#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bs5 s VAL 2 N 0.00 5.00 0.24 0.44 1.01 -1.26 -4.41 120.40 121.42 1bs5 s VAL 2 Ca 0.00 1.48 0.03 0.00 0.00 0.00 0.00 61.98 63.49 1bs5 s VAL 2 Cb 0.00 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 1bs5 s VAL 2 CO 0.00 0.18 0.40 -0.76 0.00 0.00 0.00 175.10 174.91 1bs5 s LEU 3 N 1.25 4.24 0.08 3.92 1.43 -1.26 -5.02 118.68 123.32 1bs5 s LEU 3 Ca 0.37 0.23 -0.29 0.00 -1.03 0.00 0.00 54.13 53.41 1bs5 s LEU 3 Cb -0.17 -3.02 -0.05 0.00 0.03 0.00 0.00 46.19 42.97 1bs5 s LEU 3 CO 0.16 -0.10 0.94 -1.58 0.23 0.00 0.00 176.35 176.01 1bs5 s GLN 4 N -3.82 4.65 -0.19 1.70 0.74 -1.26 -4.95 119.66 116.53 1bs5 s GLN 4 Ca 0.36 1.40 -0.13 0.00 0.05 0.00 0.00 55.36 57.04 1bs5 s GLN 4 Cb -0.10 -3.39 -0.05 0.00 1.10 0.00 0.00 33.01 30.58 1bs5 s GLN 4 CO 0.30 0.17 0.26 0.08 -0.55 0.00 0.00 175.29 175.56 1bs5 s VAL 5 N 0.18 5.31 0.55 1.34 1.01 -1.26 -4.47 120.40 123.06 1bs5 s VAL 5 Ca 0.47 0.46 -0.17 0.00 0.00 0.00 0.00 61.98 62.73 1bs5 s VAL 5 Cb -0.23 -3.60 -0.06 0.00 0.00 0.00 0.00 36.38 32.50 1bs5 s VAL 5 CO 0.29 0.37 1.04 -0.76 0.00 0.00 0.00 175.10 176.03 1bs5 s LEU 6 N 0.68 3.63 0.29 3.92 1.43 -0.30 -4.98 118.68 123.36 1bs5 s LEU 6 Ca 0.14 1.82 0.09 0.00 -1.03 0.00 0.00 54.13 55.15 1bs5 s LEU 6 Cb -0.13 -4.54 -0.06 0.00 0.03 0.00 0.00 46.19 41.50 1bs5 s LEU 6 CO 0.04 -0.95 -0.12 -1.00 0.23 0.00 0.00 176.35 174.54 1bs5 s HIS 7 N -2.32 2.15 0.47 0.29 3.76 -1.26 -4.19 115.29 114.20 1bs5 s HIS 7 Ca 0.64 -0.52 -0.23 0.00 -0.15 0.00 0.00 55.06 54.81 1bs5 s HIS 7 Cb -0.15 -1.12 -0.07 0.00 1.11 0.00 0.00 32.58 32.35 1bs5 s HIS 7 CO 0.30 0.51 1.17 0.96 -0.85 0.00 0.00 174.74 176.83 1bs5 s ILE 8 N -2.74 3.06 -0.37 0.60 -4.36 -0.70 -1.11 121.20 115.58 1bs5 s ILE 8 Ca 0.30 0.78 0.03 0.00 -0.26 0.00 0.00 60.65 61.49 1bs5 s ILE 8 Cb 0.00 -3.39 0.50 0.00 1.25 0.00 0.00 42.46 40.82 1bs5 s ILE 8 CO 0.13 -0.02 1.75 -0.81 0.24 0.00 0.00 174.94 176.24 1bs5 n PRO 9 N -0.57 2.01 -1.65 0.37 -0.04 -1.26 -4.75 135.00 129.11 1bs5 n PRO 9 Ca 0.08 -2.35 -0.51 0.00 -0.04 0.00 0.00 63.50 60.68 1bs5 n PRO 9 Cb 0.48 -1.92 -0.05 0.00 -0.04 0.00 0.00 33.50 31.96 1bs5 n PRO 9 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1bs5 n ASP 10 N -0.72 2.55 0.00 3.54 -0.08 -0.27 -4.84 116.55 116.73 1bs5 n ASP 10 Ca 0.47 1.07 0.12 0.00 -1.51 0.00 0.00 54.79 54.94 1bs5 n ASP 10 Cb 1.31 -1.29 0.53 0.00 2.34 0.00 0.00 41.12 44.02 1bs5 n ASP 10 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1bs5 n GLU 11 N 4.07 0.08 0.23 -0.67 1.02 -1.26 -2.01 120.64 122.09 1bs5 n GLU 11 Ca 0.20 0.08 0.13 0.00 -0.02 0.00 0.00 57.16 57.55 1bs5 n GLU 11 Cb 0.23 -1.50 0.29 0.00 -0.02 0.00 0.00 31.44 30.44 1bs5 n GLU 11 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bs5 h ARG 12 N 0.00 0.00 0.00 3.49 3.08 -1.96 -2.91 114.38 116.08 1bs5 h ARG 12 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1bs5 h ARG 12 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1bs5 h ARG 12 CO 0.00 0.03 0.00 1.28 -1.07 0.00 0.00 179.97 180.21 1bs5 n LEU 13 N -3.11 0.00 -0.33 3.04 4.32 -0.85 -2.20 117.00 117.88 1bs5 n LEU 13 Ca 0.03 0.28 0.06 0.00 -0.02 0.00 0.00 56.01 56.36 1bs5 n LEU 13 Cb 0.48 -0.28 0.13 0.00 -1.62 0.00 0.00 43.42 42.13 1bs5 n LEU 13 CO 0.33 -0.22 0.59 0.54 -1.22 0.00 0.00 177.39 177.41 1bs5 n ARG 14 N -1.28 2.42 -3.40 3.23 5.12 -1.10 -4.44 116.66 117.21 1bs5 n ARG 14 Ca 0.03 -2.23 -0.38 0.00 -1.93 0.00 0.00 57.85 53.34 1bs5 n ARG 14 Cb 0.05 -1.39 -0.06 0.00 -1.16 0.00 0.00 32.46 29.90 1bs5 n ARG 14 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1bs5 s LYS 15 N -1.98 4.06 -0.26 5.56 1.02 -0.93 -4.52 119.74 122.69 1bs5 s LYS 15 Ca 0.23 0.54 -0.24 0.00 0.02 0.00 0.00 55.97 56.53 1bs5 s LYS 15 Cb 0.18 -3.25 -0.00 0.00 -0.52 0.00 0.00 37.83 34.24 1bs5 s LYS 15 CO 0.06 0.62 0.81 0.08 -0.92 0.00 0.00 175.35 176.00 1bs5 s VAL 16 N -0.94 4.83 0.59 3.17 1.01 -1.26 -3.82 120.40 123.98 1bs5 s VAL 16 Ca 0.26 1.45 -0.18 0.00 0.00 0.00 0.00 61.98 63.51 1bs5 s VAL 16 Cb -0.18 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 1bs5 s VAL 16 CO 0.15 -0.11 1.16 0.00 0.00 0.00 0.00 175.10 176.30 1bs5 s ALA 17 N 2.86 2.57 0.20 5.51 0.00 -0.32 -4.98 121.76 127.59 1bs5 s ALA 17 Ca 0.34 0.84 -0.13 0.00 0.00 0.00 0.00 51.96 53.01 1bs5 s ALA 17 Cb -0.15 -3.39 -0.07 0.00 0.00 0.00 0.00 23.12 19.51 1bs5 s ALA 17 CO 0.09 -1.06 0.59 0.15 0.00 0.00 0.00 175.76 175.52 1bs5 s LYS 18 N -3.48 3.96 0.43 0.00 -0.14 -0.46 -4.79 119.74 115.25 1bs5 s LYS 18 Ca 0.73 0.48 -0.25 0.00 -1.36 0.00 0.00 55.97 55.58 1bs5 s LYS 18 Cb -0.26 -2.78 -0.08 0.00 -1.68 0.00 0.00 37.83 33.03 1bs5 s LYS 18 CO 0.33 0.38 1.30 -1.25 -0.76 0.00 0.00 175.35 175.35 1bs5 s PRO 19 N -2.34 3.84 0.08 -1.68 0.04 -1.26 -0.86 135.00 132.82 1bs5 s PRO 19 Ca 0.43 2.14 -0.31 0.00 0.04 0.00 0.00 61.00 63.30 1bs5 s PRO 19 Cb -0.13 -2.66 -0.08 0.00 0.04 0.00 0.00 34.50 31.66 1bs5 s PRO 19 CO 0.20 -0.59 1.56 0.08 0.04 0.00 0.00 177.00 178.28 1bs5 s VAL 20 N -1.29 3.12 0.04 -0.36 1.01 -1.26 -4.80 120.40 116.86 1bs5 s VAL 20 Ca 0.59 0.64 -0.17 0.00 0.00 0.00 0.00 61.98 63.04 1bs5 s VAL 20 Cb -0.38 -3.41 -0.21 0.00 0.00 0.00 0.00 36.38 32.38 1bs5 s VAL 20 CO 0.48 0.01 1.17 -0.08 0.00 0.00 0.00 175.10 176.68 1bs5 h GLU 21 N 7.79 0.54 -2.36 2.72 4.81 -2.01 -3.46 114.58 122.61 1bs5 h GLU 21 Ca -0.42 -0.53 -0.07 0.00 -0.13 0.00 0.00 59.36 58.21 1bs5 h GLU 21 Cb 1.20 0.14 -0.23 0.00 0.63 0.00 0.00 28.75 30.48 1bs5 h GLU 21 CO 0.91 1.16 -0.10 -2.00 -0.73 0.00 0.00 179.01 178.25 1bs5 s GLU 22 N -3.40 0.60 -0.93 1.92 2.12 -1.26 -5.10 118.70 112.65 1bs5 s GLU 22 Ca -0.12 0.88 -0.20 0.00 0.36 0.00 0.00 54.97 55.89 1bs5 s GLU 22 Cb 0.05 0.19 0.10 0.00 0.26 0.00 0.00 34.13 34.73 1bs5 s GLU 22 CO 0.85 -0.11 1.21 0.08 -0.54 0.00 0.00 175.26 176.75 1bs5 s VAL 23 N 0.88 4.44 0.00 3.70 1.01 -1.26 -4.82 120.40 124.35 1bs5 s VAL 23 Ca -0.05 -1.20 0.00 0.00 0.00 0.00 0.00 61.98 60.74 1bs5 s VAL 23 Cb -0.05 -4.85 0.00 0.00 0.00 0.00 0.00 36.38 31.47 1bs5 s VAL 23 CO -0.07 -1.63 0.00 -0.46 0.00 0.00 0.00 175.10 172.93 1bs5 n ASN 24 N 7.37 1.51 0.22 3.32 0.23 -1.26 -4.77 115.26 121.88 1bs5 n ASN 24 Ca 0.24 -0.40 0.11 0.00 -0.53 0.00 0.00 54.58 53.99 1bs5 n ASN 24 Cb 0.49 0.00 0.32 0.00 -2.08 0.00 0.00 39.78 38.52 1bs5 n ASN 24 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1bs5 h ALA 25 N 0.66 0.95 -0.42 -2.53 0.00 -1.98 -0.55 119.26 115.39 1bs5 h ALA 25 Ca 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1bs5 h ALA 25 Cb 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1bs5 h ALA 25 CO 0.00 0.17 0.09 1.49 0.00 0.00 0.00 179.25 181.00 1bs5 h GLU 26 N 0.00 0.67 -0.60 0.00 4.81 -1.96 -2.65 114.58 114.85 1bs5 h GLU 26 Ca -0.00 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 58.98 1bs5 h GLU 26 Cb 0.90 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 1bs5 h GLU 26 CO 0.02 0.70 0.07 0.82 -0.73 0.00 0.00 179.01 179.89 1bs5 h ILE 27 N 0.54 1.26 0.00 2.32 1.08 -1.56 -2.48 117.51 118.66 1bs5 h ILE 27 Ca 0.13 -1.02 0.00 0.00 -0.39 0.00 0.00 64.86 63.58 1bs5 h ILE 27 Cb 0.33 0.71 0.00 0.00 -3.07 0.00 0.00 36.82 34.79 1bs5 h ILE 27 CO 0.00 0.38 0.00 1.56 -0.69 0.00 0.00 178.15 179.40 1bs5 h GLN 28 N 0.93 0.00 0.00 2.37 4.20 -1.10 -1.90 115.11 119.61 1bs5 h GLN 28 Ca 0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.89 1bs5 h GLN 28 Cb 0.44 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.22 1bs5 h GLN 28 CO 0.01 0.00 -0.84 2.89 -0.67 0.00 0.00 178.83 180.22 1bs5 n ARG 29 N -3.09 0.16 -0.05 1.46 1.85 -1.00 -2.48 116.66 113.51 1bs5 n ARG 29 Ca 0.03 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.77 1bs5 n ARG 29 Cb 0.44 -1.56 -0.05 0.00 -1.05 0.00 0.00 32.46 30.24 1bs5 n ARG 29 CO 0.00 0.00 0.00 0.82 -0.01 0.00 0.00 177.63 178.44 1bs5 h ILE 30 N 0.00 1.19 -0.44 8.89 2.04 -0.93 -2.64 117.51 125.61 1bs5 h ILE 30 Ca 0.00 -0.58 0.04 0.00 1.00 0.00 0.00 64.86 65.32 1bs5 h ILE 30 Cb 0.63 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 37.90 1bs5 h ILE 30 CO 0.00 0.18 0.22 0.58 0.00 0.00 0.00 178.15 179.13 1bs5 h VAL 31 N 0.12 0.96 -0.68 1.67 2.07 -1.38 -0.63 116.25 118.37 1bs5 h VAL 31 Ca 0.06 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 1bs5 h VAL 31 Cb 0.23 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 1bs5 h VAL 31 CO -0.00 0.08 0.34 0.44 0.02 0.00 0.00 177.57 178.45 1bs5 h ASP 32 N 0.43 0.88 0.26 0.57 3.32 -1.51 -0.10 116.42 120.27 1bs5 h ASP 32 Ca 0.19 -0.12 -0.12 0.00 0.02 0.00 0.00 57.03 57.01 1bs5 h ASP 32 Cb 0.11 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1bs5 h ASP 32 CO -0.14 0.75 -0.46 0.44 -1.72 0.00 0.00 179.24 178.11 1bs5 h ASP 33 N 0.94 0.26 -0.48 6.45 3.32 -1.07 -1.32 116.42 124.52 1bs5 h ASP 33 Ca 0.24 -0.12 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 1bs5 h ASP 33 Cb 0.09 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 1bs5 h ASP 33 CO -0.03 0.68 0.10 0.24 -1.72 0.00 0.00 179.24 178.51 1bs5 h MET 34 N 0.20 0.77 -0.28 3.56 2.86 -0.21 0.31 114.93 122.13 1bs5 h MET 34 Ca 0.01 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.42 1bs5 h MET 34 Cb 0.89 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.44 1bs5 h MET 34 CO 0.07 0.77 0.03 0.74 1.06 0.00 0.00 176.91 179.58 1bs5 h PHE 35 N 0.65 0.51 -0.89 -0.22 0.04 -0.94 0.11 116.94 116.20 1bs5 h PHE 35 Ca 0.15 -0.08 -0.01 0.00 2.80 0.00 0.00 57.97 60.83 1bs5 h PHE 35 Cb 0.35 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 38.32 1bs5 h PHE 35 CO 0.02 0.59 0.51 1.49 -0.60 0.00 0.00 178.31 180.32 1bs5 h GLU 36 N 0.29 1.22 -0.09 1.51 4.81 -1.05 0.82 114.58 122.08 1bs5 h GLU 36 Ca 0.08 -0.13 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1bs5 h GLU 36 Cb 0.36 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 29.50 1bs5 h GLU 36 CO 0.01 0.87 -0.08 1.15 -0.73 0.00 0.00 179.01 180.23 1bs5 h THR 37 N 1.23 1.36 -0.03 0.32 2.02 -0.23 -1.72 112.91 115.87 1bs5 h THR 37 Ca 0.32 -1.24 0.01 0.00 0.77 0.00 0.00 66.41 66.27 1bs5 h THR 37 Cb -0.01 1.99 -0.03 0.00 -1.74 0.00 0.00 68.15 68.36 1bs5 h THR 37 CO -0.05 0.35 -0.29 -0.03 0.37 0.00 0.00 175.52 175.87 1bs5 h MET 38 N -0.21 -0.33 -0.62 6.66 1.85 -0.53 -1.16 114.93 120.59 1bs5 h MET 38 Ca 0.01 0.02 0.08 0.00 -0.61 0.00 0.00 59.70 59.21 1bs5 h MET 38 Cb 0.60 0.07 -0.04 0.00 0.43 0.00 0.00 31.60 32.66 1bs5 h MET 38 CO 0.02 -0.22 0.41 1.88 -0.40 0.00 0.00 176.91 178.61 1bs5 h TYR 39 N -0.34 0.53 -0.37 1.39 0.05 -0.92 0.84 116.97 118.15 1bs5 h TYR 39 Ca 0.01 0.01 -0.08 0.00 0.05 0.00 0.00 58.73 58.72 1bs5 h TYR 39 Cb 0.37 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 37.92 1bs5 h TYR 39 CO -0.47 0.26 -0.13 0.00 -1.05 0.00 0.00 178.16 176.77 1bs5 h ALA 40 N 1.68 1.10 -0.01 3.88 0.00 -1.04 -2.15 119.26 122.72 1bs5 h ALA 40 Ca 0.28 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1bs5 h ALA 40 Cb 0.43 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1bs5 h ALA 40 CO -0.08 0.56 -0.40 0.39 0.00 0.00 0.00 179.25 179.72 1bs5 n GLU 41 N -4.17 0.67 -2.97 0.00 -0.58 -0.46 -4.98 120.64 108.15 1bs5 n GLU 41 Ca 0.01 -0.44 -0.12 0.00 -0.42 0.00 0.00 57.16 56.18 1bs5 n GLU 41 Cb 0.35 -1.49 0.06 0.00 -0.57 0.00 0.00 31.44 29.79 1bs5 n GLU 41 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1bs5 n GLU 42 N -0.78 -2.79 -3.60 3.49 1.02 0.21 -5.06 120.64 113.13 1bs5 n GLU 42 Ca 0.10 0.69 -0.21 0.00 -0.02 0.00 0.00 57.16 57.71 1bs5 n GLU 42 Cb 0.36 -5.03 -0.03 0.00 -0.02 0.00 0.00 31.44 26.73 1bs5 n GLU 42 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1bs5 s GLY 43 N -3.53 2.16 -0.00 0.62 0.00 -0.81 -5.03 107.32 100.73 1bs5 s GLY 43 Ca 0.26 -1.86 0.13 0.00 0.00 0.00 0.00 44.72 43.25 1bs5 s GLY 43 CO 0.59 -1.73 0.50 0.29 0.00 0.00 0.00 173.10 172.75 1bs5 n ILE 44 N -1.57 0.00 -3.78 0.90 -5.35 -1.26 -4.65 119.36 103.65 1bs5 n ILE 44 Ca 0.03 -0.21 -0.12 0.00 -0.27 0.00 0.00 62.75 62.18 1bs5 n ILE 44 Cb 0.62 0.90 -0.08 0.00 -1.74 0.00 0.00 39.64 39.34 1bs5 n ILE 44 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1bs5 s GLY 45 N -2.36 -0.09 -0.14 3.28 0.00 -1.26 -0.97 107.32 105.77 1bs5 s GLY 45 Ca 0.04 0.05 -0.09 0.00 0.00 0.00 0.00 44.72 44.71 1bs5 s GLY 45 CO 0.52 -0.16 0.36 -2.27 0.00 0.00 0.00 173.10 171.55 1bs5 s LEU 46 N -1.80 0.22 0.01 0.66 2.96 0.22 -4.88 118.68 116.08 1bs5 s LEU 46 Ca -0.08 0.76 -0.02 0.00 -0.22 0.00 0.00 54.13 54.57 1bs5 s LEU 46 Cb -0.03 1.17 -0.04 0.00 0.50 0.00 0.00 46.19 47.79 1bs5 s LEU 46 CO -0.01 -0.17 0.18 0.00 -1.32 0.00 0.00 176.35 175.04 1bs5 s ALA 47 N 1.05 3.94 0.33 5.97 0.00 -1.26 -1.14 121.76 130.65 1bs5 s ALA 47 Ca -0.07 -0.79 0.05 0.00 0.00 0.00 0.00 51.96 51.14 1bs5 s ALA 47 Cb -0.07 -1.84 0.68 0.00 0.00 0.00 0.00 23.12 21.88 1bs5 s ALA 47 CO -0.08 0.76 1.90 0.00 0.00 0.00 0.00 175.76 178.34 1bs5 h ALA 48 N 3.64 1.67 0.00 0.00 0.00 -1.34 -0.91 119.26 122.32 1bs5 h ALA 48 Ca -0.48 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1bs5 h ALA 48 Cb 1.18 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1bs5 h ALA 48 CO 0.70 0.15 -0.03 1.79 0.00 0.00 0.00 179.25 181.87 1bs5 h THR 49 N 0.85 0.24 0.00 0.00 1.35 -1.66 0.82 112.91 114.51 1bs5 h THR 49 Ca 0.41 -0.21 -0.07 0.00 -0.55 0.00 0.00 66.41 65.98 1bs5 h THR 49 Cb 0.43 1.16 -0.01 0.00 -1.73 0.00 0.00 68.15 68.00 1bs5 h THR 49 CO -0.17 0.03 -0.36 1.56 -0.25 0.00 0.00 175.52 176.33 1bs5 h GLN 50 N 0.00 0.00 -0.70 4.72 4.20 -1.45 -2.26 115.11 119.62 1bs5 h GLN 50 Ca -0.00 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.46 1bs5 h GLN 50 Cb 0.16 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 27.79 1bs5 h GLN 50 CO 0.00 0.36 0.27 1.33 -0.67 0.00 0.00 178.83 180.12 1bs5 n VAL 51 N -3.61 2.88 -2.41 -0.54 0.24 0.22 -1.14 118.33 113.97 1bs5 n VAL 51 Ca -0.01 -1.86 -0.19 0.00 -2.04 0.00 0.00 64.34 60.25 1bs5 n VAL 51 Cb 0.47 -0.36 -0.00 0.00 -1.47 0.00 0.00 33.84 32.47 1bs5 n VAL 51 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1bs5 n ASP 52 N -0.50 -5.44 -4.05 -1.34 2.03 -0.85 -4.89 116.55 101.51 1bs5 n ASP 52 Ca 0.42 -0.04 -0.32 0.00 0.52 0.00 0.00 54.79 55.37 1bs5 n ASP 52 Cb 1.36 -4.48 -0.15 0.00 -0.72 0.00 0.00 41.12 37.13 1bs5 n ASP 52 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1bs5 s ILE 53 N -2.95 2.33 -1.25 5.18 1.01 -0.81 -5.00 121.20 119.70 1bs5 s ILE 53 Ca 0.03 -2.08 -0.05 0.00 0.00 0.00 0.00 60.65 58.54 1bs5 s ILE 53 Cb -0.01 -2.60 0.18 0.00 0.01 0.00 0.00 42.46 40.04 1bs5 s ILE 53 CO 0.03 -0.41 2.15 1.41 0.00 0.00 0.00 174.94 178.12 1bs5 n HIS 54 N 4.34 2.65 -4.45 3.97 8.25 -1.26 -2.08 115.22 126.64 1bs5 n HIS 54 Ca -0.02 -2.75 -0.22 0.00 -0.26 0.00 0.00 57.72 54.47 1bs5 n HIS 54 Cb 0.42 -1.70 -0.11 0.00 1.12 0.00 0.00 29.99 29.72 1bs5 n HIS 54 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1bs5 s GLN 55 N -1.60 1.64 -1.27 -0.41 -0.21 -1.26 -1.35 119.66 115.20 1bs5 s GLN 55 Ca 0.48 -1.89 -0.15 0.00 0.02 0.00 0.00 55.36 53.81 1bs5 s GLN 55 Cb 0.16 -0.95 0.12 0.00 1.00 0.00 0.00 33.01 33.34 1bs5 s GLN 55 CO -0.07 -0.14 1.65 0.54 -2.12 0.00 0.00 175.29 175.16 1bs5 n ARG 56 N -0.67 3.29 -4.29 2.91 1.74 -0.04 -4.52 116.66 115.07 1bs5 n ARG 56 Ca -0.03 -3.51 -0.21 0.00 -0.77 0.00 0.00 57.85 53.33 1bs5 n ARG 56 Cb 0.66 -3.23 -0.16 0.00 -1.02 0.00 0.00 32.46 28.71 1bs5 n ARG 56 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1bs5 s ILE 57 N 2.61 0.69 -0.03 0.55 1.01 -1.26 -0.41 121.20 124.36 1bs5 s ILE 57 Ca 0.47 -0.24 0.02 0.00 0.00 0.00 0.00 60.65 60.91 1bs5 s ILE 57 Cb 0.02 -0.67 0.01 0.00 0.01 0.00 0.00 42.46 41.83 1bs5 s ILE 57 CO 0.03 0.25 -0.09 -0.63 0.00 0.00 0.00 174.94 174.50 1bs5 s ILE 58 N 0.70 0.81 -0.03 2.92 1.01 -0.06 -1.11 121.20 125.43 1bs5 s ILE 58 Ca -0.11 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.23 1bs5 s ILE 58 Cb -0.13 -0.73 -0.03 0.00 0.01 0.00 0.00 42.46 41.57 1bs5 s ILE 58 CO 0.01 0.26 -0.12 0.68 0.00 0.00 0.00 174.94 175.77 1bs5 s VAL 59 N 0.36 3.25 -0.01 2.92 -7.23 -0.29 -1.44 120.40 117.96 1bs5 s VAL 59 Ca -0.06 -0.75 0.01 0.00 -1.81 0.00 0.00 61.98 59.37 1bs5 s VAL 59 Cb -0.11 -2.32 0.01 0.00 0.56 0.00 0.00 36.38 34.52 1bs5 s VAL 59 CO 0.01 0.53 -0.02 -0.63 -0.31 0.00 0.00 175.10 174.67 1bs5 s ILE 60 N -0.82 0.25 -0.20 -0.62 1.01 -0.31 -0.61 121.20 119.90 1bs5 s ILE 60 Ca 0.13 -0.08 -0.04 0.00 0.00 0.00 0.00 60.65 60.66 1bs5 s ILE 60 Cb -0.11 -0.26 0.10 0.00 0.01 0.00 0.00 42.46 42.20 1bs5 s ILE 60 CO 0.03 0.10 0.27 -0.62 0.00 0.00 0.00 174.94 174.72 1bs5 s ASP 61 N 0.28 0.89 0.00 3.58 2.15 -0.14 -0.28 116.67 123.15 1bs5 s ASP 61 Ca -0.03 0.05 0.26 0.00 0.43 0.00 0.00 52.55 53.26 1bs5 s ASP 61 Cb -0.06 0.63 0.61 0.00 -0.30 0.00 0.00 42.92 43.81 1bs5 s ASP 61 CO -0.01 -0.30 1.48 1.33 -0.17 0.00 0.00 175.17 177.50 1bs5 n VAL 62 N 5.34 0.00 -1.86 1.11 0.24 -1.26 -4.65 118.33 117.25 1bs5 n VAL 62 Ca -0.05 -0.04 -0.35 0.00 -2.04 0.00 0.00 64.34 61.86 1bs5 n VAL 62 Cb 0.50 0.27 0.04 0.00 -1.47 0.00 0.00 33.84 33.18 1bs5 n VAL 62 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1bs5 s SER 63 N -2.84 5.04 0.09 -1.34 1.04 -1.26 -4.97 113.70 109.46 1bs5 s SER 63 Ca 0.15 2.24 -0.16 0.00 0.48 0.00 0.00 55.95 58.66 1bs5 s SER 63 Cb 0.18 -2.58 -0.11 0.00 0.10 0.00 0.00 66.02 63.61 1bs5 s SER 63 CO 0.64 -1.68 1.38 -0.08 0.98 0.00 0.00 173.24 174.48 1bs5 h GLU 64 N 0.45 0.65 0.00 4.02 4.22 -2.00 -3.39 114.58 118.53 1bs5 h GLU 64 Ca -0.49 -0.37 0.00 0.00 0.08 0.00 0.00 59.36 58.58 1bs5 h GLU 64 Cb 1.28 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1bs5 h GLU 64 CO 0.54 0.99 -0.03 0.09 -2.18 0.00 0.00 179.01 178.41 1bs5 n ASN 65 N -4.27 1.83 -3.07 1.04 5.03 -1.26 -5.00 115.26 109.56 1bs5 n ASN 65 Ca -0.05 -2.34 -0.19 0.00 0.87 0.00 0.00 54.58 52.88 1bs5 n ASN 65 Cb 0.49 -0.18 0.07 0.00 -1.02 0.00 0.00 39.78 39.14 1bs5 n ASN 65 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1bs5 n ARG 66 N -0.79 -6.44 0.00 3.52 3.00 -1.26 -4.92 116.66 109.78 1bs5 n ARG 66 Ca 0.06 0.69 0.11 0.00 -0.01 0.00 0.00 57.85 58.70 1bs5 n ARG 66 Cb 0.45 -5.32 0.01 0.00 0.00 0.00 0.00 32.46 27.60 1bs5 n ARG 66 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1bs5 n ASP 67 N -2.36 0.74 -3.08 0.55 8.00 -1.26 -4.61 116.55 114.52 1bs5 n ASP 67 Ca -0.04 -0.59 -0.17 0.00 0.71 0.00 0.00 54.79 54.70 1bs5 n ASP 67 Cb 0.57 0.80 -0.01 0.00 -0.02 0.00 0.00 41.12 42.45 1bs5 n ASP 67 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1bs5 n GLU 68 N -1.63 0.92 -1.51 -1.24 1.02 -1.26 -5.11 120.64 111.84 1bs5 n GLU 68 Ca 0.04 -3.00 -0.56 0.00 -0.02 0.00 0.00 57.16 53.62 1bs5 n GLU 68 Cb 0.36 -1.49 -0.07 0.00 -0.02 0.00 0.00 31.44 30.23 1bs5 n GLU 68 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1bs5 n ARG 69 N 0.56 0.28 -4.74 3.49 1.74 -1.26 -4.60 116.66 112.14 1bs5 n ARG 69 Ca 0.20 0.10 -0.32 0.00 -0.77 0.00 0.00 57.85 57.06 1bs5 n ARG 69 Cb 0.64 -1.55 -0.17 0.00 -1.02 0.00 0.00 32.46 30.36 1bs5 n ARG 69 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1bs5 s LEU 70 N 0.54 2.04 -0.18 0.55 2.96 0.62 -5.01 118.68 120.19 1bs5 s LEU 70 Ca 0.85 -0.56 -0.02 0.00 -0.22 0.00 0.00 54.13 54.18 1bs5 s LEU 70 Cb -1.14 -1.37 -0.00 0.00 0.50 0.00 0.00 46.19 44.17 1bs5 s LEU 70 CO 0.55 0.08 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.87 1bs5 s VAL 71 N 0.75 3.00 -0.28 1.68 1.01 -1.26 -1.16 120.40 124.14 1bs5 s VAL 71 Ca -0.09 -0.64 -0.02 0.00 0.00 0.00 0.00 61.98 61.23 1bs5 s VAL 71 Cb -0.16 -2.31 0.04 0.00 0.00 0.00 0.00 36.38 33.95 1bs5 s VAL 71 CO 0.00 0.48 -0.02 -0.76 0.00 0.00 0.00 175.10 174.80 1bs5 s LEU 72 N 1.06 3.61 -0.13 3.92 1.43 -0.52 -4.42 118.68 123.63 1bs5 s LEU 72 Ca -0.00 -1.10 -0.01 0.00 -1.03 0.00 0.00 54.13 51.98 1bs5 s LEU 72 Cb -0.15 -1.69 -0.02 0.00 0.03 0.00 0.00 46.19 44.36 1bs5 s LEU 72 CO -0.02 -0.21 -0.09 -0.63 0.23 0.00 0.00 176.35 175.63 1bs5 s ILE 73 N 1.28 3.42 -1.24 -0.59 1.01 0.08 -0.88 121.20 124.30 1bs5 s ILE 73 Ca -0.03 -0.54 -0.09 0.00 0.00 0.00 0.00 60.65 60.00 1bs5 s ILE 73 Cb -0.18 -2.45 -0.01 0.00 0.01 0.00 0.00 42.46 39.82 1bs5 s ILE 73 CO -0.02 0.53 0.70 0.59 0.00 0.00 0.00 174.94 176.73 1bs5 n ASN 74 N 3.31 -3.10 -4.74 3.58 3.02 0.46 -0.41 115.26 117.38 1bs5 n ASN 74 Ca -0.18 -0.92 -0.42 0.00 -0.03 0.00 0.00 54.58 53.04 1bs5 n ASN 74 Cb 0.53 -3.72 -0.03 0.00 -0.61 0.00 0.00 39.78 35.95 1bs5 n ASN 74 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1bs5 s PRO 75 N -5.94 4.28 -0.02 3.52 0.04 -1.26 -4.57 135.00 131.05 1bs5 s PRO 75 Ca 0.23 2.25 0.06 0.00 0.04 0.00 0.00 61.00 63.58 1bs5 s PRO 75 Cb -0.07 -3.14 -0.02 0.00 0.04 0.00 0.00 34.50 31.31 1bs5 s PRO 75 CO 0.84 -0.43 -0.21 -1.83 0.04 0.00 0.00 177.00 175.41 1bs5 s GLU 76 N 0.10 1.70 -0.30 4.56 -1.05 0.16 -4.99 118.70 118.87 1bs5 s GLU 76 Ca 0.61 -0.75 -0.20 0.00 -0.15 0.00 0.00 54.97 54.48 1bs5 s GLU 76 Cb -0.41 -1.65 -0.01 0.00 -0.44 0.00 0.00 34.13 31.63 1bs5 s GLU 76 CO 0.39 0.45 0.63 -1.17 0.95 0.00 0.00 175.26 176.51 1bs5 s LEU 77 N -0.50 4.14 -0.17 1.83 2.96 -1.26 -1.03 118.68 124.65 1bs5 s LEU 77 Ca 0.08 0.44 -0.17 0.00 -0.22 0.00 0.00 54.13 54.26 1bs5 s LEU 77 Cb -0.08 -2.81 -0.22 0.00 0.50 0.00 0.00 46.19 43.57 1bs5 s LEU 77 CO -0.01 -0.47 0.31 -0.07 -1.32 0.00 0.00 176.35 174.79 1bs5 h LEU 78 N 9.14 0.17 -7.70 -0.68 3.38 -1.12 -3.49 115.31 115.02 1bs5 h LEU 78 Ca -0.27 -0.69 -0.12 0.00 0.09 0.00 0.00 57.88 56.89 1bs5 h LEU 78 Cb 1.12 -0.06 -0.19 0.00 0.09 0.00 0.00 40.66 41.62 1bs5 h LEU 78 CO 0.80 1.61 -0.40 -1.61 0.09 0.00 0.00 178.44 178.93 1bs5 s GLU 79 N -2.43 0.61 0.05 1.13 2.02 -1.12 -4.98 118.70 113.98 1bs5 s GLU 79 Ca -0.26 -0.46 -0.01 0.00 0.02 0.00 0.00 54.97 54.26 1bs5 s GLU 79 Cb 0.06 0.26 -0.04 0.00 0.10 0.00 0.00 34.13 34.51 1bs5 s GLU 79 CO 0.67 -0.17 -0.02 -1.59 0.02 0.00 0.00 175.26 174.17 1bs5 s LYS 80 N -1.90 0.58 0.07 1.61 -2.85 -1.26 -0.25 119.74 115.74 1bs5 s LYS 80 Ca -0.10 -1.13 -0.26 0.00 -1.00 0.00 0.00 55.97 53.48 1bs5 s LYS 80 Cb -0.04 0.20 0.07 0.00 -2.06 0.00 0.00 37.83 36.01 1bs5 s LYS 80 CO -0.00 -0.11 0.66 -1.54 0.10 0.00 0.00 175.35 174.46 1bs5 s SER 81 N -2.73 -0.58 0.00 0.03 1.04 0.24 -4.98 113.70 106.73 1bs5 s SER 81 Ca 0.04 0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.72 1bs5 s SER 81 Cb 0.06 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1bs5 s SER 81 CO -0.09 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 173.94 1bs5 n GLY 82 N 0.10 -2.37 3.44 7.32 0.00 -1.26 -0.72 105.19 111.70 1bs5 n GLY 82 Ca -0.17 -1.60 -0.12 0.00 0.00 0.00 0.00 46.02 44.13 1bs5 n GLY 82 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1bs5 s GLU 83 N -0.54 0.60 0.00 1.61 1.03 -1.26 -3.34 118.70 116.80 1bs5 s GLU 83 Ca 0.00 0.83 0.00 0.00 0.03 0.00 0.00 54.97 55.83 1bs5 s GLU 83 Cb 0.00 0.23 0.00 0.00 -0.80 0.00 0.00 34.13 33.56 1bs5 s GLU 83 CO 0.00 -0.10 0.00 0.25 -1.33 0.00 0.00 175.26 174.08 1bs5 n THR 84 N 3.26 0.00 0.00 1.83 -2.24 0.33 -4.62 114.28 112.84 1bs5 n THR 84 Ca -0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1bs5 n THR 84 Cb 0.56 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 1bs5 n THR 84 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bs5 n GLY 85 N 0.00 1.23 3.52 3.38 0.00 -1.26 -0.88 105.19 111.19 1bs5 n GLY 85 Ca 0.00 0.21 -0.25 0.00 0.00 0.00 0.00 46.02 45.97 1bs5 n GLY 85 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1bs5 s ILE 86 N -0.51 0.76 -0.56 -0.61 -4.36 -1.26 -4.94 121.20 109.71 1bs5 s ILE 86 Ca 0.00 -2.00 -0.21 0.00 -0.26 0.00 0.00 60.65 58.18 1bs5 s ILE 86 Cb 0.00 -2.42 0.07 0.00 1.25 0.00 0.00 42.46 41.36 1bs5 s ILE 86 CO 0.00 0.00 0.77 -0.70 0.24 0.00 0.00 174.94 175.25 1bs5 s GLU 87 N -3.76 3.15 0.40 0.37 2.12 -1.26 -3.41 118.70 116.31 1bs5 s GLU 87 Ca 0.25 -0.84 -0.11 0.00 0.36 0.00 0.00 54.97 54.63 1bs5 s GLU 87 Cb 0.04 -4.15 -0.06 0.00 0.26 0.00 0.00 34.13 30.21 1bs5 s GLU 87 CO 0.14 -1.45 0.77 -1.21 -0.54 0.00 0.00 175.26 172.96 1bs5 s GLU 88 N 3.18 3.79 0.11 4.30 2.02 0.82 -4.77 118.70 128.15 1bs5 s GLU 88 Ca 0.19 0.48 0.01 0.00 0.02 0.00 0.00 54.97 55.66 1bs5 s GLU 88 Cb -0.18 -2.39 -0.00 0.00 0.10 0.00 0.00 34.13 31.65 1bs5 s GLU 88 CO 0.12 -0.03 0.03 0.41 0.02 0.00 0.00 175.26 175.81 1bs5 n GLY 89 N -1.27 3.91 3.64 -1.39 0.00 -1.26 -2.20 105.19 106.62 1bs5 n GLY 89 Ca 0.02 -2.02 -0.03 0.00 0.00 0.00 0.00 46.02 43.99 1bs5 n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bs5 h LEU 91 N 6.25 0.00 0.00 0.00 3.38 -1.95 -1.17 115.31 121.82 1bs5 h LEU 91 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1bs5 h LEU 91 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1bs5 h LEU 91 CO 0.19 0.00 -0.55 -1.20 0.09 0.00 0.00 178.44 176.97 1bs5 n SER 92 N -3.24 0.54 -3.63 -0.43 7.64 -1.26 -4.29 113.62 108.96 1bs5 n SER 92 Ca -0.03 -0.28 -0.27 0.00 1.01 0.00 0.00 58.87 59.30 1bs5 n SER 92 Cb 0.08 0.30 -0.10 0.00 -1.01 0.00 0.00 64.21 63.48 1bs5 n SER 92 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1bs5 n ILE 93 N -1.53 1.47 -1.68 0.44 5.41 -0.44 -1.71 119.36 121.31 1bs5 n ILE 93 Ca 0.05 -4.80 -0.42 0.00 1.00 0.00 0.00 62.75 58.58 1bs5 n ILE 93 Cb 0.34 -2.09 -0.03 0.00 -0.71 0.00 0.00 39.64 37.15 1bs5 n ILE 93 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1bs5 s PRO 94 N -1.68 4.13 0.00 0.38 0.04 -1.25 -2.86 135.00 133.77 1bs5 s PRO 94 Ca 0.32 2.63 0.00 0.00 0.04 0.00 0.00 61.00 63.98 1bs5 s PRO 94 Cb 0.05 -3.82 0.00 0.00 0.04 0.00 0.00 34.50 30.77 1bs5 s PRO 94 CO -0.11 -0.90 0.00 0.39 0.04 0.00 0.00 177.00 176.42 1bs5 n GLU 95 N 6.43 -0.24 -3.67 4.56 1.02 -1.26 -4.77 120.64 122.71 1bs5 n GLU 95 Ca 0.19 0.06 -0.36 0.00 -0.02 0.00 0.00 57.16 57.02 1bs5 n GLU 95 Cb 0.39 -3.29 -0.06 0.00 -0.02 0.00 0.00 31.44 28.46 1bs5 n GLU 95 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1bs5 s GLN 96 N -0.41 3.69 -0.02 3.49 -1.52 -1.13 -5.11 119.66 118.64 1bs5 s GLN 96 Ca 0.00 0.11 0.03 0.00 -1.95 0.00 0.00 55.36 53.55 1bs5 s GLN 96 Cb 0.00 -3.14 -0.00 0.00 -0.22 0.00 0.00 33.01 29.65 1bs5 s GLN 96 CO 0.00 0.68 -0.09 1.03 -0.25 0.00 0.00 175.29 176.66 1bs5 s ARG 97 N -1.37 0.86 -0.06 2.91 1.81 -1.26 -4.43 118.95 117.41 1bs5 s ARG 97 Ca 0.24 -0.32 -0.14 0.00 -1.72 0.00 0.00 55.73 53.79 1bs5 s ARG 97 Cb -0.14 -0.81 0.03 0.00 -0.45 0.00 0.00 34.95 33.57 1bs5 s ARG 97 CO 0.12 0.16 0.34 0.00 -0.68 0.00 0.00 175.30 175.24 1bs5 s ALA 98 N -0.01 -0.85 -0.02 2.13 0.00 -0.94 -4.87 121.76 117.20 1bs5 s ALA 98 Ca 0.00 0.60 -0.30 0.00 0.00 0.00 0.00 51.96 52.27 1bs5 s ALA 98 Cb -0.06 -0.17 -0.06 0.00 0.00 0.00 0.00 23.12 22.83 1bs5 s ALA 98 CO 0.00 -0.23 1.59 -1.17 0.00 0.00 0.00 175.76 175.95 1bs5 s LEU 99 N -0.77 4.32 -0.07 0.00 0.20 -1.26 -0.13 118.68 120.98 1bs5 s LEU 99 Ca -0.09 2.24 0.05 0.00 0.69 0.00 0.00 54.13 57.02 1bs5 s LEU 99 Cb -0.04 -3.54 -0.00 0.00 -0.43 0.00 0.00 46.19 42.17 1bs5 s LEU 99 CO 0.03 -0.87 -0.23 -0.69 -0.29 0.00 0.00 176.35 174.30 1bs5 s VAL 100 N 3.45 1.91 0.05 1.68 1.01 -1.22 -4.97 120.40 122.31 1bs5 s VAL 100 Ca 0.71 -0.96 -0.30 0.00 0.00 0.00 0.00 61.98 61.42 1bs5 s VAL 100 Cb -0.34 -1.64 -0.08 0.00 0.00 0.00 0.00 36.38 34.33 1bs5 s VAL 100 CO 0.29 0.53 1.64 -2.84 0.00 0.00 0.00 175.10 174.72 1bs5 s PRO 101 N 0.12 4.20 0.14 2.72 0.02 -1.26 -4.23 135.00 136.70 1bs5 s PRO 101 Ca -0.10 2.29 0.03 0.00 0.02 0.00 0.00 61.00 63.24 1bs5 s PRO 101 Cb -0.15 -3.66 -0.04 0.00 0.02 0.00 0.00 34.50 30.66 1bs5 s PRO 101 CO 0.06 -0.74 -0.08 1.03 -0.33 0.00 0.00 177.00 176.93 1bs5 s ARG 102 N 2.84 1.00 0.51 5.54 1.81 -0.06 -5.00 118.95 125.59 1bs5 s ARG 102 Ca 0.73 -1.43 -0.20 0.00 -1.72 0.00 0.00 55.73 53.11 1bs5 s ARG 102 Cb -0.38 -0.46 -0.07 0.00 -0.45 0.00 0.00 34.95 33.58 1bs5 s ARG 102 CO 0.32 0.03 1.11 0.00 -0.68 0.00 0.00 175.30 176.07 1bs5 s ALA 103 N -3.45 2.81 -0.05 2.13 0.00 -1.26 -0.51 121.76 121.43 1bs5 s ALA 103 Ca 0.16 0.78 0.01 0.00 0.00 0.00 0.00 51.96 52.91 1bs5 s ALA 103 Cb 0.04 -3.33 -0.26 0.00 0.00 0.00 0.00 23.12 19.57 1bs5 s ALA 103 CO -0.01 -0.61 0.65 1.49 0.00 0.00 0.00 175.76 177.28 1bs5 h GLU 104 N 1.50 0.17 -5.83 0.00 4.81 -1.43 -3.41 114.58 110.39 1bs5 h GLU 104 Ca -0.50 -0.30 -0.57 0.00 -0.13 0.00 0.00 59.36 57.87 1bs5 h GLU 104 Cb 1.25 0.11 -0.29 0.00 0.63 0.00 0.00 28.75 30.45 1bs5 h GLU 104 CO 0.58 0.95 -0.84 0.15 -0.73 0.00 0.00 179.01 179.12 1bs5 s LYS 105 N -2.59 1.48 -0.11 1.92 1.02 0.11 -3.68 119.74 117.88 1bs5 s LYS 105 Ca -0.12 -0.71 -0.07 0.00 0.02 0.00 0.00 55.97 55.09 1bs5 s LYS 105 Cb 0.07 -1.45 0.04 0.00 -0.52 0.00 0.00 37.83 35.97 1bs5 s LYS 105 CO 0.82 0.39 0.26 0.54 -0.92 0.00 0.00 175.35 176.45 1bs5 s VAL 106 N -0.51 -0.02 -0.17 3.17 0.11 -0.25 -0.59 120.40 122.14 1bs5 s VAL 106 Ca 0.07 0.08 -0.01 0.00 -2.93 0.00 0.00 61.98 59.19 1bs5 s VAL 106 Cb -0.07 -0.39 -0.00 0.00 -1.53 0.00 0.00 36.38 34.38 1bs5 s VAL 106 CO -0.00 0.03 -0.12 -0.75 -3.33 0.00 0.00 175.10 170.93 1bs5 s LYS 107 N 0.79 3.27 0.18 1.54 2.20 0.66 -0.58 119.74 127.80 1bs5 s LYS 107 Ca -0.05 -0.71 0.10 0.00 -0.36 0.00 0.00 55.97 54.95 1bs5 s LYS 107 Cb -0.07 -2.74 -0.04 0.00 -1.51 0.00 0.00 37.83 33.47 1bs5 s LYS 107 CO -0.05 -0.04 -0.21 0.96 -0.36 0.00 0.00 175.35 175.65 1bs5 s ILE 108 N 0.99 2.08 0.03 5.43 -4.36 0.62 -0.47 121.20 125.52 1bs5 s ILE 108 Ca -0.01 -1.96 0.02 0.00 -0.26 0.00 0.00 60.65 58.44 1bs5 s ILE 108 Cb -0.15 -1.97 -0.04 0.00 1.25 0.00 0.00 42.46 41.56 1bs5 s ILE 108 CO -0.02 -0.21 0.02 -0.60 0.24 0.00 0.00 174.94 174.37 1bs5 s ARG 109 N -2.70 2.76 0.15 0.37 3.52 -0.20 -1.07 118.95 121.79 1bs5 s ARG 109 Ca 0.18 -0.67 -0.24 0.00 -0.13 0.00 0.00 55.73 54.87 1bs5 s ARG 109 Cb -0.07 -2.66 0.07 0.00 -1.56 0.00 0.00 34.95 30.73 1bs5 s ARG 109 CO 0.08 0.60 1.02 0.00 -0.81 0.00 0.00 175.30 176.19 1bs5 s ALA 110 N -1.19 -1.68 0.06 6.12 0.00 -0.50 -0.66 121.76 123.91 1bs5 s ALA 110 Ca 0.23 -0.00 0.02 0.00 0.00 0.00 0.00 51.96 52.20 1bs5 s ALA 110 Cb -0.12 0.66 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 1bs5 s ALA 110 CO 0.14 -1.05 0.11 -0.51 0.00 0.00 0.00 175.76 174.45 1bs5 s LEU 111 N -3.12 3.94 0.00 0.00 1.43 0.45 -0.25 118.68 121.13 1bs5 s LEU 111 Ca 0.16 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.33 1bs5 s LEU 111 Cb -0.01 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.64 1bs5 s LEU 111 CO 0.03 0.18 0.00 -0.90 0.23 0.00 0.00 176.35 175.89 1bs5 n ASP 112 N 0.51 0.00 0.29 2.29 5.68 -0.10 -0.74 116.55 124.49 1bs5 n ASP 112 Ca -0.08 -0.66 0.17 0.00 -0.50 0.00 0.00 54.79 53.71 1bs5 n ASP 112 Cb 0.52 0.00 0.90 0.00 -1.14 0.00 0.00 41.12 41.40 1bs5 n ASP 112 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1bs5 h ARG 113 N 0.00 0.00 -0.59 0.11 2.43 -1.89 -0.55 114.38 113.89 1bs5 h ARG 113 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1bs5 h ARG 113 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1bs5 h ARG 113 CO 0.00 0.05 0.00 -0.25 -1.51 0.00 0.00 179.97 178.26 1bs5 n ASP 114 N -3.43 5.27 -0.29 -3.80 8.00 -1.26 -4.87 116.55 116.16 1bs5 n ASP 114 Ca -0.02 -2.74 -0.04 0.00 0.71 0.00 0.00 54.79 52.70 1bs5 n ASP 114 Cb 0.17 -0.64 -0.02 0.00 -0.02 0.00 0.00 41.12 40.62 1bs5 n ASP 114 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bs5 n GLY 115 N 0.77 0.42 3.72 0.44 0.00 -0.21 -4.96 105.19 105.37 1bs5 n GLY 115 Ca 0.27 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 1bs5 n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bs5 s LYS 116 N -2.14 4.47 0.35 1.61 -0.14 -1.26 -4.76 119.74 117.87 1bs5 s LYS 116 Ca 0.00 1.00 -0.27 0.00 -1.36 0.00 0.00 55.97 55.34 1bs5 s LYS 116 Cb 0.00 -3.42 -0.09 0.00 -1.68 0.00 0.00 37.83 32.63 1bs5 s LYS 116 CO 0.00 0.11 1.23 -1.25 -0.76 0.00 0.00 175.35 174.68 1bs5 s PRO 117 N 0.58 4.27 0.04 -1.68 0.04 -1.26 -0.93 135.00 136.07 1bs5 s PRO 117 Ca 0.40 2.02 -0.01 0.00 0.04 0.00 0.00 61.00 63.45 1bs5 s PRO 117 Cb -0.19 -2.94 -0.03 0.00 0.04 0.00 0.00 34.50 31.38 1bs5 s PRO 117 CO 0.21 -0.19 -0.03 -0.59 0.04 0.00 0.00 177.00 176.44 1bs5 s PHE 118 N -1.24 0.46 0.05 0.56 -0.71 0.66 -4.92 117.98 112.83 1bs5 s PHE 118 Ca 0.51 -0.93 0.05 0.00 -1.04 0.00 0.00 56.93 55.53 1bs5 s PHE 118 Cb -0.35 -0.34 -0.04 0.00 -1.21 0.00 0.00 43.02 41.08 1bs5 s PHE 118 CO 0.46 -0.33 -0.08 -1.21 -1.34 0.00 0.00 175.22 172.72 1bs5 s GLU 119 N -3.28 2.38 -0.04 1.99 2.02 -1.26 -1.40 118.70 119.11 1bs5 s GLU 119 Ca 0.01 -0.85 -0.01 0.00 0.02 0.00 0.00 54.97 54.15 1bs5 s GLU 119 Cb 0.03 -2.42 0.03 0.00 0.10 0.00 0.00 34.13 31.87 1bs5 s GLU 119 CO -0.08 0.56 0.02 -1.17 0.02 0.00 0.00 175.26 174.62 1bs5 s LEU 120 N -1.74 0.74 -0.14 1.80 2.96 -0.23 -5.00 118.68 117.06 1bs5 s LEU 120 Ca 0.19 -0.01 -0.12 0.00 -0.22 0.00 0.00 54.13 53.98 1bs5 s LEU 120 Cb -0.11 -0.24 -0.05 0.00 0.50 0.00 0.00 46.19 46.29 1bs5 s LEU 120 CO 0.10 -0.17 0.24 -1.61 -1.32 0.00 0.00 176.35 173.60 1bs5 s GLU 121 N 1.57 4.04 -0.00 1.98 2.02 -1.26 -0.27 118.70 126.77 1bs5 s GLU 121 Ca -0.02 0.02 0.01 0.00 0.02 0.00 0.00 54.97 55.00 1bs5 s GLU 121 Cb -0.13 -3.35 0.00 0.00 0.10 0.00 0.00 34.13 30.75 1bs5 s GLU 121 CO -0.03 0.42 -0.02 0.00 0.02 0.00 0.00 175.26 175.65 1bs5 s ALA 122 N -0.04 0.17 0.07 5.21 0.00 0.26 -5.01 121.76 122.41 1bs5 s ALA 122 Ca 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.05 1bs5 s ALA 122 Cb -0.13 -0.06 -0.00 0.00 0.00 0.00 0.00 23.12 22.93 1bs5 s ALA 122 CO 0.04 0.03 0.01 -0.40 0.00 0.00 0.00 175.76 175.44 1bs5 n ASP 123 N 3.10 1.61 0.00 0.00 5.68 -1.26 -1.09 116.55 124.59 1bs5 n ASP 123 Ca -0.13 -1.33 0.00 0.00 -0.50 0.00 0.00 54.79 52.83 1bs5 n ASP 123 Cb 0.59 0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.67 1bs5 n ASP 123 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1bs5 n GLY 124 N 3.02 0.75 0.34 6.12 0.00 -1.24 -2.86 105.19 111.31 1bs5 n GLY 124 Ca -0.02 -0.77 -0.04 0.00 0.00 0.00 0.00 46.02 45.19 1bs5 n GLY 124 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1bs5 h LEU 125 N 0.00 1.04 -0.30 0.99 6.46 -1.99 -2.86 115.31 118.64 1bs5 h LEU 125 Ca 0.00 -0.06 0.07 0.00 -0.12 0.00 0.00 57.88 57.77 1bs5 h LEU 125 Cb 0.00 -0.26 -0.07 0.00 -0.73 0.00 0.00 40.66 39.60 1bs5 h LEU 125 CO 0.00 0.79 -0.19 0.25 -0.62 0.00 0.00 178.44 178.67 1bs5 h LEU 126 N 1.19 -0.64 -1.20 2.25 6.46 -1.96 0.20 115.31 121.61 1bs5 h LEU 126 Ca 0.31 0.13 -0.07 0.00 -0.12 0.00 0.00 57.88 58.14 1bs5 h LEU 126 Cb -0.06 0.33 -0.01 0.00 -0.73 0.00 0.00 40.66 40.19 1bs5 h LEU 126 CO -0.06 -0.23 -0.20 0.00 -0.62 0.00 0.00 178.44 177.33 1bs5 h ALA 127 N 1.02 1.33 -0.25 1.25 0.00 -1.37 -0.20 119.26 121.03 1bs5 h ALA 127 Ca 0.16 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 1bs5 h ALA 127 Cb 0.40 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1bs5 h ALA 127 CO -0.40 0.45 -0.22 0.82 0.00 0.00 0.00 179.25 179.90 1bs5 h ILE 128 N 0.28 1.31 0.22 0.00 2.04 -1.18 -2.88 117.51 117.29 1bs5 h ILE 128 Ca 0.05 -1.38 0.00 0.00 1.00 0.00 0.00 64.86 64.53 1bs5 h ILE 128 Cb 0.52 1.64 -0.03 0.00 -0.74 0.00 0.00 36.82 38.21 1bs5 h ILE 128 CO 0.03 0.43 -0.43 0.00 0.00 0.00 0.00 178.15 178.18 1bs5 h ILE 130 N -0.70 0.41 -0.26 0.00 2.04 -1.13 -0.81 117.51 117.06 1bs5 h ILE 130 Ca -0.02 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 1bs5 h ILE 130 Cb 0.67 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 1bs5 h ILE 130 CO -0.17 0.03 0.12 1.56 0.00 0.00 0.00 178.15 179.69 1bs5 h GLN 131 N 0.14 0.37 -0.66 2.37 4.20 -1.37 -0.01 115.11 120.15 1bs5 h GLN 131 Ca 0.39 -0.05 0.05 0.00 0.06 0.00 0.00 58.65 59.10 1bs5 h GLN 131 Cb 0.68 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.34 1bs5 h GLN 131 CO -0.60 0.37 0.38 1.25 -0.67 0.00 0.00 178.83 179.56 1bs5 h HIS 132 N 0.28 0.69 -0.08 2.96 2.76 -0.91 -1.89 115.15 118.97 1bs5 h HIS 132 Ca 0.09 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.21 1bs5 h HIS 132 Cb 0.12 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 28.87 1bs5 h HIS 132 CO -0.02 0.34 -0.23 0.93 -1.30 0.00 0.00 177.93 177.65 1bs5 h GLU 133 N 0.70 0.30 -0.36 5.26 4.39 -1.00 -2.98 114.58 120.90 1bs5 h GLU 133 Ca 0.29 -0.22 0.06 0.00 0.34 0.00 0.00 59.36 59.84 1bs5 h GLU 133 Cb 0.16 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.82 1bs5 h GLU 133 CO -0.17 0.83 0.24 0.52 -1.16 0.00 0.00 179.01 179.28 1bs5 h MET 134 N -0.18 0.21 -0.71 2.33 2.86 -0.92 0.41 114.93 118.93 1bs5 h MET 134 Ca -0.01 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1bs5 h MET 134 Cb 0.85 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.43 1bs5 h MET 134 CO 0.05 0.14 0.44 -0.44 1.06 0.00 0.00 176.91 178.16 1bs5 h ASP 135 N 0.22 0.84 -0.87 1.22 5.19 -1.19 -1.32 116.42 120.51 1bs5 h ASP 135 Ca 0.16 -0.04 0.01 0.00 -0.62 0.00 0.00 57.03 56.54 1bs5 h ASP 135 Cb 0.36 -0.21 -0.04 0.00 0.18 0.00 0.00 39.33 39.61 1bs5 h ASP 135 CO -0.03 0.64 0.57 0.45 -3.12 0.00 0.00 179.24 177.75 1bs5 h HIS 136 N 0.98 1.08 0.00 4.55 3.86 -0.83 -0.16 115.15 124.63 1bs5 h HIS 136 Ca 0.26 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.49 1bs5 h HIS 136 Cb -0.05 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 28.05 1bs5 h HIS 136 CO 0.00 0.67 0.00 1.28 0.86 0.00 0.00 177.93 180.74 1bs5 n LEU 137 N -4.49 0.00 -0.12 2.43 4.77 -0.50 -0.82 117.00 118.27 1bs5 n LEU 137 Ca 0.10 0.46 0.06 0.00 -0.03 0.00 0.00 56.01 56.60 1bs5 n LEU 137 Cb 0.03 -0.46 0.09 0.00 -2.33 0.00 0.00 43.42 40.74 1bs5 n LEU 137 CO 0.36 -0.37 0.50 1.33 -1.33 0.00 0.00 177.39 177.88 1bs5 n VAL 138 N -1.46 1.37 -0.87 4.08 0.24 -0.99 -1.18 118.33 119.51 1bs5 n VAL 138 Ca 0.02 -1.61 0.00 0.00 -2.04 0.00 0.00 64.34 60.71 1bs5 n VAL 138 Cb 0.06 0.06 0.00 0.00 -1.47 0.00 0.00 33.84 32.49 1bs5 n VAL 138 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bs5 n GLY 139 N -1.00 0.49 3.68 7.63 0.00 0.00 -4.70 105.19 111.29 1bs5 n GLY 139 Ca 0.10 -0.72 -0.35 0.00 0.00 0.00 0.00 46.02 45.05 1bs5 n GLY 139 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bs5 s LYS 140 N -1.34 4.08 0.25 1.61 2.36 -0.11 -4.51 119.74 122.07 1bs5 s LYS 140 Ca 0.00 -0.28 0.09 0.00 -2.55 0.00 0.00 55.97 53.23 1bs5 s LYS 140 Cb 0.00 -3.35 -0.04 0.00 -1.05 0.00 0.00 37.83 33.39 1bs5 s LYS 140 CO 0.00 0.25 0.01 -0.51 1.55 0.00 0.00 175.35 176.65 1bs5 s LEU 141 N 0.48 3.26 0.46 5.43 1.43 -1.26 -3.39 118.68 125.09 1bs5 s LEU 141 Ca 0.06 -0.57 0.22 0.00 -1.03 0.00 0.00 54.13 52.80 1bs5 s LEU 141 Cb -0.12 -1.81 1.12 0.00 0.03 0.00 0.00 46.19 45.41 1bs5 s LEU 141 CO -0.00 0.01 1.95 2.19 0.23 0.00 0.00 176.35 180.73 1bs5 h PHE 142 N 1.98 0.00 0.00 0.29 -5.15 -1.98 -1.59 116.94 110.49 1bs5 h PHE 142 Ca -0.45 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.32 1bs5 h PHE 142 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.41 1bs5 h PHE 142 CO 0.66 0.22 0.00 0.00 -2.00 0.00 0.00 178.31 177.19 1bs5 n MET 143 N -3.76 0.13 0.25 6.09 0.00 -1.26 -1.82 117.12 116.74 1bs5 n MET 143 Ca -0.02 0.41 0.13 0.00 0.00 0.00 0.00 57.70 58.22 1bs5 n MET 143 Cb 0.32 -1.77 0.59 0.00 0.00 0.00 0.00 33.22 32.36 1bs5 n MET 143 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 1bs5 h ASP 144 N 0.00 0.00 0.74 3.17 3.32 -1.70 -2.05 116.42 119.90 1bs5 h ASP 144 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1bs5 h ASP 144 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 1bs5 h ASP 144 CO 0.00 0.15 0.00 -1.22 -1.72 0.00 0.00 179.24 176.45 1bs5 n TYR 145 N -3.36 0.00 -3.31 4.55 4.01 -0.76 -4.92 117.16 113.37 1bs5 n TYR 145 Ca -0.00 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.55 1bs5 n TYR 145 Cb 0.35 -0.41 -0.01 0.00 -0.31 0.00 0.00 39.34 38.97 1bs5 n TYR 145 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1bs5 s LEU 146 N -2.81 3.68 0.65 7.72 1.43 -0.77 -5.00 118.68 123.58 1bs5 s LEU 146 Ca 0.19 -0.43 -0.18 0.00 -1.03 0.00 0.00 54.13 52.68 1bs5 s LEU 146 Cb 0.18 -2.53 -0.01 0.00 0.03 0.00 0.00 46.19 43.86 1bs5 s LEU 146 CO 0.46 -0.61 1.26 -0.94 0.23 0.00 0.00 176.35 176.74 1bs5 s SER 147 N -4.23 4.65 0.31 2.29 1.04 -1.26 -4.80 113.70 111.71 1bs5 s SER 147 Ca 0.50 2.52 0.09 0.00 0.48 0.00 0.00 55.95 59.54 1bs5 s SER 147 Cb -0.08 -2.61 0.89 0.00 0.10 0.00 0.00 66.02 64.32 1bs5 s SER 147 CO 0.31 -1.97 1.69 -0.65 0.98 0.00 0.00 173.24 173.60 1bs5 h PRO 148 N 0.46 0.39 -0.07 4.02 0.11 -1.97 0.45 132.00 135.39 1bs5 h PRO 148 Ca -0.50 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 1bs5 h PRO 148 Cb 1.32 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1bs5 h PRO 148 CO 0.53 0.26 0.02 1.25 -0.21 0.00 0.00 178.00 179.85 1bs5 h LEU 149 N 0.40 0.11 -1.58 2.35 7.12 -2.01 -1.99 115.31 119.72 1bs5 h LEU 149 Ca 0.64 -0.20 -0.02 0.00 0.13 0.00 0.00 57.88 58.43 1bs5 h LEU 149 Cb 1.31 -0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 41.40 1bs5 h LEU 149 CO -0.55 0.28 0.04 0.50 -0.13 0.00 0.00 178.44 178.57 1bs5 h LYS 150 N -0.07 0.31 -0.20 1.25 1.63 -1.45 -2.87 116.57 115.17 1bs5 h LYS 150 Ca 0.02 -0.04 -0.08 0.00 -0.85 0.00 0.00 60.65 59.71 1bs5 h LYS 150 Cb 0.21 -0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 31.78 1bs5 h LYS 150 CO -0.00 0.30 -0.17 1.96 -3.45 0.00 0.00 179.45 178.09 1bs5 h GLN 151 N 0.31 0.48 -0.26 1.90 4.20 -0.77 -2.82 115.11 118.15 1bs5 h GLN 151 Ca 0.08 -0.24 0.04 0.00 0.06 0.00 0.00 58.65 58.58 1bs5 h GLN 151 Cb 0.15 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.87 1bs5 h GLN 151 CO -0.00 0.81 -0.47 1.96 -0.67 0.00 0.00 178.83 180.46 1bs5 h GLN 152 N 0.15 -0.38 -0.23 1.46 7.50 -1.14 -0.89 115.11 121.58 1bs5 h GLN 152 Ca 0.04 0.03 -0.01 0.00 0.50 0.00 0.00 58.65 59.20 1bs5 h GLN 152 Cb 0.71 0.09 -0.01 0.00 0.05 0.00 0.00 27.48 28.31 1bs5 h GLN 152 CO 0.04 -0.25 0.09 -0.09 -1.50 0.00 0.00 178.83 177.12 1bs5 h ARG 153 N -0.40 0.32 -0.07 1.46 2.43 -1.55 0.28 114.38 116.86 1bs5 h ARG 153 Ca 0.05 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1bs5 h ARG 153 Cb 0.53 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1bs5 h ARG 153 CO -0.45 0.28 0.03 0.82 -1.51 0.00 0.00 179.97 179.14 1bs5 h ILE 154 N 0.33 1.10 -0.69 1.20 2.04 -1.21 -0.60 117.51 119.68 1bs5 h ILE 154 Ca 0.08 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1bs5 h ILE 154 Cb 0.08 1.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1bs5 h ILE 154 CO -0.01 0.08 0.43 -0.09 0.00 0.00 0.00 178.15 178.57 1bs5 h ARG 155 N 0.00 0.92 -0.03 2.37 9.65 0.95 -2.10 114.38 126.13 1bs5 h ARG 155 Ca 0.02 -0.07 -0.08 0.00 -1.10 0.00 0.00 59.98 58.75 1bs5 h ARG 155 Cb 0.10 -0.20 0.01 0.00 -1.39 0.00 0.00 29.97 28.49 1bs5 h ARG 155 CO -0.00 0.63 -0.31 1.96 2.80 0.00 0.00 179.97 185.05 1bs5 h GLN 156 N 0.94 0.26 -0.90 0.20 4.20 -1.02 -2.28 115.11 116.52 1bs5 h GLN 156 Ca 0.25 -0.24 0.11 0.00 0.06 0.00 0.00 58.65 58.83 1bs5 h GLN 156 Cb -0.07 0.06 -0.07 0.00 0.30 0.00 0.00 27.48 27.70 1bs5 h GLN 156 CO -0.05 0.92 0.58 0.87 -0.67 0.00 0.00 178.83 180.48 1bs5 h LYS 157 N -0.30 0.81 -0.13 1.46 1.57 -0.63 -0.59 116.57 118.75 1bs5 h LYS 157 Ca -0.03 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.62 1bs5 h LYS 157 Cb 1.00 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.13 1bs5 h LYS 157 CO 0.06 0.54 -0.25 0.28 -0.57 0.00 0.00 179.45 179.51 1bs5 h VAL 158 N 0.84 1.37 -0.95 0.50 2.07 -1.35 -2.03 116.25 116.70 1bs5 h VAL 158 Ca 0.43 -1.51 0.04 0.00 0.82 0.00 0.00 66.70 66.47 1bs5 h VAL 158 Cb 0.50 2.04 -0.05 0.00 -1.52 0.00 0.00 31.29 32.26 1bs5 h VAL 158 CO -0.19 0.44 0.62 -0.33 0.02 0.00 0.00 177.57 178.14 1bs5 h GLU 159 N -0.02 1.16 -0.44 1.57 5.08 -0.71 0.96 114.58 122.19 1bs5 h GLU 159 Ca 0.01 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1bs5 h GLU 159 Cb 0.83 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 1bs5 h GLU 159 CO 0.05 0.77 0.18 -0.22 -1.00 0.00 0.00 179.01 178.79 1bs5 h LYS 160 N 1.20 0.66 0.00 2.33 3.11 -1.07 -0.54 116.57 122.26 1bs5 h LYS 160 Ca 0.38 -0.12 0.00 0.00 -2.81 0.00 0.00 60.65 58.10 1bs5 h LYS 160 Cb 0.01 -0.11 0.00 0.00 -1.00 0.00 0.00 32.23 31.13 1bs5 h LYS 160 CO -0.12 0.60 0.00 1.25 -2.81 0.00 0.00 179.45 178.38 1bs5 h LEU 161 N 0.58 0.00 0.00 5.20 5.85 -0.09 -2.10 115.31 124.75 1bs5 h LEU 161 Ca 0.15 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.52 1bs5 h LEU 161 Cb 0.19 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.15 1bs5 h LEU 161 CO -0.01 0.00 -2.33 0.47 -0.34 0.00 0.00 178.44 176.23 1bs5 n ASP 162 N -2.51 1.05 -0.27 1.25 8.00 -0.63 -3.31 116.55 120.13 1bs5 n ASP 162 Ca 0.01 -0.05 0.22 0.00 0.71 0.00 0.00 54.79 55.68 1bs5 n ASP 162 Cb 0.20 0.43 0.37 0.00 -0.02 0.00 0.00 41.12 42.10 1bs5 n ASP 162 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1bs5 n ARG 163 N -2.90 -0.02 -0.07 -1.24 3.00 -0.24 0.26 116.66 115.45 1bs5 n ARG 163 Ca -0.36 0.63 -0.15 0.00 -0.00 0.00 0.00 57.85 57.98 1bs5 n ARG 163 Cb 1.05 -1.29 -0.14 0.00 0.00 0.00 0.00 32.46 32.09 1bs5 n ARG 163 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1bs5 n LEU 164 N -3.57 1.70 0.00 6.15 7.99 -1.17 -4.60 117.00 123.49 1bs5 n LEU 164 Ca 0.21 0.08 0.00 0.00 -0.01 0.00 0.00 56.01 56.30 1bs5 n LEU 164 Cb 0.86 -0.37 0.00 0.00 -0.11 0.00 0.00 43.42 43.79 1bs5 n LEU 164 CO 0.12 0.70 0.36 1.17 -1.51 0.00 0.00 177.39 178.23 1bs5 n LYS 165 N -3.13 0.00 -1.60 3.23 4.81 0.72 -2.81 118.16 119.38 1bs5 n LYS 165 Ca -0.34 0.53 -0.45 0.00 -0.87 0.00 0.00 58.31 57.19 1bs5 n LYS 165 Cb 1.06 -1.23 -0.04 0.00 0.02 0.00 0.00 35.03 34.84 1bs5 n LYS 165 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1bs5 n ALA 166 N -1.63 1.53 0.07 3.14 0.00 -1.10 -4.66 120.51 117.86 1bs5 n ALA 166 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1bs5 n ALA 166 Cb 0.00 -2.77 0.00 0.00 0.00 0.00 0.00 19.45 16.68 1bs5 n ALA 166 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1bs5 n ARG 167 N 8.15 0.00 0.00 0.00 0.00 -1.12 -4.71 116.66 118.98 1bs5 n ARG 167 Ca 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.14 1bs5 n ARG 167 Cb 0.39 -0.38 0.00 0.00 0.00 0.00 0.00 32.46 32.47 1bs5 n ARG 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63