#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ij5 s ALA 5 N 0.00 3.67 0.09 2.41 0.00 -1.26 -5.05 121.76 121.62 3ij5 s ALA 5 Ca 0.00 -0.37 0.10 0.00 0.00 0.00 0.00 51.96 51.68 3ij5 s ALA 5 Cb 0.00 -2.34 -0.03 0.00 0.00 0.00 0.00 23.12 20.74 3ij5 s ALA 5 CO 0.00 0.31 -0.25 0.71 0.00 0.00 0.00 175.76 176.53 3ij5 s TYR 6 N -0.34 2.18 -0.11 0.00 2.02 -1.26 -1.18 117.35 118.65 3ij5 s TYR 6 Ca 0.20 -0.39 0.02 0.00 -0.37 0.00 0.00 57.07 56.52 3ij5 s TYR 6 Cb -0.14 -1.23 -0.01 0.00 -0.40 0.00 0.00 41.96 40.18 3ij5 s TYR 6 CO 0.08 0.23 -0.18 0.42 -1.57 0.00 0.00 175.55 174.53 3ij5 s ILE 7 N -0.97 2.64 0.37 2.71 1.01 -0.13 -4.91 121.20 121.92 3ij5 s ILE 7 Ca 0.11 -0.82 -0.27 0.00 0.00 0.00 0.00 60.65 59.68 3ij5 s ILE 7 Cb -0.10 -2.07 -0.09 0.00 0.01 0.00 0.00 42.46 40.21 3ij5 s ILE 7 CO 0.04 0.54 1.26 -1.81 0.00 0.00 0.00 174.94 174.97 3ij5 s ASP 8 N 0.29 6.57 0.14 3.58 1.01 -1.26 -0.92 116.67 126.08 3ij5 s ASP 8 Ca -0.13 2.57 -0.01 0.00 0.71 0.00 0.00 52.55 55.69 3ij5 s ASP 8 Cb -0.16 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.09 3ij5 s ASP 8 CO 0.07 -0.66 0.06 0.42 0.21 0.00 0.00 175.17 175.26 3ij5 s THR 9 N -1.25 0.15 -1.13 -1.27 -4.23 -1.04 -4.89 115.64 101.98 3ij5 s THR 9 Ca 0.53 -1.93 0.06 0.00 -1.18 0.00 0.00 61.69 59.18 3ij5 s THR 9 Cb -0.37 -2.10 0.06 0.00 1.34 0.00 0.00 72.50 71.44 3ij5 s THR 9 CO 0.47 -0.42 1.13 0.00 -0.54 0.00 0.00 174.62 175.26 3ij5 n TYR 11 N -1.44 0.00 0.00 0.00 4.01 -1.26 -5.10 117.16 113.38 3ij5 n TYR 11 Ca 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 3ij5 n TYR 11 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 3ij5 n TYR 11 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ij5 n GLY 12 N 0.93 0.95 3.77 2.72 0.00 -0.30 -4.91 105.19 108.34 3ij5 n GLY 12 Ca 0.09 -2.26 -0.40 0.00 0.00 0.00 0.00 46.02 43.45 3ij5 n GLY 12 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3ij5 s PRO 13 N -1.11 4.02 -0.05 1.61 0.02 -1.26 -2.50 135.00 135.72 3ij5 s PRO 13 Ca 0.00 2.26 0.04 0.00 0.02 0.00 0.00 61.00 63.32 3ij5 s PRO 13 Cb 0.00 -2.83 -0.00 0.00 0.02 0.00 0.00 34.50 31.69 3ij5 s PRO 13 CO 0.00 -0.49 -0.17 0.08 -0.33 0.00 0.00 177.00 176.09 3ij5 s VAL 14 N -1.21 1.48 0.44 3.83 1.01 -0.10 -4.92 120.40 120.94 3ij5 s VAL 14 Ca 0.55 -0.73 -0.26 0.00 0.00 0.00 0.00 61.98 61.55 3ij5 s VAL 14 Cb -0.40 -1.29 -0.09 0.00 0.00 0.00 0.00 36.38 34.61 3ij5 s VAL 14 CO 0.53 0.43 1.45 0.00 0.00 0.00 0.00 175.10 177.50 3ij5 s ALA 15 N 0.17 3.29 0.35 5.51 0.00 -1.26 -0.96 121.76 128.87 3ij5 s ALA 15 Ca -0.07 1.51 0.08 0.00 0.00 0.00 0.00 51.96 53.47 3ij5 s ALA 15 Cb -0.13 -3.60 0.77 0.00 0.00 0.00 0.00 23.12 20.16 3ij5 s ALA 15 CO 0.03 -1.21 1.89 0.22 0.00 0.00 0.00 175.76 176.69 3ij5 h ASP 16 N 2.39 0.68 -0.65 0.00 3.58 -1.50 -1.43 116.42 119.49 3ij5 h ASP 16 Ca -0.51 0.03 0.09 0.00 0.42 0.00 0.00 57.03 57.06 3ij5 h ASP 16 Cb 1.26 -0.11 -0.07 0.00 1.72 0.00 0.00 39.33 42.13 3ij5 h ASP 16 CO 0.61 0.38 0.29 -0.78 -2.88 0.00 0.00 179.24 176.86 3ij5 h ASP 17 N 0.74 0.35 -0.32 2.28 3.58 -1.90 -1.08 116.42 120.06 3ij5 h ASP 17 Ca 0.41 0.07 -0.16 0.00 0.42 0.00 0.00 57.03 57.77 3ij5 h ASP 17 Cb 0.57 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.63 3ij5 h ASP 17 CO -0.18 0.21 -0.39 0.58 -2.88 0.00 0.00 179.24 176.58 3ij5 h VAL 18 N 0.51 1.28 -0.43 2.25 2.07 -1.63 -1.93 116.25 118.36 3ij5 h VAL 18 Ca 0.32 -1.56 0.00 0.00 0.82 0.00 0.00 66.70 66.28 3ij5 h VAL 18 Cb 0.36 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 3ij5 h VAL 18 CO -0.28 0.52 0.28 0.40 0.02 0.00 0.00 177.57 178.51 3ij5 h ILE 19 N 0.72 1.12 -0.73 4.57 1.08 -1.04 0.00 117.51 123.22 3ij5 h ILE 19 Ca 0.06 -0.24 -0.01 0.00 -0.39 0.00 0.00 64.86 64.28 3ij5 h ILE 19 Cb 0.96 0.50 -0.03 0.00 -3.07 0.00 0.00 36.82 35.18 3ij5 h ILE 19 CO 0.09 0.12 0.40 1.56 -0.69 0.00 0.00 178.15 179.63 3ij5 h GLN 20 N 0.59 1.02 -0.34 2.37 1.08 -1.09 -0.60 115.11 118.14 3ij5 h GLN 20 Ca 0.16 -0.12 -0.01 0.00 -1.45 0.00 0.00 58.65 57.23 3ij5 h GLN 20 Cb -0.05 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.16 3ij5 h GLN 20 CO -0.03 0.76 0.18 0.00 -0.95 0.00 0.00 178.83 178.78 3ij5 h ARG 21 N 1.01 0.47 -0.47 1.46 3.08 -0.97 -2.69 114.38 116.27 3ij5 h ARG 21 Ca 0.26 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.26 3ij5 h ARG 21 Cb 0.03 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 3ij5 h ARG 21 CO -0.04 0.40 0.31 0.00 -1.07 0.00 0.00 179.97 179.57 3ij5 h ALA 22 N 1.04 1.68 0.00 0.04 0.00 -0.56 -2.61 119.26 118.85 3ij5 h ALA 22 Ca 0.12 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3ij5 h ALA 22 Cb 0.07 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3ij5 h ALA 22 CO -0.02 0.29 -0.02 0.00 0.00 0.00 0.00 179.25 179.50 3ij5 h ALA 23 N 1.71 1.22 -0.01 0.00 0.00 -0.76 -2.70 119.26 118.71 3ij5 h ALA 23 Ca 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3ij5 h ALA 23 Cb -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3ij5 h ALA 23 CO -0.04 0.03 -0.34 0.09 0.00 0.00 0.00 179.25 178.99 3ij5 n ASN 24 N -3.43 1.61 -4.69 0.00 3.02 -0.98 -4.80 115.26 105.98 3ij5 n ASN 24 Ca -0.02 -1.26 -0.42 0.00 -0.03 0.00 0.00 54.58 52.84 3ij5 n ASN 24 Cb 0.12 0.29 -0.03 0.00 -0.61 0.00 0.00 39.78 39.55 3ij5 n ASN 24 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3ij5 s ILE 25 N -2.44 3.24 -0.10 2.41 -1.09 -1.02 -4.42 121.20 117.78 3ij5 s ILE 25 Ca 0.22 0.70 0.05 0.00 -2.23 0.00 0.00 60.65 59.39 3ij5 s ILE 25 Cb 0.19 -3.45 -0.06 0.00 -1.58 0.00 0.00 42.46 37.55 3ij5 s ILE 25 CO 0.53 0.00 0.14 0.54 -1.23 0.00 0.00 174.94 174.93 3ij5 n ARG 26 N 5.33 2.37 -3.72 2.79 5.12 0.14 -4.98 116.66 123.71 3ij5 n ARG 26 Ca 0.15 -0.03 -0.14 0.00 -1.93 0.00 0.00 57.85 55.90 3ij5 n ARG 26 Cb 0.41 -0.95 -0.14 0.00 -1.16 0.00 0.00 32.46 30.62 3ij5 n ARG 26 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 3ij5 s LEU 27 N -2.87 0.40 -0.22 0.55 2.96 -0.76 -2.14 118.68 116.61 3ij5 s LEU 27 Ca -0.00 0.37 -0.06 0.00 -0.22 0.00 0.00 54.13 54.22 3ij5 s LEU 27 Cb 0.03 0.43 -0.03 0.00 0.50 0.00 0.00 46.19 47.13 3ij5 s LEU 27 CO 0.20 -0.18 0.03 -0.22 -1.32 0.00 0.00 176.35 174.86 3ij5 s LEU 28 N 1.54 3.37 -0.15 -0.68 2.96 0.33 -1.13 118.68 124.93 3ij5 s LEU 28 Ca -0.06 -0.18 -0.02 0.00 -0.22 0.00 0.00 54.13 53.66 3ij5 s LEU 28 Cb -0.12 -1.87 -0.02 0.00 0.50 0.00 0.00 46.19 44.68 3ij5 s LEU 28 CO -0.07 0.04 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.29 3ij5 s ILE 29 N 1.16 3.47 0.02 6.68 1.01 0.01 -0.27 121.20 133.27 3ij5 s ILE 29 Ca 0.03 -0.51 0.08 0.00 0.00 0.00 0.00 60.65 60.26 3ij5 s ILE 29 Cb -0.14 -2.50 -0.03 0.00 0.01 0.00 0.00 42.46 39.80 3ij5 s ILE 29 CO 0.02 0.50 -0.24 0.00 0.00 0.00 0.00 174.94 175.22 3ij5 s ASP 31 N -1.02 4.67 0.00 0.00 2.15 -0.96 -2.16 116.67 119.34 3ij5 s ASP 31 Ca 0.12 0.59 0.00 0.00 0.43 0.00 0.00 52.55 53.68 3ij5 s ASP 31 Cb -0.10 -1.16 0.00 0.00 -0.30 0.00 0.00 42.92 41.35 3ij5 s ASP 31 CO 0.01 -1.74 0.00 0.52 -0.17 0.00 0.00 175.17 173.80 3ij5 n VAL 32 N -3.09 0.00 -1.96 1.11 0.31 -1.26 -4.13 118.33 109.30 3ij5 n VAL 32 Ca 0.08 0.41 -0.42 0.00 -0.01 0.00 0.00 64.34 64.40 3ij5 n VAL 32 Cb 0.61 -1.41 -0.03 0.00 -0.91 0.00 0.00 33.84 32.10 3ij5 n VAL 32 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 3ij5 s ASP 33 N -4.06 6.64 0.00 4.52 1.01 -1.26 0.01 116.67 123.53 3ij5 s ASP 33 Ca 0.00 2.31 0.00 0.00 0.71 0.00 0.00 52.55 55.57 3ij5 s ASP 33 Cb 0.00 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.40 3ij5 s ASP 33 CO 0.00 -0.94 0.00 0.61 0.21 0.00 0.00 175.17 175.05 3ij5 n GLY 34 N 4.19 1.27 0.68 0.21 0.00 -1.07 -4.76 105.19 105.71 3ij5 n GLY 34 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 3ij5 n GLY 34 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ij5 n VAL 35 N -2.00 1.27 0.79 1.61 0.31 -0.68 -4.06 118.33 115.57 3ij5 n VAL 35 Ca 0.00 0.30 0.13 0.00 -0.01 0.00 0.00 64.34 64.76 3ij5 n VAL 35 Cb 0.00 -1.84 0.32 0.00 -0.91 0.00 0.00 33.84 31.41 3ij5 n VAL 35 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 3ij5 n MET 36 N -3.80 0.14 -4.38 5.55 2.81 0.10 -1.92 117.12 115.63 3ij5 n MET 36 Ca -0.05 0.07 -0.21 0.00 -1.81 0.00 0.00 57.70 55.70 3ij5 n MET 36 Cb 0.19 -1.61 -0.09 0.00 -0.71 0.00 0.00 33.22 30.99 3ij5 n MET 36 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3ij5 s SER 37 N -3.68 1.92 -0.06 7.83 1.04 -1.15 -3.83 113.70 115.77 3ij5 s SER 37 Ca 0.10 -1.59 0.07 0.00 0.48 0.00 0.00 55.95 55.01 3ij5 s SER 37 Cb 0.16 0.40 0.31 0.00 0.10 0.00 0.00 66.02 66.99 3ij5 s SER 37 CO 0.66 -0.89 1.10 -0.90 0.98 0.00 0.00 173.24 174.18 3ij5 n ASP 38 N -1.06 2.44 0.00 7.02 5.75 -1.25 -2.05 116.55 127.41 3ij5 n ASP 38 Ca -0.00 -2.23 0.00 0.00 -0.01 0.00 0.00 54.79 52.54 3ij5 n ASP 38 Cb 0.65 -0.43 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 3ij5 n ASP 38 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ij5 n GLY 39 N 0.55 0.75 3.87 6.12 0.00 -1.26 -4.69 105.19 110.53 3ij5 n GLY 39 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 3ij5 n GLY 39 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ij5 s LEU 40 N 0.00 4.32 -0.12 0.99 1.43 -1.26 -4.77 118.68 119.27 3ij5 s LEU 40 Ca 0.00 0.76 0.03 0.00 -1.03 0.00 0.00 54.13 53.89 3ij5 s LEU 40 Cb 0.00 -3.10 0.01 0.00 0.03 0.00 0.00 46.19 43.13 3ij5 s LEU 40 CO 0.00 0.13 -0.20 -0.63 0.23 0.00 0.00 176.35 175.88 3ij5 s ILE 41 N -1.48 1.84 -0.23 -0.59 1.01 -1.26 -4.71 121.20 115.77 3ij5 s ILE 41 Ca 0.36 -0.86 -0.11 0.00 0.00 0.00 0.00 60.65 60.04 3ij5 s ILE 41 Cb -0.13 -1.63 -0.05 0.00 0.01 0.00 0.00 42.46 40.66 3ij5 s ILE 41 CO 0.20 0.51 0.18 -0.31 0.00 0.00 0.00 174.94 175.52 3ij5 s TYR 42 N 0.75 3.33 -0.01 3.97 2.02 -0.84 -4.98 117.35 121.59 3ij5 s TYR 42 Ca -0.10 0.27 0.06 0.00 -0.37 0.00 0.00 57.07 56.93 3ij5 s TYR 42 Cb -0.16 -2.29 -0.02 0.00 -0.40 0.00 0.00 41.96 39.09 3ij5 s TYR 42 CO 0.01 0.07 -0.20 -1.64 -1.57 0.00 0.00 175.55 172.21 3ij5 s MET 43 N 1.06 1.61 0.37 -0.62 -1.94 -1.26 -1.38 119.30 117.14 3ij5 s MET 43 Ca 0.09 -0.74 0.08 0.00 -1.71 0.00 0.00 55.69 53.41 3ij5 s MET 43 Cb -0.14 -1.57 -0.07 0.00 2.01 0.00 0.00 34.83 35.07 3ij5 s MET 43 CO 0.05 0.43 -0.02 0.20 -0.01 0.00 0.00 175.02 175.67 3ij5 s GLY 44 N -0.54 2.31 0.37 -0.03 0.00 -0.17 -4.98 107.32 104.29 3ij5 s GLY 44 Ca 0.08 -2.16 0.28 0.00 0.00 0.00 0.00 44.72 42.91 3ij5 s GLY 44 CO -0.01 -2.03 1.82 3.43 0.00 0.00 0.00 173.10 176.32 3ij5 h ASN 45 N 1.84 0.00 -0.49 1.64 2.35 -2.01 -2.09 115.58 116.83 3ij5 h ASN 45 Ca -0.43 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 3ij5 h ASN 45 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 3ij5 h ASN 45 CO 0.74 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 176.52 3ij5 n GLN 46 N -2.54 4.08 -0.85 0.81 1.13 -1.26 -4.92 117.38 113.84 3ij5 n GLN 46 Ca 0.01 -2.99 0.00 0.00 -1.94 0.00 0.00 57.00 52.08 3ij5 n GLN 46 Cb 0.22 -2.05 0.00 0.00 0.11 0.00 0.00 30.24 28.52 3ij5 n GLN 46 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ij5 n GLY 47 N 0.37 0.66 3.77 1.08 0.00 -0.78 -5.03 105.19 105.26 3ij5 n GLY 47 Ca 0.25 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.93 3ij5 n GLY 47 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3ij5 s GLU 48 N -0.15 3.18 -0.01 1.61 1.03 -1.25 -4.80 118.70 118.30 3ij5 s GLU 48 Ca 0.00 1.51 0.00 0.00 0.03 0.00 0.00 54.97 56.51 3ij5 s GLU 48 Cb 0.00 -1.99 0.02 0.00 -0.80 0.00 0.00 34.13 31.36 3ij5 s GLU 48 CO 0.00 -0.97 0.02 -2.00 -1.33 0.00 0.00 175.26 170.98 3ij5 s GLU 49 N -3.60 0.00 0.15 -4.83 2.12 -1.26 -1.00 118.70 110.29 3ij5 s GLU 49 Ca 0.70 0.11 0.07 0.00 0.36 0.00 0.00 54.97 56.22 3ij5 s GLU 49 Cb -0.22 -0.19 -0.04 0.00 0.26 0.00 0.00 34.13 33.94 3ij5 s GLU 49 CO 0.32 -0.11 -0.15 -0.51 -0.54 0.00 0.00 175.26 174.27 3ij5 s LEU 50 N 0.71 2.45 -0.01 2.70 1.43 -0.48 -4.99 118.68 120.49 3ij5 s LEU 50 Ca -0.06 -0.87 -0.03 0.00 -1.03 0.00 0.00 54.13 52.14 3ij5 s LEU 50 Cb -0.09 -0.65 -0.00 0.00 0.03 0.00 0.00 46.19 45.48 3ij5 s LEU 50 CO -0.02 -0.12 0.06 -0.75 0.23 0.00 0.00 176.35 175.74 3ij5 s LYS 51 N -2.94 0.20 -0.19 1.70 2.20 -1.26 -1.98 119.74 117.48 3ij5 s LYS 51 Ca 0.14 -0.16 -0.07 0.00 -0.36 0.00 0.00 55.97 55.52 3ij5 s LYS 51 Cb -0.04 0.08 -0.04 0.00 -1.51 0.00 0.00 37.83 36.33 3ij5 s LYS 51 CO 0.05 -0.04 0.04 0.00 -0.36 0.00 0.00 175.35 175.04 3ij5 s ALA 52 N -0.57 3.27 0.24 3.13 0.00 -1.26 -5.09 121.76 121.48 3ij5 s ALA 52 Ca -0.06 -0.84 0.09 0.00 0.00 0.00 0.00 51.96 51.14 3ij5 s ALA 52 Cb -0.04 -1.87 -0.04 0.00 0.00 0.00 0.00 23.12 21.16 3ij5 s ALA 52 CO 0.00 0.05 0.01 -0.06 0.00 0.00 0.00 175.76 175.76 3ij5 s PHE 53 N 0.62 2.75 -0.23 0.00 0.08 -1.26 -4.36 117.98 115.58 3ij5 s PHE 53 Ca 0.02 -0.20 -0.10 0.00 0.12 0.00 0.00 56.93 56.77 3ij5 s PHE 53 Cb -0.13 -1.25 -0.05 0.00 -0.57 0.00 0.00 43.02 41.02 3ij5 s PHE 53 CO 0.02 0.59 0.14 1.21 -0.10 0.00 0.00 175.22 177.07 3ij5 s ASN 54 N -3.50 6.01 0.27 1.36 3.84 -1.25 -5.00 114.94 116.68 3ij5 s ASN 54 Ca 0.30 0.10 -0.04 0.00 0.21 0.00 0.00 52.86 53.43 3ij5 s ASN 54 Cb -0.07 -2.07 0.34 0.00 -0.55 0.00 0.00 41.25 38.90 3ij5 s ASN 54 CO 0.20 0.09 1.95 0.58 -2.79 0.00 0.00 177.10 177.12 3ij5 h VAL 55 N 4.99 1.24 -0.27 -5.21 2.07 -1.97 -2.26 116.25 114.83 3ij5 h VAL 55 Ca -0.38 -0.44 -0.04 0.00 0.82 0.00 0.00 66.70 66.66 3ij5 h VAL 55 Cb 1.17 -0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 3ij5 h VAL 55 CO 0.67 0.23 -0.00 0.03 0.02 0.00 0.00 177.57 178.52 3ij5 h ARG 56 N 1.25 0.40 -0.58 1.57 3.08 -1.96 -1.88 114.38 116.27 3ij5 h ARG 56 Ca 0.34 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.27 3ij5 h ARG 56 Cb -0.14 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.82 3ij5 h ARG 56 CO -0.07 0.43 0.20 -0.44 -1.07 0.00 0.00 179.97 179.02 3ij5 h ASP 57 N 0.39 0.82 -0.83 7.04 3.32 -1.79 -2.40 116.42 122.97 3ij5 h ASP 57 Ca 0.09 -0.19 0.06 0.00 0.02 0.00 0.00 57.03 57.01 3ij5 h ASP 57 Cb 0.27 -0.22 -0.06 0.00 0.22 0.00 0.00 39.33 39.54 3ij5 h ASP 57 CO 0.01 0.80 0.51 1.23 -1.72 0.00 0.00 179.24 180.06 3ij5 h GLY 58 N 0.81 1.25 0.97 2.75 0.00 -0.98 -1.02 103.07 106.85 3ij5 h GLY 58 Ca 0.19 -0.37 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 3ij5 h GLY 58 CO -0.01 0.25 0.18 -1.82 0.00 0.00 0.00 176.54 175.14 3ij5 h TYR 59 N 0.93 0.79 -0.43 5.60 3.20 -1.23 -1.27 116.97 124.57 3ij5 h TYR 59 Ca 0.36 -0.07 0.01 0.00 3.14 0.00 0.00 58.73 62.18 3ij5 h TYR 59 Cb 0.18 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.19 3ij5 h TYR 59 CO -0.04 0.67 0.27 0.78 -1.64 0.00 0.00 178.16 178.21 3ij5 h GLY 60 N 0.68 0.61 0.98 1.82 0.00 -0.91 -0.76 103.07 105.49 3ij5 h GLY 60 Ca 0.17 -0.21 0.01 0.00 0.00 0.00 0.00 47.33 47.30 3ij5 h GLY 60 CO -0.01 0.19 0.32 -2.22 0.00 0.00 0.00 176.54 174.82 3ij5 h ILE 61 N 0.55 1.11 -0.68 2.60 2.04 -1.02 -1.54 117.51 120.56 3ij5 h ILE 61 Ca 0.17 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.76 3ij5 h ILE 61 Cb -0.03 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 3ij5 h ILE 61 CO -0.06 0.12 0.25 0.03 0.00 0.00 0.00 178.15 178.49 3ij5 h ARG 62 N 0.65 1.02 -0.62 2.37 3.08 -0.91 -1.12 114.38 118.86 3ij5 h ARG 62 Ca 0.18 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 3ij5 h ARG 62 Cb -0.06 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 29.80 3ij5 h ARG 62 CO -0.05 0.85 0.38 0.00 -1.07 0.00 0.00 179.97 180.07 3ij5 h LEU 64 N 0.84 -0.07 -0.73 0.00 3.38 -0.79 -1.51 115.31 116.44 3ij5 h LEU 64 Ca 0.22 -0.13 0.06 0.00 0.09 0.00 0.00 57.88 58.12 3ij5 h LEU 64 Cb -0.03 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 3ij5 h LEU 64 CO -0.04 0.09 0.43 0.40 0.09 0.00 0.00 178.44 179.41 3ij5 h ILE 65 N -0.22 0.99 0.00 1.22 2.04 -1.01 -0.02 117.51 120.51 3ij5 h ILE 65 Ca -0.01 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.58 3ij5 h ILE 65 Cb 0.20 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.42 3ij5 h ILE 65 CO 0.01 0.14 0.00 0.71 0.00 0.00 0.00 178.15 179.02 3ij5 h THR 66 N 0.78 0.00 -0.45 -0.27 1.35 -1.01 -2.70 112.91 110.61 3ij5 h THR 66 Ca 0.32 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 3ij5 h THR 66 Cb 0.18 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.13 3ij5 h THR 66 CO -0.18 0.00 0.00 -1.20 -0.25 0.00 0.00 175.52 173.89 3ij5 n SER 67 N -2.85 4.36 -2.01 5.36 7.64 -0.37 -4.92 113.62 120.84 3ij5 n SER 67 Ca 0.02 -2.61 -0.15 0.00 1.01 0.00 0.00 58.87 57.14 3ij5 n SER 67 Cb 0.36 -0.61 0.02 0.00 -1.01 0.00 0.00 64.21 62.97 3ij5 n SER 67 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3ij5 n ASP 68 N 0.56 -4.64 -4.06 6.43 8.00 -1.02 -5.02 116.55 116.81 3ij5 n ASP 68 Ca 0.21 -0.14 -0.32 0.00 0.71 0.00 0.00 54.79 55.24 3ij5 n ASP 68 Cb 0.90 -3.59 -0.16 0.00 -0.02 0.00 0.00 41.12 38.25 3ij5 n ASP 68 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ij5 s ILE 69 N -2.90 1.92 0.57 0.53 1.01 -0.16 -5.00 121.20 117.15 3ij5 s ILE 69 Ca 0.15 -1.13 -0.19 0.00 0.00 0.00 0.00 60.65 59.47 3ij5 s ILE 69 Cb -0.07 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 3ij5 s ILE 69 CO 0.18 0.26 1.20 -1.81 0.00 0.00 0.00 174.94 174.77 3ij5 s ASP 70 N 1.29 5.37 -0.09 3.58 1.01 -0.91 -3.02 116.67 123.90 3ij5 s ASP 70 Ca -0.01 2.38 0.00 0.00 0.71 0.00 0.00 52.55 55.63 3ij5 s ASP 70 Cb -0.16 -2.60 0.02 0.00 1.01 0.00 0.00 42.92 41.19 3ij5 s ASP 70 CO -0.09 -1.47 -0.07 -0.69 0.21 0.00 0.00 175.17 173.06 3ij5 s VAL 71 N -1.59 0.88 0.29 -1.27 1.01 -1.26 -0.51 120.40 117.94 3ij5 s VAL 71 Ca 0.75 -0.24 0.09 0.00 0.00 0.00 0.00 61.98 62.59 3ij5 s VAL 71 Cb -0.30 -0.90 -0.06 0.00 0.00 0.00 0.00 36.38 35.13 3ij5 s VAL 71 CO 0.33 0.33 -0.12 0.00 0.00 0.00 0.00 175.10 175.64 3ij5 s ALA 72 N 1.45 2.58 -0.05 5.51 0.00 0.63 -4.44 121.76 127.43 3ij5 s ALA 72 Ca -0.01 -1.91 0.03 0.00 0.00 0.00 0.00 51.96 50.07 3ij5 s ALA 72 Cb -0.13 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 22.94 3ij5 s ALA 72 CO -0.04 0.09 -0.13 0.42 0.00 0.00 0.00 175.76 176.09 3ij5 s ILE 73 N -2.75 1.17 -0.12 0.00 1.01 -0.29 -0.90 121.20 119.31 3ij5 s ILE 73 Ca 0.29 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.39 3ij5 s ILE 73 Cb 0.00 -1.03 0.03 0.00 0.01 0.00 0.00 42.46 41.47 3ij5 s ILE 73 CO 0.13 0.35 -0.04 -0.63 0.00 0.00 0.00 174.94 174.75 3ij5 s ILE 74 N 0.30 0.85 0.03 2.92 1.01 -0.92 -0.55 121.20 124.83 3ij5 s ILE 74 Ca -0.08 -0.29 -0.00 0.00 0.00 0.00 0.00 60.65 60.28 3ij5 s ILE 74 Cb -0.12 -0.98 -0.02 0.00 0.01 0.00 0.00 42.46 41.35 3ij5 s ILE 74 CO 0.02 0.24 -0.03 0.28 0.00 0.00 0.00 174.94 175.45 3ij5 s THR 75 N 1.77 0.15 -0.27 2.92 -1.32 0.15 -4.33 115.64 114.72 3ij5 s THR 75 Ca 0.03 -1.05 0.18 0.00 -1.21 0.00 0.00 61.69 59.65 3ij5 s THR 75 Cb -0.13 -0.46 0.16 0.00 -1.51 0.00 0.00 72.50 70.55 3ij5 s THR 75 CO -0.07 -0.57 1.47 1.23 -2.21 0.00 0.00 174.62 174.46 3ij5 h GLY 76 N 4.42 0.00 -1.09 6.08 0.00 -1.85 -0.90 103.07 109.72 3ij5 h GLY 76 Ca -0.32 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.55 3ij5 h GLY 76 CO 0.45 0.00 0.24 0.50 0.00 0.00 0.00 176.54 177.73 3ij5 s ARG 77 N -3.07 2.03 -0.08 4.80 0.52 -1.26 -3.49 118.95 118.40 3ij5 s ARG 77 Ca 0.05 -0.31 -0.03 0.00 -0.52 0.00 0.00 55.73 54.91 3ij5 s ARG 77 Cb 0.07 -2.15 0.05 0.00 0.52 0.00 0.00 34.95 33.44 3ij5 s ARG 77 CO 0.72 -1.36 0.16 0.50 0.02 0.00 0.00 175.30 175.34 3ij5 s ARG 78 N -5.30 0.06 -0.22 3.54 3.52 -1.26 -0.51 118.95 118.77 3ij5 s ARG 78 Ca 0.62 0.51 -0.19 0.00 -0.13 0.00 0.00 55.73 56.54 3ij5 s ARG 78 Cb -0.10 -0.23 0.06 0.00 -1.56 0.00 0.00 34.95 33.12 3ij5 s ARG 78 CO 0.45 -0.26 0.59 0.00 -0.81 0.00 0.00 175.30 175.27 3ij5 s ALA 79 N 1.94 -1.48 0.51 6.12 0.00 -1.26 -5.02 121.76 122.56 3ij5 s ALA 79 Ca -0.01 1.74 0.26 0.00 0.00 0.00 0.00 51.96 53.95 3ij5 s ALA 79 Cb -0.12 -1.02 1.55 0.00 0.00 0.00 0.00 23.12 23.53 3ij5 s ALA 79 CO -0.06 -0.29 2.15 -0.22 0.00 0.00 0.00 175.76 177.34 3ij5 h LYS 80 N 5.54 0.00 -0.17 0.00 3.64 -2.01 -1.82 116.57 121.75 3ij5 h LYS 80 Ca -0.29 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.08 3ij5 h LYS 80 Cb 1.18 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.99 3ij5 h LYS 80 CO 0.15 0.06 0.06 1.37 -2.27 0.00 0.00 179.45 178.82 3ij5 h LEU 81 N 0.00 0.21 -0.39 5.20 8.10 -1.96 -1.65 115.31 124.82 3ij5 h LEU 81 Ca -0.00 -0.01 -0.19 0.00 0.11 0.00 0.00 57.88 57.79 3ij5 h LEU 81 Cb 0.15 -0.05 -0.00 0.00 -0.44 0.00 0.00 40.66 40.32 3ij5 h LEU 81 CO 0.01 0.20 -0.74 0.25 -4.11 0.00 0.00 178.44 174.05 3ij5 h LEU 82 N 0.24 0.49 -0.52 0.17 5.85 -1.75 -1.89 115.31 117.89 3ij5 h LEU 82 Ca 0.06 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.45 3ij5 h LEU 82 Cb 0.06 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 3ij5 h LEU 82 CO -0.01 1.07 0.30 -0.33 -0.34 0.00 0.00 178.44 179.13 3ij5 h GLU 83 N 0.27 0.72 -0.25 1.25 5.08 -1.36 0.65 114.58 120.94 3ij5 h GLU 83 Ca -0.03 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 3ij5 h GLU 83 Cb 1.32 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.41 3ij5 h GLU 83 CO 0.13 0.55 0.14 -0.44 -1.00 0.00 0.00 179.01 178.39 3ij5 h ASP 84 N 0.70 0.22 -0.08 1.42 3.32 -1.26 0.10 116.42 120.84 3ij5 h ASP 84 Ca 0.19 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 3ij5 h ASP 84 Cb 0.03 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 3ij5 h ASP 84 CO -0.03 0.16 0.05 -0.09 -1.72 0.00 0.00 179.24 177.61 3ij5 h ARG 85 N 0.29 0.11 -0.40 3.56 9.65 -1.04 -0.37 114.38 126.19 3ij5 h ARG 85 Ca 0.10 -0.01 0.07 0.00 -1.10 0.00 0.00 59.98 59.04 3ij5 h ARG 85 Cb 0.01 -0.02 -0.06 0.00 -1.39 0.00 0.00 29.97 28.50 3ij5 h ARG 85 CO -0.06 0.14 0.02 0.00 2.80 0.00 0.00 179.97 182.87 3ij5 h ALA 86 N 0.97 0.38 -0.87 2.80 0.00 -0.68 -1.82 119.26 120.04 3ij5 h ALA 86 Ca 0.03 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.05 3ij5 h ALA 86 Cb 0.05 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 3ij5 h ALA 86 CO -0.01 -0.38 0.57 -0.91 0.00 0.00 0.00 179.25 178.52 3ij5 h ASN 87 N 0.13 1.01 0.36 0.00 2.35 -0.73 -0.04 115.58 118.66 3ij5 h ASN 87 Ca 0.20 -0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.88 3ij5 h ASN 87 Cb 0.27 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 3ij5 h ASN 87 CO -0.31 0.75 -0.13 0.71 -1.65 0.00 0.00 177.43 176.79 3ij5 h THR 88 N 1.19 0.64 -0.00 2.81 1.35 -0.28 -2.06 112.91 116.56 3ij5 h THR 88 Ca 0.32 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 3ij5 h THR 88 Cb -0.12 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 3ij5 h THR 88 CO -0.07 0.13 -0.48 0.18 -0.25 0.00 0.00 175.52 175.03 3ij5 n LEU 89 N -3.71 0.71 -0.28 3.87 4.77 -0.72 -4.94 117.00 116.69 3ij5 n LEU 89 Ca -0.02 -0.12 -0.03 0.00 -0.03 0.00 0.00 56.01 55.81 3ij5 n LEU 89 Cb 0.25 -0.19 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 3ij5 n LEU 89 CO 0.31 0.16 -0.03 0.61 -1.33 0.00 0.00 177.39 177.10 3ij5 n GLY 90 N 1.46 0.52 3.69 -0.72 0.00 -0.59 -4.74 105.19 104.82 3ij5 n GLY 90 Ca 0.07 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 3ij5 n GLY 90 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ij5 s ILE 91 N -2.13 4.88 -0.87 -0.61 1.01 -0.13 -4.94 121.20 118.41 3ij5 s ILE 91 Ca 0.00 1.79 0.11 0.00 0.00 0.00 0.00 60.65 62.54 3ij5 s ILE 91 Cb 0.00 -4.20 -0.03 0.00 0.01 0.00 0.00 42.46 38.24 3ij5 s ILE 91 CO 0.00 0.08 0.61 0.35 0.00 0.00 0.00 174.94 175.98 3ij5 n THR 92 N 4.37 0.00 -3.69 2.92 -2.24 -1.26 -4.34 114.28 110.04 3ij5 n THR 92 Ca 0.05 -0.35 -0.37 0.00 -2.27 0.00 0.00 64.05 61.11 3ij5 n THR 92 Cb 0.50 1.10 -0.09 0.00 -2.10 0.00 0.00 70.33 69.73 3ij5 n THR 92 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3ij5 s HIS 93 N -1.59 3.49 -0.14 4.78 3.76 -1.26 -5.05 115.29 119.28 3ij5 s HIS 93 Ca 0.08 -2.75 0.02 0.00 -0.15 0.00 0.00 55.06 52.26 3ij5 s HIS 93 Cb 0.09 -3.22 0.01 0.00 1.11 0.00 0.00 32.58 30.56 3ij5 s HIS 93 CO 0.32 -0.82 -0.21 -1.17 -0.85 0.00 0.00 174.74 172.00 3ij5 s LEU 94 N -0.29 2.06 -0.29 0.89 2.96 -1.26 -1.14 118.68 121.61 3ij5 s LEU 94 Ca 0.19 -0.59 0.03 0.00 -0.22 0.00 0.00 54.13 53.54 3ij5 s LEU 94 Cb -0.18 -1.41 0.08 0.00 0.50 0.00 0.00 46.19 45.18 3ij5 s LEU 94 CO -0.05 0.06 -0.03 -0.31 -1.32 0.00 0.00 176.35 174.70 3ij5 s TYR 95 N 0.89 3.33 0.32 5.38 2.02 0.28 -4.99 117.35 124.59 3ij5 s TYR 95 Ca -0.06 -2.52 0.07 0.00 -0.37 0.00 0.00 57.07 54.19 3ij5 s TYR 95 Cb -0.15 -2.28 -0.02 0.00 -0.40 0.00 0.00 41.96 39.10 3ij5 s TYR 95 CO -0.03 -0.90 0.33 -0.65 -1.57 0.00 0.00 175.55 172.73 3ij5 s GLN 96 N 1.07 2.86 -1.43 -0.62 -0.21 -1.26 -0.67 119.66 119.39 3ij5 s GLN 96 Ca -0.00 -1.19 -0.05 0.00 0.02 0.00 0.00 55.36 54.14 3ij5 s GLN 96 Cb -0.19 -2.58 0.02 0.00 1.00 0.00 0.00 33.01 31.26 3ij5 s GLN 96 CO -0.07 0.13 0.43 0.41 -2.12 0.00 0.00 175.29 174.07 3ij5 n GLY 97 N -1.42 -0.51 3.54 3.09 0.00 0.34 -4.91 105.19 105.32 3ij5 n GLY 97 Ca -0.02 0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 3ij5 n GLY 97 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ij5 s GLN 98 N -5.64 3.48 -0.10 1.61 -1.52 -0.42 -4.93 119.66 112.14 3ij5 s GLN 98 Ca 0.26 -0.19 -0.27 0.00 -1.95 0.00 0.00 55.36 53.21 3ij5 s GLN 98 Cb -0.13 -3.88 -0.26 0.00 -0.22 0.00 0.00 33.01 28.53 3ij5 s GLN 98 CO 0.32 -0.84 0.87 0.66 -0.25 0.00 0.00 175.29 176.04 3ij5 h SER 99 N 8.65 0.10 -3.32 5.90 4.64 -1.88 -3.32 113.55 124.32 3ij5 h SER 99 Ca -0.26 -0.92 -0.73 0.00 -0.47 0.00 0.00 61.79 59.41 3ij5 h SER 99 Cb 1.11 -0.03 -0.25 0.00 -0.31 0.00 0.00 62.40 62.91 3ij5 h SER 99 CO 0.85 1.01 -0.37 -0.62 -0.87 0.00 0.00 176.83 176.83 3ij5 s ASP 100 N -6.30 5.92 0.58 4.97 2.15 -1.26 -4.96 116.67 117.78 3ij5 s ASP 100 Ca -0.17 -1.54 0.34 0.00 0.43 0.00 0.00 52.55 51.61 3ij5 s ASP 100 Cb -0.01 -2.10 1.77 0.00 -0.30 0.00 0.00 42.92 42.27 3ij5 s ASP 100 CO 0.72 -0.65 2.16 0.11 -0.17 0.00 0.00 175.17 177.34 3ij5 h LYS 101 N 8.62 0.00 -0.28 4.34 1.57 -1.87 -2.87 116.57 126.07 3ij5 h LYS 101 Ca -0.26 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.48 3ij5 h LYS 101 Cb 1.09 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.39 3ij5 h LYS 101 CO 0.86 0.05 0.01 -0.07 -0.57 0.00 0.00 179.45 179.73 3ij5 h LEU 102 N 0.00 0.39 0.13 2.94 3.38 -1.95 -1.94 115.31 118.27 3ij5 h LEU 102 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3ij5 h LEU 102 Cb 0.24 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3ij5 h LEU 102 CO 0.01 0.44 -0.11 0.58 0.09 0.00 0.00 178.44 179.45 3ij5 h VAL 103 N 0.41 0.75 -0.66 1.22 2.07 -1.95 0.11 116.25 118.21 3ij5 h VAL 103 Ca 0.09 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.56 3ij5 h VAL 103 Cb 0.25 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 3ij5 h VAL 103 CO 0.00 0.00 0.22 0.00 0.02 0.00 0.00 177.57 177.82 3ij5 h ALA 104 N 0.59 0.87 -0.13 1.67 0.00 -1.71 -1.96 119.26 118.59 3ij5 h ALA 104 Ca -0.00 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.73 3ij5 h ALA 104 Cb 0.24 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3ij5 h ALA 104 CO -0.01 0.53 -0.05 -0.92 0.00 0.00 0.00 179.25 178.79 3ij5 h TYR 105 N 0.96 -0.12 -0.10 0.00 3.20 -1.03 -0.13 116.97 119.73 3ij5 h TYR 105 Ca 0.22 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.05 3ij5 h TYR 105 Cb 0.28 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 3ij5 h TYR 105 CO 0.02 -0.09 -0.15 0.45 -1.64 0.00 0.00 178.16 176.75 3ij5 h HIS 106 N -0.04 0.17 -0.37 -3.82 3.86 -0.60 -2.10 115.15 112.25 3ij5 h HIS 106 Ca 0.07 -0.02 -0.12 0.00 -1.16 0.00 0.00 60.37 59.14 3ij5 h HIS 106 Cb 0.14 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 3ij5 h HIS 106 CO -0.19 0.31 -0.24 1.49 0.86 0.00 0.00 177.93 180.17 3ij5 h GLU 107 N 0.15 0.81 -0.79 2.45 4.81 -0.69 -2.81 114.58 118.51 3ij5 h GLU 107 Ca 0.03 -0.38 -0.03 0.00 -0.13 0.00 0.00 59.36 58.85 3ij5 h GLU 107 Cb 0.36 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.70 3ij5 h GLU 107 CO 0.02 1.01 0.38 -0.07 -0.73 0.00 0.00 179.01 179.62 3ij5 h LEU 108 N 0.60 1.02 -0.75 1.64 3.38 -0.61 0.11 115.31 120.70 3ij5 h LEU 108 Ca 0.07 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 57.95 3ij5 h LEU 108 Cb 0.80 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 3ij5 h LEU 108 CO 0.07 0.86 0.48 -0.07 0.09 0.00 0.00 178.44 179.87 3ij5 h LEU 109 N 1.12 0.80 0.24 1.67 3.38 -1.29 -1.48 115.31 119.76 3ij5 h LEU 109 Ca 0.27 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 3ij5 h LEU 109 Cb 0.11 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3ij5 h LEU 109 CO -0.03 0.56 -0.12 0.00 0.09 0.00 0.00 178.44 178.93 3ij5 h ALA 110 N 1.31 -0.33 -0.44 1.53 0.00 -1.16 0.11 119.26 120.28 3ij5 h ALA 110 Ca 0.30 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 55.10 3ij5 h ALA 110 Cb -0.01 0.13 -0.09 0.00 0.00 0.00 0.00 17.79 17.82 3ij5 h ALA 110 CO -0.10 -0.40 -0.14 1.15 0.00 0.00 0.00 179.25 179.76 3ij5 h THR 111 N -0.90 0.50 -0.45 0.00 2.02 -0.76 -1.64 112.91 111.69 3ij5 h THR 111 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.15 3ij5 h THR 111 Cb 0.50 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 3ij5 h THR 111 CO 0.06 0.00 0.00 0.18 0.37 0.00 0.00 175.52 176.13 3ij5 n LEU 112 N -5.35 2.49 -4.08 2.58 4.77 -0.56 -4.94 117.00 111.90 3ij5 n LEU 112 Ca 0.03 -1.24 -0.42 0.00 -0.03 0.00 0.00 56.01 54.35 3ij5 n LEU 112 Cb 0.26 -0.32 -0.00 0.00 -2.33 0.00 0.00 43.42 41.03 3ij5 n LEU 112 CO 0.12 0.59 -0.22 0.00 -1.33 0.00 0.00 177.39 176.56 3ij5 n GLN 113 N 0.79 -0.58 -4.23 3.23 1.13 -0.62 -4.94 117.38 112.16 3ij5 n GLN 113 Ca 0.15 0.12 -0.28 0.00 -1.94 0.00 0.00 57.00 55.05 3ij5 n GLN 113 Cb 0.40 -2.94 -0.09 0.00 0.11 0.00 0.00 30.24 27.72 3ij5 n GLN 113 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3ij5 s GLN 115 N -2.51 3.51 0.26 0.00 -1.52 -1.26 -4.73 119.66 113.41 3ij5 s GLN 115 Ca 0.24 -0.30 -0.01 0.00 -1.95 0.00 0.00 55.36 53.33 3ij5 s GLN 115 Cb -0.10 -2.96 0.50 0.00 -0.22 0.00 0.00 33.01 30.22 3ij5 s GLN 115 CO 0.15 0.55 1.80 -1.35 -0.25 0.00 0.00 175.29 176.19 3ij5 h PRO 116 N 2.96 0.78 0.00 2.91 0.11 -1.96 0.24 132.00 137.03 3ij5 h PRO 116 Ca -0.45 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3ij5 h PRO 116 Cb 1.16 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3ij5 h PRO 116 CO 0.75 0.51 0.00 -0.85 -0.21 0.00 0.00 178.00 178.20 3ij5 n GLU 117 N -4.74 0.04 -0.19 1.05 0.00 -1.26 -1.22 120.64 114.31 3ij5 n GLU 117 Ca 0.17 0.40 0.11 0.00 0.00 0.00 0.00 57.16 57.83 3ij5 n GLU 117 Cb 0.36 -1.59 0.26 0.00 0.00 0.00 0.00 31.44 30.48 3ij5 n GLU 117 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 3ij5 n GLN 118 N -1.66 2.28 -4.73 3.44 6.02 0.07 -4.22 117.38 118.59 3ij5 n GLN 118 Ca 0.02 -1.95 -0.33 0.00 -0.01 0.00 0.00 57.00 54.72 3ij5 n GLN 118 Cb 0.10 -1.47 -0.12 0.00 1.02 0.00 0.00 30.24 29.77 3ij5 n GLN 118 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3ij5 s VAL 119 N -1.50 3.39 0.06 5.09 1.01 -0.36 0.24 120.40 128.32 3ij5 s VAL 119 Ca 0.37 -0.59 0.08 0.00 0.00 0.00 0.00 61.98 61.85 3ij5 s VAL 119 Cb 0.21 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 3ij5 s VAL 119 CO 0.29 0.58 -0.21 0.00 0.00 0.00 0.00 175.10 175.75 3ij5 s ALA 120 N -0.51 2.49 -0.04 5.51 0.00 -0.28 -1.51 121.76 127.42 3ij5 s ALA 120 Ca 0.07 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 50.77 3ij5 s ALA 120 Cb -0.12 -0.62 0.03 0.00 0.00 0.00 0.00 23.12 22.41 3ij5 s ALA 120 CO 0.02 0.56 -0.00 -0.47 0.00 0.00 0.00 175.76 175.87 3ij5 s TYR 121 N -0.93 0.41 -0.26 0.00 5.04 -0.60 -0.81 117.35 120.19 3ij5 s TYR 121 Ca 0.14 -0.03 -0.07 0.00 -2.44 0.00 0.00 57.07 54.66 3ij5 s TYR 121 Cb -0.10 -0.51 -0.02 0.00 0.35 0.00 0.00 41.96 41.68 3ij5 s TYR 121 CO 0.05 -0.17 0.08 0.42 -1.34 0.00 0.00 175.55 174.58 3ij5 s ILE 122 N 1.24 4.24 0.39 3.14 1.01 -0.52 -0.19 121.20 130.50 3ij5 s ILE 122 Ca -0.07 -0.31 0.06 0.00 0.00 0.00 0.00 60.65 60.33 3ij5 s ILE 122 Cb -0.13 -3.04 -0.07 0.00 0.01 0.00 0.00 42.46 39.22 3ij5 s ILE 122 CO -0.02 0.26 0.02 -0.83 0.00 0.00 0.00 174.94 174.37 3ij5 s GLY 123 N 1.59 2.39 0.00 6.18 0.00 0.12 -2.27 107.32 115.32 3ij5 s GLY 123 Ca 0.05 -2.22 0.00 0.00 0.00 0.00 0.00 44.72 42.55 3ij5 s GLY 123 CO 0.03 -2.02 0.00 2.09 0.00 0.00 0.00 173.10 173.21 3ij5 n ASP 124 N -0.89 0.09 -3.89 1.64 5.75 -1.26 -2.37 116.55 115.62 3ij5 n ASP 124 Ca -0.04 -0.11 -0.12 0.00 -0.01 0.00 0.00 54.79 54.51 3ij5 n ASP 124 Cb 0.67 0.23 -0.07 0.00 -1.03 0.00 0.00 41.12 40.92 3ij5 n ASP 124 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3ij5 s ASP 125 N -0.25 0.38 0.43 -1.12 -1.08 -1.26 -0.14 116.67 113.63 3ij5 s ASP 125 Ca 0.00 -1.31 0.12 0.00 -0.52 0.00 0.00 52.55 50.84 3ij5 s ASP 125 Cb 0.00 0.51 0.99 0.00 -1.46 0.00 0.00 42.92 42.96 3ij5 s ASP 125 CO 0.00 -1.03 2.01 -0.07 0.52 0.00 0.00 175.17 176.60 3ij5 h LEU 126 N 2.38 0.38 -1.94 -1.34 3.38 -1.99 -1.09 115.31 115.08 3ij5 h LEU 126 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3ij5 h LEU 126 Cb 1.25 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.92 3ij5 h LEU 126 CO 0.44 0.24 0.00 0.16 0.09 0.00 0.00 178.44 179.37 3ij5 h ILE 127 N 0.43 0.00 0.00 1.22 -2.65 -2.00 -1.69 117.51 112.81 3ij5 h ILE 127 Ca 0.22 -0.09 -0.01 0.00 1.03 0.00 0.00 64.86 66.01 3ij5 h ILE 127 Cb 0.34 0.86 -0.00 0.00 -2.05 0.00 0.00 36.82 35.96 3ij5 h ILE 127 CO -0.06 0.00 -0.43 0.44 0.03 0.00 0.00 178.15 178.13 3ij5 h ASP 128 N 0.00 0.00 -0.70 2.16 3.32 -1.62 -3.39 116.42 116.19 3ij5 h ASP 128 Ca 0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.07 3ij5 h ASP 128 Cb 0.11 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.62 3ij5 h ASP 128 CO 0.00 0.05 0.45 -0.25 -1.72 0.00 0.00 179.24 177.77 3ij5 h TRP 129 N 0.00 0.85 -0.93 4.55 2.91 -1.40 -2.42 115.95 119.51 3ij5 h TRP 129 Ca -0.01 0.02 0.19 0.00 1.13 0.00 0.00 58.89 60.23 3ij5 h TRP 129 Cb 1.04 -0.28 -0.11 0.00 -0.51 0.00 0.00 29.16 29.30 3ij5 h TRP 129 CO 0.00 0.51 0.51 -1.35 -1.03 0.00 0.00 178.44 177.09 3ij5 h PRO 130 N 0.91 0.61 -0.00 2.65 0.11 -1.76 0.14 132.00 134.64 3ij5 h PRO 130 Ca 0.27 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.34 3ij5 h PRO 130 Cb -0.05 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 30.93 3ij5 h PRO 130 CO -0.08 0.40 -0.02 0.28 -0.21 0.00 0.00 178.00 178.37 3ij5 h VAL 131 N 0.62 1.58 -0.90 3.15 2.07 -1.81 -3.29 116.25 117.67 3ij5 h VAL 131 Ca 0.55 -1.75 0.16 0.00 0.82 0.00 0.00 66.70 66.48 3ij5 h VAL 131 Cb 0.90 2.76 -0.07 0.00 -1.52 0.00 0.00 31.29 33.36 3ij5 h VAL 131 CO -0.42 0.46 0.58 0.24 0.02 0.00 0.00 177.57 178.45 3ij5 h MET 132 N -0.71 0.62 -0.02 1.57 2.86 -0.93 -0.79 114.93 117.53 3ij5 h MET 132 Ca -0.00 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 3ij5 h MET 132 Cb 0.76 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 32.28 3ij5 h MET 132 CO 0.00 0.41 0.03 0.00 1.06 0.00 0.00 176.91 178.41 3ij5 h ALA 133 N 1.61 1.49 0.00 6.32 0.00 -0.82 -3.04 119.26 124.82 3ij5 h ALA 133 Ca 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 3ij5 h ALA 133 Cb 0.83 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3ij5 h ALA 133 CO -0.22 -0.04 -1.20 1.04 0.00 0.00 0.00 179.25 178.83 3ij5 n GLN 134 N -3.73 0.53 -2.36 0.00 6.02 -0.31 -5.04 117.38 112.49 3ij5 n GLN 134 Ca -0.02 -0.05 -0.25 0.00 -0.01 0.00 0.00 57.00 56.67 3ij5 n GLN 134 Cb 0.11 -1.44 0.05 0.00 1.02 0.00 0.00 30.24 29.98 3ij5 n GLN 134 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3ij5 s VAL 135 N -3.01 2.73 0.23 5.09 -7.23 -1.15 -4.71 120.40 112.36 3ij5 s VAL 135 Ca 0.03 -0.29 0.01 0.00 -1.81 0.00 0.00 61.98 59.93 3ij5 s VAL 135 Cb 0.14 -3.12 -0.03 0.00 0.56 0.00 0.00 36.38 33.93 3ij5 s VAL 135 CO 0.82 -0.12 1.57 1.23 -0.31 0.00 0.00 175.10 178.29 3ij5 h GLY 136 N -0.33 0.43 -6.81 2.32 0.00 -0.47 -3.41 103.07 94.79 3ij5 h GLY 136 Ca -0.44 -0.48 -0.55 0.00 0.00 0.00 0.00 47.33 45.85 3ij5 h GLY 136 CO 0.59 0.43 -0.79 -2.27 0.00 0.00 0.00 176.54 174.50 3ij5 s LEU 137 N -8.21 1.02 -0.00 3.11 2.96 -0.88 -4.86 118.68 111.81 3ij5 s LEU 137 Ca -0.06 -1.62 -0.21 0.00 -0.22 0.00 0.00 54.13 52.03 3ij5 s LEU 137 Cb 0.12 -0.48 -0.05 0.00 0.50 0.00 0.00 46.19 46.28 3ij5 s LEU 137 CO 0.81 -0.40 0.62 -0.94 -1.32 0.00 0.00 176.35 175.12 3ij5 s SER 138 N 1.70 7.00 -0.06 3.68 1.04 -1.26 -1.56 113.70 124.24 3ij5 s SER 138 Ca 0.12 1.19 0.02 0.00 0.48 0.00 0.00 55.95 57.76 3ij5 s SER 138 Cb -0.18 -2.38 0.01 0.00 0.10 0.00 0.00 66.02 63.57 3ij5 s SER 138 CO -0.25 0.08 -0.12 -0.69 0.98 0.00 0.00 173.24 173.24 3ij5 s VAL 139 N -0.10 1.10 -0.11 5.02 1.01 0.73 -1.65 120.40 126.40 3ij5 s VAL 139 Ca 0.32 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.81 3ij5 s VAL 139 Cb -0.18 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 3ij5 s VAL 139 CO 0.18 0.34 -0.05 0.00 0.00 0.00 0.00 175.10 175.57 3ij5 s ALA 140 N 0.56 3.01 0.72 5.51 0.00 -0.46 -0.70 121.76 130.39 3ij5 s ALA 140 Ca -0.12 -0.85 -0.13 0.00 0.00 0.00 0.00 51.96 50.85 3ij5 s ALA 140 Cb -0.15 -1.39 0.03 0.00 0.00 0.00 0.00 23.12 21.61 3ij5 s ALA 140 CO 0.03 0.41 1.12 0.14 0.00 0.00 0.00 175.76 177.46 3ij5 s VAL 141 N -0.29 3.08 0.30 0.00 -7.23 -1.00 -1.42 120.40 113.84 3ij5 s VAL 141 Ca 0.04 0.45 0.05 0.00 -1.81 0.00 0.00 61.98 60.71 3ij5 s VAL 141 Cb -0.13 -2.93 0.29 0.00 0.56 0.00 0.00 36.38 34.17 3ij5 s VAL 141 CO 0.02 -0.36 1.69 0.00 -0.31 0.00 0.00 175.10 176.15 3ij5 h ALA 142 N -0.46 1.48 -0.69 1.32 0.00 -1.53 -1.45 119.26 117.94 3ij5 h ALA 142 Ca -0.46 0.16 -0.40 0.00 0.00 0.00 0.00 54.91 54.22 3ij5 h ALA 142 Cb 1.25 0.15 -0.23 0.00 0.00 0.00 0.00 17.79 18.96 3ij5 h ALA 142 CO 0.52 -0.36 0.20 -0.40 0.00 0.00 0.00 179.25 179.21 3ij5 n ASP 143 N -5.05 3.98 -4.67 0.00 5.75 -1.26 -5.00 116.55 110.29 3ij5 n ASP 143 Ca 0.23 -3.74 -0.29 0.00 -0.01 0.00 0.00 54.79 50.97 3ij5 n ASP 143 Cb 0.68 -0.72 0.17 0.00 -1.03 0.00 0.00 41.12 40.22 3ij5 n ASP 143 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ij5 s ALA 144 N -3.41 1.10 0.21 2.12 0.00 -0.55 -4.90 121.76 116.33 3ij5 s ALA 144 Ca 0.52 -0.11 -0.32 0.00 0.00 0.00 0.00 51.96 52.05 3ij5 s ALA 144 Cb 0.45 -3.19 -0.14 0.00 0.00 0.00 0.00 23.12 20.23 3ij5 s ALA 144 CO 0.03 -2.71 1.35 1.58 0.00 0.00 0.00 175.76 176.01 3ij5 n HIS 145 N -4.13 1.91 -0.26 0.00 -0.00 0.80 -4.83 115.22 108.72 3ij5 n HIS 145 Ca 0.06 0.49 0.28 0.00 0.46 0.00 0.00 57.72 59.01 3ij5 n HIS 145 Cb 0.55 -2.41 0.65 0.00 -0.12 0.00 0.00 29.99 28.66 3ij5 n HIS 145 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 3ij5 h PRO 146 N 4.16 0.15 0.00 1.57 0.13 -1.91 -0.26 132.00 135.84 3ij5 h PRO 146 Ca -0.45 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.61 3ij5 h PRO 146 Cb 1.29 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 3ij5 h PRO 146 CO 0.75 0.10 -0.29 -0.07 -0.23 0.00 0.00 178.00 178.26 3ij5 h LEU 147 N 0.15 0.00 0.11 1.56 3.38 -1.98 -3.18 115.31 115.35 3ij5 h LEU 147 Ca 0.51 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 58.21 3ij5 h LEU 147 Cb 1.75 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.50 3ij5 h LEU 147 CO -0.10 0.29 -1.23 0.25 0.09 0.00 0.00 178.44 177.74 3ij5 h LEU 148 N 0.00 0.37 -0.58 1.67 5.85 -1.38 -3.40 115.31 117.84 3ij5 h LEU 148 Ca -0.00 -0.40 0.10 0.00 0.84 0.00 0.00 57.88 58.41 3ij5 h LEU 148 Cb 0.75 -0.12 -0.11 0.00 0.37 0.00 0.00 40.66 41.55 3ij5 h LEU 148 CO 0.04 1.31 -0.38 -0.07 -0.34 0.00 0.00 178.44 179.00 3ij5 h LEU 149 N 0.06 -1.31 0.00 2.25 3.38 -1.52 -1.85 115.31 116.33 3ij5 h LEU 149 Ca -0.13 0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3ij5 h LEU 149 Cb 1.95 0.62 0.00 0.00 0.09 0.00 0.00 40.66 43.32 3ij5 h LEU 149 CO 0.19 -0.32 0.00 -0.81 0.09 0.00 0.00 178.44 177.59 3ij5 n PRO 150 N -5.42 0.36 0.05 1.13 -0.04 -1.26 -3.32 135.00 126.49 3ij5 n PRO 150 Ca 0.03 0.07 0.03 0.00 -0.04 0.00 0.00 63.50 63.59 3ij5 n PRO 150 Cb 0.35 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.25 3ij5 n PRO 150 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3ij5 h LYS 151 N 0.00 0.00 -7.13 0.54 1.57 -1.57 -3.48 116.57 106.50 3ij5 h LYS 151 Ca 0.00 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.31 3ij5 h LYS 151 Cb 0.17 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.51 3ij5 h LYS 151 CO 0.00 0.23 0.37 0.00 -0.57 0.00 0.00 179.45 179.48 3ij5 s ALA 152 N -3.02 2.91 0.32 3.86 0.00 -1.21 -4.96 121.76 119.67 3ij5 s ALA 152 Ca -0.02 0.41 0.07 0.00 0.00 0.00 0.00 51.96 52.42 3ij5 s ALA 152 Cb 0.09 -3.20 0.56 0.00 0.00 0.00 0.00 23.12 20.57 3ij5 s ALA 152 CO 0.80 -0.35 1.78 0.45 0.00 0.00 0.00 175.76 178.45 3ij5 h HIS 153 N 1.17 0.33 -3.29 0.00 3.86 -1.67 -3.44 115.15 112.12 3ij5 h HIS 153 Ca -0.48 -0.07 -0.21 0.00 -1.16 0.00 0.00 60.37 58.46 3ij5 h HIS 153 Cb 1.20 -0.08 -0.29 0.00 1.06 0.00 0.00 27.41 29.31 3ij5 h HIS 153 CO 0.60 0.55 -0.55 -0.47 0.86 0.00 0.00 177.93 178.92 3ij5 s TYR 154 N -4.43 -0.19 -0.19 2.45 5.04 -0.84 -4.92 117.35 114.26 3ij5 s TYR 154 Ca -0.05 0.48 -0.04 0.00 -2.44 0.00 0.00 57.07 55.01 3ij5 s TYR 154 Cb 0.14 0.01 -0.02 0.00 0.35 0.00 0.00 41.96 42.44 3ij5 s TYR 154 CO 0.76 -0.13 -0.02 0.08 -1.34 0.00 0.00 175.55 174.91 3ij5 s VAL 155 N 0.56 3.81 0.59 3.14 1.01 -1.26 -1.36 120.40 126.89 3ij5 s VAL 155 Ca -0.04 -0.36 -0.18 0.00 0.00 0.00 0.00 61.98 61.40 3ij5 s VAL 155 Cb -0.05 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 3ij5 s VAL 155 CO -0.03 0.44 1.11 0.42 0.00 0.00 0.00 175.10 177.04 3ij5 s THR 156 N 0.97 3.28 0.14 3.92 -4.23 -0.51 -4.90 115.64 114.32 3ij5 s THR 156 Ca 0.01 0.70 0.04 0.00 -1.18 0.00 0.00 61.69 61.27 3ij5 s THR 156 Cb -0.14 -3.24 -0.19 0.00 1.34 0.00 0.00 72.50 70.27 3ij5 s THR 156 CO 0.01 -0.27 1.32 0.03 -0.54 0.00 0.00 174.62 175.17 3ij5 h ARG 157 N 0.72 0.10 -6.33 3.99 -0.00 -1.92 -3.15 114.38 107.79 3ij5 h ARG 157 Ca -0.48 -0.14 -0.56 0.00 -0.50 0.00 0.00 59.98 58.30 3ij5 h ARG 157 Cb 1.25 0.05 -0.04 0.00 0.00 0.00 0.00 29.97 31.23 3ij5 h ARG 157 CO 0.56 0.99 0.01 0.42 0.00 0.00 0.00 179.97 181.95 3ij5 s ILE 158 N -2.92 4.66 0.75 2.04 -1.09 -1.26 -4.80 121.20 118.57 3ij5 s ILE 158 Ca -0.01 1.28 -0.11 0.00 -2.23 0.00 0.00 60.65 59.58 3ij5 s ILE 158 Cb 0.10 -3.93 0.04 0.00 -1.58 0.00 0.00 42.46 37.09 3ij5 s ILE 158 CO 0.83 0.49 1.08 -0.54 -1.23 0.00 0.00 174.94 175.57 3ij5 s LYS 159 N -1.26 2.50 0.34 2.79 1.02 -1.26 -3.29 119.74 120.58 3ij5 s LYS 159 Ca 0.32 0.89 -0.29 0.00 0.02 0.00 0.00 55.97 56.91 3ij5 s LYS 159 Cb -0.20 -1.95 -0.11 0.00 -0.52 0.00 0.00 37.83 35.05 3ij5 s LYS 159 CO 0.21 -1.39 1.52 0.41 -0.92 0.00 0.00 175.35 175.17 3ij5 n GLY 160 N -1.86 1.21 3.13 -3.33 0.00 -1.26 -1.69 105.19 101.39 3ij5 n GLY 160 Ca 0.08 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.47 3ij5 n GLY 160 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ij5 n GLY 161 N 1.20 1.41 0.34 -0.02 0.00 -0.81 -3.80 105.19 103.50 3ij5 n GLY 161 Ca 0.05 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.11 3ij5 n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ij5 n ARG 162 N -2.00 0.65 0.00 1.61 5.12 -0.68 -4.50 116.66 116.85 3ij5 n ARG 162 Ca 0.00 -1.15 0.00 0.00 -1.93 0.00 0.00 57.85 54.77 3ij5 n ARG 162 Cb 0.00 -1.16 0.00 0.00 -1.16 0.00 0.00 32.46 30.14 3ij5 n ARG 162 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3ij5 n GLY 163 N 0.40 1.76 0.20 -0.13 0.00 -1.24 -4.86 105.19 101.32 3ij5 n GLY 163 Ca 0.05 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.04 3ij5 n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ij5 h ALA 164 N 0.00 1.03 -0.27 4.61 0.00 -1.76 -2.02 119.26 120.86 3ij5 h ALA 164 Ca 0.00 -0.43 -0.14 0.00 0.00 0.00 0.00 54.91 54.35 3ij5 h ALA 164 Cb 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3ij5 h ALA 164 CO 0.00 0.61 -0.36 0.28 0.00 0.00 0.00 179.25 179.78 3ij5 h VAL 165 N 0.26 1.30 -0.95 0.00 2.07 -1.90 -2.80 116.25 114.24 3ij5 h VAL 165 Ca 0.02 -1.55 0.04 0.00 0.82 0.00 0.00 66.70 66.03 3ij5 h VAL 165 Cb 0.85 1.66 -0.05 0.00 -1.52 0.00 0.00 31.29 32.23 3ij5 h VAL 165 CO 0.07 0.50 0.62 -0.09 0.02 0.00 0.00 177.57 178.68 3ij5 h ARG 166 N 0.46 1.15 -0.38 1.57 9.65 -1.79 -0.05 114.38 124.99 3ij5 h ARG 166 Ca 0.03 -0.07 0.02 0.00 -1.10 0.00 0.00 59.98 58.87 3ij5 h ARG 166 Cb 0.95 -0.26 -0.03 0.00 -1.39 0.00 0.00 29.97 29.24 3ij5 h ARG 166 CO 0.09 0.76 0.20 1.49 2.80 0.00 0.00 179.97 185.31 3ij5 h GLU 167 N 1.19 0.41 -0.50 0.20 4.81 -1.22 0.31 114.58 119.77 3ij5 h GLU 167 Ca 0.38 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.47 3ij5 h GLU 167 Cb 0.02 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 3ij5 h GLU 167 CO -0.12 0.27 -0.12 0.28 -0.73 0.00 0.00 179.01 178.60 3ij5 h VAL 168 N 0.42 1.27 -0.30 0.32 2.07 -1.18 -0.83 116.25 118.01 3ij5 h VAL 168 Ca 0.16 -1.26 0.02 0.00 0.82 0.00 0.00 66.70 66.44 3ij5 h VAL 168 Cb 0.04 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 3ij5 h VAL 168 CO -0.10 0.44 0.14 0.00 0.02 0.00 0.00 177.57 178.07 3ij5 h ASP 170 N 0.29 1.10 -0.03 0.00 3.32 -0.25 -2.13 116.42 118.72 3ij5 h ASP 170 Ca 0.13 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 3ij5 h ASP 170 Cb 0.06 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.32 3ij5 h ASP 170 CO -0.10 0.91 0.01 0.25 -1.72 0.00 0.00 179.24 178.59 3ij5 h LEU 171 N 1.22 0.05 -0.10 1.55 5.85 -0.76 -0.70 115.31 122.41 3ij5 h LEU 171 Ca 0.30 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.85 3ij5 h LEU 171 Cb 0.08 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 3ij5 h LEU 171 CO -0.04 0.24 -0.12 0.40 -0.34 0.00 0.00 178.44 178.58 3ij5 h ILE 172 N -0.15 0.68 -0.87 4.05 2.04 -0.92 -1.01 117.51 121.32 3ij5 h ILE 172 Ca 0.01 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.84 3ij5 h ILE 172 Cb 0.21 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 36.93 3ij5 h ILE 172 CO -0.00 0.00 0.45 -0.07 0.00 0.00 0.00 178.15 178.53 3ij5 h LEU 173 N -0.15 1.12 -0.33 1.44 3.38 -1.35 -1.60 115.31 117.83 3ij5 h LEU 173 Ca 0.08 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3ij5 h LEU 173 Cb 0.26 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3ij5 h LEU 173 CO -0.19 0.92 0.21 0.25 0.09 0.00 0.00 178.44 179.72 3ij5 h LEU 174 N 1.23 0.38 -1.83 1.67 5.85 -0.87 0.23 115.31 121.97 3ij5 h LEU 174 Ca 0.30 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.98 3ij5 h LEU 174 Cb 0.08 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.01 3ij5 h LEU 174 CO -0.04 0.28 -0.14 0.00 -0.34 0.00 0.00 178.44 178.19 3ij5 h ALA 175 N 1.12 1.34 -0.51 1.25 0.00 -0.79 -2.53 119.26 119.12 3ij5 h ALA 175 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3ij5 h ALA 175 Cb -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3ij5 h ALA 175 CO -0.03 0.18 0.00 1.04 0.00 0.00 0.00 179.25 180.44 3ij5 n GLN 176 N -3.74 3.96 -3.54 0.00 6.02 -0.64 -4.58 117.38 114.86 3ij5 n GLN 176 Ca -0.02 -2.94 -0.26 0.00 -0.01 0.00 0.00 57.00 53.77 3ij5 n GLN 176 Cb 0.25 -1.99 0.00 0.00 1.02 0.00 0.00 30.24 29.52 3ij5 n GLN 176 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3ij5 n ASP 177 N 0.51 -4.06 -0.01 1.08 8.00 -0.81 -4.84 116.55 116.42 3ij5 n ASP 177 Ca 0.25 -0.53 0.00 0.00 0.71 0.00 0.00 54.79 55.22 3ij5 n ASP 177 Cb 0.98 -3.32 0.00 0.00 -0.02 0.00 0.00 41.12 38.76 3ij5 n ASP 177 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3ij5 n LYS 178 N -4.00 0.61 0.15 -1.24 5.02 0.75 -4.81 118.16 114.64 3ij5 n LYS 178 Ca 0.00 -0.91 -0.12 0.00 -2.02 0.00 0.00 58.31 55.26 3ij5 n LYS 178 Cb 0.54 -1.01 -0.07 0.00 -0.02 0.00 0.00 35.03 34.47 3ij5 n LYS 178 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3ij5 h LEU 179 N 0.05 -0.35 -0.80 -0.35 5.85 -1.77 -2.95 115.31 114.99 3ij5 h LEU 179 Ca 0.00 -0.19 0.15 0.00 0.84 0.00 0.00 57.88 58.67 3ij5 h LEU 179 Cb 0.21 0.09 -0.10 0.00 0.37 0.00 0.00 40.66 41.23 3ij5 h LEU 179 CO 0.00 0.08 0.36 -0.08 -0.34 0.00 0.00 178.44 178.45 3ij5 h GLU 180 N -0.85 0.50 -0.45 1.25 4.81 -1.90 -1.95 114.58 115.99 3ij5 h GLU 180 Ca -0.04 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 3ij5 h GLU 180 Cb 0.52 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.79 3ij5 h GLU 180 CO 0.07 0.33 0.00 0.41 -0.73 0.00 0.00 179.01 179.09 3ij5 n GLY 181 N -1.32 1.03 0.34 1.92 0.00 -1.24 -5.26 105.19 100.66 3ij5 n GLY 181 Ca 0.16 -0.43 0.15 0.00 0.00 0.00 0.00 46.02 45.89 3ij5 n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32