#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 0.52 -4.68 1.61 4.02 -1.26 -5.00 117.16 112.37 1ttn n TYR 22 Ca 0.00 -1.59 -0.23 0.00 -0.01 0.00 0.00 57.90 56.07 1ttn n TYR 22 Cb 0.00 -0.34 -0.15 0.00 -0.02 0.00 0.00 39.34 38.83 1ttn n TYR 22 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 1ttn s GLU 23 N -3.27 1.21 0.09 -0.72 2.12 -1.26 -4.74 118.70 112.12 1ttn s GLU 23 Ca 0.41 -0.52 0.00 0.00 0.36 0.00 0.00 54.97 55.22 1ttn s GLU 23 Cb 0.39 -1.16 -0.04 0.00 0.26 0.00 0.00 34.13 33.57 1ttn s GLU 23 CO -0.04 0.31 -0.03 0.00 -0.54 0.00 0.00 175.26 174.96 1ttn s GLN 25 N -3.91 0.56 0.03 0.00 -0.44 -1.26 -2.03 119.66 112.61 1ttn s GLN 25 Ca 0.13 1.19 0.04 0.00 -2.50 0.00 0.00 55.36 54.21 1ttn s GLN 25 Cb 0.07 0.48 -0.02 0.00 -1.64 0.00 0.00 33.01 31.90 1ttn s GLN 25 CO -0.05 -0.16 -0.12 -1.17 0.50 0.00 0.00 175.29 174.29 1ttn s LEU 26 N 2.24 2.15 0.05 3.68 2.96 -0.92 -1.42 118.68 127.43 1ttn s LEU 26 Ca -0.07 -0.41 -0.21 0.00 -0.22 0.00 0.00 54.13 53.22 1ttn s LEU 26 Cb -0.08 -0.53 -0.06 0.00 0.50 0.00 0.00 46.19 46.02 1ttn s LEU 26 CO -0.19 0.02 0.63 -0.60 -1.32 0.00 0.00 176.35 174.89 1ttn s ARG 27 N -1.01 4.32 -0.23 1.98 3.52 -0.99 -1.74 118.95 124.80 1ttn s ARG 27 Ca 0.01 0.82 -0.01 0.00 -0.13 0.00 0.00 55.73 56.42 1ttn s ARG 27 Cb -0.07 -3.30 0.02 0.00 -1.56 0.00 0.00 34.95 30.04 1ttn s ARG 27 CO 0.01 0.48 -0.09 -0.51 -0.81 0.00 0.00 175.30 174.38 1ttn s LEU 28 N -0.62 2.92 -0.57 -0.88 2.01 -0.67 0.87 118.68 121.73 1ttn s LEU 28 Ca 0.32 -0.76 -0.18 0.00 0.01 0.00 0.00 54.13 53.51 1ttn s LEU 28 Cb -0.19 -1.63 0.11 0.00 0.01 0.00 0.00 46.19 44.48 1ttn s LEU 28 CO 0.20 -0.08 0.64 -0.60 1.01 0.00 0.00 176.35 177.52 1ttn s ARG 29 N 1.33 3.03 0.24 1.70 3.52 -0.63 -1.49 118.95 126.65 1ttn s ARG 29 Ca 0.02 -1.40 0.05 0.00 -0.13 0.00 0.00 55.73 54.27 1ttn s ARG 29 Cb -0.16 -4.27 -0.03 0.00 -1.56 0.00 0.00 34.95 28.94 1ttn s ARG 29 CO -0.06 -1.47 0.33 -0.51 -0.81 0.00 0.00 175.30 172.78 1ttn s LEU 30 N 2.39 4.24 0.00 -0.88 1.43 -0.87 0.35 118.68 125.34 1ttn s LEU 30 Ca 0.09 0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 1ttn s LEU 30 Cb -0.25 -2.78 0.00 0.00 0.03 0.00 0.00 46.19 43.19 1ttn s LEU 30 CO 0.06 -0.06 0.00 -0.24 0.23 0.00 0.00 176.35 176.34 1ttn n SER 31 N -1.33 0.00 0.00 2.29 2.88 -1.17 -0.03 113.62 116.26 1ttn n SER 31 Ca -0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.45 1ttn n SER 31 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 1ttn n SER 31 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1ttn n THR 32 N 0.00 0.00 0.00 2.46 -1.04 -1.26 -4.78 114.28 109.66 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 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 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 0.00 0.00 3.38 3.41 0.00 0.96 -5.07 105.19 107.86 1ttn n GLY 33 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 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 3.42 -2.38 1.61 0.00 0.67 -4.75 118.16 116.73 1ttn n LYS 34 Ca 0.00 -3.83 -0.42 0.00 0.00 0.00 0.00 58.31 54.05 1ttn n LYS 34 Cb 0.00 -3.00 -0.03 0.00 0.00 0.00 0.00 35.03 32.00 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 2.46 6.98 -0.21 3.14 1.47 -1.13 -2.05 116.67 127.32 1ttn s ASP 35 Ca 0.42 1.90 -0.04 0.00 1.18 0.00 0.00 52.55 56.01 1ttn s ASP 35 Cb -0.01 -2.56 0.11 0.00 -0.34 0.00 0.00 42.92 40.12 1ttn s ASP 35 CO 0.00 -0.65 0.32 -0.22 0.68 0.00 0.00 175.17 175.31 1ttn s LEU 36 N 2.41 -0.45 -0.37 2.11 1.98 -0.56 -4.90 118.68 118.91 1ttn s LEU 36 Ca 0.58 0.24 -0.24 0.00 -2.89 0.00 0.00 54.13 51.82 1ttn s LEU 36 Cb -0.27 0.89 0.01 0.00 0.66 0.00 0.00 46.19 47.49 1ttn s LEU 36 CO 0.23 -0.29 0.85 -1.59 -1.89 0.00 0.00 176.35 173.65 1ttn s LYS 37 N 2.48 3.77 0.06 1.98 -2.85 -1.26 -1.67 119.74 122.25 1ttn s LYS 37 Ca 0.08 0.41 0.01 0.00 -1.00 0.00 0.00 55.97 55.46 1ttn s LYS 37 Cb -0.15 -3.81 -0.04 0.00 -2.06 0.00 0.00 37.83 31.77 1ttn s LYS 37 CO -0.13 -0.91 0.18 -1.17 0.10 0.00 0.00 175.35 173.41 1ttn s LEU 38 N 3.29 4.24 0.06 2.77 2.96 -0.71 -4.90 118.68 126.39 1ttn s LEU 38 Ca 0.34 0.21 -0.05 0.00 -0.22 0.00 0.00 54.13 54.41 1ttn s LEU 38 Cb -0.12 -2.84 -0.05 0.00 0.50 0.00 0.00 46.19 43.67 1ttn s LEU 38 CO 0.18 0.17 0.30 0.68 -1.32 0.00 0.00 176.35 176.37 1ttn s VAL 39 N -1.48 5.26 0.26 1.68 -7.23 -1.26 -2.16 120.40 115.47 1ttn s VAL 39 Ca 0.33 0.07 -0.19 0.00 -1.81 0.00 0.00 61.98 60.39 1ttn s VAL 39 Cb -0.13 -3.60 0.02 0.00 0.56 0.00 0.00 36.38 33.23 1ttn s VAL 39 CO 0.26 0.23 0.64 0.68 -0.31 0.00 0.00 175.10 176.61 1ttn s VAL 40 N -1.44 0.00 -0.31 1.32 -7.23 -0.86 -4.97 120.40 106.90 1ttn s VAL 40 Ca 0.33 -1.02 -0.02 0.00 -1.81 0.00 0.00 61.98 59.46 1ttn s VAL 40 Cb -0.13 -1.96 0.10 0.00 0.56 0.00 0.00 36.38 34.96 1ttn s VAL 40 CO 0.21 -0.01 0.12 -0.60 -0.31 0.00 0.00 175.10 174.51 1ttn s ARG 41 N -3.93 0.55 0.00 4.82 3.52 -1.26 -0.64 118.95 122.01 1ttn s ARG 41 Ca 0.13 -0.95 0.00 0.00 -0.13 0.00 0.00 55.73 54.78 1ttn s ARG 41 Cb -0.04 -1.67 0.00 0.00 -1.56 0.00 0.00 34.95 31.68 1ttn s ARG 41 CO 0.06 -1.02 0.00 -1.13 -0.81 0.00 0.00 175.30 172.39 1ttn n SER 42 N 4.87 0.00 0.11 -2.12 3.41 -1.26 -1.95 113.62 116.68 1ttn n SER 42 Ca -0.02 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.72 1ttn n SER 42 Cb 0.41 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.69 1ttn n SER 42 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1ttn h THR 43 N 0.00 0.00 -1.08 6.66 2.02 -1.98 -3.31 112.91 115.23 1ttn h THR 43 Ca 0.00 -0.55 -0.61 0.00 0.77 0.00 0.00 66.41 66.03 1ttn h THR 43 Cb 0.00 1.45 -0.24 0.00 -1.74 0.00 0.00 68.15 67.62 1ttn h THR 43 CO 0.00 0.00 0.78 0.47 0.37 0.00 0.00 175.52 177.14 1ttn n ASP 44 N -2.33 7.32 -3.82 4.18 9.92 -0.82 -4.74 116.55 126.26 1ttn n ASP 44 Ca 0.05 -3.60 -0.29 0.00 -0.53 0.00 0.00 54.79 50.42 1ttn n ASP 44 Cb 0.45 -1.03 0.26 0.00 -0.64 0.00 0.00 41.12 40.15 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 -0.43 0.00 -0.20 -3.53 -2.24 -1.25 -2.36 114.28 104.27 1ttn n THR 45 Ca 0.53 -0.22 0.17 0.00 -2.27 0.00 0.00 64.05 62.26 1ttn n THR 45 Cb 0.55 -0.92 0.27 0.00 -2.10 0.00 0.00 70.33 68.14 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 -5.32 -0.08 0.14 2.28 0.31 -1.25 0.79 118.33 115.19 1ttn n VAL 46 Ca 0.07 0.67 -0.05 0.00 -0.01 0.00 0.00 64.34 65.02 1ttn n VAL 46 Cb 0.56 -1.11 -0.03 0.00 -0.91 0.00 0.00 33.84 32.36 1ttn n VAL 46 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 1ttn h PHE 47 N 0.00 -0.33 -0.85 3.52 3.57 -1.84 1.01 116.94 122.02 1ttn h PHE 47 Ca 0.35 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.81 1ttn h PHE 47 Cb 1.17 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.98 1ttn h PHE 47 CO -0.00 -0.21 0.41 0.45 -2.23 0.00 0.00 178.31 176.73 1ttn h HIS 48 N -0.42 1.22 -0.84 0.41 3.86 -0.39 0.75 115.15 119.73 1ttn h HIS 48 Ca -0.04 -0.06 0.19 0.00 -1.16 0.00 0.00 60.37 59.31 1ttn h HIS 48 Cb 0.27 -0.38 -0.12 0.00 1.06 0.00 0.00 27.41 28.25 1ttn h HIS 48 CO 0.13 0.88 0.32 1.98 0.86 0.00 0.00 177.93 182.10 1ttn h MET 49 N 1.20 0.37 -0.04 2.45 -1.53 0.76 0.85 114.93 119.00 1ttn h MET 49 Ca 0.29 -0.02 -0.18 0.00 -3.44 0.00 0.00 59.70 56.35 1ttn h MET 49 Cb 0.11 -0.08 -0.01 0.00 -0.55 0.00 0.00 31.60 31.07 1ttn h MET 49 CO -0.04 0.24 -0.76 -0.22 0.14 0.00 0.00 176.91 176.27 1ttn h LYS 50 N 0.38 0.27 -0.46 0.39 1.63 0.27 -1.62 116.57 117.43 1ttn h LYS 50 Ca 0.50 -0.24 0.07 0.00 -0.85 0.00 0.00 60.65 60.13 1ttn h LYS 50 Cb 0.90 0.06 -0.06 0.00 -0.60 0.00 0.00 32.23 32.53 1ttn h LYS 50 CO -0.51 0.91 0.13 0.00 -3.45 0.00 0.00 179.45 176.53 1ttn h ARG 51 N 0.17 0.27 -0.05 1.90 2.47 0.69 0.11 114.38 119.94 1ttn h ARG 51 Ca -0.03 -0.02 -0.11 0.00 -1.26 0.00 0.00 59.98 58.56 1ttn h ARG 51 Cb 1.34 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 29.59 1ttn h ARG 51 CO 0.12 0.18 -0.47 0.00 0.56 0.00 0.00 179.97 180.36 1ttn h ARG 52 N 0.28 0.12 -0.81 0.04 2.47 -0.28 -2.43 114.38 113.78 1ttn h ARG 52 Ca 0.23 -0.06 0.13 0.00 -1.26 0.00 0.00 59.98 59.02 1ttn h ARG 52 Cb 0.27 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.53 1ttn h ARG 52 CO -0.27 0.57 0.53 -0.07 0.56 0.00 0.00 179.97 181.29 1ttn h LEU 53 N 0.10 0.56 -0.15 3.04 -0.00 0.20 0.60 115.31 119.66 1ttn h LEU 53 Ca 0.00 0.03 -0.21 0.00 -0.00 0.00 0.00 57.88 57.70 1ttn h LEU 53 Cb 0.87 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 41.43 1ttn h LEU 53 CO 0.07 0.30 -0.97 1.12 -0.00 0.00 0.00 178.44 178.95 1ttn h HIS 54 N 0.60 0.26 0.56 1.13 2.07 -0.87 -1.18 115.15 117.72 1ttn h HIS 54 Ca 0.40 -0.16 -0.03 0.00 -2.85 0.00 0.00 60.37 57.73 1ttn h HIS 54 Cb 0.69 -0.02 0.01 0.00 2.57 0.00 0.00 27.41 30.65 1ttn h HIS 54 CO -0.00 1.03 -0.27 0.00 -3.07 0.00 0.00 177.93 175.62 1ttn h ALA 55 N 0.91 -0.75 0.04 6.11 0.00 -0.07 -1.12 119.26 124.39 1ttn h ALA 55 Ca -0.05 -0.18 -0.28 0.00 0.00 0.00 0.00 54.91 54.40 1ttn h ALA 55 Cb 1.65 0.29 0.02 0.00 0.00 0.00 0.00 17.79 19.75 1ttn h ALA 55 CO 0.15 -0.71 -1.11 0.00 0.00 0.00 0.00 179.25 177.58 1ttn h ALA 56 N -1.11 0.10 0.00 0.00 0.00 -0.13 -3.39 119.26 114.74 1ttn h ALA 56 Ca -0.08 -0.73 -0.21 0.00 0.00 0.00 0.00 54.91 53.90 1ttn h ALA 56 Cb 0.60 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1ttn h ALA 56 CO 0.13 0.70 -1.18 0.93 0.00 0.00 0.00 179.25 179.83 1ttn h GLU 57 N 0.35 0.00 0.00 0.00 4.39 -1.37 -3.50 114.58 114.45 1ttn h GLU 57 Ca -0.15 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.55 1ttn h GLU 57 Cb 1.77 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.42 1ttn h GLU 57 CO 0.21 0.88 0.00 0.41 -1.16 0.00 0.00 179.01 179.35 1ttn n GLY 58 N 1.45 1.62 2.76 -3.84 0.00 -0.42 -4.99 105.19 101.76 1ttn n GLY 58 Ca -0.29 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 1ttn n GLY 58 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1ttn n VAL 59 N 0.00 4.50 -0.04 1.61 3.14 -1.21 -4.72 118.33 121.61 1ttn n VAL 59 Ca 0.00 -4.28 -0.05 0.00 -2.96 0.00 0.00 64.34 57.05 1ttn n VAL 59 Cb 0.00 -2.31 -0.04 0.00 -1.06 0.00 0.00 33.84 30.43 1ttn n VAL 59 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 1ttn h GLU 60 N 5.49 -0.04 0.00 1.45 5.08 -1.89 -3.35 114.58 121.32 1ttn h GLU 60 Ca 0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.84 1ttn h GLU 60 Cb 0.55 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1ttn h GLU 60 CO 1.61 0.24 0.00 -0.35 -1.00 0.00 0.00 179.01 179.52 1ttn n PRO 61 N -4.77 1.14 -0.09 2.33 -0.04 -1.26 -4.64 135.00 127.68 1ttn n PRO 61 Ca -0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.43 1ttn n PRO 61 Cb 0.15 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.61 1ttn n PRO 61 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ttn n GLY 62 N 0.00 1.44 1.51 0.55 0.00 -1.26 -3.59 105.19 103.83 1ttn n GLY 62 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 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 0.94 4.47 -3.97 1.61 7.64 -1.26 -4.71 113.62 118.35 1ttn n SER 63 Ca 0.00 -2.26 -0.43 0.00 1.01 0.00 0.00 58.87 57.19 1ttn n SER 63 Cb 0.33 -0.55 0.01 0.00 -1.01 0.00 0.00 64.21 62.99 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 1.38 4.35 -2.96 1.43 6.02 -1.24 -3.45 117.38 122.91 1ttn n GLN 64 Ca 0.26 -4.37 -0.44 0.00 -0.01 0.00 0.00 57.00 52.44 1ttn n GLN 64 Cb 0.78 -2.59 -0.03 0.00 1.02 0.00 0.00 30.24 29.43 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 -2.25 3.48 -0.05 -1.09 1.81 -0.95 -4.92 118.95 114.97 1ttn s ARG 65 Ca 0.33 -1.64 -0.30 0.00 -1.72 0.00 0.00 55.73 52.40 1ttn s ARG 65 Cb 0.06 -4.72 -0.04 0.00 -0.45 0.00 0.00 34.95 29.80 1ttn s ARG 65 CO 0.09 -1.72 1.27 1.67 -0.68 0.00 0.00 175.30 175.92 1ttn s TRP 66 N 2.69 3.05 -0.07 -0.53 -2.14 -1.26 -1.33 118.94 119.35 1ttn s TRP 66 Ca 0.28 1.07 -0.09 0.00 2.66 0.00 0.00 56.10 60.03 1ttn s TRP 66 Cb -0.09 -3.50 0.02 0.00 -3.10 0.00 0.00 33.47 26.80 1ttn s TRP 66 CO -0.05 -1.69 0.23 -0.06 -2.66 0.00 0.00 176.95 172.72 1ttn s PHE 67 N 2.41 -0.21 -0.07 1.66 0.40 0.27 -1.84 117.98 120.61 1ttn s PHE 67 Ca 0.58 0.48 -0.03 0.00 -0.60 0.00 0.00 56.93 57.36 1ttn s PHE 67 Cb -0.26 0.07 0.04 0.00 0.51 0.00 0.00 43.02 43.38 1ttn s PHE 67 CO 0.22 -0.18 0.16 0.12 0.70 0.00 0.00 175.22 176.25 1ttn s PHE 68 N -0.26 -0.19 0.00 0.36 5.36 0.12 0.15 117.98 123.51 1ttn s PHE 68 Ca -0.04 0.54 0.00 0.00 -0.96 0.00 0.00 56.93 56.47 1ttn s PHE 68 Cb -0.03 -0.08 0.00 0.00 -0.34 0.00 0.00 43.02 42.57 1ttn s PHE 68 CO 0.01 -0.18 0.00 0.45 -1.46 0.00 0.00 175.22 174.04 1ttn n SER 69 N 4.30 -1.96 0.00 6.13 2.88 -1.26 -1.87 113.62 121.84 1ttn n SER 69 Ca -0.25 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.29 1ttn n SER 69 Cb 0.52 -2.13 0.00 0.00 -0.75 0.00 0.00 64.21 61.85 1ttn n SER 69 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ttn n GLY 70 N -1.28 1.32 3.01 0.46 0.00 -1.26 -5.11 105.19 102.31 1ttn n GLY 70 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.23 0.38 -0.11 1.61 0.52 -0.78 -5.12 118.95 115.22 1ttn s ARG 71 Ca 0.00 -0.67 -0.29 0.00 -0.52 0.00 0.00 55.73 54.24 1ttn s ARG 71 Cb 0.00 0.01 -0.04 0.00 0.52 0.00 0.00 34.95 35.44 1ttn s ARG 71 CO 0.00 -0.03 1.55 -2.14 0.02 0.00 0.00 175.30 174.70 1ttn s PRO 72 N -1.58 4.13 0.89 3.54 0.02 -1.26 0.14 135.00 140.88 1ttn s PRO 72 Ca -0.14 1.97 -0.12 0.00 0.02 0.00 0.00 61.00 62.73 1ttn s PRO 72 Cb -0.09 -3.94 0.13 0.00 0.02 0.00 0.00 34.50 30.61 1ttn s PRO 72 CO -0.01 -0.88 1.11 -0.51 -0.33 0.00 0.00 177.00 176.38 1ttn s LEU 73 N 4.09 2.14 0.00 -5.54 1.43 -0.77 -4.90 118.68 115.14 1ttn s LEU 73 Ca 0.68 1.17 0.01 0.00 -1.03 0.00 0.00 54.13 54.97 1ttn s LEU 73 Cb -0.29 -3.57 0.01 0.00 0.03 0.00 0.00 46.19 42.37 1ttn s LEU 73 CO 0.26 -2.49 0.07 0.35 0.23 0.00 0.00 176.35 174.77 1ttn n THR 74 N -3.76 0.00 0.07 5.49 -2.24 -1.26 -4.89 114.28 107.69 1ttn n THR 74 Ca 0.06 -1.90 -0.10 0.00 -2.27 0.00 0.00 64.05 59.84 1ttn n THR 74 Cb 0.57 0.28 0.08 0.00 -2.10 0.00 0.00 70.33 69.16 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 -1.39 3.31 -1.39 3.42 5.75 -1.26 -3.58 116.55 121.41 1ttn n ASP 75 Ca -0.14 -2.67 -0.01 0.00 -0.01 0.00 0.00 54.79 51.96 1ttn n ASP 75 Cb 0.52 -0.64 -0.01 0.00 -1.03 0.00 0.00 41.12 39.95 1ttn n ASP 75 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1ttn n LYS 76 N -0.19 0.12 -0.00 0.11 4.76 -1.26 -4.71 118.16 116.99 1ttn n LYS 76 Ca 0.25 -1.61 -0.17 0.00 -2.87 0.00 0.00 58.31 53.91 1ttn n LYS 76 Cb 0.99 0.16 -0.14 0.00 -1.84 0.00 0.00 35.03 34.20 1ttn n LYS 76 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1ttn n MET 77 N 0.17 0.72 0.00 1.97 2.81 -1.24 -3.77 117.12 117.78 1ttn n MET 77 Ca -0.09 0.28 0.00 0.00 -1.81 0.00 0.00 57.70 56.08 1ttn n MET 77 Cb 0.94 -1.75 0.00 0.00 -0.71 0.00 0.00 33.22 31.70 1ttn n MET 77 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1ttn n LYS 78 N -3.33 0.00 0.00 0.03 4.76 -1.26 -0.58 118.16 117.78 1ttn n LYS 78 Ca -0.26 0.55 0.02 0.00 -2.87 0.00 0.00 58.31 55.75 1ttn n LYS 78 Cb 1.05 -1.48 0.10 0.00 -1.84 0.00 0.00 35.03 32.86 1ttn n LYS 78 CO 0.00 0.00 0.00 1.97 -1.37 0.00 0.00 177.40 178.00 1ttn n PHE 79 N -2.08 0.00 -0.00 2.13 -1.74 -1.24 -1.82 117.46 112.70 1ttn n PHE 79 Ca 0.00 0.00 -0.05 0.00 -0.56 0.00 0.00 57.45 56.84 1ttn n PHE 79 Cb 0.00 -0.46 -0.12 0.00 1.52 0.00 0.00 39.48 40.42 1ttn n PHE 79 CO 0.00 0.00 0.00 -1.91 -0.56 0.00 0.00 176.76 174.29 1ttn n GLU 80 N -1.46 0.63 -0.08 3.97 2.13 -0.74 -4.51 120.64 120.58 1ttn n GLU 80 Ca 0.01 0.27 -0.09 0.00 0.66 0.00 0.00 57.16 58.01 1ttn n GLU 80 Cb 0.05 -1.79 -0.04 0.00 0.27 0.00 0.00 31.44 29.93 1ttn n GLU 80 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1ttn n GLU 81 N -2.98 0.49 0.00 5.31 4.07 0.25 -4.95 120.64 122.83 1ttn n GLU 81 Ca -0.15 0.48 0.00 0.00 -0.06 0.00 0.00 57.16 57.43 1ttn n GLU 81 Cb 0.98 -1.66 0.00 0.00 -0.06 0.00 0.00 31.44 30.70 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 -4.55 0.00 -0.86 4.31 7.99 -0.76 -4.70 117.00 118.44 1ttn n LEU 82 Ca -0.14 0.00 0.12 0.00 -0.01 0.00 0.00 56.01 55.98 1ttn n LEU 82 Cb 0.39 -0.17 0.10 0.00 -0.11 0.00 0.00 43.42 43.63 1ttn n LEU 82 CO 0.13 0.00 0.58 0.29 -1.51 0.00 0.00 177.39 176.88 1ttn n LYS 83 N -1.97 2.10 -0.17 3.23 4.76 -1.26 -4.46 118.16 120.39 1ttn n LYS 83 Ca 0.00 -1.72 0.24 0.00 -2.87 0.00 0.00 58.31 53.95 1ttn n LYS 83 Cb 0.00 -1.46 0.64 0.00 -1.84 0.00 0.00 35.03 32.37 1ttn n LYS 83 CO 0.00 0.00 0.00 -0.84 -1.37 0.00 0.00 177.40 175.19 1ttn h ILE 84 N 4.20 0.63 -0.12 -0.18 -2.65 -1.84 -3.09 117.51 114.47 1ttn h ILE 84 Ca 0.00 -0.05 -0.46 0.00 1.03 0.00 0.00 64.86 65.38 1ttn h ILE 84 Cb 0.94 0.47 -0.03 0.00 -2.05 0.00 0.00 36.82 36.15 1ttn h ILE 84 CO 0.00 0.03 1.83 -2.65 0.03 0.00 0.00 178.15 177.39 1ttn n PRO 85 N -4.38 2.98 0.00 0.16 -0.02 -0.51 -4.01 135.00 129.22 1ttn n PRO 85 Ca 0.17 -1.77 0.00 0.00 -2.02 0.00 0.00 63.50 59.88 1ttn n PRO 85 Cb 0.80 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1ttn n PRO 85 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1ttn n LYS 86 N 2.89 0.00 -0.21 -0.52 3.00 -1.17 -4.95 118.16 117.20 1ttn n LYS 86 Ca 0.61 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.99 1ttn n LYS 86 Cb 0.54 0.00 0.16 0.00 0.00 0.00 0.00 35.03 35.72 1ttn n LYS 86 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1ttn n ASP 87 N 0.00 2.96 -4.78 3.14 2.03 -1.26 -5.02 116.55 113.62 1ttn n ASP 87 Ca 0.00 -2.55 -0.38 0.00 0.52 0.00 0.00 54.79 52.38 1ttn n ASP 87 Cb 0.00 -0.33 -0.06 0.00 -0.72 0.00 0.00 41.12 40.01 1ttn n ASP 87 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1ttn s TYR 88 N -1.97 3.84 -0.15 -0.67 1.51 -1.26 -5.04 117.35 113.61 1ttn s TYR 88 Ca 0.27 1.62 -0.07 0.00 -1.01 0.00 0.00 57.07 57.87 1ttn s TYR 88 Cb 0.20 -2.77 0.06 0.00 -0.11 0.00 0.00 41.96 39.34 1ttn s TYR 88 CO 0.08 0.44 0.35 0.54 -1.11 0.00 0.00 175.55 175.85 1ttn s VAL 89 N -1.28 -0.13 -0.31 0.71 0.11 -1.26 -2.34 120.40 115.89 1ttn s VAL 89 Ca 0.39 0.13 -0.13 0.00 -2.93 0.00 0.00 61.98 59.45 1ttn s VAL 89 Cb -0.21 -0.53 -0.03 0.00 -1.53 0.00 0.00 36.38 34.07 1ttn s VAL 89 CO 0.25 0.06 0.27 -0.69 -3.33 0.00 0.00 175.10 171.65 1ttn s VAL 90 N 1.58 5.25 -0.06 2.04 1.01 0.25 -4.70 120.40 125.77 1ttn s VAL 90 Ca -0.08 0.08 -0.27 0.00 0.00 0.00 0.00 61.98 61.71 1ttn s VAL 90 Cb -0.10 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 1ttn s VAL 90 CO -0.11 0.08 0.88 -1.58 0.00 0.00 0.00 175.10 174.37 1ttn s GLN 91 N 1.85 4.46 0.40 2.72 -0.44 0.39 -1.61 119.66 127.43 1ttn s GLN 91 Ca 0.09 1.20 0.08 0.00 -2.50 0.00 0.00 55.36 54.22 1ttn s GLN 91 Cb -0.17 -3.49 -0.05 0.00 -1.64 0.00 0.00 33.01 27.67 1ttn s GLN 91 CO 0.11 -0.10 0.16 0.14 0.50 0.00 0.00 175.29 176.10 1ttn s VAL 92 N 1.29 2.45 -0.11 1.34 -7.23 0.15 -0.56 120.40 117.73 1ttn s VAL 92 Ca 0.45 -1.71 0.01 0.00 -1.81 0.00 0.00 61.98 58.91 1ttn s VAL 92 Cb -0.19 -2.98 0.02 0.00 0.56 0.00 0.00 36.38 33.80 1ttn s VAL 92 CO 0.21 -0.05 -0.12 -0.63 -0.31 0.00 0.00 175.10 174.21 1ttn s ILE 93 N -2.56 1.27 -0.28 -0.62 1.01 -0.44 -3.03 121.20 116.55 1ttn s ILE 93 Ca 0.40 -0.48 -0.03 0.00 0.00 0.00 0.00 60.65 60.55 1ttn s ILE 93 Cb 0.02 -1.21 0.11 0.00 0.01 0.00 0.00 42.46 41.39 1ttn s ILE 93 CO 0.22 0.40 0.18 0.54 0.00 0.00 0.00 174.94 176.29 1ttn s VAL 94 N 1.32 -0.18 -0.25 2.92 0.11 -1.22 -2.25 120.40 120.84 1ttn s VAL 94 Ca -0.01 -0.61 0.16 0.00 -2.93 0.00 0.00 61.98 58.58 1ttn s VAL 94 Cb -0.14 -0.94 0.48 0.00 -1.53 0.00 0.00 36.38 34.25 1ttn s VAL 94 CO -0.05 -0.60 1.16 -0.24 -3.33 0.00 0.00 175.10 172.03 1ttn n SER 95 N 5.27 2.96 -3.49 3.54 2.88 -1.26 -4.60 113.62 118.92 1ttn n SER 95 Ca -0.05 -2.89 -0.28 0.00 -1.33 0.00 0.00 58.87 54.32 1ttn n SER 95 Cb 0.44 -0.41 -0.11 0.00 -0.75 0.00 0.00 64.21 63.38 1ttn n SER 95 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 1ttn s GLN 96 N -3.39 0.99 0.56 -1.46 -1.52 -1.26 -4.98 119.66 108.60 1ttn s GLN 96 Ca 0.39 -2.00 0.31 0.00 -1.95 0.00 0.00 55.36 52.11 1ttn s GLN 96 Cb 0.37 -1.67 1.46 0.00 -0.22 0.00 0.00 33.01 32.96 1ttn s GLN 96 CO -0.02 -1.31 1.85 -1.35 -0.25 0.00 0.00 175.29 174.21 1ttn h PRO 97 N 6.11 0.00 0.00 2.91 0.11 -2.01 -3.33 132.00 135.80 1ttn h PRO 97 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1ttn h PRO 97 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1ttn h PRO 97 CO 0.38 0.00 0.00 0.28 -0.21 0.00 0.00 178.00 178.45 1ttn n VAL 98 N -4.02 0.00 0.00 3.15 0.31 -1.26 -5.05 118.33 111.47 1ttn n VAL 98 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.50 1ttn n VAL 98 Cb 0.95 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.88 1ttn n VAL 98 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1ttn n GLN 99 N -1.24 0.00 -0.71 5.55 7.27 -1.25 -4.99 117.38 122.01 1ttn n GLN 99 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1ttn n GLN 99 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1ttn n GLN 99 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22