#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2onf s HIS 2 N 0.00 1.50 -0.18 1.61 5.04 -1.26 -5.26 115.29 116.74 2onf s HIS 2 Ca 0.00 -0.47 -0.03 0.00 -1.54 0.00 0.00 55.06 53.02 2onf s HIS 2 Cb 0.00 -1.05 -0.02 0.00 0.04 0.00 0.00 32.58 31.56 2onf s HIS 2 CO 0.00 -0.20 -0.05 0.08 -2.34 0.00 0.00 174.74 172.23 2onf s VAL 3 N 0.29 3.50 -0.11 0.89 1.01 -1.26 -5.10 120.40 119.62 2onf s VAL 3 Ca -0.08 -0.47 0.02 0.00 0.00 0.00 0.00 61.98 61.45 2onf s VAL 3 Cb -0.13 -2.55 -0.01 0.00 0.00 0.00 0.00 36.38 33.69 2onf s VAL 3 CO 0.03 0.46 -0.19 -0.31 0.00 0.00 0.00 175.10 175.08 2onf s TYR 4 N 0.92 2.67 0.13 5.22 1.51 -1.26 -5.13 117.35 121.42 2onf s TYR 4 Ca -0.01 -0.88 0.11 0.00 -1.01 0.00 0.00 57.07 55.28 2onf s TYR 4 Cb -0.15 -1.77 -0.04 0.00 -0.11 0.00 0.00 41.96 39.89 2onf s TYR 4 CO 0.01 -0.33 -0.26 -1.21 -1.11 0.00 0.00 175.55 172.65 2onf s GLU 5 N 0.36 1.36 0.31 -0.62 2.02 -1.26 -5.13 118.70 115.73 2onf s GLU 5 Ca -0.15 -1.32 -0.18 0.00 0.02 0.00 0.00 54.97 53.33 2onf s GLU 5 Cb -0.17 -1.81 0.03 0.00 0.10 0.00 0.00 34.13 32.28 2onf s GLU 5 CO 0.07 0.42 0.71 -1.54 0.02 0.00 0.00 175.26 174.95 2onf s SER 6 N -2.06 -0.12 0.03 -0.19 1.04 -1.26 -4.78 113.70 106.36 2onf s SER 6 Ca 0.13 -0.83 0.02 0.00 0.48 0.00 0.00 55.95 55.74 2onf s SER 6 Cb -0.10 0.75 -0.02 0.00 0.10 0.00 0.00 66.02 66.75 2onf s SER 6 CO 0.06 -1.43 -0.06 -1.81 0.98 0.00 0.00 173.24 170.98 2onf s ASP 7 N -2.99 0.67 -0.07 7.02 1.01 -0.49 -5.02 116.67 116.80 2onf s ASP 7 Ca 0.14 -0.45 -0.03 0.00 0.71 0.00 0.00 52.55 52.92 2onf s ASP 7 Cb -0.05 0.03 0.04 0.00 1.01 0.00 0.00 42.92 43.95 2onf s ASP 7 CO 0.09 -0.17 0.13 -0.69 0.21 0.00 0.00 175.17 174.73 2onf s VAL 8 N -1.15 -0.19 0.27 -1.27 1.01 -1.26 -0.33 120.40 117.48 2onf s VAL 8 Ca -0.09 0.36 0.08 0.00 0.00 0.00 0.00 61.98 62.33 2onf s VAL 8 Cb -0.08 -0.24 -0.05 0.00 0.00 0.00 0.00 36.38 36.00 2onf s VAL 8 CO 0.00 0.15 -0.11 -0.94 0.00 0.00 0.00 175.10 174.20 2onf s SER 9 N 2.11 3.02 -0.15 3.32 1.04 -0.39 -4.96 113.70 117.69 2onf s SER 9 Ca 0.02 -1.12 -0.23 0.00 0.48 0.00 0.00 55.95 55.10 2onf s SER 9 Cb -0.12 -0.21 -0.02 0.00 0.10 0.00 0.00 66.02 65.76 2onf s SER 9 CO -0.05 -0.21 0.71 0.86 0.98 0.00 0.00 173.24 175.54 2onf s TRP 10 N -2.85 3.44 -0.04 5.02 -0.00 -1.26 -0.42 118.94 122.83 2onf s TRP 10 Ca 0.28 1.12 -0.00 0.00 -0.00 0.00 0.00 56.10 57.50 2onf s TRP 10 Cb 0.01 -2.87 -0.00 0.00 -0.00 0.00 0.00 33.47 30.61 2onf s TRP 10 CO 0.12 -0.12 0.02 0.82 -0.00 0.00 0.00 176.95 177.78 2onf h ILE 11 N 5.07 0.00 -1.59 5.86 2.04 -1.38 -3.47 117.51 124.03 2onf h ILE 11 Ca -0.33 -0.39 0.36 0.00 1.00 0.00 0.00 64.86 65.50 2onf h ILE 11 Cb 1.15 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 37.13 2onf h ILE 11 CO 0.79 0.00 0.91 1.51 0.00 0.00 0.00 178.15 181.36 2onf s ASP 12 N -3.98 -0.02 0.82 1.72 1.47 -1.24 -5.05 116.67 110.39 2onf s ASP 12 Ca -0.00 -0.12 0.00 0.00 1.18 0.00 0.00 52.55 53.61 2onf s ASP 12 Cb 0.00 0.11 0.00 0.00 -0.34 0.00 0.00 42.92 42.69 2onf s ASP 12 CO 0.00 -0.21 0.00 0.47 0.68 0.00 0.00 175.17 176.12 2onf n ASP 13 N -0.71 0.00 -2.26 2.11 8.00 -1.26 -0.96 116.55 121.47 2onf n ASP 13 Ca -0.04 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.17 2onf n ASP 13 Cb 0.61 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.75 2onf n ASP 13 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2onf n ARG 14 N 14.00 3.29 -5.20 -1.24 5.12 -1.26 -5.01 116.66 126.36 2onf n ARG 14 Ca 0.00 -3.97 -0.31 0.00 -1.93 0.00 0.00 57.85 51.63 2onf n ARG 14 Cb 0.00 -2.28 -0.17 0.00 -1.16 0.00 0.00 32.46 28.86 2onf n ARG 14 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2onf s ARG 15 N -3.68 2.81 0.23 5.56 0.52 -0.14 -1.09 118.95 123.15 2onf s ARG 15 Ca 0.54 -0.86 0.11 0.00 -0.52 0.00 0.00 55.73 54.99 2onf s ARG 15 Cb 0.43 -2.21 -0.05 0.00 0.52 0.00 0.00 34.95 33.65 2onf s ARG 15 CO -0.06 0.24 -0.21 0.95 0.02 0.00 0.00 175.30 176.25 2onf s THR 16 N 0.18 2.29 -0.19 0.02 -4.23 -0.59 -0.98 115.64 112.15 2onf s THR 16 Ca -0.14 -2.18 0.01 0.00 -1.18 0.00 0.00 61.69 58.20 2onf s THR 16 Cb -0.16 -2.15 0.02 0.00 1.34 0.00 0.00 72.50 71.55 2onf s THR 16 CO 0.07 -0.29 -0.19 -0.70 -0.54 0.00 0.00 174.62 172.97 2onf s GLU 17 N -3.10 2.91 -0.17 3.99 2.12 0.44 -1.21 118.70 123.69 2onf s GLU 17 Ca 0.24 -0.87 -0.20 0.00 0.36 0.00 0.00 54.97 54.50 2onf s GLU 17 Cb -0.06 -2.59 -0.03 0.00 0.26 0.00 0.00 34.13 31.71 2onf s GLU 17 CO 0.11 -0.24 0.58 0.08 -0.54 0.00 0.00 175.26 175.25 2onf s VAL 18 N 1.28 5.08 -0.20 3.70 1.01 0.65 -1.26 120.40 130.67 2onf s VAL 18 Ca 0.04 1.11 0.01 0.00 0.00 0.00 0.00 61.98 63.13 2onf s VAL 18 Cb -0.14 -3.90 0.02 0.00 0.00 0.00 0.00 36.38 32.37 2onf s VAL 18 CO -0.12 0.19 -0.17 -0.55 0.00 0.00 0.00 175.10 174.45 2onf s SER 19 N 1.03 3.46 -0.17 3.32 0.15 0.55 -0.41 113.70 121.63 2onf s SER 19 Ca 0.28 -0.73 -0.04 0.00 0.70 0.00 0.00 55.95 56.15 2onf s SER 19 Cb -0.16 -1.52 0.06 0.00 -1.71 0.00 0.00 66.02 62.69 2onf s SER 19 CO 0.11 -0.03 0.08 -0.69 1.20 0.00 0.00 173.24 173.91 2onf s VAL 20 N 1.28 0.02 0.00 4.45 1.01 -0.61 -1.39 120.40 125.17 2onf s VAL 20 Ca 0.03 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.80 2onf s VAL 20 Cb -0.14 -0.64 0.00 0.00 0.00 0.00 0.00 36.38 35.60 2onf s VAL 20 CO -0.11 -0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.36 2onf n GLY 21 N 5.24 4.02 1.25 4.51 0.00 -1.26 -0.91 105.19 118.04 2onf n GLY 21 Ca -0.07 0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.24 2onf n GLY 21 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2onf n ASP 22 N 7.70 3.71 -4.88 1.61 8.00 -1.26 -4.92 116.55 126.51 2onf n ASP 22 Ca 0.00 -2.00 -0.34 0.00 0.71 0.00 0.00 54.79 53.16 2onf n ASP 22 Cb 0.00 -0.36 -0.05 0.00 -0.02 0.00 0.00 41.12 40.68 2onf n ASP 22 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 2onf s HIS 23 N -1.26 3.57 -0.05 1.24 3.76 -0.08 -5.09 115.29 117.38 2onf s HIS 23 Ca 0.44 0.62 -0.01 0.00 -0.15 0.00 0.00 55.06 55.96 2onf s HIS 23 Cb 0.24 -2.03 0.03 0.00 1.11 0.00 0.00 32.58 31.93 2onf s HIS 23 CO 0.33 0.58 0.01 1.03 -0.85 0.00 0.00 174.74 175.84 2onf s ARG 24 N -1.84 0.41 -0.06 1.40 1.81 -1.26 -1.57 118.95 117.84 2onf s ARG 24 Ca 0.30 0.15 0.04 0.00 -1.72 0.00 0.00 55.73 54.50 2onf s ARG 24 Cb -0.13 -0.76 -0.00 0.00 -0.45 0.00 0.00 34.95 33.61 2onf s ARG 24 CO 0.17 -0.26 -0.19 0.42 -0.68 0.00 0.00 175.30 174.76 2onf s ILE 25 N 1.76 1.60 -0.16 1.52 1.01 0.45 -4.97 121.20 122.40 2onf s ILE 25 Ca 0.01 -0.79 -0.25 0.00 0.00 0.00 0.00 60.65 59.62 2onf s ILE 25 Cb -0.13 -1.38 -0.02 0.00 0.01 0.00 0.00 42.46 40.94 2onf s ILE 25 CO -0.04 0.46 0.82 -0.70 0.00 0.00 0.00 174.94 175.48 2onf s GLU 26 N 0.17 4.30 -0.11 2.79 2.12 -1.26 -0.25 118.70 126.46 2onf s GLU 26 Ca -0.09 1.00 -0.01 0.00 0.36 0.00 0.00 54.97 56.24 2onf s GLU 26 Cb -0.14 -3.57 0.03 0.00 0.26 0.00 0.00 34.13 30.71 2onf s GLU 26 CO 0.04 -0.30 -0.05 0.08 -0.54 0.00 0.00 175.26 174.49 2onf s VAL 27 N 2.06 0.86 0.40 3.70 1.01 -0.35 -4.14 120.40 123.94 2onf s VAL 27 Ca 0.38 -0.23 0.07 0.00 0.00 0.00 0.00 61.98 62.21 2onf s VAL 27 Cb -0.17 -0.94 -0.08 0.00 0.00 0.00 0.00 36.38 35.20 2onf s VAL 27 CO 0.13 0.31 -0.00 -1.81 0.00 0.00 0.00 175.10 173.72 2onf s ASP 28 N 1.77 3.87 0.47 3.32 1.01 -0.05 -1.54 116.67 125.53 2onf s ASP 28 Ca 0.04 -1.33 -0.23 0.00 0.71 0.00 0.00 52.55 51.75 2onf s ASP 28 Cb -0.13 -0.39 -0.07 0.00 1.01 0.00 0.00 42.92 43.34 2onf s ASP 28 CO -0.07 -0.41 1.25 -0.44 0.21 0.00 0.00 175.17 175.71 2onf s SER 29 N -3.70 5.92 0.67 0.27 0.01 -0.25 -3.86 113.70 112.76 2onf s SER 29 Ca 0.35 2.52 -0.11 0.00 1.31 0.00 0.00 55.95 60.02 2onf s SER 29 Cb 0.08 -2.62 -0.01 0.00 0.21 0.00 0.00 66.02 63.69 2onf s SER 29 CO 0.18 -1.10 1.06 -2.16 0.41 0.00 0.00 173.24 171.62 2onf s PRO 30 N -2.66 3.15 0.33 12.44 0.04 -1.26 -3.63 135.00 143.41 2onf s PRO 30 Ca 0.65 0.75 0.13 0.00 0.04 0.00 0.00 61.00 62.56 2onf s PRO 30 Cb -0.34 -2.03 1.01 0.00 0.04 0.00 0.00 34.50 33.17 2onf s PRO 30 CO 0.42 -0.89 1.69 -1.35 0.04 0.00 0.00 177.00 176.91 2onf h PRO 31 N -0.56 0.42 0.00 0.56 0.11 -1.73 -0.68 132.00 130.13 2onf h PRO 31 Ca -0.44 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 2onf h PRO 31 Cb 1.21 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2onf h PRO 31 CO 0.61 0.28 -0.01 1.05 -0.21 0.00 0.00 178.00 179.71 2onf h GLU 32 N 0.43 0.00 -0.24 1.05 4.11 -1.93 -0.47 114.58 117.54 2onf h GLU 32 Ca 0.70 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.13 2onf h GLU 32 Cb 1.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.74 2onf h GLU 32 CO -0.55 0.01 0.00 1.19 0.07 0.00 0.00 179.01 179.74 2onf n PHE 33 N -3.19 0.74 -0.01 2.06 3.72 -0.39 -4.97 117.46 115.43 2onf n PHE 33 Ca -0.02 -0.82 0.00 0.00 -0.05 0.00 0.00 57.45 56.56 2onf n PHE 33 Cb 0.15 -0.24 0.00 0.00 -0.94 0.00 0.00 39.48 38.45 2onf n PHE 33 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2onf n GLY 34 N -0.44 0.72 3.97 1.37 0.00 -0.18 -4.90 105.19 105.72 2onf n GLY 34 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 2onf n GLY 34 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2onf s GLY 35 N -1.45 1.78 0.49 -0.02 0.00 -0.46 -4.89 107.32 102.76 2onf s GLY 35 Ca 0.00 -1.61 -0.16 0.00 0.00 0.00 0.00 44.72 42.95 2onf s GLY 35 CO 0.00 -0.90 0.95 2.56 0.00 0.00 0.00 173.10 175.71 2onf s PRO 36 N -5.53 3.97 0.60 2.90 0.04 -1.24 -3.55 135.00 132.19 2onf s PRO 36 Ca 0.72 0.91 -0.16 0.00 0.04 0.00 0.00 61.00 62.51 2onf s PRO 36 Cb -0.03 -2.18 -0.03 0.00 0.04 0.00 0.00 34.50 32.30 2onf s PRO 36 CO 0.49 -0.20 1.07 -1.21 0.04 0.00 0.00 177.00 177.18 2onf s GLU 37 N -3.90 3.24 -0.64 4.56 2.02 -1.26 -4.20 118.70 118.53 2onf s GLU 37 Ca 0.58 1.23 0.00 0.00 0.02 0.00 0.00 54.97 56.80 2onf s GLU 37 Cb -0.10 -2.02 0.00 0.00 0.10 0.00 0.00 34.13 32.11 2onf s GLU 37 CO 0.29 -0.88 0.00 0.41 0.02 0.00 0.00 175.26 175.10 2onf n GLY 38 N -0.92 0.74 3.60 -1.39 0.00 -1.26 -5.04 105.19 100.93 2onf n GLY 38 Ca 0.09 -0.75 -0.27 0.00 0.00 0.00 0.00 46.02 45.08 2onf n GLY 38 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2onf s GLN 39 N -2.80 1.93 0.38 1.61 -1.52 -1.26 -5.13 119.66 112.87 2onf s GLN 39 Ca 0.00 -2.11 -0.24 0.00 -1.95 0.00 0.00 55.36 51.06 2onf s GLN 39 Cb 0.00 -1.43 -0.10 0.00 -0.22 0.00 0.00 33.01 31.26 2onf s GLN 39 CO 0.00 -0.13 0.99 -0.51 -0.25 0.00 0.00 175.29 175.38 2onf s LEU 40 N -3.68 4.17 0.10 2.90 1.43 -1.26 -4.96 118.68 117.37 2onf s LEU 40 Ca 0.31 1.88 0.04 0.00 -1.03 0.00 0.00 54.13 55.33 2onf s LEU 40 Cb 0.08 -4.20 -0.04 0.00 0.03 0.00 0.00 46.19 42.07 2onf s LEU 40 CO 0.15 -0.30 -0.10 -0.31 0.23 0.00 0.00 176.35 176.02 2onf s TYR 41 N -1.76 1.05 0.47 0.29 2.02 -1.26 -0.87 117.35 117.29 2onf s TYR 41 Ca 0.56 -0.67 0.15 0.00 -0.37 0.00 0.00 57.07 56.73 2onf s TYR 41 Cb -0.18 -0.57 1.12 0.00 -0.40 0.00 0.00 41.96 41.93 2onf s TYR 41 CO 0.23 -0.01 2.04 -1.35 -1.57 0.00 0.00 175.55 174.89 2onf h PRO 42 N 3.51 0.26 0.00 -1.71 0.11 -1.92 -0.65 132.00 131.60 2onf h PRO 42 Ca -0.37 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.72 2onf h PRO 42 Cb 1.19 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2onf h PRO 42 CO 0.54 0.17 -0.00 0.93 -0.21 0.00 0.00 178.00 179.43 2onf h GLU 43 N 0.27 0.00 0.00 1.05 3.07 -1.96 -0.77 114.58 116.24 2onf h GLU 43 Ca 0.18 0.00 -0.33 0.00 -0.50 0.00 0.00 59.36 58.71 2onf h GLU 43 Cb 0.38 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.23 2onf h GLU 43 CO -0.04 0.00 -2.25 0.25 -1.40 0.00 0.00 179.01 175.58 2onf n THR 44 N -4.05 1.26 -0.07 1.13 -2.24 -0.97 -4.50 114.28 104.84 2onf n THR 44 Ca -0.03 -0.63 -0.15 0.00 -2.27 0.00 0.00 64.05 60.97 2onf n THR 44 Cb 0.09 -0.90 -0.05 0.00 -2.10 0.00 0.00 70.33 67.37 2onf n THR 44 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2onf h LEU 45 N 0.00 0.94 0.30 3.22 5.85 -1.00 -2.33 115.31 122.28 2onf h LEU 45 Ca -0.49 -0.56 -0.01 0.00 0.84 0.00 0.00 57.88 57.66 2onf h LEU 45 Cb 1.95 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.71 2onf h LEU 45 CO -0.02 1.32 -0.14 0.15 -0.34 0.00 0.00 178.44 179.40 2onf h PHE 46 N 0.59 -0.37 -0.29 1.25 3.57 -1.37 -0.29 116.94 120.03 2onf h PHE 46 Ca -0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 2onf h PHE 46 Cb 1.19 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 2onf h PHE 46 CO 0.08 -0.15 0.17 -1.35 -2.23 0.00 0.00 178.31 174.82 2onf h PRO 47 N -0.52 0.39 -0.49 6.41 0.11 -1.78 -1.16 132.00 134.96 2onf h PRO 47 Ca -0.04 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.97 2onf h PRO 47 Cb 0.39 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 2onf h PRO 47 CO 0.07 0.29 0.02 0.77 -0.21 0.00 0.00 178.00 178.94 2onf h SER 48 N 0.40 0.83 -0.05 -2.05 0.02 -1.24 -1.95 113.55 109.52 2onf h SER 48 Ca 0.11 -0.30 -0.10 0.00 -0.84 0.00 0.00 61.79 60.66 2onf h SER 48 Cb 0.00 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.31 2onf h SER 48 CO -0.02 0.92 -0.27 0.58 -1.14 0.00 0.00 176.83 176.90 2onf h VAL 49 N 0.71 1.27 -0.30 2.27 2.07 -0.68 0.66 116.25 122.26 2onf h VAL 49 Ca 0.14 -1.31 0.06 0.00 0.82 0.00 0.00 66.70 66.41 2onf h VAL 49 Cb 0.48 1.38 -0.06 0.00 -1.52 0.00 0.00 31.29 31.57 2onf h VAL 49 CO 0.02 0.42 -0.12 0.25 0.02 0.00 0.00 177.57 178.16 2onf h LEU 50 N 0.43 -0.40 -0.74 2.57 5.85 -1.09 -0.45 115.31 121.48 2onf h LEU 50 Ca 0.06 0.11 -0.12 0.00 0.84 0.00 0.00 57.88 58.76 2onf h LEU 50 Cb 0.70 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 2onf h LEU 50 CO 0.05 -0.15 -0.35 0.00 -0.34 0.00 0.00 178.44 177.65 2onf h ALA 51 N 1.21 0.92 -0.35 1.25 0.00 -0.93 -0.14 119.26 121.21 2onf h ALA 51 Ca 0.15 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 2onf h ALA 51 Cb 0.29 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2onf h ALA 51 CO -0.34 0.62 0.21 0.77 0.00 0.00 0.00 179.25 180.51 2onf h SER 52 N 0.46 0.42 -0.44 0.00 0.02 -0.69 -2.07 113.55 111.25 2onf h SER 52 Ca 0.05 -0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 2onf h SER 52 Cb 0.83 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.24 2onf h SER 52 CO 0.07 0.35 0.07 0.00 -1.14 0.00 0.00 176.83 176.17 2onf h LEU 54 N 0.77 0.67 0.06 0.00 5.85 -0.93 -0.50 115.31 121.22 2onf h LEU 54 Ca 0.16 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 2onf h LEU 54 Cb 0.37 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.23 2onf h LEU 54 CO 0.01 0.49 -0.03 0.25 -0.34 0.00 0.00 178.44 178.82 2onf h LEU 55 N 0.78 -0.07 -1.53 2.25 5.85 -1.07 -0.38 115.31 121.14 2onf h LEU 55 Ca 0.21 -0.36 0.04 0.00 0.84 0.00 0.00 57.88 58.62 2onf h LEU 55 Cb -0.08 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2onf h LEU 55 CO -0.04 0.33 0.37 0.71 -0.34 0.00 0.00 178.44 179.47 2onf h THR 56 N -0.47 1.03 -0.30 1.05 1.35 -0.96 0.48 112.91 115.09 2onf h THR 56 Ca -0.01 -0.20 -0.08 0.00 -0.55 0.00 0.00 66.41 65.57 2onf h THR 56 Cb 0.42 0.39 -0.01 0.00 -1.73 0.00 0.00 68.15 67.22 2onf h THR 56 CO 0.01 0.11 -0.11 0.74 -0.25 0.00 0.00 175.52 176.02 2onf h THR 57 N 0.60 1.29 -0.72 6.82 2.02 -0.96 -3.00 112.91 118.95 2onf h THR 57 Ca 0.23 -1.19 0.09 0.00 0.77 0.00 0.00 66.41 66.31 2onf h THR 57 Cb 0.17 1.43 -0.07 0.00 -1.74 0.00 0.00 68.15 67.94 2onf h THR 57 CO -0.06 0.38 0.38 0.15 0.37 0.00 0.00 175.52 176.73 2onf h PHE 58 N 0.37 0.68 -0.94 3.16 3.57 -0.15 -2.48 116.94 121.16 2onf h PHE 58 Ca 0.07 0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.67 2onf h PHE 58 Cb 0.62 -0.20 -0.06 0.00 2.79 0.00 0.00 35.95 39.10 2onf h PHE 58 CO 0.06 0.27 0.61 -0.07 -2.23 0.00 0.00 178.31 176.94 2onf h LEU 59 N 0.65 0.94 0.02 0.59 3.38 -0.81 0.28 115.31 120.35 2onf h LEU 59 Ca 0.35 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.35 2onf h LEU 59 Cb 0.33 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2onf h LEU 59 CO -0.25 0.59 -0.18 -0.08 0.09 0.00 0.00 178.44 178.62 2onf h GLU 60 N 1.06 -0.29 -0.28 1.13 4.57 -1.31 -1.66 114.58 117.80 2onf h GLU 60 Ca 0.41 0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 58.55 2onf h GLU 60 Cb 0.21 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.85 2onf h GLU 60 CO -0.16 -0.19 -0.07 0.74 -1.18 0.00 0.00 179.01 178.14 2onf h PHE 61 N -0.30 0.47 0.05 0.92 0.04 -1.10 -0.73 116.94 116.29 2onf h PHE 61 Ca 0.05 -0.06 0.01 0.00 2.80 0.00 0.00 57.97 60.77 2onf h PHE 61 Cb 0.37 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.37 2onf h PHE 61 CO -0.22 0.52 -0.07 -0.22 -0.60 0.00 0.00 178.31 177.72 2onf h LYS 62 N 0.42 -0.14 -0.47 1.51 3.11 -0.27 -2.56 116.57 118.17 2onf h LYS 62 Ca 0.09 0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 57.92 2onf h LYS 62 Cb 0.39 0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.63 2onf h LYS 62 CO 0.02 -0.10 0.24 -0.44 -2.81 0.00 0.00 179.45 176.36 2onf h ASP 63 N -0.15 0.60 0.00 4.20 3.32 -1.14 -1.24 116.42 122.01 2onf h ASP 63 Ca 0.01 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.95 2onf h ASP 63 Cb 0.15 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2onf h ASP 63 CO -0.03 0.55 0.00 0.54 -1.72 0.00 0.00 179.24 178.57 2onf n ARG 64 N -4.65 0.16 -2.08 3.56 1.74 -0.29 -4.69 116.66 110.41 2onf n ARG 64 Ca 0.01 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.06 2onf n ARG 64 Cb 0.10 -1.24 0.06 0.00 -1.02 0.00 0.00 32.46 30.36 2onf n ARG 64 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2onf n GLY 66 N 0.66 1.51 3.72 -0.13 0.00 -0.79 -5.08 105.19 105.06 2onf n GLY 66 Ca 0.00 -0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 2onf n GLY 66 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2onf s ILE 67 N 0.05 5.04 -0.88 -0.61 1.01 -0.53 -5.00 121.20 120.28 2onf s ILE 67 Ca 0.06 1.47 -0.19 0.00 0.00 0.00 0.00 60.65 62.00 2onf s ILE 67 Cb 0.29 -4.05 0.13 0.00 0.01 0.00 0.00 42.46 38.84 2onf s ILE 67 CO -0.08 0.25 1.06 0.21 0.00 0.00 0.00 174.94 176.38 2onf s ASN 68 N 0.81 6.56 -0.08 3.58 3.04 -1.26 -4.68 114.94 122.92 2onf s ASN 68 Ca 0.38 -1.94 -0.30 0.00 0.04 0.00 0.00 52.86 51.05 2onf s ASN 68 Cb -0.18 -2.38 -0.02 0.00 -1.54 0.00 0.00 41.25 37.13 2onf s ASN 68 CO 0.19 -1.08 1.09 -0.22 -3.04 0.00 0.00 177.10 174.04 2onf s LEU 69 N 2.67 4.27 -0.21 3.21 2.96 -1.26 -3.08 118.68 127.24 2onf s LEU 69 Ca 0.29 1.67 0.05 0.00 -0.22 0.00 0.00 54.13 55.92 2onf s LEU 69 Cb -0.07 -3.56 -0.21 0.00 0.50 0.00 0.00 46.19 42.85 2onf s LEU 69 CO -0.07 -0.49 -0.01 0.29 -1.32 0.00 0.00 176.35 174.75 2onf n LYS 70 N 5.00 0.67 -3.46 1.98 5.02 0.13 -5.00 118.16 122.50 2onf n LYS 70 Ca 0.09 0.14 -0.13 0.00 -2.02 0.00 0.00 58.31 56.39 2onf n LYS 70 Cb 0.48 -1.57 -0.03 0.00 -0.02 0.00 0.00 35.03 33.89 2onf n LYS 70 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2onf s SER 71 N -6.32 -0.57 -0.20 4.39 1.04 -1.02 -4.95 113.70 106.09 2onf s SER 71 Ca -0.25 0.21 -0.06 0.00 0.48 0.00 0.00 55.95 56.34 2onf s SER 71 Cb 0.08 0.55 0.10 0.00 0.10 0.00 0.00 66.02 66.85 2onf s SER 71 CO 0.70 -0.81 0.38 0.86 0.98 0.00 0.00 173.24 175.34 2onf s TRP 72 N -2.88 -0.74 -0.04 5.02 -0.11 -1.26 -1.32 118.94 117.60 2onf s TRP 72 Ca -0.02 1.28 0.03 0.00 1.22 0.00 0.00 56.10 58.62 2onf s TRP 72 Cb -0.01 0.18 0.00 0.00 -1.50 0.00 0.00 33.47 32.15 2onf s TRP 72 CO -0.06 -0.51 -0.14 -0.80 -4.62 0.00 0.00 176.95 170.82 2onf s ASN 73 N 2.57 1.82 0.00 5.86 0.01 -0.72 -5.01 114.94 119.47 2onf s ASN 73 Ca 0.02 -0.30 0.03 0.00 -0.71 0.00 0.00 52.86 51.90 2onf s ASN 73 Cb -0.13 -0.57 -0.01 0.00 0.41 0.00 0.00 41.25 40.95 2onf s ASN 73 CO -0.13 0.10 -0.11 -0.94 -1.51 0.00 0.00 177.10 174.52 2onf s SER 74 N 0.21 1.27 -0.17 -1.22 1.04 -1.26 -0.01 113.70 113.57 2onf s SER 74 Ca -0.06 -0.25 -0.05 0.00 0.48 0.00 0.00 55.95 56.08 2onf s SER 74 Cb -0.12 -0.12 -0.03 0.00 0.10 0.00 0.00 66.02 65.85 2onf s SER 74 CO 0.02 0.10 -0.01 -2.28 0.98 0.00 0.00 173.24 172.04 2onf s HIS 75 N -0.40 3.07 -0.17 5.02 2.46 0.10 -4.94 115.29 120.43 2onf s HIS 75 Ca 0.03 -0.25 -0.04 0.00 0.47 0.00 0.00 55.06 55.27 2onf s HIS 75 Cb -0.05 -2.00 -0.03 0.00 -0.13 0.00 0.00 32.58 30.38 2onf s HIS 75 CO -0.00 -0.03 -0.02 0.08 -2.47 0.00 0.00 174.74 172.30 2onf s VAL 76 N 0.45 3.94 -0.23 0.89 1.01 -1.26 -0.88 120.40 124.32 2onf s VAL 76 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 61.63 2onf s VAL 76 Cb -0.14 -2.75 0.06 0.00 0.00 0.00 0.00 36.38 33.56 2onf s VAL 76 CO 0.02 0.48 -0.04 -0.89 0.00 0.00 0.00 175.10 174.67 2onf s THR 77 N 0.53 1.38 -0.10 3.92 2.01 0.24 -4.98 115.64 118.63 2onf s THR 77 Ca -0.02 -1.14 -0.01 0.00 0.31 0.00 0.00 61.69 60.83 2onf s THR 77 Cb -0.14 -1.69 -0.03 0.00 0.01 0.00 0.00 72.50 70.65 2onf s THR 77 CO 0.02 -0.13 -0.06 0.00 -0.69 0.00 0.00 174.62 173.77 2onf s ALA 78 N 1.46 2.99 -0.25 7.40 0.00 -1.26 -0.06 121.76 132.03 2onf s ALA 78 Ca -0.05 -0.86 -0.01 0.00 0.00 0.00 0.00 51.96 51.04 2onf s ALA 78 Cb -0.19 -1.36 0.03 0.00 0.00 0.00 0.00 23.12 21.60 2onf s ALA 78 CO -0.07 0.43 -0.06 -1.21 0.00 0.00 0.00 175.76 174.85 2onf s GLU 79 N -0.33 2.78 -0.22 0.00 2.02 -0.20 -5.02 118.70 117.74 2onf s GLU 79 Ca 0.05 -1.01 -0.10 0.00 0.02 0.00 0.00 54.97 53.92 2onf s GLU 79 Cb -0.12 -2.99 -0.05 0.00 0.10 0.00 0.00 34.13 31.06 2onf s GLU 79 CO 0.02 -0.42 0.14 -1.17 0.02 0.00 0.00 175.26 173.85 2onf s LEU 80 N 1.31 4.12 0.00 1.80 2.96 -1.26 -0.22 118.68 127.38 2onf s LEU 80 Ca -0.01 0.15 -0.03 0.00 -0.22 0.00 0.00 54.13 54.03 2onf s LEU 80 Cb -0.17 -2.08 0.01 0.00 0.50 0.00 0.00 46.19 44.45 2onf s LEU 80 CO -0.04 0.12 0.52 0.61 -1.32 0.00 0.00 176.35 176.24 2onf n GLY 81 N 3.90 2.01 3.76 7.98 0.00 -0.16 -4.92 105.19 117.76 2onf n GLY 81 Ca -0.16 -1.60 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 2onf n GLY 81 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2onf n PRO 82 N -0.59 2.60 -3.85 1.61 -0.02 -1.26 -0.92 135.00 132.58 2onf n PRO 82 Ca 0.00 0.91 -0.32 0.00 -2.02 0.00 0.00 63.50 62.07 2onf n PRO 82 Cb 0.60 -2.62 -0.05 0.00 -0.02 0.00 0.00 33.50 31.41 2onf n PRO 82 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2onf s SER 83 N -0.15 6.41 0.00 2.55 0.15 -0.01 -4.66 113.70 117.97 2onf s SER 83 Ca 0.53 0.40 0.17 0.00 0.70 0.00 0.00 55.95 57.75 2onf s SER 83 Cb -0.49 -2.02 0.79 0.00 -1.71 0.00 0.00 66.02 62.59 2onf s SER 83 CO 0.64 0.19 1.51 -0.81 1.20 0.00 0.00 173.24 175.97 2onf n PRO 84 N 0.60 0.14 -0.36 5.44 -0.04 -1.26 -1.43 135.00 138.08 2onf n PRO 84 Ca -0.07 0.17 0.05 0.00 -0.04 0.00 0.00 63.50 63.61 2onf n PRO 84 Cb 0.52 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.68 2onf n PRO 84 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2onf n GLU 85 N -1.38 2.58 -0.77 0.54 1.02 -1.26 -5.04 120.64 116.33 2onf n GLU 85 Ca 0.06 -1.63 0.10 0.00 -0.02 0.00 0.00 57.16 55.67 2onf n GLU 85 Cb 0.16 -1.63 -0.04 0.00 -0.02 0.00 0.00 31.44 29.91 2onf n GLU 85 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2onf n LYS 86 N 0.53 -1.67 0.00 3.49 5.02 -0.52 -5.01 118.16 120.00 2onf n LYS 86 Ca 0.15 1.27 0.00 0.00 -2.02 0.00 0.00 58.31 57.70 2onf n LYS 86 Cb 0.57 -1.99 0.00 0.00 -0.02 0.00 0.00 35.03 33.58 2onf n LYS 86 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2onf n GLY 87 N -3.44 0.73 3.41 0.72 0.00 -1.26 -4.38 105.19 100.96 2onf n GLY 87 Ca -0.02 -0.73 -0.21 0.00 0.00 0.00 0.00 46.02 45.06 2onf n GLY 87 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2onf s PHE 88 N 0.00 1.90 0.09 1.61 0.40 -1.26 -0.83 117.98 119.89 2onf s PHE 88 Ca 0.00 -0.64 -0.13 0.00 -0.60 0.00 0.00 56.93 55.56 2onf s PHE 88 Cb 0.00 -1.01 0.02 0.00 0.51 0.00 0.00 43.02 42.54 2onf s PHE 88 CO 0.00 0.33 0.31 -1.59 0.70 0.00 0.00 175.22 174.96 2onf s LYS 89 N -3.69 0.93 -0.03 0.44 -2.85 -0.10 -4.69 119.74 109.75 2onf s LYS 89 Ca 0.27 -0.74 -0.30 0.00 -1.00 0.00 0.00 55.97 54.20 2onf s LYS 89 Cb 0.02 0.40 -0.04 0.00 -2.06 0.00 0.00 37.83 36.14 2onf s LYS 89 CO 0.11 -0.33 1.30 -0.06 0.10 0.00 0.00 175.35 176.46 2onf s PHE 90 N -3.52 3.03 -0.15 1.78 0.08 -1.26 -0.99 117.98 116.94 2onf s PHE 90 Ca 0.02 1.02 -0.24 0.00 0.12 0.00 0.00 56.93 57.85 2onf s PHE 90 Cb 0.02 -3.54 -0.21 0.00 -0.57 0.00 0.00 43.02 38.72 2onf s PHE 90 CO -0.10 -1.86 0.57 0.45 -0.10 0.00 0.00 175.22 174.18 2onf h HIS 91 N 7.63 0.00 -3.30 0.36 3.86 -0.93 -3.42 115.15 119.34 2onf h HIS 91 Ca -0.36 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 58.69 2onf h HIS 91 Cb 1.17 0.00 -0.24 0.00 1.06 0.00 0.00 27.41 29.40 2onf h HIS 91 CO 0.74 0.93 -0.47 1.03 0.86 0.00 0.00 177.93 181.01 2onf s ARG 92 N -2.16 0.32 -0.12 2.45 0.52 -1.22 -1.84 118.95 116.90 2onf s ARG 92 Ca -0.18 0.07 0.00 0.00 -0.52 0.00 0.00 55.73 55.11 2onf s ARG 92 Cb -0.01 0.15 0.02 0.00 0.52 0.00 0.00 34.95 35.63 2onf s ARG 92 CO 0.58 -0.06 -0.12 0.42 0.02 0.00 0.00 175.30 176.14 2onf s ILE 93 N -0.37 1.34 -0.12 1.52 1.01 0.39 -1.03 121.20 123.94 2onf s ILE 93 Ca -0.05 -0.51 -0.03 0.00 0.00 0.00 0.00 60.65 60.07 2onf s ILE 93 Cb -0.03 -1.28 -0.03 0.00 0.01 0.00 0.00 42.46 41.13 2onf s ILE 93 CO 0.01 0.42 -0.01 -0.54 0.00 0.00 0.00 174.94 174.81 2onf s LYS 94 N 1.40 3.36 -0.19 2.79 1.02 0.91 -1.74 119.74 127.28 2onf s LYS 94 Ca 0.01 -0.46 0.01 0.00 0.02 0.00 0.00 55.97 55.55 2onf s LYS 94 Cb -0.13 -2.87 0.04 0.00 -0.52 0.00 0.00 37.83 34.35 2onf s LYS 94 CO -0.07 0.46 -0.10 0.42 -0.92 0.00 0.00 175.35 175.14 2onf s ILE 95 N -0.22 1.57 -0.27 2.17 1.01 0.09 -0.59 121.20 124.96 2onf s ILE 95 Ca 0.05 -0.95 -0.06 0.00 0.00 0.00 0.00 60.65 59.69 2onf s ILE 95 Cb -0.13 -1.65 -0.00 0.00 0.01 0.00 0.00 42.46 40.69 2onf s ILE 95 CO 0.02 0.17 0.04 -2.28 0.00 0.00 0.00 174.94 172.90 2onf s HIS 96 N 1.43 3.09 -0.16 3.97 2.46 -0.06 -1.96 115.29 124.06 2onf s HIS 96 Ca -0.01 -0.90 -0.05 0.00 0.47 0.00 0.00 55.06 54.57 2onf s HIS 96 Cb -0.16 -2.21 -0.03 0.00 -0.13 0.00 0.00 32.58 30.05 2onf s HIS 96 CO -0.08 -0.54 -0.00 0.08 -2.47 0.00 0.00 174.74 171.73 2onf s VAL 97 N 1.51 4.22 -0.37 0.89 1.01 -0.55 -0.72 120.40 126.39 2onf s VAL 97 Ca 0.04 -0.24 -0.13 0.00 0.00 0.00 0.00 61.98 61.65 2onf s VAL 97 Cb -0.16 -2.87 0.00 0.00 0.00 0.00 0.00 36.38 33.35 2onf s VAL 97 CO 0.01 0.48 0.25 -0.54 0.00 0.00 0.00 175.10 175.30 2onf s LYS 98 N 0.34 3.20 -0.18 2.72 1.02 0.99 -0.83 119.74 126.99 2onf s LYS 98 Ca -0.01 -0.84 -0.04 0.00 0.02 0.00 0.00 55.97 55.09 2onf s LYS 98 Cb -0.13 -3.84 -0.02 0.00 -0.52 0.00 0.00 37.83 33.31 2onf s LYS 98 CO 0.02 -0.59 -0.02 0.42 -0.92 0.00 0.00 175.35 174.26 2onf s ILE 99 N 1.68 3.82 -0.33 2.17 1.01 -0.46 -1.76 121.20 127.33 2onf s ILE 99 Ca 0.05 -0.37 -0.10 0.00 0.00 0.00 0.00 60.65 60.23 2onf s ILE 99 Cb -0.18 -2.71 -0.00 0.00 0.01 0.00 0.00 42.46 39.58 2onf s ILE 99 CO 0.09 0.45 0.17 -0.83 0.00 0.00 0.00 174.94 174.83 2onf s GLY 100 N 0.80 1.88 0.13 6.18 0.00 -0.44 -1.55 107.32 114.33 2onf s GLY 100 Ca -0.01 -1.46 0.01 0.00 0.00 0.00 0.00 44.72 43.27 2onf s GLY 100 CO 0.02 0.73 -0.02 -1.34 0.00 0.00 0.00 173.10 172.49 2onf s VAL 101 N 1.61 0.59 0.42 1.40 -7.23 -1.26 0.20 120.40 116.13 2onf s VAL 101 Ca 0.04 -1.95 -0.26 0.00 -1.81 0.00 0.00 61.98 58.01 2onf s VAL 101 Cb -0.18 -1.91 -0.09 0.00 0.56 0.00 0.00 36.38 34.76 2onf s VAL 101 CO 0.06 -0.65 1.36 0.59 -0.31 0.00 0.00 175.10 176.15 2onf n ASN 102 N -0.13 3.01 -0.25 4.85 3.02 -1.18 -4.92 115.26 119.66 2onf n ASN 102 Ca -0.09 1.13 0.13 0.00 -0.03 0.00 0.00 54.58 55.72 2onf n ASN 102 Cb 0.62 -1.55 0.41 0.00 -0.61 0.00 0.00 39.78 38.65 2onf n ASN 102 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2onf h ASP 103 N 2.28 0.59 0.55 6.41 5.19 -2.00 -0.59 116.42 128.85 2onf h ASP 103 Ca -0.49 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 2onf h ASP 103 Cb 1.28 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.71 2onf h ASP 103 CO 0.61 0.29 0.00 1.05 -3.12 0.00 0.00 179.24 178.07 2onf h GLU 104 N 0.62 0.00 -0.00 3.56 9.09 -2.01 -2.80 114.58 123.03 2onf h GLU 104 Ca 0.44 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.85 2onf h GLU 104 Cb 0.80 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.90 2onf h GLU 104 CO -0.20 0.00 -0.75 -0.25 0.05 0.00 0.00 179.01 177.87 2onf n ASP 105 N -2.51 0.90 -0.32 3.06 8.00 -0.23 -4.47 116.55 120.98 2onf n ASP 105 Ca 0.00 -0.77 0.01 0.00 0.71 0.00 0.00 54.79 54.74 2onf n ASP 105 Cb 0.19 0.65 0.18 0.00 -0.02 0.00 0.00 41.12 42.12 2onf n ASP 105 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2onf h LYS 106 N 0.24 1.15 -0.19 -1.24 1.57 -1.48 -0.92 116.57 115.71 2onf h LYS 106 Ca 0.00 -0.07 0.06 0.00 -1.87 0.00 0.00 60.65 58.77 2onf h LYS 106 Cb 0.52 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 2onf h LYS 106 CO 0.00 0.76 0.17 1.49 -0.57 0.00 0.00 179.45 181.30 2onf h GLU 107 N 1.18 0.00 0.00 3.15 4.81 -1.80 -2.12 114.58 119.80 2onf h GLU 107 Ca 0.36 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.59 2onf h GLU 107 Cb -0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.35 2onf h GLU 107 CO -0.10 0.00 -0.29 1.63 -0.73 0.00 0.00 179.01 179.52 2onf n LYS 108 N -4.10 0.11 -0.10 1.92 5.02 -0.35 -4.40 118.16 116.25 2onf n LYS 108 Ca 0.02 0.05 -0.13 0.00 -2.02 0.00 0.00 58.31 56.23 2onf n LYS 108 Cb 0.30 -1.59 -0.04 0.00 -0.02 0.00 0.00 35.03 33.69 2onf n LYS 108 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2onf h ILE 109 N 0.00 1.29 -0.51 -0.18 1.08 -1.42 -1.99 117.51 115.79 2onf h ILE 109 Ca 0.00 -1.43 0.09 0.00 -0.39 0.00 0.00 64.86 63.13 2onf h ILE 109 Cb 0.59 1.50 -0.07 0.00 -3.07 0.00 0.00 36.82 35.77 2onf h ILE 109 CO 0.00 0.46 0.11 -0.65 -0.69 0.00 0.00 178.15 177.38 2onf h PRO 110 N 0.51 0.24 -0.21 2.37 0.11 -1.77 -2.34 132.00 130.91 2onf h PRO 110 Ca 0.06 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.15 2onf h PRO 110 Cb 0.84 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 2onf h PRO 110 CO 0.07 0.16 0.11 -0.09 -0.21 0.00 0.00 178.00 178.03 2onf h ARG 111 N 0.24 0.30 0.00 1.05 9.65 -1.83 -1.47 114.38 122.31 2onf h ARG 111 Ca 0.25 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 59.10 2onf h ARG 111 Cb 0.34 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 28.87 2onf h ARG 111 CO -0.33 0.30 0.00 0.00 2.80 0.00 0.00 179.97 182.74 2onf n ALA 112 N -2.21 0.93 0.00 2.80 0.00 -0.75 -1.02 120.51 120.27 2onf n ALA 112 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2onf n ALA 112 Cb 0.09 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 18.64 2onf n ALA 112 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2onf n GLN 114 N 0.38 0.00 -0.05 0.00 0.00 -0.56 -1.03 117.38 116.13 2onf n GLN 114 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.00 56.90 2onf n GLN 114 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 30.24 30.20 2onf n GLN 114 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 2onf h LEU 115 N 0.00 0.24 -0.49 1.69 3.38 -1.33 -0.55 115.31 118.25 2onf h LEU 115 Ca 0.00 -0.08 0.09 0.00 0.09 0.00 0.00 57.88 57.98 2onf h LEU 115 Cb 0.00 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 40.62 2onf h LEU 115 CO 0.00 0.25 0.06 0.00 0.09 0.00 0.00 178.44 178.85 2onf h ALA 116 N 1.00 0.52 -0.32 1.53 0.00 -1.33 -0.49 119.26 120.17 2onf h ALA 116 Ca 0.07 0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.93 2onf h ALA 116 Cb 0.07 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2onf h ALA 116 CO -0.01 -0.34 -0.46 1.49 0.00 0.00 0.00 179.25 179.93 2onf h GLU 117 N 0.19 0.84 -0.80 0.00 4.81 -1.79 -1.54 114.58 116.29 2onf h GLU 117 Ca 0.25 -0.48 -0.02 0.00 -0.13 0.00 0.00 59.36 58.98 2onf h GLU 117 Cb 0.35 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 2onf h GLU 117 CO -0.35 1.12 0.43 -0.22 -0.73 0.00 0.00 179.01 179.26 2onf h LYS 118 N 0.67 1.12 -0.03 1.92 3.64 -0.47 -3.21 116.57 120.22 2onf h LYS 118 Ca 0.04 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 2onf h LYS 118 Cb 1.05 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 2onf h LYS 118 CO 0.10 0.83 -0.14 0.66 -2.27 0.00 0.00 179.45 178.64 2onf n TYR 119 N -4.41 0.00 -1.93 1.91 4.01 -0.25 -4.74 117.16 111.75 2onf n TYR 119 Ca 0.08 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.40 2onf n TYR 119 Cb 0.10 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.10 2onf n TYR 119 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2onf h PHE 121 N 8.80 0.96 0.06 0.00 0.04 -1.90 -0.94 116.94 123.96 2onf h PHE 121 Ca -0.42 -0.02 -0.27 0.00 2.80 0.00 0.00 57.97 60.05 2onf h PHE 121 Cb 1.20 -0.31 0.02 0.00 2.20 0.00 0.00 35.95 39.06 2onf h PHE 121 CO 0.82 0.68 -1.12 0.82 -0.60 0.00 0.00 178.31 178.90 2onf h ILE 122 N 0.99 1.32 -0.54 -0.55 2.04 -1.92 -1.35 117.51 117.50 2onf h ILE 122 Ca 0.25 -2.42 0.07 0.00 1.00 0.00 0.00 64.86 63.76 2onf h ILE 122 Cb 0.04 2.55 -0.06 0.00 -0.74 0.00 0.00 36.82 38.61 2onf h ILE 122 CO -0.04 0.74 0.23 0.28 0.00 0.00 0.00 178.15 179.35 2onf h SER 123 N 0.30 0.27 -0.74 1.72 0.02 -1.80 -1.31 113.55 112.00 2onf h SER 123 Ca -0.15 0.06 0.01 0.00 -0.84 0.00 0.00 61.79 60.87 2onf h SER 123 Cb 1.79 0.02 -0.04 0.00 0.14 0.00 0.00 62.40 64.31 2onf h SER 123 CO 0.21 0.18 0.49 0.03 -1.14 0.00 0.00 176.83 176.60 2onf h ARG 124 N 0.43 0.98 -0.44 3.45 3.08 -1.10 -2.21 114.38 118.58 2onf h ARG 124 Ca 0.26 -0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.30 2onf h ARG 124 Cb 0.26 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 2onf h ARG 124 CO -0.24 0.65 0.30 0.00 -1.07 0.00 0.00 179.97 179.61 2onf h ALA 125 N 1.27 1.94 -0.17 0.04 0.00 -0.11 -2.84 119.26 119.39 2onf h ALA 125 Ca 0.27 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2onf h ALA 125 Cb -0.11 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.59 2onf h ALA 125 CO -0.06 -0.02 0.00 0.44 0.00 0.00 0.00 179.25 179.61 2onf n ILE 126 N -4.48 0.30 -1.60 0.00 -5.35 -0.87 -4.99 119.36 102.37 2onf n ILE 126 Ca 0.06 -0.65 -0.48 0.00 -0.27 0.00 0.00 62.75 61.41 2onf n ILE 126 Cb 0.24 1.08 -0.04 0.00 -1.74 0.00 0.00 39.64 39.19 2onf n ILE 126 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 2onf n ARG 127 N 0.92 1.39 -0.04 6.28 0.63 -0.85 -1.30 116.66 123.69 2onf n ARG 127 Ca 0.12 0.49 0.00 0.00 -0.92 0.00 0.00 57.85 57.54 2onf n ARG 127 Cb 0.43 -2.02 0.00 0.00 0.45 0.00 0.00 32.46 31.32 2onf n ARG 127 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 2onf n ASN 128 N 2.00 0.00 -0.02 6.15 3.02 -1.26 -4.76 115.26 120.39 2onf n ASN 128 Ca 0.14 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.74 2onf n ASN 128 Cb 0.27 -0.59 -0.12 0.00 -0.61 0.00 0.00 39.78 38.73 2onf n ASN 128 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2onf n ASN 129 N 0.00 1.40 -3.80 6.41 3.02 -0.42 -4.97 115.26 116.91 2onf n ASN 129 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.41 2onf n ASN 129 Cb 0.00 1.56 -0.15 0.00 -0.61 0.00 0.00 39.78 40.57 2onf n ASN 129 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2onf s VAL 130 N -2.95 -0.04 0.01 2.41 1.01 -1.10 -4.88 120.40 114.85 2onf s VAL 130 Ca -0.06 0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 2onf s VAL 130 Cb 0.09 -0.06 -0.06 0.00 0.00 0.00 0.00 36.38 36.35 2onf s VAL 130 CO 0.64 0.07 1.39 -0.70 0.00 0.00 0.00 175.10 176.51 2onf s GLU 131 N 0.80 4.29 -0.23 2.72 2.12 -0.77 -4.80 118.70 122.83 2onf s GLU 131 Ca -0.07 1.97 0.01 0.00 0.36 0.00 0.00 54.97 57.25 2onf s GLU 131 Cb -0.10 -3.53 0.04 0.00 0.26 0.00 0.00 34.13 30.80 2onf s GLU 131 CO -0.02 -0.55 -0.12 -2.00 -0.54 0.00 0.00 175.26 172.02 2onf s GLU 132 N 2.22 2.64 -0.29 4.30 2.12 -1.26 -0.46 118.70 127.96 2onf s GLU 132 Ca 0.64 -1.09 0.01 0.00 0.36 0.00 0.00 54.97 54.89 2onf s GLU 132 Cb -0.32 -2.82 0.07 0.00 0.26 0.00 0.00 34.13 31.32 2onf s GLU 132 CO 0.27 -0.41 -0.03 0.42 -0.54 0.00 0.00 175.26 174.97 2onf s ILE 133 N 1.22 2.53 -0.20 -3.70 1.01 -0.71 -5.00 121.20 116.35 2onf s ILE 133 Ca -0.02 -1.69 -0.04 0.00 0.00 0.00 0.00 60.65 58.91 2onf s ILE 133 Cb -0.17 -2.55 -0.01 0.00 0.01 0.00 0.00 42.46 39.74 2onf s ILE 133 CO -0.07 -0.18 -0.05 -0.69 0.00 0.00 0.00 174.94 173.95 2onf s VAL 134 N 1.12 3.51 0.26 2.92 1.01 -1.26 -0.73 120.40 127.23 2onf s VAL 134 Ca -0.04 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.50 2onf s VAL 134 Cb -0.20 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.58 2onf s VAL 134 CO -0.04 0.44 0.22 1.51 0.00 0.00 0.00 175.10 177.23 2onf s ASP 135 N 1.10 0.87 0.20 3.32 -4.77 -0.83 -4.98 116.67 111.58 2onf s ASP 135 Ca 0.01 -1.55 -0.18 0.00 -3.30 0.00 0.00 52.55 47.53 2onf s ASP 135 Cb -0.15 0.47 0.03 0.00 -1.09 0.00 0.00 42.92 42.19 2onf s ASP 135 CO -0.00 -0.96 0.54 -0.72 0.70 0.00 0.00 175.17 174.72 2onf s TYR 136 N -3.79 -0.17 0.02 2.11 -0.85 -1.26 -1.48 117.35 111.93 2onf s TYR 136 Ca 0.39 -0.17 -0.02 0.00 -0.52 0.00 0.00 57.07 56.75 2onf s TYR 136 Cb 0.04 0.42 -0.02 0.00 0.38 0.00 0.00 41.96 42.79 2onf s TYR 136 CO 0.19 -0.93 0.02 -1.83 -1.52 0.00 0.00 175.55 171.48 2onf s GLU 137 N -3.86 0.43 -0.01 -3.49 -1.05 -0.01 -4.93 118.70 105.77 2onf s GLU 137 Ca 0.08 -0.69 -0.19 0.00 -0.15 0.00 0.00 54.97 54.02 2onf s GLU 137 Cb -0.01 0.16 -0.05 0.00 -0.44 0.00 0.00 34.13 33.78 2onf s GLU 137 CO -0.03 -0.08 0.55 -0.06 0.95 0.00 0.00 175.26 176.59 2onf s PHE 138 N -2.01 3.67 -0.67 4.83 0.08 -1.26 -1.36 117.98 121.26 2onf s PHE 138 Ca -0.11 1.14 0.05 0.00 0.12 0.00 0.00 56.93 58.14 2onf s PHE 138 Cb -0.06 -2.55 0.04 0.00 -0.57 0.00 0.00 43.02 39.88 2onf s PHE 138 CO -0.03 0.38 0.67 1.33 -0.10 0.00 0.00 175.22 177.47