#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eki s SER 2 N 0.00 0.09 -0.75 1.61 0.01 -1.26 -5.10 113.70 108.30 2eki s SER 2 Ca 0.00 -0.34 -0.26 0.00 1.31 0.00 0.00 55.95 56.66 2eki s SER 2 Cb 0.00 0.21 0.01 0.00 0.21 0.00 0.00 66.02 66.45 2eki s SER 2 CO 0.00 -0.42 1.55 -0.44 0.41 0.00 0.00 173.24 174.34 2eki s SER 3 N -1.68 5.83 0.00 2.44 0.01 -1.26 -4.64 113.70 114.40 2eki s SER 3 Ca -0.11 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 56.79 2eki s SER 3 Cb -0.05 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.63 2eki s SER 3 CO -0.01 -2.05 0.00 0.61 0.41 0.00 0.00 173.24 172.20 2eki n GLY 4 N 5.83 0.33 3.81 3.44 0.00 -1.26 -5.10 105.19 112.24 2eki n GLY 4 Ca 0.16 -1.17 -0.04 0.00 0.00 0.00 0.00 46.02 44.97 2eki n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2eki s SER 5 N -4.00 -0.09 0.37 1.61 1.04 -1.26 -5.18 113.70 106.18 2eki s SER 5 Ca 0.00 -0.60 0.08 0.00 0.48 0.00 0.00 55.95 55.91 2eki s SER 5 Cb 0.00 0.55 -0.03 0.00 0.10 0.00 0.00 66.02 66.63 2eki s SER 5 CO 0.00 -1.05 0.24 -0.94 0.98 0.00 0.00 173.24 172.47 2eki s SER 6 N -3.12 4.87 0.00 7.02 1.04 -1.26 -5.03 113.70 117.22 2eki s SER 6 Ca 0.16 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 55.84 2eki s SER 6 Cb -0.02 -0.70 0.00 0.00 0.10 0.00 0.00 66.02 65.40 2eki s SER 6 CO 0.05 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 174.43 2eki n GLY 7 N -1.32 -0.16 0.76 7.32 0.00 -1.26 -4.92 105.19 105.60 2eki n GLY 7 Ca -0.01 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.04 2eki n GLY 7 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2eki n TYR 8 N -1.96 0.24 -3.08 1.61 9.36 -1.26 -4.82 117.16 117.24 2eki n TYR 8 Ca 0.00 -0.17 -0.45 0.00 3.32 0.00 0.00 57.90 60.60 2eki n TYR 8 Cb 0.00 -0.01 -0.02 0.00 -0.63 0.00 0.00 39.34 38.69 2eki n TYR 8 CO 0.00 0.00 0.00 -1.17 0.22 0.00 0.00 176.86 175.91 2eki s LEU 9 N -1.24 5.64 0.87 2.98 2.96 -1.26 -4.97 118.68 123.66 2eki s LEU 9 Ca 0.24 -2.59 -0.12 0.00 -0.22 0.00 0.00 54.13 51.44 2eki s LEU 9 Cb 0.15 -2.33 0.11 0.00 0.50 0.00 0.00 46.19 44.62 2eki s LEU 9 CO 0.21 -0.78 1.09 1.17 -1.32 0.00 0.00 176.35 176.72 2eki n LYS 10 N 5.25 -0.17 -4.23 1.98 4.81 -1.26 -4.80 118.16 119.74 2eki n LYS 10 Ca 0.24 0.02 -0.35 0.00 -0.87 0.00 0.00 58.31 57.36 2eki n LYS 10 Cb 0.46 -2.34 -0.08 0.00 0.02 0.00 0.00 35.03 33.09 2eki n LYS 10 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2eki s LEU 11 N -5.55 3.77 -0.29 3.14 2.01 -1.26 -1.99 118.68 118.52 2eki s LEU 11 Ca 0.69 0.19 -0.01 0.00 0.01 0.00 0.00 54.13 55.00 2eki s LEU 11 Cb -0.26 -1.97 0.09 0.00 0.01 0.00 0.00 46.19 44.07 2eki s LEU 11 CO 0.56 0.35 0.07 -0.69 1.01 0.00 0.00 176.35 177.66 2eki s VAL 12 N -0.99 0.91 -0.10 -1.59 1.01 -0.96 -4.83 120.40 113.85 2eki s VAL 12 Ca 0.16 -1.27 -0.24 0.00 0.00 0.00 0.00 61.98 60.62 2eki s VAL 12 Cb -0.12 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 2eki s VAL 12 CO 0.06 -0.55 0.76 -0.13 0.00 0.00 0.00 175.10 175.23 2eki s ARG 13 N 1.62 4.39 -0.24 2.72 3.00 -1.26 -2.35 118.95 126.82 2eki s ARG 13 Ca 0.07 0.95 -0.00 0.00 0.00 0.00 0.00 55.73 56.75 2eki s ARG 13 Cb -0.17 -3.50 0.03 0.00 0.00 0.00 0.00 34.95 31.31 2eki s ARG 13 CO -0.21 -0.09 -0.09 0.42 0.00 0.00 0.00 175.30 175.33 2eki s ILE 14 N 1.31 2.57 -0.70 1.52 -1.09 -1.01 -0.62 121.20 123.18 2eki s ILE 14 Ca 0.38 -1.18 -0.27 0.00 -2.23 0.00 0.00 60.65 57.35 2eki s ILE 14 Cb -0.18 -2.33 0.03 0.00 -1.58 0.00 0.00 42.46 38.41 2eki s ILE 14 CO 0.17 0.18 1.23 -0.31 -1.23 0.00 0.00 174.94 174.97 2eki s TYR 15 N 1.26 2.38 0.40 3.97 2.02 0.16 -2.85 117.35 124.69 2eki s TYR 15 Ca -0.02 -0.03 -0.25 0.00 -0.37 0.00 0.00 57.07 56.40 2eki s TYR 15 Cb -0.17 -4.56 -0.08 0.00 -0.40 0.00 0.00 41.96 36.74 2eki s TYR 15 CO -0.06 -1.94 1.17 -0.08 -1.57 0.00 0.00 175.55 173.06 2eki s THR 16 N 5.40 3.17 -0.16 -0.71 -1.32 -1.26 -1.60 115.64 119.16 2eki s THR 16 Ca 0.35 0.97 -0.00 0.00 -1.21 0.00 0.00 61.69 61.79 2eki s THR 16 Cb -0.09 -3.54 0.04 0.00 -1.51 0.00 0.00 72.50 67.40 2eki s THR 16 CO 0.16 0.08 -0.06 -0.75 -2.21 0.00 0.00 174.62 171.84 2eki s LYS 17 N -2.33 1.49 0.00 7.08 2.20 0.12 -3.44 119.74 124.85 2eki s LYS 17 Ca 0.58 -0.50 0.00 0.00 -0.36 0.00 0.00 55.97 55.69 2eki s LYS 17 Cb -0.30 -1.97 0.00 0.00 -1.51 0.00 0.00 37.83 34.05 2eki s LYS 17 CO 0.38 -0.41 0.00 -0.35 -0.36 0.00 0.00 175.35 174.61 2eki n PRO 18 N 4.87 -0.38 -0.29 4.03 -0.04 -1.26 -3.94 135.00 137.98 2eki n PRO 18 Ca -0.12 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.42 2eki n PRO 18 Cb 0.48 0.00 0.24 0.00 -0.04 0.00 0.00 33.50 34.18 2eki n PRO 18 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2eki n LYS 19 N -1.03 2.85 0.17 0.54 2.85 -1.26 -4.76 118.16 117.51 2eki n LYS 19 Ca 0.00 -2.39 0.00 0.00 -1.05 0.00 0.00 58.31 54.87 2eki n LYS 19 Cb 0.00 -1.45 0.00 0.00 -0.65 0.00 0.00 35.03 32.93 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 1.04 -0.73 3.68 2.58 0.00 -1.26 -5.13 105.19 105.38 2eki n GLY 20 Ca 0.18 0.10 -0.30 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.94 -0.82 0.28 1.61 -0.21 -1.26 -5.05 119.66 112.28 2eki s GLN 21 Ca 0.00 -0.20 -0.07 0.00 0.02 0.00 0.00 55.36 55.10 2eki s GLN 21 Cb 0.00 -1.66 -0.06 0.00 1.00 0.00 0.00 33.01 32.29 2eki s GLN 21 CO 0.00 -3.42 0.58 -0.51 -2.12 0.00 0.00 175.29 169.82 2eki s LEU 22 N -6.68 4.07 -0.07 2.90 1.43 -1.26 -4.39 118.68 114.67 2eki s LEU 22 Ca 0.72 0.85 -0.30 0.00 -1.03 0.00 0.00 54.13 54.37 2eki s LEU 22 Cb -0.07 -3.65 -0.04 0.00 0.03 0.00 0.00 46.19 42.45 2eki s LEU 22 CO 0.55 -0.18 1.50 -2.16 0.23 0.00 0.00 176.35 176.30 2eki s PRO 23 N -3.32 4.21 0.56 1.29 0.04 -1.26 -4.76 135.00 131.76 2eki s PRO 23 Ca 0.46 2.01 -0.21 0.00 0.04 0.00 0.00 61.00 63.30 2eki s PRO 23 Cb -0.11 -3.85 -0.04 0.00 0.04 0.00 0.00 34.50 30.54 2eki s PRO 23 CO 0.27 -0.76 1.34 -0.40 0.04 0.00 0.00 177.00 177.49 2eki n ASP 24 N 6.67 2.58 0.00 6.66 5.75 -1.22 -4.93 116.55 132.05 2eki n ASP 24 Ca 0.16 0.96 0.00 0.00 -0.01 0.00 0.00 54.79 55.89 2eki n ASP 24 Cb 0.43 -1.57 0.00 0.00 -1.03 0.00 0.00 41.12 38.95 2eki n ASP 24 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 2eki n TYR 25 N -1.17 0.00 0.00 2.11 4.01 -1.26 -4.56 117.16 116.29 2eki n TYR 25 Ca 0.11 -0.15 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 2eki n TYR 25 Cb 0.45 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.47 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 -2.52 -0.72 5.66 -1.26 -4.82 114.28 110.47 2eki n THR 26 Ca 0.00 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.75 2eki n THR 26 Cb 0.39 -0.29 0.00 0.00 -1.55 0.00 0.00 70.33 68.88 2eki n THR 26 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2eki n SER 27 N -1.36 4.28 -4.16 1.09 2.88 -1.26 -5.08 113.62 110.01 2eki n SER 27 Ca 0.00 -3.59 -0.29 0.00 -1.33 0.00 0.00 58.87 53.65 2eki n SER 27 Cb 0.21 -0.47 0.22 0.00 -0.75 0.00 0.00 64.21 63.42 2eki n SER 27 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2eki s PRO 28 N -3.48 -0.61 -0.34 -1.46 0.04 -1.26 -5.00 135.00 122.89 2eki s PRO 28 Ca 0.45 0.16 -0.17 0.00 0.04 0.00 0.00 61.00 61.48 2eki s PRO 28 Cb 0.40 -1.65 -0.01 0.00 0.04 0.00 0.00 34.50 33.29 2eki s PRO 28 CO -0.16 -3.35 0.48 0.54 0.04 0.00 0.00 177.00 174.55 2eki s VAL 29 N -2.99 5.05 -0.58 -0.36 0.11 -1.13 -4.91 120.40 115.59 2eki s VAL 29 Ca 0.69 0.36 -0.25 0.00 -2.93 0.00 0.00 61.98 59.84 2eki s VAL 29 Cb -0.13 -3.91 0.04 0.00 -1.53 0.00 0.00 36.38 30.84 2eki s VAL 29 CO 0.57 -0.15 1.04 -0.69 -3.33 0.00 0.00 175.10 172.54 2eki s VAL 30 N 2.31 4.22 -0.02 2.04 1.01 -1.26 -2.41 120.40 126.29 2eki s VAL 30 Ca 0.18 0.44 0.01 0.00 0.00 0.00 0.00 61.98 62.60 2eki s VAL 30 Cb -0.16 -4.63 -0.03 0.00 0.00 0.00 0.00 36.38 31.56 2eki s VAL 30 CO 0.12 -1.26 -0.01 -0.76 0.00 0.00 0.00 175.10 173.19 2eki s LEU 31 N 4.39 3.47 0.05 3.92 1.43 -0.99 -4.97 118.68 125.98 2eki s LEU 31 Ca 0.34 0.00 -0.31 0.00 -1.03 0.00 0.00 54.13 53.13 2eki s LEU 31 Cb -0.11 -1.94 -0.07 0.00 0.03 0.00 0.00 46.19 44.10 2eki s LEU 31 CO 0.20 0.30 1.40 -2.16 0.23 0.00 0.00 176.35 176.33 2eki s PRO 32 N -1.39 4.30 0.14 1.29 0.04 -1.26 -2.27 135.00 135.85 2eki s PRO 32 Ca 0.18 2.03 -0.31 0.00 0.04 0.00 0.00 61.00 62.93 2eki s PRO 32 Cb -0.11 -3.43 -0.07 0.00 0.04 0.00 0.00 34.50 30.92 2eki s PRO 32 CO 0.08 -0.51 1.55 -0.92 0.04 0.00 0.00 177.00 177.24 2eki h TYR 33 N 7.40 -1.68 -1.53 0.56 5.03 -1.71 0.42 116.97 125.46 2eki h TYR 33 Ca -0.40 0.09 0.48 0.00 2.58 0.00 0.00 58.73 61.48 2eki h TYR 33 Cb 1.19 0.81 -0.10 0.00 1.55 0.00 0.00 36.73 40.19 2eki h TYR 33 CO 0.71 -0.45 1.05 0.45 -1.32 0.00 0.00 178.16 178.60 2eki n SER 34 N -5.35 0.10 -3.81 -2.11 2.88 -1.26 -2.89 113.62 101.17 2eki n SER 34 Ca -0.01 1.08 -0.30 0.00 -1.33 0.00 0.00 58.87 58.31 2eki n SER 34 Cb 0.32 -0.54 -0.14 0.00 -0.75 0.00 0.00 64.21 63.10 2eki n SER 34 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2eki s ARG 35 N -4.89 1.10 -0.16 -1.46 1.81 0.15 -5.07 118.95 110.43 2eki s ARG 35 Ca -0.06 -1.57 -0.04 0.00 -1.72 0.00 0.00 55.73 52.34 2eki s ARG 35 Cb 0.26 -2.43 0.06 0.00 -0.45 0.00 0.00 34.95 32.39 2eki s ARG 35 CO 0.78 -1.02 0.08 0.95 -0.68 0.00 0.00 175.30 175.41 2eki s THR 36 N 1.05 -0.05 -0.19 0.02 -4.23 -1.14 -4.04 115.64 107.05 2eki s THR 36 Ca 0.12 -0.11 -0.28 0.00 -1.18 0.00 0.00 61.69 60.24 2eki s THR 36 Cb -0.20 -0.55 0.11 0.00 1.34 0.00 0.00 72.50 73.20 2eki s THR 36 CO -0.14 -0.22 0.91 0.42 -0.54 0.00 0.00 174.62 175.06 2eki s THR 37 N 2.12 0.00 0.35 3.99 -4.23 -1.26 -3.43 115.64 113.19 2eki s THR 37 Ca 0.02 0.00 0.15 0.00 -1.18 0.00 0.00 61.69 60.69 2eki s THR 37 Cb -0.16 -1.00 0.35 0.00 1.34 0.00 0.00 72.50 73.03 2eki s THR 37 CO -0.08 0.00 1.61 0.58 -0.54 0.00 0.00 174.62 176.18 2eki h VAL 38 N 3.16 0.11 -0.51 2.29 2.07 -1.60 1.09 116.25 122.85 2eki h VAL 38 Ca -0.24 -0.04 -0.11 0.00 0.82 0.00 0.00 66.70 67.12 2eki h VAL 38 Cb 1.16 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 2eki h VAL 38 CO 0.23 0.02 -0.13 1.05 0.02 0.00 0.00 177.57 178.75 2eki h GLU 39 N 0.11 0.97 -0.26 1.57 4.11 -1.86 -2.31 114.58 116.92 2eki h GLU 39 Ca 0.77 -0.37 -0.04 0.00 0.07 0.00 0.00 59.36 59.79 2eki h GLU 39 Cb 1.88 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 31.06 2eki h GLU 39 CO -0.74 1.04 -0.02 -0.44 0.07 0.00 0.00 179.01 178.93 2eki h ASP 40 N 0.86 0.36 -0.11 3.06 5.19 0.84 -2.80 116.42 123.82 2eki h ASP 40 Ca 0.13 -0.06 -0.10 0.00 -0.62 0.00 0.00 57.03 56.39 2eki h ASP 40 Cb 0.69 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 40.11 2eki h ASP 40 CO 0.05 0.43 -0.30 0.15 -3.12 0.00 0.00 179.24 176.45 2eki h PHE 41 N 0.37 0.52 -0.85 4.55 3.04 -0.98 -3.17 116.94 120.42 2eki h PHE 41 Ca 0.08 -0.20 0.15 0.00 3.98 0.00 0.00 57.97 61.98 2eki h PHE 41 Cb 0.28 -0.09 -0.06 0.00 2.56 0.00 0.00 35.95 38.63 2eki h PHE 41 CO 0.01 0.92 0.56 0.00 -2.02 0.00 0.00 178.31 177.77 2eki h MET 43 N 0.57 0.81 -0.90 0.00 2.86 -1.47 0.22 114.93 117.02 2eki h MET 43 Ca 0.43 -0.11 0.08 0.00 -2.06 0.00 0.00 59.70 58.04 2eki h MET 43 Cb 0.82 -0.15 -0.07 0.00 0.06 0.00 0.00 31.60 32.26 2eki h MET 43 CO -0.18 0.64 0.56 0.87 1.06 0.00 0.00 176.91 179.86 2eki h LYS 44 N 0.77 0.95 0.00 1.72 1.79 -1.14 -3.29 116.57 117.37 2eki h LYS 44 Ca 0.20 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 2eki h LYS 44 Cb 0.09 -0.21 0.00 0.00 -1.58 0.00 0.00 32.23 30.52 2eki h LYS 44 CO -0.03 0.63 0.00 -0.89 -1.08 0.00 0.00 179.45 178.08 2eki n ILE 45 N -4.62 0.00 -4.00 1.86 2.08 -1.01 -4.93 119.36 108.73 2eki n ILE 45 Ca 0.14 0.57 -0.20 0.00 0.56 0.00 0.00 62.75 63.82 2eki n ILE 45 Cb 0.23 -1.41 -0.17 0.00 -0.75 0.00 0.00 39.64 37.54 2eki n ILE 45 CO 0.00 0.00 0.00 -2.28 0.56 0.00 0.00 176.55 174.83 2eki s HIS 46 N -1.10 0.59 -1.20 1.39 2.46 0.03 -5.00 115.29 112.46 2eki s HIS 46 Ca 0.00 -0.13 0.06 0.00 0.47 0.00 0.00 55.06 55.46 2eki s HIS 46 Cb 0.00 -0.61 0.29 0.00 -0.13 0.00 0.00 32.58 32.13 2eki s HIS 46 CO 0.00 -0.20 1.13 0.36 -2.47 0.00 0.00 174.74 173.56 2eki n LYS 47 N 4.31 0.04 -1.34 2.88 2.85 -1.25 -1.63 118.16 124.02 2eki n LYS 47 Ca -0.21 0.32 -0.07 0.00 -1.05 0.00 0.00 58.31 57.29 2eki n LYS 47 Cb 0.50 -1.50 0.11 0.00 -0.65 0.00 0.00 35.03 33.50 2eki n LYS 47 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 2eki n ASN 48 N -1.40 3.00 -0.10 -5.58 4.05 -1.26 -4.68 115.26 109.28 2eki n ASN 48 Ca 0.02 -3.65 -0.12 0.00 0.45 0.00 0.00 54.58 51.28 2eki n ASN 48 Cb 0.06 -0.44 -0.13 0.00 1.23 0.00 0.00 39.78 40.50 2eki n ASN 48 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 2eki n LEU 49 N -0.84 1.15 0.29 1.20 7.94 -0.65 -4.34 117.00 121.76 2eki n LEU 49 Ca 0.28 -0.05 0.15 0.00 -1.11 0.00 0.00 56.01 55.28 2eki n LEU 49 Cb 0.84 -0.04 0.89 0.00 0.53 0.00 0.00 43.42 45.64 2eki n LEU 49 CO 0.15 0.64 1.12 -0.29 -1.11 0.00 0.00 177.39 177.90 2eki h ILE 50 N 0.00 0.56 -0.33 1.96 6.09 -1.83 0.39 117.51 124.34 2eki h ILE 50 Ca -0.52 0.00 -0.15 0.00 -1.37 0.00 0.00 64.86 62.82 2eki h ILE 50 Cb 2.03 0.99 -0.01 0.00 0.47 0.00 0.00 36.82 40.31 2eki h ILE 50 CO -0.02 0.00 -0.38 0.11 -3.07 0.00 0.00 178.15 174.79 2eki h LYS 51 N 0.00 0.79 0.00 2.19 1.57 -1.91 -3.17 116.57 116.04 2eki h LYS 51 Ca 0.00 -0.40 -0.11 0.00 -1.87 0.00 0.00 60.65 58.27 2eki h LYS 51 Cb 0.02 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 2eki h LYS 51 CO -0.00 1.03 -1.30 0.39 -0.57 0.00 0.00 179.45 179.00 2eki n GLU 52 N -4.05 0.62 -1.69 3.15 -0.58 -0.56 -4.92 120.64 112.61 2eki n GLU 52 Ca -0.02 0.17 -0.58 0.00 -0.42 0.00 0.00 57.16 56.32 2eki n GLU 52 Cb 0.53 -1.80 -0.07 0.00 -0.57 0.00 0.00 31.44 29.52 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 -2.79 1.88 -0.09 -0.32 7.35 0.13 -1.69 117.46 121.92 2eki n PHE 53 Ca -0.07 0.65 -0.12 0.00 -0.76 0.00 0.00 57.45 57.15 2eki n PHE 53 Cb 0.74 -2.40 -0.09 0.00 0.35 0.00 0.00 39.48 38.08 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 4.60 0.63 -3.75 -4.13 4.81 0.22 -4.80 118.16 115.75 2eki n LYS 54 Ca 0.25 0.09 -0.02 0.00 -0.87 0.00 0.00 58.31 57.77 2eki n LYS 54 Cb 0.11 -1.38 -0.00 0.00 0.02 0.00 0.00 35.03 33.78 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 -2.37 -0.06 -0.01 5.64 1.13 -1.25 -4.92 117.35 115.50 2eki s TYR 55 Ca -0.23 -0.20 0.01 0.00 -1.41 0.00 0.00 57.07 55.25 2eki s TYR 55 Cb 0.06 0.62 0.01 0.00 -1.10 0.00 0.00 41.96 41.55 2eki s TYR 55 CO 0.46 -0.67 -0.03 0.00 -2.51 0.00 0.00 175.55 172.81 2eki s ALA 56 N -2.80 0.31 -0.36 9.51 0.00 -0.17 -2.82 121.76 125.43 2eki s ALA 56 Ca 0.15 -0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.94 2eki s ALA 56 Cb 0.00 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 22.99 2eki s ALA 56 CO 0.01 0.03 0.21 -0.51 0.00 0.00 0.00 175.76 175.50 2eki s LEU 57 N 0.25 4.62 -0.07 0.00 1.43 -1.24 -1.28 118.68 122.39 2eki s LEU 57 Ca -0.02 -0.82 -0.14 0.00 -1.03 0.00 0.00 54.13 52.12 2eki s LEU 57 Cb -0.05 -2.05 -0.05 0.00 0.03 0.00 0.00 46.19 44.07 2eki s LEU 57 CO -0.01 -0.34 0.35 -0.69 0.23 0.00 0.00 176.35 175.90 2eki s VAL 58 N 1.60 5.18 -0.18 -1.59 1.01 -1.21 -2.84 120.40 122.37 2eki s VAL 58 Ca 0.03 0.69 0.13 0.00 0.00 0.00 0.00 61.98 62.84 2eki s VAL 58 Cb -0.18 -3.66 0.43 0.00 0.00 0.00 0.00 36.38 32.97 2eki s VAL 58 CO 0.07 0.52 1.21 0.79 0.00 0.00 0.00 175.10 177.69 2eki n TRP 59 N 2.42 0.29 -4.08 5.22 8.01 -1.01 -3.76 117.44 124.53 2eki n TRP 59 Ca -0.14 -1.42 -0.28 0.00 -1.31 0.00 0.00 57.50 54.36 2eki n TRP 59 Cb 0.53 -0.24 -0.01 0.00 -2.01 0.00 0.00 31.31 29.57 2eki n TRP 59 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2eki n GLY 60 N -0.80 2.92 0.23 6.99 0.00 -1.26 -4.68 105.19 108.60 2eki n GLY 60 Ca 0.19 -2.32 0.08 0.00 0.00 0.00 0.00 46.02 43.97 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 0.00 -1.82 0.99 4.07 -1.92 -2.69 115.31 113.94 2eki h LEU 61 Ca -0.36 0.00 0.37 0.00 0.08 0.00 0.00 57.88 57.97 2eki h LEU 61 Cb 1.27 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.94 2eki h LEU 61 CO 0.58 0.18 0.90 0.77 -1.08 0.00 0.00 178.44 179.79 2eki h SER 62 N 0.00 0.11 -3.30 -0.43 4.64 -1.95 -3.36 113.55 109.26 2eki h SER 62 Ca -0.00 0.03 -0.63 0.00 -0.47 0.00 0.00 61.79 60.72 2eki h SER 62 Cb 0.36 0.02 -0.20 0.00 -0.31 0.00 0.00 62.40 62.27 2eki h SER 62 CO 0.02 -0.00 -0.64 0.68 -0.87 0.00 0.00 176.83 176.01 2eki s VAL 63 N -5.07 4.08 0.12 0.95 -7.23 -1.02 -5.02 120.40 107.22 2eki s VAL 63 Ca -0.06 -0.29 -0.25 0.00 -1.81 0.00 0.00 61.98 59.57 2eki s VAL 63 Cb 0.25 -2.80 -0.04 0.00 0.56 0.00 0.00 36.38 34.34 2eki s VAL 63 CO 0.82 0.49 1.64 0.11 -0.31 0.00 0.00 175.10 177.85 2eki h LYS 64 N 6.65 -0.36 -6.04 4.82 1.57 -1.85 -3.43 116.57 117.92 2eki h LYS 64 Ca -0.33 0.02 -0.56 0.00 -1.87 0.00 0.00 60.65 57.92 2eki h LYS 64 Cb 1.19 0.08 -0.24 0.00 0.08 0.00 0.00 32.23 33.34 2eki h LYS 64 CO 0.64 -0.24 -0.83 -1.01 -0.57 0.00 0.00 179.45 177.45 2eki s HIS 65 N -6.07 1.74 0.06 -1.35 3.76 -1.26 -5.07 115.29 107.10 2eki s HIS 65 Ca -0.15 -0.39 -0.04 0.00 -0.15 0.00 0.00 55.06 54.33 2eki s HIS 65 Cb 0.09 -1.00 -0.03 0.00 1.11 0.00 0.00 32.58 32.76 2eki s HIS 65 CO 0.66 0.14 0.05 0.54 -0.85 0.00 0.00 174.74 175.28 2eki s ASN 66 N -1.52 0.35 0.30 1.40 2.20 -1.26 -3.86 114.94 112.54 2eki s ASN 66 Ca 0.06 -0.86 -0.29 0.00 -0.94 0.00 0.00 52.86 50.83 2eki s ASN 66 Cb -0.09 0.25 -0.10 0.00 -2.00 0.00 0.00 41.25 39.31 2eki s ASN 66 CO 0.03 -0.64 1.23 -2.16 -2.94 0.00 0.00 177.10 172.62 2eki s PRO 67 N -3.86 4.46 -0.04 3.55 0.04 -1.26 -5.12 135.00 132.77 2eki s PRO 67 Ca 0.06 2.06 0.06 0.00 0.04 0.00 0.00 61.00 63.21 2eki s PRO 67 Cb 0.07 -3.12 -0.02 0.00 0.04 0.00 0.00 34.50 31.46 2eki s PRO 67 CO -0.10 -0.05 -0.20 -1.14 0.04 0.00 0.00 177.00 175.55 2eki s GLN 68 N -1.52 2.34 -0.30 4.56 0.74 -1.25 -5.00 119.66 119.22 2eki s GLN 68 Ca 0.48 -0.80 -0.26 0.00 0.05 0.00 0.00 55.36 54.83 2eki s GLN 68 Cb -0.37 -2.23 0.01 0.00 1.10 0.00 0.00 33.01 31.52 2eki s GLN 68 CO 0.47 0.59 0.92 0.21 -0.55 0.00 0.00 175.29 176.93 2eki s LYS 69 N -0.66 4.03 0.22 1.67 2.47 -1.26 -3.34 119.74 122.86 2eki s LYS 69 Ca 0.10 0.84 0.11 0.00 -1.56 0.00 0.00 55.97 55.46 2eki s LYS 69 Cb -0.10 -3.72 -0.05 0.00 -1.46 0.00 0.00 37.83 32.50 2eki s LYS 69 CO -0.00 -0.75 -0.21 0.14 0.16 0.00 0.00 175.35 174.69 2eki s VAL 70 N 3.23 2.23 0.00 4.02 -7.23 -0.40 -4.96 120.40 117.29 2eki s VAL 70 Ca 0.38 -2.14 0.00 0.00 -1.81 0.00 0.00 61.98 58.41 2eki s VAL 70 Cb -0.13 -2.11 0.00 0.00 0.56 0.00 0.00 36.38 34.69 2eki s VAL 70 CO 0.13 -0.29 0.00 0.61 -0.31 0.00 0.00 175.10 175.24 2eki n GLY 71 N -0.06 1.35 0.09 2.32 0.00 -1.26 -1.00 105.19 106.64 2eki n GLY 71 Ca -0.10 -1.96 0.14 0.00 0.00 0.00 0.00 46.02 44.10 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 -0.02 0.47 -0.01 1.61 2.85 -1.26 -3.34 118.16 118.46 2eki n LYS 72 Ca 0.00 -0.19 0.12 0.00 -1.05 0.00 0.00 58.31 57.19 2eki n LYS 72 Cb 0.00 -1.50 0.22 0.00 -0.65 0.00 0.00 35.03 33.10 2eki n LYS 72 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2eki n ASP 73 N -1.10 2.62 -4.71 -5.58 8.00 -1.26 -3.45 116.55 111.07 2eki n ASP 73 Ca 0.11 -1.87 -0.42 0.00 0.71 0.00 0.00 54.79 53.32 2eki n ASP 73 Cb 0.31 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.37 2eki n ASP 73 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2eki s HIS 74 N -1.98 3.56 0.36 1.24 5.65 -1.21 -4.94 115.29 117.97 2eki s HIS 74 Ca 0.31 1.55 -0.26 0.00 0.25 0.00 0.00 55.06 56.90 2eki s HIS 74 Cb 0.20 -3.23 -0.09 0.00 -1.18 0.00 0.00 32.58 28.28 2eki s HIS 74 CO 0.31 -0.49 1.11 0.99 -0.65 0.00 0.00 174.74 176.01 2eki s THR 75 N 1.12 3.45 -0.01 0.89 2.01 -1.26 -2.17 115.64 119.68 2eki s THR 75 Ca 0.54 1.26 -0.14 0.00 0.31 0.00 0.00 61.69 63.66 2eki s THR 75 Cb -0.24 -3.72 -0.06 0.00 0.01 0.00 0.00 72.50 68.49 2eki s THR 75 CO 0.28 0.15 0.39 -0.76 -0.69 0.00 0.00 174.62 173.98 2eki s LEU 76 N -2.19 4.47 0.26 4.42 1.43 -1.22 -4.86 118.68 120.98 2eki s LEU 76 Ca 0.53 0.93 0.08 0.00 -1.03 0.00 0.00 54.13 54.64 2eki s LEU 76 Cb -0.28 -2.55 -0.04 0.00 0.03 0.00 0.00 46.19 43.35 2eki s LEU 76 CO 0.36 0.33 0.10 -0.70 0.23 0.00 0.00 176.35 176.66 2eki s GLU 77 N -1.05 2.62 0.46 1.70 2.56 -1.26 -4.80 118.70 118.93 2eki s GLU 77 Ca 0.23 -1.23 -0.23 0.00 0.00 0.00 0.00 54.97 53.74 2eki s GLU 77 Cb -0.16 -2.37 -0.07 0.00 2.00 0.00 0.00 34.13 33.53 2eki s GLU 77 CO 0.13 0.38 1.21 0.34 -0.56 0.00 0.00 175.26 176.76 2eki s ASP 78 N -3.75 6.07 -1.24 -1.70 -1.08 -1.26 -3.49 116.67 110.22 2eki s ASP 78 Ca 0.32 2.42 -0.05 0.00 -0.52 0.00 0.00 52.55 54.72 2eki s ASP 78 Cb -0.07 -2.61 -0.01 0.00 -1.46 0.00 0.00 42.92 38.76 2eki s ASP 78 CO 0.22 -1.00 0.74 -0.62 0.52 0.00 0.00 175.17 175.04 2eki n GLU 79 N -0.46 -3.74 -4.53 4.34 1.02 0.21 -4.88 120.64 112.59 2eki n GLU 79 Ca 0.07 0.61 -0.21 0.00 -0.02 0.00 0.00 57.16 57.62 2eki n GLU 79 Cb 0.47 -5.03 -0.15 0.00 -0.02 0.00 0.00 31.44 26.71 2eki n GLU 79 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2eki s ASP 80 N -4.05 1.47 -0.17 1.62 2.15 -1.17 -4.80 116.67 111.72 2eki s ASP 80 Ca 0.16 -0.25 -0.13 0.00 0.43 0.00 0.00 52.55 52.76 2eki s ASP 80 Cb -0.04 -0.16 -0.05 0.00 -0.30 0.00 0.00 42.92 42.37 2eki s ASP 80 CO 0.81 0.14 0.27 -0.69 -0.17 0.00 0.00 175.17 175.54 2eki s VAL 81 N -0.35 5.32 -0.03 1.11 1.01 -1.26 -0.67 120.40 125.53 2eki s VAL 81 Ca 0.04 0.51 0.06 0.00 0.00 0.00 0.00 61.98 62.58 2eki s VAL 81 Cb -0.05 -3.61 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 2eki s VAL 81 CO -0.00 0.39 -0.20 -0.51 0.00 0.00 0.00 175.10 174.78 2eki s ILE 82 N 0.47 1.62 -0.51 2.22 2.07 -0.63 -2.42 121.20 124.03 2eki s ILE 82 Ca 0.15 -0.85 -0.04 0.00 -1.41 0.00 0.00 60.65 58.51 2eki s ILE 82 Cb -0.13 -1.36 0.13 0.00 0.13 0.00 0.00 42.46 41.23 2eki s ILE 82 CO 0.03 0.46 0.32 -1.58 -1.91 0.00 0.00 174.94 172.26 2eki s GLN 83 N -0.24 2.29 -0.26 3.50 -0.44 -1.13 -0.71 119.66 122.68 2eki s GLN 83 Ca 0.02 -2.11 -0.29 0.00 -2.50 0.00 0.00 55.36 50.48 2eki s GLN 83 Cb -0.10 -3.69 -0.02 0.00 -1.64 0.00 0.00 33.01 27.56 2eki s GLN 83 CO 0.01 -1.13 1.68 0.42 0.50 0.00 0.00 175.29 176.77 2eki s ILE 84 N 0.66 3.62 -0.09 -2.34 -1.09 -1.25 -3.60 121.20 117.11 2eki s ILE 84 Ca 0.12 0.67 -0.01 0.00 -2.23 0.00 0.00 60.65 59.20 2eki s ILE 84 Cb -0.22 -3.69 -0.03 0.00 -1.58 0.00 0.00 42.46 36.94 2eki s ILE 84 CO -0.04 -0.35 -0.02 -0.69 -1.23 0.00 0.00 174.94 172.62 2eki s VAL 85 N 5.75 4.12 -0.23 2.92 1.01 -1.13 -4.89 120.40 127.96 2eki s VAL 85 Ca 0.74 -0.32 -0.07 0.00 0.00 0.00 0.00 61.98 62.34 2eki s VAL 85 Cb -0.24 -2.73 -0.03 0.00 0.00 0.00 0.00 36.38 33.39 2eki s VAL 85 CO 0.31 0.60 0.05 -0.54 0.00 0.00 0.00 175.10 175.51 2eki s LYS 86 N -0.78 3.67 0.11 2.72 1.02 -1.26 -0.61 119.74 124.61 2eki s LYS 86 Ca 0.12 -0.48 -0.35 0.00 0.02 0.00 0.00 55.97 55.28 2eki s LYS 86 Cb -0.11 -3.24 -0.15 0.00 -0.52 0.00 0.00 37.83 33.81 2eki s LYS 86 CO 0.02 -0.09 1.53 0.36 -0.92 0.00 0.00 175.35 176.26 2eki n LYS 87 N 4.59 1.82 -3.66 1.68 2.85 -0.68 -4.90 118.16 119.85 2eki n LYS 87 Ca -0.16 0.66 -0.18 0.00 -1.05 0.00 0.00 58.31 57.57 2eki n LYS 87 Cb 0.52 -2.39 -0.17 0.00 -0.65 0.00 0.00 35.03 32.34 2eki n LYS 87 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 2eki s SER 88 N 1.08 0.96 -0.53 -5.58 0.01 -1.26 -5.04 113.70 103.34 2eki s SER 88 Ca 0.82 0.20 0.04 0.00 1.31 0.00 0.00 55.95 58.32 2eki s SER 88 Cb -0.78 0.09 0.16 0.00 0.21 0.00 0.00 66.02 65.71 2eki s SER 88 CO 0.42 -0.25 0.37 -0.83 0.41 0.00 0.00 173.24 173.37 2eki s GLY 89 N 2.24 1.97 0.23 3.44 0.00 -1.26 -4.93 107.32 109.00 2eki s GLY 89 Ca 0.04 -3.01 0.22 0.00 0.00 0.00 0.00 44.72 41.98 2eki s GLY 89 CO -0.05 1.59 1.68 -1.55 0.00 0.00 0.00 173.10 174.77 2eki n PRO 90 N 2.69 0.17 0.22 2.90 -0.04 -1.26 -2.69 135.00 136.99 2eki n PRO 90 Ca 0.21 0.41 0.05 0.00 -0.04 0.00 0.00 63.50 64.13 2eki n PRO 90 Cb 0.40 -1.83 0.48 0.00 -0.04 0.00 0.00 33.50 32.51 2eki n PRO 90 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2eki h SER 91 N 0.00 0.00 -3.29 3.54 4.64 -2.07 -3.40 113.55 112.97 2eki h SER 91 Ca 0.00 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.66 2eki h SER 91 Cb 0.34 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 62.14 2eki h SER 91 CO 0.00 0.24 -0.78 -0.94 -0.87 0.00 0.00 176.83 174.49 2eki s SER 92 N -6.83 3.86 0.00 4.97 1.04 -1.09 -5.34 113.70 110.30 2eki s SER 92 Ca -0.03 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 55.97 2eki s SER 92 Cb 0.15 -1.61 0.00 0.00 0.10 0.00 0.00 66.02 64.66 2eki s SER 92 CO 0.69 0.07 0.00 0.61 0.98 0.00 0.00 173.24 175.59