#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eki n SER 2 N 0.00 0.43 -4.78 1.61 7.64 -1.26 -4.86 113.62 112.40 2eki n SER 2 Ca 0.00 0.35 -0.30 0.00 1.01 0.00 0.00 58.87 59.93 2eki n SER 2 Cb 0.00 -0.83 0.11 0.00 -1.01 0.00 0.00 64.21 62.48 2eki n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2eki s SER 3 N 7.09 4.05 0.00 6.43 1.04 -1.26 -4.81 113.70 126.24 2eki s SER 3 Ca 1.18 1.24 0.00 0.00 0.48 0.00 0.00 55.95 58.85 2eki s SER 3 Cb -1.23 -1.93 0.00 0.00 0.10 0.00 0.00 66.02 62.96 2eki s SER 3 CO 0.51 -2.24 0.00 0.61 0.98 0.00 0.00 173.24 173.10 2eki n GLY 4 N -1.97 2.23 3.85 7.32 0.00 -1.26 -5.15 105.19 110.21 2eki n GLY 4 Ca 0.07 -0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 2eki n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eki s SER 5 N 0.00 6.34 0.75 1.61 0.15 -1.26 -5.02 113.70 116.28 2eki s SER 5 Ca 0.00 1.54 -0.15 0.00 0.70 0.00 0.00 55.95 58.04 2eki s SER 5 Cb 0.00 -2.50 0.04 0.00 -1.71 0.00 0.00 66.02 61.85 2eki s SER 5 CO 0.00 -0.78 1.10 -1.54 1.20 0.00 0.00 173.24 173.22 2eki n SER 6 N -2.13 0.88 0.00 5.45 3.41 -1.26 -4.91 113.62 115.07 2eki n SER 6 Ca 0.07 0.65 0.00 0.00 -0.26 0.00 0.00 58.87 59.33 2eki n SER 6 Cb 0.54 -1.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.02 2eki n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eki n GLY 7 N 0.85 -0.91 1.28 5.00 0.00 -1.26 -4.96 105.19 105.20 2eki n GLY 7 Ca 0.14 0.64 -0.05 0.00 0.00 0.00 0.00 46.02 46.74 2eki n GLY 7 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2eki n TYR 8 N 0.00 0.90 -2.59 1.61 4.11 -1.26 -4.79 117.16 115.13 2eki n TYR 8 Ca 0.00 -0.77 -0.41 0.00 -0.00 0.00 0.00 57.90 56.72 2eki n TYR 8 Cb 0.00 -0.42 -0.03 0.00 -0.00 0.00 0.00 39.34 38.90 2eki n TYR 8 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.86 175.69 2eki s LEU 9 N -1.00 3.67 0.72 -3.48 2.96 -1.26 -4.97 118.68 115.33 2eki s LEU 9 Ca 0.18 -1.62 -0.11 0.00 -0.22 0.00 0.00 54.13 52.35 2eki s LEU 9 Cb 0.15 -2.56 0.02 0.00 0.50 0.00 0.00 46.19 44.30 2eki s LEU 9 CO 0.04 -1.43 1.07 -0.75 -1.32 0.00 0.00 176.35 173.96 2eki s LYS 10 N 4.68 2.76 -0.10 1.98 2.20 -1.26 -4.89 119.74 125.12 2eki s LYS 10 Ca 0.46 0.73 0.01 0.00 -0.36 0.00 0.00 55.97 56.81 2eki s LYS 10 Cb 0.00 -1.99 0.02 0.00 -1.51 0.00 0.00 37.83 34.35 2eki s LYS 10 CO -0.08 -1.17 -0.10 -0.51 -0.36 0.00 0.00 175.35 173.14 2eki s LEU 11 N -5.53 1.38 -0.08 5.43 1.43 -1.26 -0.54 118.68 119.51 2eki s LEU 11 Ca 0.58 -0.32 -0.02 0.00 -1.03 0.00 0.00 54.13 53.35 2eki s LEU 11 Cb -0.13 -0.87 -0.03 0.00 0.03 0.00 0.00 46.19 45.19 2eki s LEU 11 CO 0.54 -0.06 0.02 0.68 0.23 0.00 0.00 176.35 177.76 2eki s VAL 12 N 1.34 4.46 -0.11 -1.59 -7.23 -0.44 -4.93 120.40 111.90 2eki s VAL 12 Ca -0.02 -0.23 -0.05 0.00 -1.81 0.00 0.00 61.98 59.87 2eki s VAL 12 Cb -0.14 -2.90 -0.04 0.00 0.56 0.00 0.00 36.38 33.86 2eki s VAL 12 CO -0.05 0.57 0.07 -0.13 -0.31 0.00 0.00 175.10 175.26 2eki s ARG 13 N -1.01 3.31 -0.12 4.82 0.52 -1.26 -0.69 118.95 124.53 2eki s ARG 13 Ca 0.15 -0.27 0.02 0.00 -0.52 0.00 0.00 55.73 55.11 2eki s ARG 13 Cb -0.11 -3.03 0.01 0.00 0.52 0.00 0.00 34.95 32.34 2eki s ARG 13 CO 0.04 0.69 -0.18 0.42 0.02 0.00 0.00 175.30 176.28 2eki s ILE 14 N -0.80 1.74 -0.58 1.52 -1.09 -0.63 -1.42 121.20 119.94 2eki s ILE 14 Ca 0.13 -0.79 -0.20 0.00 -2.23 0.00 0.00 60.65 57.56 2eki s ILE 14 Cb -0.12 -1.56 0.08 0.00 -1.58 0.00 0.00 42.46 39.28 2eki s ILE 14 CO 0.03 0.49 0.75 -0.31 -1.23 0.00 0.00 174.94 174.66 2eki s TYR 15 N 0.87 2.94 0.37 3.97 2.02 0.45 -2.35 117.35 125.62 2eki s TYR 15 Ca -0.08 -0.69 -0.27 0.00 -0.37 0.00 0.00 57.07 55.67 2eki s TYR 15 Cb -0.15 -3.92 -0.09 0.00 -0.40 0.00 0.00 41.96 37.39 2eki s TYR 15 CO -0.01 -1.29 1.23 -0.08 -1.57 0.00 0.00 175.55 173.84 2eki s THR 16 N 3.01 2.94 -0.50 -0.71 -1.32 -1.26 -1.10 115.64 116.70 2eki s THR 16 Ca 0.16 0.86 0.02 0.00 -1.21 0.00 0.00 61.69 61.52 2eki s THR 16 Cb -0.20 -3.51 0.13 0.00 -1.51 0.00 0.00 72.50 67.40 2eki s THR 16 CO 0.10 0.14 0.25 -0.75 -2.21 0.00 0.00 174.62 172.15 2eki s LYS 17 N -2.05 2.01 -0.21 7.08 2.20 0.18 -3.29 119.74 125.65 2eki s LYS 17 Ca 0.53 -2.42 -0.29 0.00 -0.36 0.00 0.00 55.97 53.44 2eki s LYS 17 Cb -0.35 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.54 2eki s LYS 17 CO 0.45 -1.09 1.60 -1.25 -0.36 0.00 0.00 175.35 174.71 2eki s PRO 18 N 0.07 3.83 0.10 4.03 0.04 -1.26 -3.81 135.00 138.00 2eki s PRO 18 Ca 0.15 1.68 -0.30 0.00 0.04 0.00 0.00 61.00 62.57 2eki s PRO 18 Cb -0.23 -4.02 -0.17 0.00 0.04 0.00 0.00 34.50 30.12 2eki s PRO 18 CO -0.02 -1.26 0.70 0.36 0.04 0.00 0.00 177.00 176.82 2eki n LYS 19 N 7.60 0.00 0.00 4.56 2.85 -1.26 -0.14 118.16 131.77 2eki n LYS 19 Ca 0.19 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.45 2eki n LYS 19 Cb 0.45 -1.12 0.00 0.00 -0.65 0.00 0.00 35.03 33.71 2eki n LYS 19 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2eki n GLY 20 N 1.63 1.63 3.98 2.58 0.00 -1.26 -4.94 105.19 108.81 2eki n GLY 20 Ca 0.17 -0.18 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2eki n GLY 20 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2eki s GLN 21 N 0.00 2.26 0.20 1.61 -1.52 0.80 -5.10 119.66 117.91 2eki s GLN 21 Ca 0.00 -0.97 -0.08 0.00 -1.95 0.00 0.00 55.36 52.36 2eki s GLN 21 Cb 0.00 -2.46 -0.07 0.00 -0.22 0.00 0.00 33.01 30.26 2eki s GLN 21 CO 0.00 -0.95 0.50 -0.48 -0.25 0.00 0.00 175.29 174.11 2eki s LEU 22 N -4.86 4.20 -0.16 2.90 0.05 -1.26 -4.39 118.68 115.16 2eki s LEU 22 Ca 0.60 0.82 -0.29 0.00 0.05 0.00 0.00 54.13 55.31 2eki s LEU 22 Cb -0.08 -3.57 -0.03 0.00 -2.05 0.00 0.00 46.19 40.45 2eki s LEU 22 CO 0.40 -0.04 1.57 -2.16 -0.55 0.00 0.00 176.35 175.58 2eki s PRO 23 N -2.77 3.99 0.24 1.48 0.04 -1.26 -4.58 135.00 132.14 2eki s PRO 23 Ca 0.45 1.83 -0.31 0.00 0.04 0.00 0.00 61.00 63.01 2eki s PRO 23 Cb -0.11 -3.98 -0.12 0.00 0.04 0.00 0.00 34.50 30.33 2eki s PRO 23 CO 0.22 -1.06 1.69 -0.40 0.04 0.00 0.00 177.00 177.49 2eki n ASP 24 N 7.73 3.98 -0.18 6.66 5.68 -1.21 -4.89 116.55 134.32 2eki n ASP 24 Ca 0.17 1.09 0.02 0.00 -0.50 0.00 0.00 54.79 55.57 2eki n ASP 24 Cb 0.44 -1.59 0.04 0.00 -1.14 0.00 0.00 41.12 38.88 2eki n ASP 24 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 2eki n TYR 25 N 3.33 0.12 0.00 2.11 4.01 -1.26 -4.52 117.16 120.95 2eki n TYR 25 Ca 0.13 -0.43 0.00 0.00 -0.16 0.00 0.00 57.90 57.44 2eki n TYR 25 Cb 0.36 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.35 2eki n TYR 25 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 2eki n THR 26 N -0.15 0.00 -2.60 -0.72 5.66 -1.26 -4.77 114.28 110.44 2eki n THR 26 Ca 0.03 -0.09 -0.21 0.00 -3.05 0.00 0.00 64.05 60.74 2eki n THR 26 Cb 0.27 0.57 0.00 0.00 -1.55 0.00 0.00 70.33 69.63 2eki n THR 26 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 2eki n SER 27 N -1.34 3.53 -4.11 1.09 7.64 -1.26 -5.09 113.62 114.07 2eki n SER 27 Ca 0.00 -3.38 -0.30 0.00 1.01 0.00 0.00 58.87 56.21 2eki n SER 27 Cb 0.00 -0.50 0.22 0.00 -1.01 0.00 0.00 64.21 62.92 2eki n SER 27 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2eki s PRO 28 N -3.36 -0.71 -0.24 1.43 0.04 -1.26 -4.98 135.00 125.91 2eki s PRO 28 Ca 0.41 0.12 -0.07 0.00 0.04 0.00 0.00 61.00 61.50 2eki s PRO 28 Cb 0.41 -1.64 -0.03 0.00 0.04 0.00 0.00 34.50 33.28 2eki s PRO 28 CO -0.11 -3.41 0.05 0.54 0.04 0.00 0.00 177.00 174.11 2eki s VAL 29 N -2.99 4.17 -0.66 -0.36 0.11 -0.99 -4.92 120.40 114.76 2eki s VAL 29 Ca 0.69 -0.22 -0.22 0.00 -2.93 0.00 0.00 61.98 59.30 2eki s VAL 29 Cb -0.13 -2.94 0.08 0.00 -1.53 0.00 0.00 36.38 31.86 2eki s VAL 29 CO 0.57 0.35 0.92 -0.69 -3.33 0.00 0.00 175.10 172.92 2eki s VAL 30 N 1.58 4.43 0.00 2.04 1.01 -1.26 -1.60 120.40 126.60 2eki s VAL 30 Ca 0.06 -0.52 -0.07 0.00 0.00 0.00 0.00 61.98 61.45 2eki s VAL 30 Cb -0.15 -4.65 -0.05 0.00 0.00 0.00 0.00 36.38 31.53 2eki s VAL 30 CO 0.03 -1.40 0.27 -0.76 0.00 0.00 0.00 175.10 173.24 2eki s LEU 31 N 3.76 4.38 -0.02 3.92 1.43 0.13 -4.91 118.68 127.37 2eki s LEU 31 Ca 0.20 0.59 -0.30 0.00 -1.03 0.00 0.00 54.13 53.59 2eki s LEU 31 Cb -0.18 -2.63 -0.05 0.00 0.03 0.00 0.00 46.19 43.35 2eki s LEU 31 CO 0.09 0.27 1.46 -2.16 0.23 0.00 0.00 176.35 176.24 2eki s PRO 32 N -1.67 4.25 0.16 1.29 0.04 -1.26 -1.33 135.00 136.48 2eki s PRO 32 Ca 0.27 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 63.02 2eki s PRO 32 Cb -0.13 -3.68 -0.05 0.00 0.04 0.00 0.00 34.50 30.68 2eki s PRO 32 CO 0.15 -0.66 1.54 -0.92 0.04 0.00 0.00 177.00 177.16 2eki h TYR 33 N 8.25 -1.78 -0.72 0.56 5.03 -1.16 0.41 116.97 127.56 2eki h TYR 33 Ca -0.37 0.12 0.30 0.00 2.58 0.00 0.00 58.73 61.35 2eki h TYR 33 Cb 1.17 0.89 -0.13 0.00 1.55 0.00 0.00 36.73 40.22 2eki h TYR 33 CO 0.79 -0.40 0.37 -1.13 -1.32 0.00 0.00 178.16 176.47 2eki n SER 34 N -5.30 0.24 -3.95 -2.11 3.41 -1.26 -2.86 113.62 101.79 2eki n SER 34 Ca 0.02 1.20 -0.31 0.00 -0.26 0.00 0.00 58.87 59.52 2eki n SER 34 Cb 0.29 -0.58 -0.15 0.00 -0.26 0.00 0.00 64.21 63.51 2eki n SER 34 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2eki s ARG 35 N -5.13 1.34 -0.21 4.33 1.81 0.14 -5.07 118.95 116.18 2eki s ARG 35 Ca -0.07 -1.76 -0.02 0.00 -1.72 0.00 0.00 55.73 52.16 2eki s ARG 35 Cb 0.24 -2.94 0.06 0.00 -0.45 0.00 0.00 34.95 31.86 2eki s ARG 35 CO 0.56 -0.96 0.03 0.95 -0.68 0.00 0.00 175.30 175.20 2eki s THR 36 N 0.97 0.68 -0.10 0.02 -4.23 -1.13 -4.16 115.64 107.68 2eki s THR 36 Ca 0.11 -0.69 -0.30 0.00 -1.18 0.00 0.00 61.69 59.63 2eki s THR 36 Cb -0.19 -1.17 0.11 0.00 1.34 0.00 0.00 72.50 72.59 2eki s THR 36 CO -0.11 -0.22 0.94 0.42 -0.54 0.00 0.00 174.62 175.11 2eki s THR 37 N 1.78 0.00 0.20 3.99 -4.23 -1.26 -3.58 115.64 112.55 2eki s THR 37 Ca -0.01 0.00 -0.11 0.00 -1.18 0.00 0.00 61.69 60.39 2eki s THR 37 Cb -0.17 -1.00 0.16 0.00 1.34 0.00 0.00 72.50 72.82 2eki s THR 37 CO -0.08 0.00 1.69 0.58 -0.54 0.00 0.00 174.62 176.27 2eki h VAL 38 N 2.44 0.61 0.00 2.29 2.07 -1.41 0.40 116.25 122.64 2eki h VAL 38 Ca -0.20 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 2eki h VAL 38 Cb 1.18 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2eki h VAL 38 CO 0.32 0.04 -0.00 1.05 0.02 0.00 0.00 177.57 178.99 2eki h GLU 39 N 0.20 0.00 0.09 1.57 4.11 -1.75 -1.42 114.58 117.38 2eki h GLU 39 Ca 0.30 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.47 2eki h GLU 39 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2eki h GLU 39 CO -0.42 0.00 -1.14 0.22 0.07 0.00 0.00 179.01 177.74 2eki h ASP 40 N 0.00 0.40 0.02 3.06 1.82 -0.52 -3.32 116.42 117.87 2eki h ASP 40 Ca -0.00 -0.39 -0.00 0.00 -0.39 0.00 0.00 57.03 56.25 2eki h ASP 40 Cb 0.12 -0.13 0.00 0.00 0.68 0.00 0.00 39.33 40.00 2eki h ASP 40 CO 0.00 1.27 -0.01 0.15 -1.61 0.00 0.00 179.24 179.05 2eki h PHE 41 N 0.10 -0.02 -1.42 0.28 3.04 -0.68 -3.24 116.94 115.00 2eki h PHE 41 Ca -0.11 -0.00 0.45 0.00 3.98 0.00 0.00 57.97 62.29 2eki h PHE 41 Cb 1.84 0.01 -0.11 0.00 2.56 0.00 0.00 35.95 40.25 2eki h PHE 41 CO 0.06 0.68 0.94 0.00 -2.02 0.00 0.00 178.31 177.97 2eki h MET 43 N 0.07 0.28 -0.70 0.00 2.86 -1.58 -0.95 114.93 114.92 2eki h MET 43 Ca 0.82 -0.10 0.15 0.00 -2.06 0.00 0.00 59.70 58.51 2eki h MET 43 Cb 2.73 -0.02 -0.13 0.00 0.06 0.00 0.00 31.60 34.25 2eki h MET 43 CO -0.32 0.54 -0.09 0.87 1.06 0.00 0.00 176.91 178.96 2eki h LYS 44 N -0.00 0.04 0.16 1.72 1.79 0.27 -2.26 116.57 118.30 2eki h LYS 44 Ca 0.04 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.50 2eki h LYS 44 Cb 0.42 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.06 2eki h LYS 44 CO 0.01 0.03 -0.08 0.82 -1.08 0.00 0.00 179.45 179.15 2eki h ILE 45 N 0.04 0.93 -3.22 1.86 1.08 -1.48 -3.47 117.51 113.26 2eki h ILE 45 Ca 0.35 -1.04 -0.15 0.00 -0.39 0.00 0.00 64.86 63.64 2eki h ILE 45 Cb 0.58 1.51 -0.23 0.00 -3.07 0.00 0.00 36.82 35.61 2eki h ILE 45 CO -0.67 0.22 -0.41 -2.28 -0.69 0.00 0.00 178.15 174.32 2eki s HIS 46 N -3.82 -0.16 -1.37 1.37 2.46 -0.37 -5.02 115.29 108.39 2eki s HIS 46 Ca -0.14 0.33 0.27 0.00 0.47 0.00 0.00 55.06 56.00 2eki s HIS 46 Cb 0.01 0.05 1.34 0.00 -0.13 0.00 0.00 32.58 33.85 2eki s HIS 46 CO 0.53 -0.24 1.92 0.36 -2.47 0.00 0.00 174.74 174.84 2eki n LYS 47 N 2.09 0.33 -1.04 2.88 2.85 -1.24 -3.19 118.16 120.84 2eki n LYS 47 Ca -0.18 0.03 0.05 0.00 -1.05 0.00 0.00 58.31 57.16 2eki n LYS 47 Cb 0.57 -1.50 0.09 0.00 -0.65 0.00 0.00 35.03 33.54 2eki n LYS 47 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2eki n ASN 48 N -1.32 1.25 0.09 -5.58 3.02 -1.26 -4.82 115.26 106.66 2eki n ASN 48 Ca 0.12 -2.74 -0.22 0.00 -0.03 0.00 0.00 54.58 51.70 2eki n ASN 48 Cb 0.23 -0.38 -0.15 0.00 -0.61 0.00 0.00 39.78 38.86 2eki n ASN 48 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2eki h LEU 49 N 0.89 0.64 -1.71 3.41 5.85 -1.77 -3.25 115.31 119.37 2eki h LEU 49 Ca -0.12 -0.94 0.03 0.00 0.84 0.00 0.00 57.88 57.69 2eki h LEU 49 Cb 1.50 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 2eki h LEU 49 CO 0.05 1.54 0.46 -0.29 -0.34 0.00 0.00 178.44 179.87 2eki h ILE 50 N -0.14 0.06 -0.08 4.05 6.09 -1.83 0.58 117.51 126.25 2eki h ILE 50 Ca -0.20 0.00 -0.11 0.00 -1.37 0.00 0.00 64.86 63.18 2eki h ILE 50 Cb 1.89 0.56 -0.01 0.00 0.47 0.00 0.00 36.82 39.72 2eki h ILE 50 CO 0.21 0.00 -0.47 0.11 -3.07 0.00 0.00 178.15 174.93 2eki h LYS 51 N 0.00 0.18 0.00 2.19 1.79 -1.93 -3.24 116.57 115.56 2eki h LYS 51 Ca 0.05 -0.10 -0.31 0.00 -2.18 0.00 0.00 60.65 58.10 2eki h LYS 51 Cb 0.97 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.57 2eki h LYS 51 CO -0.00 0.62 -2.30 0.39 -1.08 0.00 0.00 179.45 177.09 2eki n GLU 52 N -3.97 0.79 -1.60 3.15 -0.58 0.17 -4.95 120.64 113.66 2eki n GLU 52 Ca -0.02 -0.03 -0.54 0.00 -0.42 0.00 0.00 57.16 56.15 2eki n GLU 52 Cb 0.52 -1.50 -0.07 0.00 -0.57 0.00 0.00 31.44 29.82 2eki n GLU 52 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2eki n PHE 53 N -2.67 1.91 -0.10 -0.32 7.35 0.46 -2.55 117.46 121.54 2eki n PHE 53 Ca -0.29 0.37 -0.22 0.00 -0.76 0.00 0.00 57.45 56.55 2eki n PHE 53 Cb 1.07 -2.51 -0.12 0.00 0.35 0.00 0.00 39.48 38.27 2eki n PHE 53 CO 0.00 0.00 0.00 1.17 -0.76 0.00 0.00 176.76 177.17 2eki n LYS 54 N 6.68 0.65 -3.77 -4.13 4.81 -0.88 -4.92 118.16 116.61 2eki n LYS 54 Ca 0.32 0.25 -0.04 0.00 -0.87 0.00 0.00 58.31 57.97 2eki n LYS 54 Cb 0.18 -1.57 -0.01 0.00 0.02 0.00 0.00 35.03 33.65 2eki n LYS 54 CO 0.00 0.00 0.00 1.52 1.17 0.00 0.00 177.40 180.09 2eki s TYR 55 N -2.51 -0.13 -0.00 5.64 1.13 -1.26 -4.92 117.35 115.29 2eki s TYR 55 Ca -0.33 -0.19 0.01 0.00 -1.41 0.00 0.00 57.07 55.15 2eki s TYR 55 Cb 0.10 0.65 -0.00 0.00 -1.10 0.00 0.00 41.96 41.60 2eki s TYR 55 CO 0.60 -0.86 -0.04 0.00 -2.51 0.00 0.00 175.55 172.74 2eki s ALA 56 N -3.31 0.36 -0.58 9.51 0.00 -0.82 -3.03 121.76 123.89 2eki s ALA 56 Ca 0.12 -0.18 -0.09 0.00 0.00 0.00 0.00 51.96 51.81 2eki s ALA 56 Cb -0.02 -0.10 0.15 0.00 0.00 0.00 0.00 23.12 23.15 2eki s ALA 56 CO 0.03 0.08 0.46 -0.51 0.00 0.00 0.00 175.76 175.82 2eki s LEU 57 N -0.08 5.86 0.30 0.00 1.43 -1.24 -1.45 118.68 123.51 2eki s LEU 57 Ca 0.01 -2.24 -0.28 0.00 -1.03 0.00 0.00 54.13 50.59 2eki s LEU 57 Cb -0.02 -2.04 -0.09 0.00 0.03 0.00 0.00 46.19 44.07 2eki s LEU 57 CO -0.00 -0.62 1.03 -0.69 0.23 0.00 0.00 176.35 176.30 2eki s VAL 58 N 0.87 3.75 -0.30 -1.59 1.01 -1.21 -3.50 120.40 119.44 2eki s VAL 58 Ca 0.10 1.63 0.00 0.00 0.00 0.00 0.00 61.98 63.72 2eki s VAL 58 Cb -0.22 -3.99 0.09 0.00 0.00 0.00 0.00 36.38 32.26 2eki s VAL 58 CO -0.03 0.29 0.07 0.26 0.00 0.00 0.00 175.10 175.69 2eki s TRP 59 N -1.33 2.15 -4.79 5.22 0.51 -0.88 -3.79 118.94 116.03 2eki s TRP 59 Ca 0.47 -1.94 0.00 0.00 -2.12 0.00 0.00 56.10 52.51 2eki s TRP 59 Cb -0.27 -1.91 0.00 0.00 -0.81 0.00 0.00 33.47 30.49 2eki s TRP 59 CO 0.34 -0.87 0.00 0.41 -0.51 0.00 0.00 176.95 176.32 2eki n GLY 60 N 4.72 -1.54 0.37 0.98 0.00 -1.26 -3.77 105.19 104.68 2eki n GLY 60 Ca -0.02 -1.22 0.10 0.00 0.00 0.00 0.00 46.02 44.87 2eki n GLY 60 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2eki h LEU 61 N 0.00 0.68 -0.82 0.99 3.38 -1.97 -2.17 115.31 115.39 2eki h LEU 61 Ca 0.00 0.03 0.34 0.00 0.09 0.00 0.00 57.88 58.34 2eki h LEU 61 Cb 0.00 -0.11 -0.15 0.00 0.09 0.00 0.00 40.66 40.49 2eki h LEU 61 CO 0.00 0.38 0.44 -0.24 0.09 0.00 0.00 178.44 179.11 2eki n SER 62 N -4.53 0.28 -4.39 -0.43 2.88 -1.26 -4.20 113.62 101.98 2eki n SER 62 Ca 0.15 1.34 -0.30 0.00 -1.33 0.00 0.00 58.87 58.74 2eki n SER 62 Cb 0.38 -0.65 -0.14 0.00 -0.75 0.00 0.00 64.21 63.05 2eki n SER 62 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2eki s VAL 63 N -5.23 2.31 -0.07 2.46 -7.23 -0.82 -5.05 120.40 106.77 2eki s VAL 63 Ca -0.07 -1.52 -0.26 0.00 -1.81 0.00 0.00 61.98 58.31 2eki s VAL 63 Cb 0.28 -1.97 -0.22 0.00 0.56 0.00 0.00 36.38 35.03 2eki s VAL 63 CO 0.63 0.23 1.04 0.11 -0.31 0.00 0.00 175.10 176.80 2eki h LYS 64 N 4.32 -0.03 -4.84 4.82 1.79 -1.82 -3.43 116.57 117.39 2eki h LYS 64 Ca -0.49 0.00 -0.68 0.00 -2.18 0.00 0.00 60.65 57.31 2eki h LYS 64 Cb 1.16 0.01 -0.35 0.00 -1.58 0.00 0.00 32.23 31.47 2eki h LYS 64 CO 0.42 0.62 -0.76 -1.01 -1.08 0.00 0.00 179.45 177.65 2eki s HIS 65 N -3.43 3.23 0.20 -1.35 3.76 -1.26 -5.07 115.29 111.37 2eki s HIS 65 Ca -0.16 -2.04 0.09 0.00 -0.15 0.00 0.00 55.06 52.79 2eki s HIS 65 Cb -0.00 -2.02 -0.04 0.00 1.11 0.00 0.00 32.58 31.63 2eki s HIS 65 CO 0.65 -0.83 -0.07 0.54 -0.85 0.00 0.00 174.74 174.18 2eki s ASN 66 N 1.19 4.34 0.53 1.40 2.20 -1.26 -3.81 114.94 119.53 2eki s ASN 66 Ca -0.06 -0.58 -0.20 0.00 -0.94 0.00 0.00 52.86 51.08 2eki s ASN 66 Cb -0.19 -0.76 -0.06 0.00 -2.00 0.00 0.00 41.25 38.23 2eki s ASN 66 CO -0.04 0.08 1.13 -2.16 -2.94 0.00 0.00 177.10 173.18 2eki s PRO 67 N -3.00 3.44 -0.05 3.55 0.04 -1.26 -5.11 135.00 132.61 2eki s PRO 67 Ca 0.26 1.64 0.03 0.00 0.04 0.00 0.00 61.00 62.98 2eki s PRO 67 Cb -0.08 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.38 2eki s PRO 67 CO 0.16 -0.78 -0.14 -1.14 0.04 0.00 0.00 177.00 175.14 2eki s GLN 68 N -3.17 1.63 0.04 4.56 0.74 -1.25 -5.00 119.66 117.22 2eki s GLN 68 Ca 0.71 -0.49 -0.31 0.00 0.05 0.00 0.00 55.36 55.32 2eki s GLN 68 Cb -0.25 -1.40 -0.06 0.00 1.10 0.00 0.00 33.01 32.41 2eki s GLN 68 CO 0.28 0.15 1.25 0.21 -0.55 0.00 0.00 175.29 176.63 2eki s LYS 69 N 0.28 4.38 0.10 1.67 2.20 -1.26 -3.30 119.74 123.80 2eki s LYS 69 Ca -0.08 1.83 0.04 0.00 -0.36 0.00 0.00 55.97 57.40 2eki s LYS 69 Cb -0.13 -3.39 -0.04 0.00 -1.51 0.00 0.00 37.83 32.77 2eki s LYS 69 CO 0.03 -0.35 -0.10 0.14 -0.36 0.00 0.00 175.35 174.70 2eki s VAL 70 N 1.42 0.95 0.00 4.02 -7.23 -0.52 -4.95 120.40 114.08 2eki s VAL 70 Ca 0.60 -1.62 0.00 0.00 -1.81 0.00 0.00 61.98 59.15 2eki s VAL 70 Cb -0.30 -1.34 0.00 0.00 0.56 0.00 0.00 36.38 35.30 2eki s VAL 70 CO 0.28 -0.54 0.00 0.61 -0.31 0.00 0.00 175.10 175.14 2eki n GLY 71 N 0.61 1.67 0.18 2.32 0.00 -1.26 -1.94 105.19 106.76 2eki n GLY 71 Ca -0.16 -1.80 0.11 0.00 0.00 0.00 0.00 46.02 44.17 2eki n GLY 71 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2eki n LYS 72 N 0.00 0.50 0.00 1.61 0.00 -1.26 -3.91 118.16 115.09 2eki n LYS 72 Ca 0.00 -0.37 0.13 0.00 -0.00 0.00 0.00 58.31 58.07 2eki n LYS 72 Cb 0.00 -1.49 0.29 0.00 -0.00 0.00 0.00 35.03 33.83 2eki n LYS 72 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2eki n ASP 73 N -0.93 2.04 -4.77 -5.58 5.75 -1.26 -2.31 116.55 109.49 2eki n ASP 73 Ca 0.07 -1.60 -0.38 0.00 -0.01 0.00 0.00 54.79 52.87 2eki n ASP 73 Cb 0.37 0.07 -0.02 0.00 -1.03 0.00 0.00 41.12 40.51 2eki n ASP 73 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 2eki s HIS 74 N -2.12 3.07 -0.09 2.11 2.46 -1.25 -4.89 115.29 114.58 2eki s HIS 74 Ca 0.30 1.56 -0.17 0.00 0.47 0.00 0.00 55.06 57.22 2eki s HIS 74 Cb 0.20 -3.37 -0.05 0.00 -0.13 0.00 0.00 32.58 29.23 2eki s HIS 74 CO 0.37 -1.27 0.45 0.99 -2.47 0.00 0.00 174.74 172.82 2eki s THR 75 N -1.44 5.14 0.19 0.89 2.01 -1.26 -1.61 115.64 119.56 2eki s THR 75 Ca 0.57 0.91 -0.08 0.00 0.31 0.00 0.00 61.69 63.41 2eki s THR 75 Cb -0.30 -3.79 -0.06 0.00 0.01 0.00 0.00 72.50 68.36 2eki s THR 75 CO 0.37 0.39 0.47 -0.76 -0.69 0.00 0.00 174.62 174.41 2eki s LEU 76 N 0.20 4.22 0.21 4.42 1.43 -1.23 -4.92 118.68 123.00 2eki s LEU 76 Ca 0.25 0.78 0.08 0.00 -1.03 0.00 0.00 54.13 54.21 2eki s LEU 76 Cb -0.15 -3.51 -0.05 0.00 0.03 0.00 0.00 46.19 42.51 2eki s LEU 76 CO 0.11 -0.01 -0.15 -1.83 0.23 0.00 0.00 176.35 174.69 2eki s GLU 77 N -2.72 1.36 0.46 1.70 -1.05 -1.26 -4.77 118.70 112.42 2eki s GLU 77 Ca 0.44 -1.60 -0.25 0.00 -0.15 0.00 0.00 54.97 53.41 2eki s GLU 77 Cb -0.12 -1.20 -0.08 0.00 -0.44 0.00 0.00 34.13 32.30 2eki s GLU 77 CO 0.23 0.20 1.39 0.16 0.95 0.00 0.00 175.26 178.19 2eki s ASP 78 N -3.31 5.82 -1.12 0.83 -4.77 -1.26 -3.24 116.67 109.62 2eki s ASP 78 Ca 0.23 2.84 -0.02 0.00 -3.30 0.00 0.00 52.55 52.30 2eki s ASP 78 Cb -0.01 -2.65 -0.02 0.00 -1.09 0.00 0.00 42.92 39.15 2eki s ASP 78 CO 0.08 -1.20 0.95 -0.62 0.70 0.00 0.00 175.17 175.07 2eki n GLU 79 N -0.32 -5.23 -4.46 2.11 -0.58 -0.51 -4.87 120.64 106.79 2eki n GLU 79 Ca 0.06 0.83 -0.20 0.00 -0.42 0.00 0.00 57.16 57.43 2eki n GLU 79 Cb 0.43 -5.74 -0.15 0.00 -0.57 0.00 0.00 31.44 25.40 2eki n GLU 79 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2eki s ASP 80 N -4.05 1.28 -0.16 1.62 2.15 -1.20 -4.94 116.67 111.37 2eki s ASP 80 Ca 0.12 -0.20 -0.08 0.00 0.43 0.00 0.00 52.55 52.82 2eki s ASP 80 Cb -0.02 -0.19 -0.04 0.00 -0.30 0.00 0.00 42.92 42.37 2eki s ASP 80 CO 0.71 0.12 0.13 -0.69 -0.17 0.00 0.00 175.17 175.27 2eki s VAL 81 N -0.16 5.45 -0.05 1.11 1.01 -1.25 -0.41 120.40 126.10 2eki s VAL 81 Ca 0.03 0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.22 2eki s VAL 81 Cb -0.05 -3.43 0.02 0.00 0.00 0.00 0.00 36.38 32.92 2eki s VAL 81 CO -0.00 0.54 -0.08 -0.51 0.00 0.00 0.00 175.10 175.04 2eki s ILE 82 N -0.39 0.83 -0.49 2.22 2.07 -0.26 -2.08 121.20 123.10 2eki s ILE 82 Ca 0.12 -0.30 -0.13 0.00 -1.41 0.00 0.00 60.65 58.93 2eki s ILE 82 Cb -0.12 -0.79 0.11 0.00 0.13 0.00 0.00 42.46 41.79 2eki s ILE 82 CO 0.01 0.29 0.40 -1.58 -1.91 0.00 0.00 174.94 172.15 2eki s GLN 83 N 0.78 2.76 -0.23 3.50 0.74 -1.23 0.52 119.66 126.49 2eki s GLN 83 Ca -0.13 -1.65 -0.29 0.00 0.05 0.00 0.00 55.36 53.34 2eki s GLN 83 Cb -0.15 -4.08 -0.01 0.00 1.10 0.00 0.00 33.01 29.86 2eki s GLN 83 CO 0.02 -1.19 1.42 0.42 -0.55 0.00 0.00 175.29 175.40 2eki s ILE 84 N 1.50 3.99 -0.00 -2.34 -1.09 -1.25 -3.63 121.20 118.38 2eki s ILE 84 Ca 0.04 1.14 0.00 0.00 -2.23 0.00 0.00 60.65 59.60 2eki s ILE 84 Cb -0.27 -3.94 -0.04 0.00 -1.58 0.00 0.00 42.46 36.64 2eki s ILE 84 CO 0.02 -0.32 0.05 0.68 -1.23 0.00 0.00 174.94 174.14 2eki s VAL 85 N 4.44 4.51 -0.15 2.92 -7.23 -1.17 -4.59 120.40 119.13 2eki s VAL 85 Ca 0.62 -0.48 -0.02 0.00 -1.81 0.00 0.00 61.98 60.29 2eki s VAL 85 Cb -0.21 -3.04 -0.02 0.00 0.56 0.00 0.00 36.38 33.67 2eki s VAL 85 CO 0.24 0.36 -0.08 -0.54 -0.31 0.00 0.00 175.10 174.77 2eki s LYS 86 N -1.66 3.53 0.58 4.82 1.02 -1.26 -2.07 119.74 124.70 2eki s LYS 86 Ca 0.21 -0.60 -0.18 0.00 0.02 0.00 0.00 55.97 55.43 2eki s LYS 86 Cb -0.12 -2.78 -0.14 0.00 -0.52 0.00 0.00 37.83 34.27 2eki s LYS 86 CO 0.12 0.21 -0.07 1.63 -0.92 0.00 0.00 175.35 176.32 2eki n LYS 87 N 3.57 0.08 -4.02 1.68 5.02 -1.06 -4.94 118.16 118.50 2eki n LYS 87 Ca -0.18 0.03 -0.31 0.00 -2.02 0.00 0.00 58.31 55.83 2eki n LYS 87 Cb 0.53 -1.14 -0.15 0.00 -0.02 0.00 0.00 35.03 34.24 2eki n LYS 87 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2eki s SER 88 N -1.05 4.40 0.07 4.39 0.15 -1.26 -5.08 113.70 115.31 2eki s SER 88 Ca 0.57 -1.57 -0.27 0.00 0.70 0.00 0.00 55.95 55.37 2eki s SER 88 Cb -0.45 -1.47 0.09 0.00 -1.71 0.00 0.00 66.02 62.48 2eki s SER 88 CO 0.66 -0.26 1.14 -0.83 1.20 0.00 0.00 173.24 175.15 2eki s GLY 89 N 1.12 -0.28 -0.24 9.45 0.00 -1.26 -5.12 107.32 110.99 2eki s GLY 89 Ca -0.02 0.34 -0.29 0.00 0.00 0.00 0.00 44.72 44.75 2eki s GLY 89 CO -0.07 0.65 1.63 2.56 0.00 0.00 0.00 173.10 177.86 2eki s PRO 90 N -2.69 3.73 -0.23 2.90 0.04 -1.26 -4.99 135.00 132.50 2eki s PRO 90 Ca 0.15 1.59 -0.10 0.00 0.04 0.00 0.00 61.00 62.69 2eki s PRO 90 Cb 0.02 -4.05 -0.05 0.00 0.04 0.00 0.00 34.50 30.45 2eki s PRO 90 CO -0.01 -1.38 0.14 -1.54 0.04 0.00 0.00 177.00 174.26 2eki s SER 91 N 4.44 6.01 -0.17 6.66 1.04 -1.26 -5.07 113.70 125.34 2eki s SER 91 Ca 0.72 0.10 -0.23 0.00 0.48 0.00 0.00 55.95 57.02 2eki s SER 91 Cb -0.24 -2.07 -0.02 0.00 0.10 0.00 0.00 66.02 63.79 2eki s SER 91 CO 0.30 0.09 0.75 -0.44 0.98 0.00 0.00 173.24 174.92 2eki s SER 92 N 0.91 6.86 0.00 7.02 0.01 -1.26 -5.33 113.70 121.91 2eki s SER 92 Ca 0.07 1.05 0.00 0.00 1.31 0.00 0.00 55.95 58.38 2eki s SER 92 Cb -0.13 -2.41 0.00 0.00 0.21 0.00 0.00 66.02 63.69 2eki s SER 92 CO 0.03 -0.34 0.00 0.61 0.41 0.00 0.00 173.24 173.95