#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ft9 n PHE 2 N 0.00 0.23 -1.54 6.00 3.72 -1.26 -4.89 117.46 119.72 2ft9 n PHE 2 Ca 0.00 0.08 -0.51 0.00 -0.05 0.00 0.00 57.45 56.97 2ft9 n PHE 2 Cb 0.00 -0.88 -0.05 0.00 -0.94 0.00 0.00 39.48 37.62 2ft9 n PHE 2 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2ft9 n ASN 3 N -2.64 0.77 0.00 4.37 4.13 -1.26 -4.72 115.26 115.90 2ft9 n ASN 3 Ca -0.19 1.14 0.00 0.00 1.68 0.00 0.00 54.58 57.21 2ft9 n ASN 3 Cb 0.92 -1.12 0.00 0.00 -1.54 0.00 0.00 39.78 38.03 2ft9 n ASN 3 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2ft9 n GLY 4 N 1.95 3.01 3.50 7.41 0.00 -0.52 -4.98 105.19 115.55 2ft9 n GLY 4 Ca 0.17 -1.59 -0.43 0.00 0.00 0.00 0.00 46.02 44.17 2ft9 n GLY 4 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ft9 s THR 5 N -2.00 4.54 -0.29 2.61 2.01 -1.26 -1.12 115.64 120.13 2ft9 s THR 5 Ca 0.00 0.01 -0.11 0.00 0.31 0.00 0.00 61.69 61.90 2ft9 s THR 5 Cb 0.00 -4.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.00 2ft9 s THR 5 CO 0.00 -1.03 0.19 0.26 -0.69 0.00 0.00 174.62 173.35 2ft9 s TRP 6 N 3.53 3.21 -0.36 4.92 0.52 -0.09 -1.35 118.94 129.32 2ft9 s TRP 6 Ca 0.25 -0.02 -0.13 0.00 0.02 0.00 0.00 56.10 56.23 2ft9 s TRP 6 Cb -0.15 -2.39 -0.00 0.00 -1.15 0.00 0.00 33.47 29.78 2ft9 s TRP 6 CO 0.17 -0.23 0.23 -1.14 0.02 0.00 0.00 176.95 176.00 2ft9 s GLN 7 N 1.73 3.26 0.11 4.98 2.00 -0.96 0.15 119.66 130.93 2ft9 s GLN 7 Ca 0.07 -0.80 -0.31 0.00 -2.00 0.00 0.00 55.36 52.32 2ft9 s GLN 7 Cb -0.16 -3.80 -0.10 0.00 0.80 0.00 0.00 33.01 29.75 2ft9 s GLN 7 CO 0.10 -0.54 1.77 0.08 -0.50 0.00 0.00 175.29 176.20 2ft9 s VAL 8 N 1.67 2.68 -0.04 1.34 1.01 -0.95 -1.78 120.40 124.34 2ft9 s VAL 8 Ca 0.05 0.19 0.06 0.00 0.00 0.00 0.00 61.98 62.28 2ft9 s VAL 8 Cb -0.18 -3.12 -0.09 0.00 0.00 0.00 0.00 36.38 32.99 2ft9 s VAL 8 CO 0.09 0.00 0.09 0.00 0.00 0.00 0.00 175.10 175.28 2ft9 n TYR 9 N 5.60 0.00 -3.77 5.22 0.18 -0.33 -4.73 117.16 119.34 2ft9 n TYR 9 Ca 0.17 0.00 -0.15 0.00 1.88 0.00 0.00 57.90 59.80 2ft9 n TYR 9 Cb 0.39 -0.23 -0.16 0.00 -0.38 0.00 0.00 39.34 38.96 2ft9 n TYR 9 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2ft9 s SER 10 N -3.27 0.09 -0.44 9.48 0.15 -1.18 -5.04 113.70 113.50 2ft9 s SER 10 Ca -0.03 0.05 0.02 0.00 0.70 0.00 0.00 55.95 56.70 2ft9 s SER 10 Cb 0.03 -0.06 0.14 0.00 -1.71 0.00 0.00 66.02 64.42 2ft9 s SER 10 CO 0.27 -0.13 0.25 -1.10 1.20 0.00 0.00 173.24 173.72 2ft9 s GLN 11 N 1.12 1.27 0.18 5.44 -0.21 -1.26 -1.29 119.66 124.90 2ft9 s GLN 11 Ca -0.09 -2.01 -0.23 0.00 0.02 0.00 0.00 55.36 53.06 2ft9 s GLN 11 Cb -0.13 -2.27 -0.08 0.00 1.00 0.00 0.00 33.01 31.53 2ft9 s GLN 11 CO -0.03 -1.18 0.74 -1.21 -2.12 0.00 0.00 175.29 171.49 2ft9 s GLU 12 N 0.33 4.41 -1.18 2.91 2.02 -1.05 -3.61 118.70 122.52 2ft9 s GLU 12 Ca 0.18 1.00 -0.03 0.00 0.02 0.00 0.00 54.97 56.15 2ft9 s GLU 12 Cb -0.23 -3.11 0.02 0.00 0.10 0.00 0.00 34.13 30.92 2ft9 s GLU 12 CO -0.01 0.51 0.22 -1.71 0.02 0.00 0.00 175.26 174.28 2ft9 n ASN 13 N 1.26 -4.09 -0.05 -0.19 5.15 -1.26 -2.32 115.26 113.77 2ft9 n ASN 13 Ca -0.05 -0.04 -0.14 0.00 -0.60 0.00 0.00 54.58 53.75 2ft9 n ASN 13 Cb 0.50 -3.42 -0.08 0.00 -0.53 0.00 0.00 39.78 36.25 2ft9 n ASN 13 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 2ft9 h TYR 14 N -0.45 0.45 -0.22 1.20 3.20 -1.87 -2.80 116.97 116.48 2ft9 h TYR 14 Ca -0.36 -0.16 0.05 0.00 3.14 0.00 0.00 58.73 61.40 2ft9 h TYR 14 Cb 1.26 -0.08 -0.07 0.00 1.54 0.00 0.00 36.73 39.37 2ft9 h TYR 14 CO 0.67 0.83 -0.39 1.49 -1.64 0.00 0.00 178.16 179.12 2ft9 h GLU 15 N -0.06 -0.40 0.00 1.82 4.81 -1.89 0.45 114.58 119.31 2ft9 h GLU 15 Ca 0.01 0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 2ft9 h GLU 15 Cb 0.80 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.27 2ft9 h GLU 15 CO 0.05 -0.26 -0.11 0.00 -0.73 0.00 0.00 179.01 177.96 2ft9 h ALA 16 N 0.31 1.28 -0.01 2.92 0.00 -1.97 -2.43 119.26 119.37 2ft9 h ALA 16 Ca 0.10 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 2ft9 h ALA 16 Cb 0.59 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.38 2ft9 h ALA 16 CO -0.44 0.13 -0.47 0.35 0.00 0.00 0.00 179.25 178.82 2ft9 h PHE 17 N 0.00 0.49 -0.68 0.00 3.57 -0.95 -2.94 116.94 116.43 2ft9 h PHE 17 Ca -0.00 -0.26 0.07 0.00 3.53 0.00 0.00 57.97 61.31 2ft9 h PHE 17 Cb 0.32 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.96 2ft9 h PHE 17 CO 0.00 1.07 0.45 -0.07 -2.23 0.00 0.00 178.31 177.53 2ft9 h LEU 18 N -0.23 0.60 -0.82 0.59 3.38 -0.64 -1.15 115.31 117.04 2ft9 h LEU 18 Ca -0.06 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.79 2ft9 h LEU 18 Cb 1.19 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2ft9 h LEU 18 CO 0.09 0.39 -0.48 -0.09 0.09 0.00 0.00 178.44 178.44 2ft9 h ARG 19 N 0.68 0.25 0.00 1.13 2.43 -1.47 -2.74 114.38 114.65 2ft9 h ARG 19 Ca 0.29 -0.14 -0.09 0.00 -0.81 0.00 0.00 59.98 59.24 2ft9 h ARG 19 Cb 0.28 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 2ft9 h ARG 19 CO -0.09 0.68 -0.44 0.00 -1.51 0.00 0.00 179.97 178.61 2ft9 h ALA 20 N 1.30 0.73 0.00 2.80 0.00 -1.27 -2.12 119.26 120.69 2ft9 h ALA 20 Ca 0.01 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2ft9 h ALA 20 Cb 0.93 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2ft9 h ALA 20 CO 0.08 0.55 0.00 0.28 0.00 0.00 0.00 179.25 180.16 2ft9 h VAL 21 N 0.00 0.00 0.00 0.00 2.07 -0.94 -3.44 116.25 113.95 2ft9 h VAL 21 Ca -0.00 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.39 2ft9 h VAL 21 Cb 1.31 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2ft9 h VAL 21 CO 0.06 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.26 2ft9 n GLY 22 N -0.77 0.62 3.77 2.17 0.00 -0.80 -5.06 105.19 105.12 2ft9 n GLY 22 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2ft9 n GLY 22 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ft9 s LEU 23 N 0.00 3.85 0.63 0.99 1.43 -1.14 -5.01 118.68 119.42 2ft9 s LEU 23 Ca 0.00 2.25 -0.16 0.00 -1.03 0.00 0.00 54.13 55.18 2ft9 s LEU 23 Cb 0.00 -4.44 -0.01 0.00 0.03 0.00 0.00 46.19 41.76 2ft9 s LEU 23 CO 0.00 -1.12 1.13 -2.16 0.23 0.00 0.00 176.35 174.43 2ft9 s PRO 24 N -3.05 2.90 0.53 1.29 0.04 -1.26 -4.66 135.00 130.79 2ft9 s PRO 24 Ca 0.69 1.50 0.20 0.00 0.04 0.00 0.00 61.00 63.44 2ft9 s PRO 24 Cb -0.26 -1.95 1.36 0.00 0.04 0.00 0.00 34.50 33.69 2ft9 s PRO 24 CO 0.31 -1.19 2.11 0.93 0.04 0.00 0.00 177.00 179.19 2ft9 h GLU 25 N 0.35 0.00 -0.90 4.56 4.39 -1.98 0.12 114.58 121.13 2ft9 h GLU 25 Ca -0.48 0.00 0.24 0.00 0.34 0.00 0.00 59.36 59.46 2ft9 h GLU 25 Cb 1.26 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 29.77 2ft9 h GLU 25 CO 0.54 0.00 0.35 0.22 -1.16 0.00 0.00 179.01 178.97 2ft9 h ASP 26 N 0.00 0.22 0.13 1.42 1.82 -2.02 -2.07 116.42 115.93 2ft9 h ASP 26 Ca 0.08 0.18 -0.36 0.00 -0.39 0.00 0.00 57.03 56.53 2ft9 h ASP 26 Cb 0.34 0.19 -0.04 0.00 0.68 0.00 0.00 39.33 40.50 2ft9 h ASP 26 CO -0.00 -0.08 -2.10 -0.38 -1.61 0.00 0.00 179.24 175.06 2ft9 n ILE 27 N -5.12 1.67 -0.29 2.25 5.41 0.30 -4.29 119.36 119.29 2ft9 n ILE 27 Ca 0.23 -0.66 0.03 0.00 1.00 0.00 0.00 62.75 63.34 2ft9 n ILE 27 Cb 0.70 -1.50 0.17 0.00 -0.71 0.00 0.00 39.64 38.30 2ft9 n ILE 27 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 2ft9 h ILE 28 N 0.04 0.91 -0.85 1.39 2.04 -1.13 0.31 117.51 120.21 2ft9 h ILE 28 Ca -0.45 -0.27 0.20 0.00 1.00 0.00 0.00 64.86 65.34 2ft9 h ILE 28 Cb 2.01 0.05 -0.12 0.00 -0.74 0.00 0.00 36.82 38.03 2ft9 h ILE 28 CO 0.04 0.14 0.33 -1.13 0.00 0.00 0.00 178.15 177.54 2ft9 h ASN 29 N 0.78 0.25 0.00 1.72 -1.24 -1.56 -2.52 115.58 113.01 2ft9 h ASN 29 Ca 0.40 0.15 -0.08 0.00 0.71 0.00 0.00 56.30 57.48 2ft9 h ASN 29 Cb 0.36 0.15 -0.01 0.00 0.73 0.00 0.00 38.32 39.55 2ft9 h ASN 29 CO -0.25 -0.00 -0.58 0.58 -1.29 0.00 0.00 177.43 175.89 2ft9 h VAL 30 N 0.37 0.61 -0.94 2.57 2.07 -1.45 -3.40 116.25 116.08 2ft9 h VAL 30 Ca 0.52 -1.62 0.19 0.00 0.82 0.00 0.00 66.70 66.61 2ft9 h VAL 30 Cb 0.95 1.31 -0.11 0.00 -1.52 0.00 0.00 31.29 31.92 2ft9 h VAL 30 CO -0.52 0.21 0.52 0.00 0.02 0.00 0.00 177.57 177.79 2ft9 h ALA 31 N -0.66 1.51 -0.16 1.67 0.00 -0.43 -2.46 119.26 118.73 2ft9 h ALA 31 Ca -0.12 0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.94 2ft9 h ALA 31 Cb 0.76 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2ft9 h ALA 31 CO -0.07 -0.13 0.15 1.57 0.00 0.00 0.00 179.25 180.77 2ft9 h LYS 32 N 0.64 0.00 -0.43 0.00 2.10 -1.66 -2.29 116.57 114.92 2ft9 h LYS 32 Ca 0.54 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.19 2ft9 h LYS 32 Cb 0.87 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.20 2ft9 h LYS 32 CO -0.41 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 176.79 2ft9 n ASP 33 N -4.05 3.43 -4.35 7.07 10.43 -0.93 -4.86 116.55 123.29 2ft9 n ASP 33 Ca 0.01 -1.96 -0.36 0.00 2.57 0.00 0.00 54.79 55.04 2ft9 n ASP 33 Cb 0.27 -0.28 -0.13 0.00 1.84 0.00 0.00 41.12 42.82 2ft9 n ASP 33 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2ft9 s ILE 34 N -1.30 3.84 -0.27 0.53 1.01 -0.86 -5.08 121.20 119.07 2ft9 s ILE 34 Ca 0.38 -0.58 -0.11 0.00 0.00 0.00 0.00 60.65 60.33 2ft9 s ILE 34 Cb 0.21 -2.91 -0.05 0.00 0.01 0.00 0.00 42.46 39.73 2ft9 s ILE 34 CO 0.29 0.20 0.21 0.20 0.00 0.00 0.00 174.94 175.84 2ft9 s ASN 35 N 1.51 6.07 0.63 3.58 0.02 -1.26 -5.01 114.94 120.48 2ft9 s ASN 35 Ca 0.04 0.06 -0.09 0.00 -1.02 0.00 0.00 52.86 51.84 2ft9 s ASN 35 Cb -0.16 -2.13 -0.00 0.00 0.02 0.00 0.00 41.25 38.97 2ft9 s ASN 35 CO 0.01 -0.04 0.99 -2.16 0.02 0.00 0.00 177.10 175.92 2ft9 s PRO 36 N 1.64 3.11 -0.13 -0.60 0.04 -1.26 -4.78 135.00 133.03 2ft9 s PRO 36 Ca 0.08 0.36 -0.24 0.00 0.04 0.00 0.00 61.00 61.25 2ft9 s PRO 36 Cb -0.15 -2.15 -0.03 0.00 0.04 0.00 0.00 34.50 32.21 2ft9 s PRO 36 CO 0.10 -0.74 0.74 0.42 0.04 0.00 0.00 177.00 177.55 2ft9 s ILE 37 N -3.14 4.98 -0.64 0.56 1.01 -0.66 -2.25 121.20 121.06 2ft9 s ILE 37 Ca 0.55 1.47 -0.10 0.00 0.00 0.00 0.00 60.65 62.57 2ft9 s ILE 37 Cb -0.11 -4.06 0.17 0.00 0.01 0.00 0.00 42.46 38.47 2ft9 s ILE 37 CO 0.50 0.13 0.53 -0.63 0.00 0.00 0.00 174.94 175.47 2ft9 s ILE 38 N 1.56 4.69 -0.15 2.92 1.01 0.39 -0.67 121.20 130.95 2ft9 s ILE 38 Ca 0.36 -2.28 -0.29 0.00 0.00 0.00 0.00 60.65 58.44 2ft9 s ILE 38 Cb -0.17 -4.00 -0.01 0.00 0.01 0.00 0.00 42.46 38.29 2ft9 s ILE 38 CO 0.14 -0.90 1.20 -0.70 0.00 0.00 0.00 174.94 174.68 2ft9 s GLU 39 N 0.63 4.27 -0.19 2.79 2.56 0.19 -0.91 118.70 128.03 2ft9 s GLU 39 Ca 0.12 1.60 0.01 0.00 0.00 0.00 0.00 54.97 56.70 2ft9 s GLU 39 Cb -0.20 -3.69 0.03 0.00 2.00 0.00 0.00 34.13 32.27 2ft9 s GLU 39 CO -0.04 -0.62 -0.16 0.42 -0.56 0.00 0.00 175.26 174.30 2ft9 s ILE 40 N 3.12 1.96 -0.06 -3.70 1.01 -0.27 -0.49 121.20 122.77 2ft9 s ILE 40 Ca 0.53 -1.04 0.03 0.00 0.00 0.00 0.00 60.65 60.16 2ft9 s ILE 40 Cb -0.21 -1.87 -0.03 0.00 0.01 0.00 0.00 42.46 40.36 2ft9 s ILE 40 CO 0.15 0.37 -0.12 -1.58 0.00 0.00 0.00 174.94 173.75 2ft9 s GLN 41 N 1.29 2.60 -0.24 2.79 0.74 0.89 -1.44 119.66 126.29 2ft9 s GLN 41 Ca 0.01 -0.66 -0.03 0.00 0.05 0.00 0.00 55.36 54.74 2ft9 s GLN 41 Cb -0.15 -2.44 0.13 0.00 1.10 0.00 0.00 33.01 31.65 2ft9 s GLN 41 CO -0.11 0.62 0.35 -1.14 -0.55 0.00 0.00 175.29 174.47 2ft9 s GLN 42 N -0.71 0.32 0.12 1.67 0.74 -1.26 -1.06 119.66 119.48 2ft9 s GLN 42 Ca 0.11 0.49 -0.16 0.00 0.05 0.00 0.00 55.36 55.85 2ft9 s GLN 42 Cb -0.11 -0.59 -0.02 0.00 1.10 0.00 0.00 33.01 33.39 2ft9 s GLN 42 CO 0.01 -0.64 1.62 -0.97 -0.55 0.00 0.00 175.29 174.76 2ft9 h ASN 43 N 8.20 0.57 0.00 6.67 -1.24 -1.90 -3.48 115.58 124.40 2ft9 h ASN 43 Ca -0.19 -0.23 0.00 0.00 0.71 0.00 0.00 56.30 56.59 2ft9 h ASN 43 Cb 1.15 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 40.05 2ft9 h ASN 43 CO 0.27 0.65 0.00 0.61 -1.29 0.00 0.00 177.43 177.67 2ft9 n GLY 44 N -0.58 -2.40 0.09 1.57 0.00 -1.26 -4.91 105.19 97.71 2ft9 n GLY 44 Ca -0.01 0.77 0.06 0.00 0.00 0.00 0.00 46.02 46.85 2ft9 n GLY 44 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ft9 n ASP 45 N 0.00 0.65 -4.86 1.61 4.64 -1.26 -4.96 116.55 112.37 2ft9 n ASP 45 Ca 0.00 0.27 -0.33 0.00 -1.38 0.00 0.00 54.79 53.34 2ft9 n ASP 45 Cb 0.00 0.66 -0.06 0.00 -1.04 0.00 0.00 41.12 40.69 2ft9 n ASP 45 CO 0.00 0.00 0.00 0.20 -0.82 0.00 0.00 177.20 176.58 2ft9 s ASN 46 N -5.36 6.70 -0.05 1.67 0.01 -1.26 -3.11 114.94 113.53 2ft9 s ASN 46 Ca -0.03 0.97 0.01 0.00 -0.71 0.00 0.00 52.86 53.10 2ft9 s ASN 46 Cb 0.10 -2.25 0.02 0.00 0.41 0.00 0.00 41.25 39.53 2ft9 s ASN 46 CO 0.82 0.01 -0.07 -0.36 -1.51 0.00 0.00 177.10 175.99 2ft9 s PHE 47 N -1.66 0.98 -0.17 2.20 0.40 0.52 -2.42 117.98 117.83 2ft9 s PHE 47 Ca 0.43 -0.32 -0.01 0.00 -0.60 0.00 0.00 56.93 56.43 2ft9 s PHE 47 Cb -0.13 -0.80 -0.01 0.00 0.51 0.00 0.00 43.02 42.60 2ft9 s PHE 47 CO 0.20 -0.22 -0.11 0.08 0.70 0.00 0.00 175.22 175.88 2ft9 s VAL 48 N 0.82 3.03 -0.15 -0.44 1.01 -0.23 -1.00 120.40 123.43 2ft9 s VAL 48 Ca -0.12 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.22 2ft9 s VAL 48 Cb -0.15 -2.31 0.03 0.00 0.00 0.00 0.00 36.38 33.94 2ft9 s VAL 48 CO 0.01 0.49 -0.12 -0.69 0.00 0.00 0.00 175.10 174.79 2ft9 s VAL 49 N 0.93 1.45 -0.20 2.92 1.01 0.35 -0.08 120.40 126.79 2ft9 s VAL 49 Ca -0.02 -0.62 -0.03 0.00 0.00 0.00 0.00 61.98 61.30 2ft9 s VAL 49 Cb -0.15 -1.42 -0.01 0.00 0.00 0.00 0.00 36.38 34.80 2ft9 s VAL 49 CO -0.01 0.38 -0.05 -0.89 0.00 0.00 0.00 175.10 174.53 2ft9 s THR 50 N 1.52 3.42 -0.25 3.92 2.01 0.36 -0.03 115.64 126.59 2ft9 s THR 50 Ca 0.04 -0.49 -0.08 0.00 0.31 0.00 0.00 61.69 61.47 2ft9 s THR 50 Cb -0.13 -2.53 -0.03 0.00 0.01 0.00 0.00 72.50 69.81 2ft9 s THR 50 CO -0.10 0.45 0.09 -0.94 -0.69 0.00 0.00 174.62 173.43 2ft9 s SER 51 N 1.16 5.36 -0.13 3.53 1.04 -0.53 0.53 113.70 124.67 2ft9 s SER 51 Ca 0.02 -0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.32 2ft9 s SER 51 Cb -0.14 -1.96 0.02 0.00 0.10 0.00 0.00 66.02 64.03 2ft9 s SER 51 CO -0.01 -0.01 -0.13 -1.59 0.98 0.00 0.00 173.24 172.48 2ft9 s LYS 52 N 1.47 2.10 0.55 4.02 -2.85 0.16 -1.21 119.74 123.97 2ft9 s LYS 52 Ca 0.06 -0.49 0.03 0.00 -1.00 0.00 0.00 55.97 54.57 2ft9 s LYS 52 Cb -0.15 -1.93 0.05 0.00 -2.06 0.00 0.00 37.83 33.73 2ft9 s LYS 52 CO 0.05 -0.20 0.77 0.95 0.10 0.00 0.00 175.35 177.01 2ft9 s THR 53 N 1.42 2.62 0.56 3.79 -4.23 -0.45 -1.65 115.64 117.70 2ft9 s THR 53 Ca 0.02 -0.74 0.33 0.00 -1.18 0.00 0.00 61.69 60.12 2ft9 s THR 53 Cb -0.13 -2.88 0.49 0.00 1.34 0.00 0.00 72.50 71.32 2ft9 s THR 53 CO -0.08 0.00 1.82 -0.65 -0.54 0.00 0.00 174.62 175.17 2ft9 h PRO 54 N 0.10 0.00 0.00 3.99 0.11 -2.01 -2.99 132.00 131.20 2ft9 h PRO 54 Ca -0.40 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.70 2ft9 h PRO 54 Cb 1.29 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.40 2ft9 h PRO 54 CO 0.48 0.00 -1.19 0.09 -0.21 0.00 0.00 178.00 177.17 2ft9 n ASN 55 N -4.04 4.10 -4.31 -2.05 4.13 -1.26 -5.09 115.26 106.73 2ft9 n ASN 55 Ca 0.20 0.00 -0.22 0.00 1.68 0.00 0.00 54.58 56.24 2ft9 n ASN 55 Cb 1.06 1.09 -0.10 0.00 -1.54 0.00 0.00 39.78 40.29 2ft9 n ASN 55 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2ft9 s GLN 56 N -2.24 1.70 -0.22 3.52 -0.21 -1.13 -5.16 119.66 115.91 2ft9 s GLN 56 Ca -0.01 -1.97 -0.15 0.00 0.02 0.00 0.00 55.36 53.24 2ft9 s GLN 56 Cb 0.02 -0.66 0.06 0.00 1.00 0.00 0.00 33.01 33.43 2ft9 s GLN 56 CO 0.16 -0.30 0.54 0.45 -2.12 0.00 0.00 175.29 174.02 2ft9 s SER 57 N -3.49 -0.66 -0.22 5.90 0.15 -1.26 -1.34 113.70 112.78 2ft9 s SER 57 Ca 0.33 1.15 -0.02 0.00 0.70 0.00 0.00 55.95 58.11 2ft9 s SER 57 Cb 0.07 1.08 0.07 0.00 -1.71 0.00 0.00 66.02 65.52 2ft9 s SER 57 CO 0.15 -0.21 0.04 -0.69 1.20 0.00 0.00 173.24 173.73 2ft9 s VAL 58 N 1.06 0.65 0.03 4.45 1.01 -0.35 -5.01 120.40 122.23 2ft9 s VAL 58 Ca -0.06 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.18 2ft9 s VAL 58 Cb -0.06 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 2ft9 s VAL 58 CO -0.10 -0.29 0.06 0.28 0.00 0.00 0.00 175.10 175.05 2ft9 s THR 59 N 1.79 4.52 0.05 3.92 -1.32 -1.26 -1.45 115.64 121.89 2ft9 s THR 59 Ca 0.01 -0.61 -0.01 0.00 -1.21 0.00 0.00 61.69 59.87 2ft9 s THR 59 Cb -0.17 -3.10 -0.03 0.00 -1.51 0.00 0.00 72.50 67.68 2ft9 s THR 59 CO -0.11 0.26 -0.01 0.20 -2.21 0.00 0.00 174.62 172.74 2ft9 s ASN 60 N -1.98 0.43 -0.01 8.08 0.01 0.96 -4.93 114.94 117.50 2ft9 s ASN 60 Ca 0.25 -0.90 0.06 0.00 -0.71 0.00 0.00 52.86 51.56 2ft9 s ASN 60 Cb -0.12 0.20 -0.02 0.00 0.41 0.00 0.00 41.25 41.72 2ft9 s ASN 60 CO 0.17 -0.57 -0.20 -0.44 -1.51 0.00 0.00 177.10 174.55 2ft9 s SER 61 N -2.71 2.33 -0.06 -1.22 0.01 -1.26 -0.49 113.70 110.31 2ft9 s SER 61 Ca 0.04 -0.38 -0.30 0.00 1.31 0.00 0.00 55.95 56.61 2ft9 s SER 61 Cb 0.05 -0.25 0.07 0.00 0.21 0.00 0.00 66.02 66.10 2ft9 s SER 61 CO -0.09 0.23 0.67 0.72 0.41 0.00 0.00 173.24 175.18 2ft9 s PHE 62 N -0.51 -0.65 -0.04 2.43 -0.12 -0.17 -4.79 117.98 114.13 2ft9 s PHE 62 Ca 0.08 1.13 0.06 0.00 -0.05 0.00 0.00 56.93 58.14 2ft9 s PHE 62 Cb -0.08 0.40 -0.02 0.00 -0.63 0.00 0.00 43.02 42.69 2ft9 s PHE 62 CO -0.00 -0.60 -0.20 0.99 -0.05 0.00 0.00 175.22 175.35 2ft9 s THR 63 N -1.14 2.51 0.27 -4.49 2.01 -1.26 -0.36 115.64 113.18 2ft9 s THR 63 Ca -0.11 -0.93 -0.31 0.00 0.31 0.00 0.00 61.69 60.66 2ft9 s THR 63 Cb -0.00 -1.94 -0.12 0.00 0.01 0.00 0.00 72.50 70.45 2ft9 s THR 63 CO 0.10 0.58 1.56 -0.38 -0.69 0.00 0.00 174.62 175.79 2ft9 n ILE 64 N 2.48 0.85 0.00 1.82 5.41 -1.18 -1.91 119.36 126.83 2ft9 n ILE 64 Ca -0.17 -0.21 0.00 0.00 1.00 0.00 0.00 62.75 63.37 2ft9 n ILE 64 Cb 0.52 -1.83 0.00 0.00 -0.71 0.00 0.00 39.64 37.62 2ft9 n ILE 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2ft9 n GLY 65 N 2.41 2.60 3.62 7.39 0.00 -1.22 -4.96 105.19 115.03 2ft9 n GLY 65 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2ft9 n GLY 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ft9 s LYS 66 N 0.00 4.01 0.03 1.61 2.20 -0.80 -4.98 119.74 121.80 2ft9 s LYS 66 Ca 0.00 0.77 -0.30 0.00 -0.36 0.00 0.00 55.97 56.08 2ft9 s LYS 66 Cb 0.00 -3.72 -0.08 0.00 -1.51 0.00 0.00 37.83 32.51 2ft9 s LYS 66 CO 0.00 -0.74 1.84 -2.00 -0.36 0.00 0.00 175.35 174.10 2ft9 s GLU 67 N 3.17 4.16 0.32 4.03 2.12 -1.26 -4.47 118.70 126.76 2ft9 s GLU 67 Ca 0.37 2.48 0.09 0.00 0.36 0.00 0.00 54.97 58.27 2ft9 s GLU 67 Cb -0.14 -4.00 -0.05 0.00 0.26 0.00 0.00 34.13 30.20 2ft9 s GLU 67 CO 0.13 -0.89 -0.00 0.00 -0.54 0.00 0.00 175.26 173.95 2ft9 s ALA 68 N 3.98 3.17 -0.20 6.30 0.00 -0.13 -4.95 121.76 129.94 2ft9 s ALA 68 Ca 0.82 -1.90 -0.20 0.00 0.00 0.00 0.00 51.96 50.69 2ft9 s ALA 68 Cb -0.40 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.25 2ft9 s ALA 68 CO 0.37 0.11 0.58 -1.21 0.00 0.00 0.00 175.76 175.61 2ft9 s GLU 69 N -3.70 4.19 -0.12 0.00 2.02 -1.26 -2.69 118.70 117.14 2ft9 s GLU 69 Ca 0.34 0.51 0.03 0.00 0.02 0.00 0.00 54.97 55.87 2ft9 s GLU 69 Cb -0.02 -3.58 0.00 0.00 0.10 0.00 0.00 34.13 30.64 2ft9 s GLU 69 CO 0.19 -0.21 -0.21 0.42 0.02 0.00 0.00 175.26 175.46 2ft9 s ILE 70 N 1.84 2.21 -0.19 -1.63 -1.09 0.75 -4.78 121.20 118.31 2ft9 s ILE 70 Ca 0.26 -0.95 0.01 0.00 -2.23 0.00 0.00 60.65 57.74 2ft9 s ILE 70 Cb -0.16 -1.87 0.02 0.00 -1.58 0.00 0.00 42.46 38.87 2ft9 s ILE 70 CO 0.10 0.55 -0.18 -0.89 -1.23 0.00 0.00 174.94 173.29 2ft9 s THR 71 N 0.56 2.20 0.00 2.92 2.01 -1.26 0.70 115.64 122.77 2ft9 s THR 71 Ca -0.13 -0.94 0.00 0.00 0.31 0.00 0.00 61.69 60.94 2ft9 s THR 71 Cb -0.17 -1.95 0.00 0.00 0.01 0.00 0.00 72.50 70.39 2ft9 s THR 71 CO 0.04 0.49 0.00 -1.54 -0.69 0.00 0.00 174.62 172.92 2ft9 n SER 72 N 4.63 0.00 -4.77 3.53 3.41 -0.68 -4.89 113.62 114.85 2ft9 n SER 72 Ca -0.20 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.02 2ft9 n SER 72 Cb 0.50 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.44 2ft9 n SER 72 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ft9 s MET 73 N 4.16 3.90 0.00 4.33 0.23 -1.26 -2.86 119.30 127.80 2ft9 s MET 73 Ca 0.00 2.04 0.00 0.00 -1.03 0.00 0.00 55.69 56.70 2ft9 s MET 73 Cb 0.00 -2.66 0.00 0.00 -1.53 0.00 0.00 34.83 30.64 2ft9 s MET 73 CO 0.00 -0.51 0.00 0.41 -2.03 0.00 0.00 175.02 172.89 2ft9 n GLY 74 N 0.64 0.51 2.07 3.16 0.00 -1.26 -2.52 105.19 107.78 2ft9 n GLY 74 Ca 0.05 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.04 2ft9 n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ft9 n GLY 75 N -1.93 0.36 3.65 -0.02 0.00 -1.13 -5.00 105.19 101.12 2ft9 n GLY 75 Ca 0.00 -0.82 -0.43 0.00 0.00 0.00 0.00 46.02 44.77 2ft9 n GLY 75 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ft9 s LYS 76 N -3.53 4.12 -0.24 1.61 2.36 -1.05 -4.89 119.74 118.12 2ft9 s LYS 76 Ca 0.00 1.72 -0.17 0.00 -2.55 0.00 0.00 55.97 54.97 2ft9 s LYS 76 Cb 0.00 -3.87 -0.03 0.00 -1.05 0.00 0.00 37.83 32.88 2ft9 s LYS 76 CO 0.00 -0.87 0.48 0.15 1.55 0.00 0.00 175.35 176.65 2ft9 s LYS 77 N 3.87 4.11 -0.07 4.03 -0.14 -1.26 -1.68 119.74 128.59 2ft9 s LYS 77 Ca 0.61 0.28 0.01 0.00 -1.36 0.00 0.00 55.97 55.51 2ft9 s LYS 77 Cb -0.24 -3.61 -0.03 0.00 -1.68 0.00 0.00 37.83 32.27 2ft9 s LYS 77 CO 0.21 -0.24 -0.07 0.42 -0.76 0.00 0.00 175.35 174.91 2ft9 s ILE 78 N 1.94 3.72 -0.18 2.17 1.01 0.22 -4.97 121.20 125.11 2ft9 s ILE 78 Ca 0.21 -0.47 -0.05 0.00 0.00 0.00 0.00 60.65 60.34 2ft9 s ILE 78 Cb -0.15 -2.53 -0.03 0.00 0.01 0.00 0.00 42.46 39.76 2ft9 s ILE 78 CO 0.09 0.60 0.00 -1.59 0.00 0.00 0.00 174.94 174.04 2ft9 s LYS 79 N -0.76 3.73 0.06 2.79 -2.85 -1.26 -0.17 119.74 121.27 2ft9 s LYS 79 Ca 0.12 -0.48 -0.27 0.00 -1.00 0.00 0.00 55.97 54.34 2ft9 s LYS 79 Cb -0.11 -3.06 0.09 0.00 -2.06 0.00 0.00 37.83 32.69 2ft9 s LYS 79 CO 0.02 0.15 0.80 0.00 0.10 0.00 0.00 175.35 176.41 2ft9 s THR 81 N -3.34 2.64 -0.57 0.00 2.01 -1.26 -0.95 115.64 114.16 2ft9 s THR 81 Ca 0.04 -1.24 -0.23 0.00 0.31 0.00 0.00 61.69 60.57 2ft9 s THR 81 Cb -0.01 -2.41 0.05 0.00 0.01 0.00 0.00 72.50 70.14 2ft9 s THR 81 CO -0.10 0.11 0.91 -0.69 -0.69 0.00 0.00 174.62 174.17 2ft9 s VAL 82 N 1.25 4.42 -0.01 3.82 1.01 -1.26 -4.42 120.40 125.21 2ft9 s VAL 82 Ca -0.03 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 2ft9 s VAL 82 Cb -0.18 -4.55 -0.04 0.00 0.00 0.00 0.00 36.38 31.62 2ft9 s VAL 82 CO -0.05 -1.16 0.09 -0.69 0.00 0.00 0.00 175.10 173.30 2ft9 s VAL 83 N 3.84 4.81 -0.26 2.92 1.01 0.13 -3.40 120.40 129.46 2ft9 s VAL 83 Ca 0.27 -0.38 -0.17 0.00 0.00 0.00 0.00 61.98 61.71 2ft9 s VAL 83 Cb -0.14 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.00 2ft9 s VAL 83 CO 0.16 0.35 0.45 -0.22 0.00 0.00 0.00 175.10 175.84 2ft9 s LEU 84 N -1.76 4.06 -0.51 3.92 0.20 -1.26 0.12 118.68 123.44 2ft9 s LEU 84 Ca 0.23 0.43 0.04 0.00 0.69 0.00 0.00 54.13 55.52 2ft9 s LEU 84 Cb -0.12 -2.56 0.13 0.00 -0.43 0.00 0.00 46.19 43.21 2ft9 s LEU 84 CO 0.14 -0.23 0.26 -1.61 -0.29 0.00 0.00 176.35 174.63 2ft9 s GLU 85 N 2.12 1.90 -1.03 1.98 2.02 0.76 -4.87 118.70 121.57 2ft9 s GLU 85 Ca 0.19 -2.56 -0.11 0.00 0.02 0.00 0.00 54.97 52.51 2ft9 s GLU 85 Cb -0.16 -3.19 -0.03 0.00 0.10 0.00 0.00 34.13 30.86 2ft9 s GLU 85 CO 0.09 -1.12 0.83 0.41 0.02 0.00 0.00 175.26 175.49 2ft9 n GLY 86 N 3.13 -1.12 1.41 -1.39 0.00 -1.26 -2.93 105.19 103.04 2ft9 n GLY 86 Ca 0.06 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.60 2ft9 n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ft9 n GLY 87 N -1.50 2.45 3.86 -0.02 0.00 -1.26 -5.02 105.19 103.70 2ft9 n GLY 87 Ca -0.08 -0.48 -0.32 0.00 0.00 0.00 0.00 46.02 45.14 2ft9 n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ft9 s LYS 88 N 0.00 3.88 -0.23 1.61 3.01 -1.15 -4.77 119.74 122.09 2ft9 s LYS 88 Ca 0.00 0.45 -0.16 0.00 -1.01 0.00 0.00 55.97 55.24 2ft9 s LYS 88 Cb 0.00 -2.54 -0.03 0.00 -1.01 0.00 0.00 37.83 34.24 2ft9 s LYS 88 CO 0.00 0.23 0.44 -0.51 0.51 0.00 0.00 175.35 176.01 2ft9 s LEU 89 N -2.96 4.10 -0.09 3.17 1.43 -0.45 -0.17 118.68 123.71 2ft9 s LEU 89 Ca 0.50 0.48 0.03 0.00 -1.03 0.00 0.00 54.13 54.11 2ft9 s LEU 89 Cb -0.11 -2.55 0.01 0.00 0.03 0.00 0.00 46.19 43.57 2ft9 s LEU 89 CO 0.20 -0.17 -0.17 -0.69 0.23 0.00 0.00 176.35 175.76 2ft9 s VAL 90 N 1.79 1.52 -0.00 -1.59 1.01 0.12 -0.30 120.40 122.94 2ft9 s VAL 90 Ca 0.19 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.48 2ft9 s VAL 90 Cb -0.15 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 34.88 2ft9 s VAL 90 CO 0.09 0.44 -0.00 -0.55 0.00 0.00 0.00 175.10 175.08 2ft9 s SER 91 N 0.63 0.06 -0.16 3.32 0.15 -0.53 0.22 113.70 117.40 2ft9 s SER 91 Ca -0.14 -0.01 -0.20 0.00 0.70 0.00 0.00 55.95 56.31 2ft9 s SER 91 Cb -0.16 -0.02 0.05 0.00 -1.71 0.00 0.00 66.02 64.18 2ft9 s SER 91 CO 0.04 -0.01 0.53 -1.59 1.20 0.00 0.00 173.24 173.41 2ft9 s LYS 92 N 0.09 0.68 0.00 5.44 -2.85 -1.26 0.50 119.74 122.35 2ft9 s LYS 92 Ca -0.01 0.58 0.00 0.00 -1.00 0.00 0.00 55.97 55.54 2ft9 s LYS 92 Cb -0.01 0.33 0.00 0.00 -2.06 0.00 0.00 37.83 36.08 2ft9 s LYS 92 CO -0.00 -0.12 0.00 0.25 0.10 0.00 0.00 175.35 175.58 2ft9 n THR 93 N 2.38 0.00 0.93 3.79 -2.24 -0.45 -4.79 114.28 113.90 2ft9 n THR 93 Ca -0.15 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.76 2ft9 n THR 93 Cb 0.56 0.00 0.48 0.00 -2.10 0.00 0.00 70.33 69.28 2ft9 n THR 93 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2ft9 n ASP 94 N 0.00 0.26 -0.07 3.42 5.75 -1.26 -4.30 116.55 120.35 2ft9 n ASP 94 Ca 0.00 0.32 -0.11 0.00 -0.01 0.00 0.00 54.79 54.99 2ft9 n ASP 94 Cb 0.00 -0.33 -0.07 0.00 -1.03 0.00 0.00 41.12 39.69 2ft9 n ASP 94 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2ft9 n GLN 95 N -1.63 0.37 -4.30 0.11 1.13 -1.26 -5.04 117.38 106.75 2ft9 n GLN 95 Ca 0.06 0.09 -0.16 0.00 -1.94 0.00 0.00 57.00 55.05 2ft9 n GLN 95 Cb 0.36 -1.28 -0.10 0.00 0.11 0.00 0.00 30.24 29.32 2ft9 n GLN 95 CO 0.00 0.00 0.00 -0.59 -1.44 0.00 0.00 177.06 175.03 2ft9 s PHE 96 N -2.29 1.47 -0.09 1.08 -0.12 -1.26 -4.33 117.98 112.43 2ft9 s PHE 96 Ca -0.20 -0.99 -0.02 0.00 -0.05 0.00 0.00 56.93 55.67 2ft9 s PHE 96 Cb 0.05 -0.85 0.04 0.00 -0.63 0.00 0.00 43.02 41.63 2ft9 s PHE 96 CO 0.34 -0.13 0.03 -1.12 -0.05 0.00 0.00 175.22 174.28 2ft9 s SER 97 N -3.27 1.76 -0.12 1.98 0.01 -0.49 -1.34 113.70 112.22 2ft9 s SER 97 Ca 0.29 -0.21 -0.00 0.00 1.31 0.00 0.00 55.95 57.34 2ft9 s SER 97 Cb 0.06 -0.38 -0.02 0.00 0.21 0.00 0.00 66.02 65.89 2ft9 s SER 97 CO 0.08 -0.24 -0.12 -2.28 0.41 0.00 0.00 173.24 171.10 2ft9 s HIS 98 N 2.01 2.83 -0.16 2.43 2.46 0.18 -1.30 115.29 123.74 2ft9 s HIS 98 Ca 0.04 -0.52 -0.03 0.00 0.47 0.00 0.00 55.06 55.01 2ft9 s HIS 98 Cb -0.13 -1.83 0.05 0.00 -0.13 0.00 0.00 32.58 30.54 2ft9 s HIS 98 CO -0.06 -0.12 0.05 0.42 -2.47 0.00 0.00 174.74 172.56 2ft9 s ILE 99 N 0.19 0.29 0.07 0.89 1.01 -0.22 -1.45 121.20 121.97 2ft9 s ILE 99 Ca -0.07 -0.30 0.05 0.00 0.00 0.00 0.00 60.65 60.33 2ft9 s ILE 99 Cb -0.15 -0.79 -0.04 0.00 0.01 0.00 0.00 42.46 41.50 2ft9 s ILE 99 CO 0.05 -0.15 -0.06 -1.58 0.00 0.00 0.00 174.94 173.19 2ft9 s GLN 100 N 1.97 2.38 -0.30 2.79 0.74 0.59 -0.62 119.66 127.22 2ft9 s GLN 100 Ca 0.01 -0.87 -0.09 0.00 0.05 0.00 0.00 55.36 54.46 2ft9 s GLN 100 Cb -0.16 -2.44 0.14 0.00 1.10 0.00 0.00 33.01 31.65 2ft9 s GLN 100 CO -0.08 0.55 0.65 -2.00 -0.55 0.00 0.00 175.29 173.86 2ft9 s GLU 101 N -1.98 0.58 0.09 1.67 -6.30 -0.89 -1.34 118.70 110.53 2ft9 s GLU 101 Ca 0.21 1.41 -0.15 0.00 -2.50 0.00 0.00 54.97 53.94 2ft9 s GLU 101 Cb -0.11 0.84 -0.06 0.00 0.00 0.00 0.00 34.13 34.80 2ft9 s GLU 101 CO 0.13 -0.25 0.51 0.14 0.02 0.00 0.00 175.26 175.82 2ft9 s VAL 102 N 2.89 4.88 -0.41 3.70 -7.23 -1.26 -0.75 120.40 122.23 2ft9 s VAL 102 Ca -0.03 0.90 0.04 0.00 -1.81 0.00 0.00 61.98 61.08 2ft9 s VAL 102 Cb -0.12 -3.77 0.16 0.00 0.56 0.00 0.00 36.38 33.21 2ft9 s VAL 102 CO -0.19 0.40 0.40 -0.75 -0.31 0.00 0.00 175.10 174.65 2ft9 s LYS 103 N -1.54 0.79 6.41 4.82 2.20 0.19 -4.99 119.74 127.62 2ft9 s LYS 103 Ca 0.32 -1.36 0.00 0.00 -0.36 0.00 0.00 55.97 54.57 2ft9 s LYS 103 Cb -0.16 -0.90 0.00 0.00 -1.51 0.00 0.00 37.83 35.25 2ft9 s LYS 103 CO 0.18 -1.28 0.00 0.41 -0.36 0.00 0.00 175.35 174.29 2ft9 n GLY 104 N 3.54 1.87 0.89 5.54 0.00 -1.26 -1.91 105.19 113.87 2ft9 n GLY 104 Ca 0.19 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.37 2ft9 n GLY 104 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ft9 n ASN 105 N 10.65 2.72 -4.51 1.61 4.13 -1.26 -4.94 115.26 123.66 2ft9 n ASN 105 Ca 0.00 -1.88 -0.33 0.00 1.68 0.00 0.00 54.58 54.04 2ft9 n ASN 105 Cb 0.00 -0.08 -0.12 0.00 -1.54 0.00 0.00 39.78 38.04 2ft9 n ASN 105 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 2ft9 s GLU 106 N -1.84 2.96 -0.05 3.52 2.56 -0.80 -1.81 118.70 123.23 2ft9 s GLU 106 Ca 0.33 -0.60 0.06 0.00 0.00 0.00 0.00 54.97 54.76 2ft9 s GLU 106 Cb 0.21 -2.60 -0.01 0.00 2.00 0.00 0.00 34.13 33.72 2ft9 s GLU 106 CO 0.31 0.51 -0.23 1.41 -0.56 0.00 0.00 175.26 176.69 2ft9 s MET 107 N -0.40 2.30 -0.16 4.30 -2.45 -0.56 0.55 119.30 122.89 2ft9 s MET 107 Ca 0.05 -0.83 0.00 0.00 -1.25 0.00 0.00 55.69 53.67 2ft9 s MET 107 Cb -0.12 -1.99 0.03 0.00 1.25 0.00 0.00 34.83 34.00 2ft9 s MET 107 CO 0.02 0.36 -0.10 0.08 1.05 0.00 0.00 175.02 176.43 2ft9 s VAL 108 N -0.16 1.43 -0.14 10.11 1.01 0.07 -0.84 120.40 131.88 2ft9 s VAL 108 Ca -0.02 -0.71 -0.03 0.00 0.00 0.00 0.00 61.98 61.21 2ft9 s VAL 108 Cb -0.13 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 2ft9 s VAL 108 CO 0.03 0.29 -0.03 -1.61 0.00 0.00 0.00 175.10 173.78 2ft9 s GLU 109 N 1.52 3.53 -0.18 2.72 2.02 0.13 -2.09 118.70 126.35 2ft9 s GLU 109 Ca 0.02 -0.49 -0.04 0.00 0.02 0.00 0.00 54.97 54.47 2ft9 s GLU 109 Cb -0.14 -2.89 -0.03 0.00 0.10 0.00 0.00 34.13 31.17 2ft9 s GLU 109 CO -0.09 0.34 -0.02 0.99 0.02 0.00 0.00 175.26 176.50 2ft9 s THR 110 N 0.09 3.92 -0.24 3.63 2.01 0.21 -0.01 115.64 125.26 2ft9 s THR 110 Ca 0.00 -0.34 -0.03 0.00 0.31 0.00 0.00 61.69 61.63 2ft9 s THR 110 Cb -0.13 -2.75 0.08 0.00 0.01 0.00 0.00 72.50 69.71 2ft9 s THR 110 CO 0.03 0.46 0.09 -0.22 -0.69 0.00 0.00 174.62 174.29 2ft9 s LEU 111 N 0.69 0.92 -0.15 4.42 2.96 -0.15 -1.06 118.68 126.31 2ft9 s LEU 111 Ca -0.01 -1.06 -0.02 0.00 -0.22 0.00 0.00 54.13 52.82 2ft9 s LEU 111 Cb -0.14 -0.47 -0.02 0.00 0.50 0.00 0.00 46.19 46.06 2ft9 s LEU 111 CO 0.02 -0.38 -0.08 -0.89 -1.32 0.00 0.00 176.35 173.70 2ft9 s THR 112 N 1.97 3.42 -0.09 3.68 2.01 -0.42 -0.34 115.64 125.87 2ft9 s THR 112 Ca 0.05 -0.52 -0.03 0.00 0.31 0.00 0.00 61.69 61.49 2ft9 s THR 112 Cb -0.16 -2.48 0.05 0.00 0.01 0.00 0.00 72.50 69.92 2ft9 s THR 112 CO -0.21 0.50 0.17 -0.69 -0.69 0.00 0.00 174.62 173.71 2ft9 s VAL 113 N 0.48 -0.26 -1.29 3.82 1.01 -0.95 -1.39 120.40 121.81 2ft9 s VAL 113 Ca -0.06 0.33 -0.05 0.00 0.00 0.00 0.00 61.98 62.20 2ft9 s VAL 113 Cb -0.15 -0.31 0.01 0.00 0.00 0.00 0.00 36.38 35.93 2ft9 s VAL 113 CO 0.04 0.14 0.63 0.61 0.00 0.00 0.00 175.10 176.51 2ft9 n GLY 114 N 5.22 -0.34 2.24 4.51 0.00 -1.26 -2.95 105.19 112.62 2ft9 n GLY 114 Ca -0.07 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2ft9 n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ft9 n GLY 115 N -1.50 0.86 3.22 -0.02 0.00 -1.26 -4.98 105.19 101.52 2ft9 n GLY 115 Ca -0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 2ft9 n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ft9 s ALA 116 N -3.38 2.46 -0.20 4.61 0.00 -1.15 -5.11 121.76 118.99 2ft9 s ALA 116 Ca 0.00 -1.11 -0.02 0.00 0.00 0.00 0.00 51.96 50.83 2ft9 s ALA 116 Cb 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 23.12 21.88 2ft9 s ALA 116 CO 0.00 -0.15 -0.11 0.99 0.00 0.00 0.00 175.76 176.49 2ft9 s THR 117 N 1.01 2.84 0.05 0.00 2.01 -1.26 -2.25 115.64 118.04 2ft9 s THR 117 Ca -0.02 -0.68 -0.22 0.00 0.31 0.00 0.00 61.69 61.08 2ft9 s THR 117 Cb -0.15 -2.26 -0.06 0.00 0.01 0.00 0.00 72.50 70.05 2ft9 s THR 117 CO -0.04 0.47 0.67 -0.22 -0.69 0.00 0.00 174.62 174.81 2ft9 s LEU 118 N 1.35 4.47 -0.35 4.42 2.96 0.53 -4.66 118.68 127.40 2ft9 s LEU 118 Ca 0.05 1.34 0.01 0.00 -0.22 0.00 0.00 54.13 55.30 2ft9 s LEU 118 Cb -0.14 -3.07 0.10 0.00 0.50 0.00 0.00 46.19 43.58 2ft9 s LEU 118 CO -0.07 0.12 0.09 -0.63 -1.32 0.00 0.00 176.35 174.54 2ft9 s ILE 119 N -0.46 2.67 -0.29 6.68 1.01 -0.98 -0.98 121.20 128.85 2ft9 s ILE 119 Ca 0.34 -2.11 -0.14 0.00 0.00 0.00 0.00 60.65 58.73 2ft9 s ILE 119 Cb -0.20 -2.85 -0.03 0.00 0.01 0.00 0.00 42.46 39.39 2ft9 s ILE 119 CO 0.21 -0.54 0.34 -0.60 0.00 0.00 0.00 174.94 174.34 2ft9 s ARG 120 N 1.03 3.88 -0.06 2.79 3.52 0.99 -2.52 118.95 128.57 2ft9 s ARG 120 Ca 0.07 -0.15 0.03 0.00 -0.13 0.00 0.00 55.73 55.55 2ft9 s ARG 120 Cb -0.20 -3.70 -0.02 0.00 -1.56 0.00 0.00 34.95 29.46 2ft9 s ARG 120 CO -0.06 -0.33 -0.14 1.03 -0.81 0.00 0.00 175.30 174.99 2ft9 s ARG 121 N 2.00 2.60 0.10 5.12 0.52 -0.41 0.19 118.95 129.06 2ft9 s ARG 121 Ca 0.13 -0.70 0.00 0.00 -0.52 0.00 0.00 55.73 54.64 2ft9 s ARG 121 Cb -0.16 -2.40 -0.04 0.00 0.52 0.00 0.00 34.95 32.87 2ft9 s ARG 121 CO 0.11 0.57 -0.02 -1.54 0.02 0.00 0.00 175.30 174.43 2ft9 s SER 122 N -0.59 0.77 -0.03 0.23 1.04 -0.02 -1.19 113.70 113.91 2ft9 s SER 122 Ca 0.08 -1.06 0.03 0.00 0.48 0.00 0.00 55.95 55.48 2ft9 s SER 122 Cb -0.11 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.18 2ft9 s SER 122 CO 0.01 -0.57 -0.10 -0.54 0.98 0.00 0.00 173.24 173.01 2ft9 s LYS 123 N -3.91 1.13 -0.07 4.02 1.02 -0.73 -1.49 119.74 119.70 2ft9 s LYS 123 Ca 0.14 -0.35 -0.34 0.00 0.02 0.00 0.00 55.97 55.43 2ft9 s LYS 123 Cb 0.07 -1.03 -0.12 0.00 -0.52 0.00 0.00 37.83 36.22 2ft9 s LYS 123 CO -0.04 0.12 1.86 -2.13 -0.92 0.00 0.00 175.35 174.24 2ft9 n ARG 124 N 3.32 2.16 0.00 1.68 0.63 -0.75 -2.26 116.66 121.43 2ft9 n ARG 124 Ca -0.19 0.79 0.01 0.00 -0.92 0.00 0.00 57.85 57.54 2ft9 n ARG 124 Cb 0.54 -2.63 0.01 0.00 0.45 0.00 0.00 32.46 30.83 2ft9 n ARG 124 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45