#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 0.01 -4.02 1.61 4.19 -1.26 -4.20 117.16 113.48 1ttn n TYR 22 Ca 0.00 0.00 -0.35 0.00 3.31 0.00 0.00 57.90 60.86 1ttn n TYR 22 Cb 0.00 -0.10 -0.12 0.00 0.49 0.00 0.00 39.34 39.60 1ttn n TYR 22 CO 0.00 0.00 0.00 -1.83 0.91 0.00 0.00 176.86 175.94 1ttn s GLU 23 N -1.03 3.64 0.07 2.98 -1.05 -1.26 -4.66 118.70 117.39 1ttn s GLU 23 Ca -0.00 -0.51 -0.04 0.00 -0.15 0.00 0.00 54.97 54.27 1ttn s GLU 23 Cb 0.00 -3.12 -0.02 0.00 -0.44 0.00 0.00 34.13 30.55 1ttn s GLU 23 CO 0.01 -0.00 0.07 0.00 0.95 0.00 0.00 175.26 176.28 1ttn s GLN 25 N -3.91 0.59 0.24 0.00 0.00 -1.26 -0.14 119.66 115.19 1ttn s GLN 25 Ca 0.07 1.03 0.10 0.00 -0.00 0.00 0.00 55.36 56.57 1ttn s GLN 25 Cb 0.07 0.13 -0.05 0.00 0.00 0.00 0.00 33.01 33.16 1ttn s GLN 25 CO -0.09 -0.13 -0.18 -1.17 0.00 0.00 0.00 175.29 173.72 1ttn s LEU 26 N 1.56 2.56 0.06 2.60 2.96 -0.91 -2.07 118.68 125.44 1ttn s LEU 26 Ca -0.10 -1.01 0.07 0.00 -0.22 0.00 0.00 54.13 52.87 1ttn s LEU 26 Cb -0.05 -0.95 -0.04 0.00 0.50 0.00 0.00 46.19 45.66 1ttn s LEU 26 CO -0.18 -0.03 -0.14 0.00 -1.32 0.00 0.00 176.35 174.68 1ttn s ARG 27 N -3.46 2.13 0.21 1.98 1.70 -1.05 -0.53 118.95 119.92 1ttn s ARG 27 Ca 0.26 -0.97 0.09 0.00 -0.47 0.00 0.00 55.73 54.64 1ttn s ARG 27 Cb -0.04 -2.26 -0.04 0.00 -0.57 0.00 0.00 34.95 32.04 1ttn s ARG 27 CO 0.12 0.54 -0.05 -0.51 -1.08 0.00 0.00 175.30 174.31 1ttn s LEU 28 N -1.70 3.11 -0.32 -1.89 2.01 -0.87 -0.44 118.68 118.57 1ttn s LEU 28 Ca 0.17 -0.58 -0.01 0.00 0.01 0.00 0.00 54.13 53.72 1ttn s LEU 28 Cb -0.11 -1.72 0.11 0.00 0.01 0.00 0.00 46.19 44.48 1ttn s LEU 28 CO 0.08 0.06 0.13 -0.60 1.01 0.00 0.00 176.35 177.04 1ttn s ARG 29 N -3.17 0.63 0.41 1.70 3.00 -0.60 -1.93 118.95 119.00 1ttn s ARG 29 Ca 0.28 -1.07 -0.20 0.00 -1.00 0.00 0.00 55.73 53.74 1ttn s ARG 29 Cb -0.08 -1.76 -0.10 0.00 0.00 0.00 0.00 34.95 33.01 1ttn s ARG 29 CO 0.17 -1.04 0.91 -0.51 0.00 0.00 0.00 175.30 174.84 1ttn s LEU 30 N 1.53 3.94 0.65 -0.88 2.01 0.12 -1.79 118.68 124.26 1ttn s LEU 30 Ca 0.11 1.60 0.23 0.00 0.01 0.00 0.00 54.13 56.08 1ttn s LEU 30 Cb -0.18 -4.45 1.19 0.00 0.01 0.00 0.00 46.19 42.76 1ttn s LEU 30 CO -0.22 -0.34 1.67 0.77 1.01 0.00 0.00 176.35 179.23 1ttn h SER 31 N 1.91 0.00 -0.48 2.29 4.64 -1.68 1.15 113.55 121.38 1ttn h SER 31 Ca -0.49 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.73 1ttn h SER 31 Cb 1.18 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.21 1ttn h SER 31 CO 0.62 0.00 0.13 0.35 -0.87 0.00 0.00 176.83 177.06 1ttn n THR 32 N -2.97 2.11 -3.26 2.95 -2.24 -1.26 -4.86 114.28 104.75 1ttn n THR 32 Ca 0.02 -1.08 -0.17 0.00 -2.27 0.00 0.00 64.05 60.56 1ttn n THR 32 Cb 0.65 -0.43 0.06 0.00 -2.10 0.00 0.00 70.33 68.52 1ttn n THR 32 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ttn n GLY 33 N 0.14 -0.19 3.19 3.38 0.00 0.39 -4.97 105.19 107.12 1ttn n GLY 33 Ca 0.26 0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.89 1ttn n GLY 33 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ttn s LYS 34 N -5.68 2.62 -0.27 1.61 2.36 -0.84 -4.85 119.74 114.69 1ttn s LYS 34 Ca 0.30 -2.10 -0.08 0.00 -2.55 0.00 0.00 55.97 51.54 1ttn s LYS 34 Cb -0.13 -3.91 -0.01 0.00 -1.05 0.00 0.00 37.83 32.72 1ttn s LYS 34 CO 0.56 -1.19 0.08 0.34 1.55 0.00 0.00 175.35 176.69 1ttn s ASP 35 N 1.94 5.18 -0.24 1.43 -1.08 -1.24 0.10 116.67 122.76 1ttn s ASP 35 Ca 0.11 -0.40 -0.12 0.00 -0.52 0.00 0.00 52.55 51.62 1ttn s ASP 35 Cb -0.22 -1.92 0.08 0.00 -1.46 0.00 0.00 42.92 39.40 1ttn s ASP 35 CO -0.03 -0.10 0.57 -0.22 0.52 0.00 0.00 175.17 175.90 1ttn s LEU 36 N 1.58 -0.65 -0.24 -1.34 1.98 -0.81 -4.94 118.68 114.25 1ttn s LEU 36 Ca 0.05 1.27 -0.19 0.00 -2.89 0.00 0.00 54.13 52.37 1ttn s LEU 36 Cb -0.16 1.95 -0.03 0.00 0.66 0.00 0.00 46.19 48.61 1ttn s LEU 36 CO 0.04 -0.22 0.54 -1.59 -1.89 0.00 0.00 176.35 173.23 1ttn s LYS 37 N 1.74 4.12 -0.01 1.98 0.00 -1.26 -2.05 119.74 124.26 1ttn s LYS 37 Ca -0.09 0.40 -0.11 0.00 0.00 0.00 0.00 55.97 56.18 1ttn s LYS 37 Cb -0.07 -3.62 -0.05 0.00 0.00 0.00 0.00 37.83 34.08 1ttn s LYS 37 CO -0.17 -0.30 0.33 -1.17 0.00 0.00 0.00 175.35 174.04 1ttn s LEU 38 N 2.14 4.41 0.41 2.77 2.96 0.31 -4.87 118.68 126.81 1ttn s LEU 38 Ca 0.23 0.75 -0.25 0.00 -0.22 0.00 0.00 54.13 54.64 1ttn s LEU 38 Cb -0.16 -2.58 -0.08 0.00 0.50 0.00 0.00 46.19 43.87 1ttn s LEU 38 CO 0.09 0.30 1.18 -0.69 -1.32 0.00 0.00 176.35 175.91 1ttn s VAL 39 N -1.18 3.10 0.23 1.68 1.01 -1.26 -2.15 120.40 121.82 1ttn s VAL 39 Ca 0.25 0.92 -0.11 0.00 0.00 0.00 0.00 61.98 63.03 1ttn s VAL 39 Cb -0.14 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.72 1ttn s VAL 39 CO 0.13 0.08 0.40 0.68 0.00 0.00 0.00 175.10 176.39 1ttn s VAL 40 N -1.41 0.01 -0.29 2.92 -7.23 0.80 -4.89 120.40 110.31 1ttn s VAL 40 Ca 0.58 -1.47 0.02 0.00 -1.81 0.00 0.00 61.98 59.30 1ttn s VAL 40 Cb -0.31 -2.17 0.20 0.00 0.56 0.00 0.00 36.38 34.65 1ttn s VAL 40 CO 0.39 -0.05 0.67 0.00 -0.31 0.00 0.00 175.10 175.80 1ttn s ARG 41 N -4.03 0.50 0.00 4.82 3.03 -1.26 -0.60 118.95 121.40 1ttn s ARG 41 Ca 0.24 0.57 0.00 0.00 2.03 0.00 0.00 55.73 58.56 1ttn s ARG 41 Cb 0.01 0.27 0.00 0.00 -1.03 0.00 0.00 34.95 34.21 1ttn s ARG 41 CO 0.08 -0.85 0.00 -1.13 -1.13 0.00 0.00 175.30 172.27 1ttn n SER 42 N 5.38 0.00 -0.06 -2.89 3.41 -1.26 -1.79 113.62 116.42 1ttn n SER 42 Ca 0.04 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.78 1ttn n SER 42 Cb 0.54 0.00 0.39 0.00 -0.26 0.00 0.00 64.21 64.87 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 0.00 0.00 6.66 -2.24 -1.26 -4.07 114.28 113.37 1ttn n THR 43 Ca 0.00 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1ttn n THR 43 Cb 0.00 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 1ttn n THR 43 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1ttn n ASP 44 N -1.27 0.00 -1.26 3.42 -0.08 -0.74 -4.75 116.55 111.87 1ttn n ASP 44 Ca 0.08 0.28 0.14 0.00 -1.51 0.00 0.00 54.79 53.79 1ttn n ASP 44 Cb 0.33 -0.30 -0.07 0.00 2.34 0.00 0.00 41.12 43.41 1ttn n ASP 44 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1ttn n THR 45 N -1.45 -0.68 -0.47 5.18 -2.24 -1.26 -0.84 114.28 112.51 1ttn n THR 45 Ca 0.00 0.73 0.35 0.00 -2.27 0.00 0.00 64.05 62.86 1ttn n THR 45 Cb 0.00 -1.11 0.55 0.00 -2.10 0.00 0.00 70.33 67.67 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 -4.06 -0.01 0.00 2.28 0.31 -1.15 0.11 118.33 115.80 1ttn n VAL 46 Ca -0.07 1.02 0.00 0.00 -0.01 0.00 0.00 64.34 65.28 1ttn n VAL 46 Cb 0.56 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 31.80 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 -3.34 0.00 -0.33 3.52 -0.00 0.30 0.14 117.46 117.74 1ttn n PHE 47 Ca 0.30 0.00 -0.02 0.00 -0.00 0.00 0.00 57.45 57.73 1ttn n PHE 47 Cb 1.34 -0.49 0.11 0.00 -0.00 0.00 0.00 39.48 40.44 1ttn n PHE 47 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1ttn h HIS 48 N 0.00 1.09 -0.81 -5.13 3.86 0.13 0.70 115.15 114.98 1ttn h HIS 48 Ca 0.00 0.03 0.19 0.00 -1.16 0.00 0.00 60.37 59.42 1ttn h HIS 48 Cb 0.00 -0.36 -0.15 0.00 1.06 0.00 0.00 27.41 27.96 1ttn h HIS 48 CO 0.17 0.64 -0.04 1.98 0.86 0.00 0.00 177.93 181.54 1ttn h MET 49 N 1.14 0.06 -0.38 2.45 1.85 0.83 1.31 114.93 122.18 1ttn h MET 49 Ca 0.35 -0.00 -0.11 0.00 -0.61 0.00 0.00 59.70 59.33 1ttn h MET 49 Cb -0.04 -0.01 -0.02 0.00 0.43 0.00 0.00 31.60 31.97 1ttn h MET 49 CO -0.10 0.04 -0.19 -0.22 -0.40 0.00 0.00 176.91 176.03 1ttn h LYS 50 N 0.06 0.74 0.26 0.39 3.11 0.42 0.76 116.57 122.31 1ttn h LYS 50 Ca 0.44 -0.28 0.00 0.00 -2.81 0.00 0.00 60.65 58.00 1ttn h LYS 50 Cb 0.78 -0.04 -0.03 0.00 -1.00 0.00 0.00 32.23 31.94 1ttn h LYS 50 CO -0.75 0.88 -0.46 -0.09 -2.81 0.00 0.00 179.45 176.21 1ttn h ARG 51 N 0.65 -0.74 0.00 1.90 9.65 0.73 -0.91 114.38 125.66 1ttn h ARG 51 Ca 0.10 0.05 0.00 0.00 -1.10 0.00 0.00 59.98 59.03 1ttn h ARG 51 Cb 0.68 0.17 0.00 0.00 -1.39 0.00 0.00 29.97 29.43 1ttn h ARG 51 CO 0.05 -0.49 0.00 0.54 2.80 0.00 0.00 179.97 182.87 1ttn n ARG 52 N -5.12 0.07 0.18 0.20 1.74 0.12 -2.49 116.66 111.36 1ttn n ARG 52 Ca -0.09 0.14 -0.14 0.00 -0.77 0.00 0.00 57.85 56.99 1ttn n ARG 52 Cb 0.38 -1.60 -0.08 0.00 -1.02 0.00 0.00 32.46 30.14 1ttn n ARG 52 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1ttn h LEU 53 N 0.00 -0.36 -0.27 0.55 5.85 0.19 0.72 115.31 121.99 1ttn h LEU 53 Ca 0.00 -0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.55 1ttn h LEU 53 Cb 0.48 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1ttn h LEU 53 CO 0.00 -0.12 -0.13 -0.74 -0.34 0.00 0.00 178.44 177.11 1ttn h HIS 54 N -0.60 0.65 -1.00 1.25 2.76 -1.26 1.14 115.15 118.09 1ttn h HIS 54 Ca -0.04 -0.16 0.05 0.00 -2.20 0.00 0.00 60.37 58.01 1ttn h HIS 54 Cb 0.43 -0.15 -0.06 0.00 1.55 0.00 0.00 27.41 29.18 1ttn h HIS 54 CO -0.01 0.81 0.65 0.00 -1.30 0.00 0.00 177.93 178.08 1ttn h ALA 55 N 0.74 1.37 0.06 5.26 0.00 -1.43 0.38 119.26 125.64 1ttn h ALA 55 Ca 0.06 -0.04 -0.30 0.00 0.00 0.00 0.00 54.91 54.64 1ttn h ALA 55 Cb 0.64 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1ttn h ALA 55 CO 0.04 0.51 -1.60 0.00 0.00 0.00 0.00 179.25 178.20 1ttn h ALA 56 N 1.43 0.34 0.00 0.00 0.00 0.53 -3.43 119.26 118.12 1ttn h ALA 56 Ca 0.41 -1.29 0.00 0.00 0.00 0.00 0.00 54.91 54.03 1ttn h ALA 56 Cb 0.06 0.72 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1ttn h ALA 56 CO -0.14 0.98 -0.30 0.39 0.00 0.00 0.00 179.25 180.19 1ttn n GLU 57 N -3.99 0.26 0.00 0.00 -0.58 0.39 -5.04 120.64 111.68 1ttn n GLU 57 Ca -0.32 0.41 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 1ttn n GLU 57 Cb 0.86 -1.30 0.00 0.00 -0.57 0.00 0.00 31.44 30.42 1ttn n GLU 57 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ttn n GLY 58 N 1.67 0.17 3.54 0.62 0.00 0.13 -4.96 105.19 106.37 1ttn n GLY 58 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.11 4.77 0.88 1.61 1.01 -1.26 -4.84 120.40 122.47 1ttn s VAL 59 Ca 0.00 0.40 -0.13 0.00 0.00 0.00 0.00 61.98 62.25 1ttn s VAL 59 Cb 0.00 -4.22 0.13 0.00 0.00 0.00 0.00 36.38 32.29 1ttn s VAL 59 CO 0.00 -0.56 1.18 -1.61 0.00 0.00 0.00 175.10 174.12 1ttn s GLU 60 N 2.98 1.37 0.24 2.72 2.02 -1.26 -3.11 118.70 123.66 1ttn s GLU 60 Ca 0.26 0.09 -0.10 0.00 0.02 0.00 0.00 54.97 55.24 1ttn s GLU 60 Cb -0.13 -1.88 0.36 0.00 0.10 0.00 0.00 34.13 32.57 1ttn s GLU 60 CO 0.19 -2.00 1.60 -1.00 0.02 0.00 0.00 175.26 174.07 1ttn h PRO 61 N -1.35 0.01 -0.79 0.39 0.13 -1.89 0.84 132.00 129.33 1ttn h PRO 61 Ca -0.47 -0.00 0.15 0.00 -0.87 0.00 0.00 66.00 64.81 1ttn h PRO 61 Cb 1.32 -0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.39 1ttn h PRO 61 CO 0.59 0.01 0.53 0.78 -0.23 0.00 0.00 178.00 179.67 1ttn h GLY 62 N 0.01 0.80 -1.66 1.56 0.00 -1.93 0.76 103.07 102.61 1ttn h GLY 62 Ca 0.39 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1ttn h GLY 62 CO -0.81 0.06 -0.13 1.44 0.00 0.00 0.00 176.54 177.10 1ttn n SER 63 N -4.49 2.72 -3.95 0.19 7.64 0.14 -4.66 113.62 111.20 1ttn n SER 63 Ca 0.15 -1.86 -0.43 0.00 1.01 0.00 0.00 58.87 57.75 1ttn n SER 63 Cb 0.54 0.13 0.01 0.00 -1.01 0.00 0.00 64.21 63.88 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 0.97 4.31 -2.59 1.43 6.02 0.25 -2.98 117.38 124.79 1ttn n GLN 64 Ca 0.13 -4.31 -0.41 0.00 -0.01 0.00 0.00 57.00 52.40 1ttn n GLN 64 Cb 0.56 -2.61 -0.03 0.00 1.02 0.00 0.00 30.24 29.18 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 -2.07 3.46 0.12 -1.09 0.52 -0.91 -4.84 118.95 114.14 1ttn s ARG 65 Ca 0.33 -0.91 -0.31 0.00 -0.52 0.00 0.00 55.73 54.33 1ttn s ARG 65 Cb 0.07 -4.97 -0.08 0.00 0.52 0.00 0.00 34.95 30.49 1ttn s ARG 65 CO 0.08 -2.15 1.36 -1.58 0.02 0.00 0.00 175.30 173.02 1ttn s TRP 66 N 5.02 3.27 -0.27 -0.53 0.51 -1.25 -1.45 118.94 124.23 1ttn s TRP 66 Ca 0.41 1.03 -0.03 0.00 -2.12 0.00 0.00 56.10 55.39 1ttn s TRP 66 Cb -0.03 -3.64 0.11 0.00 -0.81 0.00 0.00 33.47 29.09 1ttn s TRP 66 CO -0.02 -2.20 0.18 -0.06 -0.51 0.00 0.00 176.95 174.34 1ttn s PHE 67 N 0.95 0.03 -0.17 -1.98 0.08 0.18 -2.05 117.98 115.01 1ttn s PHE 67 Ca 0.63 -0.52 -0.05 0.00 0.12 0.00 0.00 56.93 57.11 1ttn s PHE 67 Cb -0.36 -0.70 -0.03 0.00 -0.57 0.00 0.00 43.02 41.36 1ttn s PHE 67 CO 0.31 -0.80 -0.00 0.12 -0.10 0.00 0.00 175.22 174.75 1ttn s PHE 68 N 2.20 3.08 -0.34 0.36 2.19 0.52 -1.44 117.98 124.55 1ttn s PHE 68 Ca 0.08 -0.24 0.00 0.00 0.33 0.00 0.00 56.93 57.10 1ttn s PHE 68 Cb -0.15 -2.02 0.00 0.00 -1.31 0.00 0.00 43.02 39.54 1ttn s PHE 68 CO -0.31 -0.04 0.00 0.45 1.83 0.00 0.00 175.22 177.15 1ttn n SER 69 N 3.70 -5.70 0.00 6.13 2.88 -1.26 -1.47 113.62 117.91 1ttn n SER 69 Ca -0.17 0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.45 1ttn n SER 69 Cb 0.52 -3.48 0.00 0.00 -0.75 0.00 0.00 64.21 60.50 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 0.48 1.28 3.13 0.46 0.00 -1.26 -5.09 105.19 104.18 1ttn n GLY 70 Ca -0.03 -0.33 -0.08 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.74 0.70 -0.45 1.61 0.52 -0.54 -5.10 118.95 113.95 1ttn s ARG 71 Ca 0.00 -1.15 -0.28 0.00 -0.52 0.00 0.00 55.73 53.79 1ttn s ARG 71 Cb 0.00 0.25 -0.02 0.00 0.52 0.00 0.00 34.95 35.70 1ttn s ARG 71 CO 0.00 -0.17 1.83 -2.14 0.02 0.00 0.00 175.30 174.84 1ttn s PRO 72 N -3.91 3.02 0.62 3.54 0.02 -1.26 -0.35 135.00 136.67 1ttn s PRO 72 Ca 0.07 1.08 -0.16 0.00 0.02 0.00 0.00 61.00 62.01 1ttn s PRO 72 Cb 0.07 -4.28 -0.02 0.00 0.02 0.00 0.00 34.50 30.29 1ttn s PRO 72 CO -0.10 -2.25 1.10 -1.17 -0.33 0.00 0.00 177.00 174.26 1ttn s LEU 73 N 7.90 3.51 0.57 -5.54 2.96 -0.87 -4.89 118.68 122.32 1ttn s LEU 73 Ca 0.75 2.01 -0.05 0.00 -0.22 0.00 0.00 54.13 56.62 1ttn s LEU 73 Cb -0.18 -4.56 0.01 0.00 0.50 0.00 0.00 46.19 41.97 1ttn s LEU 73 CO 0.28 -1.44 0.87 -0.89 -1.32 0.00 0.00 176.35 173.85 1ttn s THR 74 N -2.21 3.54 -2.28 3.68 2.01 -1.26 -4.79 115.64 114.33 1ttn s THR 74 Ca 0.68 -0.14 0.20 0.00 0.31 0.00 0.00 61.69 62.74 1ttn s THR 74 Cb -0.21 -3.39 0.44 0.00 0.01 0.00 0.00 72.50 69.35 1ttn s THR 74 CO 0.37 -0.38 1.51 0.47 -0.69 0.00 0.00 174.62 175.90 1ttn n ASP 75 N -2.52 1.86 -2.41 3.53 9.92 -1.26 -4.00 116.55 121.67 1ttn n ASP 75 Ca 0.04 -1.76 -0.18 0.00 -0.53 0.00 0.00 54.79 52.37 1ttn n ASP 75 Cb 0.58 -0.13 0.02 0.00 -0.64 0.00 0.00 41.12 40.95 1ttn n ASP 75 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1ttn n LYS 76 N 0.46 2.80 0.03 -1.24 5.02 -1.26 0.11 118.16 124.08 1ttn n LYS 76 Ca 0.16 -3.99 0.01 0.00 -2.02 0.00 0.00 58.31 52.47 1ttn n LYS 76 Cb 0.36 -1.98 -0.08 0.00 -0.02 0.00 0.00 35.03 33.31 1ttn n LYS 76 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1ttn n MET 77 N -0.53 0.62 0.15 1.97 2.81 -1.26 -4.03 117.12 116.86 1ttn n MET 77 Ca 0.30 0.20 -0.07 0.00 -1.81 0.00 0.00 57.70 56.32 1ttn n MET 77 Cb 0.83 -1.80 -0.03 0.00 -0.71 0.00 0.00 33.22 31.51 1ttn n MET 77 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 1ttn h LYS 78 N 0.00 -0.40 0.00 0.03 1.63 -1.88 0.12 116.57 116.06 1ttn h LYS 78 Ca -0.15 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.67 1ttn h LYS 78 Cb 1.53 0.09 0.00 0.00 -0.60 0.00 0.00 32.23 33.26 1ttn h LYS 78 CO 0.04 -0.27 0.00 0.34 -3.45 0.00 0.00 179.45 176.11 1ttn n PHE 79 N -3.33 0.00 -0.01 1.91 7.35 -1.26 -1.47 117.46 120.65 1ttn n PHE 79 Ca -0.05 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.52 1ttn n PHE 79 Cb 0.18 -0.49 -0.14 0.00 0.35 0.00 0.00 39.48 39.38 1ttn n PHE 79 CO 0.00 0.00 0.00 -1.91 -0.76 0.00 0.00 176.76 174.09 1ttn n GLU 80 N -1.49 0.67 -0.07 -4.13 4.07 -0.59 -4.59 120.64 114.51 1ttn n GLU 80 Ca 0.01 0.29 -0.05 0.00 -0.06 0.00 0.00 57.16 57.35 1ttn n GLU 80 Cb 0.05 -1.77 -0.02 0.00 -0.06 0.00 0.00 31.44 29.64 1ttn n GLU 80 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 1ttn n GLU 81 N -3.18 0.46 0.00 5.31 4.07 0.32 -4.95 120.64 122.67 1ttn n GLU 81 Ca -0.21 0.46 0.00 0.00 -0.06 0.00 0.00 57.16 57.35 1ttn n GLU 81 Cb 1.05 -1.62 0.00 0.00 -0.06 0.00 0.00 31.44 30.81 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 -4.54 0.00 -1.83 4.31 7.99 -0.54 -4.76 117.00 117.63 1ttn n LEU 82 Ca -0.08 0.00 -0.19 0.00 -0.01 0.00 0.00 56.01 55.73 1ttn n LEU 82 Cb 0.31 -0.16 0.15 0.00 -0.11 0.00 0.00 43.42 43.61 1ttn n LEU 82 CO 0.12 0.00 0.99 0.29 -1.51 0.00 0.00 177.39 177.29 1ttn n LYS 83 N -1.93 2.29 -1.82 3.23 4.76 -1.26 -4.57 118.16 118.86 1ttn n LYS 83 Ca 0.00 -3.24 -0.22 0.00 -2.87 0.00 0.00 58.31 51.98 1ttn n LYS 83 Cb 0.00 -2.07 0.04 0.00 -1.84 0.00 0.00 35.03 31.16 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 -1.06 2.62 -2.55 -0.18 -5.35 -1.26 -4.55 119.36 107.02 1ttn n ILE 84 Ca 0.49 -3.98 -0.42 0.00 -0.27 0.00 0.00 62.75 58.57 1ttn n ILE 84 Cb 1.19 -1.05 -0.02 0.00 -1.74 0.00 0.00 39.64 38.02 1ttn n ILE 84 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 1ttn s PRO 85 N -3.59 3.76 -0.45 6.28 0.04 -1.25 -3.98 135.00 135.82 1ttn s PRO 85 Ca 0.51 -1.57 0.00 0.00 0.04 0.00 0.00 61.00 59.98 1ttn s PRO 85 Cb 0.42 -5.45 0.00 0.00 0.04 0.00 0.00 34.50 29.51 1ttn s PRO 85 CO 0.03 -2.30 0.00 1.63 0.04 0.00 0.00 177.00 176.40 1ttn n LYS 86 N 8.62 -1.42 -0.02 4.56 5.02 -0.88 -4.76 118.16 129.27 1ttn n LYS 86 Ca 0.42 0.56 -0.01 0.00 -2.02 0.00 0.00 58.31 57.27 1ttn n LYS 86 Cb 0.48 -4.72 -0.05 0.00 -0.02 0.00 0.00 35.03 30.72 1ttn n LYS 86 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1ttn n ASP 87 N -0.72 3.46 -4.60 4.39 8.00 -1.26 -5.01 116.55 120.81 1ttn n ASP 87 Ca -0.04 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.15 1ttn n ASP 87 Cb 0.42 0.91 -0.10 0.00 -0.02 0.00 0.00 41.12 42.34 1ttn n ASP 87 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1ttn s TYR 88 N -2.28 2.83 -0.01 1.24 1.51 -1.26 -5.04 117.35 114.34 1ttn s TYR 88 Ca -0.03 -0.10 0.01 0.00 -1.01 0.00 0.00 57.07 55.94 1ttn s TYR 88 Cb 0.03 -1.51 0.01 0.00 -0.11 0.00 0.00 41.96 40.37 1ttn s TYR 88 CO 0.27 0.41 -0.02 0.54 -1.11 0.00 0.00 175.55 175.64 1ttn s VAL 89 N -1.15 0.17 0.04 0.71 0.11 -1.26 -2.54 120.40 116.49 1ttn s VAL 89 Ca 0.20 -0.05 -0.03 0.00 -2.93 0.00 0.00 61.98 59.18 1ttn s VAL 89 Cb -0.11 -0.18 -0.04 0.00 -1.53 0.00 0.00 36.38 34.51 1ttn s VAL 89 CO 0.12 0.07 0.25 -0.69 -3.33 0.00 0.00 175.10 171.52 1ttn s VAL 90 N 0.22 5.34 0.21 2.04 1.01 0.42 -4.91 120.40 124.72 1ttn s VAL 90 Ca -0.02 -0.12 -0.11 0.00 0.00 0.00 0.00 61.98 61.73 1ttn s VAL 90 Cb -0.04 -3.59 -0.07 0.00 0.00 0.00 0.00 36.38 32.68 1ttn s VAL 90 CO -0.01 0.22 0.55 -1.58 0.00 0.00 0.00 175.10 174.29 1ttn s GLN 91 N -2.21 3.86 -0.01 2.72 -0.44 -0.52 -1.56 119.66 121.50 1ttn s GLN 91 Ca 0.32 0.35 -0.01 0.00 -2.50 0.00 0.00 55.36 53.53 1ttn s GLN 91 Cb -0.13 -2.73 0.00 0.00 -1.64 0.00 0.00 33.01 28.52 1ttn s GLN 91 CO 0.22 0.36 0.02 0.14 0.50 0.00 0.00 175.29 176.53 1ttn s VAL 92 N -1.71 0.00 -0.14 1.34 -7.23 -0.74 0.50 120.40 112.42 1ttn s VAL 92 Ca 0.45 -0.03 0.01 0.00 -1.81 0.00 0.00 61.98 60.60 1ttn s VAL 92 Cb -0.12 -0.04 0.02 0.00 0.56 0.00 0.00 36.38 36.79 1ttn s VAL 92 CO 0.20 -0.01 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.18 1ttn s ILE 93 N -0.03 1.72 -0.39 -0.62 1.01 -0.53 -1.73 121.20 120.62 1ttn s ILE 93 Ca -0.00 -0.75 0.02 0.00 0.00 0.00 0.00 60.65 59.92 1ttn s ILE 93 Cb -0.00 -1.57 0.11 0.00 0.01 0.00 0.00 42.46 41.01 1ttn s ILE 93 CO 0.00 0.48 0.15 0.54 0.00 0.00 0.00 174.94 176.11 1ttn s VAL 94 N 1.20 1.80 -0.23 2.92 0.11 -1.16 -2.14 120.40 122.90 1ttn s VAL 94 Ca -0.00 -2.38 0.10 0.00 -2.93 0.00 0.00 61.98 56.77 1ttn s VAL 94 Cb -0.14 -2.30 0.44 0.00 -1.53 0.00 0.00 36.38 32.85 1ttn s VAL 94 CO -0.07 -0.73 1.27 -1.20 -3.33 0.00 0.00 175.10 171.04 1ttn n SER 95 N 3.99 1.93 -4.03 3.54 7.64 -1.26 -4.89 113.62 120.54 1ttn n SER 95 Ca 0.04 -3.88 -0.33 0.00 1.01 0.00 0.00 58.87 55.70 1ttn n SER 95 Cb 0.38 -0.55 -0.09 0.00 -1.01 0.00 0.00 64.21 62.94 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 -3.25 2.80 0.15 1.43 -1.52 -1.26 -4.96 119.66 113.04 1ttn s GLN 96 Ca 0.40 -3.13 -0.25 0.00 -1.95 0.00 0.00 55.36 50.43 1ttn s GLN 96 Cb 0.38 -3.70 0.01 0.00 -0.22 0.00 0.00 33.01 29.47 1ttn s GLN 96 CO -0.05 -1.24 1.61 -1.35 -0.25 0.00 0.00 175.29 174.00 1ttn h PRO 97 N 6.01 -0.32 -0.37 2.91 0.11 -2.03 -3.34 132.00 134.97 1ttn h PRO 97 Ca 0.11 0.02 -0.23 0.00 0.11 0.00 0.00 66.00 66.01 1ttn h PRO 97 Cb 0.82 0.07 -0.34 0.00 0.11 0.00 0.00 31.00 31.66 1ttn h PRO 97 CO 0.77 -0.22 -0.93 1.33 -0.21 0.00 0.00 178.00 178.75 1ttn n VAL 98 N -5.41 0.95 -4.21 3.15 0.24 -1.26 -5.11 118.33 106.69 1ttn n VAL 98 Ca -0.02 -2.49 -0.13 0.00 -2.04 0.00 0.00 64.34 59.66 1ttn n VAL 98 Cb 0.32 1.19 -0.10 0.00 -1.47 0.00 0.00 33.84 33.79 1ttn n VAL 98 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ttn s GLN 99 N -2.84 1.31 0.00 7.34 -2.07 -1.26 -5.29 119.66 116.86 1ttn s GLN 99 Ca 0.23 -1.70 0.24 0.00 -1.82 0.00 0.00 55.36 52.32 1ttn s GLN 99 Cb 0.36 0.28 0.29 0.00 -1.09 0.00 0.00 33.01 32.86 1ttn s GLN 99 CO -0.05 -0.45 1.32 -1.71 -1.32 0.00 0.00 175.29 173.08