#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ttn n TYR 22 N 0.00 0.00 -3.69 1.61 4.19 -1.26 -3.85 117.16 114.15 1ttn n TYR 22 Ca 0.00 0.00 -0.38 0.00 3.31 0.00 0.00 57.90 60.83 1ttn n TYR 22 Cb 0.00 -0.40 -0.10 0.00 0.49 0.00 0.00 39.34 39.33 1ttn n TYR 22 CO 0.00 0.00 0.00 -2.00 0.91 0.00 0.00 176.86 175.77 1ttn s GLU 23 N -2.59 2.27 -0.10 2.98 2.12 -1.26 -4.63 118.70 117.50 1ttn s GLU 23 Ca -0.23 -1.96 0.02 0.00 0.36 0.00 0.00 54.97 53.16 1ttn s GLU 23 Cb 0.03 -3.72 -0.01 0.00 0.26 0.00 0.00 34.13 30.68 1ttn s GLU 23 CO 0.34 -1.13 -0.17 0.00 -0.54 0.00 0.00 175.26 173.77 1ttn s GLN 25 N 0.05 1.27 -0.15 0.00 0.74 -1.10 0.41 119.66 120.88 1ttn s GLN 25 Ca -0.07 -0.86 -0.04 0.00 0.05 0.00 0.00 55.36 54.44 1ttn s GLN 25 Cb -0.15 -2.42 -0.03 0.00 1.10 0.00 0.00 33.01 31.50 1ttn s GLN 25 CO 0.05 -0.65 0.01 -1.17 -0.55 0.00 0.00 175.29 172.97 1ttn s LEU 26 N 1.53 3.53 -0.13 3.68 1.98 -0.94 -3.46 118.68 124.87 1ttn s LEU 26 Ca -0.03 0.02 -0.19 0.00 -2.89 0.00 0.00 54.13 51.04 1ttn s LEU 26 Cb -0.18 -1.85 -0.04 0.00 0.66 0.00 0.00 46.19 44.78 1ttn s LEU 26 CO -0.08 0.23 0.52 -0.13 -1.89 0.00 0.00 176.35 175.00 1ttn s ARG 27 N 0.03 4.32 -0.21 1.98 0.52 -1.01 -0.72 118.95 123.85 1ttn s ARG 27 Ca 0.03 0.51 -0.08 0.00 -0.52 0.00 0.00 55.73 55.67 1ttn s ARG 27 Cb -0.13 -3.47 -0.04 0.00 0.52 0.00 0.00 34.95 31.83 1ttn s ARG 27 CO 0.02 0.07 0.07 -0.51 0.02 0.00 0.00 175.30 174.97 1ttn s LEU 28 N 0.91 3.73 -0.68 2.53 2.01 -0.92 0.57 118.68 126.84 1ttn s LEU 28 Ca 0.27 -0.00 -0.11 0.00 0.01 0.00 0.00 54.13 54.31 1ttn s LEU 28 Cb -0.16 -1.96 0.18 0.00 0.01 0.00 0.00 46.19 44.26 1ttn s LEU 28 CO 0.11 0.10 0.57 -0.60 1.01 0.00 0.00 176.35 177.55 1ttn s ARG 29 N 0.80 3.06 0.50 1.70 6.06 -0.12 -0.96 118.95 129.99 1ttn s ARG 29 Ca 0.04 -2.26 0.08 0.00 -2.50 0.00 0.00 55.73 51.09 1ttn s ARG 29 Cb -0.13 -4.14 0.05 0.00 0.06 0.00 0.00 34.95 30.78 1ttn s ARG 29 CO 0.02 -1.25 0.69 -0.51 -2.50 0.00 0.00 175.30 171.76 1ttn s LEU 30 N 0.50 3.38 0.00 -0.88 1.43 0.71 -0.53 118.68 123.29 1ttn s LEU 30 Ca 0.14 -0.57 0.00 0.00 -1.03 0.00 0.00 54.13 52.67 1ttn s LEU 30 Cb -0.18 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 43.82 1ttn s LEU 30 CO -0.05 -1.07 0.00 -1.20 0.23 0.00 0.00 176.35 174.26 1ttn n SER 31 N -2.09 -2.00 0.00 2.29 7.64 -1.26 0.26 113.62 118.46 1ttn n SER 31 Ca 0.11 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.99 1ttn n SER 31 Cb 0.60 -1.61 0.00 0.00 -1.01 0.00 0.00 64.21 62.19 1ttn n SER 31 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1ttn n THR 32 N -0.72 0.00 0.00 0.44 -1.04 -1.26 -4.74 114.28 106.96 1ttn n THR 32 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1ttn n THR 32 Cb 0.17 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 68.42 1ttn n THR 32 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ttn n GLY 33 N -2.91 0.00 2.94 3.41 0.00 0.44 -5.08 105.19 103.98 1ttn n GLY 33 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1ttn n GLY 33 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ttn n LYS 34 N 0.00 2.03 -2.95 1.61 3.00 0.71 -4.85 118.16 117.72 1ttn n LYS 34 Ca 0.00 -4.50 -0.43 0.00 -0.00 0.00 0.00 58.31 53.39 1ttn n LYS 34 Cb 0.00 -2.32 -0.05 0.00 0.00 0.00 0.00 35.03 32.66 1ttn n LYS 34 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 1ttn s ASP 35 N -1.22 6.48 -0.21 3.14 1.47 -1.17 -0.20 116.67 124.97 1ttn s ASP 35 Ca 0.26 0.13 -0.04 0.00 1.18 0.00 0.00 52.55 54.08 1ttn s ASP 35 Cb -0.04 -2.40 0.09 0.00 -0.34 0.00 0.00 42.92 40.23 1ttn s ASP 35 CO -0.16 -0.84 0.21 -0.22 0.68 0.00 0.00 175.17 174.84 1ttn s LEU 36 N 3.24 -0.05 0.00 2.11 2.96 -0.13 -4.91 118.68 121.90 1ttn s LEU 36 Ca 0.31 -0.32 -0.25 0.00 -0.22 0.00 0.00 54.13 53.65 1ttn s LEU 36 Cb -0.12 0.31 -0.05 0.00 0.50 0.00 0.00 46.19 46.83 1ttn s LEU 36 CO 0.20 -0.34 0.76 -1.59 -1.32 0.00 0.00 176.35 174.07 1ttn s LYS 37 N 2.30 4.48 -0.02 1.98 0.00 -1.26 -2.16 119.74 125.06 1ttn s LYS 37 Ca 0.07 1.03 -0.01 0.00 0.00 0.00 0.00 55.97 57.05 1ttn s LYS 37 Cb -0.16 -3.40 -0.04 0.00 0.00 0.00 0.00 37.83 34.24 1ttn s LYS 37 CO -0.14 0.18 0.08 -1.17 0.00 0.00 0.00 175.35 174.31 1ttn s LEU 38 N 0.31 3.94 -0.42 2.77 2.96 0.10 -4.91 118.68 123.42 1ttn s LEU 38 Ca 0.39 0.19 -0.27 0.00 -0.22 0.00 0.00 54.13 54.22 1ttn s LEU 38 Cb -0.20 -2.23 0.02 0.00 0.50 0.00 0.00 46.19 44.29 1ttn s LEU 38 CO 0.22 0.29 1.02 0.68 -1.32 0.00 0.00 176.35 177.24 1ttn s VAL 39 N -1.16 4.41 0.37 1.68 -7.23 -1.26 -2.21 120.40 115.00 1ttn s VAL 39 Ca 0.22 1.17 0.07 0.00 -1.81 0.00 0.00 61.98 61.62 1ttn s VAL 39 Cb -0.12 -4.47 -0.07 0.00 0.56 0.00 0.00 36.38 32.28 1ttn s VAL 39 CO 0.12 -0.77 -0.01 0.68 -0.31 0.00 0.00 175.10 174.81 1ttn s VAL 40 N 3.92 1.88 -0.28 1.32 -7.23 0.17 -5.01 120.40 115.16 1ttn s VAL 40 Ca 0.42 -2.06 0.01 0.00 -1.81 0.00 0.00 61.98 58.55 1ttn s VAL 40 Cb -0.10 -2.84 0.16 0.00 0.56 0.00 0.00 36.38 34.16 1ttn s VAL 40 CO 0.25 -0.07 0.40 -0.60 -0.31 0.00 0.00 175.10 174.77 1ttn s ARG 41 N -3.72 0.40 0.00 4.82 3.00 -1.26 -1.17 118.95 121.02 1ttn s ARG 41 Ca 0.34 0.18 0.00 0.00 -1.00 0.00 0.00 55.73 55.25 1ttn s ARG 41 Cb 0.08 -0.34 0.00 0.00 0.00 0.00 0.00 34.95 34.69 1ttn s ARG 41 CO 0.17 -0.98 0.00 -1.13 0.00 0.00 0.00 175.30 173.36 1ttn n SER 42 N 5.35 0.00 0.09 -2.12 3.41 -1.25 -1.74 113.62 117.36 1ttn n SER 42 Ca -0.00 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.72 1ttn n SER 42 Cb 0.49 0.00 0.45 0.00 -0.26 0.00 0.00 64.21 64.89 1ttn n SER 42 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1ttn n THR 43 N 0.00 0.71 0.00 6.66 -2.24 -1.26 -4.00 114.28 114.14 1ttn n THR 43 Ca 0.00 0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 1ttn n THR 43 Cb 0.00 -0.91 0.00 0.00 -2.10 0.00 0.00 70.33 67.32 1ttn n THR 43 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ttn n ASP 44 N -2.03 0.00 -1.42 3.42 9.92 -0.71 -4.79 116.55 120.93 1ttn n ASP 44 Ca 0.04 0.24 0.12 0.00 -0.53 0.00 0.00 54.79 54.66 1ttn n ASP 44 Cb 0.28 -0.25 -0.07 0.00 -0.64 0.00 0.00 41.12 40.45 1ttn n ASP 44 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 1ttn n THR 45 N -1.25 -1.29 -0.30 -3.53 -2.24 -1.26 -1.36 114.28 103.06 1ttn n THR 45 Ca 0.00 0.99 0.23 0.00 -2.27 0.00 0.00 64.05 63.00 1ttn n THR 45 Cb 0.00 -1.53 0.36 0.00 -2.10 0.00 0.00 70.33 67.06 1ttn n THR 45 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1ttn n VAL 46 N -3.89 -0.04 0.00 2.28 0.31 -1.26 0.70 118.33 116.43 1ttn n VAL 46 Ca -0.07 0.74 0.00 0.00 -0.01 0.00 0.00 64.34 65.00 1ttn n VAL 46 Cb 0.59 -1.23 0.00 0.00 -0.91 0.00 0.00 33.84 32.29 1ttn n VAL 46 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1ttn n PHE 47 N -3.12 0.00 -0.33 3.52 7.35 -1.25 0.15 117.46 123.78 1ttn n PHE 47 Ca 0.20 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.90 1ttn n PHE 47 Cb 0.88 -0.50 0.15 0.00 0.35 0.00 0.00 39.48 40.36 1ttn n PHE 47 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1ttn h HIS 48 N 0.00 1.06 -0.74 -5.13 3.86 0.65 0.71 115.15 115.56 1ttn h HIS 48 Ca 0.00 0.03 0.16 0.00 -1.16 0.00 0.00 60.37 59.40 1ttn h HIS 48 Cb 0.00 -0.35 -0.14 0.00 1.06 0.00 0.00 27.41 27.99 1ttn h HIS 48 CO 0.16 0.55 -0.10 1.98 0.86 0.00 0.00 177.93 181.38 1ttn h MET 49 N 1.05 0.04 -0.41 2.45 1.85 0.27 1.02 114.93 121.20 1ttn h MET 49 Ca 0.39 -0.00 -0.07 0.00 -0.61 0.00 0.00 59.70 59.41 1ttn h MET 49 Cb 0.16 -0.01 -0.02 0.00 0.43 0.00 0.00 31.60 32.16 1ttn h MET 49 CO -0.17 0.03 -0.05 -0.22 -0.40 0.00 0.00 176.91 176.10 1ttn h LYS 50 N 0.04 0.69 -1.10 0.39 3.64 0.52 -1.03 116.57 119.72 1ttn h LYS 50 Ca 0.38 -0.19 0.30 0.00 -1.27 0.00 0.00 60.65 59.87 1ttn h LYS 50 Cb 0.63 -0.08 -0.10 0.00 -0.41 0.00 0.00 32.23 32.28 1ttn h LYS 50 CO -0.72 0.74 0.71 -0.09 -2.27 0.00 0.00 179.45 177.83 1ttn h ARG 51 N 0.64 0.30 0.02 1.90 9.65 0.68 0.72 114.38 128.29 1ttn h ARG 51 Ca 0.12 -0.02 -0.28 0.00 -1.10 0.00 0.00 59.98 58.70 1ttn h ARG 51 Cb 0.47 -0.07 -0.04 0.00 -1.39 0.00 0.00 29.97 28.95 1ttn h ARG 51 CO 0.02 0.20 -1.56 0.00 2.80 0.00 0.00 179.97 181.44 1ttn h ARG 52 N 0.31 0.04 -1.04 0.20 2.47 -0.41 -2.50 114.38 113.46 1ttn h ARG 52 Ca 0.63 -0.07 0.29 0.00 -1.26 0.00 0.00 59.98 59.56 1ttn h ARG 52 Cb 1.75 0.03 -0.06 0.00 -1.65 0.00 0.00 29.97 30.04 1ttn h ARG 52 CO -0.30 0.71 0.72 -0.07 0.56 0.00 0.00 179.97 181.59 1ttn h LEU 53 N 0.01 0.16 0.10 3.04 4.07 0.17 2.61 115.31 125.47 1ttn h LEU 53 Ca -0.23 0.03 -0.36 0.00 0.08 0.00 0.00 57.88 57.40 1ttn h LEU 53 Cb 1.96 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.68 1ttn h LEU 53 CO 0.10 0.04 -1.98 0.00 -1.08 0.00 0.00 178.44 175.52 1ttn n HIS 54 N -4.36 1.17 -0.01 1.13 1.44 -0.66 0.79 115.22 114.71 1ttn n HIS 54 Ca 0.23 0.27 -0.01 0.00 -2.01 0.00 0.00 57.72 56.20 1ttn n HIS 54 Cb 1.02 -1.16 -0.00 0.00 0.12 0.00 0.00 29.99 29.96 1ttn n HIS 54 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1ttn h ALA 55 N 0.21 -0.07 -0.26 1.59 0.00 -0.15 -2.27 119.26 118.30 1ttn h ALA 55 Ca -0.41 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 1ttn h ALA 55 Cb 2.03 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.83 1ttn h ALA 55 CO 0.08 -0.07 -0.03 0.00 0.00 0.00 0.00 179.25 179.23 1ttn h ALA 56 N -1.32 0.36 0.00 0.00 0.00 0.41 -3.36 119.26 115.35 1ttn h ALA 56 Ca -0.01 -0.25 -0.18 0.00 0.00 0.00 0.00 54.91 54.48 1ttn h ALA 56 Cb 0.04 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1ttn h ALA 56 CO 0.01 0.13 -1.08 0.93 0.00 0.00 0.00 179.25 179.24 1ttn h GLU 57 N 0.25 0.00 0.00 0.00 4.39 -1.29 -3.50 114.58 114.43 1ttn h GLU 57 Ca 0.07 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1ttn h GLU 57 Cb 0.48 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 1ttn h GLU 57 CO 0.02 0.77 0.00 0.41 -1.16 0.00 0.00 179.01 179.05 1ttn n GLY 58 N 1.48 0.58 3.46 -3.84 0.00 0.29 -4.96 105.19 102.20 1ttn n GLY 58 Ca -0.26 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.32 1ttn n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ttn s VAL 59 N -1.46 4.71 -0.21 1.61 1.01 0.24 -4.79 120.40 121.49 1ttn s VAL 59 Ca 0.00 -1.57 0.06 0.00 0.00 0.00 0.00 61.98 60.47 1ttn s VAL 59 Cb 0.00 -4.79 -0.21 0.00 0.00 0.00 0.00 36.38 31.38 1ttn s VAL 59 CO 0.00 -1.53 -0.02 -1.84 0.00 0.00 0.00 175.10 171.71 1ttn n GLU 60 N 6.61 0.67 0.00 2.72 0.28 -1.26 -2.59 120.64 127.07 1ttn n GLU 60 Ca 0.25 0.12 0.00 0.00 -0.16 0.00 0.00 57.16 57.37 1ttn n GLU 60 Cb 0.49 -1.56 0.00 0.00 1.43 0.00 0.00 31.44 31.80 1ttn n GLU 60 CO 0.00 0.00 0.00 -2.30 -0.16 0.00 0.00 177.13 174.67 1ttn n PRO 61 N -3.12 2.08 0.00 3.44 -0.02 -1.26 -4.80 135.00 131.32 1ttn n PRO 61 Ca -0.39 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.09 1ttn n PRO 61 Cb 1.05 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.53 1ttn n PRO 61 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ttn n GLY 62 N 2.14 -0.17 0.67 -1.23 0.00 -1.26 -3.66 105.19 101.68 1ttn n GLY 62 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 1ttn n GLY 62 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ttn n SER 63 N -0.32 1.77 -3.78 1.61 7.64 -1.26 -4.48 113.62 114.80 1ttn n SER 63 Ca 0.00 -2.15 -0.37 0.00 1.01 0.00 0.00 58.87 57.36 1ttn n SER 63 Cb 0.07 -0.40 -0.02 0.00 -1.01 0.00 0.00 64.21 62.85 1ttn n SER 63 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ttn n GLN 64 N 0.12 3.82 -3.11 1.43 6.02 -1.23 -3.30 117.38 121.11 1ttn n GLN 64 Ca 0.07 -4.61 -0.45 0.00 -0.01 0.00 0.00 57.00 52.00 1ttn n GLN 64 Cb 0.37 -2.42 -0.05 0.00 1.02 0.00 0.00 30.24 29.17 1ttn n GLN 64 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1ttn s ARG 65 N -2.75 3.05 0.11 -1.09 0.52 -1.00 -4.89 118.95 112.90 1ttn s ARG 65 Ca 0.35 -1.26 -0.31 0.00 -0.52 0.00 0.00 55.73 53.98 1ttn s ARG 65 Cb 0.09 -4.25 -0.07 0.00 0.52 0.00 0.00 34.95 31.24 1ttn s ARG 65 CO 0.06 -1.51 1.28 -1.58 0.02 0.00 0.00 175.30 173.58 1ttn s TRP 66 N 2.69 3.34 -0.16 -0.53 0.51 -1.26 -0.85 118.94 122.69 1ttn s TRP 66 Ca 0.12 1.17 -0.08 0.00 -2.12 0.00 0.00 56.10 55.19 1ttn s TRP 66 Cb -0.24 -3.54 0.06 0.00 -0.81 0.00 0.00 33.47 28.94 1ttn s TRP 66 CO 0.07 -1.76 0.37 -0.06 -0.51 0.00 0.00 176.95 175.06 1ttn s PHE 67 N 0.86 -0.55 -0.09 -1.98 0.40 0.20 -2.01 117.98 114.82 1ttn s PHE 67 Ca 0.60 1.18 0.00 0.00 -0.60 0.00 0.00 56.93 58.12 1ttn s PHE 67 Cb -0.33 0.21 0.02 0.00 0.51 0.00 0.00 43.02 43.43 1ttn s PHE 67 CO 0.31 -0.32 -0.08 0.12 0.70 0.00 0.00 175.22 175.94 1ttn s PHE 68 N 1.44 1.39 0.00 0.36 5.36 0.11 0.21 117.98 126.85 1ttn s PHE 68 Ca -0.09 -0.62 0.00 0.00 -0.96 0.00 0.00 56.93 55.26 1ttn s PHE 68 Cb -0.09 -1.13 0.00 0.00 -0.34 0.00 0.00 43.02 41.46 1ttn s PHE 68 CO -0.12 -0.42 0.00 0.43 -1.46 0.00 0.00 175.22 173.65 1ttn n SER 69 N 4.58 -2.99 0.00 6.13 7.64 -1.26 -2.00 113.62 125.72 1ttn n SER 69 Ca -0.16 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.72 1ttn n SER 69 Cb 0.51 -2.11 0.00 0.00 -1.01 0.00 0.00 64.21 61.59 1ttn n SER 69 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ttn n GLY 70 N -1.04 1.18 3.21 0.23 0.00 -1.26 -5.11 105.19 102.39 1ttn n GLY 70 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1ttn n GLY 70 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ttn s ARG 71 N -0.59 1.04 -0.02 1.61 1.81 -0.85 -5.11 118.95 116.85 1ttn s ARG 71 Ca 0.00 -0.94 -0.30 0.00 -1.72 0.00 0.00 55.73 52.77 1ttn s ARG 71 Cb 0.00 -1.14 -0.05 0.00 -0.45 0.00 0.00 34.95 33.31 1ttn s ARG 71 CO 0.00 0.27 1.48 -1.25 -0.68 0.00 0.00 175.30 175.12 1ttn s PRO 72 N -1.48 4.24 0.61 3.54 0.04 -1.26 0.08 135.00 140.77 1ttn s PRO 72 Ca 0.03 2.03 -0.09 0.00 0.04 0.00 0.00 61.00 63.01 1ttn s PRO 72 Cb -0.09 -3.69 -0.02 0.00 0.04 0.00 0.00 34.50 30.74 1ttn s PRO 72 CO 0.02 -0.67 0.97 -0.51 0.04 0.00 0.00 177.00 176.85 1ttn s LEU 73 N 2.91 3.24 0.00 -3.56 1.43 -0.85 -4.90 118.68 116.95 1ttn s LEU 73 Ca 0.66 1.10 0.02 0.00 -1.03 0.00 0.00 54.13 54.89 1ttn s LEU 73 Cb -0.32 -4.03 0.02 0.00 0.03 0.00 0.00 46.19 41.90 1ttn s LEU 73 CO 0.27 -0.96 0.17 0.35 0.23 0.00 0.00 176.35 176.41 1ttn n THR 74 N -2.67 0.00 -0.04 5.49 -2.24 -1.26 -4.82 114.28 108.73 1ttn n THR 74 Ca 0.05 -0.80 -0.04 0.00 -2.27 0.00 0.00 64.05 60.99 1ttn n THR 74 Cb 0.56 -0.40 0.15 0.00 -2.10 0.00 0.00 70.33 68.54 1ttn n THR 74 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ttn n ASP 75 N -2.06 3.41 -1.56 3.42 5.68 -1.26 -3.83 116.55 120.34 1ttn n ASP 75 Ca 0.00 -2.63 -0.00 0.00 -0.50 0.00 0.00 54.79 51.66 1ttn n ASP 75 Cb 0.23 -0.63 0.00 0.00 -1.14 0.00 0.00 41.12 39.58 1ttn n ASP 75 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1ttn n LYS 76 N 0.02 0.27 0.10 0.11 4.76 -1.26 -4.51 118.16 117.64 1ttn n LYS 76 Ca 0.22 -1.79 -0.20 0.00 -2.87 0.00 0.00 58.31 53.66 1ttn n LYS 76 Cb 0.90 0.02 -0.15 0.00 -1.84 0.00 0.00 35.03 33.96 1ttn n LYS 76 CO 0.00 0.00 0.00 0.52 -1.37 0.00 0.00 177.40 176.55 1ttn h MET 77 N 0.85 0.37 0.33 1.97 2.86 -1.93 -3.21 114.93 116.17 1ttn h MET 77 Ca -0.34 -0.63 -0.01 0.00 -2.06 0.00 0.00 59.70 56.66 1ttn h MET 77 Cb 1.64 0.23 -0.00 0.00 0.06 0.00 0.00 31.60 33.53 1ttn h MET 77 CO -0.03 1.27 -0.21 0.87 1.06 0.00 0.00 176.91 179.86 1ttn h LYS 78 N 0.10 -0.50 0.00 1.72 6.56 -1.90 0.27 116.57 122.82 1ttn h LYS 78 Ca -0.25 0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.38 1ttn h LYS 78 Cb 2.07 0.11 0.00 0.00 -0.57 0.00 0.00 32.23 33.84 1ttn h LYS 78 CO 0.21 -0.33 0.00 0.34 -2.06 0.00 0.00 179.45 177.60 1ttn n PHE 79 N -3.61 0.68 0.07 -1.35 7.35 -1.26 -1.58 117.46 117.76 1ttn n PHE 79 Ca -0.06 0.33 0.06 0.00 -0.76 0.00 0.00 57.45 57.03 1ttn n PHE 79 Cb 0.22 -1.04 -0.04 0.00 0.35 0.00 0.00 39.48 38.97 1ttn n PHE 79 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 1ttn n GLU 80 N -2.18 0.61 -0.03 -4.13 1.02 -0.64 -4.53 120.64 110.76 1ttn n GLU 80 Ca -0.00 0.15 -0.02 0.00 -0.02 0.00 0.00 57.16 57.26 1ttn n GLU 80 Cb 0.08 -1.80 -0.01 0.00 -0.02 0.00 0.00 31.44 29.68 1ttn n GLU 80 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1ttn n GLU 81 N -2.75 0.21 -0.22 3.49 4.07 0.85 -4.94 120.64 121.34 1ttn n GLU 81 Ca -0.05 0.32 0.00 0.00 -0.06 0.00 0.00 57.16 57.37 1ttn n GLU 81 Cb 0.68 -1.12 0.00 0.00 -0.06 0.00 0.00 31.44 30.94 1ttn n GLU 81 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1ttn n LEU 82 N -3.31 0.15 -1.74 4.31 7.99 -0.72 -4.77 117.00 118.92 1ttn n LEU 82 Ca -0.04 0.00 -0.11 0.00 -0.01 0.00 0.00 56.01 55.85 1ttn n LEU 82 Cb 0.14 -0.40 0.22 0.00 -0.11 0.00 0.00 43.42 43.27 1ttn n LEU 82 CO 0.06 -0.07 1.00 0.29 -1.51 0.00 0.00 177.39 177.15 1ttn n LYS 83 N -2.00 2.49 -2.87 3.23 4.76 -1.26 -4.70 118.16 117.81 1ttn n LYS 83 Ca 0.00 -3.07 -0.34 0.00 -2.87 0.00 0.00 58.31 52.02 1ttn n LYS 83 Cb 0.00 -2.05 -0.02 0.00 -1.84 0.00 0.00 35.03 31.13 1ttn n LYS 83 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 1ttn n ILE 84 N -0.88 4.46 0.16 -0.18 -5.35 -1.26 -4.53 119.36 111.78 1ttn n ILE 84 Ca 0.44 -5.75 0.01 0.00 -0.27 0.00 0.00 62.75 57.18 1ttn n ILE 84 Cb 1.35 -1.60 0.26 0.00 -1.74 0.00 0.00 39.64 37.91 1ttn n ILE 84 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1ttn h PRO 85 N 3.83 0.00 0.00 6.28 0.13 -1.84 -2.93 132.00 137.47 1ttn h PRO 85 Ca 0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.44 1ttn h PRO 85 Cb 0.45 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.58 1ttn h PRO 85 CO 1.02 0.50 0.00 0.36 -0.23 0.00 0.00 178.00 179.65 1ttn n LYS 86 N -3.84 0.00 -0.19 0.86 -0.00 -1.22 -4.38 118.16 109.39 1ttn n LYS 86 Ca -0.01 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.27 1ttn n LYS 86 Cb 0.53 0.00 0.18 0.00 -0.00 0.00 0.00 35.03 35.74 1ttn n LYS 86 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 1ttn h ASP 87 N 0.00 0.86 -3.14 -5.58 3.58 -1.88 -3.43 116.42 106.85 1ttn h ASP 87 Ca 0.00 -0.12 -0.54 0.00 0.42 0.00 0.00 57.03 56.80 1ttn h ASP 87 Cb 0.00 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 40.83 1ttn h ASP 87 CO 0.00 0.77 0.62 -0.31 -2.88 0.00 0.00 179.24 177.44 1ttn s TYR 88 N -5.44 3.33 -0.07 0.28 1.51 -1.26 -5.00 117.35 110.70 1ttn s TYR 88 Ca -0.11 1.23 -0.01 0.00 -1.01 0.00 0.00 57.07 57.17 1ttn s TYR 88 Cb 0.16 -3.45 0.03 0.00 -0.11 0.00 0.00 41.96 38.59 1ttn s TYR 88 CO 0.80 -1.43 0.00 0.54 -1.11 0.00 0.00 175.55 174.36 1ttn s VAL 89 N 1.43 0.35 -0.23 0.71 0.11 -1.26 -2.41 120.40 119.10 1ttn s VAL 89 Ca 0.59 0.12 -0.20 0.00 -2.93 0.00 0.00 61.98 59.56 1ttn s VAL 89 Cb -0.29 -0.50 -0.02 0.00 -1.53 0.00 0.00 36.38 34.04 1ttn s VAL 89 CO 0.27 0.25 0.62 -0.69 -3.33 0.00 0.00 175.10 172.23 1ttn s VAL 90 N 1.87 5.01 -0.12 2.04 1.01 0.19 -4.70 120.40 125.71 1ttn s VAL 90 Ca 0.03 1.14 -0.22 0.00 0.00 0.00 0.00 61.98 62.94 1ttn s VAL 90 Cb -0.12 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 1ttn s VAL 90 CO -0.05 0.07 0.65 -1.58 0.00 0.00 0.00 175.10 174.19 1ttn s GLN 91 N 2.21 4.35 0.39 2.72 -0.44 0.58 -0.95 119.66 128.53 1ttn s GLN 91 Ca 0.27 0.74 0.08 0.00 -2.50 0.00 0.00 55.36 53.95 1ttn s GLN 91 Cb -0.16 -3.49 -0.02 0.00 -1.64 0.00 0.00 33.01 27.71 1ttn s GLN 91 CO 0.09 -0.02 0.35 0.14 0.50 0.00 0.00 175.29 176.35 1ttn s VAL 92 N 1.13 2.88 -0.12 1.34 -7.23 0.31 0.62 120.40 119.33 1ttn s VAL 92 Ca 0.33 -1.36 0.00 0.00 -1.81 0.00 0.00 61.98 59.14 1ttn s VAL 92 Cb -0.17 -3.04 0.02 0.00 0.56 0.00 0.00 36.38 33.75 1ttn s VAL 92 CO 0.14 -0.05 -0.11 -0.63 -0.31 0.00 0.00 175.10 174.15 1ttn s ILE 93 N -2.43 1.26 -0.22 -0.62 1.01 -0.03 -4.31 121.20 115.86 1ttn s ILE 93 Ca 0.46 -0.45 -0.04 0.00 0.00 0.00 0.00 60.65 60.62 1ttn s ILE 93 Cb -0.04 -1.22 0.08 0.00 0.01 0.00 0.00 42.46 41.29 1ttn s ILE 93 CO 0.27 0.41 0.14 0.54 0.00 0.00 0.00 174.94 176.29 1ttn s VAL 94 N 1.52 -0.14 -0.37 2.92 0.11 -1.21 -2.39 120.40 120.84 1ttn s VAL 94 Ca 0.03 -0.39 0.06 0.00 -2.93 0.00 0.00 61.98 58.75 1ttn s VAL 94 Cb -0.13 -0.76 0.55 0.00 -1.53 0.00 0.00 36.38 34.51 1ttn s VAL 94 CO -0.08 -0.44 1.59 -1.20 -3.33 0.00 0.00 175.10 171.64 1ttn n SER 95 N 5.28 3.95 -3.66 3.54 7.64 -1.26 -4.57 113.62 124.53 1ttn n SER 95 Ca -0.06 -3.01 -0.28 0.00 1.01 0.00 0.00 58.87 56.53 1ttn n SER 95 Cb 0.46 -0.71 -0.12 0.00 -1.01 0.00 0.00 64.21 62.84 1ttn n SER 95 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1ttn s GLN 96 N -2.41 1.51 0.18 1.43 -1.52 -1.26 -4.96 119.66 112.63 1ttn s GLN 96 Ca 0.42 -2.44 -0.09 0.00 -1.95 0.00 0.00 55.36 51.30 1ttn s GLN 96 Cb 0.34 -2.36 0.07 0.00 -0.22 0.00 0.00 33.01 30.84 1ttn s GLN 96 CO 0.10 -1.27 1.64 -1.00 -0.25 0.00 0.00 175.29 174.50 1ttn h PRO 97 N 5.98 1.08 0.00 2.91 0.13 -1.99 -3.37 132.00 136.74 1ttn h PRO 97 Ca 0.13 -0.35 -0.09 0.00 -0.87 0.00 0.00 66.00 64.82 1ttn h PRO 97 Cb 0.87 -0.10 -0.16 0.00 0.13 0.00 0.00 31.00 31.75 1ttn h PRO 97 CO 0.52 1.06 -0.52 1.33 -0.23 0.00 0.00 178.00 180.15 1ttn n VAL 98 N -4.18 0.00 -1.48 1.56 0.24 -1.26 -5.14 118.33 108.07 1ttn n VAL 98 Ca 0.03 -0.31 0.10 0.00 -2.04 0.00 0.00 64.34 62.11 1ttn n VAL 98 Cb 0.35 0.56 -0.06 0.00 -1.47 0.00 0.00 33.84 33.23 1ttn n VAL 98 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ttn n GLN 99 N 0.16 -3.65 -0.49 7.34 6.02 -1.26 -5.31 117.38 120.20 1ttn n GLN 99 Ca -0.05 2.92 0.00 0.00 -0.01 0.00 0.00 57.00 59.86 1ttn n GLN 99 Cb 0.80 -3.92 0.00 0.00 1.02 0.00 0.00 30.24 28.14 1ttn n GLN 99 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14