#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 -0.55 -0.17 1.61 5.65 -1.26 -5.35 115.29 115.21 2onf s HIS 2 Ca 0.00 1.25 -0.05 0.00 0.25 0.00 0.00 55.06 56.51 2onf s HIS 2 Cb 0.00 0.37 -0.03 0.00 -1.18 0.00 0.00 32.58 31.74 2onf s HIS 2 CO 0.00 -0.27 -0.01 0.08 -0.65 0.00 0.00 174.74 173.89 2onf s VAL 3 N 0.64 4.09 -0.10 0.89 1.01 -1.26 -5.10 120.40 120.58 2onf s VAL 3 Ca -0.01 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 61.72 2onf s VAL 3 Cb -0.05 -2.82 0.00 0.00 0.00 0.00 0.00 36.38 33.52 2onf s VAL 3 CO -0.09 0.47 -0.23 -0.31 0.00 0.00 0.00 175.10 174.93 2onf s TYR 4 N 0.53 2.54 0.04 5.22 2.02 -1.26 -5.13 117.35 121.32 2onf s TYR 4 Ca -0.01 -1.07 0.08 0.00 -0.37 0.00 0.00 57.07 55.70 2onf s TYR 4 Cb -0.14 -1.71 -0.03 0.00 -0.40 0.00 0.00 41.96 39.69 2onf s TYR 4 CO 0.02 -0.44 -0.23 -1.21 -1.57 0.00 0.00 175.55 172.12 2onf s GLU 5 N 0.41 1.58 0.29 -0.62 2.02 -1.26 -5.14 118.70 115.99 2onf s GLU 5 Ca -0.17 -1.01 -0.11 0.00 0.02 0.00 0.00 54.97 53.70 2onf s GLU 5 Cb -0.18 -1.72 0.01 0.00 0.10 0.00 0.00 34.13 32.34 2onf s GLU 5 CO 0.07 0.44 0.53 -1.54 0.02 0.00 0.00 175.26 174.79 2onf s SER 6 N -1.19 0.19 0.04 -0.19 1.04 -1.26 -4.80 113.70 107.53 2onf s SER 6 Ca 0.09 -1.10 0.04 0.00 0.48 0.00 0.00 55.95 55.46 2onf s SER 6 Cb -0.09 0.65 -0.02 0.00 0.10 0.00 0.00 66.02 66.66 2onf s SER 6 CO 0.02 -1.27 -0.12 -1.81 0.98 0.00 0.00 173.24 171.04 2onf s ASP 7 N -3.08 1.36 -0.03 7.02 1.01 -0.61 -5.02 116.67 117.31 2onf s ASP 7 Ca 0.23 -0.45 -0.01 0.00 0.71 0.00 0.00 52.55 53.03 2onf s ASP 7 Cb -0.01 -0.06 0.03 0.00 1.01 0.00 0.00 42.92 43.88 2onf s ASP 7 CO 0.12 -0.03 0.05 -0.69 0.21 0.00 0.00 175.17 174.84 2onf s VAL 8 N -0.92 -0.09 0.21 -1.27 1.01 -1.26 -0.39 120.40 117.69 2onf s VAL 8 Ca -0.01 0.33 0.11 0.00 0.00 0.00 0.00 61.98 62.40 2onf s VAL 8 Cb -0.08 -0.12 -0.05 0.00 0.00 0.00 0.00 36.38 36.14 2onf s VAL 8 CO 0.01 0.14 -0.22 -0.94 0.00 0.00 0.00 175.10 174.09 2onf s SER 9 N 1.64 3.30 -0.12 3.32 1.04 -0.61 -4.96 113.70 117.31 2onf s SER 9 Ca -0.02 -0.91 -0.29 0.00 0.48 0.00 0.00 55.95 55.22 2onf s SER 9 Cb -0.12 -0.24 -0.01 0.00 0.10 0.00 0.00 66.02 65.74 2onf s SER 9 CO -0.03 0.07 0.99 0.86 0.98 0.00 0.00 173.24 176.10 2onf s TRP 10 N -1.97 3.49 0.00 5.02 -0.00 -1.26 -1.14 118.94 123.08 2onf s TRP 10 Ca 0.22 1.54 0.00 0.00 -0.00 0.00 0.00 56.10 57.86 2onf s TRP 10 Cb -0.07 -3.17 0.00 0.00 -0.00 0.00 0.00 33.47 30.23 2onf s TRP 10 CO 0.10 -0.25 0.00 -0.89 -0.00 0.00 0.00 176.95 175.92 2onf n ILE 11 N 4.63 0.00 -3.81 5.86 5.41 -0.37 -4.93 119.36 126.16 2onf n ILE 11 Ca 0.08 0.46 -0.02 0.00 1.00 0.00 0.00 62.75 64.27 2onf n ILE 11 Cb 0.48 -1.38 0.00 0.00 -0.71 0.00 0.00 39.64 38.04 2onf n ILE 11 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2onf s ASP 12 N -2.91 -0.07 0.85 4.38 -1.08 -1.24 -5.04 116.67 111.56 2onf s ASP 12 Ca 0.00 -0.47 0.00 0.00 -0.52 0.00 0.00 52.55 51.56 2onf s ASP 12 Cb 0.00 0.42 0.00 0.00 -1.46 0.00 0.00 42.92 41.88 2onf s ASP 12 CO 0.00 -0.81 0.00 0.47 0.52 0.00 0.00 175.17 175.35 2onf n ASP 13 N -0.84 0.00 -2.64 -0.34 8.00 -1.26 -0.90 116.55 118.56 2onf n ASP 13 Ca -0.04 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.12 2onf n ASP 13 Cb 0.60 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.73 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 3.07 -5.07 -1.24 5.12 -1.26 -5.01 116.66 126.28 2onf n ARG 14 Ca 0.00 -3.94 -0.29 0.00 -1.93 0.00 0.00 57.85 51.69 2onf n ARG 14 Cb 0.00 -2.26 -0.16 0.00 -1.16 0.00 0.00 32.46 28.87 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 -3.81 2.12 0.11 5.56 0.52 -0.08 -1.71 118.95 121.66 2onf s ARG 15 Ca 0.51 -0.77 0.06 0.00 -0.52 0.00 0.00 55.73 55.01 2onf s ARG 15 Cb 0.43 -1.85 -0.04 0.00 0.52 0.00 0.00 34.95 34.01 2onf s ARG 15 CO -0.27 0.35 -0.15 0.95 0.02 0.00 0.00 175.30 176.20 2onf s THR 16 N -0.15 1.31 -0.17 0.02 -4.23 -0.74 -1.24 115.64 110.45 2onf s THR 16 Ca -0.01 -1.62 0.00 0.00 -1.18 0.00 0.00 61.69 58.87 2onf s THR 16 Cb -0.12 -1.44 0.01 0.00 1.34 0.00 0.00 72.50 72.28 2onf s THR 16 CO 0.02 -0.35 -0.16 -0.70 -0.54 0.00 0.00 174.62 172.89 2onf s GLU 17 N -2.43 3.14 -0.10 3.99 2.12 -0.29 -0.91 118.70 124.23 2onf s GLU 17 Ca 0.07 -0.77 -0.19 0.00 0.36 0.00 0.00 54.97 54.44 2onf s GLU 17 Cb -0.06 -2.63 -0.04 0.00 0.26 0.00 0.00 34.13 31.66 2onf s GLU 17 CO 0.03 -0.07 0.50 0.08 -0.54 0.00 0.00 175.26 175.26 2onf s VAL 18 N 1.02 5.14 -0.16 3.70 1.01 0.14 -1.57 120.40 129.68 2onf s VAL 18 Ca -0.02 1.02 0.02 0.00 0.00 0.00 0.00 61.98 63.00 2onf s VAL 18 Cb -0.15 -3.84 0.02 0.00 0.00 0.00 0.00 36.38 32.41 2onf s VAL 18 CO -0.04 0.34 -0.21 -0.44 0.00 0.00 0.00 175.10 174.75 2onf s SER 19 N 0.46 3.12 -0.15 3.32 0.01 0.48 -0.44 113.70 120.51 2onf s SER 19 Ca 0.27 -0.63 -0.01 0.00 1.31 0.00 0.00 55.95 56.89 2onf s SER 19 Cb -0.16 -1.47 0.04 0.00 0.21 0.00 0.00 66.02 64.65 2onf s SER 19 CO 0.12 0.03 -0.01 -0.69 0.41 0.00 0.00 173.24 173.10 2onf s VAL 20 N 1.11 0.76 0.00 3.43 1.01 -0.86 -1.58 120.40 124.27 2onf s VAL 20 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.55 2onf s VAL 20 Cb -0.14 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.21 2onf s VAL 20 CO -0.09 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.68 2onf n GLY 21 N 4.99 3.61 0.35 4.51 0.00 -1.26 -0.85 105.19 116.54 2onf n GLY 21 Ca -0.10 0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.06 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 5.37 1.26 -4.74 1.61 9.92 -1.26 -4.90 116.55 123.81 2onf n ASP 22 Ca 0.00 -1.15 -0.41 0.00 -0.53 0.00 0.00 54.79 52.70 2onf n ASP 22 Cb 0.00 0.09 -0.04 0.00 -0.64 0.00 0.00 41.12 40.52 2onf n ASP 22 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 2onf s HIS 23 N -2.30 3.73 -0.08 1.24 3.76 -0.03 -5.06 115.29 116.56 2onf s HIS 23 Ca 0.29 1.73 0.03 0.00 -0.15 0.00 0.00 55.06 56.97 2onf s HIS 23 Cb 0.20 -3.15 0.00 0.00 1.11 0.00 0.00 32.58 30.74 2onf s HIS 23 CO 0.45 -0.15 -0.18 1.03 -0.85 0.00 0.00 174.74 175.03 2onf s ARG 24 N -0.46 2.33 -0.05 1.40 1.81 -1.26 -2.02 118.95 120.70 2onf s ARG 24 Ca 0.47 -0.66 0.01 0.00 -1.72 0.00 0.00 55.73 53.82 2onf s ARG 24 Cb -0.27 -1.84 0.02 0.00 -0.45 0.00 0.00 34.95 32.41 2onf s ARG 24 CO 0.33 0.14 -0.03 0.42 -0.68 0.00 0.00 175.30 175.48 2onf s ILE 25 N 0.41 0.45 -0.19 1.52 1.01 0.42 -4.98 121.20 119.83 2onf s ILE 25 Ca -0.15 -0.05 -0.23 0.00 0.00 0.00 0.00 60.65 60.22 2onf s ILE 25 Cb -0.16 -0.50 -0.02 0.00 0.01 0.00 0.00 42.46 41.79 2onf s ILE 25 CO 0.06 0.21 0.76 -0.70 0.00 0.00 0.00 174.94 175.27 2onf s GLU 26 N 1.08 4.24 -0.08 2.79 2.12 -1.26 0.26 118.70 127.85 2onf s GLU 26 Ca -0.09 0.85 0.00 0.00 0.36 0.00 0.00 54.97 56.10 2onf s GLU 26 Cb -0.14 -3.59 0.02 0.00 0.26 0.00 0.00 34.13 30.69 2onf s GLU 26 CO -0.01 -0.33 -0.06 0.08 -0.54 0.00 0.00 175.26 174.40 2onf s VAL 27 N 2.18 0.79 0.24 3.70 1.01 -0.09 -3.95 120.40 124.28 2onf s VAL 27 Ca 0.34 -0.18 0.04 0.00 0.00 0.00 0.00 61.98 62.18 2onf s VAL 27 Cb -0.16 -0.83 -0.05 0.00 0.00 0.00 0.00 36.38 35.34 2onf s VAL 27 CO 0.11 0.31 -0.01 -1.81 0.00 0.00 0.00 175.10 173.70 2onf s ASP 28 N 1.47 1.96 0.67 3.32 1.01 -0.04 -1.79 116.67 123.26 2onf s ASP 28 Ca -0.01 -1.21 -0.17 0.00 0.71 0.00 0.00 52.55 51.87 2onf s ASP 28 Cb -0.13 -0.02 -0.01 0.00 1.01 0.00 0.00 42.92 43.78 2onf s ASP 28 CO -0.04 -0.49 1.17 -1.20 0.21 0.00 0.00 175.17 174.82 2onf n SER 29 N -0.44 1.47 -4.75 0.27 7.64 -0.70 -4.00 113.62 113.11 2onf n SER 29 Ca -0.05 0.77 -0.29 0.00 1.01 0.00 0.00 58.87 60.31 2onf n SER 29 Cb 0.64 -1.50 0.14 0.00 -1.01 0.00 0.00 64.21 62.48 2onf n SER 29 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2onf s PRO 30 N -3.32 1.16 0.32 1.43 0.04 -1.26 -3.64 135.00 129.73 2onf s PRO 30 Ca 0.79 0.51 0.06 0.00 0.04 0.00 0.00 61.00 62.40 2onf s PRO 30 Cb -0.37 -1.82 0.72 0.00 0.04 0.00 0.00 34.50 33.06 2onf s PRO 30 CO 0.44 -2.23 1.83 -1.35 0.04 0.00 0.00 177.00 175.73 2onf h PRO 31 N -1.53 0.78 0.00 0.56 0.11 -1.75 -0.34 132.00 129.83 2onf h PRO 31 Ca -0.51 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.56 2onf h PRO 31 Cb 1.31 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2onf h PRO 31 CO 0.59 0.52 0.08 1.05 -0.21 0.00 0.00 178.00 180.03 2onf h GLU 32 N 0.80 0.00 0.00 1.05 4.11 -1.93 -2.23 114.58 116.39 2onf h GLU 32 Ca 0.51 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.93 2onf h GLU 32 Cb 0.73 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 2onf h GLU 32 CO -0.28 0.00 -0.31 1.19 0.07 0.00 0.00 179.01 179.68 2onf n PHE 33 N -3.00 0.00 -0.45 2.06 3.72 -0.28 -4.98 117.46 114.54 2onf n PHE 33 Ca -0.03 -1.14 0.00 0.00 -0.05 0.00 0.00 57.45 56.23 2onf n PHE 33 Cb 0.14 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.49 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 -1.11 0.74 4.01 1.37 0.00 -0.84 -4.80 105.19 104.55 2onf n GLY 34 Ca 0.16 -0.31 -0.19 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.28 1.87 0.62 -0.02 0.00 -0.37 -4.43 107.32 102.71 2onf s GLY 35 Ca 0.00 -1.69 -0.11 0.00 0.00 0.00 0.00 44.72 42.92 2onf s GLY 35 CO 0.00 -1.41 1.03 2.56 0.00 0.00 0.00 173.10 175.28 2onf s PRO 36 N -4.56 3.59 0.58 2.90 0.04 -1.26 -3.62 135.00 132.67 2onf s PRO 36 Ca 0.58 0.76 -0.16 0.00 0.04 0.00 0.00 61.00 62.22 2onf s PRO 36 Cb -0.09 -2.08 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 2onf s PRO 36 CO 0.36 -0.58 1.05 -1.21 0.04 0.00 0.00 177.00 176.66 2onf s GLU 37 N -5.16 3.41 -0.17 4.56 0.41 -1.26 -4.33 118.70 116.17 2onf s GLU 37 Ca 0.55 1.18 0.00 0.00 -0.41 0.00 0.00 54.97 56.29 2onf s GLU 37 Cb -0.11 -2.05 0.00 0.00 -1.78 0.00 0.00 34.13 30.19 2onf s GLU 37 CO 0.54 -0.73 0.00 0.41 -0.49 0.00 0.00 175.26 174.98 2onf n GLY 38 N -1.03 0.47 3.43 -1.39 0.00 -1.26 -5.03 105.19 100.37 2onf n GLY 38 Ca 0.08 -0.98 -0.21 0.00 0.00 0.00 0.00 46.02 44.91 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 -2.50 1.55 0.46 1.61 -1.52 -1.26 -5.14 119.66 112.87 2onf s GLN 39 Ca 0.00 -1.78 -0.24 0.00 -1.95 0.00 0.00 55.36 51.39 2onf s GLN 39 Cb 0.00 -1.19 -0.07 0.00 -0.22 0.00 0.00 33.01 31.53 2onf s GLN 39 CO 0.00 0.06 1.25 -0.51 -0.25 0.00 0.00 175.29 175.83 2onf s LEU 40 N -3.45 4.03 0.10 2.90 1.43 -1.25 -4.94 118.68 117.50 2onf s LEU 40 Ca 0.29 2.51 0.04 0.00 -1.03 0.00 0.00 54.13 55.94 2onf s LEU 40 Cb 0.03 -4.15 -0.04 0.00 0.03 0.00 0.00 46.19 42.06 2onf s LEU 40 CO 0.12 -1.05 -0.10 -0.31 0.23 0.00 0.00 176.35 175.23 2onf s TYR 41 N -1.40 1.08 0.43 0.29 2.02 -1.26 -0.86 117.35 117.64 2onf s TYR 41 Ca 0.64 -0.66 0.09 0.00 -0.37 0.00 0.00 57.07 56.77 2onf s TYR 41 Cb -0.34 -0.59 0.94 0.00 -0.40 0.00 0.00 41.96 41.58 2onf s TYR 41 CO 0.42 0.00 2.08 -1.35 -1.57 0.00 0.00 175.55 175.13 2onf h PRO 42 N 3.53 0.43 -0.04 -1.71 0.11 -1.94 0.32 132.00 132.71 2onf h PRO 42 Ca -0.37 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.72 2onf h PRO 42 Cb 1.19 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2onf h PRO 42 CO 0.53 0.29 0.04 0.93 -0.21 0.00 0.00 178.00 179.58 2onf h GLU 43 N 0.45 0.00 0.00 1.05 3.07 -1.96 -1.25 114.58 115.94 2onf h GLU 43 Ca 0.12 0.00 -0.34 0.00 -0.50 0.00 0.00 59.36 58.65 2onf h GLU 43 Cb -0.04 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 27.81 2onf h GLU 43 CO -0.03 0.00 -2.28 0.25 -1.40 0.00 0.00 179.01 175.55 2onf n THR 44 N -3.97 1.29 -0.13 1.13 -2.24 -0.94 -4.48 114.28 104.95 2onf n THR 44 Ca -0.02 -0.51 -0.12 0.00 -2.27 0.00 0.00 64.05 61.14 2onf n THR 44 Cb 0.13 -1.27 -0.02 0.00 -2.10 0.00 0.00 70.33 67.07 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 0.81 -0.11 3.22 5.85 -0.89 -2.15 115.31 122.04 2onf h LEU 45 Ca -0.50 -0.40 -0.03 0.00 0.84 0.00 0.00 57.88 57.79 2onf h LEU 45 Cb 1.80 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.60 2onf h LEU 45 CO -0.07 1.03 -0.03 0.15 -0.34 0.00 0.00 178.44 179.18 2onf h PHE 46 N 0.60 0.25 -0.68 1.25 3.57 -1.44 0.14 116.94 120.62 2onf h PHE 46 Ca 0.09 -0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.56 2onf h PHE 46 Cb 0.71 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.36 2onf h PHE 46 CO 0.06 0.52 0.45 -1.35 -2.23 0.00 0.00 178.31 175.76 2onf h PRO 47 N -0.10 0.84 -0.78 6.41 0.11 -1.75 -0.68 132.00 136.05 2onf h PRO 47 Ca 0.03 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.04 2onf h PRO 47 Cb 0.44 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.33 2onf h PRO 47 CO 0.01 0.55 0.28 0.77 -0.21 0.00 0.00 178.00 179.40 2onf h SER 48 N 0.86 1.10 0.01 -2.05 0.02 -1.13 -1.75 113.55 110.62 2onf h SER 48 Ca 0.26 -0.19 -0.15 0.00 -0.84 0.00 0.00 61.79 60.87 2onf h SER 48 Cb -0.01 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.24 2onf h SER 48 CO -0.07 0.99 -0.51 0.58 -1.14 0.00 0.00 176.83 176.69 2onf h VAL 49 N 1.14 1.32 -0.26 2.27 2.07 -0.52 -0.01 116.25 122.26 2onf h VAL 49 Ca 0.25 -1.73 0.06 0.00 0.82 0.00 0.00 66.70 66.10 2onf h VAL 49 Cb 0.26 1.71 -0.07 0.00 -1.52 0.00 0.00 31.29 31.68 2onf h VAL 49 CO -0.02 0.54 -0.17 0.25 0.02 0.00 0.00 177.57 178.19 2onf h LEU 50 N 0.43 -0.56 -1.04 2.57 5.85 -0.93 0.40 115.31 122.03 2onf h LEU 50 Ca 0.02 0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 2onf h LEU 50 Cb 1.04 0.29 -0.03 0.00 0.37 0.00 0.00 40.66 42.33 2onf h LEU 50 CO 0.10 -0.21 0.22 0.00 -0.34 0.00 0.00 178.44 178.20 2onf h ALA 51 N 1.01 1.23 -0.44 1.25 0.00 -0.84 -0.21 119.26 121.26 2onf h ALA 51 Ca 0.14 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2onf h ALA 51 Cb 0.37 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2onf h ALA 51 CO -0.36 0.55 0.29 0.77 0.00 0.00 0.00 179.25 180.50 2onf h SER 52 N 0.89 0.49 -0.60 0.00 0.02 -0.75 -2.11 113.55 111.48 2onf h SER 52 Ca 0.21 -0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 61.10 2onf h SER 52 Cb 0.21 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 2onf h SER 52 CO -0.01 0.35 0.19 0.00 -1.14 0.00 0.00 176.83 176.22 2onf h LEU 54 N 0.86 0.15 0.01 0.00 5.85 -0.95 -0.49 115.31 120.74 2onf h LEU 54 Ca 0.20 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 59.01 2onf h LEU 54 Cb 0.29 0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2onf h LEU 54 CO -0.01 0.08 -0.00 0.25 -0.34 0.00 0.00 178.44 178.42 2onf h LEU 55 N 0.35 -0.01 -1.60 2.25 5.85 -1.04 -0.90 115.31 120.21 2onf h LEU 55 Ca 0.32 -0.37 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 2onf h LEU 55 Cb 0.43 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 2onf h LEU 55 CO -0.35 0.37 0.18 0.71 -0.34 0.00 0.00 178.44 179.01 2onf h THR 56 N -0.39 1.11 -0.19 1.05 1.35 -0.70 0.62 112.91 115.75 2onf h THR 56 Ca -0.00 -0.27 -0.04 0.00 -0.55 0.00 0.00 66.41 65.55 2onf h THR 56 Cb 0.38 0.65 -0.01 0.00 -1.73 0.00 0.00 68.15 67.45 2onf h THR 56 CO 0.00 0.12 -0.04 0.74 -0.25 0.00 0.00 175.52 176.09 2onf h THR 57 N 0.46 1.28 -0.69 6.82 2.02 -0.96 -2.52 112.91 119.32 2onf h THR 57 Ca 0.12 -1.00 0.09 0.00 0.77 0.00 0.00 66.41 66.39 2onf h THR 57 Cb 0.01 1.54 -0.07 0.00 -1.74 0.00 0.00 68.15 67.90 2onf h THR 57 CO -0.02 0.30 0.34 0.15 0.37 0.00 0.00 175.52 176.66 2onf h PHE 58 N 0.09 0.62 -0.44 3.16 3.57 -0.74 -1.97 116.94 121.23 2onf h PHE 58 Ca 0.05 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 2onf h PHE 58 Cb 0.47 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 2onf h PHE 58 CO 0.05 0.24 0.24 -0.07 -2.23 0.00 0.00 178.31 176.53 2onf h LEU 59 N 0.60 0.52 -0.53 0.59 3.38 -0.72 0.23 115.31 119.37 2onf h LEU 59 Ca 0.33 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 58.15 2onf h LEU 59 Cb 0.33 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2onf h LEU 59 CO -0.25 0.43 -0.15 -0.08 0.09 0.00 0.00 178.44 178.48 2onf h GLU 60 N 0.60 1.03 -0.08 1.13 4.81 -0.94 -2.75 114.58 118.38 2onf h GLU 60 Ca 0.16 -0.40 -0.17 0.00 -0.13 0.00 0.00 59.36 58.81 2onf h GLU 60 Cb 0.02 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 2onf h GLU 60 CO -0.03 1.09 -0.70 0.74 -0.73 0.00 0.00 179.01 179.39 2onf h PHE 61 N 0.91 0.50 -0.30 0.92 0.04 -0.78 -2.28 116.94 115.94 2onf h PHE 61 Ca 0.13 -0.21 -0.09 0.00 2.80 0.00 0.00 57.97 60.60 2onf h PHE 61 Cb 0.72 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.78 2onf h PHE 61 CO 0.05 0.95 -0.20 1.57 -0.60 0.00 0.00 178.31 180.08 2onf h LYS 62 N 0.26 0.56 -0.22 1.51 5.09 -0.51 -2.61 116.57 120.66 2onf h LYS 62 Ca -0.02 -0.20 -0.20 0.00 0.09 0.00 0.00 60.65 60.32 2onf h LYS 62 Cb 1.26 -0.04 0.00 0.00 0.10 0.00 0.00 32.23 33.55 2onf h LYS 62 CO 0.12 0.73 -0.65 -0.44 -2.09 0.00 0.00 179.45 177.12 2onf h ASP 63 N 0.50 0.90 0.00 7.07 3.32 -1.51 -0.39 116.42 126.32 2onf h ASP 63 Ca 0.08 -0.53 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2onf h ASP 63 Cb 0.63 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.92 2onf h ASP 63 CO 0.04 1.32 0.00 0.54 -1.72 0.00 0.00 179.24 179.42 2onf n ARG 64 N -3.96 0.05 -1.35 3.56 1.74 -0.86 -4.77 116.66 111.06 2onf n ARG 64 Ca -0.05 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 56.99 2onf n ARG 64 Cb 0.68 -1.10 -0.02 0.00 -1.02 0.00 0.00 32.46 30.99 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 0.56 0.82 3.75 -0.13 0.00 -0.78 -5.09 105.19 104.32 2onf n GLY 66 Ca 0.00 -0.30 -0.40 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.14 4.72 -0.55 -0.61 1.01 -0.23 -5.02 121.20 120.38 2onf s ILE 67 Ca 0.11 1.58 -0.18 0.00 0.00 0.00 0.00 60.65 62.17 2onf s ILE 67 Cb 0.16 -4.09 0.10 0.00 0.01 0.00 0.00 42.46 38.64 2onf s ILE 67 CO -0.06 0.39 0.59 0.21 0.00 0.00 0.00 174.94 176.07 2onf s ASN 68 N -0.19 6.19 -0.09 3.58 3.84 -1.26 -4.63 114.94 122.37 2onf s ASN 68 Ca 0.37 -1.47 -0.26 0.00 0.21 0.00 0.00 52.86 51.71 2onf s ASN 68 Cb -0.20 -2.26 -0.03 0.00 -0.55 0.00 0.00 41.25 38.21 2onf s ASN 68 CO 0.22 -0.95 0.82 -0.22 -2.79 0.00 0.00 177.10 174.18 2onf s LEU 69 N 2.21 4.27 -0.23 3.21 2.96 -1.26 -3.54 118.68 126.31 2onf s LEU 69 Ca 0.08 1.29 -0.02 0.00 -0.22 0.00 0.00 54.13 55.26 2onf s LEU 69 Cb -0.25 -3.26 -0.18 0.00 0.50 0.00 0.00 46.19 42.99 2onf s LEU 69 CO 0.06 -0.26 -0.11 0.29 -1.32 0.00 0.00 176.35 175.00 2onf n LYS 70 N 4.39 0.66 -3.54 1.98 5.02 0.12 -5.01 118.16 121.79 2onf n LYS 70 Ca 0.03 0.20 -0.13 0.00 -2.02 0.00 0.00 58.31 56.39 2onf n LYS 70 Cb 0.50 -1.56 -0.04 0.00 -0.02 0.00 0.00 35.03 33.91 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 -6.75 -0.44 -0.18 4.39 1.04 -0.89 -4.94 113.70 105.93 2onf s SER 71 Ca -0.33 0.03 -0.07 0.00 0.48 0.00 0.00 55.95 56.07 2onf s SER 71 Cb 0.09 0.52 0.08 0.00 0.10 0.00 0.00 66.02 66.82 2onf s SER 71 CO 0.62 -0.82 0.38 0.86 0.98 0.00 0.00 173.24 175.26 2onf s TRP 72 N -3.11 -0.69 -0.02 5.02 -0.11 -1.26 -1.12 118.94 117.65 2onf s TRP 72 Ca -0.02 1.37 0.03 0.00 1.22 0.00 0.00 56.10 58.71 2onf s TRP 72 Cb -0.00 0.23 -0.00 0.00 -1.50 0.00 0.00 33.47 32.19 2onf s TRP 72 CO -0.07 -0.44 -0.10 -0.80 -4.62 0.00 0.00 176.95 170.92 2onf s ASN 73 N 2.42 1.26 0.01 5.86 0.01 -0.67 -5.00 114.94 118.83 2onf s ASN 73 Ca -0.02 -0.20 0.01 0.00 -0.71 0.00 0.00 52.86 51.95 2onf s ASN 73 Cb -0.12 -0.24 -0.01 0.00 0.41 0.00 0.00 41.25 41.29 2onf s ASN 73 CO -0.12 0.10 -0.05 -0.94 -1.51 0.00 0.00 177.10 174.58 2onf s SER 74 N -0.03 0.56 -0.13 -1.22 1.04 -1.26 -0.17 113.70 112.48 2onf s SER 74 Ca 0.00 -0.26 -0.02 0.00 0.48 0.00 0.00 55.95 56.16 2onf s SER 74 Cb -0.06 -0.01 -0.03 0.00 0.10 0.00 0.00 66.02 66.02 2onf s SER 74 CO 0.00 -0.06 -0.06 -2.28 0.98 0.00 0.00 173.24 171.82 2onf s HIS 75 N -0.61 2.96 -0.11 5.02 2.46 -0.14 -4.95 115.29 119.92 2onf s HIS 75 Ca -0.04 -0.31 0.02 0.00 0.47 0.00 0.00 55.06 55.21 2onf s HIS 75 Cb -0.05 -1.88 -0.01 0.00 -0.13 0.00 0.00 32.58 30.51 2onf s HIS 75 CO -0.00 0.00 -0.20 0.08 -2.47 0.00 0.00 174.74 172.16 2onf s VAL 76 N 0.11 2.46 -0.19 0.89 1.01 -1.26 -1.07 120.40 122.35 2onf s VAL 76 Ca -0.02 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.09 2onf s VAL 76 Cb -0.14 -1.98 0.04 0.00 0.00 0.00 0.00 36.38 34.30 2onf s VAL 76 CO 0.03 0.55 -0.10 -0.89 0.00 0.00 0.00 175.10 174.68 2onf s THR 77 N 0.33 1.60 -0.14 3.92 2.01 -0.17 -4.99 115.64 118.21 2onf s THR 77 Ca -0.16 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 60.88 2onf s THR 77 Cb -0.17 -1.66 -0.03 0.00 0.01 0.00 0.00 72.50 70.65 2onf s THR 77 CO 0.08 0.20 -0.04 0.00 -0.69 0.00 0.00 174.62 174.17 2onf s ALA 78 N 1.42 3.03 -0.18 7.40 0.00 -1.26 -0.44 121.76 131.72 2onf s ALA 78 Ca -0.00 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.14 2onf s ALA 78 Cb -0.16 -1.50 0.02 0.00 0.00 0.00 0.00 23.12 21.48 2onf s ALA 78 CO -0.08 0.31 -0.18 -1.21 0.00 0.00 0.00 175.76 174.59 2onf s GLU 79 N 0.06 3.04 -0.04 0.00 2.02 0.18 -5.01 118.70 118.94 2onf s GLU 79 Ca -0.00 -0.81 -0.02 0.00 0.02 0.00 0.00 54.97 54.16 2onf s GLU 79 Cb -0.13 -2.61 -0.04 0.00 0.10 0.00 0.00 34.13 31.45 2onf s GLU 79 CO 0.03 -0.19 0.07 -1.17 0.02 0.00 0.00 175.26 174.02 2onf s LEU 80 N 1.26 3.92 0.39 1.80 2.96 -1.26 -0.87 118.68 126.88 2onf s LEU 80 Ca 0.04 0.21 -0.14 0.00 -0.22 0.00 0.00 54.13 54.02 2onf s LEU 80 Cb -0.13 -2.13 0.05 0.00 0.50 0.00 0.00 46.19 44.48 2onf s LEU 80 CO -0.11 0.32 0.77 -0.83 -1.32 0.00 0.00 176.35 175.18 2onf s GLY 81 N -1.41 0.53 0.36 7.98 0.00 -0.33 -4.88 107.32 109.58 2onf s GLY 81 Ca 0.19 -0.87 -0.27 0.00 0.00 0.00 0.00 44.72 43.77 2onf s GLY 81 CO 0.09 -0.40 1.19 -1.05 0.00 0.00 0.00 173.10 172.94 2onf n PRO 82 N -0.54 1.83 -4.04 2.90 -0.02 -1.26 -1.08 135.00 132.79 2onf n PRO 82 Ca -0.08 0.65 -0.34 0.00 -2.02 0.00 0.00 63.50 61.71 2onf n PRO 82 Cb 0.60 -2.21 -0.06 0.00 -0.02 0.00 0.00 33.50 31.81 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 -0.46 5.91 0.23 2.55 0.15 -0.35 -4.66 113.70 117.06 2onf s SER 83 Ca 0.58 0.23 0.17 0.00 0.70 0.00 0.00 55.95 57.64 2onf s SER 83 Cb -0.58 -1.76 0.88 0.00 -1.71 0.00 0.00 66.02 62.85 2onf s SER 83 CO 0.60 0.29 1.52 -0.81 1.20 0.00 0.00 173.24 176.04 2onf n PRO 84 N 1.27 0.11 -0.38 5.44 -0.04 -1.26 -1.71 135.00 138.43 2onf n PRO 84 Ca -0.14 0.57 0.06 0.00 -0.04 0.00 0.00 63.50 63.96 2onf n PRO 84 Cb 0.53 -1.83 0.23 0.00 -0.04 0.00 0.00 33.50 32.39 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 -2.07 2.69 -0.46 0.54 1.02 -1.26 -5.04 120.64 116.06 2onf n GLU 85 Ca -0.01 -1.84 0.06 0.00 -0.02 0.00 0.00 57.16 55.35 2onf n GLU 85 Cb 0.06 -1.63 -0.03 0.00 -0.02 0.00 0.00 31.44 29.82 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 0.69 -1.04 0.00 3.49 5.02 -0.69 -5.01 118.16 120.62 2onf n LYS 86 Ca 0.17 0.81 0.00 0.00 -2.02 0.00 0.00 58.31 57.27 2onf n LYS 86 Cb 0.59 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 34.38 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 -2.94 0.82 3.24 0.72 0.00 -1.26 -4.36 105.19 101.42 2onf n GLY 87 Ca -0.02 -0.74 -0.14 0.00 0.00 0.00 0.00 46.02 45.12 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 1.20 0.08 1.61 0.08 -1.26 -1.21 117.98 118.49 2onf s PHE 88 Ca 0.00 -0.91 -0.11 0.00 0.12 0.00 0.00 56.93 56.02 2onf s PHE 88 Cb 0.00 -0.67 0.01 0.00 -0.57 0.00 0.00 43.02 41.79 2onf s PHE 88 CO 0.00 -0.10 0.26 -1.59 -0.10 0.00 0.00 175.22 173.69 2onf s LYS 89 N -3.85 0.87 0.00 0.44 -2.85 -0.24 -4.71 119.74 109.42 2onf s LYS 89 Ca 0.20 -0.80 -0.30 0.00 -1.00 0.00 0.00 55.97 54.07 2onf s LYS 89 Cb 0.05 0.37 -0.07 0.00 -2.06 0.00 0.00 37.83 36.12 2onf s LYS 89 CO 0.02 -0.29 1.61 -0.06 0.10 0.00 0.00 175.35 176.72 2onf s PHE 90 N -3.52 2.29 -0.13 1.78 0.08 -1.26 -1.18 117.98 116.04 2onf s PHE 90 Ca 0.02 0.35 -0.18 0.00 0.12 0.00 0.00 56.93 57.24 2onf s PHE 90 Cb 0.03 -3.89 -0.25 0.00 -0.57 0.00 0.00 43.02 38.34 2onf s PHE 90 CO -0.09 -3.62 0.49 0.45 -0.10 0.00 0.00 175.22 172.35 2onf h HIS 91 N 8.78 0.29 -2.88 0.36 3.86 -1.34 -3.42 115.15 120.81 2onf h HIS 91 Ca -0.40 -0.21 -0.13 0.00 -1.16 0.00 0.00 60.37 58.46 2onf h HIS 91 Cb 1.19 -0.01 -0.24 0.00 1.06 0.00 0.00 27.41 29.40 2onf h HIS 91 CO 0.82 1.49 -0.30 1.03 0.86 0.00 0.00 177.93 181.83 2onf s ARG 92 N -2.43 0.43 -0.10 2.45 0.52 -1.15 -1.61 118.95 117.07 2onf s ARG 92 Ca -0.22 0.46 0.01 0.00 -0.52 0.00 0.00 55.73 55.46 2onf s ARG 92 Cb 0.04 0.21 0.02 0.00 0.52 0.00 0.00 34.95 35.74 2onf s ARG 92 CO 0.72 -0.06 -0.13 0.42 0.02 0.00 0.00 175.30 176.27 2onf s ILE 93 N 0.10 1.31 -0.07 1.52 1.01 0.24 -0.65 121.20 124.66 2onf s ILE 93 Ca -0.01 -0.53 0.03 0.00 0.00 0.00 0.00 60.65 60.13 2onf s ILE 93 Cb -0.03 -1.22 -0.02 0.00 0.01 0.00 0.00 42.46 41.20 2onf s ILE 93 CO 0.01 0.40 -0.14 -0.75 0.00 0.00 0.00 174.94 174.46 2onf s LYS 94 N 1.02 2.73 -0.17 2.79 2.47 0.41 -1.29 119.74 127.70 2onf s LYS 94 Ca -0.07 -0.69 -0.00 0.00 -1.56 0.00 0.00 55.97 53.65 2onf s LYS 94 Cb -0.15 -2.45 0.04 0.00 -1.46 0.00 0.00 37.83 33.82 2onf s LYS 94 CO -0.01 0.52 -0.05 0.42 0.16 0.00 0.00 175.35 176.39 2onf s ILE 95 N -0.47 1.13 -0.25 5.43 1.01 -0.12 -1.00 121.20 126.94 2onf s ILE 95 Ca 0.06 -0.64 -0.07 0.00 0.00 0.00 0.00 60.65 60.00 2onf s ILE 95 Cb -0.12 -1.30 -0.02 0.00 0.01 0.00 0.00 42.46 41.02 2onf s ILE 95 CO 0.02 0.13 0.06 -2.28 0.00 0.00 0.00 174.94 172.87 2onf s HIS 96 N 1.62 3.07 -0.17 3.97 2.46 -0.23 -1.83 115.29 124.19 2onf s HIS 96 Ca 0.01 -0.51 -0.07 0.00 0.47 0.00 0.00 55.06 54.95 2onf s HIS 96 Cb -0.15 -2.23 -0.04 0.00 -0.13 0.00 0.00 32.58 30.03 2onf s HIS 96 CO -0.08 -0.39 0.06 0.08 -2.47 0.00 0.00 174.74 171.94 2onf s VAL 97 N 1.59 4.82 -0.35 0.89 1.01 0.32 -0.96 120.40 127.73 2onf s VAL 97 Ca 0.06 -0.03 -0.11 0.00 0.00 0.00 0.00 61.98 61.91 2onf s VAL 97 Cb -0.15 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.08 2onf s VAL 97 CO 0.03 0.49 0.19 -0.54 0.00 0.00 0.00 175.10 175.26 2onf s LYS 98 N 0.15 3.10 -0.18 2.72 1.02 0.76 -1.02 119.74 126.29 2onf s LYS 98 Ca 0.05 -0.89 -0.04 0.00 0.02 0.00 0.00 55.97 55.11 2onf s LYS 98 Cb -0.12 -3.67 -0.02 0.00 -0.52 0.00 0.00 37.83 33.50 2onf s LYS 98 CO 0.00 -0.56 -0.03 0.42 -0.92 0.00 0.00 175.35 174.26 2onf s ILE 99 N 1.59 3.73 -0.31 2.17 1.01 -0.38 -1.68 121.20 127.35 2onf s ILE 99 Ca 0.04 -0.40 -0.10 0.00 0.00 0.00 0.00 60.65 60.18 2onf s ILE 99 Cb -0.18 -2.66 -0.02 0.00 0.01 0.00 0.00 42.46 39.61 2onf s ILE 99 CO 0.07 0.46 0.17 -0.83 0.00 0.00 0.00 174.94 174.81 2onf s GLY 100 N 0.80 1.89 0.08 6.18 0.00 -0.27 -1.06 107.32 114.94 2onf s GLY 100 Ca -0.01 -1.32 0.02 0.00 0.00 0.00 0.00 44.72 43.42 2onf s GLY 100 CO 0.02 0.69 -0.08 -1.34 0.00 0.00 0.00 173.10 172.39 2onf s VAL 101 N 1.66 0.72 0.22 1.40 -7.23 -1.26 0.13 120.40 116.04 2onf s VAL 101 Ca 0.05 -1.66 -0.31 0.00 -1.81 0.00 0.00 61.98 58.25 2onf s VAL 101 Cb -0.17 -1.35 -0.15 0.00 0.56 0.00 0.00 36.38 35.28 2onf s VAL 101 CO 0.08 -0.68 1.16 0.59 -0.31 0.00 0.00 175.10 175.93 2onf n ASN 102 N 0.46 1.60 -0.26 4.85 3.02 -1.23 -4.88 115.26 118.81 2onf n ASN 102 Ca -0.16 1.15 0.18 0.00 -0.03 0.00 0.00 54.58 55.73 2onf n ASN 102 Cb 0.59 -1.28 0.49 0.00 -0.61 0.00 0.00 39.78 38.97 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 3.07 0.45 0.65 6.41 3.32 -2.00 0.46 116.42 128.77 2onf h ASP 103 Ca -0.42 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.67 2onf h ASP 103 Cb 1.33 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.84 2onf h ASP 103 CO 0.68 0.18 0.00 1.05 -1.72 0.00 0.00 179.24 179.42 2onf h GLU 104 N 0.45 0.00 -0.00 3.56 4.11 -2.02 -2.78 114.58 117.89 2onf h GLU 104 Ca 0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.91 2onf h GLU 104 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2onf h GLU 104 CO -0.20 0.00 -0.51 -0.25 0.07 0.00 0.00 179.01 178.12 2onf n ASP 105 N -3.00 0.85 -0.14 3.06 8.00 0.15 -4.47 116.55 121.01 2onf n ASP 105 Ca -0.00 -0.65 -0.03 0.00 0.71 0.00 0.00 54.79 54.81 2onf n ASP 105 Cb 0.22 0.36 0.17 0.00 -0.02 0.00 0.00 41.12 41.85 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 0.53 0.86 0.00 -1.24 1.57 -1.52 -1.44 116.57 115.34 2onf h LYS 106 Ca 0.00 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 2onf h LYS 106 Cb 0.52 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2onf h LYS 106 CO 0.00 0.78 0.00 1.05 -0.57 0.00 0.00 179.45 180.71 2onf h GLU 107 N 0.82 0.00 0.00 3.15 4.11 -1.80 -2.10 114.58 118.77 2onf h GLU 107 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.61 2onf h GLU 107 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2onf h GLU 107 CO 0.00 0.00 -0.44 1.63 0.07 0.00 0.00 179.01 180.27 2onf n LYS 108 N -3.02 0.13 0.01 1.06 5.02 -0.54 -4.39 118.16 116.42 2onf n LYS 108 Ca -0.01 0.05 -0.12 0.00 -2.02 0.00 0.00 58.31 56.20 2onf n LYS 108 Cb 0.16 -1.59 0.01 0.00 -0.02 0.00 0.00 35.03 33.58 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 1.33 -0.71 -0.18 1.08 -1.38 -1.67 117.51 115.98 2onf h ILE 109 Ca 0.00 -1.96 0.09 0.00 -0.39 0.00 0.00 64.86 62.60 2onf h ILE 109 Cb 0.61 1.93 -0.07 0.00 -3.07 0.00 0.00 36.82 36.22 2onf h ILE 109 CO 0.00 0.61 0.36 -0.65 -0.69 0.00 0.00 178.15 177.78 2onf h PRO 110 N 0.42 0.60 -0.21 2.37 0.11 -1.77 -2.28 132.00 131.25 2onf h PRO 110 Ca -0.02 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.02 2onf h PRO 110 Cb 1.25 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2onf h PRO 110 CO 0.13 0.40 0.01 -0.09 -0.21 0.00 0.00 178.00 178.23 2onf h ARG 111 N 0.61 0.36 -0.07 1.05 2.43 -1.82 -1.32 114.38 115.63 2onf h ARG 111 Ca 0.35 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 2onf h ARG 111 Cb 0.35 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2onf h ARG 111 CO -0.26 0.54 0.00 0.00 -1.51 0.00 0.00 179.97 178.74 2onf n ALA 112 N -2.32 0.90 0.00 2.80 0.00 -0.64 -0.97 120.51 120.28 2onf n ALA 112 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2onf n ALA 112 Cb 0.22 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 0.46 0.00 -0.13 0.00 0.00 -0.50 -1.01 117.38 116.20 2onf n GLN 114 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.00 56.91 2onf n GLN 114 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 30.24 30.23 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 0.52 -0.55 1.69 3.38 -1.32 -0.00 115.31 119.03 2onf h LEU 115 Ca 0.00 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 57.87 2onf h LEU 115 Cb 0.00 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 2onf h LEU 115 CO 0.00 0.51 0.29 0.00 0.09 0.00 0.00 178.44 179.34 2onf h ALA 116 N 1.03 0.71 -0.24 1.53 0.00 -1.32 -1.22 119.26 119.74 2onf h ALA 116 Ca 0.13 0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 2onf h ALA 116 Cb 0.14 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2onf h ALA 116 CO -0.01 -0.04 -0.52 1.49 0.00 0.00 0.00 179.25 180.16 2onf h GLU 117 N 0.56 0.70 -0.38 0.00 4.81 -1.79 -1.00 114.58 117.49 2onf h GLU 117 Ca 0.24 -0.43 -0.03 0.00 -0.13 0.00 0.00 59.36 59.01 2onf h GLU 117 Cb 0.13 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2onf h GLU 117 CO -0.15 1.05 0.11 -0.22 -0.73 0.00 0.00 179.01 179.07 2onf h LYS 118 N 0.54 0.60 0.00 1.92 3.64 -0.74 -3.26 116.57 119.26 2onf h LYS 118 Ca 0.02 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 2onf h LYS 118 Cb 1.09 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 2onf h LYS 118 CO 0.11 0.62 -1.00 0.66 -2.27 0.00 0.00 179.45 177.56 2onf n TYR 119 N -4.61 0.27 -1.69 1.91 4.01 -0.48 -4.74 117.16 111.84 2onf n TYR 119 Ca -0.01 0.08 -0.51 0.00 -0.16 0.00 0.00 57.90 57.30 2onf n TYR 119 Cb 0.18 -0.44 -0.05 0.00 -0.31 0.00 0.00 39.34 38.72 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 8.42 0.72 -0.11 0.00 0.04 -1.90 -0.78 116.94 123.33 2onf h PHE 121 Ca -0.48 -0.09 -0.21 0.00 2.80 0.00 0.00 57.97 59.99 2onf h PHE 121 Cb 1.29 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 39.24 2onf h PHE 121 CO 0.83 0.69 -0.78 0.82 -0.60 0.00 0.00 178.31 179.27 2onf h ILE 122 N 0.64 1.32 -0.53 -0.55 2.04 -1.92 -1.40 117.51 117.12 2onf h ILE 122 Ca 0.13 -2.08 0.05 0.00 1.00 0.00 0.00 64.86 63.95 2onf h ILE 122 Cb 0.42 2.08 -0.05 0.00 -0.74 0.00 0.00 36.82 38.53 2onf h ILE 122 CO 0.02 0.64 0.27 0.28 0.00 0.00 0.00 178.15 179.36 2onf h SER 123 N 0.41 0.39 -0.95 1.72 0.02 -1.81 -2.01 113.55 111.32 2onf h SER 123 Ca -0.05 0.03 0.05 0.00 -0.84 0.00 0.00 61.79 60.98 2onf h SER 123 Cb 1.39 -0.04 -0.06 0.00 0.14 0.00 0.00 62.40 63.83 2onf h SER 123 CO 0.15 0.27 0.62 0.03 -1.14 0.00 0.00 176.83 176.76 2onf h ARG 124 N 0.52 1.13 0.00 3.45 3.08 -1.06 -2.77 114.38 118.73 2onf h ARG 124 Ca 0.23 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.18 2onf h ARG 124 Cb 0.14 -0.25 -0.00 0.00 0.08 0.00 0.00 29.97 29.93 2onf h ARG 124 CO -0.16 0.74 -0.15 0.00 -1.07 0.00 0.00 179.97 179.33 2onf h ALA 125 N 1.46 1.47 -0.13 0.04 0.00 -0.50 -2.98 119.26 118.62 2onf h ALA 125 Ca 0.39 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2onf h ALA 125 Cb 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2onf h ALA 125 CO -0.13 0.19 0.00 0.44 0.00 0.00 0.00 179.25 179.75 2onf n ILE 126 N -3.95 0.24 -1.57 0.00 -5.35 -1.07 -4.99 119.36 102.67 2onf n ILE 126 Ca -0.02 -0.62 -0.49 0.00 -0.27 0.00 0.00 62.75 61.35 2onf n ILE 126 Cb 0.24 1.13 -0.04 0.00 -1.74 0.00 0.00 39.64 39.23 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 0.90 1.11 0.00 6.28 0.63 -1.07 -1.11 116.66 123.40 2onf n ARG 127 Ca 0.11 0.39 0.00 0.00 -0.92 0.00 0.00 57.85 57.43 2onf n ARG 127 Cb 0.42 -1.86 0.00 0.00 0.45 0.00 0.00 32.46 31.47 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 1.92 0.00 -0.04 6.15 3.02 -1.26 -4.74 115.26 120.31 2onf n ASN 128 Ca 0.15 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.67 2onf n ASN 128 Cb 0.25 -0.33 -0.08 0.00 -0.61 0.00 0.00 39.78 39.01 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 2.55 -3.90 6.41 3.02 -0.27 -4.98 115.26 118.10 2onf n ASN 129 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.40 2onf n ASN 129 Cb 0.00 0.93 -0.15 0.00 -0.61 0.00 0.00 39.78 39.95 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 -2.36 0.26 0.02 2.41 1.01 -1.03 -4.87 120.40 115.85 2onf s VAL 130 Ca -0.05 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 2onf s VAL 130 Cb 0.04 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 2onf s VAL 130 CO 0.42 0.10 1.05 -0.70 0.00 0.00 0.00 175.10 175.97 2onf s GLU 131 N 0.28 4.52 -0.20 2.72 2.12 -0.64 -4.73 118.70 122.78 2onf s GLU 131 Ca -0.03 1.54 -0.01 0.00 0.36 0.00 0.00 54.97 56.83 2onf s GLU 131 Cb -0.06 -3.42 0.01 0.00 0.26 0.00 0.00 34.13 30.93 2onf s GLU 131 CO -0.01 -0.11 -0.14 -2.00 -0.54 0.00 0.00 175.26 172.46 2onf s GLU 132 N 0.98 3.13 -0.27 4.30 2.12 -1.26 -0.59 118.70 127.11 2onf s GLU 132 Ca 0.54 -0.76 0.02 0.00 0.36 0.00 0.00 54.97 55.13 2onf s GLU 132 Cb -0.24 -2.73 0.07 0.00 0.26 0.00 0.00 34.13 31.49 2onf s GLU 132 CO 0.29 -0.21 -0.04 0.42 -0.54 0.00 0.00 175.26 175.18 2onf s ILE 133 N 1.36 1.85 -0.17 -3.70 1.01 -0.42 -5.00 121.20 116.14 2onf s ILE 133 Ca 0.05 -1.62 -0.05 0.00 0.00 0.00 0.00 60.65 59.03 2onf s ILE 133 Cb -0.13 -2.14 -0.03 0.00 0.01 0.00 0.00 42.46 40.16 2onf s ILE 133 CO -0.09 -0.23 -0.01 -0.69 0.00 0.00 0.00 174.94 173.91 2onf s VAL 134 N 1.21 4.00 0.27 2.92 1.01 -1.26 -0.94 120.40 127.60 2onf s VAL 134 Ca -0.02 -0.31 -0.04 0.00 0.00 0.00 0.00 61.98 61.61 2onf s VAL 134 Cb -0.19 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.39 2onf s VAL 134 CO -0.08 0.47 0.34 1.51 0.00 0.00 0.00 175.10 177.34 2onf s ASP 135 N 0.59 0.48 0.13 3.32 -4.77 -0.76 -5.00 116.67 110.66 2onf s ASP 135 Ca -0.01 -1.33 -0.17 0.00 -3.30 0.00 0.00 52.55 47.74 2onf s ASP 135 Cb -0.14 0.54 0.04 0.00 -1.09 0.00 0.00 42.92 42.27 2onf s ASP 135 CO 0.02 -1.08 0.42 -0.72 0.70 0.00 0.00 175.17 174.52 2onf s TYR 136 N -3.72 -0.22 0.04 2.11 -0.85 -1.26 -0.52 117.35 112.92 2onf s TYR 136 Ca 0.32 -0.09 0.00 0.00 -0.52 0.00 0.00 57.07 56.78 2onf s TYR 136 Cb 0.02 0.29 -0.03 0.00 0.38 0.00 0.00 41.96 42.62 2onf s TYR 136 CO 0.15 -0.73 -0.04 -1.83 -1.52 0.00 0.00 175.55 171.59 2onf s GLU 137 N -3.81 0.49 0.19 -3.49 -1.05 -0.19 -4.93 118.70 105.91 2onf s GLU 137 Ca 0.03 -0.90 -0.18 0.00 -0.15 0.00 0.00 54.97 53.77 2onf s GLU 137 Cb 0.01 0.07 -0.08 0.00 -0.44 0.00 0.00 34.13 33.70 2onf s GLU 137 CO -0.11 -0.06 0.65 -0.06 0.95 0.00 0.00 175.26 176.63 2onf s PHE 138 N -2.50 3.64 0.00 4.83 0.08 -1.26 -1.24 117.98 121.52 2onf s PHE 138 Ca -0.05 1.26 0.00 0.00 0.12 0.00 0.00 56.93 58.27 2onf s PHE 138 Cb -0.02 -2.52 0.00 0.00 -0.57 0.00 0.00 43.02 39.90 2onf s PHE 138 CO -0.04 0.38 0.10 1.33 -0.10 0.00 0.00 175.22 176.89