#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ff0 s GLU 11 N 0.00 4.35 0.11 -0.67 0.41 -1.26 -5.01 118.70 116.62 2ff0 s GLU 11 Ca 0.00 2.11 0.05 0.00 -0.41 0.00 0.00 54.97 56.72 2ff0 s GLU 11 Cb 0.00 -3.19 -0.04 0.00 -1.78 0.00 0.00 34.13 29.13 2ff0 s GLU 11 CO 0.00 -0.33 -0.12 -0.51 -0.49 0.00 0.00 175.26 173.81 2ff0 s LEU 12 N 0.12 2.39 -0.17 1.80 1.43 -1.26 -3.22 118.68 119.76 2ff0 s LEU 12 Ca 0.59 -0.79 -0.29 0.00 -1.03 0.00 0.00 54.13 52.61 2ff0 s LEU 12 Cb -0.38 -0.43 -0.04 0.00 0.03 0.00 0.00 46.19 45.37 2ff0 s LEU 12 CO 0.37 -0.19 1.67 0.00 0.23 0.00 0.00 176.35 178.43 2ff0 n PRO 14 N 7.60 0.15 -0.02 0.00 -0.04 -1.26 -0.52 135.00 140.91 2ff0 n PRO 14 Ca 0.19 0.19 -0.00 0.00 -0.04 0.00 0.00 63.50 63.84 2ff0 n PRO 14 Cb 0.45 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.41 2ff0 n PRO 14 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2ff0 h VAL 15 N 0.00 0.00 0.00 0.52 2.07 -1.89 -3.44 116.25 113.51 2ff0 h VAL 15 Ca 0.00 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 67.09 2ff0 h VAL 15 Cb 0.11 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.88 2ff0 h VAL 15 CO 0.00 0.00 -1.54 0.00 0.02 0.00 0.00 177.57 176.05 2ff0 n GLY 17 N 2.01 0.99 3.85 0.00 0.00 0.32 -4.51 105.19 107.84 2ff0 n GLY 17 Ca -0.05 -0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 2ff0 n GLY 17 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ff0 s ASP 18 N -2.00 4.56 0.32 1.61 1.01 -1.26 -4.66 116.67 116.26 2ff0 s ASP 18 Ca 0.00 1.05 -0.28 0.00 0.71 0.00 0.00 52.55 54.03 2ff0 s ASP 18 Cb 0.00 -1.71 -0.10 0.00 1.01 0.00 0.00 42.92 42.12 2ff0 s ASP 18 CO 0.00 -1.89 1.19 -0.54 0.21 0.00 0.00 175.17 174.13 2ff0 s LYS 19 N -5.35 4.42 0.49 8.23 1.02 -1.26 0.41 119.74 127.70 2ff0 s LYS 19 Ca 0.61 1.96 -0.22 0.00 0.02 0.00 0.00 55.97 58.34 2ff0 s LYS 19 Cb -0.13 -3.04 -0.07 0.00 -0.52 0.00 0.00 37.83 34.08 2ff0 s LYS 19 CO 0.52 -0.04 1.18 0.14 -0.92 0.00 0.00 175.35 176.23 2ff0 s VAL 20 N -1.21 3.00 -0.39 3.17 -7.23 -1.20 -4.48 120.40 112.06 2ff0 s VAL 20 Ca 0.49 0.72 0.13 0.00 -1.81 0.00 0.00 61.98 61.51 2ff0 s VAL 20 Cb -0.34 -3.35 0.36 0.00 0.56 0.00 0.00 36.38 33.61 2ff0 s VAL 20 CO 0.45 -0.04 1.28 -1.20 -0.31 0.00 0.00 175.10 175.28 2ff0 n SER 21 N -0.73 3.14 0.00 4.85 7.64 0.16 -4.91 113.62 123.77 2ff0 n SER 21 Ca 0.09 -2.59 0.00 0.00 1.01 0.00 0.00 58.87 57.38 2ff0 n SER 21 Cb 0.48 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 2ff0 n SER 21 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ff0 n GLY 22 N -0.32 -2.10 3.67 0.23 0.00 -1.21 -4.93 105.19 100.53 2ff0 n GLY 22 Ca 0.15 -2.15 -0.43 0.00 0.00 0.00 0.00 46.02 43.59 2ff0 n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ff0 s TYR 23 N -0.49 3.38 0.16 1.61 1.51 -1.26 -0.93 117.35 121.34 2ff0 s TYR 23 Ca 0.00 1.48 0.00 0.00 -1.01 0.00 0.00 57.07 57.54 2ff0 s TYR 23 Cb 0.00 -3.23 0.00 0.00 -0.11 0.00 0.00 41.96 38.62 2ff0 s TYR 23 CO 0.00 -0.41 0.00 0.72 -1.11 0.00 0.00 175.55 174.75 2ff0 n HIS 24 N 5.98 -1.63 -3.06 2.71 8.25 -0.95 -4.95 115.22 121.58 2ff0 n HIS 24 Ca 0.11 0.31 -0.43 0.00 -0.26 0.00 0.00 57.72 57.45 2ff0 n HIS 24 Cb 0.47 0.76 0.01 0.00 1.12 0.00 0.00 29.99 32.35 2ff0 n HIS 24 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2ff0 n TYR 25 N -3.01 2.72 0.00 4.41 4.02 -1.26 -4.70 117.16 119.34 2ff0 n TYR 25 Ca 0.00 -2.80 0.00 0.00 -0.01 0.00 0.00 57.90 55.09 2ff0 n TYR 25 Cb 0.00 -1.31 0.00 0.00 -0.02 0.00 0.00 39.34 38.01 2ff0 n TYR 25 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2ff0 n GLY 26 N 1.51 2.84 0.00 2.72 0.00 -1.26 -3.42 105.19 107.58 2ff0 n GLY 26 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 2ff0 n GLY 26 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2ff0 n LEU 27 N 0.00 0.00 -4.58 0.99 -0.00 -1.26 -4.87 117.00 107.28 2ff0 n LEU 27 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 56.01 55.60 2ff0 n LEU 27 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.39 2ff0 n LEU 27 CO 0.00 0.00 1.90 0.18 -0.00 0.00 0.00 177.39 179.47 2ff0 n LEU 28 N 0.00 2.98 -4.15 1.47 7.99 -1.26 -2.23 117.00 121.80 2ff0 n LEU 28 Ca 0.00 0.01 -0.17 0.00 -0.01 0.00 0.00 56.01 55.85 2ff0 n LEU 28 Cb 0.00 -1.56 -0.12 0.00 -0.11 0.00 0.00 43.42 41.64 2ff0 n LEU 28 CO 0.00 -0.93 -0.44 0.42 -1.51 0.00 0.00 177.39 174.93 2ff0 s THR 29 N 9.36 0.97 0.17 -5.08 -4.23 -0.11 -4.50 115.64 112.21 2ff0 s THR 29 Ca 1.01 -1.32 0.05 0.00 -1.18 0.00 0.00 61.69 60.24 2ff0 s THR 29 Cb -0.31 -1.03 -0.04 0.00 1.34 0.00 0.00 72.50 72.47 2ff0 s THR 29 CO 0.33 -0.32 0.17 0.00 -0.54 0.00 0.00 174.62 174.26 2ff0 h GLU 31 N 2.31 0.00 -0.22 0.00 4.57 -1.93 0.48 114.58 119.79 2ff0 h GLU 31 Ca -0.48 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 57.63 2ff0 h GLU 31 Cb 1.20 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.79 2ff0 h GLU 31 CO 0.64 0.04 -0.14 0.66 -1.18 0.00 0.00 179.01 179.03 2ff0 h SER 32 N 0.00 0.51 0.28 1.04 4.64 -1.94 0.49 113.55 118.57 2ff0 h SER 32 Ca -0.00 -0.44 -0.20 0.00 -0.47 0.00 0.00 61.79 60.68 2ff0 h SER 32 Cb 0.21 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2ff0 h SER 32 CO 0.01 0.84 -0.82 0.00 -0.87 0.00 0.00 176.83 175.98 2ff0 h LYS 34 N 0.26 0.08 -0.14 0.00 3.64 -0.82 0.32 116.57 119.93 2ff0 h LYS 34 Ca -0.05 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2ff0 h LYS 34 Cb 1.43 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.22 2ff0 h LYS 34 CO 0.14 0.06 0.08 0.78 -2.27 0.00 0.00 179.45 178.24 2ff0 h GLY 35 N 0.09 0.20 0.92 5.01 0.00 0.00 -0.34 103.07 108.95 2ff0 h GLY 35 Ca 0.09 -0.08 0.02 0.00 0.00 0.00 0.00 47.33 47.36 2ff0 h GLY 35 CO -0.14 0.08 0.51 -2.75 0.00 0.00 0.00 176.54 174.24 2ff0 h PHE 36 N 0.15 0.97 -0.15 5.60 3.57 -1.04 0.14 116.94 126.18 2ff0 h PHE 36 Ca 0.05 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 2ff0 h PHE 36 Cb 0.03 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.44 2ff0 h PHE 36 CO -0.05 0.58 0.07 0.35 -2.23 0.00 0.00 178.31 177.02 2ff0 h PHE 37 N 1.02 0.21 -0.36 0.41 3.57 -0.14 -0.78 116.94 120.87 2ff0 h PHE 37 Ca 0.31 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.86 2ff0 h PHE 37 Cb -0.04 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 38.58 2ff0 h PHE 37 CO -0.02 0.24 0.01 0.87 -2.23 0.00 0.00 178.31 177.17 2ff0 h LYS 38 N 0.12 0.11 -0.39 1.11 1.57 -0.58 0.45 116.57 118.95 2ff0 h LYS 38 Ca 0.05 -0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.88 2ff0 h LYS 38 Cb 0.11 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.35 2ff0 h LYS 38 CO -0.01 0.07 0.12 0.00 -0.57 0.00 0.00 179.45 179.07 2ff0 h ARG 39 N 0.11 0.27 0.17 3.15 2.47 -0.37 -1.84 114.38 118.34 2ff0 h ARG 39 Ca 0.17 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.87 2ff0 h ARG 39 Cb 0.23 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 2ff0 h ARG 39 CO -0.28 0.18 -0.08 1.15 0.56 0.00 0.00 179.97 181.49 2ff0 h THR 40 N 0.27 0.70 -0.36 2.04 2.02 -0.81 -3.16 112.91 113.61 2ff0 h THR 40 Ca 0.18 -1.11 -0.09 0.00 0.77 0.00 0.00 66.41 66.16 2ff0 h THR 40 Cb 0.18 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 2ff0 h THR 40 CO -0.20 0.19 -0.14 0.58 0.37 0.00 0.00 175.52 176.32 2ff0 h VAL 41 N -0.92 1.28 -0.30 3.16 2.07 -0.95 0.17 116.25 120.76 2ff0 h VAL 41 Ca -0.02 -1.25 -0.10 0.00 0.82 0.00 0.00 66.70 66.14 2ff0 h VAL 41 Cb 0.49 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2ff0 h VAL 41 CO 0.04 0.41 -0.25 1.56 0.02 0.00 0.00 177.57 179.35 2ff0 h GLN 42 N 0.52 0.59 -0.38 1.57 1.08 -1.49 -0.59 115.11 116.42 2ff0 h GLN 42 Ca 0.08 -0.23 0.00 0.00 -1.45 0.00 0.00 58.65 57.05 2ff0 h GLN 42 Cb 0.67 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.07 2ff0 h GLN 42 CO 0.05 0.79 0.00 0.09 -0.95 0.00 0.00 178.83 178.81 2ff0 n ASN 43 N -4.11 1.88 -4.24 1.46 3.02 -1.18 -4.89 115.26 107.20 2ff0 n ASN 43 Ca -0.00 -2.05 -0.35 0.00 -0.03 0.00 0.00 54.58 52.15 2ff0 n ASN 43 Cb 0.42 -0.26 -0.04 0.00 -0.61 0.00 0.00 39.78 39.29 2ff0 n ASN 43 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2ff0 n ASN 44 N 0.43 -2.06 -4.90 6.41 0.23 -0.23 -4.90 115.26 110.24 2ff0 n ASN 44 Ca 0.11 -1.08 -0.28 0.00 -0.53 0.00 0.00 54.58 52.80 2ff0 n ASN 44 Cb 0.32 -2.51 -0.01 0.00 -2.08 0.00 0.00 39.78 35.50 2ff0 n ASN 44 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2ff0 s LYS 45 N -6.96 3.59 -0.13 -3.83 1.02 0.55 -5.02 119.74 108.97 2ff0 s LYS 45 Ca 0.54 0.22 -0.04 0.00 0.02 0.00 0.00 55.97 56.71 2ff0 s LYS 45 Cb -0.30 -2.40 0.06 0.00 -0.52 0.00 0.00 37.83 34.67 2ff0 s LYS 45 CO 0.94 -0.13 0.21 -3.38 -0.92 0.00 0.00 175.35 172.07 2ff0 s HIS 46 N -2.61 -0.30 0.66 3.18 -3.43 -1.26 -4.76 115.29 106.77 2ff0 s HIS 46 Ca 0.48 0.68 -0.02 0.00 -0.80 0.00 0.00 55.06 55.40 2ff0 s HIS 46 Cb -0.10 -0.19 0.08 0.00 -1.43 0.00 0.00 32.58 30.94 2ff0 s HIS 46 CO 0.41 -0.37 0.93 0.71 -2.00 0.00 0.00 174.74 174.42 2ff0 s TYR 47 N 2.35 2.35 -0.09 0.38 2.02 -1.26 -5.10 117.35 118.01 2ff0 s TYR 47 Ca 0.03 -0.00 -0.00 0.00 -0.37 0.00 0.00 57.07 56.73 2ff0 s TYR 47 Cb -0.13 -2.99 0.02 0.00 -0.40 0.00 0.00 41.96 38.47 2ff0 s TYR 47 CO -0.08 -1.37 -0.05 0.99 -1.57 0.00 0.00 175.55 173.47 2ff0 s THR 48 N -3.05 0.75 -0.35 -0.71 2.01 -1.26 -4.89 115.64 108.14 2ff0 s THR 48 Ca 0.62 -0.14 -0.15 0.00 0.31 0.00 0.00 61.69 62.32 2ff0 s THR 48 Cb -0.08 -0.81 -0.01 0.00 0.01 0.00 0.00 72.50 71.61 2ff0 s THR 48 CO 0.42 0.31 0.36 0.00 -0.69 0.00 0.00 174.62 175.03 2ff0 n THR 50 N 5.25 0.30 -0.46 0.00 -2.24 -1.26 -4.61 114.28 111.26 2ff0 n THR 50 Ca -0.09 0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2ff0 n THR 50 Cb 0.49 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 68.06 2ff0 n THR 50 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ff0 n GLU 51 N -1.44 3.29 -0.03 -0.78 -0.58 -1.26 -4.94 120.64 114.90 2ff0 n GLU 51 Ca 0.07 0.00 0.09 0.00 -0.42 0.00 0.00 57.16 56.90 2ff0 n GLU 51 Cb 0.26 0.00 0.43 0.00 -0.57 0.00 0.00 31.44 31.56 2ff0 n GLU 51 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2ff0 n SER 52 N 0.00 0.62 0.00 1.62 3.41 -1.26 -4.91 113.62 113.10 2ff0 n SER 52 Ca 0.00 -1.59 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 2ff0 n SER 52 Cb 0.00 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 2ff0 n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ff0 n GLN 53 N -0.35 0.00 -1.48 4.33 6.02 -1.26 -4.69 117.38 119.95 2ff0 n GLN 53 Ca 0.13 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.73 2ff0 n GLN 53 Cb 0.15 -0.04 -0.02 0.00 1.02 0.00 0.00 30.24 31.36 2ff0 n GLN 53 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2ff0 n SER 54 N 1.63 7.97 -4.94 1.08 7.64 -1.26 -4.62 113.62 121.11 2ff0 n SER 54 Ca 0.00 -2.69 -0.24 0.00 1.01 0.00 0.00 58.87 56.95 2ff0 n SER 54 Cb 0.00 -1.54 0.04 0.00 -1.01 0.00 0.00 64.21 61.69 2ff0 n SER 54 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ff0 s LYS 56 N -4.88 4.31 -0.92 0.00 3.01 -1.26 -5.00 119.74 114.99 2ff0 s LYS 56 Ca 0.55 0.61 -0.20 0.00 -1.01 0.00 0.00 55.97 55.92 2ff0 s LYS 56 Cb -0.10 -3.49 0.11 0.00 -1.01 0.00 0.00 37.83 33.33 2ff0 s LYS 56 CO 0.41 -0.02 1.18 0.42 0.51 0.00 0.00 175.35 177.86 2ff0 s ILE 57 N 1.16 4.51 0.57 2.17 -1.09 -1.26 -4.62 121.20 122.65 2ff0 s ILE 57 Ca 0.30 -1.28 0.09 0.00 -2.23 0.00 0.00 60.65 57.53 2ff0 s ILE 57 Cb -0.16 -4.83 0.08 0.00 -1.58 0.00 0.00 42.46 35.97 2ff0 s ILE 57 CO 0.12 -1.60 0.71 -0.62 -1.23 0.00 0.00 174.94 172.33 2ff0 s ASP 58 N 3.93 4.98 0.28 3.58 2.15 -1.26 -4.76 116.67 125.56 2ff0 s ASP 58 Ca 0.35 -0.96 -0.03 0.00 0.43 0.00 0.00 52.55 52.34 2ff0 s ASP 58 Cb -0.05 0.37 0.40 0.00 -0.30 0.00 0.00 42.92 43.34 2ff0 s ASP 58 CO -0.08 -1.32 1.92 0.11 -0.17 0.00 0.00 175.17 175.64 2ff0 h LYS 59 N 0.28 1.16 0.09 4.34 1.57 -1.94 -1.22 116.57 120.85 2ff0 h LYS 59 Ca -0.31 -0.07 -0.31 0.00 -1.87 0.00 0.00 60.65 58.09 2ff0 h LYS 59 Cb 1.29 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 2ff0 h LYS 59 CO 0.44 0.77 -1.70 1.79 -0.57 0.00 0.00 179.45 180.18 2ff0 h THR 60 N 1.20 0.76 0.00 -0.16 1.35 -1.95 -3.39 112.91 110.71 2ff0 h THR 60 Ca 0.38 -2.30 0.00 0.00 -0.55 0.00 0.00 66.41 63.94 2ff0 h THR 60 Cb 0.00 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 68.86 2ff0 h THR 60 CO -0.11 0.69 0.00 1.56 -0.25 0.00 0.00 175.52 177.41 2ff0 h GLN 61 N -0.31 0.00 0.00 4.72 4.20 -1.81 -2.57 115.11 119.34 2ff0 h GLN 61 Ca -0.39 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.32 2ff0 h GLN 61 Cb 1.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.56 2ff0 h GLN 61 CO -0.01 0.00 0.00 2.89 -0.67 0.00 0.00 178.83 181.04 2ff0 n ARG 62 N -2.45 0.01 -0.07 1.46 1.85 -0.47 -2.57 116.66 114.41 2ff0 n ARG 62 Ca 0.02 0.26 -0.20 0.00 -1.00 0.00 0.00 57.85 56.92 2ff0 n ARG 62 Cb 0.25 -1.51 -0.13 0.00 -1.05 0.00 0.00 32.46 30.01 2ff0 n ARG 62 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2ff0 n LYS 63 N -1.53 0.69 0.12 2.89 5.02 -0.97 -4.48 118.16 119.90 2ff0 n LYS 63 Ca 0.03 0.23 -0.02 0.00 -2.02 0.00 0.00 58.31 56.53 2ff0 n LYS 63 Cb 0.17 -1.61 0.20 0.00 -0.02 0.00 0.00 35.03 33.77 2ff0 n LYS 63 CO 0.00 0.00 0.00 0.07 -0.52 0.00 0.00 177.40 176.95 2ff0 h ARG 64 N -0.09 0.14 -3.23 1.97 0.11 -1.65 -3.35 114.38 108.29 2ff0 h ARG 64 Ca -0.51 -0.08 -0.64 0.00 0.10 0.00 0.00 59.98 58.85 2ff0 h ARG 64 Cb 1.91 0.01 -0.40 0.00 1.11 0.00 0.00 29.97 32.59 2ff0 h ARG 64 CO -0.04 0.62 -0.50 0.00 0.10 0.00 0.00 179.97 180.15 2ff0 h PRO 66 N 5.89 0.81 -0.89 0.00 0.13 -1.79 -1.97 132.00 134.19 2ff0 h PRO 66 Ca 0.08 -0.34 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 2ff0 h PRO 66 Cb 0.81 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 31.87 2ff0 h PRO 66 CO 0.73 0.97 0.52 0.35 -0.23 0.00 0.00 178.00 180.34 2ff0 h PHE 67 N 0.71 1.18 -0.21 1.56 3.57 -1.90 0.23 116.94 122.08 2ff0 h PHE 67 Ca 0.09 -0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.44 2ff0 h PHE 67 Cb 0.76 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 2ff0 h PHE 67 CO 0.04 0.79 -0.47 0.00 -2.23 0.00 0.00 178.31 176.44 2ff0 h ARG 69 N 0.44 1.00 -0.12 0.00 2.43 -0.72 0.15 114.38 117.56 2ff0 h ARG 69 Ca 0.02 -0.26 0.02 0.00 -0.81 0.00 0.00 59.98 58.95 2ff0 h ARG 69 Cb 0.99 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.41 2ff0 h ARG 69 CO 0.09 0.93 0.02 0.35 -1.51 0.00 0.00 179.97 179.85 2ff0 h PHE 70 N 0.94 0.03 -0.78 2.20 3.57 -0.66 0.33 116.94 122.58 2ff0 h PHE 70 Ca 0.19 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.72 2ff0 h PHE 70 Cb 0.43 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.13 2ff0 h PHE 70 CO 0.03 0.01 0.50 1.96 -2.23 0.00 0.00 178.31 178.58 2ff0 h GLN 71 N 0.07 0.95 -0.89 1.11 1.08 -0.92 -1.77 115.11 114.75 2ff0 h GLN 71 Ca 0.05 -0.06 0.02 0.00 -1.45 0.00 0.00 58.65 57.22 2ff0 h GLN 71 Cb 0.05 -0.21 -0.05 0.00 -0.05 0.00 0.00 27.48 27.22 2ff0 h GLN 71 CO -0.07 0.63 0.58 -0.22 -0.95 0.00 0.00 178.83 178.80 2ff0 h LYS 72 N 0.98 1.11 0.60 1.46 1.63 -0.20 0.89 116.57 123.04 2ff0 h LYS 72 Ca 0.31 -0.07 -0.03 0.00 -0.85 0.00 0.00 60.65 60.01 2ff0 h LYS 72 Cb -0.01 -0.25 0.01 0.00 -0.60 0.00 0.00 32.23 31.37 2ff0 h LYS 72 CO -0.10 0.73 -0.29 0.00 -3.45 0.00 0.00 179.45 176.35 2ff0 h LEU 74 N -0.85 0.00 0.13 0.00 4.07 -1.10 -0.65 115.31 116.91 2ff0 h LEU 74 Ca -0.08 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.87 2ff0 h LEU 74 Cb 0.63 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.37 2ff0 h LEU 74 CO 0.13 0.03 -0.06 0.74 -1.08 0.00 0.00 178.44 178.20 2ff0 h THR 75 N 0.00 1.02 0.00 0.22 2.02 -0.37 -3.26 112.91 112.54 2ff0 h THR 75 Ca -0.00 -0.66 -0.04 0.00 0.77 0.00 0.00 66.41 66.48 2ff0 h THR 75 Cb 0.08 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 2ff0 h THR 75 CO 0.00 0.16 -0.17 -0.37 0.37 0.00 0.00 175.52 175.51 2ff0 h VAL 76 N -0.49 0.40 0.00 3.16 -1.51 -0.96 -3.45 116.25 113.41 2ff0 h VAL 76 Ca -0.02 -1.02 0.00 0.00 -1.23 0.00 0.00 66.70 64.43 2ff0 h VAL 76 Cb 0.39 1.75 0.00 0.00 -2.13 0.00 0.00 31.29 31.30 2ff0 h VAL 76 CO 0.03 0.17 0.00 0.61 -1.23 0.00 0.00 177.57 177.15 2ff0 n GLY 77 N 0.23 -0.84 3.61 5.19 0.00 -1.07 -4.92 105.19 107.40 2ff0 n GLY 77 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 2ff0 n GLY 77 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ff0 s MET 78 N 0.00 3.66 0.35 1.61 1.00 -0.29 -4.25 119.30 121.38 2ff0 s MET 78 Ca 0.00 1.07 0.03 0.00 0.00 0.00 0.00 55.69 56.79 2ff0 s MET 78 Cb 0.00 -4.00 -0.02 0.00 0.00 0.00 0.00 34.83 30.82 2ff0 s MET 78 CO 0.00 -1.46 0.53 1.03 0.00 0.00 0.00 175.02 175.12 2ff0 s ARG 79 N 4.77 3.23 0.12 2.03 0.52 -1.26 -3.30 118.95 125.06 2ff0 s ARG 79 Ca 0.61 -0.68 -0.06 0.00 -0.52 0.00 0.00 55.73 55.08 2ff0 s ARG 79 Cb -0.15 -2.72 -0.12 0.00 0.52 0.00 0.00 34.95 32.47 2ff0 s ARG 79 CO 0.30 0.05 1.28 -0.07 0.02 0.00 0.00 175.30 176.88 2ff0 h LEU 80 N 0.77 0.61 0.00 2.53 3.38 -1.96 -2.87 115.31 117.76 2ff0 h LEU 80 Ca -0.48 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.00 2ff0 h LEU 80 Cb 1.24 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2ff0 h LEU 80 CO 0.57 1.29 0.00 -1.84 0.09 0.00 0.00 178.44 178.55 2ff0 n GLU 81 N -3.76 0.13 0.25 1.13 0.00 -1.26 -2.05 120.64 115.07 2ff0 n GLU 81 Ca -0.08 0.20 0.16 0.00 0.00 0.00 0.00 57.16 57.44 2ff0 n GLU 81 Cb 0.85 -1.50 0.61 0.00 0.00 0.00 0.00 31.44 31.39 2ff0 n GLU 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2ff0 h ALA 82 N 2.57 1.00 -2.73 -1.84 0.00 -1.92 -3.42 119.26 112.93 2ff0 h ALA 82 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 2ff0 h ALA 82 Cb 0.16 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 2ff0 h ALA 82 CO 0.00 0.00 -0.35 0.54 0.00 0.00 0.00 179.25 179.44 2ff0 s VAL 83 N -3.57 5.24 -0.62 0.00 0.11 -0.87 -5.02 120.40 115.67 2ff0 s VAL 83 Ca 0.02 0.15 -0.20 0.00 -2.93 0.00 0.00 61.98 59.03 2ff0 s VAL 83 Cb 0.09 -3.60 0.09 0.00 -1.53 0.00 0.00 36.38 31.43 2ff0 s VAL 83 CO 0.54 0.27 0.80 -0.13 -3.33 0.00 0.00 175.10 173.25 2ff0 s ARG 84 N -2.02 3.07 0.10 1.54 1.81 -1.26 -4.86 118.95 117.33 2ff0 s ARG 84 Ca 0.32 -1.16 0.11 0.00 -1.72 0.00 0.00 55.73 53.29 2ff0 s ARG 84 Cb -0.13 -4.26 0.54 0.00 -0.45 0.00 0.00 34.95 30.65 2ff0 s ARG 84 CO 0.19 -1.65 1.35 0.00 -0.68 0.00 0.00 175.30 174.52 2ff0 n ALA 85 N 6.82 1.26 0.58 2.13 0.00 -1.26 -0.68 120.51 129.36 2ff0 n ALA 85 Ca -0.07 0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.49 2ff0 n ALA 85 Cb 0.44 -1.18 0.35 0.00 0.00 0.00 0.00 19.45 19.05 2ff0 n ALA 85 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2ff0 n ASP 86 N -1.76 0.00 -0.65 0.00 9.92 -1.26 -4.84 116.55 117.95 2ff0 n ASP 86 Ca 0.01 0.43 -0.08 0.00 -0.53 0.00 0.00 54.79 54.61 2ff0 n ASP 86 Cb 0.08 -0.46 -0.04 0.00 -0.64 0.00 0.00 41.12 40.06 2ff0 n ASP 86 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 2ff0 n ARG 87 N -1.46 -0.95 -3.30 -1.24 0.00 0.14 -4.97 116.66 104.88 2ff0 n ARG 87 Ca 0.04 0.73 -0.40 0.00 -0.00 0.00 0.00 57.85 58.23 2ff0 n ARG 87 Cb 0.17 -4.71 -0.08 0.00 0.00 0.00 0.00 32.46 27.84 2ff0 n ARG 87 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.63 179.04 2ff0 s MET 88 N -2.46 3.89 0.53 -0.14 1.75 -1.25 -4.93 119.30 116.69 2ff0 s MET 88 Ca 0.00 0.05 0.34 0.00 -1.25 0.00 0.00 55.69 54.83 2ff0 s MET 88 Cb 0.00 -3.71 1.53 0.00 2.84 0.00 0.00 34.83 35.49 2ff0 s MET 88 CO 0.00 -0.42 2.02 0.00 -0.65 0.00 0.00 175.02 175.96 2ff0 h ARG 89 N 8.22 0.00 -3.15 4.11 3.08 -1.93 -3.31 114.38 121.40 2ff0 h ARG 89 Ca -0.29 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.10 2ff0 h ARG 89 Cb 1.14 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.21 2ff0 h ARG 89 CO 0.71 0.00 3.69 0.41 -1.07 0.00 0.00 179.97 183.71 2ff0 n GLY 90 N -0.26 4.18 1.95 0.04 0.00 -1.26 -4.61 105.19 105.22 2ff0 n GLY 90 Ca -0.00 -1.46 -0.19 0.00 0.00 0.00 0.00 46.02 44.36 2ff0 n GLY 90 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ff0 n GLY 91 N 3.66 4.09 3.36 -0.02 0.00 -1.25 -4.86 105.19 110.18 2ff0 n GLY 91 Ca 0.73 -1.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.30 2ff0 n GLY 91 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ff0 s ARG 92 N -2.50 3.13 0.00 1.61 3.52 -1.26 -4.51 118.95 118.93 2ff0 s ARG 92 Ca 0.43 -1.60 0.00 0.00 -0.13 0.00 0.00 55.73 54.44 2ff0 s ARG 92 Cb 0.36 -4.34 0.00 0.00 -1.56 0.00 0.00 34.95 29.41 2ff0 s ARG 92 CO 0.06 -1.47 0.00 -1.71 -0.81 0.00 0.00 175.30 171.37 2ff0 n ASN 93 N 5.76 0.00 -0.12 -2.12 5.15 -1.26 -5.04 115.26 117.63 2ff0 n ASN 93 Ca -0.06 0.00 -0.05 0.00 -0.60 0.00 0.00 54.58 53.88 2ff0 n ASN 93 Cb 0.43 0.00 0.02 0.00 -0.53 0.00 0.00 39.78 39.70 2ff0 n ASN 93 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 2ff0 h LYS 94 N 0.00 0.02 -0.59 1.20 1.79 -1.99 -1.44 116.57 115.56 2ff0 h LYS 94 Ca 0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2ff0 h LYS 94 Cb 0.00 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 2ff0 h LYS 94 CO 0.00 0.02 0.00 1.19 -1.08 0.00 0.00 179.45 179.58 2ff0 n PHE 95 N -5.28 0.90 0.25 -1.35 3.01 -1.26 -4.56 117.46 109.17 2ff0 n PHE 95 Ca 0.02 -0.41 -0.10 0.00 1.01 0.00 0.00 57.45 57.97 2ff0 n PHE 95 Cb 0.22 -0.07 -0.05 0.00 -0.01 0.00 0.00 39.48 39.57 2ff0 n PHE 95 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2ff0 h GLY 96 N 4.67 -0.79 0.96 1.37 0.00 -1.65 -2.56 103.07 105.07 2ff0 h GLY 96 Ca 0.00 0.31 0.03 0.00 0.00 0.00 0.00 47.33 47.67 2ff0 h GLY 96 CO 0.06 -0.28 0.62 -2.55 0.00 0.00 0.00 176.54 174.39 2ff0 h PRO 97 N -0.66 1.16 0.00 4.80 0.11 -1.80 -2.56 132.00 133.05 2ff0 h PRO 97 Ca -0.06 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 65.94 2ff0 h PRO 97 Cb 0.52 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 2ff0 h PRO 97 CO 0.09 0.77 -0.17 0.00 -0.21 0.00 0.00 178.00 178.47 2ff0 h MET 98 N 1.20 0.00 -0.08 1.05 -0.00 -1.83 -1.65 114.93 113.62 2ff0 h MET 98 Ca 0.37 0.00 0.04 0.00 -0.00 0.00 0.00 59.70 60.11 2ff0 h MET 98 Cb -0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 31.60 31.54 2ff0 h MET 98 CO -0.11 0.17 -0.33 1.88 -0.00 0.00 0.00 176.91 178.52 2ff0 h TYR 99 N 0.00 -0.92 -0.23 -0.10 0.05 -1.02 0.39 116.97 115.14 2ff0 h TYR 99 Ca -0.00 0.04 -0.10 0.00 0.05 0.00 0.00 58.73 58.72 2ff0 h TYR 99 Cb 0.35 0.42 -0.01 0.00 1.01 0.00 0.00 36.73 38.49 2ff0 h TYR 99 CO 0.00 -0.41 -0.27 0.87 -1.05 0.00 0.00 178.16 177.30 2ff0 h LYS 100 N -0.44 0.45 0.01 4.88 1.57 -1.51 -1.97 116.57 119.56 2ff0 h LYS 100 Ca 0.08 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2ff0 h LYS 100 Cb 0.56 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2ff0 h LYS 100 CO -0.32 0.68 -0.01 -0.09 -0.57 0.00 0.00 179.45 179.14 2ff0 h ARG 101 N 0.40 -0.02 -0.76 3.15 2.43 -0.80 -1.80 114.38 116.99 2ff0 h ARG 101 Ca 0.06 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.24 2ff0 h ARG 101 Cb 0.68 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.19 2ff0 h ARG 101 CO 0.05 0.14 0.49 0.22 -1.51 0.00 0.00 179.97 179.37 2ff0 h ASP 102 N -0.17 0.84 -0.63 -3.80 3.58 -0.01 0.35 116.42 116.58 2ff0 h ASP 102 Ca -0.00 -0.02 0.03 0.00 0.42 0.00 0.00 57.03 57.47 2ff0 h ASP 102 Cb 0.17 -0.20 -0.04 0.00 1.72 0.00 0.00 39.33 40.97 2ff0 h ASP 102 CO 0.00 0.60 0.38 -0.09 -2.88 0.00 0.00 179.24 177.26 2ff0 h ARG 103 N 1.00 0.72 -0.24 0.28 2.43 -1.29 0.05 114.38 117.33 2ff0 h ARG 103 Ca 0.29 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.28 2ff0 h ARG 103 Cb -0.08 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.30 2ff0 h ARG 103 CO -0.08 0.48 -0.38 0.00 -1.51 0.00 0.00 179.97 178.48 2ff0 h ALA 104 N 1.28 0.88 -0.33 2.80 0.00 -0.36 -1.25 119.26 122.28 2ff0 h ALA 104 Ca 0.26 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 2ff0 h ALA 104 Cb 0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2ff0 h ALA 104 CO -0.12 0.64 0.13 -0.07 0.00 0.00 0.00 179.25 179.83 2ff0 h LEU 105 N 0.46 0.46 -0.79 0.00 3.38 0.23 0.15 115.31 119.21 2ff0 h LEU 105 Ca 0.04 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 2ff0 h LEU 105 Cb 0.88 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 2ff0 h LEU 105 CO 0.08 0.51 -0.08 0.11 0.09 0.00 0.00 178.44 179.14 2ff0 h LYS 106 N 0.39 0.83 -0.72 1.13 1.57 -0.91 -2.18 116.57 116.68 2ff0 h LYS 106 Ca 0.11 -0.27 -0.03 0.00 -1.87 0.00 0.00 60.65 58.59 2ff0 h LYS 106 Cb 0.20 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 2ff0 h LYS 106 CO -0.01 0.89 0.33 1.96 -0.57 0.00 0.00 179.45 182.05 2ff0 h GLN 107 N 0.75 1.03 0.00 3.15 4.20 -0.96 0.14 115.11 123.43 2ff0 h GLN 107 Ca 0.13 -0.15 -0.05 0.00 0.06 0.00 0.00 58.65 58.64 2ff0 h GLN 107 Cb 0.58 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 2ff0 h GLN 107 CO 0.04 0.81 -0.22 0.37 -0.67 0.00 0.00 178.83 179.15 2ff0 h GLN 108 N 1.03 0.00 0.00 1.46 5.75 -0.10 -3.35 115.11 119.90 2ff0 h GLN 108 Ca 0.25 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.75 2ff0 h GLN 108 Cb 0.13 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.68 2ff0 h GLN 108 CO -0.03 0.22 -0.36 1.63 -2.65 0.00 0.00 178.83 177.64 2ff0 n LYS 109 N -4.22 0.23 -3.92 1.69 5.02 -0.93 -4.92 118.16 111.10 2ff0 n LYS 109 Ca -0.02 0.21 -0.34 0.00 -2.02 0.00 0.00 58.31 56.13 2ff0 n LYS 109 Cb 0.28 -1.02 -0.14 0.00 -0.02 0.00 0.00 35.03 34.13 2ff0 n LYS 109 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2ff0 s LYS 110 N -1.74 2.12 0.00 1.97 2.47 0.46 -5.11 119.74 119.91 2ff0 s LYS 110 Ca -0.11 -1.53 0.00 0.00 -1.56 0.00 0.00 55.97 52.78 2ff0 s LYS 110 Cb 0.01 -3.24 0.00 0.00 -1.46 0.00 0.00 37.83 33.14 2ff0 s LYS 110 CO 0.16 -0.78 0.26 0.00 0.16 0.00 0.00 175.35 175.14