#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ee9 s SER 2 N 0.00 4.36 0.18 1.61 1.04 -1.26 -5.07 113.70 114.56 2ee9 s SER 2 Ca 0.00 -3.45 -0.09 0.00 0.48 0.00 0.00 55.95 52.89 2ee9 s SER 2 Cb 0.00 -1.51 -0.01 0.00 0.10 0.00 0.00 66.02 64.60 2ee9 s SER 2 CO 0.00 -0.15 0.30 -0.55 0.98 0.00 0.00 173.24 173.82 2ee9 s SER 3 N -0.86 0.03 0.77 7.02 0.15 -1.26 -5.15 113.70 114.41 2ee9 s SER 3 Ca 0.22 -0.92 -0.16 0.00 0.70 0.00 0.00 55.95 55.80 2ee9 s SER 3 Cb -0.12 0.45 -0.05 0.00 -1.71 0.00 0.00 66.02 64.59 2ee9 s SER 3 CO -0.10 -0.92 0.28 0.61 1.20 0.00 0.00 173.24 174.31 2ee9 n GLY 4 N -0.24 -2.16 3.58 9.45 0.00 -1.26 -5.02 105.19 109.54 2ee9 n GLY 4 Ca -0.06 -0.47 -0.16 0.00 0.00 0.00 0.00 46.02 45.33 2ee9 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ee9 s SER 5 N -1.46 -0.70 -0.41 1.61 0.15 -1.26 -5.09 113.70 106.53 2ee9 s SER 5 Ca 0.60 1.13 -0.38 0.00 0.70 0.00 0.00 55.95 57.99 2ee9 s SER 5 Cb -0.32 1.06 -0.16 0.00 -1.71 0.00 0.00 66.02 64.89 2ee9 s SER 5 CO 0.63 -0.40 1.34 -1.20 1.20 0.00 0.00 173.24 174.81 2ee9 n SER 6 N 1.93 0.97 -3.42 5.45 7.64 -1.26 -1.73 113.62 123.21 2ee9 n SER 6 Ca -0.16 0.95 -0.16 0.00 1.01 0.00 0.00 58.87 60.51 2ee9 n SER 6 Cb 0.56 -0.72 0.01 0.00 -1.01 0.00 0.00 64.21 63.04 2ee9 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ee9 n GLY 7 N 3.44 -1.11 3.65 0.23 0.00 -1.26 -4.77 105.19 105.37 2ee9 n GLY 7 Ca 0.27 0.70 -0.51 0.00 0.00 0.00 0.00 46.02 46.47 2ee9 n GLY 7 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ee9 n VAL 8 N -1.80 0.14 -2.62 1.61 0.31 -0.71 -4.91 118.33 110.36 2ee9 n VAL 8 Ca -0.14 -0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 63.75 2ee9 n VAL 8 Cb 0.60 -1.21 -0.04 0.00 -0.91 0.00 0.00 33.84 32.29 2ee9 n VAL 8 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2ee9 s SER 9 N 1.69 7.35 -0.39 4.52 0.01 -1.26 -4.96 113.70 120.66 2ee9 s SER 9 Ca 0.87 1.89 0.05 0.00 1.31 0.00 0.00 55.95 60.08 2ee9 s SER 9 Cb -0.88 -2.59 0.44 0.00 0.21 0.00 0.00 66.02 63.20 2ee9 s SER 9 CO 0.49 -0.20 1.23 0.47 0.41 0.00 0.00 173.24 175.65 2ee9 n ASP 10 N 3.00 5.09 -4.40 2.44 8.00 -1.26 -5.02 116.55 124.40 2ee9 n ASP 10 Ca 0.04 -3.74 -0.32 0.00 0.71 0.00 0.00 54.79 51.47 2ee9 n ASP 10 Cb 0.48 -0.45 -0.14 0.00 -0.02 0.00 0.00 41.12 40.99 2ee9 n ASP 10 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2ee9 s MET 11 N -3.61 2.56 -0.25 -1.24 -1.94 -1.26 -5.03 119.30 108.53 2ee9 s MET 11 Ca 0.51 -0.77 -0.07 0.00 -1.71 0.00 0.00 55.69 53.65 2ee9 s MET 11 Cb 0.41 -2.32 0.12 0.00 2.01 0.00 0.00 34.83 35.05 2ee9 s MET 11 CO -0.07 0.52 0.51 -0.80 -0.01 0.00 0.00 175.02 175.17 2ee9 s ASN 12 N -0.48 -0.63 0.00 3.03 -0.87 -1.26 -4.95 114.94 109.78 2ee9 s ASN 12 Ca 0.06 1.12 0.00 0.00 -1.57 0.00 0.00 52.86 52.47 2ee9 s ASN 12 Cb -0.12 1.74 0.00 0.00 -0.02 0.00 0.00 41.25 42.86 2ee9 s ASN 12 CO 0.01 -0.24 0.00 0.61 -2.57 0.00 0.00 177.10 174.92 2ee9 n GLY 13 N 5.41 1.08 3.64 0.66 0.00 -1.26 -4.72 105.19 110.01 2ee9 n GLY 13 Ca -0.09 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.86 2ee9 n GLY 13 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2ee9 s LEU 14 N 0.00 -0.37 0.00 0.99 0.05 -1.26 -5.16 118.68 112.92 2ee9 s LEU 14 Ca 0.00 0.71 0.00 0.00 0.05 0.00 0.00 54.13 54.89 2ee9 s LEU 14 Cb 0.00 1.71 0.00 0.00 -2.05 0.00 0.00 46.19 45.85 2ee9 s LEU 14 CO 0.00 -0.12 0.00 0.61 -0.55 0.00 0.00 176.35 176.29 2ee9 n GLY 15 N 2.21 2.38 2.83 -3.48 0.00 -1.26 -5.00 105.19 102.86 2ee9 n GLY 15 Ca -0.12 -0.14 -0.14 0.00 0.00 0.00 0.00 46.02 45.61 2ee9 n GLY 15 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ee9 s PHE 16 N 2.83 -0.03 0.36 1.61 0.40 -1.26 -4.72 117.98 117.17 2ee9 s PHE 16 Ca 0.00 0.23 -0.28 0.00 -0.60 0.00 0.00 56.93 56.29 2ee9 s PHE 16 Cb 0.00 -0.18 -0.12 0.00 0.51 0.00 0.00 43.02 43.24 2ee9 s PHE 16 CO 0.00 -0.11 1.34 1.17 0.70 0.00 0.00 175.22 178.32 2ee9 n LYS 17 N 4.12 2.25 -1.18 0.44 4.81 -1.26 -4.51 118.16 122.82 2ee9 n LYS 17 Ca -0.26 0.79 -0.29 0.00 -0.87 0.00 0.00 58.31 57.67 2ee9 n LYS 17 Cb 0.51 -2.43 0.16 0.00 0.02 0.00 0.00 35.03 33.29 2ee9 n LYS 17 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2ee9 s PRO 18 N -1.98 0.82 -0.34 1.64 0.04 -1.26 -4.55 135.00 129.36 2ee9 s PRO 18 Ca 0.55 0.66 0.01 0.00 0.04 0.00 0.00 61.00 62.27 2ee9 s PRO 18 Cb -0.54 -1.77 0.11 0.00 0.04 0.00 0.00 34.50 32.34 2ee9 s PRO 18 CO 0.62 -2.50 0.11 0.12 0.04 0.00 0.00 177.00 175.39 2ee9 s PHE 19 N -2.95 2.24 0.33 0.56 5.36 -1.22 -5.00 117.98 117.31 2ee9 s PHE 19 Ca 0.64 -2.15 -0.16 0.00 -0.96 0.00 0.00 56.93 54.30 2ee9 s PHE 19 Cb -0.18 -2.04 -0.09 0.00 -0.34 0.00 0.00 43.02 40.37 2ee9 s PHE 19 CO 0.57 -0.88 0.76 0.16 -1.46 0.00 0.00 175.22 174.38 2ee9 s ASP 20 N 1.25 6.83 0.01 6.13 1.47 -1.26 -2.92 116.67 128.17 2ee9 s ASP 20 Ca 0.11 1.35 -0.15 0.00 1.18 0.00 0.00 52.55 55.04 2ee9 s ASP 20 Cb -0.19 -2.40 0.03 0.00 -0.34 0.00 0.00 42.92 40.02 2ee9 s ASP 20 CO -0.17 -0.20 0.33 -0.22 0.68 0.00 0.00 175.17 175.59 2ee9 s LEU 21 N -2.90 0.75 -0.08 2.11 0.20 0.48 -4.95 118.68 114.29 2ee9 s LEU 21 Ca 0.54 0.01 0.01 0.00 0.69 0.00 0.00 54.13 55.39 2ee9 s LEU 21 Cb -0.11 1.40 0.02 0.00 -0.43 0.00 0.00 46.19 47.07 2ee9 s LEU 21 CO 0.17 -0.53 -0.11 0.54 -0.29 0.00 0.00 176.35 176.13 2ee9 s VAL 22 N -1.84 1.11 0.33 1.68 0.11 -1.26 0.47 120.40 121.00 2ee9 s VAL 22 Ca -0.10 -0.42 -0.29 0.00 -2.93 0.00 0.00 61.98 58.24 2ee9 s VAL 22 Cb -0.03 -1.05 -0.11 0.00 -1.53 0.00 0.00 36.38 33.66 2ee9 s VAL 22 CO 0.01 0.36 1.47 -0.63 -3.33 0.00 0.00 175.10 172.98 2ee9 s ILE 23 N 1.00 2.27 -0.02 7.04 1.01 -1.22 -4.95 121.20 126.33 2ee9 s ILE 23 Ca -0.08 0.25 -0.25 0.00 0.00 0.00 0.00 60.65 60.57 2ee9 s ILE 23 Cb -0.15 -3.16 -0.20 0.00 0.01 0.00 0.00 42.46 38.97 2ee9 s ILE 23 CO -0.00 0.05 1.23 1.55 0.00 0.00 0.00 174.94 177.77 2ee9 h PRO 24 N 3.71 -0.05 -7.63 2.79 0.13 -2.00 -3.46 132.00 125.49 2ee9 h PRO 24 Ca -0.49 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.18 2ee9 h PRO 24 Cb 1.23 0.01 0.12 0.00 0.13 0.00 0.00 31.00 32.49 2ee9 h PRO 24 CO 0.69 0.42 0.38 -0.59 -0.23 0.00 0.00 178.00 178.67 2ee9 s PHE 25 N -4.21 2.43 0.15 1.56 -0.71 -1.26 -5.06 117.98 110.87 2ee9 s PHE 25 Ca -0.16 0.52 -0.11 0.00 -1.04 0.00 0.00 56.93 56.15 2ee9 s PHE 25 Cb 0.02 -3.66 -0.07 0.00 -1.21 0.00 0.00 43.02 38.10 2ee9 s PHE 25 CO 0.65 -2.03 0.49 0.00 -1.34 0.00 0.00 175.22 172.99 2ee9 s ALA 26 N -3.63 3.63 0.16 1.99 0.00 -1.26 -4.91 121.76 117.74 2ee9 s ALA 26 Ca 0.66 -0.27 -0.21 0.00 0.00 0.00 0.00 51.96 52.14 2ee9 s ALA 26 Cb -0.08 -2.40 0.06 0.00 0.00 0.00 0.00 23.12 20.69 2ee9 s ALA 26 CO 0.50 0.52 0.56 0.54 0.00 0.00 0.00 175.76 177.88 2ee9 s VAL 27 N -1.55 0.01 0.06 0.00 0.11 -1.26 -5.14 120.40 112.63 2ee9 s VAL 27 Ca 0.39 -0.22 0.04 0.00 -2.93 0.00 0.00 61.98 59.26 2ee9 s VAL 27 Cb -0.14 -1.13 -0.04 0.00 -1.53 0.00 0.00 36.38 33.55 2ee9 s VAL 27 CO 0.20 -0.07 -0.01 0.00 -3.33 0.00 0.00 175.10 171.89 2ee9 s ARG 28 N -3.78 2.61 -0.96 1.54 1.70 -1.26 -4.76 118.95 114.04 2ee9 s ARG 28 Ca 0.02 -0.76 -0.20 0.00 -0.47 0.00 0.00 55.73 54.32 2ee9 s ARG 28 Cb -0.01 -2.57 0.10 0.00 -0.57 0.00 0.00 34.95 31.91 2ee9 s ARG 28 CO -0.11 0.57 1.24 0.21 -1.08 0.00 0.00 175.30 176.13 2ee9 s LYS 29 N -2.00 3.60 0.00 3.89 2.20 -1.26 -4.51 119.74 121.66 2ee9 s LYS 29 Ca 0.23 -1.56 0.00 0.00 -0.36 0.00 0.00 55.97 54.28 2ee9 s LYS 29 Cb -0.12 -5.07 0.00 0.00 -1.51 0.00 0.00 37.83 31.14 2ee9 s LYS 29 CO 0.15 -1.92 0.00 0.41 -0.36 0.00 0.00 175.35 173.63 2ee9 n GLY 30 N 5.94 -1.66 1.88 5.54 0.00 -1.26 -4.95 105.19 110.68 2ee9 n GLY 30 Ca 0.27 0.43 -0.18 0.00 0.00 0.00 0.00 46.02 46.55 2ee9 n GLY 30 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ee9 n GLU 31 N -1.96 1.90 -4.35 1.61 -0.58 -1.26 -4.91 120.64 111.09 2ee9 n GLU 31 Ca 0.00 -2.10 -0.30 0.00 -0.42 0.00 0.00 57.16 54.34 2ee9 n GLU 31 Cb 0.00 -1.82 -0.10 0.00 -0.57 0.00 0.00 31.44 28.94 2ee9 n GLU 31 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 2ee9 s ILE 32 N -2.41 3.36 0.28 -3.67 2.07 -1.26 -0.55 121.20 119.01 2ee9 s ILE 32 Ca 0.40 -1.13 -0.02 0.00 -1.41 0.00 0.00 60.65 58.49 2ee9 s ILE 32 Cb 0.33 -2.52 -0.02 0.00 0.13 0.00 0.00 42.46 40.38 2ee9 s ILE 32 CO 0.06 0.21 0.33 0.42 -1.91 0.00 0.00 174.94 174.06 2ee9 s THR 33 N -1.12 0.00 -0.06 4.00 -4.23 -1.13 -4.99 115.64 108.12 2ee9 s THR 33 Ca 0.19 -1.78 -0.30 0.00 -1.18 0.00 0.00 61.69 58.63 2ee9 s THR 33 Cb -0.11 -2.49 0.07 0.00 1.34 0.00 0.00 72.50 71.31 2ee9 s THR 33 CO 0.11 0.00 0.67 -0.83 -0.54 0.00 0.00 174.62 174.03 2ee9 s GLY 34 N -3.21 -0.56 0.01 3.99 0.00 -1.26 -2.99 107.32 103.30 2ee9 s GLY 34 Ca 0.34 1.32 -0.03 0.00 0.00 0.00 0.00 44.72 46.34 2ee9 s GLY 34 CO 0.18 0.97 0.05 1.85 0.00 0.00 0.00 173.10 176.14 2ee9 s GLU 35 N -1.12 0.38 -0.09 2.90 2.56 -0.16 -4.23 118.70 118.95 2ee9 s GLU 35 Ca -0.11 -0.49 0.03 0.00 0.00 0.00 0.00 54.97 54.41 2ee9 s GLU 35 Cb -0.00 0.15 0.00 0.00 2.00 0.00 0.00 34.13 36.28 2ee9 s GLU 35 CO 0.09 -0.08 -0.20 0.08 -0.56 0.00 0.00 175.26 174.59 2ee9 s VAL 36 N -1.38 1.76 -0.49 3.70 1.01 0.38 -0.42 120.40 124.97 2ee9 s VAL 36 Ca -0.15 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 60.86 2ee9 s VAL 36 Cb -0.09 -1.54 0.11 0.00 0.00 0.00 0.00 36.38 34.86 2ee9 s VAL 36 CO 0.00 0.49 0.40 -1.00 0.00 0.00 0.00 175.10 174.99 2ee9 s HIS 37 N 0.47 3.33 0.46 5.22 3.76 0.63 -1.81 115.29 127.35 2ee9 s HIS 37 Ca -0.17 -1.51 -0.23 0.00 -0.15 0.00 0.00 55.06 53.00 2ee9 s HIS 37 Cb -0.17 -3.50 -0.07 0.00 1.11 0.00 0.00 32.58 29.94 2ee9 s HIS 37 CO 0.07 -0.96 1.17 -1.64 -0.85 0.00 0.00 174.74 172.52 2ee9 s MET 38 N 1.49 3.74 0.55 1.40 -1.94 -0.69 -2.40 119.30 121.45 2ee9 s MET 38 Ca 0.04 1.78 0.34 0.00 -1.71 0.00 0.00 55.69 56.14 2ee9 s MET 38 Cb -0.27 -2.40 1.40 0.00 2.01 0.00 0.00 34.83 35.57 2ee9 s MET 38 CO 0.02 -0.57 1.99 -1.00 -0.01 0.00 0.00 175.02 175.45 2ee9 h PRO 39 N 2.03 0.00 0.00 2.03 0.13 -1.87 -2.61 132.00 131.71 2ee9 h PRO 39 Ca -0.49 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 2ee9 h PRO 39 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 2ee9 h PRO 39 CO 0.60 0.00 -0.05 0.77 -0.23 0.00 0.00 178.00 179.09 2ee9 h SER 40 N 0.00 0.00 0.00 1.44 0.02 -1.91 -3.47 113.55 109.63 2ee9 h SER 40 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ee9 h SER 40 Cb 0.48 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.02 2ee9 h SER 40 CO 0.00 0.05 0.00 0.61 -1.14 0.00 0.00 176.83 176.35 2ee9 n GLY 41 N 0.89 1.54 2.26 -3.77 0.00 -0.98 -5.13 105.19 99.99 2ee9 n GLY 41 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 2ee9 n GLY 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ee9 n LYS 42 N -0.49 0.91 -3.91 1.61 4.76 -1.25 -4.96 118.16 114.82 2ee9 n LYS 42 Ca 0.00 -1.94 -0.09 0.00 -2.87 0.00 0.00 58.31 53.41 2ee9 n LYS 42 Cb 0.00 0.06 -0.09 0.00 -1.84 0.00 0.00 35.03 33.17 2ee9 n LYS 42 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2ee9 s THR 43 N -1.38 0.15 0.08 -0.18 -4.23 -1.26 -1.70 115.64 107.11 2ee9 s THR 43 Ca 0.26 -1.21 -0.26 0.00 -1.18 0.00 0.00 61.69 59.30 2ee9 s THR 43 Cb -0.02 -1.16 0.08 0.00 1.34 0.00 0.00 72.50 72.74 2ee9 s THR 43 CO 0.16 -0.67 0.69 0.00 -0.54 0.00 0.00 174.62 174.27 2ee9 s ALA 44 N -3.27 -1.69 -0.17 3.99 0.00 -0.75 -4.96 121.76 114.91 2ee9 s ALA 44 Ca 0.01 0.77 -0.09 0.00 0.00 0.00 0.00 51.96 52.65 2ee9 s ALA 44 Cb 0.03 0.59 -0.05 0.00 0.00 0.00 0.00 23.12 23.69 2ee9 s ALA 44 CO -0.08 -0.68 0.12 0.95 0.00 0.00 0.00 175.76 176.08 2ee9 s THR 45 N -3.14 5.33 1.17 0.00 -4.23 -1.26 0.14 115.64 113.66 2ee9 s THR 45 Ca 0.00 0.16 -0.18 0.00 -1.18 0.00 0.00 61.69 60.49 2ee9 s THR 45 Cb -0.01 -3.40 0.27 0.00 1.34 0.00 0.00 72.50 70.71 2ee9 s THR 45 CO -0.08 0.49 1.11 -2.16 -0.54 0.00 0.00 174.62 173.44 2ee9 s PRO 46 N -0.03 -1.00 -0.08 3.99 0.04 -1.26 -4.95 135.00 131.72 2ee9 s PRO 46 Ca 0.09 0.02 -0.26 0.00 0.04 0.00 0.00 61.00 60.89 2ee9 s PRO 46 Cb -0.11 -1.61 -0.03 0.00 0.04 0.00 0.00 34.50 32.78 2ee9 s PRO 46 CO -0.00 -3.58 0.84 -2.00 0.04 0.00 0.00 177.00 172.30 2ee9 s GLU 47 N -5.33 4.43 -0.49 4.56 2.12 0.11 -4.90 118.70 119.20 2ee9 s GLU 47 Ca 0.70 1.11 0.03 0.00 0.36 0.00 0.00 54.97 57.17 2ee9 s GLU 47 Cb -0.11 -3.49 0.13 0.00 0.26 0.00 0.00 34.13 30.92 2ee9 s GLU 47 CO 0.56 -0.10 0.24 0.42 -0.54 0.00 0.00 175.26 175.84 2ee9 s ILE 48 N 1.31 2.27 0.01 -3.70 1.01 -1.26 -3.86 121.20 116.99 2ee9 s ILE 48 Ca 0.43 -3.08 0.06 0.00 0.00 0.00 0.00 60.65 58.05 2ee9 s ILE 48 Cb -0.18 -2.59 -0.02 0.00 0.01 0.00 0.00 42.46 39.68 2ee9 s ILE 48 CO 0.19 -0.81 -0.17 -0.69 0.00 0.00 0.00 174.94 173.46 2ee9 s VAL 49 N -0.07 1.34 -0.49 2.92 1.01 -1.24 -5.01 120.40 118.86 2ee9 s VAL 49 Ca 0.17 -0.88 -0.10 0.00 0.00 0.00 0.00 61.98 61.16 2ee9 s VAL 49 Cb -0.25 -1.15 0.12 0.00 0.00 0.00 0.00 36.38 35.10 2ee9 s VAL 49 CO -0.00 0.25 0.38 -0.62 0.00 0.00 0.00 175.10 175.10 2ee9 s ASP 50 N -0.73 5.80 1.02 3.32 2.15 -1.26 -1.37 116.67 125.60 2ee9 s ASP 50 Ca 0.06 -1.90 -0.17 0.00 0.43 0.00 0.00 52.55 50.96 2ee9 s ASP 50 Cb -0.07 -2.05 -0.00 0.00 -0.30 0.00 0.00 42.92 40.50 2ee9 s ASP 50 CO 0.00 -0.72 -0.18 0.59 -0.17 0.00 0.00 175.17 174.69 2ee9 n ASN 51 N 4.96 -2.94 -1.39 -0.34 3.02 -0.44 -4.80 115.26 113.33 2ee9 n ASN 51 Ca -0.09 0.11 -0.07 0.00 -0.03 0.00 0.00 54.58 54.51 2ee9 n ASN 51 Cb 0.41 -0.96 0.04 0.00 -0.61 0.00 0.00 39.78 38.66 2ee9 n ASN 51 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2ee9 n LYS 52 N -0.61 1.34 0.00 3.52 0.00 -1.26 -3.42 118.16 117.73 2ee9 n LYS 52 Ca 0.02 -0.78 0.00 0.00 0.00 0.00 0.00 58.31 57.55 2ee9 n LYS 52 Cb 0.60 -1.31 0.00 0.00 0.00 0.00 0.00 35.03 34.32 2ee9 n LYS 52 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2ee9 n ASP 53 N 0.24 3.83 0.00 3.14 2.03 -1.26 -5.04 116.55 119.49 2ee9 n ASP 53 Ca 0.15 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.46 2ee9 n ASP 53 Cb 0.75 0.44 0.00 0.00 -0.72 0.00 0.00 41.12 41.59 2ee9 n ASP 53 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ee9 n GLY 54 N 2.34 1.49 3.36 0.27 0.00 -1.22 -5.15 105.19 106.28 2ee9 n GLY 54 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 2ee9 n GLY 54 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ee9 s THR 55 N -1.86 0.00 0.11 2.61 -4.23 -1.26 -4.64 115.64 106.37 2ee9 s THR 55 Ca 0.00 -1.85 0.09 0.00 -1.18 0.00 0.00 61.69 58.75 2ee9 s THR 55 Cb 0.00 -2.57 -0.04 0.00 1.34 0.00 0.00 72.50 71.23 2ee9 s THR 55 CO 0.00 0.00 -0.22 -0.69 -0.54 0.00 0.00 174.62 173.17 2ee9 s VAL 56 N -3.23 1.83 -0.20 2.29 1.01 -1.26 -1.32 120.40 119.52 2ee9 s VAL 56 Ca 0.37 -1.59 0.01 0.00 0.00 0.00 0.00 61.98 60.78 2ee9 s VAL 56 Cb 0.01 -1.65 0.04 0.00 0.00 0.00 0.00 36.38 34.78 2ee9 s VAL 56 CO 0.26 -0.02 -0.13 -0.89 0.00 0.00 0.00 175.10 174.31 2ee9 s THR 57 N -1.14 1.84 -0.17 3.92 2.01 -0.47 -3.38 115.64 118.26 2ee9 s THR 57 Ca 0.08 -1.09 -0.08 0.00 0.31 0.00 0.00 61.69 60.91 2ee9 s THR 57 Cb -0.10 -1.84 -0.04 0.00 0.01 0.00 0.00 72.50 70.52 2ee9 s THR 57 CO 0.05 0.24 0.10 -0.69 -0.69 0.00 0.00 174.62 173.63 2ee9 s VAL 58 N 1.32 5.16 -0.01 3.82 1.01 0.18 -3.66 120.40 128.21 2ee9 s VAL 58 Ca -0.01 0.09 -0.14 0.00 0.00 0.00 0.00 61.98 61.93 2ee9 s VAL 58 Cb -0.16 -3.31 0.02 0.00 0.00 0.00 0.00 36.38 32.93 2ee9 s VAL 58 CO -0.09 0.50 0.29 0.00 0.00 0.00 0.00 175.10 175.80 2ee9 s ARG 59 N -0.05 0.66 -0.23 2.72 1.70 -1.25 0.18 118.95 122.68 2ee9 s ARG 59 Ca 0.08 -0.25 -0.05 0.00 -0.47 0.00 0.00 55.73 55.05 2ee9 s ARG 59 Cb -0.12 0.29 0.12 0.00 -0.57 0.00 0.00 34.95 34.67 2ee9 s ARG 59 CO 0.00 -0.18 0.42 -0.47 -1.08 0.00 0.00 175.30 173.99 2ee9 s TYR 60 N -1.44 -0.88 -0.35 5.89 5.04 -1.15 -0.71 117.35 123.75 2ee9 s TYR 60 Ca -0.13 1.30 -0.27 0.00 -2.44 0.00 0.00 57.07 55.53 2ee9 s TYR 60 Cb -0.05 0.23 0.01 0.00 0.35 0.00 0.00 41.96 42.50 2ee9 s TYR 60 CO 0.03 -0.61 0.96 0.00 -1.34 0.00 0.00 175.55 174.60 2ee9 s ALA 61 N 2.61 3.44 0.01 3.97 0.00 -1.26 -3.39 121.76 127.14 2ee9 s ALA 61 Ca 0.05 -0.33 -0.30 0.00 0.00 0.00 0.00 51.96 51.38 2ee9 s ALA 61 Cb -0.14 -3.56 -0.06 0.00 0.00 0.00 0.00 23.12 19.36 2ee9 s ALA 61 CO -0.15 -1.54 1.44 -1.25 0.00 0.00 0.00 175.76 174.26 2ee9 s PRO 62 N 3.50 4.27 -0.01 0.00 0.04 -1.26 -4.92 135.00 136.62 2ee9 s PRO 62 Ca 0.40 2.02 0.14 0.00 0.04 0.00 0.00 61.00 63.60 2ee9 s PRO 62 Cb -0.12 -3.58 -0.20 0.00 0.04 0.00 0.00 34.50 30.64 2ee9 s PRO 62 CO 0.17 -0.61 0.70 2.41 0.04 0.00 0.00 177.00 179.72 2ee9 n THR 63 N 4.69 1.44 -4.62 1.26 -1.04 -1.26 -4.20 114.28 110.55 2ee9 n THR 63 Ca 0.14 -0.76 -0.29 0.00 -2.04 0.00 0.00 64.05 61.10 2ee9 n THR 63 Cb 0.43 -0.90 -0.08 0.00 -1.82 0.00 0.00 70.33 67.96 2ee9 n THR 63 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2ee9 s GLU 64 N -2.72 2.04 0.18 -2.82 8.01 -1.26 -4.92 118.70 117.21 2ee9 s GLU 64 Ca -0.04 -2.27 0.02 0.00 0.01 0.00 0.00 54.97 52.68 2ee9 s GLU 64 Cb 0.08 -1.01 -0.04 0.00 -4.31 0.00 0.00 34.13 28.85 2ee9 s GLU 64 CO 0.82 -0.42 0.33 0.14 0.01 0.00 0.00 175.26 176.14 2ee9 s VAL 65 N -3.06 5.28 -2.10 2.63 -7.23 -1.26 -4.91 120.40 109.75 2ee9 s VAL 65 Ca 0.16 -0.61 0.00 0.00 -1.81 0.00 0.00 61.98 59.73 2ee9 s VAL 65 Cb 0.02 -3.75 0.00 0.00 0.56 0.00 0.00 36.38 33.21 2ee9 s VAL 65 CO 0.10 -0.15 0.00 0.61 -0.31 0.00 0.00 175.10 175.34 2ee9 n GLY 66 N -0.70 0.65 3.61 2.32 0.00 -1.25 -4.81 105.19 105.01 2ee9 n GLY 66 Ca -0.06 -2.13 -0.37 0.00 0.00 0.00 0.00 46.02 43.46 2ee9 n GLY 66 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ee9 s LEU 67 N 0.00 4.00 -0.11 0.99 2.96 -1.26 -1.80 118.68 123.46 2ee9 s LEU 67 Ca 0.00 0.02 -0.02 0.00 -0.22 0.00 0.00 54.13 53.91 2ee9 s LEU 67 Cb 0.00 -2.09 -0.03 0.00 0.50 0.00 0.00 46.19 44.57 2ee9 s LEU 67 CO 0.00 0.00 -0.03 -1.00 -1.32 0.00 0.00 176.35 174.00 2ee9 s HIS 68 N 1.44 3.05 -0.17 5.38 3.76 -1.13 -3.76 115.29 123.86 2ee9 s HIS 68 Ca 0.07 -0.05 -0.02 0.00 -0.15 0.00 0.00 55.06 54.91 2ee9 s HIS 68 Cb -0.15 -1.85 -0.01 0.00 1.11 0.00 0.00 32.58 31.68 2ee9 s HIS 68 CO 0.08 0.22 -0.09 -2.00 -0.85 0.00 0.00 174.74 172.09 2ee9 s GLU 69 N -0.32 3.40 -0.02 1.40 2.12 -1.01 -2.00 118.70 122.27 2ee9 s GLU 69 Ca 0.06 -0.65 -0.03 0.00 0.36 0.00 0.00 54.97 54.71 2ee9 s GLU 69 Cb -0.12 -2.80 -0.04 0.00 0.26 0.00 0.00 34.13 31.43 2ee9 s GLU 69 CO 0.02 0.05 0.15 1.41 -0.54 0.00 0.00 175.26 176.35 2ee9 s MET 70 N 0.80 3.34 -0.20 4.30 -2.45 -0.57 -0.27 119.30 124.25 2ee9 s MET 70 Ca -0.03 -0.34 -0.02 0.00 -1.25 0.00 0.00 55.69 54.05 2ee9 s MET 70 Cb -0.15 -3.04 0.06 0.00 1.25 0.00 0.00 34.83 32.95 2ee9 s MET 70 CO 0.01 0.68 0.01 -1.01 1.05 0.00 0.00 175.02 175.77 2ee9 s HIS 71 N -1.24 1.33 -0.00 4.11 3.76 0.44 -2.26 115.29 121.42 2ee9 s HIS 71 Ca 0.24 -1.05 0.07 0.00 -0.15 0.00 0.00 55.06 54.17 2ee9 s HIS 71 Cb -0.12 -1.15 -0.03 0.00 1.11 0.00 0.00 32.58 32.39 2ee9 s HIS 71 CO 0.15 -0.64 -0.22 0.42 -0.85 0.00 0.00 174.74 173.60 2ee9 s ILE 72 N 1.75 2.45 -0.05 0.60 1.01 -1.26 -0.98 121.20 124.72 2ee9 s ILE 72 Ca -0.02 -1.08 -0.01 0.00 0.00 0.00 0.00 60.65 59.54 2ee9 s ILE 72 Cb -0.17 -1.93 0.03 0.00 0.01 0.00 0.00 42.46 40.39 2ee9 s ILE 72 CO -0.07 0.50 0.03 -0.54 0.00 0.00 0.00 174.94 174.85 2ee9 s LYS 73 N -0.90 0.27 -0.26 2.79 1.02 -1.16 -3.47 119.74 118.03 2ee9 s LYS 73 Ca 0.11 0.21 -0.17 0.00 0.02 0.00 0.00 55.97 56.15 2ee9 s LYS 73 Cb -0.10 -0.70 -0.03 0.00 -0.52 0.00 0.00 37.83 36.48 2ee9 s LYS 73 CO 0.01 -0.28 0.48 -0.47 -0.92 0.00 0.00 175.35 174.16 2ee9 s TYR 74 N 1.88 3.27 -1.33 3.18 5.04 0.18 -2.82 117.35 126.76 2ee9 s TYR 74 Ca 0.02 0.59 -0.05 0.00 -2.44 0.00 0.00 57.07 55.19 2ee9 s TYR 74 Cb -0.12 -2.67 0.03 0.00 0.35 0.00 0.00 41.96 39.54 2ee9 s TYR 74 CO -0.04 -0.25 0.35 -1.33 -1.34 0.00 0.00 175.55 172.95 2ee9 n MET 75 N 5.42 -3.35 -1.54 4.97 2.81 0.28 -0.43 117.12 125.28 2ee9 n MET 75 Ca -0.05 0.66 0.00 0.00 -1.81 0.00 0.00 57.70 56.50 2ee9 n MET 75 Cb 0.50 -5.38 0.00 0.00 -0.71 0.00 0.00 33.22 27.64 2ee9 n MET 75 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ee9 n GLY 76 N -1.15 0.39 2.72 3.03 0.00 -1.26 -5.04 105.19 103.88 2ee9 n GLY 76 Ca -0.09 -0.97 -0.20 0.00 0.00 0.00 0.00 46.02 44.76 2ee9 n GLY 76 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ee9 s SER 77 N -2.98 1.12 0.49 1.61 0.01 0.43 -5.09 113.70 109.29 2ee9 s SER 77 Ca 0.00 0.02 -0.24 0.00 1.31 0.00 0.00 55.95 57.05 2ee9 s SER 77 Cb 0.00 -0.23 -0.07 0.00 0.21 0.00 0.00 66.02 65.93 2ee9 s SER 77 CO 0.00 -0.21 1.36 1.41 0.41 0.00 0.00 173.24 176.21 2ee9 n HIS 78 N 5.07 2.38 -3.31 2.43 8.25 -1.26 0.49 115.22 129.26 2ee9 n HIS 78 Ca -0.08 0.44 -0.25 0.00 -0.26 0.00 0.00 57.72 57.57 2ee9 n HIS 78 Cb 0.50 -2.39 -0.02 0.00 1.12 0.00 0.00 29.99 29.20 2ee9 n HIS 78 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2ee9 s ILE 79 N -1.25 5.07 -2.00 1.59 -4.36 -1.23 -4.81 121.20 114.22 2ee9 s ILE 79 Ca 0.66 -0.27 0.15 0.00 -0.26 0.00 0.00 60.65 60.93 2ee9 s ILE 79 Cb -0.44 -3.83 0.42 0.00 1.25 0.00 0.00 42.46 39.86 2ee9 s ILE 79 CO 0.54 -0.51 1.30 -0.81 0.24 0.00 0.00 174.94 175.69 2ee9 n PRO 80 N -1.58 0.49 -0.00 0.37 -0.04 -1.26 -1.90 135.00 131.07 2ee9 n PRO 80 Ca -0.04 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.51 2ee9 n PRO 80 Cb 0.55 -1.48 -0.12 0.00 -0.04 0.00 0.00 33.50 32.42 2ee9 n PRO 80 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2ee9 n GLU 81 N -0.98 0.93 -4.28 0.54 4.71 -1.26 -5.00 120.64 115.31 2ee9 n GLU 81 Ca 0.11 -0.09 -0.15 0.00 -0.01 0.00 0.00 57.16 57.02 2ee9 n GLU 81 Cb 0.05 -1.36 -0.10 0.00 -1.01 0.00 0.00 31.44 29.02 2ee9 n GLU 81 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2ee9 s SER 82 N -3.39 1.91 0.74 1.62 0.01 -0.80 -4.21 113.70 109.59 2ee9 s SER 82 Ca -0.01 -1.05 -0.12 0.00 1.31 0.00 0.00 55.95 56.09 2ee9 s SER 82 Cb 0.12 -0.02 0.04 0.00 0.21 0.00 0.00 66.02 66.37 2ee9 s SER 82 CO 0.71 -0.34 1.10 -2.16 0.41 0.00 0.00 173.24 172.95 2ee9 s PRO 83 N -3.75 2.39 0.19 12.44 0.04 -1.26 -4.35 135.00 140.70 2ee9 s PRO 83 Ca 0.19 1.23 0.03 0.00 0.04 0.00 0.00 61.00 62.49 2ee9 s PRO 83 Cb 0.03 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.61 2ee9 s PRO 83 CO 0.03 -1.55 -0.02 -0.48 0.04 0.00 0.00 177.00 175.02 2ee9 s LEU 84 N -5.66 2.22 -0.04 -3.56 0.05 -0.96 -4.97 118.68 105.77 2ee9 s LEU 84 Ca 0.63 -1.16 0.02 0.00 0.05 0.00 0.00 54.13 53.66 2ee9 s LEU 84 Cb -0.18 -0.20 0.01 0.00 -2.05 0.00 0.00 46.19 43.77 2ee9 s LEU 84 CO 0.52 -0.50 -0.08 -1.10 -0.55 0.00 0.00 176.35 174.64 2ee9 s GLN 85 N -3.86 1.08 -0.06 1.48 -0.21 -1.26 -1.51 119.66 115.31 2ee9 s GLN 85 Ca 0.24 -0.25 -0.01 0.00 0.02 0.00 0.00 55.36 55.36 2ee9 s GLN 85 Cb 0.05 -0.98 0.03 0.00 1.00 0.00 0.00 33.01 33.11 2ee9 s GLN 85 CO 0.05 0.02 0.01 -0.59 -2.12 0.00 0.00 175.29 172.66 2ee9 s PHE 86 N 0.57 0.54 0.24 0.91 -0.71 -0.85 -5.00 117.98 113.69 2ee9 s PHE 86 Ca -0.09 -0.08 -0.30 0.00 -1.04 0.00 0.00 56.93 55.42 2ee9 s PHE 86 Cb -0.13 -0.73 -0.09 0.00 -1.21 0.00 0.00 43.02 40.87 2ee9 s PHE 86 CO 0.01 -0.29 0.98 -0.47 -1.34 0.00 0.00 175.22 174.10 2ee9 s TYR 87 N 1.97 3.89 -0.49 3.49 5.04 -1.26 -2.83 117.35 127.15 2ee9 s TYR 87 Ca 0.04 1.86 -0.07 0.00 -2.44 0.00 0.00 57.07 56.46 2ee9 s TYR 87 Cb -0.12 -3.05 0.13 0.00 0.35 0.00 0.00 41.96 39.26 2ee9 s TYR 87 CO -0.05 0.22 0.34 0.08 -1.34 0.00 0.00 175.55 174.81 2ee9 s VAL 88 N -1.09 4.00 0.32 3.14 1.01 -0.74 -5.01 120.40 122.02 2ee9 s VAL 88 Ca 0.42 -2.03 -0.27 0.00 0.00 0.00 0.00 61.98 60.10 2ee9 s VAL 88 Cb -0.27 -3.64 -0.09 0.00 0.00 0.00 0.00 36.38 32.37 2ee9 s VAL 88 CO 0.34 -0.78 1.01 0.20 0.00 0.00 0.00 175.10 175.86 2ee9 s ASN 89 N 2.21 7.21 0.31 3.32 -0.87 -1.26 -3.79 114.94 122.07 2ee9 s ASN 89 Ca 0.08 2.01 -0.28 0.00 -1.57 0.00 0.00 52.86 53.10 2ee9 s ASN 89 Cb -0.24 -2.60 -0.09 0.00 -0.02 0.00 0.00 41.25 38.30 2ee9 s ASN 89 CO -0.02 -0.17 1.11 -0.47 -2.57 0.00 0.00 177.10 174.98 2ee9 s TYR 90 N -1.45 3.44 0.07 2.20 6.14 -1.26 -4.97 117.35 121.52 2ee9 s TYR 90 Ca 0.49 1.66 -0.31 0.00 0.64 0.00 0.00 57.07 59.55 2ee9 s TYR 90 Cb -0.24 -3.30 -0.07 0.00 0.42 0.00 0.00 41.96 38.77 2ee9 s TYR 90 CO 0.30 -0.74 1.39 -1.25 0.64 0.00 0.00 175.55 175.90 2ee9 s PRO 91 N -1.72 4.31 -0.40 4.97 0.04 -1.26 -5.00 135.00 135.94 2ee9 s PRO 91 Ca 0.48 2.03 -0.13 0.00 0.04 0.00 0.00 61.00 63.42 2ee9 s PRO 91 Cb -0.31 -3.38 0.02 0.00 0.04 0.00 0.00 34.50 30.88 2ee9 s PRO 91 CO 0.40 -0.48 0.27 1.21 0.04 0.00 0.00 177.00 178.43 2ee9 s ASN 92 N 1.42 5.97 -0.33 6.66 2.47 -1.26 -5.03 114.94 124.83 2ee9 s ASN 92 Ca 0.64 -0.94 0.02 0.00 0.42 0.00 0.00 52.86 53.00 2ee9 s ASN 92 Cb -0.35 -2.11 0.10 0.00 -1.45 0.00 0.00 41.25 37.44 2ee9 s ASN 92 CO 0.29 -0.43 0.07 -0.94 -3.72 0.00 0.00 177.10 172.37 2ee9 s SER 93 N 1.63 4.49 -0.04 -4.21 1.04 -1.26 -4.97 113.70 110.39 2ee9 s SER 93 Ca 0.04 -2.00 -0.14 0.00 0.48 0.00 0.00 55.95 54.33 2ee9 s SER 93 Cb -0.19 -1.36 -0.32 0.00 0.10 0.00 0.00 66.02 64.25 2ee9 s SER 93 CO 0.09 -0.39 0.75 1.23 0.98 0.00 0.00 173.24 175.90 2ee9 h GLY 94 N 7.74 0.46 0.00 7.32 0.00 -2.06 -3.57 103.07 112.97 2ee9 h GLY 94 Ca -0.07 -1.19 0.00 0.00 0.00 0.00 0.00 47.33 46.07 2ee9 h GLY 94 CO 0.51 1.04 0.00 -1.26 0.00 0.00 0.00 176.54 176.82