#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eky s ARG 5 N 0.00 2.20 0.20 2.12 3.52 -1.26 -5.06 118.95 120.67 2eky s ARG 5 Ca 0.00 -3.05 -0.30 0.00 -0.13 0.00 0.00 55.73 52.25 2eky s ARG 5 Cb 0.00 -3.21 -0.08 0.00 -1.56 0.00 0.00 34.95 30.09 2eky s ARG 5 CO 0.00 -1.25 1.21 0.21 -0.81 0.00 0.00 175.30 174.66 2eky s LYS 6 N -1.03 4.48 0.17 5.12 2.20 -1.26 -0.96 119.74 128.47 2eky s LYS 6 Ca 0.23 1.90 -0.04 0.00 -0.36 0.00 0.00 55.97 57.71 2eky s LYS 6 Cb -0.09 -3.23 -0.03 0.00 -1.51 0.00 0.00 37.83 32.97 2eky s LYS 6 CO -0.13 -0.09 0.17 0.14 -0.36 0.00 0.00 175.35 175.08 2eky s VAL 7 N -0.14 0.05 -0.08 4.02 -7.23 -0.52 -4.79 120.40 111.71 2eky s VAL 7 Ca 0.53 -1.77 0.03 0.00 -1.81 0.00 0.00 61.98 58.96 2eky s VAL 7 Cb -0.33 -2.15 -0.02 0.00 0.56 0.00 0.00 36.38 34.44 2eky s VAL 7 CO 0.38 -0.25 -0.16 -0.69 -0.31 0.00 0.00 175.10 174.07 2eky s VAL 8 N -4.06 2.82 0.17 1.32 1.01 -1.08 -2.31 120.40 118.26 2eky s VAL 8 Ca 0.27 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.45 2eky s VAL 8 Cb 0.06 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 2eky s VAL 8 CO 0.05 0.56 0.11 0.00 0.00 0.00 0.00 175.10 175.82 2eky s ALA 9 N -0.20 0.95 -0.02 5.51 0.00 0.30 -0.78 121.76 127.53 2eky s ALA 9 Ca -0.00 -1.54 0.02 0.00 0.00 0.00 0.00 51.96 50.43 2eky s ALA 9 Cb -0.13 1.11 0.00 0.00 0.00 0.00 0.00 23.12 24.10 2eky s ALA 9 CO 0.03 -0.55 -0.08 -2.00 0.00 0.00 0.00 175.76 173.17 2eky s GLU 10 N -4.10 0.78 -0.06 0.00 2.12 -0.19 -0.12 118.70 117.14 2eky s GLU 10 Ca 0.31 -0.26 0.04 0.00 0.36 0.00 0.00 54.97 55.42 2eky s GLU 10 Cb 0.07 -0.75 -0.00 0.00 0.26 0.00 0.00 34.13 33.71 2eky s GLU 10 CO 0.07 0.11 -0.19 0.08 -0.54 0.00 0.00 175.26 174.79 2eky s VAL 11 N 0.13 1.58 -0.04 3.70 1.01 0.34 -0.97 120.40 126.15 2eky s VAL 11 Ca -0.02 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.20 2eky s VAL 11 Cb -0.07 -1.37 0.01 0.00 0.00 0.00 0.00 36.38 34.96 2eky s VAL 11 CO 0.00 0.45 -0.08 -0.94 0.00 0.00 0.00 175.10 174.53 2eky s SER 12 N 0.17 1.26 -0.10 3.32 1.04 -0.82 -0.45 113.70 118.12 2eky s SER 12 Ca -0.08 -0.20 0.02 0.00 0.48 0.00 0.00 55.95 56.17 2eky s SER 12 Cb -0.14 -0.50 0.01 0.00 0.10 0.00 0.00 66.02 65.49 2eky s SER 12 CO 0.04 0.02 -0.17 -0.63 0.98 0.00 0.00 173.24 173.47 2eky s ILE 13 N 0.56 1.62 -0.33 -1.02 1.01 -1.26 -0.44 121.20 121.33 2eky s ILE 13 Ca -0.09 -0.73 -0.03 0.00 0.00 0.00 0.00 60.65 59.79 2eky s ILE 13 Cb -0.13 -1.45 0.06 0.00 0.01 0.00 0.00 42.46 40.95 2eky s ILE 13 CO 0.01 0.46 0.07 -0.63 0.00 0.00 0.00 174.94 174.86 2eky s ILE 14 N 0.78 3.26 0.04 2.92 1.01 0.26 -4.96 121.20 124.51 2eky s ILE 14 Ca -0.10 -1.46 -0.21 0.00 0.00 0.00 0.00 60.65 58.87 2eky s ILE 14 Cb -0.16 -2.94 -0.06 0.00 0.01 0.00 0.00 42.46 39.31 2eky s ILE 14 CO 0.01 -0.25 0.62 -2.16 0.00 0.00 0.00 174.94 173.17 2eky s PRO 15 N 1.27 4.33 -0.72 2.79 0.04 -1.26 -1.10 135.00 140.34 2eky s PRO 15 Ca -0.01 0.81 -0.08 0.00 0.04 0.00 0.00 61.00 61.76 2eky s PRO 15 Cb -0.20 -3.31 0.19 0.00 0.04 0.00 0.00 34.50 31.22 2eky s PRO 15 CO -0.01 0.46 0.60 -0.51 0.04 0.00 0.00 177.00 177.58 2eky s LEU 16 N -0.54 5.93 0.00 -3.56 1.43 0.06 -5.00 118.68 117.01 2eky s LEU 16 Ca 0.32 -2.81 0.00 0.00 -1.03 0.00 0.00 54.13 50.61 2eky s LEU 16 Cb -0.19 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.01 2eky s LEU 16 CO 0.19 -0.45 0.03 0.61 0.23 0.00 0.00 176.35 176.96 2eky n GLY 17 N 3.67 3.63 0.79 -3.19 0.00 -1.26 -4.07 105.19 104.76 2eky n GLY 17 Ca 0.11 -2.22 0.07 0.00 0.00 0.00 0.00 46.02 43.98 2eky n GLY 17 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2eky n LYS 18 N -0.46 2.62 -3.49 1.61 5.02 -1.26 -4.97 118.16 117.22 2eky n LYS 18 Ca -0.03 -2.11 -0.22 0.00 -2.02 0.00 0.00 58.31 53.94 2eky n LYS 18 Cb 0.13 -1.34 -0.00 0.00 -0.02 0.00 0.00 35.03 33.80 2eky n LYS 18 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2eky s GLY 19 N -1.02 2.10 0.10 0.72 0.00 -1.26 -5.05 107.32 102.92 2eky s GLY 19 Ca 0.28 -1.75 0.22 0.00 0.00 0.00 0.00 44.72 43.47 2eky s GLY 19 CO 0.20 -1.74 0.82 0.00 0.00 0.00 0.00 173.10 172.37 2eky n ALA 20 N -1.77 2.52 -2.65 3.20 0.00 -1.26 -4.80 120.51 115.74 2eky n ALA 20 Ca 0.05 -0.39 -0.43 0.00 0.00 0.00 0.00 53.44 52.67 2eky n ALA 20 Cb 0.62 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 19.06 2eky n ALA 20 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2eky s SER 21 N -5.15 6.30 -0.20 0.00 0.15 -1.26 -4.81 113.70 108.73 2eky s SER 21 Ca -0.03 -0.54 0.13 0.00 0.70 0.00 0.00 55.95 56.21 2eky s SER 21 Cb 0.11 -2.35 -0.23 0.00 -1.71 0.00 0.00 66.02 61.84 2eky s SER 21 CO 0.83 -0.96 0.07 1.33 1.20 0.00 0.00 173.24 175.71 2eky n VAL 22 N 5.89 1.44 -0.27 4.45 0.24 -1.26 -4.29 118.33 124.53 2eky n VAL 22 Ca -0.02 -0.79 0.23 0.00 -2.04 0.00 0.00 64.34 61.72 2eky n VAL 22 Cb 0.47 -0.76 0.56 0.00 -1.47 0.00 0.00 33.84 32.64 2eky n VAL 22 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2eky h SER 23 N 0.00 0.32 -0.40 -1.34 4.64 -1.99 0.76 113.55 115.55 2eky h SER 23 Ca -0.53 0.05 0.07 0.00 -0.47 0.00 0.00 61.79 60.91 2eky h SER 23 Cb 2.15 -0.01 -0.07 0.00 -0.31 0.00 0.00 62.40 64.16 2eky h SER 23 CO 0.01 0.10 -0.00 0.50 -0.87 0.00 0.00 176.83 176.57 2eky h LYS 24 N 0.31 0.10 -0.11 4.77 3.64 -1.98 0.16 116.57 123.45 2eky h LYS 24 Ca 0.51 -0.01 -0.21 0.00 -1.27 0.00 0.00 60.65 59.68 2eky h LYS 24 Cb 1.46 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.26 2eky h LYS 24 CO -0.18 0.07 -0.77 1.88 -2.27 0.00 0.00 179.45 178.18 2eky h TYR 25 N 0.10 0.84 -0.72 1.91 0.05 -1.15 -3.20 116.97 114.81 2eky h TYR 25 Ca 0.20 -0.38 -0.04 0.00 0.05 0.00 0.00 58.73 58.56 2eky h TYR 25 Cb 0.28 -0.13 -0.03 0.00 1.01 0.00 0.00 36.73 37.86 2eky h TYR 25 CO -0.27 1.18 0.28 0.28 -1.05 0.00 0.00 178.16 178.57 2eky h VAL 26 N 0.42 1.25 -0.94 -2.88 2.07 -0.82 -1.82 116.25 113.52 2eky h VAL 26 Ca -0.05 -0.80 0.10 0.00 0.82 0.00 0.00 66.70 66.78 2eky h VAL 26 Cb 1.38 0.40 -0.07 0.00 -1.52 0.00 0.00 31.29 31.48 2eky h VAL 26 CO 0.15 0.32 0.60 0.11 0.02 0.00 0.00 177.57 178.77 2eky h LYS 27 N 1.05 0.93 -0.82 1.57 1.57 -0.69 0.57 116.57 120.74 2eky h LYS 27 Ca 0.24 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.93 2eky h LYS 27 Cb 0.22 -0.21 -0.04 0.00 0.08 0.00 0.00 32.23 32.28 2eky h LYS 27 CO -0.02 0.61 0.37 -0.22 -0.57 0.00 0.00 179.45 179.62 2eky h LYS 28 N 0.96 1.21 -0.56 3.15 3.64 -1.35 -1.50 116.57 122.12 2eky h LYS 28 Ca 0.44 -0.20 -0.10 0.00 -1.27 0.00 0.00 60.65 59.52 2eky h LYS 28 Cb 0.40 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 2eky h LYS 28 CO -0.20 0.95 -0.05 0.00 -2.27 0.00 0.00 179.45 177.88 2eky h ALA 29 N 1.20 0.85 -0.64 5.00 0.00 -0.56 -2.80 119.26 122.30 2eky h ALA 29 Ca 0.28 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2eky h ALA 29 Cb 0.16 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2eky h ALA 29 CO -0.03 0.66 0.11 0.82 0.00 0.00 0.00 179.25 180.81 2eky h ILE 30 N 0.92 1.26 -0.17 0.00 2.04 -0.64 -2.11 117.51 118.81 2eky h ILE 30 Ca 0.16 -0.99 -0.03 0.00 1.00 0.00 0.00 64.86 65.00 2eky h ILE 30 Cb 0.60 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 2eky h ILE 30 CO 0.04 0.37 -0.01 -0.33 0.00 0.00 0.00 178.15 178.22 2eky h GLU 31 N 0.98 0.24 -0.38 2.37 4.39 -1.10 -2.26 114.58 118.81 2eky h GLU 31 Ca 0.20 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.84 2eky h GLU 31 Cb 0.41 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.00 2eky h GLU 31 CO 0.01 0.28 0.13 0.28 -1.16 0.00 0.00 179.01 178.55 2eky h VAL 32 N 0.24 1.21 -0.86 3.13 2.07 -1.13 -2.70 116.25 118.20 2eky h VAL 32 Ca 0.06 -0.66 0.12 0.00 0.82 0.00 0.00 66.70 67.04 2eky h VAL 32 Cb 0.19 0.92 -0.08 0.00 -1.52 0.00 0.00 31.29 30.80 2eky h VAL 32 CO 0.01 0.23 0.48 -0.26 0.02 0.00 0.00 177.57 178.05 2eky h PHE 33 N 0.47 0.86 0.00 1.57 0.04 -1.18 -0.37 116.94 118.34 2eky h PHE 33 Ca 0.13 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.93 2eky h PHE 33 Cb 0.23 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.13 2eky h PHE 33 CO 0.01 0.29 0.00 1.63 -0.60 0.00 0.00 178.31 179.63 2eky n LYS 34 N -4.78 0.03 0.08 1.51 5.02 -1.02 -1.37 118.16 117.63 2eky n LYS 34 Ca 0.16 0.34 0.13 0.00 -2.02 0.00 0.00 58.31 56.92 2eky n LYS 34 Cb 0.36 -1.50 0.30 0.00 -0.02 0.00 0.00 35.03 34.17 2eky n LYS 34 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2eky n LYS 35 N -1.44 0.26 -3.51 1.97 5.02 -0.15 -4.88 118.16 115.43 2eky n LYS 35 Ca 0.02 0.14 -0.21 0.00 -2.02 0.00 0.00 58.31 56.24 2eky n LYS 35 Cb 0.07 -1.73 -0.01 0.00 -0.02 0.00 0.00 35.03 33.34 2eky n LYS 35 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2eky s TYR 36 N -3.12 3.27 -1.43 2.13 1.51 -0.47 -4.99 117.35 114.25 2eky s TYR 36 Ca 0.09 -0.01 -0.15 0.00 -1.01 0.00 0.00 57.07 55.99 2eky s TYR 36 Cb 0.13 -1.92 0.05 0.00 -0.11 0.00 0.00 41.96 40.11 2eky s TYR 36 CO 0.65 0.07 2.14 -3.47 -1.11 0.00 0.00 175.55 173.84 2eky n ASP 37 N -1.67 4.06 -4.07 2.29 2.03 -1.26 -4.87 116.55 113.06 2eky n ASP 37 Ca -0.03 -2.86 -0.10 0.00 0.52 0.00 0.00 54.79 52.32 2eky n ASP 37 Cb 0.57 -1.67 -0.11 0.00 -0.72 0.00 0.00 41.12 39.20 2eky n ASP 37 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2eky s LEU 38 N 2.49 2.35 -0.10 -2.67 1.43 -1.26 -4.63 118.68 116.29 2eky s LEU 38 Ca 0.48 -0.72 -0.19 0.00 -1.03 0.00 0.00 54.13 52.67 2eky s LEU 38 Cb 0.12 -0.01 -0.04 0.00 0.03 0.00 0.00 46.19 46.29 2eky s LEU 38 CO -0.06 -0.36 0.52 -0.75 0.23 0.00 0.00 176.35 175.93 2eky s LYS 39 N -2.47 4.35 -0.15 1.70 2.20 -0.49 -4.92 119.74 119.97 2eky s LYS 39 Ca -0.04 0.54 0.02 0.00 -0.36 0.00 0.00 55.97 56.13 2eky s LYS 39 Cb -0.03 -3.43 0.01 0.00 -1.51 0.00 0.00 37.83 32.87 2eky s LYS 39 CO -0.03 0.17 -0.21 0.08 -0.36 0.00 0.00 175.35 175.00 2eky s VAL 40 N 0.57 2.12 -0.31 4.02 1.01 -1.26 -1.74 120.40 124.80 2eky s VAL 40 Ca 0.28 -0.96 -0.00 0.00 0.00 0.00 0.00 61.98 61.30 2eky s VAL 40 Cb -0.16 -1.85 0.10 0.00 0.00 0.00 0.00 36.38 34.47 2eky s VAL 40 CO 0.12 0.54 0.09 -1.61 0.00 0.00 0.00 175.10 174.24 2eky s GLU 41 N 0.89 0.80 0.02 2.72 0.41 -0.17 -5.01 118.70 118.36 2eky s GLU 41 Ca -0.05 -1.14 -0.21 0.00 -0.41 0.00 0.00 54.97 53.16 2eky s GLU 41 Cb -0.15 -2.12 -0.06 0.00 -1.78 0.00 0.00 34.13 30.02 2eky s GLU 41 CO -0.03 -0.97 0.61 0.99 -0.49 0.00 0.00 175.26 175.37 2eky s THR 42 N 1.55 4.85 0.28 3.63 2.01 -1.26 -0.60 115.64 126.09 2eky s THR 42 Ca 0.09 1.29 0.00 0.00 0.31 0.00 0.00 61.69 63.38 2eky s THR 42 Cb -0.17 -3.95 -0.00 0.00 0.01 0.00 0.00 72.50 68.39 2eky s THR 42 CO -0.23 0.44 0.01 -0.46 -0.69 0.00 0.00 174.62 173.69 2eky n ASN 43 N 2.53 2.62 0.07 3.53 0.23 0.14 -4.97 115.26 119.42 2eky n ASN 43 Ca -0.07 -2.26 0.10 0.00 -0.53 0.00 0.00 54.58 51.82 2eky n ASN 43 Cb 0.51 0.24 0.42 0.00 -2.08 0.00 0.00 39.78 38.87 2eky n ASN 43 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2eky n ALA 44 N -2.07 1.70 -0.11 -2.53 0.00 -1.26 -3.45 120.51 112.79 2eky n ALA 44 Ca -0.12 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2eky n ALA 44 Cb 0.36 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2eky n ALA 44 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2eky n MET 45 N -1.91 0.84 -3.19 0.00 2.81 -1.26 -5.10 117.12 109.29 2eky n MET 45 Ca 0.03 -0.32 0.00 0.00 -1.81 0.00 0.00 57.70 55.60 2eky n MET 45 Cb 0.21 -0.80 0.00 0.00 -0.71 0.00 0.00 33.22 31.92 2eky n MET 45 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2eky n GLY 46 N 0.21 -1.37 3.14 3.03 0.00 -1.22 -4.77 105.19 104.21 2eky n GLY 46 Ca 0.00 -0.99 -0.30 0.00 0.00 0.00 0.00 46.02 44.73 2eky n GLY 46 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eky s THR 47 N -2.44 1.81 -0.06 2.61 2.01 0.41 -0.68 115.64 119.29 2eky s THR 47 Ca 0.00 -0.85 -0.17 0.00 0.31 0.00 0.00 61.69 60.99 2eky s THR 47 Cb 0.00 -1.60 -0.05 0.00 0.01 0.00 0.00 72.50 70.86 2eky s THR 47 CO 0.00 0.50 0.45 -0.69 -0.69 0.00 0.00 174.62 174.19 2eky s VAL 48 N 0.69 5.10 0.14 3.82 1.01 0.23 -0.50 120.40 130.89 2eky s VAL 48 Ca -0.12 0.91 0.09 0.00 0.00 0.00 0.00 61.98 62.86 2eky s VAL 48 Cb -0.16 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 2eky s VAL 48 CO 0.02 0.44 -0.21 -0.76 0.00 0.00 0.00 175.10 174.59 2eky s LEU 49 N -0.15 2.37 -0.04 3.92 1.43 0.83 -0.99 118.68 126.05 2eky s LEU 49 Ca 0.25 -0.78 -0.01 0.00 -1.03 0.00 0.00 54.13 52.55 2eky s LEU 49 Cb -0.16 -0.95 0.03 0.00 0.03 0.00 0.00 46.19 45.14 2eky s LEU 49 CO 0.12 0.05 0.04 -0.70 0.23 0.00 0.00 176.35 176.09 2eky s GLU 50 N -2.34 0.03 0.00 1.70 2.12 -0.71 -0.54 118.70 118.96 2eky s GLU 50 Ca 0.13 0.29 0.00 0.00 0.36 0.00 0.00 54.97 55.74 2eky s GLU 50 Cb -0.08 -0.49 0.00 0.00 0.26 0.00 0.00 34.13 33.82 2eky s GLU 50 CO 0.06 -0.27 0.00 0.41 -0.54 0.00 0.00 175.26 174.92 2eky n GLY 51 N 4.93 -1.14 3.77 -1.50 0.00 -0.98 -1.39 105.19 108.88 2eky n GLY 51 Ca -0.11 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 2eky n GLY 51 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2eky s ASP 52 N -4.00 6.38 0.18 1.61 2.15 -1.26 -1.44 116.67 120.29 2eky s ASP 52 Ca 0.00 2.99 -0.13 0.00 0.43 0.00 0.00 52.55 55.84 2eky s ASP 52 Cb 0.00 -2.65 0.14 0.00 -0.30 0.00 0.00 42.92 40.11 2eky s ASP 52 CO 0.00 -0.88 1.77 0.25 -0.17 0.00 0.00 175.17 176.14 2eky h LEU 53 N 3.82 0.29 -0.74 -1.34 5.85 -1.40 -1.08 115.31 120.70 2eky h LEU 53 Ca -0.49 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.25 2eky h LEU 53 Cb 1.23 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.22 2eky h LEU 53 CO 0.71 0.20 0.38 0.44 -0.34 0.00 0.00 178.44 179.83 2eky h ASP 54 N 0.43 0.95 -0.83 1.25 3.32 -1.91 -0.77 116.42 118.86 2eky h ASP 54 Ca 0.22 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 2eky h ASP 54 Cb 0.17 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 2eky h ASP 54 CO -0.18 0.79 0.39 -0.33 -1.72 0.00 0.00 179.24 178.19 2eky h GLU 55 N 1.03 1.19 -0.60 3.56 4.39 -1.82 -0.92 114.58 121.42 2eky h GLU 55 Ca 0.26 -0.18 -0.07 0.00 0.34 0.00 0.00 59.36 59.71 2eky h GLU 55 Cb 0.08 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 2eky h GLU 55 CO -0.04 0.92 0.09 0.82 -1.16 0.00 0.00 179.01 179.65 2eky h ILE 56 N 1.18 1.26 -0.65 3.13 2.04 -0.76 0.67 117.51 124.37 2eky h ILE 56 Ca 0.28 -1.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.09 2eky h ILE 56 Cb 0.13 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 2eky h ILE 56 CO -0.03 0.37 0.18 -0.07 0.00 0.00 0.00 178.15 178.60 2eky h LEU 57 N 0.90 0.94 -0.12 1.44 3.38 -0.71 0.17 115.31 121.31 2eky h LEU 57 Ca 0.18 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2eky h LEU 57 Cb 0.43 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2eky h LEU 57 CO 0.01 0.89 -0.09 0.11 0.09 0.00 0.00 178.44 179.46 2eky h LYS 58 N 0.97 0.27 -0.85 1.13 1.57 -0.91 -2.00 116.57 116.75 2eky h LYS 58 Ca 0.21 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 58.87 2eky h LYS 58 Cb 0.30 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.57 2eky h LYS 58 CO -0.00 0.64 0.56 0.00 -0.57 0.00 0.00 179.45 180.08 2eky h ALA 59 N 0.62 1.08 0.01 3.86 0.00 -0.65 -0.92 119.26 123.26 2eky h ALA 59 Ca 0.02 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2eky h ALA 59 Cb 0.58 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2eky h ALA 59 CO 0.02 0.47 -0.00 0.35 0.00 0.00 0.00 179.25 180.09 2eky h PHE 60 N 1.14 -0.01 -0.52 0.00 3.57 -0.62 0.06 116.94 120.56 2eky h PHE 60 Ca 0.32 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.83 2eky h PHE 60 Cb -0.12 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.60 2eky h PHE 60 CO -0.01 -0.00 0.33 -0.22 -2.23 0.00 0.00 178.31 176.17 2eky h LYS 61 N -0.01 0.64 -0.59 1.11 3.64 -0.94 -1.28 116.57 119.14 2eky h LYS 61 Ca -0.00 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.24 2eky h LYS 61 Cb 0.01 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 2eky h LYS 61 CO 0.00 0.42 -0.04 1.49 -2.27 0.00 0.00 179.45 179.05 2eky h GLU 62 N 0.66 1.06 -0.15 1.90 4.81 -0.96 -1.06 114.58 120.84 2eky h GLU 62 Ca 0.20 -0.36 -0.01 0.00 -0.13 0.00 0.00 59.36 59.06 2eky h GLU 62 Cb -0.02 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 2eky h GLU 62 CO -0.07 1.06 0.06 0.00 -0.73 0.00 0.00 179.01 179.33 2eky h ALA 63 N 0.97 0.19 -0.28 2.92 0.00 -0.76 0.39 119.26 122.68 2eky h ALA 63 Ca 0.16 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.01 2eky h ALA 63 Cb 0.61 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 2eky h ALA 63 CO 0.04 -0.22 0.06 1.25 0.00 0.00 0.00 179.25 180.38 2eky h HIS 64 N 0.09 0.10 -0.59 0.00 -0.00 -1.16 -2.53 115.15 111.07 2eky h HIS 64 Ca 0.05 0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.39 2eky h HIS 64 Cb 0.16 -0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.54 2eky h HIS 64 CO -0.02 0.03 0.19 0.77 -0.00 0.00 0.00 177.93 178.90 2eky h SER 65 N 0.17 0.81 -0.78 3.26 0.02 -0.98 -1.85 113.55 114.20 2eky h SER 65 Ca 0.13 -0.13 -0.05 0.00 -0.84 0.00 0.00 61.79 60.91 2eky h SER 65 Cb 0.13 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.43 2eky h SER 65 CO -0.17 0.76 0.31 0.74 -1.14 0.00 0.00 176.83 177.33 2eky h THR 66 N 0.86 1.26 -0.26 -2.27 2.02 -0.56 -2.60 112.91 111.35 2eky h THR 66 Ca 0.20 -0.82 -0.18 0.00 0.77 0.00 0.00 66.41 66.37 2eky h THR 66 Cb 0.24 0.32 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 2eky h THR 66 CO -0.01 0.34 -0.55 0.58 0.37 0.00 0.00 175.52 176.25 2eky h VAL 67 N 1.14 1.28 0.00 3.16 2.07 -1.17 -2.91 116.25 119.82 2eky h VAL 67 Ca 0.26 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 66.03 2eky h VAL 67 Cb 0.22 1.66 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 2eky h VAL 67 CO -0.02 0.56 0.00 -0.11 0.02 0.00 0.00 177.57 178.02 2eky n LEU 68 N -3.99 0.44 0.17 2.57 7.94 -0.72 -0.69 117.00 122.72 2eky n LEU 68 Ca -0.04 0.68 0.13 0.00 -1.11 0.00 0.00 56.01 55.67 2eky n LEU 68 Cb 0.62 -0.70 0.31 0.00 0.53 0.00 0.00 43.42 44.18 2eky n LEU 68 CO 0.50 -0.75 0.85 -1.13 -1.11 0.00 0.00 177.39 175.75 2eky h ASN 69 N 0.00 0.00 0.00 1.96 -0.73 -1.27 -3.32 115.58 112.22 2eky h ASN 69 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2eky h ASN 69 Cb 0.08 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.67 2eky h ASN 69 CO 0.00 0.00 -1.62 0.47 -0.37 0.00 0.00 177.43 175.91 2eky n ASP 70 N -2.71 1.33 -4.30 1.15 8.00 0.13 -5.02 116.55 115.13 2eky n ASP 70 Ca 0.04 -0.09 -0.16 0.00 0.71 0.00 0.00 54.79 55.29 2eky n ASP 70 Cb 0.47 1.64 -0.10 0.00 -0.02 0.00 0.00 41.12 43.11 2eky n ASP 70 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2eky s VAL 71 N -3.03 1.02 -0.30 2.53 -7.23 -1.13 -5.05 120.40 107.22 2eky s VAL 71 Ca -0.05 -2.03 0.24 0.00 -1.81 0.00 0.00 61.98 58.33 2eky s VAL 71 Cb 0.10 -2.22 0.31 0.00 0.56 0.00 0.00 36.38 35.13 2eky s VAL 71 CO 0.65 -0.42 1.66 0.44 -0.31 0.00 0.00 175.10 177.12 2eky h ASP 72 N 2.56 0.00 -4.09 4.85 3.32 -1.83 -3.43 116.42 117.80 2eky h ASP 72 Ca -0.38 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.52 2eky h ASP 72 Cb 1.21 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.52 2eky h ASP 72 CO 0.64 0.07 -0.41 -0.60 -1.72 0.00 0.00 179.24 177.21 2eky s ARG 73 N -3.27 0.36 -0.01 3.56 3.52 -1.26 -5.07 118.95 116.78 2eky s ARG 73 Ca 0.05 0.21 0.00 0.00 -0.13 0.00 0.00 55.73 55.86 2eky s ARG 73 Cb 0.06 0.17 0.01 0.00 -1.56 0.00 0.00 34.95 33.63 2eky s ARG 73 CO 0.66 -0.06 0.00 0.08 -0.81 0.00 0.00 175.30 175.17 2eky s VAL 74 N -0.20 0.05 -0.30 7.11 1.01 -1.26 -0.76 120.40 126.05 2eky s VAL 74 Ca -0.03 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.01 2eky s VAL 74 Cb -0.03 -0.11 0.06 0.00 0.00 0.00 0.00 36.38 36.31 2eky s VAL 74 CO 0.01 0.06 -0.02 -0.69 0.00 0.00 0.00 175.10 174.46 2eky s VAL 75 N 0.48 2.64 -0.03 2.92 1.01 -0.26 -4.98 120.40 122.19 2eky s VAL 75 Ca -0.04 -1.62 0.05 0.00 0.00 0.00 0.00 61.98 60.37 2eky s VAL 75 Cb -0.06 -2.60 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 2eky s VAL 75 CO -0.01 -0.17 -0.17 -0.44 0.00 0.00 0.00 175.10 174.30 2eky s SER 76 N 1.21 3.80 0.01 3.32 0.01 -1.26 -0.58 113.70 120.21 2eky s SER 76 Ca -0.04 -0.29 0.08 0.00 1.31 0.00 0.00 55.95 57.01 2eky s SER 76 Cb -0.20 -0.70 -0.02 0.00 0.21 0.00 0.00 66.02 65.30 2eky s SER 76 CO -0.03 0.32 -0.25 -0.44 0.41 0.00 0.00 173.24 173.25 2eky s SER 77 N -0.84 2.94 -0.07 2.44 0.01 0.41 -4.99 113.70 113.59 2eky s SER 77 Ca 0.12 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 56.87 2eky s SER 77 Cb -0.10 -0.29 0.02 0.00 0.21 0.00 0.00 66.02 65.85 2eky s SER 77 CO 0.01 0.27 -0.05 -0.22 0.41 0.00 0.00 173.24 173.66 2eky s LEU 78 N -0.90 1.08 -0.09 2.44 2.96 -1.26 -1.95 118.68 120.96 2eky s LEU 78 Ca 0.10 -0.18 0.04 0.00 -0.22 0.00 0.00 54.13 53.88 2eky s LEU 78 Cb -0.10 -0.59 -0.01 0.00 0.50 0.00 0.00 46.19 46.00 2eky s LEU 78 CO 0.01 -0.11 -0.23 -0.75 -1.32 0.00 0.00 176.35 173.95 2eky s LYS 79 N 1.44 2.90 -0.07 1.98 2.20 -0.15 -4.97 119.74 123.07 2eky s LYS 79 Ca -0.02 -0.86 0.05 0.00 -0.36 0.00 0.00 55.97 54.77 2eky s LYS 79 Cb -0.13 -2.29 -0.01 0.00 -1.51 0.00 0.00 37.83 33.89 2eky s LYS 79 CO -0.03 0.26 -0.23 0.42 -0.36 0.00 0.00 175.35 175.41 2eky s ILE 80 N 0.14 2.26 -0.28 5.43 -1.09 -1.26 -1.02 121.20 125.38 2eky s ILE 80 Ca -0.12 -0.98 0.03 0.00 -2.23 0.00 0.00 60.65 57.34 2eky s ILE 80 Cb -0.16 -1.85 0.07 0.00 -1.58 0.00 0.00 42.46 38.94 2eky s ILE 80 CO 0.07 0.57 -0.06 -0.62 -1.23 0.00 0.00 174.94 173.66 2eky s ASP 81 N -0.07 4.57 -0.04 3.58 2.15 0.04 -5.01 116.67 121.88 2eky s ASP 81 Ca -0.06 -1.54 0.05 0.00 0.43 0.00 0.00 52.55 51.43 2eky s ASP 81 Cb -0.14 -1.59 -0.01 0.00 -0.30 0.00 0.00 42.92 40.88 2eky s ASP 81 CO 0.04 -0.24 -0.18 -0.70 -0.17 0.00 0.00 175.17 173.92 2eky s GLU 82 N 1.08 1.85 0.07 4.34 2.12 -1.26 -2.64 118.70 124.25 2eky s GLU 82 Ca -0.05 -0.66 0.03 0.00 0.36 0.00 0.00 54.97 54.65 2eky s GLU 82 Cb -0.20 -1.62 -0.03 0.00 0.26 0.00 0.00 34.13 32.54 2eky s GLU 82 CO -0.05 0.28 -0.08 -0.98 -0.54 0.00 0.00 175.26 173.89 2eky s ARG 83 N -0.06 0.67 0.00 4.30 1.70 -1.26 -5.05 118.95 119.26 2eky s ARG 83 Ca -0.02 -0.97 0.03 0.00 -0.47 0.00 0.00 55.73 54.30 2eky s ARG 83 Cb -0.11 -0.35 0.02 0.00 -0.57 0.00 0.00 34.95 33.94 2eky s ARG 83 CO 0.02 0.05 0.59 0.36 -1.08 0.00 0.00 175.30 175.23 2eky n LYS 84 N 0.95 -0.18 0.10 3.89 2.85 -1.26 -4.58 118.16 119.93 2eky n LYS 84 Ca -0.19 -0.67 0.08 0.00 -1.05 0.00 0.00 58.31 56.48 2eky n LYS 84 Cb 0.57 -1.05 -0.00 0.00 -0.65 0.00 0.00 35.03 33.90 2eky n LYS 84 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 177.40 177.73 2eky h ASP 85 N 0.65 0.00 -5.18 -5.58 2.03 -2.05 -3.48 116.42 102.82 2eky h ASP 85 Ca 0.00 0.00 -0.08 0.00 -0.73 0.00 0.00 57.03 56.22 2eky h ASP 85 Cb 0.14 0.00 -0.13 0.00 -0.83 0.00 0.00 39.33 38.51 2eky h ASP 85 CO 0.00 0.16 -0.26 -0.54 -1.03 0.00 0.00 179.24 177.57 2eky s LYS 86 N -3.23 1.06 0.20 4.15 1.02 -1.26 -5.13 119.74 116.54 2eky s LYS 86 Ca -0.00 -0.99 -0.30 0.00 0.02 0.00 0.00 55.97 54.70 2eky s LYS 86 Cb 0.09 0.40 -0.08 0.00 -0.52 0.00 0.00 37.83 37.71 2eky s LYS 86 CO 0.78 -0.38 1.21 -2.00 -0.92 0.00 0.00 175.35 174.04 2eky s GLU 87 N -3.89 4.48 -0.19 1.68 2.12 -1.26 -4.76 118.70 116.88 2eky s GLU 87 Ca 0.10 1.91 -0.01 0.00 0.36 0.00 0.00 54.97 57.33 2eky s GLU 87 Cb 0.03 -3.22 0.01 0.00 0.26 0.00 0.00 34.13 31.21 2eky s GLU 87 CO -0.06 -0.10 -0.14 1.21 -0.54 0.00 0.00 175.26 175.63 2eky s ASN 88 N 0.07 3.62 0.12 -1.70 2.47 -1.26 -4.99 114.94 113.26 2eky s ASN 88 Ca 0.53 -0.53 -0.04 0.00 0.42 0.00 0.00 52.86 53.24 2eky s ASN 88 Cb -0.33 -1.58 -0.03 0.00 -1.45 0.00 0.00 41.25 37.86 2eky s ASN 88 CO 0.38 0.01 0.11 0.42 -3.72 0.00 0.00 177.10 174.30 2eky s THR 89 N 1.24 0.12 0.12 -5.21 -4.23 -1.26 -4.60 115.64 101.82 2eky s THR 89 Ca 0.03 -1.67 -0.21 0.00 -1.18 0.00 0.00 61.69 58.66 2eky s THR 89 Cb -0.14 -1.80 -0.07 0.00 1.34 0.00 0.00 72.50 71.82 2eky s THR 89 CO -0.07 -0.55 1.73 0.40 -0.54 0.00 0.00 174.62 175.59 2eky h ILE 90 N 2.83 0.91 -0.50 2.99 2.04 -1.94 -1.17 117.51 122.67 2eky h ILE 90 Ca -0.34 -0.02 -0.10 0.00 1.00 0.00 0.00 64.86 65.41 2eky h ILE 90 Cb 1.19 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 2eky h ILE 90 CO 0.57 0.01 -0.08 -0.33 0.00 0.00 0.00 178.15 178.32 2eky h GLU 91 N 0.04 0.90 -0.57 2.37 5.08 -1.99 -2.01 114.58 118.41 2eky h GLU 91 Ca 0.06 -0.30 -0.06 0.00 -1.00 0.00 0.00 59.36 58.06 2eky h GLU 91 Cb 0.08 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2eky h GLU 91 CO -0.11 0.94 0.12 0.00 -1.00 0.00 0.00 179.01 178.97 2eky h ARG 92 N 0.81 0.92 -0.62 2.33 3.08 -1.90 -0.39 114.38 118.60 2eky h ARG 92 Ca 0.14 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 2eky h ARG 92 Cb 0.60 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.50 2eky h ARG 92 CO 0.04 0.86 0.32 0.87 -1.07 0.00 0.00 179.97 180.99 2eky h LYS 93 N 0.82 0.88 -0.48 0.04 1.57 -1.07 -1.03 116.57 117.31 2eky h LYS 93 Ca 0.18 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.78 2eky h LYS 93 Cb 0.37 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 2eky h LYS 93 CO 0.00 0.69 0.07 -0.07 -0.57 0.00 0.00 179.45 179.58 2eky h LEU 94 N 0.85 0.76 -0.86 2.94 3.38 -1.09 -3.02 115.31 118.27 2eky h LEU 94 Ca 0.22 -0.26 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 2eky h LEU 94 Cb 0.09 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2eky h LEU 94 CO -0.03 0.83 -0.47 0.50 0.09 0.00 0.00 178.44 179.36 2eky h LYS 95 N 0.66 0.23 0.00 1.13 3.64 -0.93 0.18 116.57 121.49 2eky h LYS 95 Ca 0.14 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2eky h LYS 95 Cb 0.40 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 2eky h LYS 95 CO 0.01 0.65 -0.02 0.00 -2.27 0.00 0.00 179.45 177.83 2eky h ALA 96 N 1.33 1.15 -0.16 5.00 0.00 -1.05 -1.47 119.26 124.06 2eky h ALA 96 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2eky h ALA 96 Cb 0.90 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2eky h ALA 96 CO 0.07 0.02 0.00 0.44 0.00 0.00 0.00 179.25 179.78 2eky n ILE 97 N -3.32 1.26 -1.88 0.00 -5.35 -1.07 -4.98 119.36 104.01 2eky n ILE 97 Ca -0.02 -1.25 -0.14 0.00 -0.27 0.00 0.00 62.75 61.06 2eky n ILE 97 Cb 0.12 0.32 -0.03 0.00 -1.74 0.00 0.00 39.64 38.31 2eky n ILE 97 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2eky n GLY 98 N -0.24 0.52 0.90 3.28 0.00 -0.55 -4.91 105.19 104.19 2eky n GLY 98 Ca 0.09 -0.34 0.08 0.00 0.00 0.00 0.00 46.02 45.85 2eky n GLY 98 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2eky n GLU 99 N -2.44 2.79 0.00 1.61 -0.58 0.61 -4.99 120.64 117.63 2eky n GLU 99 Ca -0.15 -2.27 0.14 0.00 -0.42 0.00 0.00 57.16 54.46 2eky n GLU 99 Cb 0.55 -1.38 0.54 0.00 -0.57 0.00 0.00 31.44 30.58 2eky n GLU 99 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54