#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1non s GLN 2 N 0.00 4.48 -0.22 3.17 0.74 -1.26 -1.03 119.66 125.54 1non s GLN 2 Ca 0.00 1.58 -0.13 0.00 0.05 0.00 0.00 55.36 56.86 1non s GLN 2 Cb 0.00 -3.43 -0.18 0.00 1.10 0.00 0.00 33.01 30.50 1non s GLN 2 CO 0.00 -0.18 0.02 1.63 -0.55 0.00 0.00 175.29 176.20 1non n LYS 3 N 4.08 0.62 -3.50 1.67 5.02 0.22 -4.95 118.16 121.31 1non n LYS 3 Ca 0.08 0.37 -0.09 0.00 -2.02 0.00 0.00 58.31 56.64 1non n LYS 3 Cb 0.49 -1.64 -0.03 0.00 -0.02 0.00 0.00 35.03 33.84 1non n LYS 3 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1non s ALA 4 N -2.46 -1.81 -0.12 7.82 0.00 -1.08 -4.99 121.76 119.12 1non s ALA 4 Ca -0.31 1.04 -0.16 0.00 0.00 0.00 0.00 51.96 52.53 1non s ALA 4 Cb 0.09 0.32 -0.05 0.00 0.00 0.00 0.00 23.12 23.48 1non s ALA 4 CO 0.60 -0.64 0.40 0.08 0.00 0.00 0.00 175.76 176.20 1non s VAL 5 N -2.87 5.21 -0.33 0.00 1.01 -1.26 -0.50 120.40 121.65 1non s VAL 5 Ca 0.03 0.80 0.03 0.00 0.00 0.00 0.00 61.98 62.84 1non s VAL 5 Cb -0.01 -3.74 0.01 0.00 0.00 0.00 0.00 36.38 32.64 1non s VAL 5 CO -0.07 0.38 0.43 1.33 0.00 0.00 0.00 175.10 177.17 1non n VAL 6 N 3.39 0.00 -3.62 2.92 0.24 -0.01 -4.96 118.33 116.29 1non n VAL 6 Ca -0.10 -0.47 -0.02 0.00 -2.04 0.00 0.00 64.34 61.71 1non n VAL 6 Cb 0.52 1.05 -0.05 0.00 -1.47 0.00 0.00 33.84 33.89 1non n VAL 6 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1non s MET 7 N -0.66 0.57 0.41 7.34 -1.94 -1.07 -4.97 119.30 118.99 1non s MET 7 Ca 0.03 1.33 0.05 0.00 -1.71 0.00 0.00 55.69 55.39 1non s MET 7 Cb 0.03 0.70 0.07 0.00 2.01 0.00 0.00 34.83 37.64 1non s MET 7 CO 0.07 -0.18 0.57 -0.40 -0.01 0.00 0.00 175.02 175.08 1non n ASP 8 N 5.18 1.26 -0.29 3.03 5.68 -1.26 -1.20 116.55 128.95 1non n ASP 8 Ca -0.13 -1.95 0.04 0.00 -0.50 0.00 0.00 54.79 52.25 1non n ASP 8 Cb 0.51 -0.33 0.18 0.00 -1.14 0.00 0.00 41.12 40.34 1non n ASP 8 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1non h GLU 9 N 0.00 0.72 -0.53 0.11 4.81 -1.95 -1.46 114.58 116.27 1non h GLU 9 Ca -0.19 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 58.91 1non h GLU 9 Cb 0.82 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 1non h GLU 9 CO 0.25 0.47 -0.01 0.37 -0.73 0.00 0.00 179.01 179.36 1non h GLN 10 N 0.74 0.95 -0.34 1.92 4.15 -1.94 -0.91 115.11 119.68 1non h GLN 10 Ca 0.41 -0.31 -0.10 0.00 0.77 0.00 0.00 58.65 59.42 1non h GLN 10 Cb 0.43 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.02 1non h GLN 10 CO -0.28 0.97 -0.20 0.00 -1.93 0.00 0.00 178.83 177.40 1non h ALA 11 N 0.95 1.02 -0.34 3.38 0.00 -1.82 -1.59 119.26 120.85 1non h ALA 11 Ca 0.15 -0.34 -0.17 0.00 0.00 0.00 0.00 54.91 54.55 1non h ALA 11 Cb 0.55 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1non h ALA 11 CO 0.03 0.59 -0.46 0.82 0.00 0.00 0.00 179.25 180.23 1non h ILE 12 N 0.57 1.27 0.17 0.00 2.04 -1.09 -1.16 117.51 119.31 1non h ILE 12 Ca 0.09 -1.63 -0.01 0.00 1.00 0.00 0.00 64.86 64.31 1non h ILE 12 Cb 0.66 1.49 0.00 0.00 -0.74 0.00 0.00 36.82 38.23 1non h ILE 12 CO 0.05 0.54 -0.08 -0.09 0.00 0.00 0.00 178.15 178.57 1non h ARG 13 N 0.73 -0.22 -0.72 2.37 2.43 -1.00 -1.20 114.38 116.76 1non h ARG 13 Ca 0.04 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 1non h ARG 13 Cb 1.06 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.63 1non h ARG 13 CO 0.11 -0.03 0.32 0.00 -1.51 0.00 0.00 179.97 178.86 1non h ARG 14 N -0.37 1.04 -0.18 0.20 3.08 -1.30 -1.44 114.38 115.41 1non h ARG 14 Ca -0.02 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 1non h ARG 14 Cb 0.29 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1non h ARG 14 CO 0.04 0.82 0.07 0.00 -1.07 0.00 0.00 179.97 179.83 1non h ALA 15 N 1.32 0.24 -0.25 0.04 0.00 -1.07 -1.21 119.26 118.33 1non h ALA 15 Ca 0.25 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1non h ALA 15 Cb 0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1non h ALA 15 CO -0.03 -0.16 -0.11 -0.07 0.00 0.00 0.00 179.25 178.88 1non h LEU 16 N 0.13 0.39 -0.23 0.00 3.38 -1.03 -1.47 115.31 116.48 1non h LEU 16 Ca 0.06 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1non h LEU 16 Cb 0.20 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 1non h LEU 16 CO -0.00 0.54 -0.28 0.74 0.09 0.00 0.00 178.44 179.52 1non h THR 17 N 0.38 1.32 -0.07 0.22 2.02 -1.06 -2.32 112.91 113.40 1non h THR 17 Ca 0.07 -1.47 -0.06 0.00 0.77 0.00 0.00 66.41 65.72 1non h THR 17 Cb 0.44 1.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.57 1non h THR 17 CO 0.02 0.46 -0.24 -0.09 0.37 0.00 0.00 175.52 176.04 1non h ARG 18 N 0.29 0.12 -0.32 6.66 1.12 -1.05 -2.65 114.38 118.55 1non h ARG 18 Ca 0.03 -0.03 -0.09 0.00 -1.11 0.00 0.00 59.98 58.77 1non h ARG 18 Cb 0.85 -0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.79 1non h ARG 18 CO 0.07 0.36 -0.16 0.82 -3.11 0.00 0.00 179.97 177.95 1non h ILE 19 N 0.11 1.29 -0.51 1.20 2.04 -1.13 -1.34 117.51 119.18 1non h ILE 19 Ca 0.02 -1.27 0.07 0.00 1.00 0.00 0.00 64.86 64.68 1non h ILE 19 Cb 0.50 1.42 -0.06 0.00 -0.74 0.00 0.00 36.82 37.94 1non h ILE 19 CO 0.03 0.41 0.17 0.00 0.00 0.00 0.00 178.15 178.77 1non h ALA 20 N 0.77 0.61 -0.50 1.87 0.00 -1.08 0.17 119.26 121.09 1non h ALA 20 Ca 0.07 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1non h ALA 20 Cb 0.69 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1non h ALA 20 CO 0.05 -0.23 0.11 0.45 0.00 0.00 0.00 179.25 179.63 1non h HIS 21 N 0.34 0.79 -0.43 0.00 3.86 -1.32 -1.54 115.15 116.85 1non h HIS 21 Ca 0.25 -0.07 -0.05 0.00 -1.16 0.00 0.00 60.37 59.33 1non h HIS 21 Cb 0.28 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.50 1non h HIS 21 CO -0.17 0.68 0.06 0.93 0.86 0.00 0.00 177.93 180.29 1non h GLU 22 N 0.74 0.72 -0.23 2.45 5.08 0.01 -0.18 114.58 123.17 1non h GLU 22 Ca 0.16 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1non h GLU 22 Cb 0.29 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1non h GLU 22 CO -0.00 0.75 0.13 0.82 -1.00 0.00 0.00 179.01 179.71 1non h ILE 23 N 0.57 1.11 -0.69 3.13 2.04 -0.38 -0.77 117.51 122.53 1non h ILE 23 Ca 0.13 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 1non h ILE 23 Cb 0.39 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 1non h ILE 23 CO 0.01 0.11 0.42 0.40 0.00 0.00 0.00 178.15 179.09 1non h ILE 24 N 0.27 1.20 -0.12 -0.67 2.04 -1.15 -2.71 117.51 116.36 1non h ILE 24 Ca 0.08 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 1non h ILE 24 Cb 0.06 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 1non h ILE 24 CO -0.01 0.20 0.04 -0.08 0.00 0.00 0.00 178.15 178.30 1non h GLU 25 N 0.94 0.18 0.00 2.37 4.81 -0.78 0.61 114.58 122.72 1non h GLU 25 Ca 0.25 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 1non h GLU 25 Cb -0.04 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.31 1non h GLU 25 CO -0.05 0.32 0.00 0.54 -0.73 0.00 0.00 179.01 179.10 1non n ARG 26 N -4.88 0.64 0.00 1.92 1.74 -0.31 -2.65 116.66 113.12 1non n ARG 26 Ca -0.05 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 1non n ARG 26 Cb 0.14 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 1non n ARG 26 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1non n ASN 27 N -1.10 0.73 -3.79 0.55 3.02 -1.03 -5.02 115.26 108.63 1non n ASN 27 Ca 0.16 -0.97 -0.26 0.00 -0.03 0.00 0.00 54.58 53.48 1non n ASN 27 Cb 0.12 0.03 0.02 0.00 -0.61 0.00 0.00 39.78 39.34 1non n ASN 27 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1non n LYS 28 N -0.03 -3.00 0.00 3.52 5.02 0.05 -4.68 118.16 119.04 1non n LYS 28 Ca 0.00 0.48 0.00 0.00 -2.02 0.00 0.00 58.31 56.77 1non n LYS 28 Cb 0.06 -4.58 0.00 0.00 -0.02 0.00 0.00 35.03 30.48 1non n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1non n GLY 29 N -1.77 2.55 0.99 0.72 0.00 -0.29 -4.81 105.19 102.58 1non n GLY 29 Ca -0.23 -1.96 0.08 0.00 0.00 0.00 0.00 46.02 43.90 1non n GLY 29 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1non n ILE 30 N 0.59 0.81 -1.67 -0.61 -6.64 -1.26 -4.83 119.36 105.75 1non n ILE 30 Ca 0.00 -0.71 -0.47 0.00 -1.77 0.00 0.00 62.75 59.81 1non n ILE 30 Cb 0.00 0.26 -0.04 0.00 -1.44 0.00 0.00 39.64 38.42 1non n ILE 30 CO 0.00 0.00 0.00 -0.67 -1.77 0.00 0.00 176.55 174.11 1non n ASP 31 N 0.92 3.08 0.00 7.28 2.03 -1.26 -0.11 116.55 128.49 1non n ASP 31 Ca 0.17 1.07 0.00 0.00 0.52 0.00 0.00 54.79 56.55 1non n ASP 31 Cb 0.48 -1.41 0.00 0.00 -0.72 0.00 0.00 41.12 39.47 1non n ASP 31 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1non n GLY 32 N 3.52 0.83 3.87 0.27 0.00 -1.26 -4.90 105.19 107.51 1non n GLY 32 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 1non n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1non s VAL 34 N -1.84 -0.04 -0.22 0.00 1.01 -0.58 -4.37 120.40 114.37 1non s VAL 34 Ca 0.48 0.14 -0.13 0.00 0.00 0.00 0.00 61.98 62.47 1non s VAL 34 Cb -0.11 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.86 1non s VAL 34 CO 0.20 0.06 0.28 -0.76 0.00 0.00 0.00 175.10 174.88 1non s LEU 35 N 1.15 4.14 -0.26 3.92 1.43 -0.50 -0.09 118.68 128.48 1non s LEU 35 Ca -0.08 0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.37 1non s LEU 35 Cb -0.10 -2.32 0.06 0.00 0.03 0.00 0.00 46.19 43.87 1non s LEU 35 CO -0.08 0.00 -0.07 -0.69 0.23 0.00 0.00 176.35 175.75 1non s VAL 36 N 1.13 1.90 0.22 -1.59 1.01 -0.08 -0.26 120.40 122.72 1non s VAL 36 Ca 0.14 -1.53 -0.29 0.00 0.00 0.00 0.00 61.98 60.30 1non s VAL 36 Cb -0.14 -2.11 -0.09 0.00 0.00 0.00 0.00 36.38 34.04 1non s VAL 36 CO 0.06 -0.13 0.89 -0.83 0.00 0.00 0.00 175.10 175.09 1non s GLY 37 N 1.21 3.06 0.48 4.51 0.00 -0.67 -0.92 107.32 114.98 1non s GLY 37 Ca -0.05 0.54 0.06 0.00 0.00 0.00 0.00 44.72 45.26 1non s GLY 37 CO -0.06 1.09 0.66 -0.42 0.00 0.00 0.00 173.10 174.37 1non s ILE 38 N -1.16 2.82 0.00 0.90 1.01 0.04 -1.33 121.20 123.48 1non s ILE 38 Ca 0.39 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 60.16 1non s ILE 38 Cb -0.25 -2.93 0.00 0.00 0.01 0.00 0.00 42.46 39.29 1non s ILE 38 CO 0.30 0.00 0.00 0.29 0.00 0.00 0.00 174.94 175.53 1non n LYS 39 N -2.05 0.00 -0.10 2.79 5.02 -1.23 -2.52 118.16 120.06 1non n LYS 39 Ca 0.09 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.16 1non n LYS 39 Cb 0.59 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.53 1non n LYS 39 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1non n THR 40 N 0.00 1.25 0.23 -0.18 -1.04 -1.26 -4.47 114.28 108.82 1non n THR 40 Ca 0.00 -0.24 0.11 0.00 -2.04 0.00 0.00 64.05 61.89 1non n THR 40 Cb 0.00 -1.86 0.51 0.00 -1.82 0.00 0.00 70.33 67.16 1non n THR 40 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1non h ARG 41 N -0.80 0.00 -0.14 -2.82 3.08 -1.99 -2.83 114.38 108.88 1non h ARG 41 Ca -0.48 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.47 1non h ARG 41 Cb 1.39 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.43 1non h ARG 41 CO -0.29 0.18 -0.36 0.78 -1.07 0.00 0.00 179.97 179.21 1non h GLY 42 N 2.04 0.33 0.90 0.04 0.00 -1.75 -1.38 103.07 103.25 1non h GLY 42 Ca -0.00 -0.29 -0.07 0.00 0.00 0.00 0.00 47.33 46.97 1non h GLY 42 CO 0.02 0.26 -0.06 -2.22 0.00 0.00 0.00 176.54 174.55 1non h ILE 43 N 0.26 1.28 -0.45 2.60 2.04 -1.37 0.16 117.51 122.03 1non h ILE 43 Ca 0.03 -1.09 -0.07 0.00 1.00 0.00 0.00 64.86 64.73 1non h ILE 43 Cb 0.75 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 1non h ILE 43 CO 0.06 0.35 0.01 1.88 0.00 0.00 0.00 178.15 180.45 1non h TYR 44 N 0.38 0.78 -0.45 1.37 0.05 -1.49 -0.24 116.97 117.36 1non h TYR 44 Ca 0.08 -0.10 -0.10 0.00 0.05 0.00 0.00 58.73 58.66 1non h TYR 44 Cb 0.55 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 1non h TYR 44 CO 0.05 0.72 -0.10 -0.07 -1.05 0.00 0.00 178.16 177.71 1non h LEU 45 N 0.69 0.87 -0.31 3.88 3.38 -1.00 -1.90 115.31 120.92 1non h LEU 45 Ca 0.14 -0.36 0.01 0.00 0.09 0.00 0.00 57.88 57.76 1non h LEU 45 Cb 0.42 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1non h LEU 45 CO 0.02 1.03 0.18 0.00 0.09 0.00 0.00 178.44 179.75 1non h ALA 46 N 0.87 0.39 -0.69 1.53 0.00 -0.07 -0.82 119.26 120.47 1non h ALA 46 Ca 0.12 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1non h ALA 46 Cb 0.64 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1non h ALA 46 CO 0.04 -0.19 0.42 0.00 0.00 0.00 0.00 179.25 179.52 1non h ARG 47 N 0.36 0.94 -0.27 0.00 3.08 -0.94 -0.40 114.38 117.15 1non h ARG 47 Ca 0.12 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 1non h ARG 47 Cb 0.01 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 1non h ARG 47 CO -0.06 0.66 0.00 0.00 -1.07 0.00 0.00 179.97 179.50 1non h ARG 48 N 0.95 0.48 -0.83 0.04 3.08 -0.67 -2.29 114.38 115.14 1non h ARG 48 Ca 0.25 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 1non h ARG 48 Cb -0.04 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 29.93 1non h ARG 48 CO -0.05 0.64 0.49 -0.07 -1.07 0.00 0.00 179.97 179.91 1non h LEU 49 N 0.27 1.01 -0.63 3.04 3.38 -0.64 -1.07 115.31 120.67 1non h LEU 49 Ca 0.08 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1non h LEU 49 Cb 0.42 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1non h LEU 49 CO 0.01 0.79 0.41 0.00 0.09 0.00 0.00 178.44 179.73 1non h ALA 50 N 1.27 0.81 -0.38 1.53 0.00 -0.95 0.92 119.26 122.45 1non h ALA 50 Ca 0.30 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 1non h ALA 50 Cb -0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1non h ALA 50 CO -0.05 0.19 0.13 0.93 0.00 0.00 0.00 179.25 180.45 1non h GLU 51 N 0.82 0.59 -0.62 0.00 5.08 -1.04 0.18 114.58 119.58 1non h GLU 51 Ca 0.24 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1non h GLU 51 Cb -0.05 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 1non h GLU 51 CO -0.07 0.58 0.40 0.00 -1.00 0.00 0.00 179.01 178.92 1non h ARG 52 N 0.47 0.83 -0.06 2.33 2.47 -0.67 0.21 114.38 119.96 1non h ARG 52 Ca 0.13 -0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 58.78 1non h ARG 52 Cb 0.23 -0.18 -0.00 0.00 -1.65 0.00 0.00 29.97 28.37 1non h ARG 52 CO -0.01 0.57 0.02 0.82 0.56 0.00 0.00 179.97 181.94 1non h ILE 53 N 0.85 1.15 -0.81 2.04 2.04 -0.65 -0.58 117.51 121.55 1non h ILE 53 Ca 0.23 -0.46 0.12 0.00 1.00 0.00 0.00 64.86 65.75 1non h ILE 53 Cb -0.07 1.34 -0.08 0.00 -0.74 0.00 0.00 36.82 37.27 1non h ILE 53 CO -0.05 0.13 0.41 -0.08 0.00 0.00 0.00 178.15 178.57 1non h GLU 54 N -0.07 0.62 -0.30 2.37 4.57 -0.63 0.49 114.58 121.63 1non h GLU 54 Ca 0.02 -0.04 -0.07 0.00 -1.18 0.00 0.00 59.36 58.09 1non h GLU 54 Cb 0.19 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.62 1non h GLU 54 CO -0.00 0.41 -0.12 0.37 -1.18 0.00 0.00 179.01 178.48 1non h GLN 55 N 0.64 0.51 0.09 1.92 4.15 -0.23 0.17 115.11 122.36 1non h GLN 55 Ca 0.42 -0.15 -0.20 0.00 0.77 0.00 0.00 58.65 59.50 1non h GLN 55 Cb 0.53 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.17 1non h GLN 55 CO -0.32 0.63 -0.98 0.82 -1.93 0.00 0.00 178.83 177.04 1non h ILE 56 N 0.47 1.29 0.00 2.39 2.04 0.63 -3.40 117.51 120.93 1non h ILE 56 Ca 0.09 -2.41 0.00 0.00 1.00 0.00 0.00 64.86 63.54 1non h ILE 56 Cb 0.50 2.92 0.00 0.00 -0.74 0.00 0.00 36.82 39.50 1non h ILE 56 CO 0.03 0.65 -1.19 -0.62 0.00 0.00 0.00 178.15 177.02 1non n GLU 57 N -4.15 0.17 -0.05 2.37 -0.58 0.15 -4.97 120.64 113.59 1non n GLU 57 Ca -0.20 -0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.50 1non n GLU 57 Cb 0.78 -1.52 0.00 0.00 -0.57 0.00 0.00 31.44 30.14 1non n GLU 57 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1non n GLY 58 N 1.43 2.73 3.70 0.62 0.00 0.61 -4.99 105.19 109.30 1non n GLY 58 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 1non n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1non s ALA 59 N -2.99 3.41 0.46 4.61 0.00 -1.25 -5.00 121.76 121.00 1non s ALA 59 Ca 0.00 -0.76 -0.11 0.00 0.00 0.00 0.00 51.96 51.09 1non s ALA 59 Cb 0.00 -1.66 -0.06 0.00 0.00 0.00 0.00 23.12 21.40 1non s ALA 59 CO 0.00 0.50 0.84 -1.54 0.00 0.00 0.00 175.76 175.56 1non s SER 60 N -0.61 6.48 -0.08 0.00 1.04 -1.26 -3.61 113.70 115.66 1non s SER 60 Ca 0.11 1.22 0.05 0.00 0.48 0.00 0.00 55.95 57.81 1non s SER 60 Cb -0.12 -2.37 -0.00 0.00 0.10 0.00 0.00 66.02 63.63 1non s SER 60 CO 0.02 -0.50 -0.23 -0.69 0.98 0.00 0.00 173.24 172.82 1non s VAL 61 N -2.54 1.97 0.39 5.02 1.01 -1.26 -5.00 120.40 119.99 1non s VAL 61 Ca 0.53 -0.99 -0.27 0.00 0.00 0.00 0.00 61.98 61.24 1non s VAL 61 Cb -0.10 -1.70 -0.10 0.00 0.00 0.00 0.00 36.38 34.48 1non s VAL 61 CO 0.35 0.54 1.46 -2.84 0.00 0.00 0.00 175.10 174.61 1non s PRO 62 N 0.18 4.01 -0.13 2.72 0.02 -1.26 -4.85 135.00 135.68 1non s PRO 62 Ca -0.13 2.51 0.02 0.00 0.02 0.00 0.00 61.00 63.42 1non s PRO 62 Cb -0.16 -2.89 0.01 0.00 0.02 0.00 0.00 34.50 31.48 1non s PRO 62 CO 0.07 -0.59 -0.19 0.08 -0.33 0.00 0.00 177.00 176.04 1non s VAL 63 N -1.15 1.82 0.32 3.83 1.01 -1.26 -1.41 120.40 123.57 1non s VAL 63 Ca 0.55 -0.83 0.09 0.00 0.00 0.00 0.00 61.98 61.79 1non s VAL 63 Cb -0.45 -1.64 -0.05 0.00 0.00 0.00 0.00 36.38 34.24 1non s VAL 63 CO 0.61 0.50 0.02 -0.83 0.00 0.00 0.00 175.10 175.40 1non s GLY 64 N 0.98 1.97 -0.05 4.51 0.00 0.64 -5.00 107.32 110.37 1non s GLY 64 Ca -0.05 -1.89 0.06 0.00 0.00 0.00 0.00 44.72 42.85 1non s GLY 64 CO -0.04 -1.85 -0.24 -0.54 0.00 0.00 0.00 173.10 170.43 1non s GLU 65 N -3.72 2.38 -0.09 2.90 2.02 -1.26 -1.67 118.70 119.27 1non s GLU 65 Ca 0.34 -0.86 0.04 0.00 0.02 0.00 0.00 54.97 54.51 1non s GLU 65 Cb -0.02 -2.05 0.00 0.00 0.10 0.00 0.00 34.13 32.16 1non s GLU 65 CO 0.20 0.38 -0.21 -1.17 0.02 0.00 0.00 175.26 174.48 1non s LEU 66 N -0.19 1.98 -0.45 1.80 2.96 -0.44 -1.56 118.68 122.78 1non s LEU 66 Ca -0.02 -0.49 -0.03 0.00 -0.22 0.00 0.00 54.13 53.36 1non s LEU 66 Cb -0.13 -1.26 0.12 0.00 0.50 0.00 0.00 46.19 45.42 1non s LEU 66 CO 0.03 0.14 0.26 -0.62 -1.32 0.00 0.00 176.35 174.83 1non s ASP 67 N 0.38 5.29 0.00 3.68 -1.08 -1.26 -3.58 116.67 120.09 1non s ASP 67 Ca -0.17 -2.17 0.00 0.00 -0.52 0.00 0.00 52.55 49.69 1non s ASP 67 Cb -0.17 -1.85 0.00 0.00 -1.46 0.00 0.00 42.92 39.44 1non s ASP 67 CO 0.07 -0.53 0.02 -0.38 0.52 0.00 0.00 175.17 174.88 1non n ILE 68 N 4.42 0.00 0.00 4.11 5.41 -1.26 -4.75 119.36 127.29 1non n ILE 68 Ca -0.01 0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.79 1non n ILE 68 Cb 0.41 -0.10 0.00 0.00 -0.71 0.00 0.00 39.64 39.23 1non n ILE 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1non n THR 69 N -0.34 0.00 -1.23 1.39 -1.04 -1.26 -4.42 114.28 107.38 1non n THR 69 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.89 1non n THR 69 Cb 0.00 0.00 0.09 0.00 -1.82 0.00 0.00 70.33 68.60 1non n THR 69 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1non n LEU 70 N 0.00 0.00 0.00 -4.42 4.77 -1.26 -3.59 117.00 112.50 1non n LEU 70 Ca 0.00 -0.56 0.00 0.00 -0.03 0.00 0.00 56.01 55.42 1non n LEU 70 Cb 0.00 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 1non n LEU 70 CO 0.00 -1.01 0.00 -1.22 -1.33 0.00 0.00 177.39 173.83 1non n TYR 71 N -2.90 0.00 -3.80 -1.77 4.01 -1.26 -5.09 117.16 106.36 1non n TYR 71 Ca 0.07 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.51 1non n TYR 71 Cb 0.23 -1.28 -0.01 0.00 -0.31 0.00 0.00 39.34 37.98 1non n TYR 71 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1non n ARG 72 N -2.00 -3.71 0.00 -0.72 1.74 -1.24 -4.81 116.66 105.92 1non n ARG 72 Ca 0.00 0.46 0.00 0.00 -0.77 0.00 0.00 57.85 57.54 1non n ARG 72 Cb 0.00 -5.21 0.00 0.00 -1.02 0.00 0.00 32.46 26.23 1non n ARG 72 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1non n VAL 91 N -4.25 0.00 -0.92 1.55 0.31 -0.60 -4.17 118.33 110.25 1non n VAL 91 Ca 0.03 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.04 1non n VAL 91 Cb 0.52 0.00 0.14 0.00 -0.91 0.00 0.00 33.84 33.59 1non n VAL 91 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1non n PRO 92 N 0.00 -0.09 -3.60 5.55 -0.02 -1.26 -4.12 135.00 131.45 1non n PRO 92 Ca 0.00 0.05 -0.04 0.00 -2.02 0.00 0.00 63.50 61.49 1non n PRO 92 Cb 0.00 -2.36 -0.02 0.00 -0.02 0.00 0.00 33.50 31.10 1non n PRO 92 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1non s PHE 93 N -2.33 -0.11 0.00 6.00 -0.12 -1.26 -4.84 117.98 115.32 1non s PHE 93 Ca 0.70 0.06 0.00 0.00 -0.05 0.00 0.00 56.93 57.64 1non s PHE 93 Cb -0.26 0.52 0.00 0.00 -0.63 0.00 0.00 43.02 42.64 1non s PHE 93 CO 0.55 -0.20 0.00 -2.30 -0.05 0.00 0.00 175.22 173.22 1non n PRO 94 N -0.12 0.00 0.00 1.99 -0.02 -1.26 -4.84 135.00 130.75 1non n PRO 94 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1non n PRO 94 Cb 0.58 -0.17 0.00 0.00 -0.02 0.00 0.00 33.50 33.89 1non n PRO 94 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1non n VAL 95 N -0.02 0.00 -1.71 -1.45 0.31 -1.26 -4.95 118.33 109.25 1non n VAL 95 Ca 0.00 0.00 -0.65 0.00 -0.01 0.00 0.00 64.34 63.68 1non n VAL 95 Cb 0.00 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.84 1non n VAL 95 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1non n THR 96 N 0.00 0.05 -1.66 2.52 -1.04 -1.26 0.38 114.28 113.27 1non n THR 96 Ca 0.00 -0.01 -0.16 0.00 -2.04 0.00 0.00 64.05 61.84 1non n THR 96 Cb 0.00 -0.56 -0.06 0.00 -1.82 0.00 0.00 70.33 67.89 1non n THR 96 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1non n GLU 97 N 3.86 -1.48 -3.96 -2.82 4.07 0.22 -4.84 120.64 115.69 1non n GLU 97 Ca 0.29 0.91 -0.22 0.00 -0.06 0.00 0.00 57.16 58.08 1non n GLU 97 Cb -0.01 -5.28 -0.05 0.00 -0.06 0.00 0.00 31.44 26.05 1non n GLU 97 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 1non s ARG 98 N -3.70 2.56 -0.78 5.31 1.81 0.16 -4.25 118.95 120.08 1non s ARG 98 Ca 0.00 -1.40 -0.16 0.00 -1.72 0.00 0.00 55.73 52.45 1non s ARG 98 Cb 0.00 -2.34 0.17 0.00 -0.45 0.00 0.00 34.95 32.33 1non s ARG 98 CO 0.00 0.12 0.81 1.21 -0.68 0.00 0.00 175.30 176.76 1non s ASN 99 N -3.92 6.57 -0.45 0.23 2.47 0.12 -0.32 114.94 119.64 1non s ASN 99 Ca 0.39 -2.22 -0.29 0.00 0.42 0.00 0.00 52.86 51.16 1non s ASN 99 Cb -0.04 -2.27 0.02 0.00 -1.45 0.00 0.00 41.25 37.51 1non s ASN 99 CO 0.25 -0.81 1.20 -0.69 -3.72 0.00 0.00 177.10 173.33 1non s VAL 100 N 1.34 4.15 -0.44 -5.21 1.01 -0.16 -1.53 120.40 119.57 1non s VAL 100 Ca 0.18 1.18 -0.14 0.00 0.00 0.00 0.00 61.98 63.20 1non s VAL 100 Cb -0.14 -4.49 0.05 0.00 0.00 0.00 0.00 36.38 31.80 1non s VAL 100 CO -0.05 -0.92 0.33 -0.63 0.00 0.00 0.00 175.10 173.83 1non s ILE 101 N 4.65 5.02 0.24 2.22 1.01 0.87 -0.14 121.20 135.07 1non s ILE 101 Ca 0.51 -0.98 -0.30 0.00 0.00 0.00 0.00 60.65 59.89 1non s ILE 101 Cb -0.09 -3.92 -0.09 0.00 0.01 0.00 0.00 42.46 38.37 1non s ILE 101 CO 0.31 -0.45 1.12 -0.76 0.00 0.00 0.00 174.94 175.16 1non s LEU 102 N 1.61 4.52 -0.06 2.97 1.43 0.17 -0.90 118.68 128.41 1non s LEU 102 Ca 0.04 2.23 0.04 0.00 -1.03 0.00 0.00 54.13 55.41 1non s LEU 102 Cb -0.22 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.38 1non s LEU 102 CO 0.07 -0.21 -0.17 -0.69 0.23 0.00 0.00 176.35 175.57 1non s VAL 103 N -0.74 1.50 0.09 -1.59 1.01 -0.10 0.19 120.40 120.76 1non s VAL 103 Ca 0.47 -0.72 -0.11 0.00 0.00 0.00 0.00 61.98 61.63 1non s VAL 103 Cb -0.32 -1.31 0.01 0.00 0.00 0.00 0.00 36.38 34.76 1non s VAL 103 CO 0.39 0.43 0.24 -0.62 0.00 0.00 0.00 175.10 175.55 1non s ASP 104 N 0.31 0.03 0.02 3.32 3.68 -0.34 -0.78 116.67 122.92 1non s ASP 104 Ca -0.11 -0.55 -0.17 0.00 2.13 0.00 0.00 52.55 53.85 1non s ASP 104 Cb -0.15 0.37 -0.31 0.00 -1.45 0.00 0.00 42.92 41.38 1non s ASP 104 CO 0.04 -0.75 1.03 -2.24 0.13 0.00 0.00 175.17 173.38 1non h ASP 105 N 2.70 0.76 -3.61 -0.34 2.03 -1.86 -2.93 116.42 113.17 1non h ASP 105 Ca -0.34 -0.87 -0.35 0.00 -0.73 0.00 0.00 57.03 54.74 1non h ASP 105 Cb 1.21 -0.24 -0.32 0.00 -0.83 0.00 0.00 39.33 39.15 1non h ASP 105 CO 0.53 1.57 -0.76 -0.69 -1.03 0.00 0.00 179.24 178.87 1non s VAL 106 N -2.78 0.34 -0.25 4.15 1.01 -1.26 -1.27 120.40 120.34 1non s VAL 106 Ca -0.11 -0.06 -0.10 0.00 0.00 0.00 0.00 61.98 61.72 1non s VAL 106 Cb 0.04 -0.37 -0.05 0.00 0.00 0.00 0.00 36.38 36.01 1non s VAL 106 CO 0.91 0.15 0.14 -0.22 0.00 0.00 0.00 175.10 176.08 1non s LEU 107 N 0.64 3.93 0.00 3.92 2.96 0.16 -4.99 118.68 125.29 1non s LEU 107 Ca -0.07 0.01 0.00 0.00 -0.22 0.00 0.00 54.13 53.85 1non s LEU 107 Cb -0.10 -2.06 0.00 0.00 0.50 0.00 0.00 46.19 44.53 1non s LEU 107 CO -0.01 0.03 0.00 0.33 -1.32 0.00 0.00 176.35 175.38 1non n PHE 108 N 4.54 0.00 0.18 5.38 -0.00 -1.26 -1.85 117.46 124.45 1non n PHE 108 Ca -0.15 0.00 0.06 0.00 -0.00 0.00 0.00 57.45 57.36 1non n PHE 108 Cb 0.52 0.00 0.27 0.00 -0.00 0.00 0.00 39.48 40.26 1non n PHE 108 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.76 178.55 1non h THR 109 N 0.00 0.73 0.00 -2.13 1.35 -1.79 -3.11 112.91 107.97 1non h THR 109 Ca 0.00 -1.61 0.00 0.00 -0.55 0.00 0.00 66.41 64.25 1non h THR 109 Cb 0.00 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 1non h THR 109 CO 0.00 0.35 0.00 0.61 -0.25 0.00 0.00 175.52 176.23 1non n GLY 110 N 0.58 0.85 0.28 5.82 0.00 -1.26 -0.33 105.19 111.13 1non n GLY 110 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1non n GLY 110 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1non h ARG 111 N 3.84 0.38 -0.46 1.61 3.08 -1.92 -2.50 114.38 118.41 1non h ARG 111 Ca 0.00 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 59.91 1non h ARG 111 Cb 0.00 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 1non h ARG 111 CO 0.00 0.34 -0.11 1.15 -1.07 0.00 0.00 179.97 180.28 1non h THR 112 N 0.39 1.26 -0.33 2.04 2.02 -1.93 -2.85 112.91 113.50 1non h THR 112 Ca 0.10 -1.19 0.01 0.00 0.77 0.00 0.00 66.41 66.09 1non h THR 112 Cb 0.11 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 1non h THR 112 CO -0.01 0.41 0.22 0.58 0.37 0.00 0.00 175.52 177.09 1non h VAL 113 N 0.76 1.08 -0.02 3.16 2.07 -1.80 0.20 116.25 121.70 1non h VAL 113 Ca 0.13 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.53 1non h VAL 113 Cb 0.61 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 1non h VAL 113 CO 0.04 0.08 -0.20 -0.09 0.02 0.00 0.00 177.57 177.42 1non h ARG 114 N 0.44 -0.30 -0.77 1.57 2.43 -1.44 0.54 114.38 116.85 1non h ARG 114 Ca 0.12 0.02 0.09 0.00 -0.81 0.00 0.00 59.98 59.41 1non h ARG 114 Cb -0.04 0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 29.50 1non h ARG 114 CO -0.03 -0.20 0.42 0.00 -1.51 0.00 0.00 179.97 178.64 1non h ALA 115 N 0.59 1.09 -0.48 2.80 0.00 -1.25 -0.67 119.26 121.34 1non h ALA 115 Ca 0.07 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1non h ALA 115 Cb 0.40 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1non h ALA 115 CO -0.20 0.03 0.11 0.00 0.00 0.00 0.00 179.25 179.19 1non h ALA 116 N 1.44 1.30 -0.34 0.00 0.00 0.11 -2.41 119.26 119.37 1non h ALA 116 Ca 0.38 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1non h ALA 116 Cb 0.37 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1non h ALA 116 CO -0.26 0.49 -0.03 0.52 0.00 0.00 0.00 179.25 179.98 1non h MET 117 N 0.71 0.62 -0.21 0.00 2.07 0.15 -2.16 114.93 116.11 1non h MET 117 Ca 0.16 -0.21 0.03 0.00 -2.07 0.00 0.00 59.70 57.61 1non h MET 117 Cb 0.27 -0.05 -0.03 0.00 -1.87 0.00 0.00 31.60 29.92 1non h MET 117 CO -0.00 0.76 0.02 -0.44 1.07 0.00 0.00 176.91 178.32 1non h ASP 118 N 0.42 -0.02 -0.57 1.22 3.32 -1.15 -1.42 116.42 118.22 1non h ASP 118 Ca 0.09 0.04 0.13 0.00 0.02 0.00 0.00 57.03 57.31 1non h ASP 118 Cb 0.50 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 1non h ASP 118 CO 0.02 0.02 0.39 0.00 -1.72 0.00 0.00 179.24 177.95 1non h ALA 119 N 1.16 2.25 0.04 3.45 0.00 -1.27 -0.10 119.26 124.79 1non h ALA 119 Ca 0.10 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1non h ALA 119 Cb 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1non h ALA 119 CO -0.14 -0.40 -0.02 0.28 0.00 0.00 0.00 179.25 178.97 1non h VAL 120 N 0.20 1.35 0.00 0.00 2.07 -0.62 -3.20 116.25 116.06 1non h VAL 120 Ca 0.27 -1.40 0.00 0.00 0.82 0.00 0.00 66.70 66.39 1non h VAL 120 Cb 0.79 2.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.82 1non h VAL 120 CO -0.05 0.35 0.00 0.23 0.02 0.00 0.00 177.57 178.12 1non n MET 121 N -4.82 0.89 0.04 1.57 2.00 -0.77 -1.49 117.12 114.55 1non n MET 121 Ca -0.09 0.00 0.12 0.00 0.00 0.00 0.00 57.70 57.73 1non n MET 121 Cb 0.30 -1.47 0.21 0.00 0.00 0.00 0.00 33.22 32.26 1non n MET 121 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1non n ASP 122 N -0.97 0.61 -0.40 7.83 9.92 -0.10 -3.64 116.55 129.80 1non n ASP 122 Ca 0.20 0.03 0.06 0.00 -0.53 0.00 0.00 54.79 54.55 1non n ASP 122 Cb 0.09 0.18 0.03 0.00 -0.64 0.00 0.00 41.12 40.78 1non n ASP 122 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1non n LEU 123 N -1.92 1.73 0.00 0.64 4.77 -0.55 -5.08 117.00 116.59 1non n LEU 123 Ca 0.04 -0.90 0.00 0.00 -0.03 0.00 0.00 56.01 55.12 1non n LEU 123 Cb 0.41 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1non n LEU 123 CO 0.36 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 1non n GLY 124 N 0.82 -1.42 2.99 -0.72 0.00 -1.09 -4.76 105.19 101.00 1non n GLY 124 Ca 0.06 -1.35 -0.31 0.00 0.00 0.00 0.00 46.02 44.42 1non n GLY 124 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1non s ARG 125 N -1.96 1.49 0.60 1.61 1.81 -1.26 -4.07 118.95 117.17 1non s ARG 125 Ca 0.00 -1.92 -0.13 0.00 -1.72 0.00 0.00 55.73 51.96 1non s ARG 125 Cb 0.00 -3.13 -0.04 0.00 -0.45 0.00 0.00 34.95 31.33 1non s ARG 125 CO 0.00 -0.97 1.03 -1.25 -0.68 0.00 0.00 175.30 173.43 1non s PRO 126 N 0.79 3.52 0.27 3.54 0.04 -1.25 0.70 135.00 142.61 1non s PRO 126 Ca 0.12 0.91 -0.02 0.00 0.04 0.00 0.00 61.00 62.05 1non s PRO 126 Cb -0.20 -2.07 0.36 0.00 0.04 0.00 0.00 34.50 32.64 1non s PRO 126 CO -0.08 -0.63 1.83 0.00 0.04 0.00 0.00 177.00 178.15 1non h ALA 127 N 0.04 1.20 -1.91 8.56 0.00 -0.85 -3.42 119.26 122.88 1non h ALA 127 Ca -0.45 -0.20 0.20 0.00 0.00 0.00 0.00 54.91 54.46 1non h ALA 127 Cb 1.20 -0.24 -0.15 0.00 0.00 0.00 0.00 17.79 18.60 1non h ALA 127 CO 0.60 0.56 0.64 -0.98 0.00 0.00 0.00 179.25 180.08 1non s ARG 128 N -5.30 0.65 -0.08 0.00 1.70 -1.15 -5.01 118.95 109.75 1non s ARG 128 Ca -0.10 -0.28 0.05 0.00 -0.47 0.00 0.00 55.73 54.93 1non s ARG 128 Cb 0.16 0.27 -0.00 0.00 -0.57 0.00 0.00 34.95 34.80 1non s ARG 128 CO 0.81 -0.29 -0.24 0.42 -1.08 0.00 0.00 175.30 174.92 1non s ILE 129 N -2.82 2.02 0.32 4.99 1.01 -1.26 -0.99 121.20 124.48 1non s ILE 129 Ca 0.09 -1.02 0.09 0.00 0.00 0.00 0.00 60.65 59.80 1non s ILE 129 Cb -0.00 -1.73 -0.06 0.00 0.01 0.00 0.00 42.46 40.67 1non s ILE 129 CO -0.05 0.56 -0.09 -1.10 0.00 0.00 0.00 174.94 174.25 1non s GLN 130 N 0.14 1.72 -0.05 2.79 -0.21 0.80 -4.98 119.66 119.88 1non s GLN 130 Ca -0.12 -1.88 0.00 0.00 0.02 0.00 0.00 55.36 53.39 1non s GLN 130 Cb -0.16 -1.53 0.02 0.00 1.00 0.00 0.00 33.01 32.34 1non s GLN 130 CO 0.07 0.12 -0.02 -1.17 -2.12 0.00 0.00 175.29 172.16 1non s LEU 131 N -3.55 1.15 -0.09 2.90 2.96 -1.26 0.43 118.68 121.23 1non s LEU 131 Ca 0.31 -0.09 0.04 0.00 -0.22 0.00 0.00 54.13 54.17 1non s LEU 131 Cb 0.02 -0.39 0.00 0.00 0.50 0.00 0.00 46.19 46.33 1non s LEU 131 CO 0.15 -0.09 -0.22 0.00 -1.32 0.00 0.00 176.35 174.86 1non s ALA 132 N 1.14 2.03 0.07 5.97 0.00 0.13 -0.34 121.76 130.76 1non s ALA 132 Ca -0.08 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.02 1non s ALA 132 Cb -0.14 -0.75 -0.03 0.00 0.00 0.00 0.00 23.12 22.20 1non s ALA 132 CO -0.01 0.28 -0.10 0.14 0.00 0.00 0.00 175.76 176.07 1non s VAL 133 N 0.31 0.81 0.00 0.00 -7.23 -0.59 -1.19 120.40 112.50 1non s VAL 133 Ca -0.16 -1.43 -0.20 0.00 -1.81 0.00 0.00 61.98 58.38 1non s VAL 133 Cb -0.17 -1.09 -0.23 0.00 0.56 0.00 0.00 36.38 35.45 1non s VAL 133 CO 0.07 -0.48 1.10 0.25 -0.31 0.00 0.00 175.10 175.74 1non h LEU 134 N 3.93 0.49 -7.91 1.32 5.85 -1.25 -0.55 115.31 117.20 1non h LEU 134 Ca -0.37 -0.75 -0.32 0.00 0.84 0.00 0.00 57.88 57.28 1non h LEU 134 Cb 1.19 -0.15 -0.28 0.00 0.37 0.00 0.00 40.66 41.79 1non h LEU 134 CO 0.48 1.18 -0.75 0.68 -0.34 0.00 0.00 178.44 179.68 1non s VAL 135 N -3.25 0.41 -0.26 1.05 -7.23 -0.40 -0.49 120.40 110.24 1non s VAL 135 Ca -0.14 -0.24 -0.04 0.00 -1.81 0.00 0.00 61.98 59.76 1non s VAL 135 Cb 0.03 -0.35 0.02 0.00 0.56 0.00 0.00 36.38 36.64 1non s VAL 135 CO 0.81 0.11 -0.00 -0.62 -0.31 0.00 0.00 175.10 175.08 1non s ASP 136 N -0.15 4.63 -0.07 4.85 -1.08 -0.88 -0.67 116.67 123.32 1non s ASP 136 Ca 0.02 -0.77 0.17 0.00 -0.52 0.00 0.00 52.55 51.45 1non s ASP 136 Cb -0.02 -1.75 0.59 0.00 -1.46 0.00 0.00 42.92 40.27 1non s ASP 136 CO -0.00 -0.14 1.50 -2.11 0.52 0.00 0.00 175.17 174.93 1non n ARG 137 N 4.75 3.23 0.00 4.34 1.85 -0.77 -0.75 116.66 129.30 1non n ARG 137 Ca -0.16 -2.64 0.00 0.00 -1.00 0.00 0.00 57.85 54.06 1non n ARG 137 Cb 0.48 -1.67 0.00 0.00 -1.05 0.00 0.00 32.46 30.22 1non n ARG 137 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1non n GLY 138 N 0.92 -1.51 2.42 2.89 0.00 -1.26 -4.04 105.19 104.62 1non n GLY 138 Ca 0.22 -1.26 -0.12 0.00 0.00 0.00 0.00 46.02 44.85 1non n GLY 138 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1non n HIS 139 N -0.49 -1.03 -1.75 1.61 8.25 -1.26 -4.49 115.22 116.07 1non n HIS 139 Ca 0.00 0.26 -0.39 0.00 -0.26 0.00 0.00 57.72 57.32 1non n HIS 139 Cb 0.00 -2.92 0.03 0.00 1.12 0.00 0.00 29.99 28.22 1non n HIS 139 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1non n ARG 140 N -2.52 1.92 0.00 -0.41 3.00 -1.17 -4.01 116.66 113.47 1non n ARG 140 Ca -0.07 0.70 0.00 0.00 -0.00 0.00 0.00 57.85 58.47 1non n ARG 140 Cb 0.57 -2.60 0.00 0.00 0.00 0.00 0.00 32.46 30.43 1non n ARG 140 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1non n GLU 141 N -0.69 1.44 -3.97 -0.14 1.02 0.55 -4.95 120.64 113.90 1non n GLU 141 Ca 0.08 -1.10 -0.09 0.00 -0.02 0.00 0.00 57.16 56.03 1non n GLU 141 Cb 0.43 -0.99 -0.10 0.00 -0.02 0.00 0.00 31.44 30.76 1non n GLU 141 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1non s LEU 142 N -0.60 2.09 -0.46 -4.62 1.43 -1.18 -5.04 118.68 110.29 1non s LEU 142 Ca 0.00 -0.54 -0.05 0.00 -1.03 0.00 0.00 54.13 52.51 1non s LEU 142 Cb 0.00 0.30 -0.12 0.00 0.03 0.00 0.00 46.19 46.41 1non s LEU 142 CO 0.00 -0.40 2.33 -0.81 0.23 0.00 0.00 176.35 177.70 1non n PRO 143 N 1.18 1.72 -5.06 1.29 -0.04 -1.26 -4.82 135.00 128.01 1non n PRO 143 Ca -0.21 -1.05 -0.32 0.00 -0.04 0.00 0.00 63.50 61.88 1non n PRO 143 Cb 0.57 -2.13 -0.14 0.00 -0.04 0.00 0.00 33.50 31.76 1non n PRO 143 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1non s ILE 144 N 2.45 2.63 0.06 0.52 1.01 -1.26 -5.13 121.20 121.48 1non s ILE 144 Ca 0.42 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 60.20 1non s ILE 144 Cb 0.16 -1.99 -0.03 0.00 0.01 0.00 0.00 42.46 40.60 1non s ILE 144 CO -0.02 0.58 -0.06 0.00 0.00 0.00 0.00 174.94 175.45 1non s ARG 145 N -0.58 0.64 0.18 2.79 1.04 -1.26 -5.00 118.95 116.76 1non s ARG 145 Ca 0.08 -1.08 -0.18 0.00 -1.04 0.00 0.00 55.73 53.51 1non s ARG 145 Cb -0.11 -0.09 -0.08 0.00 -2.04 0.00 0.00 34.95 32.63 1non s ARG 145 CO 0.01 -0.03 0.66 0.00 -0.04 0.00 0.00 175.30 175.90 1non s ALA 146 N -2.88 3.48 0.06 7.88 0.00 -1.26 -4.82 121.76 124.22 1non s ALA 146 Ca 0.02 0.08 -0.04 0.00 0.00 0.00 0.00 51.96 52.01 1non s ALA 146 Cb 0.00 -2.72 -0.28 0.00 0.00 0.00 0.00 23.12 20.12 1non s ALA 146 CO -0.04 0.37 1.08 -0.44 0.00 0.00 0.00 175.76 176.73 1non h ASP 147 N 3.63 0.43 -3.50 0.00 3.32 -1.07 -3.45 116.42 115.78 1non h ASP 147 Ca -0.48 -0.48 -0.53 0.00 0.02 0.00 0.00 57.03 55.56 1non h ASP 147 Cb 1.20 -0.14 -0.33 0.00 0.22 0.00 0.00 39.33 40.28 1non h ASP 147 CO 0.65 1.38 -0.82 -0.36 -1.72 0.00 0.00 179.24 178.37 1non s PHE 148 N -2.65 1.57 -0.08 4.55 0.40 -0.77 -5.02 117.98 115.98 1non s PHE 148 Ca -0.05 -0.56 0.00 0.00 -0.60 0.00 0.00 56.93 55.72 1non s PHE 148 Cb 0.07 -1.12 0.02 0.00 0.51 0.00 0.00 43.02 42.50 1non s PHE 148 CO 0.88 -0.26 -0.06 0.08 0.70 0.00 0.00 175.22 176.56 1non s VAL 149 N 0.52 0.79 0.05 -0.44 1.01 -1.26 -1.55 120.40 119.53 1non s VAL 149 Ca -0.13 -0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.38 1non s VAL 149 Cb -0.15 -0.82 -0.17 0.00 0.00 0.00 0.00 36.38 35.23 1non s VAL 149 CO 0.04 0.31 1.51 1.23 0.00 0.00 0.00 175.10 178.19 1non h GLY 150 N 7.82 -0.63 -5.05 4.51 0.00 -0.54 -3.46 103.07 105.72 1non h GLY 150 Ca -0.29 0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.23 1non h GLY 150 CO 0.40 -0.23 0.05 1.25 0.00 0.00 0.00 176.54 178.01 1non s LYS 151 N -5.61 0.75 -0.24 4.80 2.20 0.36 -4.90 119.74 117.10 1non s LYS 151 Ca -0.16 1.00 -0.23 0.00 -0.36 0.00 0.00 55.97 56.22 1non s LYS 151 Cb 0.03 0.31 -0.01 0.00 -1.51 0.00 0.00 37.83 36.65 1non s LYS 151 CO 0.60 -0.11 0.77 -0.80 -0.36 0.00 0.00 175.35 175.45 1non s ASN 152 N 0.71 6.76 -0.37 1.43 -0.87 -1.26 -2.07 114.94 119.27 1non s ASN 152 Ca -0.03 0.94 0.01 0.00 -1.57 0.00 0.00 52.86 52.21 1non s ASN 152 Cb -0.05 -2.41 0.10 0.00 -0.02 0.00 0.00 41.25 38.88 1non s ASN 152 CO -0.05 -0.47 0.12 -0.69 -2.57 0.00 0.00 177.10 173.44 1non s VAL 153 N 2.74 2.74 0.22 1.60 1.01 0.07 -4.95 120.40 123.82 1non s VAL 153 Ca 0.32 -2.19 -0.32 0.00 0.00 0.00 0.00 61.98 59.79 1non s VAL 153 Cb -0.15 -2.94 -0.13 0.00 0.00 0.00 0.00 36.38 33.16 1non s VAL 153 CO 0.08 -0.62 1.59 -2.65 0.00 0.00 0.00 175.10 173.49 1non n PRO 154 N 4.41 2.42 -4.13 2.72 -0.02 -1.26 -4.29 135.00 134.85 1non n PRO 154 Ca 0.01 0.87 -0.10 0.00 -2.02 0.00 0.00 63.50 62.26 1non n PRO 154 Cb 0.42 -2.64 -0.10 0.00 -0.02 0.00 0.00 33.50 31.16 1non n PRO 154 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1non s THR 155 N 0.60 0.09 0.32 3.45 -4.23 -1.26 -5.09 115.64 109.53 1non s THR 155 Ca 0.73 -1.86 -0.01 0.00 -1.18 0.00 0.00 61.69 59.37 1non s THR 155 Cb -0.59 -2.04 -0.04 0.00 1.34 0.00 0.00 72.50 71.17 1non s THR 155 CO 0.41 -0.43 0.53 -0.94 -0.54 0.00 0.00 174.62 173.66 1non s SER 156 N -3.05 6.33 0.41 3.99 1.04 -1.26 -4.98 113.70 116.18 1non s SER 156 Ca 0.24 0.49 0.11 0.00 0.48 0.00 0.00 55.95 57.27 1non s SER 156 Cb 0.07 -2.05 0.93 0.00 0.10 0.00 0.00 66.02 65.07 1non s SER 156 CO 0.02 -0.25 1.96 -0.09 0.98 0.00 0.00 173.24 175.86 1non h ARG 157 N 1.03 0.52 0.00 4.02 9.65 -2.00 -2.42 114.38 125.18 1non h ARG 157 Ca -0.49 -0.03 -0.08 0.00 -1.10 0.00 0.00 59.98 58.28 1non h ARG 157 Cb 1.21 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 29.66 1non h ARG 157 CO 0.63 0.34 -0.37 0.66 2.80 0.00 0.00 179.97 184.04 1non h SER 158 N 0.54 0.00 -4.22 -3.80 4.64 -2.00 -3.46 113.55 105.25 1non h SER 158 Ca 0.31 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 61.12 1non h SER 158 Cb 0.49 0.00 0.16 0.00 -0.31 0.00 0.00 62.40 62.74 1non h SER 158 CO -0.10 0.36 0.27 -1.61 -0.87 0.00 0.00 176.83 174.88 1non s GLU 159 N -3.03 1.62 -0.05 4.77 2.02 -0.91 -4.85 118.70 118.27 1non s GLU 159 Ca 0.05 1.20 0.06 0.00 0.02 0.00 0.00 54.97 56.30 1non s GLU 159 Cb 0.07 -1.82 -0.01 0.00 0.10 0.00 0.00 34.13 32.46 1non s GLU 159 CO 0.72 -2.10 -0.25 -1.17 0.02 0.00 0.00 175.26 172.49 1non s LEU 160 N -6.21 2.05 -0.24 1.80 0.20 -0.26 -4.87 118.68 111.15 1non s LEU 160 Ca 0.63 -0.49 -0.11 0.00 0.69 0.00 0.00 54.13 54.85 1non s LEU 160 Cb -0.19 -1.33 -0.05 0.00 -0.43 0.00 0.00 46.19 44.19 1non s LEU 160 CO 0.57 0.25 0.20 -0.63 -0.29 0.00 0.00 176.35 176.45 1non s ILE 161 N -0.24 5.33 -0.22 6.68 -1.09 -1.26 -0.22 121.20 130.19 1non s ILE 161 Ca -0.01 0.25 -0.02 0.00 -2.23 0.00 0.00 60.65 58.64 1non s ILE 161 Cb -0.13 -3.53 0.00 0.00 -1.58 0.00 0.00 42.46 37.22 1non s ILE 161 CO 0.03 0.33 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.29 1non s VAL 162 N 1.14 3.01 -0.27 2.92 1.01 -0.24 -4.99 120.40 122.99 1non s VAL 162 Ca 0.09 -0.70 -0.07 0.00 0.00 0.00 0.00 61.98 61.31 1non s VAL 162 Cb -0.14 -2.39 -0.01 0.00 0.00 0.00 0.00 36.38 33.84 1non s VAL 162 CO 0.05 0.40 0.06 -0.69 0.00 0.00 0.00 175.10 174.92 1non s VAL 163 N 1.41 4.07 -0.14 2.92 1.01 -1.26 -1.53 120.40 126.87 1non s VAL 163 Ca 0.04 -0.43 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 1non s VAL 163 Cb -0.14 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 1non s VAL 163 CO -0.05 0.24 -0.05 -1.61 0.00 0.00 0.00 175.10 173.63 1non s GLU 164 N 1.55 3.55 -0.02 2.72 2.02 0.81 -5.00 118.70 124.34 1non s GLU 164 Ca 0.05 -0.53 0.07 0.00 0.02 0.00 0.00 54.97 54.58 1non s GLU 164 Cb -0.16 -2.86 -0.02 0.00 0.10 0.00 0.00 34.13 31.19 1non s GLU 164 CO 0.02 0.29 -0.23 -0.51 0.02 0.00 0.00 175.26 174.86 1non s LEU 165 N 0.21 2.04 0.33 1.80 1.43 -0.89 -0.95 118.68 122.65 1non s LEU 165 Ca -0.03 -0.42 0.11 0.00 -1.03 0.00 0.00 54.13 52.76 1non s LEU 165 Cb -0.14 -1.18 0.90 0.00 0.03 0.00 0.00 46.19 45.80 1non s LEU 165 CO 0.03 0.27 1.74 0.77 0.23 0.00 0.00 176.35 179.39 1non h SER 166 N 5.69 0.65 0.21 2.29 4.64 -1.68 0.70 113.55 126.06 1non h SER 166 Ca -0.39 0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 61.05 1non h SER 166 Cb 1.14 0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1non h SER 166 CO 0.47 0.12 -0.03 -0.33 -0.87 0.00 0.00 176.83 176.20 1non h GLU 167 N 0.58 0.00 0.00 4.77 3.07 -1.93 -2.48 114.58 118.59 1non h GLU 167 Ca 0.63 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.49 1non h GLU 167 Cb 1.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.14 1non h GLU 167 CO -0.44 0.03 -0.73 0.28 -1.40 0.00 0.00 179.01 176.76 1non n VAL 168 N -3.42 0.00 0.17 3.13 0.31 -0.24 -4.84 118.33 113.44 1non n VAL 168 Ca -0.02 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.33 1non n VAL 168 Cb 0.14 -0.40 0.02 0.00 -0.91 0.00 0.00 33.84 32.69 1non n VAL 168 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1non n ASP 169 N -1.44 1.43 0.00 4.52 8.00 0.23 -4.97 116.55 124.32 1non n ASP 169 Ca 0.00 -1.24 0.00 0.00 0.71 0.00 0.00 54.79 54.26 1non n ASP 169 Cb 0.26 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 1non n ASP 169 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1non n GLY 170 N 0.23 2.49 3.32 0.44 0.00 -0.93 -4.90 105.19 105.83 1non n GLY 170 Ca 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 1non n GLY 170 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1non s ILE 171 N -2.52 0.07 -0.32 -0.61 -4.36 -1.26 -4.73 121.20 107.47 1non s ILE 171 Ca 0.00 -0.55 -0.12 0.00 -0.26 0.00 0.00 60.65 59.72 1non s ILE 171 Cb 0.00 -1.10 -0.03 0.00 1.25 0.00 0.00 42.46 42.58 1non s ILE 171 CO 0.00 -0.30 0.23 -1.81 0.24 0.00 0.00 174.94 173.29 1non s ASP 172 N -2.54 6.05 -0.25 4.36 1.01 -1.25 -1.95 116.67 122.09 1non s ASP 172 Ca 0.00 -0.31 -0.27 0.00 0.71 0.00 0.00 52.55 52.69 1non s ASP 172 Cb 0.01 -2.13 0.14 0.00 1.01 0.00 0.00 42.92 41.94 1non s ASP 172 CO -0.09 -0.18 1.09 -1.58 0.21 0.00 0.00 175.17 174.62 1non s GLN 173 N 1.73 0.45 -0.10 8.23 0.74 -0.12 -2.86 119.66 127.74 1non s GLN 173 Ca 0.06 0.38 0.03 0.00 0.05 0.00 0.00 55.36 55.89 1non s GLN 173 Cb -0.17 0.22 0.00 0.00 1.10 0.00 0.00 33.01 34.16 1non s GLN 173 CO 0.11 -0.08 -0.21 0.08 -0.55 0.00 0.00 175.29 174.63 1non s VAL 174 N -0.21 1.85 0.13 1.34 1.01 -0.34 -0.13 120.40 124.05 1non s VAL 174 Ca 0.03 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.10 1non s VAL 174 Cb -0.04 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 1non s VAL 174 CO -0.05 0.51 0.07 -0.94 0.00 0.00 0.00 175.10 174.68 1non s SER 175 N 0.46 0.30 -0.18 3.32 1.04 -0.58 -0.83 113.70 117.22 1non s SER 175 Ca -0.17 -1.18 -0.05 0.00 0.48 0.00 0.00 55.95 55.03 1non s SER 175 Cb -0.17 0.30 -0.03 0.00 0.10 0.00 0.00 66.02 66.22 1non s SER 175 CO 0.07 -0.73 -0.00 -0.63 0.98 0.00 0.00 173.24 172.92 1non s ILE 176 N -4.04 4.06 0.43 -1.02 1.01 0.34 -1.08 121.20 120.90 1non s ILE 176 Ca 0.23 -0.28 0.06 0.00 0.00 0.00 0.00 60.65 60.66 1non s ILE 176 Cb 0.07 -2.82 -0.07 0.00 0.01 0.00 0.00 42.46 39.66 1non s ILE 176 CO 0.01 0.45 0.03 -1.00 0.00 0.00 0.00 174.94 174.43 1non s HIS 177 N 0.72 2.43 -0.23 3.97 3.76 0.70 0.71 115.29 127.35 1non s HIS 177 Ca -0.00 -0.70 -0.07 0.00 -0.15 0.00 0.00 55.06 54.14 1non s HIS 177 Cb -0.14 -1.78 0.11 0.00 1.11 0.00 0.00 32.58 31.88 1non s HIS 177 CO 0.02 0.38 0.47 -2.00 -0.85 0.00 0.00 174.74 172.76 1non s GLU 178 N -3.76 0.38 0.00 1.40 2.12 -0.20 -1.10 118.70 117.55 1non s GLU 178 Ca 0.32 1.06 0.27 0.00 0.36 0.00 0.00 54.97 56.97 1non s GLU 178 Cb 0.08 0.35 0.91 0.00 0.26 0.00 0.00 34.13 35.73 1non s GLU 178 CO 0.16 -0.30 1.66 1.63 -0.54 0.00 0.00 175.26 177.87