#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 0.03 -0.13 1.61 1.01 -1.26 -3.94 120.40 117.72 1b6f s VAL 2 Ca 0.00 -0.24 0.02 0.00 0.00 0.00 0.00 61.98 61.77 1b6f s VAL 2 Cb 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 36.38 35.97 1b6f s VAL 2 CO 0.00 -0.13 -0.20 -0.36 0.00 0.00 0.00 175.10 174.40 1b6f s PHE 3 N -0.46 2.67 -0.07 5.22 0.08 -0.90 -4.98 117.98 119.53 1b6f s PHE 3 Ca -0.06 -1.11 0.00 0.00 0.12 0.00 0.00 56.93 55.89 1b6f s PHE 3 Cb -0.04 -1.79 0.02 0.00 -0.57 0.00 0.00 43.02 40.64 1b6f s PHE 3 CO 0.01 -0.48 -0.06 0.54 -0.10 0.00 0.00 175.22 175.14 1b6f s ASN 4 N 0.60 1.62 -1.02 1.36 4.22 -1.26 0.18 114.94 120.62 1b6f s ASN 4 Ca -0.11 -0.21 -0.04 0.00 -2.14 0.00 0.00 52.86 50.36 1b6f s ASN 4 Cb -0.16 -0.65 0.28 0.00 1.28 0.00 0.00 41.25 42.00 1b6f s ASN 4 CO 0.03 -0.08 1.22 -1.22 -2.04 0.00 0.00 177.10 175.01 1b6f n TYR 5 N 4.48 3.53 -2.82 1.54 4.01 -0.83 -4.87 117.16 122.21 1b6f n TYR 5 Ca -0.17 -3.33 -0.34 0.00 -0.16 0.00 0.00 57.90 53.90 1b6f n TYR 5 Cb 0.51 -1.30 -0.07 0.00 -0.31 0.00 0.00 39.34 38.16 1b6f n TYR 5 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 1b6f s GLU 6 N -2.15 4.28 0.14 -0.72 -6.30 -1.26 -2.89 118.70 109.80 1b6f s GLU 6 Ca 0.31 1.15 -0.05 0.00 -2.50 0.00 0.00 54.97 53.88 1b6f s GLU 6 Cb -0.00 -2.28 0.02 0.00 0.00 0.00 0.00 34.13 31.87 1b6f s GLU 6 CO 0.01 0.02 0.28 0.25 0.02 0.00 0.00 175.26 175.85 1b6f n THR 7 N -0.45 0.00 -3.50 -1.70 -2.24 0.39 -4.91 114.28 101.87 1b6f n THR 7 Ca 0.06 -0.35 -0.16 0.00 -2.27 0.00 0.00 64.05 61.33 1b6f n THR 7 Cb 0.53 0.35 -0.05 0.00 -2.10 0.00 0.00 70.33 69.07 1b6f n THR 7 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1b6f s GLU 8 N -2.03 1.11 0.20 -0.78 -1.05 -1.26 0.12 118.70 115.01 1b6f s GLU 8 Ca 0.06 -0.01 -0.01 0.00 -0.15 0.00 0.00 54.97 54.86 1b6f s GLU 8 Cb -0.02 0.52 -0.04 0.00 -0.44 0.00 0.00 34.13 34.15 1b6f s GLU 8 CO 0.04 -0.40 0.13 0.99 0.95 0.00 0.00 175.26 176.98 1b6f s THR 9 N -2.05 0.01 0.27 1.83 2.01 -0.01 -4.95 115.64 112.75 1b6f s THR 9 Ca -0.07 -2.00 0.11 0.00 0.31 0.00 0.00 61.69 60.04 1b6f s THR 9 Cb -0.00 -2.50 -0.05 0.00 0.01 0.00 0.00 72.50 69.96 1b6f s THR 9 CO 0.02 0.00 -0.11 0.42 -0.69 0.00 0.00 174.62 174.26 1b6f s THR 10 N -4.15 2.95 -0.22 -0.82 -4.23 -1.26 -1.74 115.64 106.16 1b6f s THR 10 Ca 0.39 -2.16 -0.25 0.00 -1.18 0.00 0.00 61.69 58.49 1b6f s THR 10 Cb 0.07 -2.56 0.07 0.00 1.34 0.00 0.00 72.50 71.42 1b6f s THR 10 CO 0.12 -0.38 0.67 -0.44 -0.54 0.00 0.00 174.62 174.05 1b6f s SER 11 N -3.57 -0.69 0.04 3.99 0.01 -0.70 -4.97 113.70 107.82 1b6f s SER 11 Ca 0.30 1.25 0.28 0.00 1.31 0.00 0.00 55.95 59.10 1b6f s SER 11 Cb -0.06 1.24 1.15 0.00 0.21 0.00 0.00 66.02 68.56 1b6f s SER 11 CO 0.17 -0.29 1.89 1.33 0.41 0.00 0.00 173.24 176.75 1b6f n VAL 12 N 2.42 0.13 -2.16 3.43 0.24 -1.26 -0.10 118.33 121.03 1b6f n VAL 12 Ca -0.15 -0.05 -0.35 0.00 -2.04 0.00 0.00 64.34 61.74 1b6f n VAL 12 Cb 0.56 -0.53 0.01 0.00 -1.47 0.00 0.00 33.84 32.41 1b6f n VAL 12 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1b6f s ILE 13 N -3.02 2.95 0.63 1.34 1.09 -1.26 -4.15 121.20 118.77 1b6f s ILE 13 Ca 0.13 0.59 -0.17 0.00 -1.10 0.00 0.00 60.65 60.10 1b6f s ILE 13 Cb 0.18 -3.24 -0.02 0.00 -1.06 0.00 0.00 42.46 38.32 1b6f s ILE 13 CO 0.54 -0.12 1.18 -2.16 -0.10 0.00 0.00 174.94 174.28 1b6f s PRO 14 N -3.29 2.80 0.42 2.79 0.04 -1.26 -2.91 135.00 133.59 1b6f s PRO 14 Ca 0.74 1.72 0.23 0.00 0.04 0.00 0.00 61.00 63.74 1b6f s PRO 14 Cb -0.27 -1.92 0.70 0.00 0.04 0.00 0.00 34.50 33.06 1b6f s PRO 14 CO 0.29 -1.31 1.73 0.00 0.04 0.00 0.00 177.00 177.75 1b6f h ALA 15 N 0.52 0.94 0.00 8.56 0.00 -1.90 -2.28 119.26 125.11 1b6f h ALA 15 Ca -0.49 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.20 1b6f h ALA 15 Cb 1.29 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1b6f h ALA 15 CO 0.54 0.28 -0.11 0.00 0.00 0.00 0.00 179.25 179.96 1b6f h ALA 16 N 1.78 0.01 -0.28 0.00 0.00 -1.98 -2.43 119.26 116.36 1b6f h ALA 16 Ca -0.00 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1b6f h ALA 16 Cb 0.89 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1b6f h ALA 16 CO 0.03 0.08 0.19 -0.09 0.00 0.00 0.00 179.25 179.46 1b6f h ARG 17 N -1.00 0.35 -0.23 0.00 9.65 -1.97 -2.06 114.38 119.12 1b6f h ARG 17 Ca -0.02 -0.02 -0.16 0.00 -1.10 0.00 0.00 59.98 58.68 1b6f h ARG 17 Cb 0.40 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 28.91 1b6f h ARG 17 CO -0.01 0.23 -0.47 1.25 2.80 0.00 0.00 179.97 183.77 1b6f h LEU 18 N 0.37 0.82 0.34 3.80 5.85 -1.52 -2.56 115.31 122.40 1b6f h LEU 18 Ca 0.11 -0.55 -0.02 0.00 0.84 0.00 0.00 57.88 58.26 1b6f h LEU 18 Cb -0.02 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.78 1b6f h LEU 18 CO -0.02 1.21 -0.16 0.15 -0.34 0.00 0.00 178.44 179.27 1b6f h PHE 19 N 0.45 -0.43 -0.90 1.25 3.04 -0.86 0.20 116.94 119.70 1b6f h PHE 19 Ca 0.01 -0.01 0.23 0.00 3.98 0.00 0.00 57.97 62.18 1b6f h PHE 19 Cb 1.08 0.14 -0.13 0.00 2.56 0.00 0.00 35.95 39.60 1b6f h PHE 19 CO 0.08 -0.27 0.37 0.87 -2.02 0.00 0.00 178.31 177.35 1b6f h LYS 20 N -0.48 0.34 -0.03 1.11 1.57 -1.57 0.75 116.57 118.27 1b6f h LYS 20 Ca -0.05 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.62 1b6f h LYS 20 Cb 0.35 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 1b6f h LYS 20 CO 0.08 0.23 -0.44 0.00 -0.57 0.00 0.00 179.45 178.75 1b6f h ALA 21 N 1.74 1.23 0.00 3.86 0.00 -1.31 1.01 119.26 125.79 1b6f h ALA 21 Ca 0.57 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1b6f h ALA 21 Cb 1.12 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1b6f h ALA 21 CO -0.56 0.57 -0.60 0.34 0.00 0.00 0.00 179.25 178.99 1b6f n PHE 22 N -4.01 0.21 0.05 0.00 -0.00 0.17 -1.92 117.46 111.96 1b6f n PHE 22 Ca -0.02 0.06 0.00 0.00 -0.00 0.00 0.00 57.45 57.50 1b6f n PHE 22 Cb 0.47 -0.41 0.00 0.00 -0.00 0.00 0.00 39.48 39.54 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 -1.76 0.76 -0.22 -2.13 -0.00 0.21 -3.86 119.36 112.36 1b6f n ILE 23 Ca 0.04 0.25 0.18 0.00 -0.00 0.00 0.00 62.75 63.22 1b6f n ILE 23 Cb 0.38 -1.24 0.51 0.00 -0.00 0.00 0.00 39.64 39.29 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 0.00 0.41 -0.28 1.39 6.46 0.89 -3.00 115.31 121.18 1b6f h LEU 24 Ca 0.00 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.80 1b6f h LEU 24 Cb 0.00 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 39.89 1b6f h LEU 24 CO 0.00 0.18 0.00 0.47 -0.62 0.00 0.00 178.44 178.47 1b6f n ASP 25 N -4.50 0.28 -0.29 1.25 8.00 -0.45 -4.76 116.55 116.07 1b6f n ASP 25 Ca 0.18 -0.61 0.11 0.00 0.71 0.00 0.00 54.79 55.18 1b6f n ASP 25 Cb 0.64 0.47 0.26 0.00 -0.02 0.00 0.00 41.12 42.47 1b6f n ASP 25 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1b6f h GLY 26 N 0.00 1.21 0.26 0.44 0.00 -1.23 1.35 103.07 105.10 1b6f h GLY 26 Ca 0.00 0.04 0.22 0.00 0.00 0.00 0.00 47.33 47.59 1b6f h GLY 26 CO 0.00 -0.37 0.61 1.29 0.00 0.00 0.00 176.54 178.07 1b6f h ASP 27 N 0.15 0.27 0.00 0.19 2.03 -1.83 0.39 116.42 117.62 1b6f h ASP 27 Ca 0.52 0.03 -0.37 0.00 -0.73 0.00 0.00 57.03 56.49 1b6f h ASP 27 Cb 1.03 -0.02 -0.07 0.00 -0.83 0.00 0.00 39.33 39.45 1b6f h ASP 27 CO -0.70 0.10 -2.39 -3.20 -1.03 0.00 0.00 179.24 172.02 1b6f n ASN 28 N -4.44 0.74 -0.12 4.15 5.15 0.32 -4.44 115.26 116.63 1b6f n ASN 28 Ca 0.19 -0.05 -0.12 0.00 -0.60 0.00 0.00 54.58 54.00 1b6f n ASN 28 Cb 0.79 0.52 -0.03 0.00 -0.53 0.00 0.00 39.78 40.54 1b6f n ASN 28 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 1b6f h LEU 29 N 0.00 0.83 -0.52 1.20 5.85 0.19 -2.73 115.31 120.13 1b6f h LEU 29 Ca -0.55 -0.43 0.06 0.00 0.84 0.00 0.00 57.88 57.80 1b6f h LEU 29 Cb 2.11 -0.23 -0.09 0.00 0.37 0.00 0.00 40.66 42.82 1b6f h LEU 29 CO -0.01 1.09 -0.52 -0.26 -0.34 0.00 0.00 178.44 178.39 1b6f h PHE 30 N 0.58 -1.60 0.00 1.25 0.04 -0.44 1.22 116.94 118.00 1b6f h PHE 30 Ca 0.07 0.09 0.00 0.00 2.80 0.00 0.00 57.97 60.93 1b6f h PHE 30 Cb 0.81 0.77 0.00 0.00 2.20 0.00 0.00 35.95 39.73 1b6f h PHE 30 CO 0.06 -0.46 0.00 -0.35 -0.60 0.00 0.00 178.31 176.96 1b6f n PRO 31 N -5.37 0.44 -0.05 1.51 -0.04 -1.22 -0.17 135.00 130.08 1b6f n PRO 31 Ca -0.01 0.05 -0.07 0.00 -0.04 0.00 0.00 63.50 63.43 1b6f n PRO 31 Cb 0.34 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.27 1b6f n PRO 31 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1b6f n LYS 32 N -1.14 0.39 0.14 0.54 4.76 0.32 -4.34 118.16 118.83 1b6f n LYS 32 Ca 0.12 0.15 0.12 0.00 -2.87 0.00 0.00 58.31 55.83 1b6f n LYS 32 Cb 0.10 -1.17 0.16 0.00 -1.84 0.00 0.00 35.03 32.28 1b6f n LYS 32 CO 0.00 0.00 0.00 -0.39 -1.37 0.00 0.00 177.40 175.64 1b6f h VAL 33 N -0.73 0.00 -2.05 -0.18 -1.51 0.93 -3.38 116.25 109.32 1b6f h VAL 33 Ca 0.00 -0.82 -0.56 0.00 -1.23 0.00 0.00 66.70 64.09 1b6f h VAL 33 Cb 0.73 1.58 -0.40 0.00 -2.13 0.00 0.00 31.29 31.07 1b6f h VAL 33 CO 0.00 0.00 -0.99 0.00 -1.23 0.00 0.00 177.57 175.35 1b6f n ALA 34 N -2.02 2.82 1.44 5.19 0.00 0.75 -4.87 120.51 123.82 1b6f n ALA 34 Ca 0.03 -3.74 0.12 0.00 0.00 0.00 0.00 53.44 49.85 1b6f n ALA 34 Cb 0.50 -0.84 0.70 0.00 0.00 0.00 0.00 19.45 19.81 1b6f n ALA 34 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1b6f n PRO 35 N 1.10 0.67 0.12 0.00 -0.04 -1.17 -2.84 135.00 132.84 1b6f n PRO 35 Ca 0.24 0.02 0.10 0.00 -0.04 0.00 0.00 63.50 63.81 1b6f n PRO 35 Cb 0.51 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.50 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 -1.90 -3.41 115.11 114.54 1b6f h GLN 36 Ca 0.00 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 1b6f h GLN 36 Cb 0.05 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1b6f h GLN 36 CO 0.00 0.06 -1.02 0.00 -0.67 0.00 0.00 178.83 177.20 1b6f n ALA 37 N -2.19 1.42 -2.83 3.87 0.00 -1.13 -4.84 120.51 114.80 1b6f n ALA 37 Ca -0.00 -0.67 -0.34 0.00 0.00 0.00 0.00 53.44 52.42 1b6f n ALA 37 Cb 0.59 0.11 -0.10 0.00 0.00 0.00 0.00 19.45 20.05 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 -2.64 4.72 -0.14 0.00 1.09 -1.17 -4.22 121.20 118.83 1b6f s ILE 38 Ca -0.24 -0.06 -0.24 0.00 -1.10 0.00 0.00 60.65 59.02 1b6f s ILE 38 Cb 0.05 -3.13 -0.25 0.00 -1.06 0.00 0.00 42.46 38.07 1b6f s ILE 38 CO 0.34 0.46 0.59 0.77 -0.10 0.00 0.00 174.94 176.99 1b6f h SER 39 N 6.74 0.11 -4.74 3.58 4.64 -1.29 -3.36 113.55 119.24 1b6f h SER 39 Ca -0.37 -0.83 0.03 0.00 -0.47 0.00 0.00 61.79 60.15 1b6f h SER 39 Cb 1.17 -0.04 -0.17 0.00 -0.31 0.00 0.00 62.40 63.06 1b6f h SER 39 CO 0.70 1.29 0.35 -0.44 -0.87 0.00 0.00 176.83 177.85 1b6f s SER 40 N -6.62 -0.49 0.07 4.97 0.01 -1.22 -4.76 113.70 105.67 1b6f s SER 40 Ca -0.21 0.24 0.09 0.00 1.31 0.00 0.00 55.95 57.37 1b6f s SER 40 Cb 0.01 0.47 -0.03 0.00 0.21 0.00 0.00 66.02 66.68 1b6f s SER 40 CO 0.69 -0.67 -0.24 -0.69 0.41 0.00 0.00 173.24 172.74 1b6f s VAL 41 N -2.50 2.40 -0.36 3.43 1.01 -1.26 0.11 120.40 123.22 1b6f s VAL 41 Ca -0.01 -1.45 0.02 0.00 0.00 0.00 0.00 61.98 60.54 1b6f s VAL 41 Cb -0.01 -2.01 0.15 0.00 0.00 0.00 0.00 36.38 34.52 1b6f s VAL 41 CO -0.04 0.26 0.29 -1.61 0.00 0.00 0.00 175.10 174.01 1b6f s GLU 42 N -1.59 0.59 -0.07 2.72 2.02 -0.16 -4.91 118.70 117.29 1b6f s GLU 42 Ca 0.14 -1.07 -0.33 0.00 0.02 0.00 0.00 54.97 53.73 1b6f s GLU 42 Cb -0.10 -1.00 -0.11 0.00 0.10 0.00 0.00 34.13 33.02 1b6f s GLU 42 CO 0.05 -1.20 1.93 0.09 0.02 0.00 0.00 175.26 176.15 1b6f n ASN 43 N 4.17 3.60 0.03 -0.19 3.02 -1.26 0.11 115.26 124.73 1b6f n ASN 43 Ca 0.11 0.91 -0.19 0.00 -0.03 0.00 0.00 54.58 55.38 1b6f n ASN 43 Cb 0.41 -1.41 -0.14 0.00 -0.61 0.00 0.00 39.78 38.03 1b6f n ASN 43 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1b6f h ILE 44 N 5.63 0.84 -4.27 2.41 2.04 0.19 -3.46 117.51 120.88 1b6f h ILE 44 Ca -0.48 -2.52 -0.25 0.00 1.00 0.00 0.00 64.86 62.60 1b6f h ILE 44 Cb 1.26 2.61 -0.11 0.00 -0.74 0.00 0.00 36.82 39.85 1b6f h ILE 44 CO 0.95 0.82 -0.33 -0.70 0.00 0.00 0.00 178.15 178.89 1b6f s GLU 45 N -2.58 1.63 0.49 2.37 2.12 0.00 -4.95 118.70 117.78 1b6f s GLU 45 Ca -0.16 -1.66 0.00 0.00 0.36 0.00 0.00 54.97 53.51 1b6f s GLU 45 Cb 0.06 0.39 0.00 0.00 0.26 0.00 0.00 34.13 34.84 1b6f s GLU 45 CO 0.82 -0.63 0.00 0.41 -0.54 0.00 0.00 175.26 175.31 1b6f n GLY 46 N -0.46 -2.80 1.58 -1.50 0.00 -1.26 -2.28 105.19 98.47 1b6f n GLY 46 Ca 0.02 -1.11 0.05 0.00 0.00 0.00 0.00 46.02 44.97 1b6f n GLY 46 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1b6f n ASN 47 N -4.20 4.90 0.00 1.61 4.05 -1.26 -4.80 115.26 115.56 1b6f n ASN 47 Ca -0.05 -3.05 0.00 0.00 0.45 0.00 0.00 54.58 51.93 1b6f n ASN 47 Cb 0.64 -0.65 0.00 0.00 1.23 0.00 0.00 39.78 40.99 1b6f n ASN 47 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1b6f n GLY 48 N 0.06 1.00 0.00 8.20 0.00 -1.26 -5.09 105.19 108.10 1b6f n GLY 48 Ca 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.30 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 -2.01 0.48 3.67 -0.02 0.00 -1.26 -4.92 105.19 101.13 1b6f n GLY 49 Ca 0.00 -1.85 -0.43 0.00 0.00 0.00 0.00 46.02 43.75 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 0.33 4.27 0.00 1.61 0.04 -1.26 -2.58 135.00 137.42 1b6f s PRO 50 Ca 0.00 1.75 0.00 0.00 0.04 0.00 0.00 61.00 62.79 1b6f s PRO 50 Cb 0.00 -3.69 0.00 0.00 0.04 0.00 0.00 34.50 30.85 1b6f s PRO 50 CO 0.00 -0.62 0.00 0.41 0.04 0.00 0.00 177.00 176.83 1b6f n GLY 51 N 3.58 0.63 3.78 0.56 0.00 0.18 -4.91 105.19 109.00 1b6f n GLY 51 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.41 3.43 -0.06 2.61 2.01 -1.06 -4.57 115.64 115.59 1b6f s THR 52 Ca 0.00 0.60 0.06 0.00 0.31 0.00 0.00 61.69 62.66 1b6f s THR 52 Cb 0.00 -3.13 -0.01 0.00 0.01 0.00 0.00 72.50 69.37 1b6f s THR 52 CO 0.00 -0.48 -0.25 -0.63 -0.69 0.00 0.00 174.62 172.58 1b6f s ILE 53 N -2.55 2.08 -0.09 1.82 1.01 -0.97 0.53 121.20 123.04 1b6f s ILE 53 Ca 0.64 -1.06 -0.13 0.00 0.00 0.00 0.00 60.65 60.11 1b6f s ILE 53 Cb -0.18 -1.75 0.03 0.00 0.01 0.00 0.00 42.46 40.56 1b6f s ILE 53 CO 0.45 0.57 0.32 -1.59 0.00 0.00 0.00 174.94 174.70 1b6f s LYS 54 N -0.16 0.48 -0.52 2.79 -2.85 -0.96 0.20 119.74 118.72 1b6f s LYS 54 Ca -0.04 0.24 -0.22 0.00 -1.00 0.00 0.00 55.97 54.95 1b6f s LYS 54 Cb -0.14 0.23 0.04 0.00 -2.06 0.00 0.00 37.83 35.90 1b6f s LYS 54 CO 0.04 -0.09 0.81 0.21 0.10 0.00 0.00 175.35 176.42 1b6f s LYS 55 N -0.34 3.28 -0.22 1.78 2.20 0.29 -1.63 119.74 125.09 1b6f s LYS 55 Ca -0.05 -0.43 -0.20 0.00 -0.36 0.00 0.00 55.97 54.93 1b6f s LYS 55 Cb -0.03 -4.05 -0.02 0.00 -1.51 0.00 0.00 37.83 32.22 1b6f s LYS 55 CO 0.02 -1.33 0.62 0.42 -0.36 0.00 0.00 175.35 174.72 1b6f s ILE 56 N 3.41 5.01 0.20 5.43 -1.09 0.33 -0.99 121.20 133.50 1b6f s ILE 56 Ca 0.25 1.15 -0.24 0.00 -2.23 0.00 0.00 60.65 59.59 1b6f s ILE 56 Cb -0.15 -3.93 -0.08 0.00 -1.58 0.00 0.00 42.46 36.72 1b6f s ILE 56 CO 0.17 0.08 0.78 -0.44 -1.23 0.00 0.00 174.94 174.30 1b6f s SER 57 N 1.31 7.27 0.03 3.58 0.01 0.30 0.68 113.70 126.88 1b6f s SER 57 Ca 0.27 1.59 0.04 0.00 1.31 0.00 0.00 55.95 59.16 1b6f s SER 57 Cb -0.16 -2.48 -0.04 0.00 0.21 0.00 0.00 66.02 63.56 1b6f s SER 57 CO 0.09 0.12 -0.05 -0.36 0.41 0.00 0.00 173.24 173.46 1b6f s PHE 58 N -1.33 2.92 -0.99 2.43 0.40 -1.01 -0.90 117.98 119.50 1b6f s PHE 58 Ca 0.40 -0.03 -0.12 0.00 -0.60 0.00 0.00 56.93 56.58 1b6f s PHE 58 Cb -0.20 -1.59 -0.08 0.00 0.51 0.00 0.00 43.02 41.66 1b6f s PHE 58 CO 0.24 0.42 2.15 -0.35 0.70 0.00 0.00 175.22 178.37 1b6f n PRO 59 N 1.24 2.13 0.00 0.24 -0.04 -1.26 -4.66 135.00 132.65 1b6f n PRO 59 Ca -0.14 -1.74 0.00 0.00 -0.04 0.00 0.00 63.50 61.58 1b6f n PRO 59 Cb 0.52 -2.69 0.00 0.00 -0.04 0.00 0.00 33.50 31.29 1b6f n PRO 59 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1b6f n GLU 60 N 5.13 0.00 0.00 0.54 2.13 -1.26 -4.82 120.64 122.36 1b6f n GLU 60 Ca 0.50 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.32 1b6f n GLU 60 Cb 0.24 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.95 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 0.00 2.86 4.01 8.31 0.00 -1.26 -5.01 105.19 114.10 1b6f n GLY 61 Ca 0.00 -0.77 -0.21 0.00 0.00 0.00 0.00 46.02 45.05 1b6f n GLY 61 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1b6f s PHE 62 N -0.80 1.85 0.07 1.61 0.40 -1.26 -5.00 117.98 114.85 1b6f s PHE 62 Ca 0.00 -0.45 0.19 0.00 -0.60 0.00 0.00 56.93 56.08 1b6f s PHE 62 Cb 0.00 -2.55 0.60 0.00 0.51 0.00 0.00 43.02 41.57 1b6f s PHE 62 CO 0.00 -1.19 1.69 -1.00 0.70 0.00 0.00 175.22 175.42 1b6f h PRO 63 N 0.01 0.00 -5.40 0.24 0.13 -1.99 -3.43 132.00 121.56 1b6f h PRO 63 Ca -0.35 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.13 1b6f h PRO 63 Cb 1.28 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.17 1b6f h PRO 63 CO 0.43 0.36 -0.72 -0.06 -0.23 0.00 0.00 178.00 177.77 1b6f s PHE 64 N -3.46 2.90 0.00 1.56 0.08 -1.26 -5.06 117.98 112.74 1b6f s PHE 64 Ca 0.01 -0.45 0.00 0.00 0.12 0.00 0.00 56.93 56.61 1b6f s PHE 64 Cb 0.10 -1.87 0.00 0.00 -0.57 0.00 0.00 43.02 40.68 1b6f s PHE 64 CO 0.69 -0.09 0.37 1.63 -0.10 0.00 0.00 175.22 177.71 1b6f n LYS 65 N 3.39 0.00 -0.71 0.44 4.01 -1.26 -4.80 118.16 119.23 1b6f n LYS 65 Ca -0.18 0.14 -0.01 0.00 -0.51 0.00 0.00 58.31 57.75 1b6f n LYS 65 Cb 0.53 -0.87 0.01 0.00 -0.51 0.00 0.00 35.03 34.18 1b6f n LYS 65 CO 0.00 0.00 0.00 2.48 -1.11 0.00 0.00 177.40 178.77 1b6f n TYR 66 N -0.51 -3.38 -3.66 2.13 0.18 -1.26 -2.41 117.16 108.25 1b6f n TYR 66 Ca 0.00 -0.10 -0.14 0.00 1.88 0.00 0.00 57.90 59.55 1b6f n TYR 66 Cb 0.00 -0.04 -0.08 0.00 -0.38 0.00 0.00 39.34 38.84 1b6f n TYR 66 CO 0.00 0.00 0.00 0.14 -2.08 0.00 0.00 176.86 174.92 1b6f s VAL 67 N 0.02 0.00 -0.09 -3.48 -7.23 0.21 -4.38 120.40 105.46 1b6f s VAL 67 Ca 0.04 -0.01 -0.26 0.00 -1.81 0.00 0.00 61.98 59.94 1b6f s VAL 67 Cb -0.00 -0.84 -0.03 0.00 0.56 0.00 0.00 36.38 36.07 1b6f s VAL 67 CO 0.02 -0.00 0.83 -0.54 -0.31 0.00 0.00 175.10 175.10 1b6f s LYS 68 N 0.23 4.42 -0.11 4.82 1.02 -0.37 -0.51 119.74 129.23 1b6f s LYS 68 Ca -0.01 1.09 0.01 0.00 0.02 0.00 0.00 55.97 57.09 1b6f s LYS 68 Cb -0.04 -3.50 0.02 0.00 -0.52 0.00 0.00 37.83 33.79 1b6f s LYS 68 CO 0.01 -0.12 -0.14 0.34 -0.92 0.00 0.00 175.35 174.52 1b6f s ASP 69 N 0.99 2.35 -0.02 2.83 -1.08 -0.65 0.54 116.67 121.62 1b6f s ASP 69 Ca 0.42 -0.40 -0.06 0.00 -0.52 0.00 0.00 52.55 51.99 1b6f s ASP 69 Cb -0.18 -1.03 -0.04 0.00 -1.46 0.00 0.00 42.92 40.20 1b6f s ASP 69 CO 0.18 -0.01 0.22 -0.60 0.52 0.00 0.00 175.17 175.48 1b6f s ARG 70 N 1.12 3.51 0.40 4.34 3.52 0.26 -2.27 118.95 129.84 1b6f s ARG 70 Ca -0.04 -0.16 -0.24 0.00 -0.13 0.00 0.00 55.73 55.16 1b6f s ARG 70 Cb -0.14 -3.11 -0.09 0.00 -1.56 0.00 0.00 34.95 30.05 1b6f s ARG 70 CO -0.03 0.68 1.05 0.08 -0.81 0.00 0.00 175.30 176.27 1b6f s VAL 71 N -1.25 3.73 0.00 7.11 1.01 0.19 0.28 120.40 131.47 1b6f s VAL 71 Ca 0.25 1.31 0.00 0.00 0.00 0.00 0.00 61.98 63.53 1b6f s VAL 71 Cb -0.13 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.59 1b6f s VAL 71 CO 0.14 -0.01 0.00 -0.67 0.00 0.00 0.00 175.10 174.56 1b6f n ASP 72 N -0.14 0.00 -4.00 3.32 2.03 0.38 0.48 116.55 118.62 1b6f n ASP 72 Ca 0.05 0.03 -0.15 0.00 0.52 0.00 0.00 54.79 55.24 1b6f n ASP 72 Cb 0.50 -0.38 -0.13 0.00 -0.72 0.00 0.00 41.12 40.39 1b6f n ASP 72 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 1b6f s GLU 73 N -0.76 0.47 -0.06 -0.67 2.12 -1.02 -3.76 118.70 115.02 1b6f s GLU 73 Ca 0.00 -0.42 0.02 0.00 0.36 0.00 0.00 54.97 54.93 1b6f s GLU 73 Cb 0.00 -0.37 0.02 0.00 0.26 0.00 0.00 34.13 34.04 1b6f s GLU 73 CO 0.00 0.09 -0.09 0.08 -0.54 0.00 0.00 175.26 174.80 1b6f s VAL 74 N -0.63 0.93 -0.26 3.70 1.01 -1.24 0.57 120.40 124.48 1b6f s VAL 74 Ca -0.03 -0.34 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 1b6f s VAL 74 Cb -0.05 -0.88 0.08 0.00 0.00 0.00 0.00 36.38 35.53 1b6f s VAL 74 CO 0.00 0.31 0.09 -1.81 0.00 0.00 0.00 175.10 173.69 1b6f s ASP 75 N 0.84 3.38 0.00 3.32 1.11 0.69 -4.89 116.67 121.11 1b6f s ASP 75 Ca -0.12 -1.19 0.28 0.00 0.18 0.00 0.00 52.55 51.71 1b6f s ASP 75 Cb -0.15 -0.57 1.21 0.00 1.07 0.00 0.00 42.92 44.48 1b6f s ASP 75 CO 0.02 -0.38 1.90 1.41 1.18 0.00 0.00 175.17 179.29 1b6f n HIS 76 N 5.07 0.00 -0.05 4.23 8.25 -1.26 -1.90 115.22 129.56 1b6f n HIS 76 Ca -0.06 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.33 1b6f n HIS 76 Cb 0.44 -0.50 -0.06 0.00 1.12 0.00 0.00 29.99 31.00 1b6f n HIS 76 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1b6f n THR 77 N -1.50 0.64 1.30 1.59 -1.04 -1.26 -4.52 114.28 109.49 1b6f n THR 77 Ca 0.07 -0.28 0.11 0.00 -2.04 0.00 0.00 64.05 61.92 1b6f n THR 77 Cb 0.33 -0.87 0.42 0.00 -1.82 0.00 0.00 70.33 68.38 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 -2.72 1.60 -3.44 8.00 2.85 -1.25 -4.95 115.26 115.36 1b6f n ASN 78 Ca -0.19 -1.65 -0.22 0.00 -0.11 0.00 0.00 54.58 52.41 1b6f n ASN 78 Cb 0.73 -0.08 0.06 0.00 1.24 0.00 0.00 39.78 41.73 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 0.27 -2.22 -3.65 1.20 3.72 -0.80 -4.75 117.46 111.22 1b6f n PHE 79 Ca 0.17 0.69 -0.23 0.00 -0.05 0.00 0.00 57.45 58.02 1b6f n PHE 79 Cb 0.33 -3.86 -0.17 0.00 -0.94 0.00 0.00 39.48 34.84 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 -5.09 0.08 -0.11 -1.08 2.20 -0.89 -2.08 119.74 112.77 1b6f s LYS 80 Ca 0.45 0.10 -0.02 0.00 -0.36 0.00 0.00 55.97 56.15 1b6f s LYS 80 Cb -0.10 -1.24 0.04 0.00 -1.51 0.00 0.00 37.83 35.02 1b6f s LYS 80 CO 0.79 -0.50 0.03 -0.47 -0.36 0.00 0.00 175.35 174.84 1b6f s TYR 81 N 2.12 0.64 0.10 4.03 6.14 -0.71 0.25 117.35 129.93 1b6f s TYR 81 Ca 0.03 -0.31 0.07 0.00 0.64 0.00 0.00 57.07 57.51 1b6f s TYR 81 Cb -0.14 -0.81 -0.03 0.00 0.42 0.00 0.00 41.96 41.39 1b6f s TYR 81 CO -0.06 -0.40 -0.18 -0.80 0.64 0.00 0.00 175.55 174.75 1b6f s ASN 82 N 1.98 2.20 -0.08 4.32 0.01 0.19 -0.81 114.94 122.76 1b6f s ASN 82 Ca 0.03 -0.70 -0.06 0.00 -0.71 0.00 0.00 52.86 51.43 1b6f s ASN 82 Cb -0.14 -0.10 0.03 0.00 0.41 0.00 0.00 41.25 41.45 1b6f s ASN 82 CO -0.06 -0.02 0.19 -0.72 -1.51 0.00 0.00 177.10 174.98 1b6f s TYR 83 N -1.41 -0.23 0.32 2.20 -0.85 0.26 0.14 117.35 117.79 1b6f s TYR 83 Ca 0.05 0.56 0.06 0.00 -0.52 0.00 0.00 57.07 57.22 1b6f s TYR 83 Cb -0.09 0.04 -0.01 0.00 0.38 0.00 0.00 41.96 42.28 1b6f s TYR 83 CO 0.04 -0.14 0.44 -1.12 -1.52 0.00 0.00 175.55 173.25 1b6f s SER 84 N 0.48 5.96 -0.19 -0.18 0.01 0.81 -1.63 113.70 118.97 1b6f s SER 84 Ca -0.03 -0.18 -0.05 0.00 1.31 0.00 0.00 55.95 57.01 1b6f s SER 84 Cb -0.05 -1.30 -0.02 0.00 0.21 0.00 0.00 66.02 64.86 1b6f s SER 84 CO -0.02 -0.38 -0.01 -0.69 0.41 0.00 0.00 173.24 172.55 1b6f s VAL 85 N -2.16 3.91 0.00 3.43 1.01 0.08 0.88 120.40 127.55 1b6f s VAL 85 Ca 0.43 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.08 1b6f s VAL 85 Cb -0.09 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.54 1b6f s VAL 85 CO 0.30 0.45 0.00 2.30 0.00 0.00 0.00 175.10 178.15 1b6f n ILE 86 N 4.04 0.00 -2.06 2.22 -5.35 0.19 -4.19 119.36 114.20 1b6f n ILE 86 Ca -0.17 0.06 -0.39 0.00 -0.27 0.00 0.00 62.75 61.97 1b6f n ILE 86 Cb 0.52 -0.88 -0.00 0.00 -1.74 0.00 0.00 39.64 37.54 1b6f n ILE 86 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1b6f n GLU 87 N -1.85 4.60 -4.42 6.28 2.13 -1.15 -4.65 120.64 121.58 1b6f n GLU 87 Ca 0.00 -3.59 -0.27 0.00 0.66 0.00 0.00 57.16 53.96 1b6f n GLU 87 Cb 0.00 -2.57 -0.13 0.00 0.27 0.00 0.00 31.44 29.00 1b6f n GLU 87 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1b6f s GLY 88 N 0.09 1.37 0.00 8.31 0.00 -1.26 -1.24 107.32 114.59 1b6f s GLY 88 Ca 0.52 -1.32 0.00 0.00 0.00 0.00 0.00 44.72 43.92 1b6f s GLY 88 CO -0.11 -1.29 0.00 0.61 0.00 0.00 0.00 173.10 172.31 1b6f n GLY 89 N 1.16 0.83 0.00 0.20 0.00 -1.26 -1.99 105.19 104.13 1b6f n GLY 89 Ca -0.18 -0.78 0.05 0.00 0.00 0.00 0.00 46.02 45.10 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 0.87 -1.54 1.61 -0.04 -1.26 -4.90 135.00 129.74 1b6f n PRO 90 Ca 0.00 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.07 1b6f n PRO 90 Cb 0.00 -1.16 0.04 0.00 -0.04 0.00 0.00 33.50 32.33 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 -0.66 2.74 -3.71 0.52 5.41 -0.84 -5.01 119.36 117.81 1b6f n ILE 91 Ca 0.07 -0.50 -0.14 0.00 1.00 0.00 0.00 62.75 63.18 1b6f n ILE 91 Cb 0.03 -0.90 -0.09 0.00 -0.71 0.00 0.00 39.64 37.97 1b6f n ILE 91 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1b6f s GLY 92 N -1.11 -0.34 0.00 7.39 0.00 -1.25 -4.75 107.32 107.26 1b6f s GLY 92 Ca 0.70 1.18 0.00 0.00 0.00 0.00 0.00 44.72 46.59 1b6f s GLY 92 CO 0.52 0.98 0.00 1.22 0.00 0.00 0.00 173.10 175.83 1b6f n ASP 93 N 2.50 0.00 -0.24 1.64 8.00 -1.26 -0.91 116.55 126.29 1b6f n ASP 93 Ca -0.15 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.35 1b6f n ASP 93 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 1b6f n ASP 93 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1b6f n THR 94 N 0.00 0.00 -2.99 -3.53 -2.24 -1.26 -5.05 114.28 99.21 1b6f n THR 94 Ca 0.00 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.44 1b6f n THR 94 Cb 0.00 0.47 -0.06 0.00 -2.10 0.00 0.00 70.33 68.64 1b6f n THR 94 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1b6f s LEU 95 N 0.00 4.14 -1.36 3.22 0.05 -0.09 -3.63 118.68 121.02 1b6f s LEU 95 Ca 0.00 1.51 -0.07 0.00 0.05 0.00 0.00 54.13 55.62 1b6f s LEU 95 Cb 0.00 -4.07 0.04 0.00 -2.05 0.00 0.00 46.19 40.11 1b6f s LEU 95 CO 0.00 -0.17 0.48 -0.62 -0.55 0.00 0.00 176.35 175.49 1b6f n GLU 96 N -0.03 -3.79 -1.60 1.48 1.02 0.19 -3.91 120.64 114.00 1b6f n GLU 96 Ca 0.03 0.64 -0.32 0.00 -0.02 0.00 0.00 57.16 57.49 1b6f n GLU 96 Cb 0.52 -5.39 0.06 0.00 -0.02 0.00 0.00 31.44 26.61 1b6f n GLU 96 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1b6f s LYS 97 N -5.81 2.73 -0.06 3.49 1.02 0.83 -4.67 119.74 117.28 1b6f s LYS 97 Ca 0.33 1.19 -0.02 0.00 0.02 0.00 0.00 55.97 57.48 1b6f s LYS 97 Cb -0.16 -1.95 0.04 0.00 -0.52 0.00 0.00 37.83 35.23 1b6f s LYS 97 CO 0.40 -1.28 0.11 0.42 -0.92 0.00 0.00 175.35 174.09 1b6f s ILE 98 N -2.70 -0.12 -0.26 2.17 1.01 -1.26 0.21 121.20 120.24 1b6f s ILE 98 Ca 0.62 0.28 0.02 0.00 0.00 0.00 0.00 60.65 61.58 1b6f s ILE 98 Cb -0.17 -0.21 0.07 0.00 0.01 0.00 0.00 42.46 42.15 1b6f s ILE 98 CO 0.48 0.12 -0.07 -0.44 0.00 0.00 0.00 174.94 175.03 1b6f s SER 99 N 1.66 4.33 -0.01 3.58 0.01 -0.41 -0.74 113.70 122.12 1b6f s SER 99 Ca -0.03 -1.44 -0.08 0.00 1.31 0.00 0.00 55.95 55.70 1b6f s SER 99 Cb -0.12 -1.45 -0.05 0.00 0.21 0.00 0.00 66.02 64.61 1b6f s SER 99 CO -0.05 -0.23 0.28 0.20 0.41 0.00 0.00 173.24 173.85 1b6f s ASN 100 N 1.16 6.54 0.22 2.44 -0.87 -0.64 -2.56 114.94 121.22 1b6f s ASN 100 Ca -0.05 0.63 0.04 0.00 -1.57 0.00 0.00 52.86 51.91 1b6f s ASN 100 Cb -0.20 -2.12 -0.05 0.00 -0.02 0.00 0.00 41.25 38.86 1b6f s ASN 100 CO -0.06 0.29 -0.04 -1.61 -2.57 0.00 0.00 177.10 173.11 1b6f s GLU 101 N -1.51 1.32 -0.24 -0.60 2.02 -0.16 -0.57 118.70 118.95 1b6f s GLU 101 Ca 0.25 -1.65 -0.03 0.00 0.02 0.00 0.00 54.97 53.56 1b6f s GLU 101 Cb -0.14 -0.72 0.13 0.00 0.10 0.00 0.00 34.13 33.51 1b6f s GLU 101 CO 0.13 -0.03 0.39 0.42 0.02 0.00 0.00 175.26 176.19 1b6f s ILE 102 N -3.32 -0.62 -0.10 -1.63 -1.09 0.01 -2.53 121.20 111.92 1b6f s ILE 102 Ca 0.26 -0.06 0.01 0.00 -2.23 0.00 0.00 60.65 58.63 1b6f s ILE 102 Cb 0.05 -0.82 -0.02 0.00 -1.58 0.00 0.00 42.46 40.09 1b6f s ILE 102 CO 0.08 -0.11 -0.13 -0.75 -1.23 0.00 0.00 174.94 172.80 1b6f s LYS 103 N 2.56 3.05 0.16 2.79 2.20 -0.87 -1.73 119.74 127.90 1b6f s LYS 103 Ca 0.13 -0.67 0.10 0.00 -0.36 0.00 0.00 55.97 55.17 1b6f s LYS 103 Cb -0.15 -2.55 -0.04 0.00 -1.51 0.00 0.00 37.83 33.57 1b6f s LYS 103 CO -0.16 0.39 -0.20 0.42 -0.36 0.00 0.00 175.35 175.44 1b6f s ILE 104 N -0.11 2.64 -0.21 5.43 1.01 -0.88 0.33 121.20 129.40 1b6f s ILE 104 Ca -0.01 -1.76 -0.07 0.00 0.00 0.00 0.00 60.65 58.81 1b6f s ILE 104 Cb -0.14 -2.24 0.10 0.00 0.01 0.00 0.00 42.46 40.19 1b6f s ILE 104 CO 0.03 -0.02 0.45 -0.69 0.00 0.00 0.00 174.94 174.72 1b6f s VAL 105 N -1.42 -0.70 0.50 2.92 1.01 -0.26 -4.66 120.40 117.80 1b6f s VAL 105 Ca 0.20 0.14 -0.19 0.00 0.00 0.00 0.00 61.98 62.12 1b6f s VAL 105 Cb -0.09 -0.72 -0.08 0.00 0.00 0.00 0.00 36.38 35.49 1b6f s VAL 105 CO 0.10 0.06 1.03 0.00 0.00 0.00 0.00 175.10 176.28 1b6f s ALA 106 N 2.65 2.89 0.48 5.51 0.00 -1.26 0.79 121.76 132.82 1b6f s ALA 106 Ca -0.02 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.46 1b6f s ALA 106 Cb -0.12 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1b6f s ALA 106 CO -0.14 -0.33 0.00 0.25 0.00 0.00 0.00 175.76 175.55 1b6f n THR 107 N -1.13 0.00 0.10 0.00 -2.24 0.63 -4.85 114.28 106.78 1b6f n THR 107 Ca 0.09 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.84 1b6f n THR 107 Cb 0.53 -1.48 -0.03 0.00 -2.10 0.00 0.00 70.33 67.25 1b6f n THR 107 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1b6f h PRO 108 N 0.00 0.00 0.00 -0.78 0.13 -1.98 -3.43 132.00 125.94 1b6f h PRO 108 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1b6f h PRO 108 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1b6f h PRO 108 CO 0.00 0.78 0.00 -3.47 -0.23 0.00 0.00 178.00 175.08 1b6f n ASP 109 N -3.35 0.00 -1.32 1.44 2.03 -1.26 -5.01 116.55 109.07 1b6f n ASP 109 Ca 0.01 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.36 1b6f n ASP 109 Cb 0.83 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 41.28 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 0.00 1.80 0.00 0.27 0.00 -1.26 -5.12 105.19 100.88 1b6f n GLY 110 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.08 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 0.18 -1.12 3.28 -0.02 0.00 -1.26 -4.56 105.19 101.68 1b6f n GLY 111 Ca 0.09 -1.94 -0.15 0.00 0.00 0.00 0.00 46.02 44.02 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 1.00 -0.10 1.61 1.04 0.86 -0.27 113.70 113.84 1b6f s SER 112 Ca 0.00 -1.34 0.01 0.00 0.48 0.00 0.00 55.95 55.10 1b6f s SER 112 Cb 0.00 0.19 0.02 0.00 0.10 0.00 0.00 66.02 66.33 1b6f s SER 112 CO 0.00 -0.72 -0.11 -0.63 0.98 0.00 0.00 173.24 172.76 1b6f s ILE 113 N -3.81 1.21 -0.10 -1.02 1.01 0.24 -1.71 121.20 117.01 1b6f s ILE 113 Ca 0.35 -0.45 -0.02 0.00 0.00 0.00 0.00 60.65 60.53 1b6f s ILE 113 Cb 0.07 -1.15 -0.03 0.00 0.01 0.00 0.00 42.46 41.36 1b6f s ILE 113 CO 0.11 0.39 -0.03 -1.48 0.00 0.00 0.00 174.94 173.93 1b6f s LEU 114 N 1.20 3.39 -0.28 2.97 0.05 -0.71 -1.10 118.68 124.20 1b6f s LEU 114 Ca -0.04 0.03 -0.05 0.00 0.05 0.00 0.00 54.13 54.12 1b6f s LEU 114 Cb -0.14 -1.78 0.01 0.00 -2.05 0.00 0.00 46.19 42.24 1b6f s LEU 114 CO -0.03 0.32 0.04 -0.54 -0.55 0.00 0.00 176.35 175.59 1b6f s LYS 115 N -0.54 3.01 -0.08 1.48 1.02 0.15 -0.83 119.74 123.95 1b6f s LYS 115 Ca 0.09 -0.90 -0.19 0.00 0.02 0.00 0.00 55.97 54.99 1b6f s LYS 115 Cb -0.12 -3.26 -0.05 0.00 -0.52 0.00 0.00 37.83 33.88 1b6f s LYS 115 CO 0.02 -0.44 0.51 0.42 -0.92 0.00 0.00 175.35 174.95 1b6f s ILE 116 N 1.45 5.10 -0.31 2.17 1.01 0.33 -2.05 121.20 128.89 1b6f s ILE 116 Ca 0.02 1.05 0.02 0.00 0.00 0.00 0.00 60.65 61.73 1b6f s ILE 116 Cb -0.17 -3.85 0.08 0.00 0.01 0.00 0.00 42.46 38.53 1b6f s ILE 116 CO 0.01 0.36 -0.00 -0.44 0.00 0.00 0.00 174.94 174.86 1b6f s SER 117 N 0.31 4.72 0.29 3.58 0.01 -1.05 0.15 113.70 121.71 1b6f s SER 117 Ca 0.28 -1.70 -0.04 0.00 1.31 0.00 0.00 55.95 55.80 1b6f s SER 117 Cb -0.16 -1.64 -0.05 0.00 0.21 0.00 0.00 66.02 64.39 1b6f s SER 117 CO 0.13 -0.30 0.54 0.21 0.41 0.00 0.00 173.24 174.22 1b6f s ASN 118 N 1.14 6.42 -0.18 2.44 3.04 -1.14 -0.98 114.94 125.67 1b6f s ASN 118 Ca 0.00 0.65 -0.12 0.00 0.04 0.00 0.00 52.86 53.43 1b6f s ASN 118 Cb -0.20 -2.12 0.06 0.00 -1.54 0.00 0.00 41.25 37.45 1b6f s ASN 118 CO -0.05 -0.20 0.45 -0.75 -3.04 0.00 0.00 177.10 173.51 1b6f s LYS 119 N -3.64 0.47 -0.27 0.43 2.47 -1.06 -1.96 119.74 116.18 1b6f s LYS 119 Ca 0.43 0.79 -0.01 0.00 -1.56 0.00 0.00 55.97 55.61 1b6f s LYS 119 Cb -0.11 0.08 0.09 0.00 -1.46 0.00 0.00 37.83 36.43 1b6f s LYS 119 CO 0.31 -0.13 0.07 -0.47 0.16 0.00 0.00 175.35 175.29 1b6f s TYR 120 N 1.08 1.49 0.25 4.03 6.14 0.46 -1.28 117.35 129.51 1b6f s TYR 120 Ca -0.07 -1.46 -0.25 0.00 0.64 0.00 0.00 57.07 55.93 1b6f s TYR 120 Cb -0.06 -1.48 -0.09 0.00 0.42 0.00 0.00 41.96 40.75 1b6f s TYR 120 CO -0.10 -0.80 0.86 -1.01 0.64 0.00 0.00 175.55 175.14 1b6f s HIS 121 N 1.70 3.80 0.02 4.97 3.76 0.56 -2.12 115.29 127.97 1b6f s HIS 121 Ca 0.06 1.69 0.00 0.00 -0.15 0.00 0.00 55.06 56.67 1b6f s HIS 121 Cb -0.17 -2.83 0.00 0.00 1.11 0.00 0.00 32.58 30.69 1b6f s HIS 121 CO -0.20 0.37 0.02 0.25 -0.85 0.00 0.00 174.74 174.32 1b6f n THR 122 N 1.05 0.00 -2.53 1.30 -2.24 -1.25 -0.12 114.28 110.49 1b6f n THR 122 Ca -0.02 -0.06 -0.34 0.00 -2.27 0.00 0.00 64.05 61.37 1b6f n THR 122 Cb 0.49 -0.67 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 1b6f n THR 122 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1b6f n LYS 123 N -0.72 3.76 -2.00 -0.78 4.81 -1.26 -3.89 118.16 118.08 1b6f n LYS 123 Ca 0.00 -4.43 -0.03 0.00 -0.87 0.00 0.00 58.31 52.98 1b6f n LYS 123 Cb 0.02 -2.31 -0.01 0.00 0.02 0.00 0.00 35.03 32.75 1b6f n LYS 123 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1b6f n GLY 124 N -0.32 -0.22 1.66 3.14 0.00 -1.26 -4.07 105.19 104.12 1b6f n GLY 124 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.44 1b6f n GLY 124 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1b6f n ASP 125 N -0.80 -2.16 -3.02 1.61 2.03 -1.26 -5.00 116.55 107.95 1b6f n ASP 125 Ca -0.03 0.53 -0.02 0.00 0.52 0.00 0.00 54.79 55.79 1b6f n ASP 125 Cb 0.38 2.21 0.02 0.00 -0.72 0.00 0.00 41.12 43.01 1b6f n ASP 125 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1b6f n HIS 126 N -2.97 -1.88 -3.78 -0.67 8.25 -1.26 -5.06 115.22 107.86 1b6f n HIS 126 Ca 0.00 -0.05 -0.09 0.00 -0.26 0.00 0.00 57.72 57.32 1b6f n HIS 126 Cb 0.00 -0.09 -0.00 0.00 1.12 0.00 0.00 29.99 31.01 1b6f n HIS 126 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1b6f n GLU 127 N -1.97 0.70 -3.77 -0.41 1.02 -1.26 -4.57 120.64 110.37 1b6f n GLU 127 Ca 0.01 -1.93 -0.36 0.00 -0.02 0.00 0.00 57.16 54.85 1b6f n GLU 127 Cb 0.04 2.10 -0.12 0.00 -0.02 0.00 0.00 31.44 33.44 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 -2.53 3.35 0.10 2.62 1.01 -1.26 -5.01 120.40 118.68 1b6f s VAL 128 Ca 0.17 -1.92 -0.31 0.00 0.00 0.00 0.00 61.98 59.92 1b6f s VAL 128 Cb -0.02 -3.23 -0.08 0.00 0.00 0.00 0.00 36.38 33.05 1b6f s VAL 128 CO 0.13 -0.61 1.42 -0.54 0.00 0.00 0.00 175.10 175.50 1b6f s LYS 129 N 1.18 4.30 0.18 2.72 -0.14 -1.26 -4.90 119.74 121.82 1b6f s LYS 129 Ca 0.06 2.10 -0.14 0.00 -1.36 0.00 0.00 55.97 56.63 1b6f s LYS 129 Cb -0.23 -3.30 0.17 0.00 -1.68 0.00 0.00 37.83 32.79 1b6f s LYS 129 CO -0.03 -0.49 1.67 0.00 -0.76 0.00 0.00 175.35 175.74 1b6f h ALA 130 N 7.03 0.41 -0.92 5.17 0.00 -1.98 -1.87 119.26 127.10 1b6f h ALA 130 Ca -0.42 0.16 0.22 0.00 0.00 0.00 0.00 54.91 54.87 1b6f h ALA 130 Cb 1.20 0.30 -0.17 0.00 0.00 0.00 0.00 17.79 19.12 1b6f h ALA 130 CO 0.88 -0.41 -0.11 0.39 0.00 0.00 0.00 179.25 180.00 1b6f n GLU 131 N -5.28 -0.08 0.04 0.00 -0.58 -1.26 0.27 120.64 113.76 1b6f n GLU 131 Ca 0.05 1.41 -0.04 0.00 -0.42 0.00 0.00 57.16 58.16 1b6f n GLU 131 Cb 0.27 -2.17 0.18 0.00 -0.57 0.00 0.00 31.44 29.15 1b6f n GLU 131 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 1b6f h GLN 132 N 0.00 0.40 -0.01 3.49 4.20 -1.73 0.03 115.11 121.48 1b6f h GLN 132 Ca 0.50 -0.19 -0.06 0.00 0.06 0.00 0.00 58.65 58.96 1b6f h GLN 132 Cb 0.90 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.68 1b6f h GLN 132 CO -0.91 0.72 -0.25 0.28 -0.67 0.00 0.00 178.83 178.01 1b6f h VAL 133 N 0.34 1.52 -0.11 -0.54 2.07 0.41 -2.39 116.25 117.55 1b6f h VAL 133 Ca 0.04 -1.88 -0.01 0.00 0.82 0.00 0.00 66.70 65.67 1b6f h VAL 133 Cb 0.81 2.67 -0.01 0.00 -1.52 0.00 0.00 31.29 33.25 1b6f h VAL 133 CO 0.07 0.52 0.02 0.50 0.02 0.00 0.00 177.57 178.69 1b6f h LYS 134 N -0.45 0.15 -0.02 1.57 3.64 0.35 0.19 116.57 122.00 1b6f h LYS 134 Ca -0.03 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1b6f h LYS 134 Cb 0.97 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.76 1b6f h LYS 134 CO 0.05 0.15 -0.02 0.00 -2.27 0.00 0.00 179.45 177.36 1b6f h ALA 135 N 1.87 0.03 -0.19 5.00 0.00 -0.95 -0.46 119.26 124.55 1b6f h ALA 135 Ca 0.04 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 1b6f h ALA 135 Cb 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1b6f h ALA 135 CO -0.00 -0.20 -0.19 1.03 0.00 0.00 0.00 179.25 179.88 1b6f h SER 136 N -0.43 0.32 0.17 0.00 0.87 -0.98 -2.63 113.55 110.88 1b6f h SER 136 Ca 0.00 -0.09 -0.16 0.00 -1.23 0.00 0.00 61.79 60.32 1b6f h SER 136 Cb 0.52 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.39 1b6f h SER 136 CO 0.01 0.53 -0.59 0.50 -0.53 0.00 0.00 176.83 176.75 1b6f h LYS 137 N 0.31 0.42 -0.22 2.24 3.64 -0.57 -2.76 116.57 119.64 1b6f h LYS 137 Ca 0.05 -0.28 0.06 0.00 -1.27 0.00 0.00 60.65 59.21 1b6f h LYS 137 Cb 0.52 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.30 1b6f h LYS 137 CO 0.03 0.89 -0.36 1.49 -2.27 0.00 0.00 179.45 179.24 1b6f h GLU 138 N 0.32 -0.37 -0.34 1.90 4.81 -0.68 -0.92 114.58 119.30 1b6f h GLU 138 Ca -0.00 0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.16 1b6f h GLU 138 Cb 1.12 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.57 1b6f h GLU 138 CO 0.10 -0.25 -0.20 -0.07 -0.73 0.00 0.00 179.01 177.87 1b6f h LEU 139 N -0.38 0.63 -1.00 1.64 -0.00 -1.61 -2.74 115.31 111.85 1b6f h LEU 139 Ca 0.11 -0.21 0.27 0.00 -0.00 0.00 0.00 57.88 58.06 1b6f h LEU 139 Cb 0.57 -0.17 -0.13 0.00 -0.00 0.00 0.00 40.66 40.92 1b6f h LEU 139 CO -0.43 0.83 0.58 1.23 -0.00 0.00 0.00 178.44 180.65 1b6f h GLY 140 N 0.99 1.95 0.33 0.83 0.00 -0.87 0.64 103.07 106.93 1b6f h GLY 140 Ca 0.09 -0.28 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 1b6f h GLY 140 CO 0.05 -0.34 -0.16 -2.09 0.00 0.00 0.00 176.54 174.00 1b6f h GLU 141 N 0.48 -0.42 -0.20 4.80 4.22 -1.12 -2.69 114.58 119.64 1b6f h GLU 141 Ca 0.67 0.03 0.06 0.00 0.08 0.00 0.00 59.36 60.20 1b6f h GLU 141 Cb 1.38 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.72 1b6f h GLU 141 CO -0.53 -0.28 0.48 1.15 -2.18 0.00 0.00 179.01 177.65 1b6f h THR 142 N -0.77 0.13 0.22 0.32 2.02 -1.33 -0.69 112.91 112.80 1b6f h THR 142 Ca -0.04 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.12 1b6f h THR 142 Cb 0.33 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 1b6f h THR 142 CO 0.07 0.00 -0.10 -0.07 0.37 0.00 0.00 175.52 175.79 1b6f h LEU 143 N 0.00 -0.25 -2.30 2.58 3.38 0.41 0.11 115.31 119.24 1b6f h LEU 143 Ca 0.10 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.83 1b6f h LEU 143 Cb 1.05 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1b6f h LEU 143 CO -0.00 0.21 0.15 0.17 0.09 0.00 0.00 178.44 179.06 1b6f h LEU 144 N -0.79 0.00 0.08 1.67 8.10 -0.80 0.32 115.31 123.89 1b6f h LEU 144 Ca -0.03 0.00 -0.27 0.00 0.11 0.00 0.00 57.88 57.69 1b6f h LEU 144 Cb 0.51 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.72 1b6f h LEU 144 CO 0.05 0.00 -1.32 -0.09 -4.11 0.00 0.00 178.44 172.97 1b6f h ARG 145 N 0.00 0.17 -0.83 0.17 9.65 -1.27 -2.69 114.38 119.59 1b6f h ARG 145 Ca 0.06 -0.30 0.04 0.00 -1.10 0.00 0.00 59.98 58.68 1b6f h ARG 145 Cb 0.35 0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.99 1b6f h ARG 145 CO -0.00 1.07 0.52 0.00 2.80 0.00 0.00 179.97 184.36 1b6f h ALA 146 N 0.69 1.10 0.05 2.80 0.00 0.14 0.13 119.26 124.16 1b6f h ALA 146 Ca -0.15 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1b6f h ALA 146 Cb 1.94 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.47 1b6f h ALA 146 CO 0.16 0.33 -0.02 0.28 0.00 0.00 0.00 179.25 179.99 1b6f h VAL 147 N 1.00 1.23 -0.94 0.00 2.07 -1.58 -2.78 116.25 115.26 1b6f h VAL 147 Ca 0.34 -1.63 0.20 0.00 0.82 0.00 0.00 66.70 66.43 1b6f h VAL 147 Cb 0.05 2.20 -0.08 0.00 -1.52 0.00 0.00 31.29 31.95 1b6f h VAL 147 CO -0.13 0.37 0.61 -0.08 0.02 0.00 0.00 177.57 178.36 1b6f h GLU 148 N -0.88 0.52 0.29 1.57 4.81 -1.35 -1.72 114.58 117.82 1b6f h GLU 148 Ca -0.01 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1b6f h GLU 148 Cb 0.66 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.92 1b6f h GLU 148 CO 0.01 0.34 -0.14 1.03 -0.73 0.00 0.00 179.01 179.52 1b6f h SER 149 N 0.53 -0.33 -0.00 1.04 0.87 -0.78 -2.60 113.55 112.27 1b6f h SER 149 Ca 0.51 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.88 1b6f h SER 149 Cb 1.09 0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 63.13 1b6f h SER 149 CO -0.24 0.05 -0.00 0.22 -0.53 0.00 0.00 176.83 176.33 1b6f h TYR 150 N -0.75 -0.01 -0.95 2.24 3.20 -1.03 0.60 116.97 120.26 1b6f h TYR 150 Ca -0.04 0.00 0.26 0.00 3.14 0.00 0.00 58.73 62.09 1b6f h TYR 150 Cb 0.50 0.00 -0.17 0.00 1.54 0.00 0.00 36.73 38.60 1b6f h TYR 150 CO 0.03 -0.00 0.05 -0.07 -1.64 0.00 0.00 178.16 176.53 1b6f h LEU 151 N -0.00 -0.40 -1.08 2.82 3.38 -1.55 1.21 115.31 119.68 1b6f h LEU 151 Ca 0.00 0.26 -0.08 0.00 0.09 0.00 0.00 57.88 58.15 1b6f h LEU 151 Cb 0.00 0.45 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1b6f h LEU 151 CO -0.00 -0.32 -0.39 -0.07 0.09 0.00 0.00 178.44 177.75 1b6f h LEU 152 N 0.04 0.00 -1.29 1.67 3.38 -0.92 -2.85 115.31 115.34 1b6f h LEU 152 Ca 0.58 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.47 1b6f h LEU 152 Cb 1.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1b6f h LEU 152 CO -0.86 0.39 -0.34 0.00 0.09 0.00 0.00 178.44 177.72 1b6f h ALA 153 N 1.61 1.41 -2.50 1.53 0.00 0.71 -3.43 119.26 118.59 1b6f h ALA 153 Ca -0.00 -0.31 -0.53 0.00 0.00 0.00 0.00 54.91 54.06 1b6f h ALA 153 Cb 0.82 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1b6f h ALA 153 CO 0.05 0.44 -0.10 -1.58 0.00 0.00 0.00 179.25 178.05 1b6f s HIS 154 N -4.28 3.42 -0.59 0.00 5.65 -0.90 -5.04 115.29 113.56 1b6f s HIS 154 Ca -0.03 0.88 -0.14 0.00 0.25 0.00 0.00 55.06 56.02 1b6f s HIS 154 Cb 0.15 -2.27 0.15 0.00 -1.18 0.00 0.00 32.58 29.43 1b6f s HIS 154 CO 0.73 0.25 0.53 0.45 -0.65 0.00 0.00 174.74 176.05 1b6f s SER 155 N -2.40 6.20 -0.14 9.88 0.15 -1.26 -4.85 113.70 121.28 1b6f s SER 155 Ca 0.48 -2.05 0.18 0.00 0.70 0.00 0.00 55.95 55.25 1b6f s SER 155 Cb -0.11 -2.16 0.44 0.00 -1.71 0.00 0.00 66.02 62.47 1b6f s SER 155 CO 0.21 -0.75 1.19 -0.67 1.20 0.00 0.00 173.24 174.42 1b6f n ASP 156 N 4.85 1.73 -1.32 5.45 -0.08 -1.26 -5.11 116.55 120.80 1b6f n ASP 156 Ca -0.06 -2.96 0.16 0.00 -1.51 0.00 0.00 54.79 50.42 1b6f n ASP 156 Cb 0.42 -0.42 -0.08 0.00 2.34 0.00 0.00 41.12 43.38 1b6f n ASP 156 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1b6f n ALA 157 N -0.39 -3.47 0.60 -1.67 0.00 -1.26 -4.42 120.51 109.90 1b6f n ALA 157 Ca 0.15 0.78 0.13 0.00 0.00 0.00 0.00 53.44 54.50 1b6f n ALA 157 Cb 0.91 -1.40 0.39 0.00 0.00 0.00 0.00 19.45 19.35 1b6f n ALA 157 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1b6f h TYR 158 N -1.29 0.00 0.00 0.00 0.05 -2.00 -3.52 116.97 110.21 1b6f h TYR 158 Ca -0.14 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.64 1b6f h TYR 158 Cb 1.26 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.00 1b6f h TYR 158 CO 0.03 0.00 0.00 -1.71 -1.05 0.00 0.00 178.16 175.43