#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 2.23 -0.17 1.61 0.01 -1.26 -5.11 113.70 111.01 2ee9 s SER 2 Ca 0.00 -0.38 -0.03 0.00 1.31 0.00 0.00 55.95 56.85 2ee9 s SER 2 Cb 0.00 -0.99 0.06 0.00 0.21 0.00 0.00 66.02 65.30 2ee9 s SER 2 CO 0.00 0.01 0.05 -0.94 0.41 0.00 0.00 173.24 172.76 2ee9 s SER 3 N 0.96 2.55 0.00 2.44 1.04 -1.26 -5.04 113.70 114.40 2ee9 s SER 3 Ca -0.08 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 55.70 2ee9 s SER 3 Cb -0.15 -0.47 0.00 0.00 0.10 0.00 0.00 66.02 65.50 2ee9 s SER 3 CO -0.01 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.52 2ee9 n GLY 4 N 5.13 -2.13 3.63 7.32 0.00 -1.26 -5.10 105.19 112.79 2ee9 n GLY 4 Ca -0.08 1.03 -0.41 0.00 0.00 0.00 0.00 46.02 46.56 2ee9 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ee9 s SER 5 N 0.00 6.66 -1.53 1.61 1.04 -1.26 -4.24 113.70 115.97 2ee9 s SER 5 Ca 0.00 0.81 -0.11 0.00 0.48 0.00 0.00 55.95 57.13 2ee9 s SER 5 Cb 0.00 -2.37 0.11 0.00 0.10 0.00 0.00 66.02 63.86 2ee9 s SER 5 CO 0.00 -0.41 0.27 -1.20 0.98 0.00 0.00 173.24 172.88 2ee9 n SER 6 N 5.76 -0.40 -2.90 7.02 7.64 -1.26 -4.82 113.62 124.66 2ee9 n SER 6 Ca 0.01 -1.13 -0.32 0.00 1.01 0.00 0.00 58.87 58.45 2ee9 n SER 6 Cb 0.49 -1.42 0.00 0.00 -1.01 0.00 0.00 64.21 62.27 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 -1.70 5.82 3.41 0.23 0.00 -1.26 -4.97 105.19 106.72 2ee9 n GLY 7 Ca -0.09 -2.68 -0.44 0.00 0.00 0.00 0.00 46.02 42.80 2ee9 n GLY 7 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ee9 s VAL 8 N -4.93 4.81 -0.48 1.61 1.01 -1.26 -5.00 120.40 116.16 2ee9 s VAL 8 Ca 0.48 -1.34 -0.19 0.00 0.00 0.00 0.00 61.98 60.93 2ee9 s VAL 8 Cb 0.34 -4.64 0.04 0.00 0.00 0.00 0.00 36.38 32.12 2ee9 s VAL 8 CO -0.21 -1.32 0.61 -0.94 0.00 0.00 0.00 175.10 173.23 2ee9 s SER 9 N 3.43 6.25 -0.69 3.32 1.04 -1.26 -4.95 113.70 120.84 2ee9 s SER 9 Ca 0.23 -0.71 -0.04 0.00 0.48 0.00 0.00 55.95 55.91 2ee9 s SER 9 Cb -0.13 -2.29 0.12 0.00 0.10 0.00 0.00 66.02 63.82 2ee9 s SER 9 CO -0.02 -0.82 2.57 0.47 0.98 0.00 0.00 173.24 176.42 2ee9 n ASP 10 N 6.14 6.94 -4.78 7.02 8.00 -1.26 -4.98 116.55 133.63 2ee9 n ASP 10 Ca -0.05 -3.29 -0.36 0.00 0.71 0.00 0.00 54.79 51.80 2ee9 n ASP 10 Cb 0.46 -1.23 -0.02 0.00 -0.02 0.00 0.00 41.12 40.31 2ee9 n ASP 10 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 2ee9 s MET 11 N -2.02 3.73 -0.20 -1.24 -2.45 -1.26 -4.99 119.30 110.87 2ee9 s MET 11 Ca 0.56 1.59 -0.18 0.00 -1.25 0.00 0.00 55.69 56.41 2ee9 s MET 11 Cb 0.34 -2.25 -0.20 0.00 1.25 0.00 0.00 34.83 33.98 2ee9 s MET 11 CO -0.22 -0.54 0.19 -1.71 1.05 0.00 0.00 175.02 173.79 2ee9 n ASN 12 N -0.75 1.91 0.00 1.11 5.15 -1.26 -4.97 115.26 116.45 2ee9 n ASN 12 Ca 0.09 0.38 0.00 0.00 -0.60 0.00 0.00 54.58 54.44 2ee9 n ASN 12 Cb 0.50 -0.94 0.00 0.00 -0.53 0.00 0.00 39.78 38.82 2ee9 n ASN 12 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2ee9 n GLY 13 N 1.52 1.33 0.29 8.20 0.00 -1.26 -3.23 105.19 112.03 2ee9 n GLY 13 Ca -0.34 -0.67 -0.05 0.00 0.00 0.00 0.00 46.02 44.95 2ee9 n GLY 13 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ee9 h LEU 14 N 0.00 0.87 0.00 0.99 -0.00 -2.02 -3.48 115.31 111.67 2ee9 h LEU 14 Ca 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 57.88 57.81 2ee9 h LEU 14 Cb 0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 40.66 40.44 2ee9 h LEU 14 CO 0.00 0.69 0.00 0.61 -0.00 0.00 0.00 178.44 179.74 2ee9 n GLY 15 N -1.15 -2.04 3.77 0.83 0.00 -1.20 -5.13 105.19 100.27 2ee9 n GLY 15 Ca 0.06 0.70 -0.40 0.00 0.00 0.00 0.00 46.02 46.38 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 0.00 2.89 0.40 1.61 0.08 -1.26 -4.56 117.98 117.14 2ee9 s PHE 16 Ca 0.00 1.39 -0.24 0.00 0.12 0.00 0.00 56.93 58.20 2ee9 s PHE 16 Cb 0.00 -3.71 -0.09 0.00 -0.57 0.00 0.00 43.02 38.65 2ee9 s PHE 16 CO 0.00 -2.08 1.05 0.15 -0.10 0.00 0.00 175.22 174.24 2ee9 s LYS 17 N -2.05 4.14 0.86 0.44 -0.14 -1.26 -4.80 119.74 116.93 2ee9 s LYS 17 Ca 0.53 1.50 -0.11 0.00 -1.36 0.00 0.00 55.97 56.53 2ee9 s LYS 17 Cb -0.39 -2.51 0.11 0.00 -1.68 0.00 0.00 37.83 33.36 2ee9 s LYS 17 CO 0.52 -0.16 1.09 -1.25 -0.76 0.00 0.00 175.35 174.79 2ee9 s PRO 18 N -2.55 1.53 -0.20 -1.68 0.04 -1.26 -4.43 135.00 126.44 2ee9 s PRO 18 Ca 0.58 0.91 -0.01 0.00 0.04 0.00 0.00 61.00 62.52 2ee9 s PRO 18 Cb -0.22 -1.83 0.06 0.00 0.04 0.00 0.00 34.50 32.55 2ee9 s PRO 18 CO 0.27 -2.08 -0.01 0.12 0.04 0.00 0.00 177.00 175.34 2ee9 s PHE 19 N -2.93 1.63 -0.06 0.56 5.36 -1.23 -5.00 117.98 116.31 2ee9 s PHE 19 Ca 0.63 -1.21 0.00 0.00 -0.96 0.00 0.00 56.93 55.39 2ee9 s PHE 19 Cb -0.18 -1.27 -0.03 0.00 -0.34 0.00 0.00 43.02 41.20 2ee9 s PHE 19 CO 0.57 -0.66 -0.03 0.34 -1.46 0.00 0.00 175.22 173.98 2ee9 s ASP 20 N 1.65 4.97 -0.01 6.13 -1.08 -1.26 -2.16 116.67 124.91 2ee9 s ASP 20 Ca -0.02 0.04 0.00 0.00 -0.52 0.00 0.00 52.55 52.05 2ee9 s ASP 20 Cb -0.17 -1.31 0.01 0.00 -1.46 0.00 0.00 42.92 39.99 2ee9 s ASP 20 CO -0.07 0.35 -0.00 -0.22 0.52 0.00 0.00 175.17 175.74 2ee9 s LEU 21 N -1.03 1.58 -0.35 -1.34 0.20 -0.60 -4.99 118.68 112.14 2ee9 s LEU 21 Ca 0.14 -0.01 -0.04 0.00 0.69 0.00 0.00 54.13 54.91 2ee9 s LEU 21 Cb -0.11 -0.11 0.06 0.00 -0.43 0.00 0.00 46.19 45.60 2ee9 s LEU 21 CO 0.04 -0.05 0.11 0.54 -0.29 0.00 0.00 176.35 176.71 2ee9 s VAL 22 N 0.48 3.48 0.25 1.68 0.11 -1.26 -1.25 120.40 123.89 2ee9 s VAL 22 Ca -0.04 -1.46 -0.30 0.00 -2.93 0.00 0.00 61.98 57.24 2ee9 s VAL 22 Cb -0.07 -3.09 -0.14 0.00 -1.53 0.00 0.00 36.38 31.55 2ee9 s VAL 22 CO -0.01 -0.32 1.29 -0.38 -3.33 0.00 0.00 175.10 172.35 2ee9 n ILE 23 N 4.72 1.29 0.01 7.04 5.41 -1.25 -4.92 119.36 131.65 2ee9 n ILE 23 Ca -0.10 -0.32 -0.13 0.00 1.00 0.00 0.00 62.75 63.20 2ee9 n ILE 23 Cb 0.43 -1.32 -0.10 0.00 -0.71 0.00 0.00 39.64 37.94 2ee9 n ILE 23 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 2ee9 h PRO 24 N 3.45 -0.05 -7.58 0.38 0.13 -1.98 -3.46 132.00 122.89 2ee9 h PRO 24 Ca -0.44 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.22 2ee9 h PRO 24 Cb 1.30 0.01 0.10 0.00 0.13 0.00 0.00 31.00 32.54 2ee9 h PRO 24 CO 0.70 0.42 0.39 -0.59 -0.23 0.00 0.00 178.00 178.69 2ee9 s PHE 25 N -4.20 2.91 0.39 1.56 -0.71 -1.26 -5.08 117.98 111.59 2ee9 s PHE 25 Ca -0.16 0.80 0.01 0.00 -1.04 0.00 0.00 56.93 56.55 2ee9 s PHE 25 Cb 0.02 -3.43 -0.02 0.00 -1.21 0.00 0.00 43.02 38.37 2ee9 s PHE 25 CO 0.65 -1.82 0.59 0.00 -1.34 0.00 0.00 175.22 173.30 2ee9 s ALA 26 N -3.50 3.76 0.17 1.99 0.00 -1.26 -4.92 121.76 117.99 2ee9 s ALA 26 Ca 0.62 -1.01 -0.23 0.00 0.00 0.00 0.00 51.96 51.34 2ee9 s ALA 26 Cb -0.12 -2.09 0.07 0.00 0.00 0.00 0.00 23.12 20.98 2ee9 s ALA 26 CO 0.50 -0.17 0.62 0.54 0.00 0.00 0.00 175.76 177.25 2ee9 s VAL 27 N -2.41 0.00 -0.36 0.00 0.11 -1.26 -5.14 120.40 111.35 2ee9 s VAL 27 Ca 0.44 -0.09 -0.13 0.00 -2.93 0.00 0.00 61.98 59.27 2ee9 s VAL 27 Cb -0.10 -1.09 -0.00 0.00 -1.53 0.00 0.00 36.38 33.66 2ee9 s VAL 27 CO 0.36 0.00 0.24 -0.13 -3.33 0.00 0.00 175.10 172.25 2ee9 s ARG 28 N -3.75 3.28 -0.96 1.54 0.52 -1.26 -4.95 118.95 113.36 2ee9 s ARG 28 Ca 0.02 -0.79 -0.25 0.00 -0.52 0.00 0.00 55.73 54.19 2ee9 s ARG 28 Cb -0.01 -3.82 -0.21 0.00 0.52 0.00 0.00 34.95 31.43 2ee9 s ARG 28 CO -0.11 -0.55 2.09 1.17 0.02 0.00 0.00 175.30 177.92 2ee9 n LYS 29 N 5.10 0.16 0.09 3.54 4.81 -1.26 -3.45 118.16 127.15 2ee9 n LYS 29 Ca -0.12 -1.42 0.00 0.00 -0.87 0.00 0.00 58.31 55.90 2ee9 n LYS 29 Cb 0.49 -3.66 0.00 0.00 0.02 0.00 0.00 35.03 31.87 2ee9 n LYS 29 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2ee9 n GLY 30 N 6.13 -1.12 3.03 3.14 0.00 -1.26 -5.04 105.19 110.07 2ee9 n GLY 30 Ca 0.40 0.20 -0.33 0.00 0.00 0.00 0.00 46.02 46.29 2ee9 n GLY 30 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ee9 s GLU 31 N -2.00 2.89 -0.06 1.61 0.41 -1.22 -5.03 118.70 115.30 2ee9 s GLU 31 Ca 0.00 -3.20 -0.25 0.00 -0.41 0.00 0.00 54.97 51.11 2ee9 s GLU 31 Cb 0.00 -3.74 0.05 0.00 -1.78 0.00 0.00 34.13 28.66 2ee9 s GLU 31 CO 0.00 -1.26 0.55 -1.50 -0.49 0.00 0.00 175.26 172.57 2ee9 s ILE 32 N -1.21 0.02 0.08 -1.63 2.07 -1.26 -2.28 121.20 116.99 2ee9 s ILE 32 Ca 0.25 -0.15 -0.07 0.00 -1.41 0.00 0.00 60.65 59.27 2ee9 s ILE 32 Cb -0.09 -0.86 -0.01 0.00 0.13 0.00 0.00 42.46 41.64 2ee9 s ILE 32 CO -0.12 -0.08 0.15 0.42 -1.91 0.00 0.00 174.94 173.39 2ee9 s THR 33 N -1.06 0.16 0.01 4.00 -4.23 -1.18 -5.01 115.64 108.33 2ee9 s THR 33 Ca -0.11 -1.28 -0.11 0.00 -1.18 0.00 0.00 61.69 59.01 2ee9 s THR 33 Cb -0.02 -1.34 0.01 0.00 1.34 0.00 0.00 72.50 72.49 2ee9 s THR 33 CO 0.07 -0.71 0.23 -0.83 -0.54 0.00 0.00 174.62 172.84 2ee9 s GLY 34 N -2.82 -0.04 0.02 3.99 0.00 -1.26 -2.41 107.32 104.80 2ee9 s GLY 34 Ca 0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 44.72 44.74 2ee9 s GLY 34 CO -0.10 -0.19 0.00 1.85 0.00 0.00 0.00 173.10 174.65 2ee9 s GLU 35 N -1.87 0.38 -0.13 2.90 -6.30 -0.42 -4.38 118.70 108.88 2ee9 s GLU 35 Ca -0.10 -0.64 0.02 0.00 -2.50 0.00 0.00 54.97 51.75 2ee9 s GLU 35 Cb -0.04 0.14 0.01 0.00 0.00 0.00 0.00 34.13 34.24 2ee9 s GLU 35 CO 0.00 -0.07 -0.20 0.08 0.02 0.00 0.00 175.26 175.09 2ee9 s VAL 36 N -1.74 1.88 -0.56 3.70 1.01 0.10 -0.00 120.40 124.79 2ee9 s VAL 36 Ca -0.13 -0.87 -0.18 0.00 0.00 0.00 0.00 61.98 60.80 2ee9 s VAL 36 Cb -0.08 -1.68 0.11 0.00 0.00 0.00 0.00 36.38 34.74 2ee9 s VAL 36 CO -0.02 0.52 0.61 -1.00 0.00 0.00 0.00 175.10 175.21 2ee9 s HIS 37 N 0.86 3.10 0.70 5.22 3.76 0.11 -2.08 115.29 126.96 2ee9 s HIS 37 Ca -0.07 -1.03 -0.16 0.00 -0.15 0.00 0.00 55.06 53.65 2ee9 s HIS 37 Cb -0.15 -3.86 0.02 0.00 1.11 0.00 0.00 32.58 29.70 2ee9 s HIS 37 CO -0.02 -1.16 1.21 -1.64 -0.85 0.00 0.00 174.74 172.28 2ee9 s MET 38 N 2.27 2.32 0.26 1.40 -1.94 -0.34 -1.87 119.30 121.40 2ee9 s MET 38 Ca 0.09 1.76 0.03 0.00 -1.71 0.00 0.00 55.69 55.86 2ee9 s MET 38 Cb -0.26 -1.85 0.33 0.00 2.01 0.00 0.00 34.83 35.06 2ee9 s MET 38 CO 0.06 -1.70 1.64 -1.00 -0.01 0.00 0.00 175.02 174.00 2ee9 h PRO 39 N -0.07 0.35 0.00 2.03 0.13 -1.81 -2.71 132.00 129.93 2ee9 h PRO 39 Ca -0.48 -0.18 0.00 0.00 -0.87 0.00 0.00 66.00 64.47 2ee9 h PRO 39 Cb 1.30 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2ee9 h PRO 39 CO 0.51 0.73 0.00 0.45 -0.23 0.00 0.00 178.00 179.46 2ee9 n SER 40 N -4.00 0.00 0.00 1.44 2.88 -1.26 -4.86 113.62 107.82 2ee9 n SER 40 Ca -0.02 0.45 0.00 0.00 -1.33 0.00 0.00 58.87 57.97 2ee9 n SER 40 Cb 0.52 -0.48 0.00 0.00 -0.75 0.00 0.00 64.21 63.50 2ee9 n SER 40 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ee9 n GLY 41 N 1.03 0.88 1.99 0.46 0.00 -1.02 -5.10 105.19 103.42 2ee9 n GLY 41 Ca 0.06 0.00 -0.16 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 -0.81 -1.67 -3.73 1.61 5.02 -1.26 -4.78 118.16 112.55 2ee9 n LYS 42 Ca 0.00 -1.02 -0.11 0.00 -2.02 0.00 0.00 58.31 55.16 2ee9 n LYS 42 Cb 0.00 -0.85 -0.07 0.00 -0.02 0.00 0.00 35.03 34.10 2ee9 n LYS 42 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2ee9 s THR 43 N -2.26 0.09 0.13 -0.18 -4.23 -1.26 -1.19 115.64 106.73 2ee9 s THR 43 Ca 0.40 -0.70 -0.23 0.00 -1.18 0.00 0.00 61.69 59.97 2ee9 s THR 43 Cb -0.03 -1.05 0.07 0.00 1.34 0.00 0.00 72.50 72.83 2ee9 s THR 43 CO 0.30 -0.39 0.59 0.00 -0.54 0.00 0.00 174.62 174.57 2ee9 s ALA 44 N -2.99 -1.54 -0.20 3.99 0.00 -0.88 -4.94 121.76 115.20 2ee9 s ALA 44 Ca -0.02 0.53 -0.10 0.00 0.00 0.00 0.00 51.96 52.37 2ee9 s ALA 44 Cb 0.01 0.76 -0.05 0.00 0.00 0.00 0.00 23.12 23.84 2ee9 s ALA 44 CO -0.06 -0.71 0.12 0.95 0.00 0.00 0.00 175.76 176.06 2ee9 s THR 45 N -3.44 5.32 1.23 0.00 -4.23 -1.26 0.02 115.64 113.28 2ee9 s THR 45 Ca -0.00 0.16 -0.20 0.00 -1.18 0.00 0.00 61.69 60.46 2ee9 s THR 45 Cb -0.01 -3.42 0.30 0.00 1.34 0.00 0.00 72.50 70.71 2ee9 s THR 45 CO -0.10 0.45 1.11 -2.16 -0.54 0.00 0.00 174.62 173.38 2ee9 s PRO 46 N 0.33 -1.41 -0.36 3.99 0.04 -1.26 -4.98 135.00 131.36 2ee9 s PRO 46 Ca 0.07 -0.14 -0.08 0.00 0.04 0.00 0.00 61.00 60.89 2ee9 s PRO 46 Cb -0.11 -1.58 0.04 0.00 0.04 0.00 0.00 34.50 32.88 2ee9 s PRO 46 CO -0.02 -3.82 0.16 -2.00 0.04 0.00 0.00 177.00 171.36 2ee9 s GLU 47 N -5.46 2.70 -0.43 4.56 2.12 0.22 -4.95 118.70 117.46 2ee9 s GLU 47 Ca 0.72 -1.16 -0.15 0.00 0.36 0.00 0.00 54.97 54.74 2ee9 s GLU 47 Cb -0.09 -3.59 0.04 0.00 0.26 0.00 0.00 34.13 30.75 2ee9 s GLU 47 CO 0.56 -0.70 0.34 0.42 -0.54 0.00 0.00 175.26 175.34 2ee9 s ILE 48 N 1.47 5.24 0.01 -3.70 1.01 -1.26 -1.18 121.20 122.79 2ee9 s ILE 48 Ca 0.00 -0.76 0.07 0.00 0.00 0.00 0.00 60.65 59.96 2ee9 s ILE 48 Cb -0.20 -3.99 -0.02 0.00 0.01 0.00 0.00 42.46 38.26 2ee9 s ILE 48 CO 0.04 -0.40 -0.23 -0.69 0.00 0.00 0.00 174.94 173.67 2ee9 s VAL 49 N 1.69 1.81 -0.33 2.92 1.01 -1.09 -4.98 120.40 121.44 2ee9 s VAL 49 Ca 0.05 -1.11 -0.12 0.00 0.00 0.00 0.00 61.98 60.81 2ee9 s VAL 49 Cb -0.20 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.63 2ee9 s VAL 49 CO 0.09 0.40 0.21 -0.62 0.00 0.00 0.00 175.10 175.17 2ee9 s ASP 50 N -0.84 5.85 1.01 3.32 -1.08 -1.26 -0.04 116.67 123.63 2ee9 s ASP 50 Ca 0.09 -0.50 -0.13 0.00 -0.52 0.00 0.00 52.55 51.49 2ee9 s ASP 50 Cb -0.09 -2.08 0.13 0.00 -1.46 0.00 0.00 42.92 39.43 2ee9 s ASP 50 CO 0.00 -0.23 0.70 0.59 0.52 0.00 0.00 175.17 176.75 2ee9 n ASN 51 N 5.05 -1.29 -1.02 -0.34 3.02 0.42 -4.86 115.26 116.23 2ee9 n ASN 51 Ca -0.13 0.19 0.02 0.00 -0.03 0.00 0.00 54.58 54.62 2ee9 n ASN 51 Cb 0.49 -1.26 0.14 0.00 -0.61 0.00 0.00 39.78 38.54 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 -3.23 2.32 -0.02 3.52 3.00 -1.26 -3.91 118.16 118.58 2ee9 n LYS 52 Ca 0.07 -1.11 -0.04 0.00 -0.00 0.00 0.00 58.31 57.23 2ee9 n LYS 52 Cb 0.55 -1.75 -0.01 0.00 0.00 0.00 0.00 35.03 33.81 2ee9 n LYS 52 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2ee9 n ASP 53 N 0.20 0.71 0.00 3.14 9.92 -1.26 -5.05 116.55 124.21 2ee9 n ASP 53 Ca 0.11 0.04 0.00 0.00 -0.53 0.00 0.00 54.79 54.40 2ee9 n ASP 53 Cb 0.61 -0.11 0.00 0.00 -0.64 0.00 0.00 41.12 40.98 2ee9 n ASP 53 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ee9 n GLY 54 N 2.83 0.00 2.52 0.44 0.00 -1.25 -5.11 105.19 104.62 2ee9 n GLY 54 Ca -0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.81 2ee9 n GLY 54 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ee9 n THR 55 N 0.00 0.00 -4.33 2.61 -2.24 -1.26 -4.84 114.28 104.22 2ee9 n THR 55 Ca 0.00 -1.65 -0.20 0.00 -2.27 0.00 0.00 64.05 59.93 2ee9 n THR 55 Cb 0.00 0.90 -0.11 0.00 -2.10 0.00 0.00 70.33 69.02 2ee9 n THR 55 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2ee9 s VAL 56 N -2.90 1.72 -0.21 2.28 1.01 -1.26 -0.44 120.40 120.60 2ee9 s VAL 56 Ca 0.27 -2.03 -0.03 0.00 0.00 0.00 0.00 61.98 60.18 2ee9 s VAL 56 Cb 0.01 -1.90 0.07 0.00 0.00 0.00 0.00 36.38 34.55 2ee9 s VAL 56 CO 0.19 -0.46 0.07 -0.89 0.00 0.00 0.00 175.10 174.01 2ee9 s THR 57 N -2.49 0.30 -0.44 3.92 2.01 0.94 -3.83 115.64 116.05 2ee9 s THR 57 Ca 0.18 -0.53 -0.22 0.00 0.31 0.00 0.00 61.69 61.43 2ee9 s THR 57 Cb -0.03 -0.94 0.02 0.00 0.01 0.00 0.00 72.50 71.56 2ee9 s THR 57 CO 0.06 -0.33 0.72 -0.69 -0.69 0.00 0.00 174.62 173.69 2ee9 s VAL 58 N 1.95 4.74 0.03 3.82 1.01 -0.38 -2.66 120.40 128.91 2ee9 s VAL 58 Ca 0.02 0.32 0.07 0.00 0.00 0.00 0.00 61.98 62.39 2ee9 s VAL 58 Cb -0.17 -4.25 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 2ee9 s VAL 58 CO -0.13 -0.63 -0.20 -0.60 0.00 0.00 0.00 175.10 173.54 2ee9 s ARG 59 N 3.05 2.05 -0.28 2.72 3.52 -0.32 -1.56 118.95 128.14 2ee9 s ARG 59 Ca 0.26 -0.98 -0.01 0.00 -0.13 0.00 0.00 55.73 54.88 2ee9 s ARG 59 Cb -0.13 -2.15 0.17 0.00 -1.56 0.00 0.00 34.95 31.28 2ee9 s ARG 59 CO 0.20 0.54 0.51 -0.47 -0.81 0.00 0.00 175.30 175.28 2ee9 s TYR 60 N -0.85 -1.33 -0.20 5.12 5.04 -0.92 0.73 117.35 124.95 2ee9 s TYR 60 Ca 0.13 1.31 -0.29 0.00 -2.44 0.00 0.00 57.07 55.78 2ee9 s TYR 60 Cb -0.10 0.33 0.00 0.00 0.35 0.00 0.00 41.96 42.54 2ee9 s TYR 60 CO 0.03 -0.84 1.02 0.00 -1.34 0.00 0.00 175.55 174.42 2ee9 s ALA 61 N 2.74 3.61 0.10 3.97 0.00 -1.26 -3.58 121.76 127.34 2ee9 s ALA 61 Ca 0.17 0.21 -0.31 0.00 0.00 0.00 0.00 51.96 52.03 2ee9 s ALA 61 Cb -0.15 -3.50 -0.07 0.00 0.00 0.00 0.00 23.12 19.40 2ee9 s ALA 61 CO -0.20 -0.92 1.37 -1.25 0.00 0.00 0.00 175.76 174.76 2ee9 s PRO 62 N 2.85 4.33 -0.03 0.00 0.04 -1.26 -4.92 135.00 136.01 2ee9 s PRO 62 Ca 0.45 2.03 0.20 0.00 0.04 0.00 0.00 61.00 63.72 2ee9 s PRO 62 Cb -0.16 -3.29 -0.31 0.00 0.04 0.00 0.00 34.50 30.78 2ee9 s PRO 62 CO 0.09 -0.43 0.43 2.41 0.04 0.00 0.00 177.00 179.54 2ee9 n THR 63 N 4.01 0.04 -4.46 1.26 -1.04 -1.26 -4.57 114.28 108.26 2ee9 n THR 63 Ca 0.11 -0.47 -0.22 0.00 -2.04 0.00 0.00 64.05 61.43 2ee9 n THR 63 Cb 0.43 0.02 -0.11 0.00 -1.82 0.00 0.00 70.33 68.86 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 -3.37 1.67 0.36 -2.82 2.02 -1.26 -5.04 118.70 110.26 2ee9 s GLU 64 Ca -0.07 -1.92 0.01 0.00 0.02 0.00 0.00 54.97 53.01 2ee9 s GLU 64 Cb 0.13 -0.95 -0.03 0.00 0.10 0.00 0.00 34.13 33.38 2ee9 s GLU 64 CO 0.83 -0.16 0.55 0.14 0.02 0.00 0.00 175.26 176.64 2ee9 s VAL 65 N -3.23 4.88 0.00 2.63 -7.23 -1.26 -4.87 120.40 111.32 2ee9 s VAL 65 Ca 0.36 -0.53 0.00 0.00 -1.81 0.00 0.00 61.98 60.00 2ee9 s VAL 65 Cb 0.09 -3.78 0.00 0.00 0.56 0.00 0.00 36.38 33.25 2ee9 s VAL 65 CO 0.15 -0.49 0.00 0.61 -0.31 0.00 0.00 175.10 175.07 2ee9 n GLY 66 N -1.80 0.31 3.62 2.32 0.00 -1.25 -4.73 105.19 103.66 2ee9 n GLY 66 Ca -0.04 -2.26 -0.34 0.00 0.00 0.00 0.00 46.02 43.37 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 3.71 -0.09 0.99 2.96 -1.26 -1.95 118.68 123.04 2ee9 s LEU 67 Ca 0.00 0.05 0.03 0.00 -0.22 0.00 0.00 54.13 53.99 2ee9 s LEU 67 Cb 0.00 -1.93 -0.01 0.00 0.50 0.00 0.00 46.19 44.75 2ee9 s LEU 67 CO 0.00 0.19 -0.18 -1.00 -1.32 0.00 0.00 176.35 174.04 2ee9 s HIS 68 N 0.29 2.66 -0.23 5.38 3.76 -0.86 -2.82 115.29 123.47 2ee9 s HIS 68 Ca 0.02 -0.63 -0.04 0.00 -0.15 0.00 0.00 55.06 54.27 2ee9 s HIS 68 Cb -0.13 -1.72 0.00 0.00 1.11 0.00 0.00 32.58 31.84 2ee9 s HIS 68 CO 0.01 -0.17 -0.04 -2.00 -0.85 0.00 0.00 174.74 171.69 2ee9 s GLU 69 N 0.01 3.21 0.21 1.40 2.12 -0.78 -1.20 118.70 123.67 2ee9 s GLU 69 Ca -0.06 -0.74 -0.12 0.00 0.36 0.00 0.00 54.97 54.41 2ee9 s GLU 69 Cb -0.15 -3.03 -0.07 0.00 0.26 0.00 0.00 34.13 31.14 2ee9 s GLU 69 CO 0.05 -0.27 0.57 1.41 -0.54 0.00 0.00 175.26 176.47 2ee9 s MET 70 N 1.44 3.89 -0.28 4.30 -2.45 0.57 0.06 119.30 126.83 2ee9 s MET 70 Ca 0.04 0.39 -0.02 0.00 -1.25 0.00 0.00 55.69 54.85 2ee9 s MET 70 Cb -0.15 -2.73 0.09 0.00 1.25 0.00 0.00 34.83 33.29 2ee9 s MET 70 CO -0.03 0.36 0.09 -1.01 1.05 0.00 0.00 175.02 175.48 2ee9 s HIS 71 N -1.71 1.22 -0.12 4.11 3.76 0.99 -1.77 115.29 121.79 2ee9 s HIS 71 Ca 0.45 -1.35 -0.01 0.00 -0.15 0.00 0.00 55.06 54.00 2ee9 s HIS 71 Cb -0.12 -1.37 -0.03 0.00 1.11 0.00 0.00 32.58 32.17 2ee9 s HIS 71 CO 0.20 -0.81 -0.07 0.42 -0.85 0.00 0.00 174.74 173.63 2ee9 s ILE 72 N 1.79 3.61 -0.07 0.60 1.01 -1.26 -1.31 121.20 125.57 2ee9 s ILE 72 Ca 0.07 -0.48 -0.00 0.00 0.00 0.00 0.00 60.65 60.24 2ee9 s ILE 72 Cb -0.17 -2.53 0.02 0.00 0.01 0.00 0.00 42.46 39.80 2ee9 s ILE 72 CO -0.25 0.54 -0.04 -0.54 0.00 0.00 0.00 174.94 174.65 2ee9 s LYS 73 N -0.08 0.95 -0.43 2.79 1.02 -1.01 -3.74 119.74 119.23 2ee9 s LYS 73 Ca 0.00 -0.07 -0.20 0.00 0.02 0.00 0.00 55.97 55.72 2ee9 s LYS 73 Cb -0.13 -1.09 0.02 0.00 -0.52 0.00 0.00 37.83 36.11 2ee9 s LYS 73 CO 0.03 -0.20 0.62 -0.47 -0.92 0.00 0.00 175.35 174.41 2ee9 s TYR 74 N 1.49 3.08 -1.53 3.18 5.04 0.19 -3.08 117.35 125.72 2ee9 s TYR 74 Ca -0.01 -0.05 -0.05 0.00 -2.44 0.00 0.00 57.07 54.52 2ee9 s TYR 74 Cb -0.13 -3.28 0.01 0.00 0.35 0.00 0.00 41.96 38.91 2ee9 s TYR 74 CO -0.04 -0.83 0.53 -1.33 -1.34 0.00 0.00 175.55 172.54 2ee9 n MET 75 N 6.18 -4.38 -0.87 4.97 2.81 -0.97 -1.05 117.12 123.81 2ee9 n MET 75 Ca -0.02 0.85 0.00 0.00 -1.81 0.00 0.00 57.70 56.72 2ee9 n MET 75 Cb 0.48 -5.68 0.00 0.00 -0.71 0.00 0.00 33.22 27.31 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 -1.42 0.49 3.17 3.03 0.00 -1.26 -5.04 105.19 104.16 2ee9 n GLY 76 Ca -0.11 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 44.96 2ee9 n GLY 76 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ee9 s SER 77 N -2.58 2.86 0.21 1.61 1.04 -0.21 -5.08 113.70 111.55 2ee9 s SER 77 Ca 0.00 -0.52 -0.30 0.00 0.48 0.00 0.00 55.95 55.61 2ee9 s SER 77 Cb 0.00 -1.31 -0.08 0.00 0.10 0.00 0.00 66.02 64.72 2ee9 s SER 77 CO 0.00 0.11 1.16 -1.00 0.98 0.00 0.00 173.24 174.50 2ee9 s HIS 78 N 0.55 3.47 0.38 5.02 3.76 -1.26 0.52 115.29 127.74 2ee9 s HIS 78 Ca -0.15 1.51 -0.05 0.00 -0.15 0.00 0.00 55.06 56.23 2ee9 s HIS 78 Cb -0.17 -3.38 -0.05 0.00 1.11 0.00 0.00 32.58 30.09 2ee9 s HIS 78 CO 0.05 -0.99 0.67 0.96 -0.85 0.00 0.00 174.74 174.58 2ee9 s ILE 79 N -0.37 4.96 -1.69 0.60 -4.36 -1.25 -4.91 121.20 114.18 2ee9 s ILE 79 Ca 0.50 0.10 0.15 0.00 -0.26 0.00 0.00 60.65 61.15 2ee9 s ILE 79 Cb -0.32 -3.80 0.34 0.00 1.25 0.00 0.00 42.46 39.92 2ee9 s ILE 79 CO 0.38 -0.58 1.37 -0.81 0.24 0.00 0.00 174.94 175.55 2ee9 n PRO 80 N -1.60 0.33 -0.01 0.37 -0.04 -1.26 -1.95 135.00 130.85 2ee9 n PRO 80 Ca -0.01 0.08 0.09 0.00 -0.04 0.00 0.00 63.50 63.63 2ee9 n PRO 80 Cb 0.55 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.37 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 -1.16 0.64 -4.23 0.54 -0.58 -1.26 -4.99 120.64 109.61 2ee9 n GLU 81 Ca 0.09 -0.10 -0.13 0.00 -0.42 0.00 0.00 57.16 56.60 2ee9 n GLU 81 Cb 0.09 -1.44 -0.10 0.00 -0.57 0.00 0.00 31.44 29.42 2ee9 n GLU 81 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2ee9 s SER 82 N -3.63 1.48 0.55 1.62 0.01 -0.82 -4.08 113.70 108.83 2ee9 s SER 82 Ca -0.01 -1.06 -0.19 0.00 1.31 0.00 0.00 55.95 56.00 2ee9 s SER 82 Cb 0.13 0.05 -0.06 0.00 0.21 0.00 0.00 66.02 66.36 2ee9 s SER 82 CO 0.80 -0.43 1.13 -2.16 0.41 0.00 0.00 173.24 172.99 2ee9 s PRO 83 N -3.82 3.34 0.31 12.44 0.04 -1.26 -4.22 135.00 141.84 2ee9 s PRO 83 Ca 0.18 1.61 0.07 0.00 0.04 0.00 0.00 61.00 62.90 2ee9 s PRO 83 Cb 0.04 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.52 2ee9 s PRO 83 CO 0.00 -0.86 -0.05 -0.48 0.04 0.00 0.00 177.00 175.65 2ee9 s LEU 84 N -3.83 2.55 0.00 -3.56 0.05 -0.73 -4.95 118.68 108.22 2ee9 s LEU 84 Ca 0.73 -1.22 0.03 0.00 0.05 0.00 0.00 54.13 53.72 2ee9 s LEU 84 Cb -0.24 -0.73 -0.01 0.00 -2.05 0.00 0.00 46.19 43.16 2ee9 s LEU 84 CO 0.27 -0.34 -0.11 0.00 -0.55 0.00 0.00 176.35 175.63 2ee9 s GLN 85 N -3.71 0.84 -0.07 1.48 -2.07 -1.26 -0.31 119.66 114.56 2ee9 s GLN 85 Ca 0.31 -0.44 -0.03 0.00 -1.82 0.00 0.00 55.36 53.38 2ee9 s GLN 85 Cb 0.04 -0.81 0.04 0.00 -1.09 0.00 0.00 33.01 31.19 2ee9 s GLN 85 CO 0.14 0.22 0.16 -0.59 -1.32 0.00 0.00 175.29 173.90 2ee9 s PHE 86 N -0.38 -0.19 0.03 9.60 -0.71 -0.34 -4.99 117.98 121.00 2ee9 s PHE 86 Ca 0.03 0.54 -0.21 0.00 -1.04 0.00 0.00 56.93 56.25 2ee9 s PHE 86 Cb -0.05 -0.06 -0.06 0.00 -1.21 0.00 0.00 43.02 41.64 2ee9 s PHE 86 CO -0.00 -0.18 0.60 -0.47 -1.34 0.00 0.00 175.22 173.84 2ee9 s TYR 87 N 1.18 3.74 -0.32 3.49 5.04 -1.26 -2.03 117.35 127.18 2ee9 s TYR 87 Ca -0.09 1.26 -0.09 0.00 -2.44 0.00 0.00 57.07 55.71 2ee9 s TYR 87 Cb -0.11 -2.59 0.00 0.00 0.35 0.00 0.00 41.96 39.61 2ee9 s TYR 87 CO -0.06 0.43 0.15 0.08 -1.34 0.00 0.00 175.55 174.81 2ee9 s VAL 88 N -0.53 4.49 0.10 3.14 1.01 -0.82 -5.02 120.40 122.76 2ee9 s VAL 88 Ca 0.31 -0.57 -0.19 0.00 0.00 0.00 0.00 61.98 61.53 2ee9 s VAL 88 Cb -0.19 -3.34 -0.07 0.00 0.00 0.00 0.00 36.38 32.78 2ee9 s VAL 88 CO 0.19 -0.00 0.58 0.20 0.00 0.00 0.00 175.10 176.06 2ee9 s ASN 89 N 1.58 7.04 0.32 3.32 0.01 -1.26 -3.89 114.94 122.05 2ee9 s ASN 89 Ca 0.04 1.26 -0.29 0.00 -0.71 0.00 0.00 52.86 53.15 2ee9 s ASN 89 Cb -0.18 -2.36 -0.11 0.00 0.41 0.00 0.00 41.25 39.02 2ee9 s ASN 89 CO 0.06 0.23 1.46 -0.47 -1.51 0.00 0.00 177.10 176.87 2ee9 s TYR 90 N -1.19 2.84 -0.03 2.20 6.14 -1.26 -4.76 117.35 121.29 2ee9 s TYR 90 Ca 0.31 1.10 -0.30 0.00 0.64 0.00 0.00 57.07 58.83 2ee9 s TYR 90 Cb -0.19 -3.90 -0.05 0.00 0.42 0.00 0.00 41.96 38.24 2ee9 s TYR 90 CO 0.19 -2.78 1.47 -1.25 0.64 0.00 0.00 175.55 173.83 2ee9 s PRO 91 N -1.24 4.24 0.27 4.97 0.04 -1.26 -4.93 135.00 137.09 2ee9 s PRO 91 Ca 0.56 2.02 -0.22 0.00 0.04 0.00 0.00 61.00 63.40 2ee9 s PRO 91 Cb -0.44 -3.70 -0.15 0.00 0.04 0.00 0.00 34.50 30.25 2ee9 s PRO 91 CO 0.52 -0.68 0.28 0.09 0.04 0.00 0.00 177.00 177.25 2ee9 n ASN 92 N 5.99 -1.86 -3.96 6.66 4.13 -1.26 -4.97 115.26 119.98 2ee9 n ASN 92 Ca 0.15 0.88 -0.18 0.00 1.68 0.00 0.00 54.58 57.11 2ee9 n ASN 92 Cb 0.43 -0.83 -0.15 0.00 -1.54 0.00 0.00 39.78 37.69 2ee9 n ASN 92 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2ee9 s SER 93 N -0.91 0.83 0.00 6.41 0.15 -1.26 -5.10 113.70 113.82 2ee9 s SER 93 Ca 0.56 -0.12 0.00 0.00 0.70 0.00 0.00 55.95 57.09 2ee9 s SER 93 Cb -0.71 -0.19 0.00 0.00 -1.71 0.00 0.00 66.02 63.41 2ee9 s SER 93 CO 0.54 0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.63 2ee9 n GLY 94 N 3.25 -0.20 0.00 9.45 0.00 -1.26 -5.32 105.19 111.11 2ee9 n GLY 94 Ca -0.17 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.07 2ee9 n GLY 94 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76