#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1or4 n LYS 22 N 0.00 0.00 -2.99 2.61 2.85 -1.26 -5.00 118.16 114.37 1or4 n LYS 22 Ca 0.00 0.00 -0.16 0.00 -1.05 0.00 0.00 58.31 57.10 1or4 n LYS 22 Cb 0.00 0.00 -0.01 0.00 -0.65 0.00 0.00 35.03 34.37 1or4 n LYS 22 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1or4 n ASN 23 N 0.00 1.27 -0.10 -5.58 6.94 -1.26 -4.96 115.26 111.56 1or4 n ASN 23 Ca 0.00 -2.96 0.14 0.00 -0.02 0.00 0.00 54.58 51.75 1or4 n ASN 23 Cb 0.00 -0.58 0.66 0.00 -2.36 0.00 0.00 39.78 37.50 1or4 n ASN 23 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1or4 n ARG 24 N 0.13 0.72 -4.01 -3.83 1.74 -1.26 -4.52 116.66 105.63 1or4 n ARG 24 Ca 0.20 -0.21 -0.34 0.00 -0.77 0.00 0.00 57.85 56.74 1or4 n ARG 24 Cb 0.70 -1.50 -0.15 0.00 -1.02 0.00 0.00 32.46 30.50 1or4 n ARG 24 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1or4 s ILE 25 N -2.42 2.63 -0.52 0.55 1.01 -1.26 -0.12 121.20 121.06 1or4 s ILE 25 Ca 0.31 -1.08 0.07 0.00 0.00 0.00 0.00 60.65 59.95 1or4 s ILE 25 Cb 0.20 -2.32 0.25 0.00 0.01 0.00 0.00 42.46 40.61 1or4 s ILE 25 CO 0.46 0.24 0.64 0.00 0.00 0.00 0.00 174.94 176.28 1or4 n GLN 26 N 4.63 1.67 -4.24 2.79 10.64 0.07 -4.97 117.38 127.97 1or4 n GLN 26 Ca -0.17 -3.98 -0.35 0.00 -1.83 0.00 0.00 57.00 50.66 1or4 n GLN 26 Cb 0.47 -1.76 -0.09 0.00 -0.86 0.00 0.00 30.24 28.00 1or4 n GLN 26 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1or4 s LEU 27 N -1.88 3.80 0.58 2.61 1.43 -1.26 -3.70 118.68 120.26 1or4 s LEU 27 Ca 0.38 0.23 -0.09 0.00 -1.03 0.00 0.00 54.13 53.62 1or4 s LEU 27 Cb 0.16 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.46 1or4 s LEU 27 CO -0.06 0.39 0.96 0.42 0.23 0.00 0.00 176.35 178.28 1or4 s THR 28 N -0.91 4.67 0.54 5.49 -4.23 -1.26 -4.95 115.64 115.00 1or4 s THR 28 Ca 0.14 0.63 0.33 0.00 -1.18 0.00 0.00 61.69 61.61 1or4 s THR 28 Cb -0.12 -3.83 0.33 0.00 1.34 0.00 0.00 72.50 70.22 1or4 s THR 28 CO 0.03 -1.01 2.02 0.78 -0.54 0.00 0.00 174.62 175.89 1or4 h ASN 29 N -0.17 0.00 0.60 3.99 4.21 -1.99 0.29 115.58 122.51 1or4 h ASN 29 Ca -0.45 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.06 1or4 h ASN 29 Cb 1.20 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.40 1or4 h ASN 29 CO 0.62 0.00 0.00 0.11 -1.29 0.00 0.00 177.43 176.87 1or4 h LYS 30 N 0.00 0.00 -0.77 0.81 6.56 -2.04 -2.43 116.57 118.70 1or4 h LYS 30 Ca 0.00 0.00 -0.46 0.00 -1.06 0.00 0.00 60.65 59.13 1or4 h LYS 30 Cb 0.36 0.00 -0.26 0.00 -0.57 0.00 0.00 32.23 31.76 1or4 h LYS 30 CO 0.00 0.00 0.29 0.72 -2.06 0.00 0.00 179.45 178.40 1or4 n HIS 31 N -3.03 2.47 -0.22 -1.35 8.25 0.10 -4.76 115.22 116.68 1or4 n HIS 31 Ca -0.01 -2.15 -0.04 0.00 -0.26 0.00 0.00 57.72 55.26 1or4 n HIS 31 Cb 0.21 -0.87 0.02 0.00 1.12 0.00 0.00 29.99 30.47 1or4 n HIS 31 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1or4 h ALA 32 N 1.43 0.08 -0.31 -1.41 0.00 -1.54 -2.16 119.26 115.34 1or4 h ALA 32 Ca 0.47 0.19 -0.07 0.00 0.00 0.00 0.00 54.91 55.50 1or4 h ALA 32 Cb 1.77 0.73 -0.02 0.00 0.00 0.00 0.00 17.79 20.28 1or4 h ALA 32 CO 0.98 -0.62 -0.10 -0.44 0.00 0.00 0.00 179.25 179.07 1or4 h ASP 33 N -0.12 0.51 -0.69 0.00 3.32 -1.88 -2.26 116.42 115.29 1or4 h ASP 33 Ca 0.26 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 1or4 h ASP 33 Cb 0.55 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 1or4 h ASP 33 CO -0.70 0.65 0.43 0.58 -1.72 0.00 0.00 179.24 178.48 1or4 h VAL 34 N 0.49 1.19 -0.97 -1.35 2.07 -1.77 0.37 116.25 116.27 1or4 h VAL 34 Ca 0.09 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 67.21 1or4 h VAL 34 Cb 0.47 0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 30.40 1or4 h VAL 34 CO 0.03 0.20 0.63 0.11 0.02 0.00 0.00 177.57 178.56 1or4 h LYS 35 N 0.96 1.29 -0.29 1.57 1.57 -1.16 0.18 116.57 120.69 1or4 h LYS 35 Ca 0.25 -0.09 -0.18 0.00 -1.87 0.00 0.00 60.65 58.77 1or4 h LYS 35 Cb -0.05 -0.29 -0.00 0.00 0.08 0.00 0.00 32.23 31.97 1or4 h LYS 35 CO -0.05 0.86 -0.52 0.87 -0.57 0.00 0.00 179.45 180.05 1or4 h LYS 36 N 1.32 0.85 -0.35 3.15 1.57 -0.74 -2.43 116.57 119.94 1or4 h LYS 36 Ca 0.36 -0.52 0.03 0.00 -1.87 0.00 0.00 60.65 58.64 1or4 h LYS 36 Cb -0.13 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 1or4 h LYS 36 CO -0.07 1.15 0.17 1.96 -0.57 0.00 0.00 179.45 182.09 1or4 h GLN 37 N 0.66 0.34 -0.68 3.15 4.20 0.31 -0.98 115.11 122.12 1or4 h GLN 37 Ca 0.02 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.74 1or4 h GLN 37 Cb 1.11 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.78 1or4 h GLN 37 CO 0.11 0.23 0.43 -0.07 -0.67 0.00 0.00 178.83 178.86 1or4 h LEU 38 N 0.35 0.72 -1.19 1.46 3.38 -0.60 -1.97 115.31 117.46 1or4 h LEU 38 Ca 0.15 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1or4 h LEU 38 Cb 0.06 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1or4 h LEU 38 CO -0.11 0.50 0.19 0.50 0.09 0.00 0.00 178.44 179.62 1or4 h LYS 39 N 0.85 0.76 0.00 1.13 3.64 -1.04 0.23 116.57 122.13 1or4 h LYS 39 Ca 0.27 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1or4 h LYS 39 Cb -0.02 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1or4 h LYS 39 CO -0.09 0.64 -0.06 1.98 -2.27 0.00 0.00 179.45 179.65 1or4 h MET 40 N 0.75 0.00 -0.29 1.90 4.05 -0.47 -2.48 114.93 118.38 1or4 h MET 40 Ca 0.18 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.60 1or4 h MET 40 Cb 0.17 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.97 1or4 h MET 40 CO -0.01 0.06 0.00 1.33 0.23 0.00 0.00 176.91 178.51 1or4 n VAL 41 N -3.13 0.47 -3.04 -5.77 0.24 -0.86 -4.95 118.33 101.29 1or4 n VAL 41 Ca 0.02 -0.74 -0.17 0.00 -2.04 0.00 0.00 64.34 61.42 1or4 n VAL 41 Cb 0.47 0.97 0.04 0.00 -1.47 0.00 0.00 33.84 33.85 1or4 n VAL 41 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1or4 n ARG 42 N 1.13 -4.69 -3.17 7.34 1.74 -0.13 -4.92 116.66 113.96 1or4 n ARG 42 Ca 0.15 0.65 -0.46 0.00 -0.77 0.00 0.00 57.85 57.42 1or4 n ARG 42 Cb 0.51 -5.03 -0.02 0.00 -1.02 0.00 0.00 32.46 26.89 1or4 n ARG 42 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1or4 s LEU 43 N -5.35 6.08 0.00 0.55 0.20 -0.12 -4.87 118.68 115.17 1or4 s LEU 43 Ca 0.32 -2.39 0.00 0.00 0.69 0.00 0.00 54.13 52.75 1or4 s LEU 43 Cb -0.14 -2.28 0.00 0.00 -0.43 0.00 0.00 46.19 43.34 1or4 s LEU 43 CO 0.40 -0.78 0.00 0.61 -0.29 0.00 0.00 176.35 176.29 1or4 n GLY 44 N 4.59 7.08 0.12 7.98 0.00 -1.26 -4.60 105.19 119.10 1or4 n GLY 44 Ca 0.16 -2.02 -0.10 0.00 0.00 0.00 0.00 46.02 44.07 1or4 n GLY 44 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1or4 h ASP 45 N 0.00 0.28 -0.65 1.61 3.32 -1.96 -0.57 116.42 118.45 1or4 h ASP 45 Ca 0.00 -0.02 0.09 0.00 0.02 0.00 0.00 57.03 57.12 1or4 h ASP 45 Cb 0.00 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 39.41 1or4 h ASP 45 CO 0.00 0.22 0.29 0.00 -1.72 0.00 0.00 179.24 178.03 1or4 h ALA 46 N 1.07 0.88 -0.05 3.45 0.00 -1.97 0.22 119.26 122.86 1or4 h ALA 46 Ca 0.09 0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 1or4 h ALA 46 Cb -0.02 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1or4 h ALA 46 CO -0.02 -0.11 -0.71 0.93 0.00 0.00 0.00 179.25 179.34 1or4 h GLU 47 N 0.51 0.26 -0.12 0.00 3.07 -1.82 -1.88 114.58 114.60 1or4 h GLU 47 Ca 0.32 -0.22 -0.17 0.00 -0.50 0.00 0.00 59.36 58.80 1or4 h GLU 47 Cb 0.36 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 1or4 h GLU 47 CO -0.28 0.87 -0.64 -0.07 -1.40 0.00 0.00 179.01 177.49 1or4 h LEU 48 N 0.18 0.51 -0.83 1.33 3.38 -0.68 -2.08 115.31 117.12 1or4 h LEU 48 Ca -0.02 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 1or4 h LEU 48 Cb 1.27 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.83 1or4 h LEU 48 CO 0.11 1.02 0.45 0.22 0.09 0.00 0.00 178.44 180.33 1or4 h TYR 49 N 0.32 1.15 -0.54 1.13 -0.00 -0.45 -1.17 116.97 117.41 1or4 h TYR 49 Ca -0.01 -0.03 0.01 0.00 -0.00 0.00 0.00 58.73 58.69 1or4 h TYR 49 Cb 1.19 -0.37 -0.03 0.00 -0.00 0.00 0.00 36.73 37.53 1or4 h TYR 49 CO 0.04 0.81 0.35 0.28 -0.00 0.00 0.00 178.16 179.64 1or4 h VAL 50 N 1.16 1.14 -0.50 1.81 2.07 -1.09 -0.82 116.25 120.02 1or4 h VAL 50 Ca 0.29 -0.25 0.01 0.00 0.82 0.00 0.00 66.70 67.57 1or4 h VAL 50 Cb 0.04 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.13 1or4 h VAL 50 CO -0.05 0.13 0.32 -0.07 0.02 0.00 0.00 177.57 177.93 1or4 h LEU 51 N 0.73 0.55 -0.35 2.57 3.38 -1.11 -0.61 115.31 120.46 1or4 h LEU 51 Ca 0.20 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.20 1or4 h LEU 51 Cb -0.08 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 1or4 h LEU 51 CO -0.04 0.40 0.10 -0.08 0.09 0.00 0.00 178.44 178.91 1or4 h GLU 52 N 0.66 0.23 -0.79 1.13 4.81 -0.91 -0.49 114.58 119.21 1or4 h GLU 52 Ca 0.19 -0.01 0.16 0.00 -0.13 0.00 0.00 59.36 59.56 1or4 h GLU 52 Cb -0.05 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.22 1or4 h GLU 52 CO -0.05 0.15 0.53 1.96 -0.73 0.00 0.00 179.01 180.87 1or4 h GLN 53 N 0.24 0.43 0.00 1.92 7.50 -0.79 -1.75 115.11 122.66 1or4 h GLN 53 Ca 0.16 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.29 1or4 h GLN 53 Cb 0.16 -0.10 0.00 0.00 0.05 0.00 0.00 27.48 27.59 1or4 h GLN 53 CO -0.19 0.29 -0.10 -0.07 -1.50 0.00 0.00 178.83 177.26 1or4 h LEU 54 N 0.45 0.00 -0.53 1.46 3.38 0.44 -3.39 115.31 117.12 1or4 h LEU 54 Ca 0.39 -0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.45 1or4 h LEU 54 Cb 0.88 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.54 1or4 h LEU 54 CO -0.14 0.01 -0.04 -0.61 0.09 0.00 0.00 178.44 177.76 1or4 h GLN 55 N 0.00 0.08 -0.61 1.13 4.15 -0.33 -0.81 115.11 118.72 1or4 h GLN 55 Ca 0.00 -0.00 0.05 0.00 0.77 0.00 0.00 58.65 59.47 1or4 h GLN 55 Cb 0.80 -0.02 -0.05 0.00 0.21 0.00 0.00 27.48 28.43 1or4 h GLN 55 CO 0.00 0.05 0.33 -1.35 -1.93 0.00 0.00 178.83 175.93 1or4 h PRO 56 N 0.08 0.61 -0.47 -2.39 0.11 -1.77 0.65 132.00 128.82 1or4 h PRO 56 Ca 0.27 -0.04 0.07 0.00 0.11 0.00 0.00 66.00 66.41 1or4 h PRO 56 Cb 0.42 -0.14 -0.06 0.00 0.11 0.00 0.00 31.00 31.33 1or4 h PRO 56 CO -0.48 0.40 0.13 1.25 -0.21 0.00 0.00 178.00 179.10 1or4 h LEU 57 N 0.62 0.10 -0.27 2.35 5.85 -1.54 -0.08 115.31 122.34 1or4 h LEU 57 Ca 0.27 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 59.02 1or4 h LEU 57 Cb 0.16 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 1or4 h LEU 57 CO -0.17 0.08 0.03 0.40 -0.34 0.00 0.00 178.44 178.44 1or4 h ILE 58 N 0.29 1.24 0.00 4.05 1.08 -0.23 -2.21 117.51 121.72 1or4 h ILE 58 Ca 0.23 -0.82 -0.02 0.00 -0.39 0.00 0.00 64.86 63.85 1or4 h ILE 58 Cb 0.26 1.26 -0.00 0.00 -3.07 0.00 0.00 36.82 35.27 1or4 h ILE 58 CO -0.26 0.26 -0.11 1.56 -0.69 0.00 0.00 178.15 178.91 1or4 h GLN 59 N 0.25 0.00 0.00 2.37 4.20 0.58 -1.78 115.11 120.73 1or4 h GLN 59 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1or4 h GLN 59 Cb 0.36 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1or4 h GLN 59 CO 0.01 0.11 0.00 -0.85 -0.67 0.00 0.00 178.83 177.43 1or4 n GLU 60 N -4.38 0.32 -0.16 1.46 0.28 -0.07 -3.09 120.64 115.01 1or4 n GLU 60 Ca -0.03 0.01 0.08 0.00 -0.16 0.00 0.00 57.16 57.06 1or4 n GLU 60 Cb 0.19 -1.50 0.11 0.00 1.43 0.00 0.00 31.44 31.66 1or4 n GLU 60 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1or4 n ASN 61 N -1.33 1.83 -0.12 -1.84 3.02 -0.72 -4.84 115.26 111.26 1or4 n ASN 61 Ca 0.12 -2.81 -0.04 0.00 -0.03 0.00 0.00 54.58 51.82 1or4 n ASN 61 Cb 0.26 -0.36 0.17 0.00 -0.61 0.00 0.00 39.78 39.23 1or4 n ASN 61 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1or4 h ILE 62 N 1.49 1.24 -0.24 2.41 6.09 -1.35 -0.54 117.51 126.61 1or4 h ILE 62 Ca 0.00 -0.95 -0.00 0.00 -1.37 0.00 0.00 64.86 62.54 1or4 h ILE 62 Cb 1.07 0.81 -0.01 0.00 0.47 0.00 0.00 36.82 39.15 1or4 h ILE 62 CO 0.00 0.34 0.14 0.58 -3.07 0.00 0.00 178.15 176.14 1or4 h VAL 63 N 0.77 1.10 -0.27 2.19 2.07 -1.88 -0.89 116.25 119.34 1or4 h VAL 63 Ca 0.16 -0.24 -0.10 0.00 0.82 0.00 0.00 66.70 67.34 1or4 h VAL 63 Cb 0.40 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1or4 h VAL 63 CO 0.01 0.09 -0.24 0.78 0.02 0.00 0.00 177.57 178.24 1or4 h ASN 64 N 0.29 0.52 -0.64 0.57 2.35 -1.89 0.25 115.58 117.03 1or4 h ASN 64 Ca 0.08 -0.18 -0.02 0.00 -0.55 0.00 0.00 56.30 55.64 1or4 h ASN 64 Cb 0.03 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.23 1or4 h ASN 64 CO -0.02 0.76 0.32 0.40 -1.65 0.00 0.00 177.43 177.25 1or4 h ILE 65 N 0.46 1.21 -0.02 2.81 2.04 -0.64 -1.73 117.51 121.65 1or4 h ILE 65 Ca 0.07 -0.57 -0.20 0.00 1.00 0.00 0.00 64.86 65.15 1or4 h ILE 65 Cb 0.67 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.17 1or4 h ILE 65 CO 0.05 0.24 -0.85 -0.37 0.00 0.00 0.00 178.15 177.21 1or4 h VAL 66 N 0.87 1.42 -0.69 1.67 -1.51 -0.87 -1.51 116.25 115.62 1or4 h VAL 66 Ca 0.22 -2.40 0.08 0.00 -1.23 0.00 0.00 66.70 63.37 1or4 h VAL 66 Cb 0.09 2.34 -0.06 0.00 -2.13 0.00 0.00 31.29 31.52 1or4 h VAL 66 CO -0.03 0.71 0.37 0.44 -1.23 0.00 0.00 177.57 177.83 1or4 h ASP 67 N 0.20 0.51 -0.38 4.19 3.45 -0.34 -2.26 116.42 121.79 1or4 h ASP 67 Ca -0.05 0.05 -0.07 0.00 0.43 0.00 0.00 57.03 57.38 1or4 h ASP 67 Cb 1.47 -0.05 -0.02 0.00 -0.56 0.00 0.00 39.33 40.17 1or4 h ASP 67 CO 0.14 0.31 0.00 0.00 -1.57 0.00 0.00 179.24 178.12 1or4 h ALA 68 N 1.39 1.14 0.22 3.45 0.00 -1.05 -1.99 119.26 122.41 1or4 h ALA 68 Ca 0.33 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1or4 h ALA 68 Cb 0.28 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1or4 h ALA 68 CO -0.23 0.56 -0.23 0.35 0.00 0.00 0.00 179.25 179.70 1or4 h PHE 69 N 0.71 -0.60 -0.24 0.00 3.57 -0.69 -1.01 116.94 118.68 1or4 h PHE 69 Ca 0.14 0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.47 1or4 h PHE 69 Cb 0.43 0.23 -0.00 0.00 2.79 0.00 0.00 35.95 39.41 1or4 h PHE 69 CO 0.02 -0.33 -0.54 1.88 -2.23 0.00 0.00 178.31 177.10 1or4 h TYR 70 N -0.48 0.91 -0.71 0.41 0.05 -1.47 -1.36 116.97 114.32 1or4 h TYR 70 Ca -0.00 -0.32 0.15 0.00 0.05 0.00 0.00 58.73 58.60 1or4 h TYR 70 Cb 0.45 -0.17 -0.10 0.00 1.01 0.00 0.00 36.73 37.92 1or4 h TYR 70 CO -0.16 1.11 0.18 -0.22 -1.05 0.00 0.00 178.16 178.02 1or4 h LYS 71 N 0.56 0.28 -0.23 4.88 1.63 -1.29 0.27 116.57 122.68 1or4 h LYS 71 Ca 0.01 -0.02 -0.12 0.00 -0.85 0.00 0.00 60.65 59.68 1or4 h LYS 71 Cb 1.12 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.68 1or4 h LYS 71 CO 0.11 0.19 -0.36 -0.97 -3.45 0.00 0.00 179.45 174.97 1or4 h ASN 72 N 0.29 0.52 -0.35 4.20 -1.24 -0.71 -2.63 115.58 115.66 1or4 h ASN 72 Ca 0.39 -0.21 -0.05 0.00 0.71 0.00 0.00 56.30 57.14 1or4 h ASN 72 Cb 0.64 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.52 1or4 h ASN 72 CO -0.47 0.83 0.07 -0.07 -1.29 0.00 0.00 177.43 176.50 1or4 h LEU 73 N 0.42 0.62 -0.31 0.34 4.07 0.12 -3.07 115.31 117.49 1or4 h LEU 73 Ca 0.04 -0.11 0.00 0.00 0.08 0.00 0.00 57.88 57.89 1or4 h LEU 73 Cb 0.82 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.40 1or4 h LEU 73 CO 0.07 0.65 0.10 0.47 -1.08 0.00 0.00 178.44 178.64 1or4 n ASP 74 N -4.28 0.12 0.00 -0.43 8.00 -0.46 -0.48 116.55 119.02 1or4 n ASP 74 Ca 0.03 0.48 0.12 0.00 0.71 0.00 0.00 54.79 56.13 1or4 n ASP 74 Cb 0.23 -0.49 0.55 0.00 -0.02 0.00 0.00 41.12 41.39 1or4 n ASP 74 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1or4 n HIS 75 N -1.61 0.00 -3.88 1.24 -0.00 -1.16 -4.30 115.22 105.50 1or4 n HIS 75 Ca -0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.41 1or4 n HIS 75 Cb 0.10 -0.48 -0.15 0.00 -0.00 0.00 0.00 29.99 29.47 1or4 n HIS 75 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.34 174.34 1or4 s GLU 76 N -2.96 1.31 0.41 -0.41 2.56 0.36 -5.00 118.70 114.97 1or4 s GLU 76 Ca 0.13 -1.78 0.19 0.00 0.00 0.00 0.00 54.97 53.51 1or4 s GLU 76 Cb 0.17 -2.75 1.12 0.00 2.00 0.00 0.00 34.13 34.66 1or4 s GLU 76 CO 0.45 -1.01 1.81 1.03 -0.56 0.00 0.00 175.26 176.98 1or4 h SER 77 N 7.44 0.41 1.04 -1.70 0.87 -1.81 0.16 113.55 119.97 1or4 h SER 77 Ca -0.07 0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.50 1or4 h SER 77 Cb 0.98 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.93 1or4 h SER 77 CO 0.53 0.12 -0.24 0.77 -0.53 0.00 0.00 176.83 177.48 1or4 h SER 78 N 0.38 0.00 -0.16 6.23 4.64 -1.94 -1.50 113.55 121.20 1or4 h SER 78 Ca 0.54 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.67 1or4 h SER 78 Cb 1.40 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.50 1or4 h SER 78 CO -0.23 0.24 -0.65 -0.07 -0.87 0.00 0.00 176.83 175.25 1or4 h LEU 79 N 0.00 0.85 -1.05 5.97 3.38 -0.98 -2.54 115.31 120.94 1or4 h LEU 79 Ca -0.00 -0.61 -0.06 0.00 0.09 0.00 0.00 57.88 57.29 1or4 h LEU 79 Cb 0.82 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1or4 h LEU 79 CO 0.03 1.32 -0.29 0.24 0.09 0.00 0.00 178.44 179.84 1or4 h MET 80 N 0.43 0.00 -0.42 1.13 2.86 -1.46 -2.10 114.93 115.37 1or4 h MET 80 Ca -0.04 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 1or4 h MET 80 Cb 1.28 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.93 1or4 h MET 80 CO 0.14 0.29 -0.00 -0.44 1.06 0.00 0.00 176.91 177.95 1or4 h ASP 81 N 0.00 0.73 -0.97 1.22 3.45 -1.14 0.56 116.42 120.28 1or4 h ASP 81 Ca -0.00 -0.31 0.01 0.00 0.43 0.00 0.00 57.03 57.16 1or4 h ASP 81 Cb 0.80 -0.20 -0.05 0.00 -0.56 0.00 0.00 39.33 39.33 1or4 h ASP 81 CO 0.04 0.86 0.64 0.40 -1.57 0.00 0.00 179.24 179.61 1or4 h ILE 82 N 0.58 1.23 -0.21 0.35 2.04 -1.07 -0.76 117.51 119.67 1or4 h ILE 82 Ca 0.12 -0.44 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 1or4 h ILE 82 Cb 0.49 -0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 1or4 h ILE 82 CO 0.02 0.24 -0.06 0.40 0.00 0.00 0.00 178.15 178.75 1or4 h ILE 83 N 1.29 1.29 0.00 -0.67 2.04 -1.11 -2.90 117.51 117.45 1or4 h ILE 83 Ca 0.36 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 65.15 1or4 h ILE 83 Cb -0.12 1.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1or4 h ILE 83 CO -0.08 0.32 0.00 0.78 0.00 0.00 0.00 178.15 179.17 1or4 h ASN 84 N 0.13 0.00 0.05 1.72 -0.26 -0.64 0.11 115.58 116.68 1or4 h ASN 84 Ca 0.05 0.00 -0.17 0.00 -0.56 0.00 0.00 56.30 55.62 1or4 h ASN 84 Cb 0.52 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.78 1or4 h ASN 84 CO 0.02 0.00 -0.59 -0.78 -1.06 0.00 0.00 177.43 175.02 1or4 h ASP 85 N 0.00 0.62 0.00 5.81 3.58 -1.04 -3.38 116.42 122.01 1or4 h ASP 85 Ca 0.00 -0.35 -0.17 0.00 0.42 0.00 0.00 57.03 56.93 1or4 h ASP 85 Cb 0.63 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.47 1or4 h ASP 85 CO 0.00 1.07 -1.88 1.41 -2.88 0.00 0.00 179.24 176.96 1or4 n HIS 86 N -3.94 0.00 0.00 0.28 8.25 -1.11 -5.09 115.22 113.62 1or4 n HIS 86 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 1or4 n HIS 86 Cb 0.63 -0.58 0.00 0.00 1.12 0.00 0.00 29.99 31.16 1or4 n HIS 86 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1or4 n SER 87 N -2.36 2.67 -3.50 0.41 2.88 0.35 -5.10 113.62 108.98 1or4 n SER 87 Ca -0.16 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.29 1or4 n SER 87 Cb 0.77 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.21 1or4 n SER 87 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1or4 s SER 88 N 2.00 -0.39 0.41 -3.46 1.04 -1.21 -4.27 113.70 107.82 1or4 s SER 88 Ca 0.00 0.05 0.09 0.00 0.48 0.00 0.00 55.95 56.57 1or4 s SER 88 Cb 0.00 0.40 0.86 0.00 0.10 0.00 0.00 66.02 67.38 1or4 s SER 88 CO 0.00 -0.63 2.00 0.58 0.98 0.00 0.00 173.24 176.17 1or4 h VAL 89 N 2.07 1.12 -0.13 5.02 2.07 -1.98 0.15 116.25 124.58 1or4 h VAL 89 Ca -0.23 -0.42 -0.14 0.00 0.82 0.00 0.00 66.70 66.73 1or4 h VAL 89 Cb 1.24 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1or4 h VAL 89 CO 0.32 0.15 -0.46 0.44 0.02 0.00 0.00 177.57 178.04 1or4 h ASP 90 N 0.37 0.62 -0.24 0.57 3.45 -2.00 -0.01 116.42 119.19 1or4 h ASP 90 Ca 0.09 -0.62 -0.12 0.00 0.43 0.00 0.00 57.03 56.81 1or4 h ASP 90 Cb 0.13 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.71 1or4 h ASP 90 CO -0.01 1.13 -0.28 -0.09 -1.57 0.00 0.00 179.24 178.43 1or4 h ARG 91 N 0.15 0.74 -0.55 3.56 2.43 -1.85 -3.18 114.38 115.68 1or4 h ARG 91 Ca -0.02 -0.32 -0.08 0.00 -0.81 0.00 0.00 59.98 58.75 1or4 h ARG 91 Cb 1.09 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.60 1or4 h ARG 91 CO 0.10 0.93 0.02 -0.07 -1.51 0.00 0.00 179.97 179.44 1or4 h LEU 92 N 0.63 0.89 -2.29 3.80 3.38 -0.56 -2.19 115.31 118.97 1or4 h LEU 92 Ca 0.08 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1or4 h LEU 92 Cb 0.79 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 1or4 h LEU 92 CO 0.07 0.94 -0.05 0.11 0.09 0.00 0.00 178.44 179.59 1or4 h LYS 93 N 0.85 0.00 -0.22 1.13 1.57 -0.98 -1.37 116.57 117.55 1or4 h LYS 93 Ca 0.16 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.80 1or4 h LYS 93 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1or4 h LYS 93 CO 0.02 0.05 -0.43 1.96 -0.57 0.00 0.00 179.45 180.48 1or4 h GLN 94 N 0.00 0.68 0.00 3.15 4.20 -1.41 -1.47 115.11 120.26 1or4 h GLN 94 Ca -0.00 -0.44 -0.07 0.00 0.06 0.00 0.00 58.65 58.20 1or4 h GLN 94 Cb 0.18 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1or4 h GLN 94 CO 0.01 1.06 -0.34 1.79 -0.67 0.00 0.00 178.83 180.67 1or4 h THR 95 N 0.39 0.79 0.06 -0.54 1.35 -1.45 -3.10 112.91 110.41 1or4 h THR 95 Ca 0.01 -1.48 -0.24 0.00 -0.55 0.00 0.00 66.41 64.15 1or4 h THR 95 Cb 1.04 1.93 0.00 0.00 -1.73 0.00 0.00 68.15 69.39 1or4 h THR 95 CO 0.10 0.34 -1.06 0.25 -0.25 0.00 0.00 175.52 174.89 1or4 h LEU 96 N 0.00 0.46 -0.85 3.87 5.85 -1.13 -0.98 115.31 122.53 1or4 h LEU 96 Ca -0.00 -0.42 0.09 0.00 0.84 0.00 0.00 57.88 58.38 1or4 h LEU 96 Cb 0.90 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.72 1or4 h LEU 96 CO 0.04 1.26 0.51 0.11 -0.34 0.00 0.00 178.44 180.02 1or4 h LYS 97 N 0.15 0.85 -0.00 1.25 1.57 -1.26 0.40 116.57 119.53 1or4 h LYS 97 Ca -0.10 -0.05 -0.25 0.00 -1.87 0.00 0.00 60.65 58.38 1or4 h LYS 97 Cb 1.74 -0.19 0.02 0.00 0.08 0.00 0.00 32.23 33.88 1or4 h LYS 97 CO 0.18 0.56 -0.96 -0.09 -0.57 0.00 0.00 179.45 178.57 1or4 h ARG 98 N 0.87 0.66 -0.06 3.15 9.65 -1.45 -2.22 114.38 124.98 1or4 h ARG 98 Ca 0.40 -0.70 -0.00 0.00 -1.10 0.00 0.00 59.98 58.57 1or4 h ARG 98 Cb 0.31 0.20 -0.00 0.00 -1.39 0.00 0.00 29.97 29.08 1or4 h ARG 98 CO -0.22 1.29 0.03 1.25 2.80 0.00 0.00 179.97 185.12 1or4 h HIS 99 N 0.32 0.09 -0.65 2.20 2.76 -1.01 0.98 115.15 119.84 1or4 h HIS 99 Ca -0.12 -0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.01 1or4 h HIS 99 Cb 1.63 -0.03 -0.03 0.00 1.55 0.00 0.00 27.41 30.53 1or4 h HIS 99 CO 0.11 0.14 0.24 0.82 -1.30 0.00 0.00 177.93 177.93 1or4 h ILE 100 N 0.01 1.24 -0.67 6.26 2.04 -0.97 -2.66 117.51 122.75 1or4 h ILE 100 Ca 0.02 -0.79 -0.05 0.00 1.00 0.00 0.00 64.86 65.04 1or4 h ILE 100 Cb 0.08 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 1or4 h ILE 100 CO -0.00 0.31 0.21 1.56 0.00 0.00 0.00 178.15 180.22 1or4 h GLN 101 N 0.92 1.03 0.00 2.37 4.20 -1.25 0.35 115.11 122.74 1or4 h GLN 101 Ca 0.21 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1or4 h GLN 101 Cb 0.24 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.86 1or4 h GLN 101 CO -0.01 0.89 0.00 0.93 -0.67 0.00 0.00 178.83 179.96 1or4 h GLU 102 N 1.00 0.00 0.00 1.46 5.08 -0.52 -2.37 114.58 119.23 1or4 h GLU 102 Ca 0.22 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.54 1or4 h GLU 102 Cb 0.29 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1or4 h GLU 102 CO -0.01 0.00 -0.19 0.52 -1.00 0.00 0.00 179.01 178.33 1or4 h MET 103 N 0.00 0.00 -0.45 2.33 2.86 -0.59 -2.81 114.93 116.27 1or4 h MET 103 Ca 0.00 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.50 1or4 h MET 103 Cb 0.11 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.68 1or4 h MET 103 CO 0.00 0.19 0.08 1.19 1.06 0.00 0.00 176.91 179.43 1or4 n PHE 104 N -3.35 1.48 0.22 -0.22 3.72 -0.89 -4.51 117.46 113.91 1or4 n PHE 104 Ca 0.00 -1.25 0.08 0.00 -0.05 0.00 0.00 57.45 56.23 1or4 n PHE 104 Cb 0.41 -0.50 0.48 0.00 -0.94 0.00 0.00 39.48 38.93 1or4 n PHE 104 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1or4 h ALA 105 N 1.70 1.14 0.00 4.37 0.00 -1.55 -3.24 119.26 121.68 1or4 h ALA 105 Ca 0.18 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1or4 h ALA 105 Cb 1.82 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1or4 h ALA 105 CO 0.46 0.33 0.00 0.41 0.00 0.00 0.00 179.25 180.45 1or4 n GLY 106 N -0.16 0.60 3.35 0.00 0.00 -1.26 -4.66 105.19 103.06 1or4 n GLY 106 Ca -0.01 -0.58 -0.09 0.00 0.00 0.00 0.00 46.02 45.34 1or4 n GLY 106 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1or4 s VAL 107 N -2.00 -0.21 -0.28 1.61 1.01 -1.26 -4.61 120.40 114.66 1or4 s VAL 107 Ca 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 61.98 62.01 1or4 s VAL 107 Cb 0.00 -0.71 0.01 0.00 0.00 0.00 0.00 36.38 35.68 1or4 s VAL 107 CO 0.00 0.04 0.04 -0.63 0.00 0.00 0.00 175.10 174.55 1or4 s ILE 108 N 1.80 3.76 0.43 2.22 -1.09 0.83 -4.96 121.20 124.19 1or4 s ILE 108 Ca -0.08 -0.68 0.03 0.00 -2.23 0.00 0.00 60.65 57.70 1or4 s ILE 108 Cb -0.09 -2.90 -0.02 0.00 -1.58 0.00 0.00 42.46 37.87 1or4 s ILE 108 CO -0.14 0.15 0.11 1.51 -1.23 0.00 0.00 174.94 175.34 1or4 s ASP 109 N 1.48 3.08 0.30 3.58 3.84 -1.26 -0.75 116.67 126.95 1or4 s ASP 109 Ca 0.03 -1.68 0.02 0.00 -0.00 0.00 0.00 52.55 50.92 1or4 s ASP 109 Cb -0.17 0.53 0.58 0.00 -1.38 0.00 0.00 42.92 42.49 1or4 s ASP 109 CO 0.01 -0.93 1.88 0.44 -0.00 0.00 0.00 175.17 176.57 1or4 h ASP 110 N 1.69 0.87 0.14 2.11 3.45 -1.97 -1.51 116.42 121.20 1or4 h ASP 110 Ca -0.37 0.02 -0.17 0.00 0.43 0.00 0.00 57.03 56.94 1or4 h ASP 110 Cb 1.28 -0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 39.89 1or4 h ASP 110 CO 0.60 0.52 -0.65 -0.08 -1.57 0.00 0.00 179.24 178.05 1or4 h GLU 111 N 0.96 0.49 -0.10 3.56 4.57 -1.96 0.21 114.58 122.32 1or4 h GLU 111 Ca 0.43 -0.35 0.03 0.00 -1.18 0.00 0.00 59.36 58.29 1or4 h GLU 111 Cb 0.37 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.99 1or4 h GLU 111 CO -0.19 0.97 -0.08 0.35 -1.18 0.00 0.00 179.01 178.88 1or4 h PHE 112 N 0.35 -0.21 -0.42 0.92 3.57 -1.68 -0.02 116.94 119.45 1or4 h PHE 112 Ca -0.01 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.51 1or4 h PHE 112 Cb 1.21 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 40.03 1or4 h PHE 112 CO 0.05 -0.13 0.26 0.82 -2.23 0.00 0.00 178.31 177.07 1or4 h ILE 113 N -0.10 1.07 -0.66 1.41 1.08 -1.18 -2.71 117.51 116.42 1or4 h ILE 113 Ca 0.07 -0.18 -0.01 0.00 -0.39 0.00 0.00 64.86 64.35 1or4 h ILE 113 Cb 0.20 0.50 -0.03 0.00 -3.07 0.00 0.00 36.82 34.41 1or4 h ILE 113 CO -0.16 0.10 0.37 -0.33 -0.69 0.00 0.00 178.15 177.44 1or4 h GLU 114 N 0.53 0.91 -0.23 2.37 5.08 -0.13 -1.65 114.58 121.45 1or4 h GLU 114 Ca 0.16 -0.09 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 1or4 h GLU 114 Cb -0.02 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 1or4 h GLU 114 CO -0.06 0.66 -0.13 0.87 -1.00 0.00 0.00 179.01 179.35 1or4 h LYS 115 N 0.92 0.50 -0.91 2.33 1.57 -0.86 -2.16 116.57 117.96 1or4 h LYS 115 Ca 0.24 -0.22 0.12 0.00 -1.87 0.00 0.00 60.65 58.91 1or4 h LYS 115 Cb 0.01 -0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.22 1or4 h LYS 115 CO -0.04 0.78 0.54 0.00 -0.57 0.00 0.00 179.45 180.15 1or4 h ARG 116 N 0.21 0.83 0.22 3.15 -0.00 -1.14 0.35 114.38 118.00 1or4 h ARG 116 Ca 0.05 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.98 59.47 1or4 h ARG 116 Cb 0.64 -0.19 0.00 0.00 0.00 0.00 0.00 29.97 30.42 1or4 h ARG 116 CO 0.04 0.55 -0.11 -0.91 0.00 0.00 0.00 179.97 179.54 1or4 h ASN 117 N 0.85 -0.26 -0.84 7.04 2.35 -1.23 0.13 115.58 123.62 1or4 h ASN 117 Ca 0.45 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 56.17 1or4 h ASN 117 Cb 0.47 0.07 -0.04 0.00 0.05 0.00 0.00 38.32 38.87 1or4 h ASN 117 CO -0.28 -0.14 0.51 0.03 -1.65 0.00 0.00 177.43 175.90 1or4 h ARG 118 N -0.35 1.15 -0.10 0.81 3.08 -0.57 -1.85 114.38 116.55 1or4 h ARG 118 Ca -0.03 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 59.84 1or4 h ARG 118 Cb 0.27 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1or4 h ARG 118 CO 0.05 0.81 -0.27 0.82 -1.07 0.00 0.00 179.97 180.31 1or4 h ILE 119 N 1.17 1.24 0.70 2.04 5.03 -0.20 -2.49 117.51 125.00 1or4 h ILE 119 Ca 0.30 -1.11 -0.03 0.00 -0.12 0.00 0.00 64.86 63.90 1or4 h ILE 119 Cb -0.04 1.46 0.01 0.00 -3.03 0.00 0.00 36.82 35.21 1or4 h ILE 119 CO -0.06 0.33 -0.34 0.00 -0.68 0.00 0.00 178.15 177.41 1or4 h ALA 120 N 1.56 -0.94 -0.62 1.87 0.00 -0.13 -3.03 119.26 117.97 1or4 h ALA 120 Ca 0.03 -0.21 0.15 0.00 0.00 0.00 0.00 54.91 54.87 1or4 h ALA 120 Cb 0.57 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1or4 h ALA 120 CO 0.04 -0.99 0.43 1.03 0.00 0.00 0.00 179.25 179.76 1or4 h SER 121 N -1.01 0.19 -0.73 0.00 0.87 -1.32 0.76 113.55 112.30 1or4 h SER 121 Ca -0.10 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1or4 h SER 121 Cb 0.74 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.63 1or4 h SER 121 CO 0.16 0.10 0.44 0.40 -0.53 0.00 0.00 176.83 177.40 1or4 h ILE 122 N 0.20 1.21 -0.08 2.23 2.04 -1.36 -1.69 117.51 120.06 1or4 h ILE 122 Ca 0.30 -0.46 -0.10 0.00 1.00 0.00 0.00 64.86 65.60 1or4 h ILE 122 Cb 0.90 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1or4 h ILE 122 CO -0.05 0.22 -0.39 0.45 0.00 0.00 0.00 178.15 178.37 1or4 h HIS 123 N 1.00 0.19 -0.03 1.37 3.86 0.64 -1.85 115.15 120.33 1or4 h HIS 123 Ca 0.26 -0.05 -0.18 0.00 -1.16 0.00 0.00 60.37 59.24 1or4 h HIS 123 Cb -0.03 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.39 1or4 h HIS 123 CO -0.01 0.54 -0.78 1.37 0.86 0.00 0.00 177.93 179.91 1or4 h LEU 124 N 0.14 0.32 -1.21 2.43 8.10 -1.08 -1.31 115.31 122.70 1or4 h LEU 124 Ca 0.01 -0.23 -0.08 0.00 0.11 0.00 0.00 57.88 57.70 1or4 h LEU 124 Cb 0.76 -0.09 -0.01 0.00 -0.44 0.00 0.00 40.66 40.87 1or4 h LEU 124 CO 0.06 0.98 -0.32 0.03 -4.11 0.00 0.00 178.44 175.08 1or4 h ARG 125 N 0.16 0.13 -0.00 0.17 2.47 -0.91 -2.32 114.38 114.09 1or4 h ARG 125 Ca -0.03 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.64 1or4 h ARG 125 Cb 1.36 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.67 1or4 h ARG 125 CO 0.12 0.44 -0.10 0.44 0.56 0.00 0.00 179.97 181.44 1or4 n ILE 126 N -4.13 0.00 -0.81 2.04 -5.35 -0.73 -4.93 119.36 105.46 1or4 n ILE 126 Ca -0.01 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 1or4 n ILE 126 Cb 0.39 -0.23 0.00 0.00 -1.74 0.00 0.00 39.64 38.06 1or4 n ILE 126 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1or4 n GLY 127 N 1.33 0.60 3.66 3.28 0.00 -0.87 -5.02 105.19 108.16 1or4 n GLY 127 Ca 0.13 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 1or4 n GLY 127 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1or4 s LEU 128 N 0.00 4.21 0.27 0.99 2.96 -0.52 -4.99 118.68 121.60 1or4 s LEU 128 Ca 0.00 1.81 -0.30 0.00 -0.22 0.00 0.00 54.13 55.43 1or4 s LEU 128 Cb 0.00 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 43.05 1or4 s LEU 128 CO 0.00 -0.80 1.36 -0.76 -1.32 0.00 0.00 176.35 174.83 1or4 s LEU 129 N 3.61 4.41 0.51 -0.68 1.43 -1.26 -4.69 118.68 122.01 1or4 s LEU 129 Ca 0.59 2.62 0.25 0.00 -1.03 0.00 0.00 54.13 56.56 1or4 s LEU 129 Cb -0.24 -3.63 1.36 0.00 0.03 0.00 0.00 46.19 43.71 1or4 s LEU 129 CO 0.18 -0.60 2.05 -0.65 0.23 0.00 0.00 176.35 177.57 1or4 h PRO 130 N 4.44 0.00 -0.25 1.29 0.11 -1.98 -0.84 132.00 134.78 1or4 h PRO 130 Ca -0.47 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1or4 h PRO 130 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1or4 h PRO 130 CO 0.73 0.13 0.15 1.57 -0.21 0.00 0.00 178.00 180.38 1or4 h LYS 131 N 0.00 0.34 0.03 1.05 2.10 -1.99 -0.34 116.57 117.77 1or4 h LYS 131 Ca -0.00 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1or4 h LYS 131 Cb 0.34 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.60 1or4 h LYS 131 CO 0.02 0.26 -0.02 -1.49 -2.00 0.00 0.00 179.45 176.22 1or4 h TRP 132 N 0.32 -0.04 -0.90 0.07 -0.00 -1.64 0.47 115.95 114.22 1or4 h TRP 132 Ca 0.09 -0.00 0.18 0.00 -0.00 0.00 0.00 58.89 59.15 1or4 h TRP 132 Cb 0.00 0.01 -0.17 0.00 -0.00 0.00 0.00 29.16 29.01 1or4 h TRP 132 CO -0.05 0.30 -0.25 -0.92 -0.00 0.00 0.00 178.44 177.53 1or4 h TYR 133 N -0.39 -0.55 -0.20 0.49 -0.00 -1.20 -1.20 116.97 113.91 1or4 h TYR 133 Ca -0.00 0.08 -0.02 0.00 -0.00 0.00 0.00 58.73 58.79 1or4 h TYR 133 Cb 0.36 0.38 -0.01 0.00 -0.00 0.00 0.00 36.73 37.47 1or4 h TYR 133 CO 0.04 -0.39 0.04 1.98 -0.00 0.00 0.00 178.16 179.84 1or4 h MET 134 N -0.01 0.33 -0.99 1.82 4.05 -0.59 -2.94 114.93 116.61 1or4 h MET 134 Ca 0.42 -0.08 0.03 0.00 -0.28 0.00 0.00 59.70 59.79 1or4 h MET 134 Cb 0.65 -0.04 -0.06 0.00 -0.80 0.00 0.00 31.60 31.35 1or4 h MET 134 CO -0.93 0.47 0.65 0.78 0.23 0.00 0.00 176.91 178.11 1or4 h GLY 135 N 0.14 1.44 0.95 1.39 0.00 -0.16 -2.44 103.07 104.38 1or4 h GLY 135 Ca 0.06 -0.50 0.10 0.00 0.00 0.00 0.00 47.33 47.00 1or4 h GLY 135 CO 0.00 0.43 0.43 0.00 0.00 0.00 0.00 176.54 177.40 1or4 h ALA 136 N 1.40 2.03 0.00 3.60 0.00 -1.05 0.14 119.26 125.38 1or4 h ALA 136 Ca 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1or4 h ALA 136 Cb -0.01 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1or4 h ALA 136 CO -0.12 -0.61 -0.24 0.74 0.00 0.00 0.00 179.25 179.02 1or4 h PHE 137 N 0.00 0.00 0.06 0.00 0.04 -1.49 -3.26 116.94 112.30 1or4 h PHE 137 Ca 0.17 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.69 1or4 h PHE 137 Cb 1.02 0.00 0.02 0.00 2.20 0.00 0.00 35.95 39.19 1or4 h PHE 137 CO 0.00 0.00 -1.04 0.37 -0.60 0.00 0.00 178.31 177.04 1or4 h GLN 138 N 0.00 0.59 -0.56 1.51 5.75 -0.80 -2.52 115.11 119.08 1or4 h GLN 138 Ca 0.00 -0.72 0.09 0.00 -0.15 0.00 0.00 58.65 57.87 1or4 h GLN 138 Cb 0.88 0.23 -0.07 0.00 1.07 0.00 0.00 27.48 29.58 1or4 h GLN 138 CO 0.00 1.31 0.16 1.49 -2.65 0.00 0.00 178.83 179.14 1or4 h GLU 139 N 0.20 0.31 0.02 1.69 4.57 -1.61 -0.91 114.58 118.84 1or4 h GLU 139 Ca -0.15 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.01 1or4 h GLU 139 Cb 1.72 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 30.24 1or4 h GLU 139 CO 0.20 0.20 -0.01 -0.07 -1.18 0.00 0.00 179.01 178.16 1or4 h LEU 140 N 0.32 -0.02 -0.70 1.64 3.38 -1.59 -1.81 115.31 116.52 1or4 h LEU 140 Ca 0.28 -0.19 0.14 0.00 0.09 0.00 0.00 57.88 58.21 1or4 h LEU 140 Cb 0.37 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.03 1or4 h LEU 140 CO -0.33 0.18 0.18 0.25 0.09 0.00 0.00 178.44 178.81 1or4 h LEU 141 N -0.22 0.05 0.02 1.67 5.85 -1.00 0.19 115.31 121.87 1or4 h LEU 141 Ca -0.00 0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 1or4 h LEU 141 Cb 0.21 0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.41 1or4 h LEU 141 CO 0.00 -0.00 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.02 1or4 h LEU 142 N 0.30 -0.02 -1.23 2.25 4.07 -1.16 0.54 115.31 120.05 1or4 h LEU 142 Ca 0.39 -0.10 0.00 0.00 0.08 0.00 0.00 57.88 58.25 1or4 h LEU 142 Cb 0.63 0.01 -0.04 0.00 1.08 0.00 0.00 40.66 42.34 1or4 h LEU 142 CO -0.46 0.09 0.49 0.28 -1.08 0.00 0.00 178.44 177.76 1or4 h SER 143 N -0.14 0.88 -0.32 -0.43 0.02 -0.88 0.78 113.55 113.47 1or4 h SER 143 Ca -0.00 -0.03 -0.13 0.00 -0.84 0.00 0.00 61.79 60.78 1or4 h SER 143 Cb 0.13 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.44 1or4 h SER 143 CO 0.00 0.65 -0.32 0.24 -1.14 0.00 0.00 176.83 176.26 1or4 h MET 144 N 1.04 0.78 0.00 3.45 2.86 -0.15 -1.69 114.93 121.21 1or4 h MET 144 Ca 0.28 -0.41 -0.08 0.00 -2.06 0.00 0.00 59.70 57.42 1or4 h MET 144 Cb -0.10 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 1or4 h MET 144 CO -0.06 1.04 -0.38 0.82 1.06 0.00 0.00 176.91 179.39 1or4 h ILE 145 N 0.55 1.20 0.13 -1.22 2.04 0.41 -1.77 117.51 118.85 1or4 h ILE 145 Ca 0.05 -1.34 -0.01 0.00 1.00 0.00 0.00 64.86 64.56 1or4 h ILE 145 Cb 0.90 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 1or4 h ILE 145 CO 0.08 0.37 -0.06 0.44 0.00 0.00 0.00 178.15 178.98 1or4 h ASP 146 N 0.00 -0.15 -0.70 1.72 5.19 -0.56 -1.85 116.42 120.06 1or4 h ASP 146 Ca -0.00 -0.28 0.10 0.00 -0.62 0.00 0.00 57.03 56.22 1or4 h ASP 146 Cb 0.71 0.04 -0.07 0.00 0.18 0.00 0.00 39.33 40.18 1or4 h ASP 146 CO 0.05 0.22 0.33 0.40 -3.12 0.00 0.00 179.24 177.12 1or4 h ILE 147 N -0.54 0.81 0.00 0.35 2.04 -1.14 -1.68 117.51 117.35 1or4 h ILE 147 Ca -0.02 -0.19 -0.07 0.00 1.00 0.00 0.00 64.86 65.58 1or4 h ILE 147 Cb 0.42 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1or4 h ILE 147 CO 0.03 0.10 -0.32 1.88 0.00 0.00 0.00 178.15 179.84 1or4 h TYR 148 N 0.55 0.00 0.00 1.37 0.05 -1.24 -1.03 116.97 116.68 1or4 h TYR 148 Ca 0.35 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.98 1or4 h TYR 148 Cb 0.41 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.13 1or4 h TYR 148 CO -0.12 0.32 -0.73 1.49 -1.05 0.00 0.00 178.16 178.06 1or4 h GLU 149 N 0.00 0.00 0.00 4.88 4.81 -0.46 0.12 114.58 123.94 1or4 h GLU 149 Ca -0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1or4 h GLU 149 Cb 0.61 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.98 1or4 h GLU 149 CO 0.04 0.73 -0.15 0.00 -0.73 0.00 0.00 179.01 178.90 1or4 h ALA 150 N 1.27 0.90 0.00 2.92 0.00 -0.98 -3.38 119.26 120.00 1or4 h ALA 150 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1or4 h ALA 150 Cb 1.32 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1or4 h ALA 150 CO 0.10 0.18 -0.88 0.43 0.00 0.00 0.00 179.25 179.08 1or4 n SER 151 N -3.14 1.76 -3.89 0.00 7.64 -0.43 -4.96 113.62 110.61 1or4 n SER 151 Ca 0.03 -0.34 -0.28 0.00 1.01 0.00 0.00 58.87 59.29 1or4 n SER 151 Cb 0.59 1.19 -0.16 0.00 -1.01 0.00 0.00 64.21 64.81 1or4 n SER 151 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1or4 s ILE 152 N -2.16 1.11 -0.09 0.44 1.01 0.40 -5.00 121.20 116.91 1or4 s ILE 152 Ca -0.00 -0.66 -0.19 0.00 0.00 0.00 0.00 60.65 59.80 1or4 s ILE 152 Cb 0.06 -1.31 -0.28 0.00 0.01 0.00 0.00 42.46 40.94 1or4 s ILE 152 CO 0.33 0.10 0.68 0.74 0.00 0.00 0.00 174.94 176.79 1or4 h THR 153 N 6.40 1.23 -2.98 2.92 2.02 -1.90 -3.43 112.91 117.18 1or4 h THR 153 Ca -0.23 -2.44 -0.53 0.00 0.77 0.00 0.00 66.41 63.97 1or4 h THR 153 Cb 1.11 2.90 0.01 0.00 -1.74 0.00 0.00 68.15 70.43 1or4 h THR 153 CO 0.40 0.69 0.75 0.21 0.37 0.00 0.00 175.52 177.94 1or4 s ASN 154 N -6.98 6.85 0.36 4.18 2.47 -1.26 -4.87 114.94 115.69 1or4 s ASN 154 Ca -0.18 2.24 0.05 0.00 0.42 0.00 0.00 52.86 55.39 1or4 s ASN 154 Cb 0.03 -2.58 0.69 0.00 -1.45 0.00 0.00 41.25 37.94 1or4 s ASN 154 CO 0.78 -0.67 1.94 -0.61 -3.72 0.00 0.00 177.10 174.83 1or4 h GLN 155 N 7.19 0.53 -0.12 0.43 4.15 -1.99 -0.06 115.11 125.25 1or4 h GLN 155 Ca -0.41 -0.08 -0.10 0.00 0.77 0.00 0.00 58.65 58.83 1or4 h GLN 155 Cb 1.20 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.80 1or4 h GLN 155 CO 0.87 0.48 -0.33 1.96 -1.93 0.00 0.00 178.83 179.89 1or4 h GLN 156 N 0.53 0.43 -0.58 1.69 1.08 -1.97 -0.57 115.11 115.72 1or4 h GLN 156 Ca 0.12 -0.31 -0.01 0.00 -1.45 0.00 0.00 58.65 57.01 1or4 h GLN 156 Cb 0.19 0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.64 1or4 h GLN 156 CO -0.01 0.92 0.33 0.93 -0.95 0.00 0.00 178.83 180.06 1or4 h GLU 157 N 0.01 0.78 -0.17 1.46 5.08 -1.86 -0.35 114.58 119.53 1or4 h GLU 157 Ca -0.01 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1or4 h GLU 157 Cb 0.95 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 1or4 h GLU 157 CO 0.07 0.56 0.07 1.25 -1.00 0.00 0.00 179.01 179.97 1or4 h LEU 158 N 0.80 0.23 -0.67 1.33 5.85 -0.80 -1.16 115.31 120.89 1or4 h LEU 158 Ca 0.21 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1or4 h LEU 158 Cb -0.01 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 1or4 h LEU 158 CO -0.04 0.32 0.44 -0.07 -0.34 0.00 0.00 178.44 178.75 1or4 h LEU 159 N 0.13 0.77 -0.72 2.25 3.38 -0.77 -2.11 115.31 118.25 1or4 h LEU 159 Ca 0.06 -0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.12 1or4 h LEU 159 Cb 0.16 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 40.63 1or4 h LEU 159 CO -0.01 0.57 0.32 0.50 0.09 0.00 0.00 178.44 179.91 1or4 h LYS 160 N 0.91 0.49 -0.11 1.13 3.64 -0.88 0.12 116.57 121.87 1or4 h LYS 160 Ca 0.24 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.47 1or4 h LYS 160 Cb -0.09 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.62 1or4 h LYS 160 CO -0.05 0.33 -0.43 0.00 -2.27 0.00 0.00 179.45 177.02 1or4 h ALA 161 N 1.48 0.20 -0.61 5.00 0.00 -1.01 -1.99 119.26 122.33 1or4 h ALA 161 Ca 0.38 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1or4 h ALA 161 Cb 0.49 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1or4 h ALA 161 CO -0.34 0.33 0.37 0.82 0.00 0.00 0.00 179.25 180.44 1or4 h ILE 162 N 0.08 1.18 -0.13 0.00 2.04 -1.20 -1.70 117.51 117.78 1or4 h ILE 162 Ca -0.02 -0.39 0.01 0.00 1.00 0.00 0.00 64.86 65.46 1or4 h ILE 162 Cb 1.07 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 1or4 h ILE 162 CO 0.09 0.18 0.04 0.11 0.00 0.00 0.00 178.15 178.57 1or4 h LYS 163 N 0.82 0.10 -0.32 2.37 1.57 -0.80 -0.71 116.57 119.60 1or4 h LYS 163 Ca 0.22 -0.01 0.05 0.00 -1.87 0.00 0.00 60.65 59.04 1or4 h LYS 163 Cb -0.03 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.21 1or4 h LYS 163 CO -0.04 0.07 0.03 0.00 -0.57 0.00 0.00 179.45 178.94 1or4 h ALA 164 N 1.08 0.32 -0.59 3.86 0.00 -1.29 -1.12 119.26 121.52 1or4 h ALA 164 Ca 0.06 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1or4 h ALA 164 Cb 0.03 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1or4 h ALA 164 CO -0.06 -0.37 0.21 1.15 0.00 0.00 0.00 179.25 180.18 1or4 h THR 165 N 0.13 1.22 -0.53 0.00 2.02 -1.10 -0.78 112.91 113.87 1or4 h THR 165 Ca 0.15 -0.70 -0.07 0.00 0.77 0.00 0.00 66.41 66.56 1or4 h THR 165 Cb 0.19 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 1or4 h THR 165 CO -0.23 0.28 0.04 0.00 0.37 0.00 0.00 175.52 175.98 1or4 h THR 166 N 0.85 1.25 -0.11 3.16 1.03 -0.93 -1.69 112.91 116.46 1or4 h THR 166 Ca 0.20 -0.99 -0.04 0.00 -0.01 0.00 0.00 66.41 65.57 1or4 h THR 166 Cb 0.20 0.79 -0.00 0.00 -1.07 0.00 0.00 68.15 68.07 1or4 h THR 166 CO -0.01 0.36 -0.09 0.11 -0.01 0.00 0.00 175.52 175.87 1or4 h LYS 167 N 0.82 0.25 -0.52 0.00 1.57 0.13 -2.41 116.57 116.40 1or4 h LYS 167 Ca 0.16 -0.13 -0.12 0.00 -1.87 0.00 0.00 60.65 58.70 1or4 h LYS 167 Cb 0.43 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 1or4 h LYS 167 CO 0.02 0.64 -0.13 0.97 -0.57 0.00 0.00 179.45 180.38 1or4 h ILE 168 N -0.14 1.27 -0.24 1.86 6.09 -1.25 -0.81 117.51 124.30 1or4 h ILE 168 Ca 0.02 -1.28 -0.06 0.00 -1.37 0.00 0.00 64.86 62.17 1or4 h ILE 168 Cb 0.59 1.02 -0.01 0.00 0.47 0.00 0.00 36.82 38.88 1or4 h ILE 168 CO 0.02 0.45 -0.10 -0.07 -3.07 0.00 0.00 178.15 175.39 1or4 h LEU 169 N 0.88 0.36 -0.21 2.19 3.38 -1.32 -1.23 115.31 119.35 1or4 h LEU 169 Ca 0.13 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1or4 h LEU 169 Cb 0.70 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1or4 h LEU 169 CO 0.05 0.50 0.05 -1.13 0.09 0.00 0.00 178.44 178.00 1or4 h ASN 170 N 0.36 0.31 -0.44 -0.43 -0.73 -0.89 -1.08 115.58 112.68 1or4 h ASN 170 Ca 0.07 -0.23 0.08 0.00 1.87 0.00 0.00 56.30 58.10 1or4 h ASN 170 Cb 0.39 -0.08 -0.10 0.00 0.27 0.00 0.00 38.32 38.81 1or4 h ASN 170 CO 0.02 0.46 -0.36 0.25 -0.37 0.00 0.00 177.43 177.43 1or4 h LEU 171 N 0.15 -1.21 -1.36 0.34 6.46 -0.90 0.14 115.31 118.95 1or4 h LEU 171 Ca 0.07 0.21 0.10 0.00 -0.12 0.00 0.00 57.88 58.14 1or4 h LEU 171 Cb 0.27 0.56 -0.06 0.00 -0.73 0.00 0.00 40.66 40.70 1or4 h LEU 171 CO 0.00 -0.33 0.52 -0.08 -0.62 0.00 0.00 178.44 177.93 1or4 h GLU 172 N -0.26 0.68 -0.05 1.25 4.57 -0.98 0.25 114.58 120.05 1or4 h GLU 172 Ca 0.17 -0.04 -0.20 0.00 -1.18 0.00 0.00 59.36 58.12 1or4 h GLU 172 Cb 0.56 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.99 1or4 h GLU 172 CO -0.58 0.45 -0.81 1.96 -1.18 0.00 0.00 179.01 178.85 1or4 h GLN 173 N 0.70 0.39 -0.71 1.92 4.20 -0.02 -2.87 115.11 118.73 1or4 h GLN 173 Ca 0.38 -0.36 0.01 0.00 0.06 0.00 0.00 58.65 58.74 1or4 h GLN 173 Cb 0.51 0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.34 1or4 h GLN 173 CO -0.15 1.01 0.47 1.96 -0.67 0.00 0.00 178.83 181.45 1or4 h GLN 174 N 0.25 0.92 -0.06 1.46 4.20 0.21 -1.27 115.11 120.82 1or4 h GLN 174 Ca -0.05 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.50 1or4 h GLN 174 Cb 1.41 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.97 1or4 h GLN 174 CO 0.14 0.61 -0.45 -0.07 -0.67 0.00 0.00 178.83 178.39 1or4 h LEU 175 N 0.95 0.14 -0.36 1.46 3.38 -0.96 -0.50 115.31 119.41 1or4 h LEU 175 Ca 0.26 -0.06 -0.18 0.00 0.09 0.00 0.00 57.88 57.99 1or4 h LEU 175 Cb -0.09 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1or4 h LEU 175 CO -0.06 0.57 -0.55 0.58 0.09 0.00 0.00 178.44 179.07 1or4 h VAL 176 N 0.11 1.29 0.00 1.22 2.07 -1.27 -3.21 116.25 116.46 1or4 h VAL 176 Ca 0.01 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 65.78 1or4 h VAL 176 Cb 0.84 1.66 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 1or4 h VAL 176 CO 0.06 0.56 0.00 -0.07 0.02 0.00 0.00 177.57 178.15 1or4 h LEU 177 N 0.61 0.00 0.00 2.57 -0.00 -0.78 -3.48 115.31 114.24 1or4 h LEU 177 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.89 1or4 h LEU 177 Cb 1.14 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.80 1or4 h LEU 177 CO 0.12 0.00 0.00 1.21 -0.00 0.00 0.00 178.44 179.77