#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b6f s VAL 2 N 0.00 2.02 0.48 1.61 1.01 -1.26 -2.82 120.40 121.44 1b6f s VAL 2 Ca 0.00 -1.08 -0.01 0.00 0.00 0.00 0.00 61.98 60.89 1b6f s VAL 2 Cb 0.00 -1.68 -0.00 0.00 0.00 0.00 0.00 36.38 34.70 1b6f s VAL 2 CO 0.00 0.57 0.73 -0.36 0.00 0.00 0.00 175.10 176.04 1b6f s PHE 3 N -0.49 3.25 -0.03 5.22 0.08 0.45 -4.90 117.98 121.55 1b6f s PHE 3 Ca 0.06 0.35 -0.05 0.00 0.12 0.00 0.00 56.93 57.41 1b6f s PHE 3 Cb -0.11 -2.41 0.01 0.00 -0.57 0.00 0.00 43.02 39.94 1b6f s PHE 3 CO 0.00 -0.46 0.13 1.21 -0.10 0.00 0.00 175.22 176.01 1b6f s ASN 4 N -4.23 -0.07 -0.46 1.36 3.04 -1.26 -1.22 114.94 112.10 1b6f s ASN 4 Ca 0.49 0.09 0.07 0.00 0.04 0.00 0.00 52.86 53.56 1b6f s ASN 4 Cb -0.10 0.25 0.28 0.00 -1.54 0.00 0.00 41.25 40.14 1b6f s ASN 4 CO 0.40 -0.16 0.90 -1.22 -3.04 0.00 0.00 177.10 173.98 1b6f n TYR 5 N 2.46 -2.48 -2.89 0.43 4.01 0.17 -4.98 117.16 113.87 1b6f n TYR 5 Ca -0.16 -2.31 -0.31 0.00 -0.16 0.00 0.00 57.90 54.96 1b6f n TYR 5 Cb 0.58 1.15 -0.04 0.00 -0.31 0.00 0.00 39.34 40.72 1b6f n TYR 5 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 1b6f s GLU 6 N 0.02 3.88 0.31 -0.72 4.04 -1.26 -3.35 118.70 121.62 1b6f s GLU 6 Ca 0.30 0.61 -0.02 0.00 0.04 0.00 0.00 54.97 55.89 1b6f s GLU 6 Cb 0.25 -2.37 -0.01 0.00 0.02 0.00 0.00 34.13 32.03 1b6f s GLU 6 CO -0.15 -0.00 0.41 0.95 -1.84 0.00 0.00 175.26 174.62 1b6f s THR 7 N -2.28 0.00 -0.06 1.83 -4.23 0.49 -4.90 115.64 106.50 1b6f s THR 7 Ca 0.53 -1.68 -0.28 0.00 -1.18 0.00 0.00 61.69 59.08 1b6f s THR 7 Cb -0.10 -2.55 0.06 0.00 1.34 0.00 0.00 72.50 71.25 1b6f s THR 7 CO 0.26 0.00 0.63 -1.83 -0.54 0.00 0.00 174.62 173.14 1b6f s GLU 8 N -3.37 0.99 0.00 3.99 -1.05 -1.26 0.15 118.70 118.15 1b6f s GLU 8 Ca 0.32 0.24 0.00 0.00 -0.15 0.00 0.00 54.97 55.38 1b6f s GLU 8 Cb 0.01 0.46 -0.00 0.00 -0.44 0.00 0.00 34.13 34.16 1b6f s GLU 8 CO 0.19 -0.29 0.00 2.41 0.95 0.00 0.00 175.26 178.52 1b6f n THR 9 N 1.07 0.00 -4.47 1.83 -1.04 0.32 -4.93 114.28 107.06 1b6f n THR 9 Ca -0.19 -0.01 -0.23 0.00 -2.04 0.00 0.00 64.05 61.58 1b6f n THR 9 Cb 0.57 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.98 1b6f n THR 9 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1b6f s THR 10 N -2.03 1.47 -0.26 12.58 -4.23 -1.26 0.95 115.64 122.86 1b6f s THR 10 Ca 0.00 -2.04 -0.22 0.00 -1.18 0.00 0.00 61.69 58.25 1b6f s THR 10 Cb 0.00 -2.72 0.07 0.00 1.34 0.00 0.00 72.50 71.18 1b6f s THR 10 CO 0.00 -0.09 0.67 -0.55 -0.54 0.00 0.00 174.62 174.11 1b6f s SER 11 N -3.51 -0.74 0.18 3.99 0.15 0.02 -4.81 113.70 108.99 1b6f s SER 11 Ca 0.34 1.38 0.26 0.00 0.70 0.00 0.00 55.95 58.63 1b6f s SER 11 Cb 0.07 1.37 0.87 0.00 -1.71 0.00 0.00 66.02 66.62 1b6f s SER 11 CO 0.15 -0.23 1.80 0.55 1.20 0.00 0.00 173.24 176.70 1b6f n VAL 12 N 2.99 0.52 -2.19 4.45 3.14 -1.26 -0.20 118.33 125.79 1b6f n VAL 12 Ca -0.15 -0.24 -0.34 0.00 -2.96 0.00 0.00 64.34 60.65 1b6f n VAL 12 Cb 0.56 -0.58 0.00 0.00 -1.06 0.00 0.00 33.84 32.76 1b6f n VAL 12 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1b6f s ILE 13 N -3.09 3.52 0.59 1.55 1.09 -1.26 -4.37 121.20 119.24 1b6f s ILE 13 Ca 0.11 0.84 -0.19 0.00 -1.10 0.00 0.00 60.65 60.32 1b6f s ILE 13 Cb 0.13 -3.33 -0.03 0.00 -1.06 0.00 0.00 42.46 38.17 1b6f s ILE 13 CO 0.59 -0.31 1.20 -2.16 -0.10 0.00 0.00 174.94 174.15 1b6f s PRO 14 N -3.63 2.98 0.45 2.79 0.04 -1.26 -3.43 135.00 132.94 1b6f s PRO 14 Ca 0.68 1.79 0.25 0.00 0.04 0.00 0.00 61.00 63.76 1b6f s PRO 14 Cb -0.19 -1.93 0.79 0.00 0.04 0.00 0.00 34.50 33.21 1b6f s PRO 14 CO 0.30 -1.19 1.77 0.00 0.04 0.00 0.00 177.00 177.92 1b6f h ALA 15 N 0.85 0.96 0.00 8.56 0.00 -1.88 -2.32 119.26 125.44 1b6f h ALA 15 Ca -0.50 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 1b6f h ALA 15 Cb 1.29 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 1b6f h ALA 15 CO 0.55 0.18 -0.09 0.00 0.00 0.00 0.00 179.25 179.90 1b6f h ALA 16 N 1.85 0.01 0.00 0.00 0.00 -1.95 -2.44 119.26 116.73 1b6f h ALA 16 Ca -0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1b6f h ALA 16 Cb 0.83 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1b6f h ALA 16 CO 0.02 0.07 -0.02 -0.09 0.00 0.00 0.00 179.25 179.23 1b6f h ARG 17 N -1.00 0.00 -0.08 0.00 2.43 -1.97 -2.20 114.38 111.57 1b6f h ARG 17 Ca -0.01 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 58.97 1b6f h ARG 17 Cb 0.33 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1b6f h ARG 17 CO -0.01 0.02 -0.68 1.25 -1.51 0.00 0.00 179.97 179.04 1b6f h LEU 18 N 0.00 0.74 0.67 3.80 5.85 -1.52 -2.36 115.31 122.49 1b6f h LEU 18 Ca -0.00 -0.68 -0.03 0.00 0.84 0.00 0.00 57.88 58.01 1b6f h LEU 18 Cb 0.03 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.85 1b6f h LEU 18 CO 0.00 1.30 -0.34 0.15 -0.34 0.00 0.00 178.44 179.22 1b6f h PHE 19 N 0.23 -0.88 -0.65 1.25 3.04 -0.89 1.29 116.94 120.33 1b6f h PHE 19 Ca -0.06 -0.02 0.10 0.00 3.98 0.00 0.00 57.97 61.97 1b6f h PHE 19 Cb 1.34 0.30 -0.08 0.00 2.56 0.00 0.00 35.95 40.07 1b6f h PHE 19 CO 0.11 -0.54 0.25 -0.22 -2.02 0.00 0.00 178.31 175.90 1b6f h LYS 20 N -0.92 0.42 0.00 1.11 3.64 -1.61 1.66 116.57 120.87 1b6f h LYS 20 Ca -0.09 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.17 1b6f h LYS 20 Cb 0.71 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 1b6f h LYS 20 CO 0.14 0.28 -0.47 0.00 -2.27 0.00 0.00 179.45 177.13 1b6f h ALA 21 N 1.44 1.09 0.00 5.00 0.00 -1.28 0.40 119.26 125.91 1b6f h ALA 21 Ca 0.33 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1b6f h ALA 21 Cb 0.42 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1b6f h ALA 21 CO -0.32 0.58 -1.06 0.34 0.00 0.00 0.00 179.25 178.80 1b6f n PHE 22 N -3.78 0.59 0.02 0.00 -0.00 0.44 -2.56 117.46 112.17 1b6f n PHE 22 Ca -0.01 0.17 -0.01 0.00 -0.00 0.00 0.00 57.45 57.60 1b6f n PHE 22 Cb 0.52 -0.71 -0.00 0.00 -0.00 0.00 0.00 39.48 39.29 1b6f n PHE 22 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.76 175.87 1b6f n ILE 23 N -2.33 0.82 -0.23 -2.13 5.41 0.55 -3.55 119.36 117.90 1b6f n ILE 23 Ca 0.01 0.26 0.03 0.00 1.00 0.00 0.00 62.75 64.05 1b6f n ILE 23 Cb 0.50 -1.46 0.13 0.00 -0.71 0.00 0.00 39.64 38.10 1b6f n ILE 23 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 1b6f h LEU 24 N -0.08 -0.30 0.00 1.39 7.12 -0.33 -2.50 115.31 120.62 1b6f h LEU 24 Ca 0.00 0.17 0.00 0.00 0.13 0.00 0.00 57.88 58.18 1b6f h LEU 24 Cb 0.08 0.30 0.00 0.00 -0.53 0.00 0.00 40.66 40.51 1b6f h LEU 24 CO 0.00 -0.14 -0.85 0.47 -0.13 0.00 0.00 178.44 177.80 1b6f n ASP 25 N -5.30 0.88 -0.62 1.25 9.92 -0.52 -4.50 116.55 117.66 1b6f n ASP 25 Ca 0.11 -0.65 0.49 0.00 -0.53 0.00 0.00 54.79 54.20 1b6f n ASP 25 Cb 0.41 1.13 0.80 0.00 -0.64 0.00 0.00 41.12 42.82 1b6f n ASP 25 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 1b6f h GLY 26 N 3.08 0.11 0.68 0.44 0.00 -1.16 0.73 103.07 106.95 1b6f h GLY 26 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 1b6f h GLY 26 CO 0.00 -0.03 -0.48 -0.55 0.00 0.00 0.00 176.54 175.47 1b6f h ASP 27 N 0.01 -1.27 1.04 0.19 5.19 -1.79 0.16 116.42 119.95 1b6f h ASP 27 Ca 0.86 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 57.36 1b6f h ASP 27 Cb 3.41 0.40 0.00 0.00 0.18 0.00 0.00 39.33 43.31 1b6f h ASP 27 CO -0.04 -0.69 -0.68 -0.55 -3.12 0.00 0.00 179.24 174.15 1b6f h ASN 28 N -1.08 0.00 -0.01 6.45 7.08 -1.13 -3.36 115.58 123.54 1b6f h ASN 28 Ca -0.08 -0.11 -0.12 0.00 -3.08 0.00 0.00 56.30 52.91 1b6f h ASN 28 Cb 0.90 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 37.15 1b6f h ASN 28 CO 0.02 0.05 -0.47 0.25 -2.08 0.00 0.00 177.43 175.20 1b6f h LEU 29 N 0.00 0.43 -0.69 6.14 5.85 0.45 -2.99 115.31 124.50 1b6f h LEU 29 Ca 0.00 -0.76 0.09 0.00 0.84 0.00 0.00 57.88 58.05 1b6f h LEU 29 Cb 0.86 -0.13 -0.11 0.00 0.37 0.00 0.00 40.66 41.65 1b6f h LEU 29 CO 0.00 1.13 -0.49 -0.26 -0.34 0.00 0.00 178.44 178.48 1b6f h PHE 30 N -0.23 -1.48 0.00 1.25 0.04 -0.83 1.41 116.94 117.10 1b6f h PHE 30 Ca -0.06 0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.81 1b6f h PHE 30 Cb 1.20 0.74 0.00 0.00 2.20 0.00 0.00 35.95 40.09 1b6f h PHE 30 CO 0.16 -0.42 0.00 -0.35 -0.60 0.00 0.00 178.31 177.09 1b6f n PRO 31 N -5.37 0.05 -0.10 1.51 -0.04 -1.25 -0.30 135.00 129.50 1b6f n PRO 31 Ca 0.02 0.22 -0.24 0.00 -0.04 0.00 0.00 63.50 63.46 1b6f n PRO 31 Cb 0.33 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.18 1b6f n PRO 31 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1b6f n LYS 32 N -1.45 0.63 0.00 0.54 4.81 0.42 -3.95 118.16 119.17 1b6f n LYS 32 Ca 0.04 0.32 0.12 0.00 -0.87 0.00 0.00 58.31 57.93 1b6f n LYS 32 Cb 0.16 -1.60 0.23 0.00 0.02 0.00 0.00 35.03 33.83 1b6f n LYS 32 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1b6f n VAL 33 N -3.96 0.00 -2.89 3.15 0.24 0.21 -4.63 118.33 110.45 1b6f n VAL 33 Ca -0.43 -0.06 -0.07 0.00 -2.04 0.00 0.00 64.34 61.74 1b6f n VAL 33 Cb 0.88 0.45 -0.01 0.00 -1.47 0.00 0.00 33.84 33.69 1b6f n VAL 33 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1b6f s ALA 34 N -2.81 -1.63 -1.37 2.33 0.00 0.59 -4.83 121.76 114.04 1b6f s ALA 34 Ca 0.15 -0.65 0.21 0.00 0.00 0.00 0.00 51.96 51.67 1b6f s ALA 34 Cb 0.18 -2.56 1.03 0.00 0.00 0.00 0.00 23.12 21.77 1b6f s ALA 34 CO 0.66 -2.20 1.66 -0.35 0.00 0.00 0.00 175.76 175.53 1b6f n PRO 35 N 3.08 0.25 0.10 0.00 -0.04 -1.25 -2.63 135.00 134.50 1b6f n PRO 35 Ca 0.19 0.10 0.12 0.00 -0.04 0.00 0.00 63.50 63.86 1b6f n PRO 35 Cb 0.55 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.56 1b6f n PRO 35 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1b6f h GLN 36 N 0.00 0.00 0.00 0.54 4.20 -1.92 -3.42 115.11 114.51 1b6f h GLN 36 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1b6f h GLN 36 Cb 0.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.00 1b6f h GLN 36 CO 0.00 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.16 1b6f n ALA 37 N -2.07 0.00 -2.92 3.87 0.00 -1.08 -4.74 120.51 113.58 1b6f n ALA 37 Ca 0.01 -0.19 -0.28 0.00 0.00 0.00 0.00 53.44 52.97 1b6f n ALA 37 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.93 1b6f n ALA 37 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1b6f s ILE 38 N -0.90 5.34 -0.06 0.00 1.09 -1.20 -4.10 121.20 121.37 1b6f s ILE 38 Ca 0.00 -0.52 0.04 0.00 -1.10 0.00 0.00 60.65 59.07 1b6f s ILE 38 Cb 0.00 -3.69 -0.06 0.00 -1.06 0.00 0.00 42.46 37.65 1b6f s ILE 38 CO 0.00 0.01 -0.01 -0.24 -0.10 0.00 0.00 174.94 174.60 1b6f n SER 39 N -0.17 3.55 -3.58 3.58 2.88 0.37 -4.28 113.62 115.97 1b6f n SER 39 Ca -0.06 -0.01 -0.12 0.00 -1.33 0.00 0.00 58.87 57.35 1b6f n SER 39 Cb 0.53 0.40 -0.06 0.00 -0.75 0.00 0.00 64.21 64.33 1b6f n SER 39 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1b6f s SER 40 N -4.02 -0.48 -0.01 -3.46 0.15 -1.08 -4.83 113.70 99.97 1b6f s SER 40 Ca -0.05 0.66 0.03 0.00 0.70 0.00 0.00 55.95 57.29 1b6f s SER 40 Cb 0.02 0.58 -0.01 0.00 -1.71 0.00 0.00 66.02 64.91 1b6f s SER 40 CO 0.21 -0.34 -0.08 -0.69 1.20 0.00 0.00 173.24 173.53 1b6f s VAL 41 N -0.68 0.67 0.10 4.45 1.01 -1.26 0.67 120.40 125.35 1b6f s VAL 41 Ca -0.02 -0.36 -0.15 0.00 0.00 0.00 0.00 61.98 61.44 1b6f s VAL 41 Cb -0.02 -0.56 0.03 0.00 0.00 0.00 0.00 36.38 35.83 1b6f s VAL 41 CO 0.01 0.19 0.37 -0.70 0.00 0.00 0.00 175.10 174.97 1b6f s GLU 42 N -0.20 1.00 -0.28 2.72 2.12 -0.37 -4.89 118.70 118.80 1b6f s GLU 42 Ca 0.03 -0.67 -0.09 0.00 0.36 0.00 0.00 54.97 54.61 1b6f s GLU 42 Cb -0.03 0.44 -0.02 0.00 0.26 0.00 0.00 34.13 34.77 1b6f s GLU 42 CO -0.00 -0.37 0.12 1.21 -0.54 0.00 0.00 175.26 175.68 1b6f s ASN 43 N -2.62 5.45 -0.00 -1.70 3.84 -1.26 0.13 114.94 118.78 1b6f s ASN 43 Ca 0.01 -0.34 -0.09 0.00 0.21 0.00 0.00 52.86 52.65 1b6f s ASN 43 Cb 0.02 -1.99 -0.31 0.00 -0.55 0.00 0.00 41.25 38.42 1b6f s ASN 43 CO -0.10 -0.11 0.86 0.40 -2.79 0.00 0.00 177.10 175.36 1b6f h ILE 44 N 5.58 1.14 -4.00 -5.21 1.08 0.84 -3.47 117.51 113.48 1b6f h ILE 44 Ca -0.35 -2.70 -0.18 0.00 -0.39 0.00 0.00 64.86 61.24 1b6f h ILE 44 Cb 1.16 2.85 -0.10 0.00 -3.07 0.00 0.00 36.82 37.67 1b6f h ILE 44 CO 0.59 0.84 -0.23 -0.70 -0.69 0.00 0.00 178.15 177.96 1b6f s GLU 45 N -2.60 1.64 0.42 2.37 2.56 -0.37 -4.95 118.70 117.76 1b6f s GLU 45 Ca -0.11 -1.53 0.00 0.00 0.00 0.00 0.00 54.97 53.33 1b6f s GLU 45 Cb 0.06 0.43 0.00 0.00 2.00 0.00 0.00 34.13 36.61 1b6f s GLU 45 CO 0.88 -0.66 0.00 0.41 -0.56 0.00 0.00 175.26 175.33 1b6f n GLY 46 N -0.44 -2.58 1.77 -1.50 0.00 -1.26 -1.50 105.19 99.67 1b6f n GLY 46 Ca 0.00 -1.16 -0.19 0.00 0.00 0.00 0.00 46.02 44.67 1b6f n GLY 46 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1b6f n ASN 47 N -4.04 4.56 -0.28 1.61 4.13 -1.26 -4.76 115.26 115.22 1b6f n ASN 47 Ca -0.04 -3.78 0.00 0.00 1.68 0.00 0.00 54.58 52.44 1b6f n ASN 47 Cb 0.57 -0.49 0.00 0.00 -1.54 0.00 0.00 39.78 38.32 1b6f n ASN 47 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1b6f n GLY 48 N -0.85 0.92 0.00 7.41 0.00 -1.26 -5.08 105.19 106.33 1b6f n GLY 48 Ca 0.42 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1b6f n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b6f n GLY 49 N -0.53 3.51 3.55 -0.02 0.00 -1.26 -4.88 105.19 105.57 1b6f n GLY 49 Ca 0.00 -2.16 -0.39 0.00 0.00 0.00 0.00 46.02 43.47 1b6f n GLY 49 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1b6f s PRO 50 N -1.47 2.78 0.00 1.61 0.04 -1.26 -1.97 135.00 134.74 1b6f s PRO 50 Ca 0.00 0.53 0.00 0.00 0.04 0.00 0.00 61.00 61.57 1b6f s PRO 50 Cb 0.00 -4.33 0.00 0.00 0.04 0.00 0.00 34.50 30.21 1b6f s PRO 50 CO 0.00 -2.56 0.00 0.41 0.04 0.00 0.00 177.00 174.89 1b6f n GLY 51 N 5.61 0.85 3.70 0.56 0.00 0.41 -4.89 105.19 111.44 1b6f n GLY 51 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1b6f n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1b6f s THR 52 N -2.00 2.14 -0.11 2.61 2.01 -0.83 -4.42 115.64 115.04 1b6f s THR 52 Ca 0.00 0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.07 1b6f s THR 52 Cb 0.00 -2.49 -0.02 0.00 0.01 0.00 0.00 72.50 70.00 1b6f s THR 52 CO 0.00 -0.05 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.14 1b6f s ILE 53 N -2.15 3.25 -0.04 1.82 -1.09 -0.56 0.36 121.20 122.80 1b6f s ILE 53 Ca 0.73 -0.61 -0.07 0.00 -2.23 0.00 0.00 60.65 58.47 1b6f s ILE 53 Cb -0.28 -2.35 0.01 0.00 -1.58 0.00 0.00 42.46 38.26 1b6f s ILE 53 CO 0.50 0.54 0.18 -0.75 -1.23 0.00 0.00 174.94 174.18 1b6f s LYS 54 N -0.00 0.35 -0.39 2.79 2.20 -1.07 0.14 119.74 123.75 1b6f s LYS 54 Ca -0.03 -0.02 -0.19 0.00 -0.36 0.00 0.00 55.97 55.37 1b6f s LYS 54 Cb -0.14 0.16 0.01 0.00 -1.51 0.00 0.00 37.83 36.35 1b6f s LYS 54 CO 0.04 -0.07 0.57 0.21 -0.36 0.00 0.00 175.35 175.74 1b6f s LYS 55 N -0.57 3.46 -0.11 4.03 2.20 0.35 -2.40 119.74 126.70 1b6f s LYS 55 Ca -0.07 -0.26 -0.05 0.00 -0.36 0.00 0.00 55.97 55.24 1b6f s LYS 55 Cb -0.04 -3.87 -0.04 0.00 -1.51 0.00 0.00 37.83 32.37 1b6f s LYS 55 CO 0.01 -0.81 0.06 0.42 -0.36 0.00 0.00 175.35 174.67 1b6f s ILE 56 N 2.57 4.83 -0.01 5.43 -1.09 0.14 -1.24 121.20 131.84 1b6f s ILE 56 Ca 0.20 -0.04 0.06 0.00 -2.23 0.00 0.00 60.65 58.64 1b6f s ILE 56 Cb -0.15 -3.08 -0.03 0.00 -1.58 0.00 0.00 42.46 37.62 1b6f s ILE 56 CO 0.16 0.59 -0.19 -0.55 -1.23 0.00 0.00 174.94 173.72 1b6f s SER 57 N -0.79 3.68 -0.08 3.58 0.15 0.21 -0.61 113.70 119.84 1b6f s SER 57 Ca 0.13 -0.35 0.04 0.00 0.70 0.00 0.00 55.95 56.47 1b6f s SER 57 Cb -0.12 -0.63 -0.02 0.00 -1.71 0.00 0.00 66.02 63.55 1b6f s SER 57 CO 0.03 0.31 -0.19 -0.36 1.20 0.00 0.00 173.24 174.23 1b6f s PHE 58 N -0.76 2.62 0.17 3.44 0.40 -1.25 0.14 117.98 122.74 1b6f s PHE 58 Ca 0.12 -0.55 -0.30 0.00 -0.60 0.00 0.00 56.93 55.60 1b6f s PHE 58 Cb -0.10 -1.68 -0.07 0.00 0.51 0.00 0.00 43.02 41.67 1b6f s PHE 58 CO 0.02 -0.10 1.11 -1.25 0.70 0.00 0.00 175.22 175.69 1b6f s PRO 59 N -0.17 4.58 0.21 0.24 0.04 -1.26 -4.56 135.00 134.08 1b6f s PRO 59 Ca -0.02 1.72 0.00 0.00 0.04 0.00 0.00 61.00 62.75 1b6f s PRO 59 Cb -0.14 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.12 1b6f s PRO 59 CO 0.03 0.05 0.00 -1.91 0.04 0.00 0.00 177.00 175.21 1b6f n GLU 60 N 2.48 -1.74 0.00 4.56 2.13 -1.26 -4.96 120.64 121.85 1b6f n GLU 60 Ca 0.03 1.17 0.00 0.00 0.66 0.00 0.00 57.16 59.03 1b6f n GLU 60 Cb 0.46 -2.15 0.00 0.00 0.27 0.00 0.00 31.44 30.02 1b6f n GLU 60 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1b6f n GLY 61 N -2.82 0.75 7.00 8.31 0.00 -1.26 -4.87 105.19 112.29 1b6f n GLY 61 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1b6f n GLY 61 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1b6f n PHE 62 N 0.00 -0.56 0.08 1.61 7.35 -1.26 -3.79 117.46 120.89 1b6f n PHE 62 Ca 0.00 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.58 1b6f n PHE 62 Cb 0.00 0.03 -0.13 0.00 0.35 0.00 0.00 39.48 39.73 1b6f n PHE 62 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 1b6f h PRO 63 N 0.00 0.13 -5.76 -7.13 0.13 -2.03 -3.44 132.00 113.91 1b6f h PRO 63 Ca 0.00 -0.22 -0.58 0.00 -0.87 0.00 0.00 66.00 64.33 1b6f h PRO 63 Cb 0.00 0.08 -0.08 0.00 0.13 0.00 0.00 31.00 31.13 1b6f h PRO 63 CO 0.00 1.09 -0.06 -0.59 -0.23 0.00 0.00 178.00 178.21 1b6f s PHE 64 N -2.68 3.49 0.00 1.56 -0.12 -1.25 -4.79 117.98 114.19 1b6f s PHE 64 Ca -0.02 0.94 0.00 0.00 -0.05 0.00 0.00 56.93 57.81 1b6f s PHE 64 Cb 0.09 -2.64 0.00 0.00 -0.63 0.00 0.00 43.02 39.83 1b6f s PHE 64 CO 0.85 0.08 0.00 0.36 -0.05 0.00 0.00 175.22 176.46 1b6f n LYS 65 N 3.99 0.00 -1.07 1.99 2.85 -1.26 -4.86 118.16 119.80 1b6f n LYS 65 Ca -0.05 0.00 -0.16 0.00 -1.05 0.00 0.00 58.31 57.05 1b6f n LYS 65 Cb 0.51 0.00 0.11 0.00 -0.65 0.00 0.00 35.03 35.00 1b6f n LYS 65 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 177.40 179.83 1b6f n TYR 66 N -1.61 -3.95 0.00 5.58 0.18 -1.26 -3.93 117.16 112.18 1b6f n TYR 66 Ca 0.00 -0.66 0.00 0.00 1.88 0.00 0.00 57.90 59.12 1b6f n TYR 66 Cb 0.00 -0.55 0.00 0.00 -0.38 0.00 0.00 39.34 38.41 1b6f n TYR 66 CO 0.00 0.00 0.00 1.55 -2.08 0.00 0.00 176.86 176.33 1b6f n VAL 67 N -2.95 0.00 -2.37 -3.48 3.14 0.22 -2.88 118.33 110.00 1b6f n VAL 67 Ca 0.09 0.00 -0.36 0.00 -2.96 0.00 0.00 64.34 61.11 1b6f n VAL 67 Cb 0.31 0.00 0.02 0.00 -1.06 0.00 0.00 33.84 33.11 1b6f n VAL 67 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 1b6f n LYS 68 N -0.56 3.76 -1.53 1.45 3.00 0.76 0.29 118.16 125.32 1b6f n LYS 68 Ca 0.00 -4.22 -0.58 0.00 -0.00 0.00 0.00 58.31 53.51 1b6f n LYS 68 Cb 0.00 -2.32 -0.08 0.00 0.00 0.00 0.00 35.03 32.63 1b6f n LYS 68 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1b6f n ASP 69 N -0.35 0.43 -4.91 3.14 9.92 -1.01 -4.12 116.55 119.65 1b6f n ASP 69 Ca 0.46 1.15 -0.31 0.00 -0.53 0.00 0.00 54.79 55.57 1b6f n ASP 69 Cb 0.33 -0.98 -0.04 0.00 -0.64 0.00 0.00 41.12 39.79 1b6f n ASP 69 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1b6f s ARG 70 N 0.29 3.51 0.30 -1.24 3.52 0.50 -2.61 118.95 123.21 1b6f s ARG 70 Ca 0.90 -0.32 -0.25 0.00 -0.13 0.00 0.00 55.73 55.94 1b6f s ARG 70 Cb -1.21 -2.95 -0.10 0.00 -1.56 0.00 0.00 34.95 29.13 1b6f s ARG 70 CO 0.56 0.54 0.90 0.08 -0.81 0.00 0.00 175.30 176.57 1b6f s VAL 71 N -1.61 4.27 0.00 7.11 1.01 0.16 0.26 120.40 131.60 1b6f s VAL 71 Ca 0.37 1.75 0.00 0.00 0.00 0.00 0.00 61.98 64.10 1b6f s VAL 71 Cb -0.12 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.25 1b6f s VAL 71 CO 0.27 0.18 0.00 -0.67 0.00 0.00 0.00 175.10 174.88 1b6f n ASP 72 N 0.65 0.00 -3.57 3.32 -0.08 0.66 0.15 116.55 117.69 1b6f n ASP 72 Ca 0.01 0.04 -0.19 0.00 -1.51 0.00 0.00 54.79 53.13 1b6f n ASP 72 Cb 0.50 -0.45 -0.14 0.00 2.34 0.00 0.00 41.12 43.37 1b6f n ASP 72 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 1b6f s GLU 73 N -0.90 0.12 -0.13 -0.67 2.56 -0.98 -3.62 118.70 115.08 1b6f s GLU 73 Ca 0.00 0.27 -0.05 0.00 0.00 0.00 0.00 54.97 55.19 1b6f s GLU 73 Cb 0.00 -1.03 -0.04 0.00 2.00 0.00 0.00 34.13 35.06 1b6f s GLU 73 CO 0.00 -0.55 0.06 0.08 -0.56 0.00 0.00 175.26 174.28 1b6f s VAL 74 N 2.29 4.76 -0.14 3.70 1.01 -1.26 -1.76 120.40 129.00 1b6f s VAL 74 Ca 0.05 -0.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.92 1b6f s VAL 74 Cb -0.15 -3.07 0.06 0.00 0.00 0.00 0.00 36.38 33.22 1b6f s VAL 74 CO -0.10 0.56 0.11 -1.81 0.00 0.00 0.00 175.10 173.86 1b6f s ASP 75 N -0.45 1.80 0.00 3.32 1.01 0.37 -4.85 116.67 117.87 1b6f s ASP 75 Ca 0.10 -0.32 0.30 0.00 0.71 0.00 0.00 52.55 53.34 1b6f s ASP 75 Cb -0.12 -0.08 1.50 0.00 1.01 0.00 0.00 42.92 45.23 1b6f s ASP 75 CO 0.02 -0.32 2.02 1.57 0.21 0.00 0.00 175.17 178.67 1b6f n HIS 76 N 5.29 0.00 -0.06 4.23 -0.00 -1.26 -2.29 115.22 121.13 1b6f n HIS 76 Ca -0.06 0.00 -0.07 0.00 0.46 0.00 0.00 57.72 58.05 1b6f n HIS 76 Cb 0.49 -0.13 -0.06 0.00 -0.12 0.00 0.00 29.99 30.17 1b6f n HIS 76 CO 0.00 0.00 0.00 2.41 0.46 0.00 0.00 176.34 179.21 1b6f n THR 77 N -0.95 0.70 -0.17 3.57 -1.04 -1.26 -4.53 114.28 110.61 1b6f n THR 77 Ca 0.18 -0.32 0.07 0.00 -2.04 0.00 0.00 64.05 61.94 1b6f n THR 77 Cb 0.22 -0.87 0.29 0.00 -1.82 0.00 0.00 70.33 68.14 1b6f n THR 77 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1b6f n ASN 78 N -2.70 3.92 -4.02 8.00 2.85 -1.25 -4.93 115.26 117.13 1b6f n ASN 78 Ca -0.20 -2.38 -0.29 0.00 -0.11 0.00 0.00 54.58 51.60 1b6f n ASN 78 Cb 0.76 -0.52 -0.03 0.00 1.24 0.00 0.00 39.78 41.23 1b6f n ASN 78 CO 0.00 0.00 0.00 0.49 -2.11 0.00 0.00 177.26 175.64 1b6f n PHE 79 N 0.82 -1.56 -4.20 1.20 3.72 -1.08 -4.76 117.46 111.59 1b6f n PHE 79 Ca 0.20 0.62 -0.26 0.00 -0.05 0.00 0.00 57.45 57.97 1b6f n PHE 79 Cb 0.75 -3.41 -0.17 0.00 -0.94 0.00 0.00 39.48 35.71 1b6f n PHE 79 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1b6f s LYS 80 N -6.76 1.60 -0.27 -1.08 2.20 -0.97 -1.57 119.74 112.89 1b6f s LYS 80 Ca 0.10 -0.32 -0.04 0.00 -0.36 0.00 0.00 55.97 55.34 1b6f s LYS 80 Cb -0.04 -1.50 0.09 0.00 -1.51 0.00 0.00 37.83 34.87 1b6f s LYS 80 CO 0.92 -0.14 0.12 -0.47 -0.36 0.00 0.00 175.35 175.42 1b6f s TYR 81 N 1.23 0.39 -0.08 4.03 5.04 -0.65 0.14 117.35 127.46 1b6f s TYR 81 Ca -0.04 -0.85 0.02 0.00 -2.44 0.00 0.00 57.07 53.76 1b6f s TYR 81 Cb -0.14 -0.92 -0.02 0.00 0.35 0.00 0.00 41.96 41.23 1b6f s TYR 81 CO -0.03 -0.78 -0.13 -0.80 -1.34 0.00 0.00 175.55 172.46 1b6f s ASN 82 N 2.07 4.06 -0.03 4.32 0.01 -0.72 -1.81 114.94 122.84 1b6f s ASN 82 Ca 0.08 -0.24 0.01 0.00 -0.71 0.00 0.00 52.86 52.01 1b6f s ASN 82 Cb -0.16 -1.17 0.01 0.00 0.41 0.00 0.00 41.25 40.35 1b6f s ASN 82 CO -0.32 0.28 -0.05 -0.72 -1.51 0.00 0.00 177.10 174.78 1b6f s TYR 83 N -0.31 0.67 0.44 2.20 -0.85 0.16 0.24 117.35 119.90 1b6f s TYR 83 Ca 0.03 -0.16 0.08 0.00 -0.52 0.00 0.00 57.07 56.49 1b6f s TYR 83 Cb -0.13 -0.56 0.02 0.00 0.38 0.00 0.00 41.96 41.67 1b6f s TYR 83 CO 0.03 -0.13 0.60 -1.12 -1.52 0.00 0.00 175.55 173.41 1b6f s SER 84 N 0.57 5.59 -0.16 -0.18 0.01 0.72 -0.67 113.70 119.58 1b6f s SER 84 Ca -0.07 -0.41 -0.05 0.00 1.31 0.00 0.00 55.95 56.72 1b6f s SER 84 Cb -0.11 -0.61 -0.03 0.00 0.21 0.00 0.00 66.02 65.48 1b6f s SER 84 CO 0.00 -0.83 0.01 -0.69 0.41 0.00 0.00 173.24 172.13 1b6f s VAL 85 N -2.41 4.29 0.00 3.43 1.01 0.24 0.19 120.40 127.16 1b6f s VAL 85 Ca 0.56 -0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1b6f s VAL 85 Cb -0.10 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.39 1b6f s VAL 85 CO 0.34 0.50 0.00 2.30 0.00 0.00 0.00 175.10 178.24 1b6f n ILE 86 N 3.34 0.00 -3.07 2.22 -5.35 -1.26 -4.05 119.36 111.19 1b6f n ILE 86 Ca -0.17 0.00 -0.43 0.00 -0.27 0.00 0.00 62.75 61.87 1b6f n ILE 86 Cb 0.53 -0.29 -0.06 0.00 -1.74 0.00 0.00 39.64 38.08 1b6f n ILE 86 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1b6f s GLU 87 N -0.08 3.20 0.00 6.28 2.12 -1.26 -4.74 118.70 124.22 1b6f s GLU 87 Ca 0.00 -0.63 0.00 0.00 0.36 0.00 0.00 54.97 54.70 1b6f s GLU 87 Cb 0.00 -4.06 0.00 0.00 0.26 0.00 0.00 34.13 30.33 1b6f s GLU 87 CO 0.00 -1.24 0.00 0.41 -0.54 0.00 0.00 175.26 173.89 1b6f n GLY 88 N 5.13 0.16 7.00 -1.50 0.00 -1.26 0.27 105.19 114.99 1b6f n GLY 88 Ca -0.04 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1b6f n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b6f n GLY 89 N -0.79 0.67 0.00 -0.02 0.00 -1.14 -2.16 105.19 101.74 1b6f n GLY 89 Ca 0.00 -0.86 0.09 0.00 0.00 0.00 0.00 46.02 45.24 1b6f n GLY 89 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1b6f n PRO 90 N 0.00 0.13 -1.19 1.61 -0.04 -1.26 -4.84 135.00 129.41 1b6f n PRO 90 Ca 0.00 0.16 -0.36 0.00 -0.04 0.00 0.00 63.50 63.26 1b6f n PRO 90 Cb 0.00 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.04 1b6f n PRO 90 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1b6f n ILE 91 N -1.39 1.52 0.10 0.52 5.41 -0.92 -4.94 119.36 119.66 1b6f n ILE 91 Ca 0.06 -0.36 0.00 0.00 1.00 0.00 0.00 62.75 63.45 1b6f n ILE 91 Cb 0.17 -0.73 0.00 0.00 -0.71 0.00 0.00 39.64 38.37 1b6f n ILE 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1b6f n GLY 92 N 1.61 -0.20 1.07 7.39 0.00 -1.26 -4.67 105.19 109.13 1b6f n GLY 92 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1b6f n GLY 92 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1b6f n ASP 93 N -3.34 0.08 0.00 1.61 2.03 -1.26 -4.99 116.55 110.68 1b6f n ASP 93 Ca 0.00 0.01 0.00 0.00 0.52 0.00 0.00 54.79 55.32 1b6f n ASP 93 Cb 0.03 -0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1b6f n ASP 93 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 1b6f n THR 94 N -2.58 0.00 -3.34 5.18 5.66 -1.26 -5.01 114.28 112.93 1b6f n THR 94 Ca 0.00 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.72 1b6f n THR 94 Cb 0.00 0.69 -0.03 0.00 -1.55 0.00 0.00 70.33 69.44 1b6f n THR 94 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 175.07 170.54 1b6f s LEU 95 N 0.00 4.04 -1.49 1.09 0.05 -1.26 -4.16 118.68 116.96 1b6f s LEU 95 Ca 0.00 0.66 -0.07 0.00 0.05 0.00 0.00 54.13 54.77 1b6f s LEU 95 Cb 0.00 -3.49 0.02 0.00 -2.05 0.00 0.00 46.19 40.68 1b6f s LEU 95 CO 0.00 -0.22 0.71 -0.62 -0.55 0.00 0.00 176.35 175.68 1b6f n GLU 96 N -1.11 -5.24 -1.86 1.48 1.02 -0.25 -4.55 120.64 110.13 1b6f n GLU 96 Ca -0.02 0.81 -0.31 0.00 -0.02 0.00 0.00 57.16 57.62 1b6f n GLU 96 Cb 0.54 -5.69 0.01 0.00 -0.02 0.00 0.00 31.44 26.29 1b6f n GLU 96 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1b6f s LYS 97 N -5.92 3.49 -0.00 3.49 2.20 -0.00 -4.76 119.74 118.24 1b6f s LYS 97 Ca 0.39 0.82 0.00 0.00 -0.36 0.00 0.00 55.97 56.82 1b6f s LYS 97 Cb -0.18 -2.07 0.01 0.00 -1.51 0.00 0.00 37.83 34.08 1b6f s LYS 97 CO 0.48 -0.66 0.00 0.42 -0.36 0.00 0.00 175.35 175.24 1b6f s ILE 98 N -3.08 0.01 -0.22 5.43 1.01 -1.26 0.16 121.20 123.25 1b6f s ILE 98 Ca 0.56 0.04 0.01 0.00 0.00 0.00 0.00 60.65 61.27 1b6f s ILE 98 Cb -0.12 -0.04 0.05 0.00 0.01 0.00 0.00 42.46 42.36 1b6f s ILE 98 CO 0.52 0.03 -0.10 -0.44 0.00 0.00 0.00 174.94 174.95 1b6f s SER 99 N 0.24 3.73 -0.19 3.58 0.01 0.23 0.83 113.70 122.13 1b6f s SER 99 Ca -0.02 -1.06 -0.11 0.00 1.31 0.00 0.00 55.95 56.07 1b6f s SER 99 Cb -0.03 -1.30 -0.05 0.00 0.21 0.00 0.00 66.02 64.85 1b6f s SER 99 CO -0.01 -0.17 0.16 0.20 0.41 0.00 0.00 173.24 173.83 1b6f s ASN 100 N 1.32 6.25 -0.02 2.44 -0.87 0.16 0.27 114.94 124.48 1b6f s ASN 100 Ca -0.04 0.27 0.06 0.00 -1.57 0.00 0.00 52.86 51.59 1b6f s ASN 100 Cb -0.18 -2.10 -0.02 0.00 -0.02 0.00 0.00 41.25 38.93 1b6f s ASN 100 CO -0.07 0.17 -0.21 -1.61 -2.57 0.00 0.00 177.10 172.80 1b6f s GLU 101 N 0.38 1.73 -0.13 -0.60 2.02 0.18 0.36 118.70 122.64 1b6f s GLU 101 Ca 0.09 -0.75 -0.02 0.00 0.02 0.00 0.00 54.97 54.31 1b6f s GLU 101 Cb -0.11 -1.66 0.04 0.00 0.10 0.00 0.00 34.13 32.50 1b6f s GLU 101 CO -0.01 0.45 0.02 0.42 0.02 0.00 0.00 175.26 176.16 1b6f s ILE 102 N -0.47 0.39 -0.17 -1.63 1.01 -0.75 0.10 121.20 119.68 1b6f s ILE 102 Ca 0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 60.65 60.53 1b6f s ILE 102 Cb -0.08 -0.74 -0.01 0.00 0.01 0.00 0.00 42.46 41.64 1b6f s ILE 102 CO -0.01 0.01 -0.11 -0.75 0.00 0.00 0.00 174.94 174.09 1b6f s LYS 103 N 1.94 3.30 -0.10 2.79 2.20 0.20 -1.63 119.74 128.44 1b6f s LYS 103 Ca 0.02 -0.69 0.00 0.00 -0.36 0.00 0.00 55.97 54.94 1b6f s LYS 103 Cb -0.15 -2.76 -0.02 0.00 -1.51 0.00 0.00 37.83 33.39 1b6f s LYS 103 CO -0.07 -0.03 -0.09 0.42 -0.36 0.00 0.00 175.35 175.22 1b6f s ILE 104 N 0.97 3.43 -0.01 5.43 1.09 -0.61 -1.38 121.20 130.12 1b6f s ILE 104 Ca -0.02 -0.55 -0.01 0.00 -1.10 0.00 0.00 60.65 58.97 1b6f s ILE 104 Cb -0.15 -2.43 0.01 0.00 -1.06 0.00 0.00 42.46 38.83 1b6f s ILE 104 CO -0.01 0.55 0.03 -0.69 -0.10 0.00 0.00 174.94 174.72 1b6f s VAL 105 N -0.19 -0.01 0.22 2.92 1.01 -0.98 -4.59 120.40 118.77 1b6f s VAL 105 Ca 0.02 0.04 -0.15 0.00 0.00 0.00 0.00 61.98 61.89 1b6f s VAL 105 Cb -0.13 -0.05 -0.08 0.00 0.00 0.00 0.00 36.38 36.12 1b6f s VAL 105 CO 0.03 0.02 0.64 0.00 0.00 0.00 0.00 175.10 175.79 1b6f s ALA 106 N 0.23 3.47 0.75 5.51 0.00 -1.26 0.92 121.76 131.39 1b6f s ALA 106 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 51.92 1b6f s ALA 106 Cb -0.03 -2.65 0.00 0.00 0.00 0.00 0.00 23.12 20.44 1b6f s ALA 106 CO -0.01 0.40 0.00 0.25 0.00 0.00 0.00 175.76 176.40 1b6f n THR 107 N 0.39 0.00 -1.74 0.00 -2.24 0.20 -4.85 114.28 106.03 1b6f n THR 107 Ca -0.02 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.34 1b6f n THR 107 Cb 0.52 -1.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.00 1b6f n THR 107 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1b6f n PRO 108 N -0.49 2.86 -2.61 -0.78 -0.04 -1.26 -4.26 135.00 128.42 1b6f n PRO 108 Ca 0.00 -2.61 -0.14 0.00 -0.04 0.00 0.00 63.50 60.71 1b6f n PRO 108 Cb 0.00 -3.29 0.02 0.00 -0.04 0.00 0.00 33.50 30.18 1b6f n PRO 108 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1b6f n ASP 109 N 6.11 -4.31 -2.58 3.54 2.03 -1.26 -4.92 116.55 115.16 1b6f n ASP 109 Ca 0.52 -0.14 -0.01 0.00 0.52 0.00 0.00 54.79 55.68 1b6f n ASP 109 Cb 0.39 -3.27 0.05 0.00 -0.72 0.00 0.00 41.12 37.57 1b6f n ASP 109 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1b6f n GLY 110 N -1.18 2.09 2.91 0.27 0.00 -1.26 -5.12 105.19 102.91 1b6f n GLY 110 Ca -0.09 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.76 1b6f n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b6f n GLY 111 N -0.48 -1.77 3.21 -0.02 0.00 -1.26 -4.78 105.19 100.10 1b6f n GLY 111 Ca 0.10 -1.73 -0.12 0.00 0.00 0.00 0.00 46.02 44.26 1b6f n GLY 111 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b6f s SER 112 N -4.00 0.74 -0.14 1.61 1.04 0.73 0.60 113.70 114.27 1b6f s SER 112 Ca 0.00 -1.25 0.02 0.00 0.48 0.00 0.00 55.95 55.20 1b6f s SER 112 Cb 0.00 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.35 1b6f s SER 112 CO 0.00 -0.69 -0.20 -0.63 0.98 0.00 0.00 173.24 172.70 1b6f s ILE 113 N -3.88 2.25 0.04 -1.02 1.01 0.26 -0.80 121.20 119.07 1b6f s ILE 113 Ca 0.28 -0.92 -0.06 0.00 0.00 0.00 0.00 60.65 59.95 1b6f s ILE 113 Cb 0.07 -1.91 -0.05 0.00 0.01 0.00 0.00 42.46 40.58 1b6f s ILE 113 CO 0.06 0.54 0.29 -0.76 0.00 0.00 0.00 174.94 175.07 1b6f s LEU 114 N 0.73 4.35 -0.18 2.97 1.02 0.27 -2.33 118.68 125.51 1b6f s LEU 114 Ca -0.08 0.56 -0.05 0.00 0.02 0.00 0.00 54.13 54.58 1b6f s LEU 114 Cb -0.16 -2.84 0.07 0.00 0.02 0.00 0.00 46.19 43.29 1b6f s LEU 114 CO 0.00 0.20 0.13 -0.54 0.02 0.00 0.00 176.35 176.17 1b6f s LYS 115 N -2.00 0.10 -0.13 1.70 1.02 -0.48 0.12 119.74 120.07 1b6f s LYS 115 Ca 0.31 0.00 -0.04 0.00 0.02 0.00 0.00 55.97 56.26 1b6f s LYS 115 Cb -0.13 -1.64 -0.03 0.00 -0.52 0.00 0.00 37.83 35.51 1b6f s LYS 115 CO 0.19 -0.67 0.02 0.42 -0.92 0.00 0.00 175.35 174.39 1b6f s ILE 116 N 2.20 4.46 -0.23 2.17 1.01 0.40 -0.63 121.20 130.57 1b6f s ILE 116 Ca 0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 60.65 60.50 1b6f s ILE 116 Cb -0.16 -2.93 0.03 0.00 0.01 0.00 0.00 42.46 39.41 1b6f s ILE 116 CO -0.10 0.55 -0.10 -0.44 0.00 0.00 0.00 174.94 174.85 1b6f s SER 117 N -0.33 4.08 -0.21 3.58 0.01 0.29 0.19 113.70 121.30 1b6f s SER 117 Ca 0.07 -0.87 -0.08 0.00 1.31 0.00 0.00 55.95 56.38 1b6f s SER 117 Cb -0.12 -1.61 -0.04 0.00 0.21 0.00 0.00 66.02 64.46 1b6f s SER 117 CO 0.02 -0.10 0.08 0.21 0.41 0.00 0.00 173.24 173.86 1b6f s ASN 118 N 1.30 5.55 -0.12 2.44 3.04 -1.21 0.51 114.94 126.44 1b6f s ASN 118 Ca 0.00 -0.01 0.01 0.00 0.04 0.00 0.00 52.86 52.91 1b6f s ASN 118 Cb -0.16 -1.97 -0.01 0.00 -1.54 0.00 0.00 41.25 37.56 1b6f s ASN 118 CO -0.06 0.09 -0.16 -0.75 -3.04 0.00 0.00 177.10 173.18 1b6f s LYS 119 N 0.87 3.29 -0.22 0.43 2.20 0.14 -0.66 119.74 125.79 1b6f s LYS 119 Ca 0.04 -0.73 -0.01 0.00 -0.36 0.00 0.00 55.97 54.91 1b6f s LYS 119 Cb -0.14 -2.55 0.02 0.00 -1.51 0.00 0.00 37.83 33.66 1b6f s LYS 119 CO 0.03 0.21 -0.11 -0.47 -0.36 0.00 0.00 175.35 174.65 1b6f s TYR 120 N 0.33 2.97 -0.13 4.03 6.14 -0.36 0.74 117.35 131.06 1b6f s TYR 120 Ca -0.13 -1.55 -0.16 0.00 0.64 0.00 0.00 57.07 55.88 1b6f s TYR 120 Cb -0.16 -2.01 -0.04 0.00 0.42 0.00 0.00 41.96 40.16 1b6f s TYR 120 CO 0.06 -0.74 0.37 -1.01 0.64 0.00 0.00 175.55 174.88 1b6f s HIS 121 N 1.32 3.50 0.40 4.97 3.76 0.43 0.17 115.29 129.83 1b6f s HIS 121 Ca 0.02 0.74 0.07 0.00 -0.15 0.00 0.00 55.06 55.74 1b6f s HIS 121 Cb -0.15 -2.42 -0.06 0.00 1.11 0.00 0.00 32.58 31.06 1b6f s HIS 121 CO -0.07 0.23 0.14 0.95 -0.85 0.00 0.00 174.74 175.14 1b6f s THR 122 N 0.44 2.32 -1.02 1.30 -4.23 -1.13 -0.82 115.64 112.51 1b6f s THR 122 Ca 0.21 -1.77 -0.02 0.00 -1.18 0.00 0.00 61.69 58.93 1b6f s THR 122 Cb -0.14 -2.98 0.32 0.00 1.34 0.00 0.00 72.50 71.04 1b6f s THR 122 CO 0.07 -0.03 1.64 1.17 -0.54 0.00 0.00 174.62 176.93 1b6f n LYS 123 N -1.16 4.93 0.00 3.99 0.00 -1.26 -4.63 118.16 120.03 1b6f n LYS 123 Ca -0.02 -4.64 0.00 0.00 0.00 0.00 0.00 58.31 53.65 1b6f n LYS 123 Cb 0.65 -2.47 0.00 0.00 0.00 0.00 0.00 35.03 33.21 1b6f n LYS 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1b6f n GLY 124 N 0.46 0.37 0.39 3.14 0.00 -1.26 -2.64 105.19 105.66 1b6f n GLY 124 Ca 0.38 0.37 -0.04 0.00 0.00 0.00 0.00 46.02 46.73 1b6f n GLY 124 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1b6f h ASP 125 N 0.00 -1.60 -3.35 1.61 5.19 -2.02 -3.40 116.42 112.85 1b6f h ASP 125 Ca 0.00 0.31 -0.41 0.00 -0.62 0.00 0.00 57.03 56.31 1b6f h ASP 125 Cb 0.00 0.80 0.20 0.00 0.18 0.00 0.00 39.33 40.51 1b6f h ASP 125 CO 0.00 -0.28 0.04 -1.00 -3.12 0.00 0.00 179.24 174.88 1b6f s HIS 126 N -5.84 0.31 0.07 4.55 3.76 -1.08 -5.07 115.29 111.99 1b6f s HIS 126 Ca -0.13 0.61 -0.02 0.00 -0.15 0.00 0.00 55.06 55.37 1b6f s HIS 126 Cb 0.18 -3.23 0.01 0.00 1.11 0.00 0.00 32.58 30.65 1b6f s HIS 126 CO 0.69 -4.19 0.13 0.39 -0.85 0.00 0.00 174.74 170.91 1b6f n GLU 127 N -5.03 0.18 -4.07 1.40 1.02 -1.26 -4.46 120.64 108.41 1b6f n GLU 127 Ca 0.11 -0.50 -0.32 0.00 -0.02 0.00 0.00 57.16 56.44 1b6f n GLU 127 Cb 0.59 0.54 -0.16 0.00 -0.02 0.00 0.00 31.44 32.39 1b6f n GLU 127 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1b6f s VAL 128 N -2.67 1.98 0.06 2.62 1.01 -1.26 -4.97 120.40 117.17 1b6f s VAL 128 Ca 0.04 -1.13 -0.30 0.00 0.00 0.00 0.00 61.98 60.59 1b6f s VAL 128 Cb -0.01 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 1b6f s VAL 128 CO 0.03 0.30 0.96 -0.54 0.00 0.00 0.00 175.10 175.86 1b6f s LYS 129 N 1.27 4.63 0.21 2.72 1.02 -1.26 -4.94 119.74 123.38 1b6f s LYS 129 Ca -0.00 1.42 -0.12 0.00 0.02 0.00 0.00 55.97 57.29 1b6f s LYS 129 Cb -0.16 -3.42 0.26 0.00 -0.52 0.00 0.00 37.83 34.00 1b6f s LYS 129 CO -0.10 0.09 1.67 0.00 -0.92 0.00 0.00 175.35 176.09 1b6f h ALA 130 N 6.17 0.55 -0.85 5.17 0.00 -1.99 -2.28 119.26 126.04 1b6f h ALA 130 Ca -0.42 0.18 0.11 0.00 0.00 0.00 0.00 54.91 54.78 1b6f h ALA 130 Cb 1.21 0.31 -0.13 0.00 0.00 0.00 0.00 17.79 19.19 1b6f h ALA 130 CO 0.73 -0.39 -0.38 0.39 0.00 0.00 0.00 179.25 179.60 1b6f n GLU 131 N -5.28 -0.25 -0.01 0.00 1.02 -1.26 0.27 120.64 115.13 1b6f n GLU 131 Ca 0.08 1.30 0.01 0.00 -0.02 0.00 0.00 57.16 58.53 1b6f n GLU 131 Cb 0.33 -1.92 0.33 0.00 -0.02 0.00 0.00 31.44 30.16 1b6f n GLU 131 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1b6f h GLN 132 N 0.00 0.55 -0.01 3.49 5.75 -1.82 0.97 115.11 124.03 1b6f h GLN 132 Ca 0.25 -0.09 -0.04 0.00 -0.15 0.00 0.00 58.65 58.62 1b6f h GLN 132 Cb 0.46 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 28.91 1b6f h GLN 132 CO -0.83 0.50 -0.16 0.28 -2.65 0.00 0.00 178.83 175.97 1b6f h VAL 133 N 0.54 1.53 -0.01 2.39 2.07 0.37 -2.16 116.25 120.99 1b6f h VAL 133 Ca 0.13 -1.79 -0.08 0.00 0.82 0.00 0.00 66.70 65.78 1b6f h VAL 133 Cb 0.19 2.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.61 1b6f h VAL 133 CO -0.01 0.48 -0.37 0.50 0.02 0.00 0.00 177.57 178.20 1b6f h LYS 134 N -0.53 0.02 0.00 1.57 1.63 0.42 -2.30 116.57 117.38 1b6f h LYS 134 Ca -0.02 -0.01 -0.10 0.00 -0.85 0.00 0.00 60.65 59.68 1b6f h LYS 134 Cb 0.87 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.49 1b6f h LYS 134 CO 0.03 0.39 -0.46 0.00 -3.45 0.00 0.00 179.45 175.96 1b6f h ALA 135 N 1.61 0.90 -0.12 5.00 0.00 0.96 -2.56 119.26 125.06 1b6f h ALA 135 Ca -0.00 -0.42 -0.17 0.00 0.00 0.00 0.00 54.91 54.32 1b6f h ALA 135 Cb 0.66 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1b6f h ALA 135 CO 0.05 0.57 -0.64 1.03 0.00 0.00 0.00 179.25 180.27 1b6f h SER 136 N 0.00 0.50 1.59 0.00 0.87 -0.81 -3.08 113.55 112.61 1b6f h SER 136 Ca -0.00 -0.29 -0.08 0.00 -1.23 0.00 0.00 61.79 60.18 1b6f h SER 136 Cb 1.06 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.86 1b6f h SER 136 CO 0.06 1.01 -0.39 0.50 -0.53 0.00 0.00 176.83 177.48 1b6f h LYS 137 N 0.32 0.00 -0.11 2.24 3.64 -1.42 -3.16 116.57 118.08 1b6f h LYS 137 Ca -0.01 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.41 1b6f h LYS 137 Cb 1.19 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.96 1b6f h LYS 137 CO 0.11 0.39 -0.20 1.49 -2.27 0.00 0.00 179.45 178.97 1b6f h GLU 138 N 0.00 -0.26 0.00 1.90 4.81 -1.36 -2.03 114.58 117.65 1b6f h GLU 138 Ca -0.00 0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 59.10 1b6f h GLU 138 Cb 1.29 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.70 1b6f h GLU 138 CO 0.05 -0.17 -0.66 -0.07 -0.73 0.00 0.00 179.01 177.43 1b6f h LEU 139 N -0.27 0.00 -0.49 1.64 3.38 -1.67 -3.25 115.31 114.65 1b6f h LEU 139 Ca 0.09 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.13 1b6f h LEU 139 Cb 0.40 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.10 1b6f h LEU 139 CO -0.26 0.66 0.18 1.23 0.09 0.00 0.00 178.44 180.34 1b6f h GLY 140 N 2.37 0.66 0.64 0.83 0.00 -1.35 -1.55 103.07 104.67 1b6f h GLY 140 Ca -0.01 -0.10 0.02 0.00 0.00 0.00 0.00 47.33 47.24 1b6f h GLY 140 CO 0.09 0.02 -0.16 -2.09 0.00 0.00 0.00 176.54 174.39 1b6f h GLU 141 N 0.36 -0.27 -0.21 4.80 4.81 -1.47 -0.78 114.58 121.82 1b6f h GLU 141 Ca 0.24 0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.55 1b6f h GLU 141 Cb 0.24 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1b6f h GLU 141 CO -0.23 -0.18 0.17 1.15 -0.73 0.00 0.00 179.01 179.18 1b6f h THR 142 N -0.28 0.78 -0.16 0.32 2.02 -1.56 -1.63 112.91 112.40 1b6f h THR 142 Ca 0.04 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.16 1b6f h THR 142 Cb 0.34 0.88 -0.00 0.00 -1.74 0.00 0.00 68.15 67.62 1b6f h THR 142 CO -0.14 0.00 -0.14 -0.07 0.37 0.00 0.00 175.52 175.54 1b6f h LEU 143 N 0.00 0.40 -1.34 2.58 3.38 -0.16 0.20 115.31 120.37 1b6f h LEU 143 Ca 0.10 -0.47 -0.06 0.00 0.09 0.00 0.00 57.88 57.55 1b6f h LEU 143 Cb 0.43 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1b6f h LEU 143 CO -0.00 0.78 -0.27 0.17 0.09 0.00 0.00 178.44 179.21 1b6f h LEU 144 N 0.02 0.00 0.21 1.67 8.10 -0.69 -2.76 115.31 121.87 1b6f h LEU 144 Ca 0.03 0.00 -0.31 0.00 0.11 0.00 0.00 57.88 57.70 1b6f h LEU 144 Cb 0.66 0.00 0.03 0.00 -0.44 0.00 0.00 40.66 40.91 1b6f h LEU 144 CO 0.04 0.27 -1.45 -0.09 -4.11 0.00 0.00 178.44 173.09 1b6f h ARG 145 N 0.00 0.45 -0.16 0.17 2.43 -1.17 -2.63 114.38 113.46 1b6f h ARG 145 Ca -0.00 -0.76 0.04 0.00 -0.81 0.00 0.00 59.98 58.44 1b6f h ARG 145 Cb 0.65 0.28 -0.04 0.00 -0.42 0.00 0.00 29.97 30.44 1b6f h ARG 145 CO 0.03 1.37 -0.07 0.00 -1.51 0.00 0.00 179.97 179.79 1b6f h ALA 146 N 0.11 0.08 -0.10 2.80 0.00 -0.47 0.38 119.26 122.06 1b6f h ALA 146 Ca -0.27 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1b6f h ALA 146 Cb 2.04 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 20.00 1b6f h ALA 146 CO 0.22 -0.50 0.05 0.28 0.00 0.00 0.00 179.25 179.29 1b6f h VAL 147 N -0.04 1.12 -0.56 0.00 2.07 -1.61 0.44 116.25 117.66 1b6f h VAL 147 Ca 0.09 -0.33 0.10 0.00 0.82 0.00 0.00 66.70 67.37 1b6f h VAL 147 Cb 0.17 1.16 -0.08 0.00 -1.52 0.00 0.00 31.29 31.02 1b6f h VAL 147 CO -0.19 0.10 0.14 -0.08 0.02 0.00 0.00 177.57 177.56 1b6f h GLU 148 N 0.04 0.27 0.08 1.57 4.81 -1.03 -1.42 114.58 118.90 1b6f h GLU 148 Ca 0.03 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1b6f h GLU 148 Cb 0.12 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1b6f h GLU 148 CO -0.00 0.18 -0.04 1.03 -0.73 0.00 0.00 179.01 179.45 1b6f h SER 149 N 0.28 -0.09 -0.03 1.04 0.87 0.11 -2.46 113.55 113.27 1b6f h SER 149 Ca 0.28 -0.32 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1b6f h SER 149 Cb 0.39 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 1b6f h SER 149 CO -0.35 0.28 -0.03 0.22 -0.53 0.00 0.00 176.83 176.42 1b6f h TYR 150 N -0.48 -0.11 -1.03 2.24 3.20 0.44 0.95 116.97 122.19 1b6f h TYR 150 Ca -0.01 0.01 0.26 0.00 3.14 0.00 0.00 58.73 62.12 1b6f h TYR 150 Cb 0.41 0.05 -0.10 0.00 1.54 0.00 0.00 36.73 38.63 1b6f h TYR 150 CO 0.05 -0.03 0.65 -0.07 -1.64 0.00 0.00 178.16 177.12 1b6f h LEU 151 N -0.02 0.50 -0.38 2.82 3.38 -1.37 0.91 115.31 121.14 1b6f h LEU 151 Ca 0.01 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1b6f h LEU 151 Cb 0.03 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1b6f h LEU 151 CO -0.04 0.10 0.00 -0.07 0.09 0.00 0.00 178.44 178.52 1b6f h LEU 152 N 0.45 0.00 0.00 1.67 3.38 -0.40 -3.15 115.31 117.25 1b6f h LEU 152 Ca 0.60 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.57 1b6f h LEU 152 Cb 1.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.16 1b6f h LEU 152 CO -0.32 0.00 -1.11 0.00 0.09 0.00 0.00 178.44 177.10 1b6f n ALA 153 N -2.03 4.01 -4.02 1.53 0.00 0.31 -4.81 120.51 115.51 1b6f n ALA 153 Ca 0.03 -0.51 -0.31 0.00 0.00 0.00 0.00 53.44 52.65 1b6f n ALA 153 Cb 0.44 -0.67 -0.15 0.00 0.00 0.00 0.00 19.45 19.08 1b6f n ALA 153 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1b6f s HIS 154 N -2.88 3.64 -0.65 0.00 5.65 0.24 -4.91 115.29 116.37 1b6f s HIS 154 Ca 0.04 -2.81 0.06 0.00 0.25 0.00 0.00 55.06 52.60 1b6f s HIS 154 Cb 0.14 -2.69 0.09 0.00 -1.18 0.00 0.00 32.58 28.93 1b6f s HIS 154 CO 0.77 -0.93 0.85 0.45 -0.65 0.00 0.00 174.74 175.22 1b6f n SER 155 N 4.31 1.85 0.00 9.88 2.88 -1.26 -4.70 113.62 126.57 1b6f n SER 155 Ca -0.01 -1.51 0.00 0.00 -1.33 0.00 0.00 58.87 56.02 1b6f n SER 155 Cb 0.42 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 1b6f n SER 155 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1b6f n ASP 156 N 0.23 0.00 -0.24 -3.46 8.00 -1.26 -5.17 116.55 114.65 1b6f n ASP 156 Ca 0.04 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.54 1b6f n ASP 156 Cb 0.22 0.31 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 1b6f n ASP 156 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1b6f n ALA 157 N -2.44 0.00 1.46 2.24 0.00 -1.26 -5.01 120.51 115.50 1b6f n ALA 157 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1b6f n ALA 157 Cb 0.00 0.00 0.19 0.00 0.00 0.00 0.00 19.45 19.64 1b6f n ALA 157 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1b6f n TYR 158 N 0.00 0.21 1.66 0.00 9.36 -1.26 -4.88 117.16 122.25 1b6f n TYR 158 Ca 0.00 -0.11 0.15 0.00 3.32 0.00 0.00 57.90 61.26 1b6f n TYR 158 Cb 0.00 0.00 0.66 0.00 -0.63 0.00 0.00 39.34 39.37 1b6f n TYR 158 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37