#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f6n s LEU 9 N 0.00 4.37 0.49 -0.35 1.43 -1.26 -4.13 118.68 119.23 2f6n s LEU 9 Ca 0.00 -0.54 0.08 0.00 -1.03 0.00 0.00 54.13 52.64 2f6n s LEU 9 Cb 0.00 -2.06 0.04 0.00 0.03 0.00 0.00 46.19 44.20 2f6n s LEU 9 CO 0.00 -0.24 0.67 -0.31 0.23 0.00 0.00 176.35 176.70 2f6n s TYR 10 N 1.65 2.27 0.36 0.29 1.51 0.74 -4.60 117.35 119.58 2f6n s TYR 10 Ca 0.05 -0.50 0.00 0.00 -1.01 0.00 0.00 57.07 55.61 2f6n s TYR 10 Cb -0.17 -2.35 0.00 0.00 -0.11 0.00 0.00 41.96 39.32 2f6n s TYR 10 CO 0.08 -0.74 0.00 0.00 -1.11 0.00 0.00 175.55 173.78 2f6n h ILE 12 N -1.13 1.22 0.00 0.00 2.04 -1.96 -1.81 117.51 115.87 2f6n h ILE 12 Ca -0.04 -0.78 0.00 0.00 1.00 0.00 0.00 64.86 65.04 2f6n h ILE 12 Cb 1.11 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 37.89 2f6n h ILE 12 CO 0.03 0.29 0.00 0.00 0.00 0.00 0.00 178.15 178.47 2f6n n LYS 14 N -1.24 -1.33 -4.27 0.00 4.76 -0.68 -5.02 118.16 110.37 2f6n n LYS 14 Ca 0.10 0.86 -0.17 0.00 -2.87 0.00 0.00 58.31 56.24 2f6n n LYS 14 Cb 0.14 -3.78 -0.10 0.00 -1.84 0.00 0.00 35.03 29.45 2f6n n LYS 14 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2f6n s THR 15 N -3.14 1.37 0.74 -0.18 -4.23 -0.42 -4.74 115.64 105.04 2f6n s THR 15 Ca 0.15 -1.98 -0.15 0.00 -1.18 0.00 0.00 61.69 58.53 2f6n s THR 15 Cb -0.06 -1.79 0.04 0.00 1.34 0.00 0.00 72.50 72.04 2f6n s THR 15 CO 0.85 -0.60 1.22 -2.84 -0.54 0.00 0.00 174.62 172.71 2f6n s PRO 16 N -3.35 2.04 0.13 3.99 0.02 -1.26 -0.18 135.00 136.39 2f6n s PRO 16 Ca 0.15 1.82 -0.31 0.00 0.02 0.00 0.00 61.00 62.68 2f6n s PRO 16 Cb -0.01 -1.82 -0.08 0.00 0.02 0.00 0.00 34.50 32.61 2f6n s PRO 16 CO 0.03 -1.92 1.43 -0.47 -0.33 0.00 0.00 177.00 175.73 2f6n s TYR 17 N -1.93 3.20 -0.38 6.54 5.04 -1.26 -4.80 117.35 123.76 2f6n s TYR 17 Ca 0.75 0.89 -0.06 0.00 -2.44 0.00 0.00 57.07 56.21 2f6n s TYR 17 Cb -0.31 -3.74 0.07 0.00 0.35 0.00 0.00 41.96 38.34 2f6n s TYR 17 CO 0.46 -2.60 0.18 0.34 -1.34 0.00 0.00 175.55 172.59 2f6n s ASP 18 N 1.08 5.40 0.66 4.32 -1.08 -1.26 -4.98 116.67 120.81 2f6n s ASP 18 Ca 0.65 -1.50 0.24 0.00 -0.52 0.00 0.00 52.55 51.42 2f6n s ASP 18 Cb -0.38 -1.90 1.26 0.00 -1.46 0.00 0.00 42.92 40.44 2f6n s ASP 18 CO 0.31 -0.46 1.71 -0.08 0.52 0.00 0.00 175.17 177.17 2f6n h GLU 19 N 8.24 0.00 0.00 4.34 4.57 -2.05 -0.57 114.58 129.12 2f6n h GLU 19 Ca -0.21 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.97 2f6n h GLU 19 Cb 1.07 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.66 2f6n h GLU 19 CO 0.68 0.00 -0.73 -1.13 -1.18 0.00 0.00 179.01 176.66 2f6n n SER 20 N -2.89 0.63 -4.89 1.04 3.41 -1.26 -4.95 113.62 104.71 2f6n n SER 20 Ca -0.00 -0.34 -0.30 0.00 -0.26 0.00 0.00 58.87 57.97 2f6n n SER 20 Cb 0.56 0.51 -0.04 0.00 -0.26 0.00 0.00 64.21 64.98 2f6n n SER 20 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2f6n s LYS 21 N -3.06 3.70 -0.09 4.33 -0.14 -0.22 -5.07 119.74 119.19 2f6n s LYS 21 Ca 0.08 0.12 -0.23 0.00 -1.36 0.00 0.00 55.97 54.58 2f6n s LYS 21 Cb 0.16 -2.64 -0.03 0.00 -1.68 0.00 0.00 37.83 33.64 2f6n s LYS 21 CO 0.76 0.24 0.70 0.12 -0.76 0.00 0.00 175.35 176.41 2f6n s PHE 22 N -2.00 3.55 0.17 3.18 5.36 -1.26 -4.96 117.98 122.02 2f6n s PHE 22 Ca 0.45 1.22 0.07 0.00 -0.96 0.00 0.00 56.93 57.72 2f6n s PHE 22 Cb -0.11 -2.82 -0.04 0.00 -0.34 0.00 0.00 43.02 39.71 2f6n s PHE 22 CO 0.27 0.04 -0.15 0.71 -1.46 0.00 0.00 175.22 174.63 2f6n s TYR 23 N 1.00 1.62 -0.09 10.12 1.51 -1.26 -2.84 117.35 127.41 2f6n s TYR 23 Ca 0.37 -0.56 0.03 0.00 -1.01 0.00 0.00 57.07 55.91 2f6n s TYR 23 Cb -0.17 -0.80 0.00 0.00 -0.11 0.00 0.00 41.96 40.88 2f6n s TYR 23 CO 0.17 0.27 -0.20 -1.50 -1.11 0.00 0.00 175.55 173.18 2f6n s ILE 24 N -2.53 1.76 0.13 2.71 2.07 0.31 -4.88 121.20 120.77 2f6n s ILE 24 Ca 0.17 -0.85 -0.11 0.00 -1.41 0.00 0.00 60.65 58.45 2f6n s ILE 24 Cb -0.03 -1.54 -0.06 0.00 0.13 0.00 0.00 42.46 40.96 2f6n s ILE 24 CO 0.05 0.49 0.47 -0.83 -1.91 0.00 0.00 174.94 173.21 2f6n s GLY 25 N 0.44 2.36 -0.34 1.50 0.00 -1.26 -1.35 107.32 108.67 2f6n s GLY 25 Ca -0.17 -0.30 -0.07 0.00 0.00 0.00 0.00 44.72 44.18 2f6n s GLY 25 CO 0.07 -0.08 0.11 0.00 0.00 0.00 0.00 173.10 173.20 2f6n h ASP 27 N 8.23 0.46 0.11 0.00 3.32 -1.88 0.28 116.42 126.95 2f6n h ASP 27 Ca -0.24 0.05 0.01 0.00 0.02 0.00 0.00 57.03 56.87 2f6n h ASP 27 Cb 1.08 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.57 2f6n h ASP 27 CO 0.60 0.28 -0.44 0.03 -1.72 0.00 0.00 179.24 177.99 2f6n h ARG 28 N 0.61 -0.61 -0.00 3.56 3.08 -1.94 -3.12 114.38 115.95 2f6n h ARG 28 Ca 0.33 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.42 2f6n h ARG 28 Cb 0.31 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.50 2f6n h ARG 28 CO -0.24 -0.41 -0.58 0.00 -1.07 0.00 0.00 179.97 177.66 2f6n n GLN 30 N -1.47 -1.18 -2.97 0.00 1.13 0.99 -5.01 117.38 108.88 2f6n n GLN 30 Ca 0.05 0.87 -0.19 0.00 -1.94 0.00 0.00 57.00 55.79 2f6n n GLN 30 Cb 0.34 -5.15 0.02 0.00 0.11 0.00 0.00 30.24 25.55 2f6n n GLN 30 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 2f6n s ASN 31 N -2.51 5.61 -0.00 1.08 3.84 -1.22 -4.90 114.94 116.84 2f6n s ASN 31 Ca 0.00 -0.20 0.05 0.00 0.21 0.00 0.00 52.86 52.92 2f6n s ASN 31 Cb 0.00 -0.90 -0.01 0.00 -0.55 0.00 0.00 41.25 39.79 2f6n s ASN 31 CO 0.00 -0.81 -0.16 0.26 -2.79 0.00 0.00 177.10 173.60 2f6n s TRP 32 N -2.46 1.42 -0.02 0.43 0.52 -1.26 -1.90 118.94 115.66 2f6n s TRP 32 Ca 0.53 -0.28 0.05 0.00 0.02 0.00 0.00 56.10 56.41 2f6n s TRP 32 Cb -0.10 -0.90 -0.01 0.00 -1.15 0.00 0.00 33.47 31.31 2f6n s TRP 32 CO 0.35 -0.01 -0.16 0.71 0.02 0.00 0.00 176.95 177.86 2f6n s TYR 33 N -0.46 1.51 0.14 -1.98 1.51 -0.46 -0.52 117.35 117.09 2f6n s TYR 33 Ca 0.06 -0.35 -0.31 0.00 -1.01 0.00 0.00 57.07 55.46 2f6n s TYR 33 Cb -0.06 -1.00 -0.10 0.00 -0.11 0.00 0.00 41.96 40.69 2f6n s TYR 33 CO -0.00 -0.08 1.59 -1.01 -1.11 0.00 0.00 175.55 174.94 2f6n s HIS 34 N -0.19 2.87 0.49 2.71 3.76 -1.26 -0.53 115.29 123.14 2f6n s HIS 34 Ca 0.02 0.54 0.26 0.00 -0.15 0.00 0.00 55.06 55.73 2f6n s HIS 34 Cb -0.08 -3.94 1.33 0.00 1.11 0.00 0.00 32.58 31.00 2f6n s HIS 34 CO 0.00 -3.55 1.86 0.78 -0.85 0.00 0.00 174.74 172.99 2f6n h GLY 35 N 7.32 0.39 1.65 -2.22 0.00 -1.76 0.20 103.07 108.64 2f6n h GLY 35 Ca -0.43 -0.08 -0.14 0.00 0.00 0.00 0.00 47.33 46.69 2f6n h GLY 35 CO 0.92 -0.02 -0.50 -0.09 0.00 0.00 0.00 176.54 176.85 2f6n h ARG 36 N 0.16 0.38 -0.10 4.80 2.43 -1.86 0.44 114.38 120.63 2f6n h ARG 36 Ca 0.46 -0.22 -0.12 0.00 -0.81 0.00 0.00 59.98 59.30 2f6n h ARG 36 Cb 1.56 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 31.11 2f6n h ARG 36 CO -0.09 0.79 -0.47 0.00 -1.51 0.00 0.00 179.97 178.70 2f6n n VAL 38 N -3.98 0.38 -2.77 0.00 0.24 -1.08 -4.98 118.33 106.15 2f6n n VAL 38 Ca -0.02 -0.69 -0.16 0.00 -2.04 0.00 0.00 64.34 61.43 2f6n n VAL 38 Cb 0.52 1.09 0.02 0.00 -1.47 0.00 0.00 33.84 34.00 2f6n n VAL 38 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2f6n n GLY 39 N 1.33 -0.19 3.22 7.63 0.00 -0.21 -5.01 105.19 111.95 2f6n n GLY 39 Ca 0.17 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 2f6n n GLY 39 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f6n s ILE 40 N -2.98 2.95 0.53 -0.61 1.01 0.14 -5.00 121.20 117.24 2f6n s ILE 40 Ca 0.20 -0.90 -0.20 0.00 0.00 0.00 0.00 60.65 59.76 2f6n s ILE 40 Cb -0.09 -2.45 -0.06 0.00 0.01 0.00 0.00 42.46 39.87 2f6n s ILE 40 CO 0.25 0.27 1.11 -0.76 0.00 0.00 0.00 174.94 175.81 2f6n s LEU 41 N 1.36 3.77 0.29 2.97 1.43 -1.26 -4.44 118.68 122.79 2f6n s LEU 41 Ca 0.02 2.13 -0.00 0.00 -1.03 0.00 0.00 54.13 55.25 2f6n s LEU 41 Cb -0.16 -4.57 0.50 0.00 0.03 0.00 0.00 46.19 41.98 2f6n s LEU 41 CO -0.05 -1.13 1.88 1.56 0.23 0.00 0.00 176.35 178.84 2f6n h GLN 42 N 1.28 1.04 -0.84 1.70 4.20 -1.99 0.15 115.11 120.66 2f6n h GLN 42 Ca -0.50 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.11 2f6n h GLN 42 Cb 1.25 -0.23 -0.04 0.00 0.30 0.00 0.00 27.48 28.76 2f6n h GLN 42 CO 0.57 0.69 0.38 0.66 -0.67 0.00 0.00 178.83 180.46 2f6n h SER 43 N 1.07 1.12 -0.14 1.46 4.64 -2.02 -2.59 113.55 117.09 2f6n h SER 43 Ca 0.43 -0.15 -0.16 0.00 -0.47 0.00 0.00 61.79 61.44 2f6n h SER 43 Cb 0.27 -0.29 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 2f6n h SER 43 CO -0.18 0.96 -0.49 -0.33 -0.87 0.00 0.00 176.83 175.91 2f6n h GLU 44 N 1.20 0.71 -0.74 4.77 5.08 -1.57 -3.16 114.58 120.88 2f6n h GLU 44 Ca 0.29 -0.41 0.11 0.00 -1.00 0.00 0.00 59.36 58.34 2f6n h GLU 44 Cb 0.15 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.39 2f6n h GLU 44 CO -0.03 1.03 0.49 0.00 -1.00 0.00 0.00 179.01 179.50 2f6n h ALA 45 N 0.89 1.92 -0.10 3.43 0.00 -0.36 -0.09 119.26 124.95 2f6n h ALA 45 Ca 0.03 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2f6n h ALA 45 Cb 1.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2f6n h ALA 45 CO 0.10 -0.09 -0.31 0.93 0.00 0.00 0.00 179.25 179.88 2f6n h GLU 46 N 0.56 0.18 0.00 0.00 5.08 -1.48 -2.83 114.58 116.10 2f6n h GLU 46 Ca 0.35 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 2f6n h GLU 46 Cb 0.59 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2f6n h GLU 46 CO -0.12 0.48 0.00 1.28 -1.00 0.00 0.00 179.01 179.64 2f6n n LEU 47 N -4.13 0.00 -4.43 1.33 4.77 -0.05 -4.70 117.00 109.80 2f6n n LEU 47 Ca -0.01 0.31 -0.33 0.00 -0.03 0.00 0.00 56.01 55.95 2f6n n LEU 47 Cb 0.39 -0.31 -0.14 0.00 -2.33 0.00 0.00 43.42 41.03 2f6n n LEU 47 CO 0.40 -0.15 -0.45 0.27 -1.33 0.00 0.00 177.39 176.13 2f6n s ILE 48 N -2.62 3.05 -0.13 -0.08 -4.36 -1.07 -5.05 121.20 110.95 2f6n s ILE 48 Ca 0.14 -0.69 -0.08 0.00 -0.26 0.00 0.00 60.65 59.75 2f6n s ILE 48 Cb 0.11 -2.24 -0.06 0.00 1.25 0.00 0.00 42.46 41.53 2f6n s ILE 48 CO 0.25 0.56 0.02 0.44 0.24 0.00 0.00 174.94 176.45 2f6n h ASP 49 N 5.99 0.00 -4.08 4.36 5.19 -1.86 -3.44 116.42 122.58 2f6n h ASP 49 Ca -0.36 -0.14 -0.67 0.00 -0.62 0.00 0.00 57.03 55.23 2f6n h ASP 49 Cb 1.18 0.00 -0.38 0.00 0.18 0.00 0.00 39.33 40.32 2f6n h ASP 49 CO 0.53 0.74 -0.51 -0.70 -3.12 0.00 0.00 179.24 176.18 2f6n s GLU 50 N -1.97 2.18 0.18 3.56 2.12 -1.26 -5.08 118.70 118.44 2f6n s GLU 50 Ca -0.10 -2.40 -0.30 0.00 0.36 0.00 0.00 54.97 52.52 2f6n s GLU 50 Cb 0.01 -3.52 -0.08 0.00 0.26 0.00 0.00 34.13 30.80 2f6n s GLU 50 CO 0.21 -1.11 1.25 -0.47 -0.54 0.00 0.00 175.26 174.60 2f6n s TYR 51 N 0.12 3.35 -0.24 5.30 5.04 -1.26 -5.02 117.35 124.64 2f6n s TYR 51 Ca 0.15 1.31 0.02 0.00 -2.44 0.00 0.00 57.07 56.11 2f6n s TYR 51 Cb -0.22 -3.51 0.06 0.00 0.35 0.00 0.00 41.96 38.63 2f6n s TYR 51 CO -0.03 -1.54 -0.10 0.08 -1.34 0.00 0.00 175.55 172.63 2f6n s VAL 52 N 0.13 1.91 0.95 3.14 1.01 -1.26 -3.96 120.40 122.32 2f6n s VAL 52 Ca 0.55 -1.42 -0.11 0.00 0.00 0.00 0.00 61.98 61.00 2f6n s VAL 52 Cb -0.34 -2.05 0.12 0.00 0.00 0.00 0.00 36.38 34.10 2f6n s VAL 52 CO 0.37 -0.01 0.83 0.00 0.00 0.00 0.00 175.10 176.29 2f6n h PRO 54 N -1.84 0.23 -0.28 0.00 0.11 -1.99 0.03 132.00 128.25 2f6n h PRO 54 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2f6n h PRO 54 Cb 1.28 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2f6n h PRO 54 CO 0.39 0.15 0.19 0.37 -0.21 0.00 0.00 178.00 178.88 2f6n h GLN 55 N 0.23 0.38 -0.85 1.05 5.75 -1.99 0.15 115.11 119.83 2f6n h GLN 55 Ca 0.24 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.70 2f6n h GLN 55 Cb 0.31 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 28.74 2f6n h GLN 55 CO -0.31 0.25 0.46 0.00 -2.65 0.00 0.00 178.83 176.58 2f6n h GLN 57 N 1.19 0.99 -0.18 0.00 5.75 -0.58 -0.39 115.11 121.89 2f6n h GLN 57 Ca 0.30 -0.34 -0.01 0.00 -0.15 0.00 0.00 58.65 58.45 2f6n h GLN 57 Cb 0.05 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.51 2f6n h GLN 57 CO -0.05 1.01 0.08 1.03 -2.65 0.00 0.00 178.83 178.26 2f6n h SER 58 N 0.86 0.24 -0.65 -0.69 0.87 -0.30 -0.93 113.55 112.96 2f6n h SER 58 Ca 0.15 -0.15 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 2f6n h SER 58 Cb 0.60 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.47 2f6n h SER 58 CO 0.04 0.32 0.30 0.74 -0.53 0.00 0.00 176.83 177.70 2f6n h THR 59 N 0.15 1.23 -0.34 2.23 2.02 -1.03 -0.63 112.91 116.53 2f6n h THR 59 Ca 0.06 -0.65 0.02 0.00 0.77 0.00 0.00 66.41 66.60 2f6n h THR 59 Cb 0.15 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 2f6n h THR 59 CO -0.01 0.27 0.19 -0.08 0.37 0.00 0.00 175.52 176.26 2f6n h GLU 60 N 0.90 0.38 -0.65 6.66 4.81 -0.83 -2.63 114.58 123.23 2f6n h GLU 60 Ca 0.22 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.35 2f6n h GLU 60 Cb 0.14 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 2f6n h GLU 60 CO -0.03 0.25 0.08 -0.44 -0.73 0.00 0.00 179.01 178.14 2f6n h ASP 61 N 0.39 1.05 0.00 1.04 3.32 -0.89 0.98 116.42 122.31 2f6n h ASP 61 Ca 0.14 -0.26 0.00 0.00 0.02 0.00 0.00 57.03 56.92 2f6n h ASP 61 Cb 0.01 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.28 2f6n h ASP 61 CO -0.07 1.05 0.00 0.00 -1.72 0.00 0.00 179.24 178.50 2f6n n ALA 62 N -2.47 1.21 0.00 3.45 0.00 -0.27 -1.96 120.51 120.46 2f6n n ALA 62 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2f6n n ALA 62 Cb 0.31 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.76 2f6n n ALA 62 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2f6n n THR 64 N 0.60 0.00 0.81 0.00 -1.04 0.34 -3.42 114.28 111.57 2f6n n THR 64 Ca 0.00 0.00 0.08 0.00 -2.04 0.00 0.00 64.05 62.09 2f6n n THR 64 Cb 0.02 0.00 0.42 0.00 -1.82 0.00 0.00 70.33 68.95 2f6n n THR 64 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2f6n n VAL 65 N 0.00 0.43 0.49 12.58 0.24 -0.83 -2.22 118.33 129.03 2f6n n VAL 65 Ca 0.00 0.11 0.05 0.00 -2.04 0.00 0.00 64.34 62.46 2f6n n VAL 65 Cb 0.00 -0.84 -0.03 0.00 -1.47 0.00 0.00 33.84 31.49 2f6n n VAL 65 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2f6n n LEU 66 N -1.23 0.82 -4.76 1.34 4.77 -1.22 -2.89 117.00 113.83 2f6n n LEU 66 Ca 0.09 -0.61 -0.41 0.00 -0.03 0.00 0.00 56.01 55.04 2f6n n LEU 66 Cb 0.11 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.19 2f6n n LEU 66 CO 0.12 0.18 1.18 -0.89 -1.33 0.00 0.00 177.39 176.64 2f6n s THR 67 N -1.76 2.13 0.17 -5.08 2.01 -0.94 -4.81 115.64 107.37 2f6n s THR 67 Ca 0.06 0.12 -0.33 0.00 0.31 0.00 0.00 61.69 61.85 2f6n s THR 67 Cb 0.08 -3.08 -0.15 0.00 0.01 0.00 0.00 72.50 69.36 2f6n s THR 67 CO 0.36 0.02 1.23 -2.65 -0.69 0.00 0.00 174.62 172.90 2f6n n PRO 68 N 1.38 1.31 -2.42 4.92 -0.02 -1.26 -4.46 135.00 134.46 2f6n n PRO 68 Ca 0.05 0.47 -0.40 0.00 -2.02 0.00 0.00 63.50 61.60 2f6n n PRO 68 Cb 0.39 -2.01 -0.04 0.00 -0.02 0.00 0.00 33.50 31.82 2f6n n PRO 68 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2f6n s LEU 69 N 0.56 4.48 0.31 2.45 1.43 -0.12 -4.99 118.68 122.82 2f6n s LEU 69 Ca 0.74 2.32 0.07 0.00 -1.03 0.00 0.00 54.13 56.23 2f6n s LEU 69 Cb -0.83 -3.70 -0.03 0.00 0.03 0.00 0.00 46.19 41.67 2f6n s LEU 69 CO 0.51 -0.26 0.31 0.42 0.23 0.00 0.00 176.35 177.56 2f6n s THR 70 N -1.21 3.91 0.31 5.49 -4.23 -1.26 -4.96 115.64 113.68 2f6n s THR 70 Ca 0.47 -1.28 0.04 0.00 -1.18 0.00 0.00 61.69 59.74 2f6n s THR 70 Cb -0.32 -3.31 0.30 0.00 1.34 0.00 0.00 72.50 70.51 2f6n s THR 70 CO 0.42 -0.21 1.83 -0.33 -0.54 0.00 0.00 174.62 175.79 2f6n h GLU 71 N 1.22 0.85 -0.55 3.99 4.39 -1.99 0.15 114.58 122.63 2f6n h GLU 71 Ca -0.46 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.14 2f6n h GLU 71 Cb 1.25 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.69 2f6n h GLU 71 CO 0.58 0.56 0.17 -0.22 -1.16 0.00 0.00 179.01 178.94 2f6n h LYS 72 N 0.87 0.85 -0.87 2.33 3.11 -2.01 -1.88 116.57 118.98 2f6n h LYS 72 Ca 0.50 -0.18 0.08 0.00 -2.81 0.00 0.00 60.65 58.24 2f6n h LYS 72 Cb 0.63 -0.12 -0.06 0.00 -1.00 0.00 0.00 32.23 31.68 2f6n h LYS 72 CO -0.27 0.78 0.56 -0.44 -2.81 0.00 0.00 179.45 177.27 2f6n h ASP 73 N 0.76 0.82 0.20 4.20 3.32 -1.15 -0.46 116.42 124.11 2f6n h ASP 73 Ca 0.18 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.21 2f6n h ASP 73 Cb 0.28 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.67 2f6n h ASP 73 CO -0.01 0.51 -0.13 1.88 -1.72 0.00 0.00 179.24 179.77 2f6n h TYR 74 N 0.92 0.00 -0.67 4.55 -1.99 -0.32 -0.33 116.97 119.13 2f6n h TYR 74 Ca 0.39 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 61.10 2f6n h TYR 74 Cb 0.30 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.00 2f6n h TYR 74 CO -0.00 0.13 0.36 0.93 -0.00 0.00 0.00 178.16 179.57 2f6n h GLU 75 N 0.00 0.93 -0.27 4.88 5.08 -0.83 0.26 114.58 124.63 2f6n h GLU 75 Ca -0.00 -0.10 -0.10 0.00 -1.00 0.00 0.00 59.36 58.15 2f6n h GLU 75 Cb 0.26 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 2f6n h GLU 75 CO 0.02 0.69 -0.23 0.78 -1.00 0.00 0.00 179.01 179.26 2f6n h GLY 76 N 0.99 0.69 1.17 -3.84 0.00 -1.06 -2.13 103.07 98.89 2f6n h GLY 76 Ca 0.24 -0.69 -0.06 0.00 0.00 0.00 0.00 47.33 46.82 2f6n h GLY 76 CO -0.04 0.62 0.18 1.41 0.00 0.00 0.00 176.54 178.72 2f6n h LEU 77 N 0.36 0.97 -0.43 3.11 3.38 -0.89 -1.54 115.31 120.27 2f6n h LEU 77 Ca 0.05 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2f6n h LEU 77 Cb 0.79 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2f6n h LEU 77 CO 0.06 0.92 0.21 0.11 0.09 0.00 0.00 178.44 179.83 2f6n h LYS 78 N 0.99 0.61 -0.03 1.13 1.57 -0.91 -0.58 116.57 119.35 2f6n h LYS 78 Ca 0.21 -0.09 0.02 0.00 -1.87 0.00 0.00 60.65 58.92 2f6n h LYS 78 Cb 0.32 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2f6n h LYS 78 CO -0.00 0.52 -0.06 0.00 -0.57 0.00 0.00 179.45 179.34 2f6n h ARG 79 N 0.55 -0.09 -0.59 3.15 3.08 -1.00 0.23 114.38 119.72 2f6n h ARG 79 Ca 0.15 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 2f6n h ARG 79 Cb 0.11 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 2f6n h ARG 79 CO -0.02 -0.06 0.33 0.28 -1.07 0.00 0.00 179.97 179.44 2f6n h VAL 80 N -0.09 1.19 -0.42 2.04 2.07 -1.15 -0.54 116.25 119.35 2f6n h VAL 80 Ca 0.04 -0.47 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 2f6n h VAL 80 Cb 0.14 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 2f6n h VAL 80 CO -0.08 0.20 0.21 0.25 0.02 0.00 0.00 177.57 178.17 2f6n h LEU 81 N 0.80 0.54 -1.28 2.57 5.85 -0.86 -2.19 115.31 120.75 2f6n h LEU 81 Ca 0.21 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 2f6n h LEU 81 Cb 0.03 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 2f6n h LEU 81 CO -0.03 0.50 0.21 0.03 -0.34 0.00 0.00 178.44 178.81 2f6n h ARG 82 N 0.54 0.71 -0.62 1.25 3.08 -0.60 -1.17 114.38 117.57 2f6n h ARG 82 Ca 0.15 -0.10 -0.09 0.00 0.07 0.00 0.00 59.98 60.02 2f6n h ARG 82 Cb 0.09 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 2f6n h ARG 82 CO -0.02 0.58 0.05 0.66 -1.07 0.00 0.00 179.97 180.16 2f6n h SER 83 N 0.70 1.02 -0.22 7.04 4.64 -0.66 -1.01 113.55 125.07 2f6n h SER 83 Ca 0.17 -0.26 -0.06 0.00 -0.47 0.00 0.00 61.79 61.17 2f6n h SER 83 Cb 0.12 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 2f6n h SER 83 CO -0.02 1.04 -0.09 -0.07 -0.87 0.00 0.00 176.83 176.82 2f6n h LEU 84 N 0.97 0.45 -2.06 5.97 -0.00 -0.94 -2.21 115.31 117.50 2f6n h LEU 84 Ca 0.18 -0.40 -0.01 0.00 -0.00 0.00 0.00 57.88 57.65 2f6n h LEU 84 Cb 0.49 -0.12 -0.00 0.00 -0.00 0.00 0.00 40.66 41.03 2f6n h LEU 84 CO 0.02 0.75 -0.06 1.56 -0.00 0.00 0.00 178.44 180.71 2f6n h GLN 85 N 0.15 0.00 0.00 1.13 4.20 -1.06 -1.70 115.11 117.84 2f6n h GLN 85 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2f6n h GLN 85 Cb 0.57 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.35 2f6n h GLN 85 CO 0.03 0.06 -0.55 0.00 -0.67 0.00 0.00 178.83 177.69 2f6n n ALA 86 N -2.43 2.85 -1.71 3.87 0.00 -0.40 -4.89 120.51 117.80 2f6n n ALA 86 Ca -0.03 -0.22 -0.43 0.00 0.00 0.00 0.00 53.44 52.76 2f6n n ALA 86 Cb 0.14 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 18.36 2f6n n ALA 86 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 2f6n n HIS 87 N -2.13 2.62 0.00 0.00 -0.00 -0.64 -4.96 115.22 110.11 2f6n n HIS 87 Ca 0.04 0.18 0.00 0.00 -0.00 0.00 0.00 57.72 57.93 2f6n n HIS 87 Cb 0.44 -2.61 0.00 0.00 -0.00 0.00 0.00 29.99 27.82 2f6n n HIS 87 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2f6n n LYS 88 N 3.21 0.00 -0.31 1.57 5.02 -1.26 -4.27 118.16 122.11 2f6n n LYS 88 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.43 2f6n n LYS 88 Cb 0.34 -1.18 0.00 0.00 -0.02 0.00 0.00 35.03 34.17 2f6n n LYS 88 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2f6n n ALA 90 N 0.77 0.00 -0.20 7.82 0.00 -1.26 -4.99 120.51 122.64 2f6n n ALA 90 Ca 0.00 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.66 2f6n n ALA 90 Cb 0.00 -0.69 0.59 0.00 0.00 0.00 0.00 19.45 19.35 2f6n n ALA 90 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 2f6n h TRP 91 N 0.00 0.34 0.00 0.00 5.08 -1.91 -1.06 115.95 118.41 2f6n h TRP 91 Ca 0.00 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.98 2f6n h TRP 91 Cb 0.00 -0.11 0.00 0.00 -3.00 0.00 0.00 29.16 26.05 2f6n h TRP 91 CO 0.00 0.09 0.00 -0.35 -1.28 0.00 0.00 178.44 176.90 2f6n n PRO 92 N -4.43 0.01 -0.07 0.12 -0.04 -1.26 -3.31 135.00 126.02 2f6n n PRO 92 Ca 0.18 0.17 0.04 0.00 -0.04 0.00 0.00 63.50 63.84 2f6n n PRO 92 Cb 0.76 -1.52 0.07 0.00 -0.04 0.00 0.00 33.50 32.78 2f6n n PRO 92 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2f6n n PHE 93 N -1.53 0.19 -0.03 0.54 3.72 -0.41 -4.65 117.46 115.29 2f6n n PHE 93 Ca 0.05 -0.32 -0.03 0.00 -0.05 0.00 0.00 57.45 57.10 2f6n n PHE 93 Cb 0.24 -0.02 0.21 0.00 -0.94 0.00 0.00 39.48 38.96 2f6n n PHE 93 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2f6n h LEU 94 N 1.34 0.57 -8.97 4.37 3.38 -1.53 -0.19 115.31 114.28 2f6n h LEU 94 Ca 0.00 -0.16 -0.41 0.00 0.09 0.00 0.00 57.88 57.40 2f6n h LEU 94 Cb 0.52 -0.15 -0.14 0.00 0.09 0.00 0.00 40.66 40.97 2f6n h LEU 94 CO 0.00 0.73 -0.66 -1.61 0.09 0.00 0.00 178.44 176.99 2f6n s GLU 95 N -4.74 1.41 0.57 1.13 0.41 -1.26 -1.49 118.70 114.73 2f6n s GLU 95 Ca -0.08 -1.72 -0.20 0.00 -0.41 0.00 0.00 54.97 52.56 2f6n s GLU 95 Cb 0.14 -0.75 -0.05 0.00 -1.78 0.00 0.00 34.13 31.69 2f6n s GLU 95 CO 0.79 -0.08 1.10 -2.30 -0.49 0.00 0.00 175.26 174.29 2f6n n PRO 96 N -0.48 1.18 -1.75 0.39 -0.02 -1.26 -4.83 135.00 128.24 2f6n n PRO 96 Ca -0.05 0.45 -0.42 0.00 -2.02 0.00 0.00 63.50 61.46 2f6n n PRO 96 Cb 0.64 -2.29 -0.01 0.00 -0.02 0.00 0.00 33.50 31.81 2f6n n PRO 96 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2f6n n VAL 97 N -1.41 1.27 -3.42 -1.45 0.31 -1.26 -4.96 118.33 107.40 2f6n n VAL 97 Ca 0.13 -0.32 -0.39 0.00 -0.01 0.00 0.00 64.34 63.75 2f6n n VAL 97 Cb 0.46 -1.92 -0.09 0.00 -0.91 0.00 0.00 33.84 31.37 2f6n n VAL 97 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2f6n s ASP 98 N 0.32 6.24 0.45 4.52 2.15 -1.26 -4.97 116.67 124.12 2f6n s ASP 98 Ca 0.62 0.27 0.28 0.00 0.43 0.00 0.00 52.55 54.15 2f6n s ASP 98 Cb -0.50 -2.20 1.35 0.00 -0.30 0.00 0.00 42.92 41.26 2f6n s ASP 98 CO 0.52 -0.16 1.70 -0.65 -0.17 0.00 0.00 175.17 176.42 2f6n h PRO 99 N 8.11 0.17 -0.20 4.34 0.11 -1.93 0.27 132.00 142.87 2f6n h PRO 99 Ca -0.32 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.83 2f6n h PRO 99 Cb 1.16 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2f6n h PRO 99 CO 0.64 0.12 0.17 -0.91 -0.21 0.00 0.00 178.00 177.80 2f6n h ASN 100 N 0.18 0.00 0.90 -2.05 2.35 -1.96 0.83 115.58 115.83 2f6n h ASN 100 Ca 0.70 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.45 2f6n h ASN 100 Cb 2.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.58 2f6n h ASN 100 CO -0.28 0.00 -0.79 0.44 -1.65 0.00 0.00 177.43 175.14 2f6n h ASP 101 N 0.00 0.00 -0.81 5.81 3.32 -0.88 -3.43 116.42 120.44 2f6n h ASP 101 Ca 0.09 -0.14 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 2f6n h ASP 101 Cb 0.43 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 39.80 2f6n h ASP 101 CO -0.00 0.07 -0.38 0.00 -1.72 0.00 0.00 179.24 177.21 2f6n s ALA 102 N -3.25 -2.84 0.40 3.45 0.00 0.08 -5.06 121.76 114.55 2f6n s ALA 102 Ca 0.03 0.31 0.16 0.00 0.00 0.00 0.00 51.96 52.47 2f6n s ALA 102 Cb 0.12 -2.80 1.04 0.00 0.00 0.00 0.00 23.12 21.48 2f6n s ALA 102 CO 0.75 -2.29 1.83 -1.35 0.00 0.00 0.00 175.76 174.70 2f6n h PRO 103 N 6.14 0.44 0.00 0.00 0.11 -1.28 -2.16 132.00 135.26 2f6n h PRO 103 Ca 0.03 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2f6n h PRO 103 Cb 1.18 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2f6n h PRO 103 CO 0.04 0.29 -0.64 -0.40 -0.21 0.00 0.00 178.00 177.08 2f6n n ASP 104 N -4.55 0.59 -0.12 -2.05 5.75 -1.26 -4.62 116.55 110.29 2f6n n ASP 104 Ca 0.21 -0.31 -0.03 0.00 -0.01 0.00 0.00 54.79 54.65 2f6n n ASP 104 Cb 0.71 0.40 -0.03 0.00 -1.03 0.00 0.00 41.12 41.17 2f6n n ASP 104 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2f6n n TYR 105 N -1.61 -0.13 0.17 2.11 9.36 -0.81 -0.39 117.16 125.86 2f6n n TYR 105 Ca 0.05 0.36 0.02 0.00 3.32 0.00 0.00 57.90 61.65 2f6n n TYR 105 Cb 0.36 -0.51 0.09 0.00 -0.63 0.00 0.00 39.34 38.64 2f6n n TYR 105 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2f6n n TYR 106 N -3.64 0.00 -0.07 2.98 4.01 -1.26 0.06 117.16 119.24 2f6n n TYR 106 Ca 0.01 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.67 2f6n n TYR 106 Cb 0.08 -0.18 -0.15 0.00 -0.31 0.00 0.00 39.34 38.77 2f6n n TYR 106 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2f6n n GLY 107 N -0.93 -1.01 0.14 2.72 0.00 0.48 -4.45 105.19 102.13 2f6n n GLY 107 Ca 0.02 -0.27 -0.22 0.00 0.00 0.00 0.00 46.02 45.55 2f6n n GLY 107 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2f6n h VAL 108 N 0.00 0.65 -3.58 1.61 2.07 0.28 -3.44 116.25 113.84 2f6n h VAL 108 Ca -0.44 -2.36 -0.67 0.00 0.82 0.00 0.00 66.70 64.06 2f6n h VAL 108 Cb 2.08 2.53 -0.17 0.00 -1.52 0.00 0.00 31.29 34.22 2f6n h VAL 108 CO 0.04 0.90 -0.09 -0.63 0.02 0.00 0.00 177.57 177.81 2f6n s ILE 109 N -2.56 5.01 -0.12 4.57 -1.09 0.11 -4.94 121.20 122.18 2f6n s ILE 109 Ca -0.22 -0.01 0.15 0.00 -2.23 0.00 0.00 60.65 58.34 2f6n s ILE 109 Cb 0.06 -4.04 -0.04 0.00 -1.58 0.00 0.00 42.46 36.86 2f6n s ILE 109 CO 0.78 -0.38 1.18 0.11 -1.23 0.00 0.00 174.94 175.39 2f6n h LYS 110 N 8.67 0.00 -2.25 2.79 1.79 -1.86 -3.40 116.57 122.31 2f6n h LYS 110 Ca -0.27 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 57.61 2f6n h LYS 110 Cb 1.11 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 31.35 2f6n h LYS 110 CO 0.81 0.46 -0.75 0.39 -1.08 0.00 0.00 179.45 179.27 2f6n n GLU 111 N -3.10 1.82 -0.77 3.15 1.02 -1.26 -5.15 120.64 116.35 2f6n n GLU 111 Ca -0.03 -4.17 -0.30 0.00 -0.02 0.00 0.00 57.16 52.64 2f6n n GLU 111 Cb 0.80 -1.94 0.26 0.00 -0.02 0.00 0.00 31.44 30.54 2f6n n GLU 111 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2f6n s PRO 112 N -1.86 -1.84 0.00 3.49 0.04 -1.26 -4.95 135.00 128.61 2f6n s PRO 112 Ca 0.36 0.10 0.00 0.00 0.04 0.00 0.00 61.00 61.50 2f6n s PRO 112 Cb 0.13 -1.51 0.00 0.00 0.04 0.00 0.00 34.50 33.16 2f6n s PRO 112 CO -0.07 -4.15 0.00 -0.40 0.04 0.00 0.00 177.00 172.42 2f6n n ASP 114 N -5.11 0.00 0.19 6.66 5.75 -1.26 -5.06 116.55 117.72 2f6n n ASP 114 Ca 0.12 0.00 0.03 0.00 -0.01 0.00 0.00 54.79 54.93 2f6n n ASP 114 Cb 0.59 0.00 0.36 0.00 -1.03 0.00 0.00 41.12 41.04 2f6n n ASP 114 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 2f6n h LEU 115 N 0.00 0.00 -0.37 -2.12 3.38 -1.15 -2.95 115.31 112.10 2f6n h LEU 115 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 2f6n h LEU 115 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2f6n h LEU 115 CO 0.00 0.38 -0.07 0.00 0.09 0.00 0.00 178.44 178.84 2f6n h ALA 116 N 1.62 0.51 0.00 1.53 0.00 -1.48 -1.11 119.26 120.33 2f6n h ALA 116 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2f6n h ALA 116 Cb 0.70 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2f6n h ALA 116 CO 0.05 0.35 0.00 2.41 0.00 0.00 0.00 179.25 182.06 2f6n n THR 117 N -4.40 0.28 0.00 0.00 -1.04 -1.12 -1.68 114.28 106.32 2f6n n THR 117 Ca -0.02 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2f6n n THR 117 Cb 0.33 -0.65 0.00 0.00 -1.82 0.00 0.00 70.33 68.20 2f6n n THR 117 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2f6n n GLU 119 N 0.89 0.00 0.09 -2.82 2.13 -0.42 -1.56 120.64 118.95 2f6n n GLU 119 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 2f6n n GLU 119 Cb 0.14 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.77 2f6n n GLU 119 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2f6n h GLU 120 N 0.00 -0.14 -0.65 5.31 5.08 -1.60 -0.44 114.58 122.15 2f6n h GLU 120 Ca 0.00 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2f6n h GLU 120 Cb 0.00 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 2f6n h GLU 120 CO 0.00 -0.09 0.32 0.00 -1.00 0.00 0.00 179.01 178.24 2f6n h ARG 121 N -0.15 0.91 -0.42 2.33 3.08 -1.57 -1.84 114.38 116.72 2f6n h ARG 121 Ca -0.01 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 59.85 2f6n h ARG 121 Cb 0.12 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 2f6n h ARG 121 CO 0.02 0.69 -0.04 0.28 -1.07 0.00 0.00 179.97 179.85 2f6n h VAL 122 N 0.91 1.27 -0.70 2.04 2.07 -1.76 0.35 116.25 120.43 2f6n h VAL 122 Ca 0.23 -1.10 0.02 0.00 0.82 0.00 0.00 66.70 66.67 2f6n h VAL 122 Cb 0.08 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 2f6n h VAL 122 CO -0.03 0.37 0.45 -0.61 0.02 0.00 0.00 177.57 177.77 2f6n h GLN 123 N 0.59 0.86 -0.56 1.57 4.15 -0.54 -1.22 115.11 119.96 2f6n h GLN 123 Ca 0.11 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.48 2f6n h GLN 123 Cb 0.55 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.04 2f6n h GLN 123 CO 0.03 0.57 0.00 2.89 -1.93 0.00 0.00 178.83 180.39 2f6n n ARG 124 N -4.64 2.39 -3.84 1.69 1.85 -0.74 -4.91 116.66 108.46 2f6n n ARG 124 Ca 0.07 -1.49 -0.26 0.00 -1.00 0.00 0.00 57.85 55.17 2f6n n ARG 124 Cb 0.07 -1.57 0.02 0.00 -1.05 0.00 0.00 32.46 29.93 2f6n n ARG 124 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2f6n n ARG 125 N 0.49 -4.85 0.09 2.89 5.12 -0.46 -4.88 116.66 115.06 2f6n n ARG 125 Ca 0.14 0.57 0.00 0.00 -1.93 0.00 0.00 57.85 56.63 2f6n n ARG 125 Cb 0.51 -5.20 0.30 0.00 -1.16 0.00 0.00 32.46 26.91 2f6n n ARG 125 CO 0.00 0.00 0.00 -0.92 -1.93 0.00 0.00 177.63 174.78 2f6n h TYR 126 N -1.93 0.31 -3.57 -1.55 5.03 -0.55 -3.43 116.97 111.28 2f6n h TYR 126 Ca -0.60 -0.05 -0.52 0.00 2.58 0.00 0.00 58.73 60.14 2f6n h TYR 126 Cb 1.37 -0.08 -0.02 0.00 1.55 0.00 0.00 36.73 39.54 2f6n h TYR 126 CO 0.51 0.50 0.32 0.71 -1.32 0.00 0.00 178.16 178.89 2f6n s TYR 127 N -4.51 3.83 -0.16 -3.82 2.02 -1.26 -4.95 117.35 108.51 2f6n s TYR 127 Ca -0.05 1.76 0.13 0.00 -0.37 0.00 0.00 57.07 58.53 2f6n s TYR 127 Cb 0.14 -2.99 -0.18 0.00 -0.40 0.00 0.00 41.96 38.53 2f6n s TYR 127 CO 0.75 0.26 0.34 0.39 -1.57 0.00 0.00 175.55 175.73 2f6n n GLU 128 N 2.58 1.01 -3.99 -0.62 1.02 -1.26 -4.82 120.64 114.56 2f6n n GLU 128 Ca 0.01 -0.09 -0.09 0.00 -0.02 0.00 0.00 57.16 56.97 2f6n n GLU 128 Cb 0.49 -1.25 -0.11 0.00 -0.02 0.00 0.00 31.44 30.55 2f6n n GLU 128 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2f6n s LYS 129 N -2.71 0.36 0.39 3.49 1.02 -1.26 -0.94 119.74 120.09 2f6n s LYS 129 Ca -0.02 -0.67 0.09 0.00 0.02 0.00 0.00 55.97 55.39 2f6n s LYS 129 Cb 0.08 0.13 0.85 0.00 -0.52 0.00 0.00 37.83 38.38 2f6n s LYS 129 CO 0.52 -0.06 1.97 1.25 -0.92 0.00 0.00 175.35 178.11 2f6n h LEU 130 N 4.45 0.54 -0.96 3.17 5.85 -1.77 -1.99 115.31 124.60 2f6n h LEU 130 Ca -0.32 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.49 2f6n h LEU 130 Cb 1.20 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 42.05 2f6n h LEU 130 CO 0.44 0.35 0.60 0.00 -0.34 0.00 0.00 178.44 179.49 2f6n h THR 131 N 0.62 1.02 -0.45 1.05 1.03 -1.92 -1.36 112.91 112.89 2f6n h THR 131 Ca 0.29 -0.36 -0.10 0.00 -0.01 0.00 0.00 66.41 66.23 2f6n h THR 131 Cb 0.35 -0.13 -0.01 0.00 -1.07 0.00 0.00 68.15 67.28 2f6n h THR 131 CO -0.09 0.19 -0.11 -0.33 -0.01 0.00 0.00 175.52 175.17 2f6n h GLU 132 N 1.05 0.87 -0.25 0.00 5.08 -1.70 0.13 114.58 119.76 2f6n h GLU 132 Ca 0.44 -0.33 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2f6n h GLU 132 Cb 0.27 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2f6n h GLU 132 CO -0.21 0.97 0.15 0.35 -1.00 0.00 0.00 179.01 179.27 2f6n h PHE 133 N 0.70 0.33 -0.46 4.33 3.57 -1.43 -1.85 116.94 122.12 2f6n h PHE 133 Ca 0.11 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 2f6n h PHE 133 Cb 0.65 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 2f6n h PHE 133 CO 0.05 0.25 0.15 0.28 -2.23 0.00 0.00 178.31 176.81 2f6n h VAL 134 N 0.30 1.19 -0.46 1.41 2.07 -1.10 -2.67 116.25 116.98 2f6n h VAL 134 Ca 0.09 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 2f6n h VAL 134 Cb 0.02 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 2f6n h VAL 134 CO -0.02 0.23 0.23 0.00 0.02 0.00 0.00 177.57 178.04 2f6n h ALA 135 N 1.51 0.60 0.00 1.67 0.00 -0.37 -0.77 119.26 121.90 2f6n h ALA 135 Ca 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2f6n h ALA 135 Cb 0.18 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2f6n h ALA 135 CO -0.01 0.16 0.00 -0.25 0.00 0.00 0.00 179.25 179.15 2f6n n ASP 136 N -4.64 0.15 0.00 0.00 9.92 -0.75 -1.19 116.55 120.04 2f6n n ASP 136 Ca 0.01 -0.19 0.00 0.00 -0.53 0.00 0.00 54.79 54.09 2f6n n ASP 136 Cb 0.11 -0.05 0.00 0.00 -0.64 0.00 0.00 41.12 40.54 2f6n n ASP 136 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 2f6n n THR 138 N 0.61 0.00 -0.20 -3.53 -1.04 -0.30 -2.47 114.28 107.36 2f6n n THR 138 Ca 0.00 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 61.98 2f6n n THR 138 Cb 0.03 0.00 0.16 0.00 -1.82 0.00 0.00 70.33 68.70 2f6n n THR 138 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2f6n h LYS 139 N 0.00 0.97 -0.24 -2.82 3.64 -1.40 0.23 116.57 116.96 2f6n h LYS 139 Ca 0.00 -0.16 -0.00 0.00 -1.27 0.00 0.00 60.65 59.22 2f6n h LYS 139 Cb 0.00 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 2f6n h LYS 139 CO 0.00 0.80 0.15 0.82 -2.27 0.00 0.00 179.45 178.95 2f6n h ILE 140 N 0.95 1.08 -0.33 2.00 2.04 -1.76 -0.38 117.51 121.12 2f6n h ILE 140 Ca 0.22 -0.18 -0.16 0.00 1.00 0.00 0.00 64.86 65.74 2f6n h ILE 140 Cb 0.20 0.78 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 2f6n h ILE 140 CO -0.02 0.08 -0.43 -0.26 0.00 0.00 0.00 178.15 177.52 2f6n h PHE 141 N 0.30 1.06 -0.53 1.37 0.04 -1.76 -2.78 116.94 114.65 2f6n h PHE 141 Ca 0.09 -0.34 -0.05 0.00 2.80 0.00 0.00 57.97 60.46 2f6n h PHE 141 Cb 0.00 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 37.92 2f6n h PHE 141 CO -0.05 1.16 0.13 -0.44 -0.60 0.00 0.00 178.31 178.50 2f6n h ASP 142 N 0.66 0.80 -0.97 2.17 3.32 -0.46 -1.68 116.42 120.27 2f6n h ASP 142 Ca 0.04 -0.23 0.01 0.00 0.02 0.00 0.00 57.03 56.86 2f6n h ASP 142 Cb 1.02 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 40.32 2f6n h ASP 142 CO 0.10 0.83 0.64 0.78 -1.72 0.00 0.00 179.24 179.87 2f6n h ASN 143 N 0.74 1.11 0.09 6.45 2.35 -1.07 0.31 115.58 125.56 2f6n h ASN 143 Ca 0.16 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2f6n h ASN 143 Cb 0.34 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.43 2f6n h ASN 143 CO 0.00 0.81 -0.04 0.00 -1.65 0.00 0.00 177.43 176.54 2f6n h ARG 145 N -0.31 0.00 0.05 0.00 3.08 -1.04 -0.74 114.38 115.42 2f6n h ARG 145 Ca -0.01 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 2f6n h ARG 145 Cb 0.26 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.32 2f6n h ARG 145 CO 0.02 0.11 -0.41 -0.92 -1.07 0.00 0.00 179.97 177.70 2f6n h TYR 146 N 0.00 0.31 -0.30 3.04 3.20 -0.71 -3.36 116.97 119.15 2f6n h TYR 146 Ca -0.00 -0.21 -0.14 0.00 3.14 0.00 0.00 58.73 61.53 2f6n h TYR 146 Cb 0.35 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.59 2f6n h TYR 146 CO 0.00 1.11 -0.34 -0.92 -1.64 0.00 0.00 178.16 176.37 2f6n h TYR 147 N -0.58 0.93 -3.12 -3.82 3.20 -1.02 -3.45 116.97 109.10 2f6n h TYR 147 Ca -0.07 -0.29 -0.59 0.00 3.14 0.00 0.00 58.73 60.93 2f6n h TYR 147 Cb 1.27 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 39.31 2f6n h TYR 147 CO 0.22 1.06 -0.34 -0.80 -1.64 0.00 0.00 178.16 176.66 2f6n s ASN 148 N -6.65 6.48 0.69 -2.11 -0.87 -0.30 -5.09 114.94 107.09 2f6n s ASN 148 Ca -0.12 0.56 -0.14 0.00 -1.57 0.00 0.00 52.86 51.59 2f6n s ASN 148 Cb 0.09 -2.08 0.01 0.00 -0.02 0.00 0.00 41.25 39.26 2f6n s ASN 148 CO 0.85 0.08 1.11 -2.16 -2.57 0.00 0.00 177.10 174.40 2f6n s PRO 149 N -2.57 2.67 0.62 -0.60 0.04 -1.26 -4.70 135.00 129.19 2f6n s PRO 149 Ca 0.39 1.34 0.36 0.00 0.04 0.00 0.00 61.00 63.13 2f6n s PRO 149 Cb -0.12 -1.94 2.04 0.00 0.04 0.00 0.00 34.50 34.52 2f6n s PRO 149 CO 0.24 -1.34 2.29 0.66 0.04 0.00 0.00 177.00 178.89 2f6n h SER 150 N -0.25 0.00 -0.13 6.66 4.64 -1.98 -0.62 113.55 121.87 2f6n h SER 150 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2f6n h SER 150 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2f6n h SER 150 CO 0.53 0.01 0.00 -0.90 -0.87 0.00 0.00 176.83 175.60 2f6n n ASP 151 N -3.52 1.40 -4.77 4.97 5.75 -1.26 -4.55 116.55 114.56 2f6n n ASP 151 Ca -0.03 -1.65 -0.40 0.00 -0.01 0.00 0.00 54.79 52.71 2f6n n ASP 151 Cb 0.09 -0.08 -0.06 0.00 -1.03 0.00 0.00 41.12 40.04 2f6n n ASP 151 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2f6n s SER 152 N -1.59 7.38 0.50 -1.12 0.15 -0.24 -4.95 113.70 113.83 2f6n s SER 152 Ca 0.32 1.64 0.18 0.00 0.70 0.00 0.00 55.95 58.79 2f6n s SER 152 Cb 0.17 -2.50 1.25 0.00 -1.71 0.00 0.00 66.02 63.23 2f6n s SER 152 CO 0.26 0.17 2.07 -0.65 1.20 0.00 0.00 173.24 176.29 2f6n h PRO 153 N 4.54 0.09 -0.29 5.44 0.11 -1.89 -1.15 132.00 138.84 2f6n h PRO 153 Ca -0.46 -0.01 -0.19 0.00 0.11 0.00 0.00 66.00 65.45 2f6n h PRO 153 Cb 1.21 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2f6n h PRO 153 CO 0.67 0.06 -0.54 0.74 -0.21 0.00 0.00 178.00 178.72 2f6n h PHE 154 N 0.09 1.11 -0.33 0.65 0.04 -1.92 0.14 116.94 116.72 2f6n h PHE 154 Ca 0.13 -0.39 -0.01 0.00 2.80 0.00 0.00 57.97 60.49 2f6n h PHE 154 Cb 0.40 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 2f6n h PHE 154 CO -0.00 1.23 0.16 -0.92 -0.60 0.00 0.00 178.31 178.17 2f6n h TYR 155 N 0.68 0.48 -0.74 -0.55 5.03 -1.49 -1.27 116.97 119.11 2f6n h TYR 155 Ca 0.02 -0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.26 2f6n h TYR 155 Cb 1.15 -0.15 -0.03 0.00 1.55 0.00 0.00 36.73 39.25 2f6n h TYR 155 CO 0.07 0.42 0.27 1.96 -1.32 0.00 0.00 178.16 179.57 2f6n h GLN 156 N 0.39 1.10 -0.71 1.82 1.08 -1.17 -2.44 115.11 115.20 2f6n h GLN 156 Ca 0.11 -0.20 0.00 0.00 -1.45 0.00 0.00 58.65 57.11 2f6n h GLN 156 Cb 0.12 -0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 27.34 2f6n h GLN 156 CO -0.01 0.91 0.44 0.00 -0.95 0.00 0.00 178.83 179.22 2f6n h ALA 158 N 1.24 1.09 0.09 0.00 0.00 -0.80 0.12 119.26 121.00 2f6n h ALA 158 Ca 0.26 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.17 2f6n h ALA 158 Cb -0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2f6n h ALA 158 CO -0.05 0.20 -0.10 0.93 0.00 0.00 0.00 179.25 180.23 2f6n h GLU 159 N 0.88 -0.22 0.06 0.00 4.39 -0.87 -0.98 114.58 117.85 2f6n h GLU 159 Ca 0.35 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 60.06 2f6n h GLU 159 Cb 0.18 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 2f6n h GLU 159 CO -0.18 -0.14 -0.03 0.28 -1.16 0.00 0.00 179.01 177.78 2f6n h VAL 160 N -0.22 0.94 -0.72 3.13 2.07 -0.60 -2.68 116.25 118.18 2f6n h VAL 160 Ca 0.01 -0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 2f6n h VAL 160 Cb 0.23 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 2f6n h VAL 160 CO -0.04 0.00 0.47 -0.07 0.02 0.00 0.00 177.57 177.95 2f6n h LEU 161 N -0.08 0.82 -0.82 2.57 4.07 -0.68 -1.70 115.31 119.49 2f6n h LEU 161 Ca -0.01 -0.02 -0.09 0.00 0.08 0.00 0.00 57.88 57.83 2f6n h LEU 161 Cb 0.06 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 41.58 2f6n h LEU 161 CO 0.01 0.60 -0.14 -0.08 -1.08 0.00 0.00 178.44 177.75 2f6n h GLU 162 N 0.97 0.73 -0.12 1.13 4.81 -1.01 0.68 114.58 121.76 2f6n h GLU 162 Ca 0.26 -0.25 -0.10 0.00 -0.13 0.00 0.00 59.36 59.14 2f6n h GLU 162 Cb -0.11 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 2f6n h GLU 162 CO -0.06 0.84 -0.36 1.03 -0.73 0.00 0.00 179.01 179.73 2f6n h SER 163 N 0.66 0.26 -0.30 1.04 0.87 -1.08 0.35 113.55 115.36 2f6n h SER 163 Ca 0.11 -0.10 -0.16 0.00 -1.23 0.00 0.00 61.79 60.41 2f6n h SER 163 Cb 0.61 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 2f6n h SER 163 CO 0.04 0.61 -0.42 0.15 -0.53 0.00 0.00 176.83 176.68 2f6n h PHE 164 N 0.22 1.03 -0.09 2.24 3.57 -0.82 -2.26 116.94 120.83 2f6n h PHE 164 Ca 0.02 -0.32 -0.01 0.00 3.53 0.00 0.00 57.97 61.20 2f6n h PHE 164 Cb 0.75 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.27 2f6n h PHE 164 CO 0.01 1.12 0.02 0.35 -2.23 0.00 0.00 178.31 177.59 2f6n h PHE 165 N 0.69 0.16 -0.91 0.41 3.57 -0.37 -1.20 116.94 119.30 2f6n h PHE 165 Ca 0.05 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.58 2f6n h PHE 165 Cb 1.00 -0.05 -0.06 0.00 2.79 0.00 0.00 35.95 39.64 2f6n h PHE 165 CO 0.06 0.33 0.60 0.28 -2.23 0.00 0.00 178.31 177.35 2f6n h VAL 166 N -0.06 1.11 -0.38 1.41 2.07 -0.92 -0.98 116.25 118.51 2f6n h VAL 166 Ca 0.03 -0.38 -0.07 0.00 0.82 0.00 0.00 66.70 67.11 2f6n h VAL 166 Cb 0.25 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 2f6n h VAL 166 CO 0.00 0.20 -0.02 1.56 0.02 0.00 0.00 177.57 179.33 2f6n h GLN 167 N 1.09 0.68 0.00 1.57 4.20 -1.17 -2.10 115.11 119.39 2f6n h GLN 167 Ca 0.38 -0.23 -0.05 0.00 0.06 0.00 0.00 58.65 58.81 2f6n h GLN 167 Cb 0.10 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 2f6n h GLN 167 CO -0.13 0.79 -0.21 0.87 -0.67 0.00 0.00 178.83 179.48 2f6n h LYS 168 N 0.50 0.00 -0.06 1.46 1.79 -0.58 -2.66 116.57 117.03 2f6n h LYS 168 Ca 0.11 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.37 2f6n h LYS 168 Cb 0.50 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 2f6n h LYS 168 CO 0.02 0.21 -0.82 -0.07 -1.08 0.00 0.00 179.45 177.72 2f6n h LEU 169 N 0.00 0.57 0.00 2.94 3.38 -0.94 -3.49 115.31 117.77 2f6n h LEU 169 Ca -0.00 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2f6n h LEU 169 Cb 0.38 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2f6n h LEU 169 CO 0.03 1.17 0.00 0.29 0.09 0.00 0.00 178.44 180.02