#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 -0.67 -0.01 1.61 9.36 -1.26 -5.03 117.16 121.15 1ttn n TYR 22 Ca 0.00 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 61.20 1ttn n TYR 22 Cb 0.00 0.36 -0.01 0.00 -0.63 0.00 0.00 39.34 39.07 1ttn n TYR 22 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 1ttn n GLU 23 N -2.22 0.10 -4.42 2.98 4.07 -1.26 -5.07 120.64 114.81 1ttn n GLU 23 Ca 0.00 0.04 -0.22 0.00 -0.06 0.00 0.00 57.16 56.92 1ttn n GLU 23 Cb 0.00 -0.61 -0.10 0.00 -0.06 0.00 0.00 31.44 30.67 1ttn n GLU 23 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1ttn s GLN 25 N -3.57 0.43 -0.01 0.00 -2.07 -1.26 -0.25 119.66 112.94 1ttn s GLN 25 Ca 0.27 0.72 0.06 0.00 -1.82 0.00 0.00 55.36 54.60 1ttn s GLN 25 Cb -0.03 0.10 -0.02 0.00 -1.09 0.00 0.00 33.01 31.97 1ttn s GLN 25 CO 0.12 -0.09 -0.20 -1.17 -1.32 0.00 0.00 175.29 172.63 1ttn s LEU 26 N 1.28 2.06 0.19 2.60 0.20 -0.87 -2.74 118.68 121.40 1ttn s LEU 26 Ca -0.08 -0.39 -0.27 0.00 0.69 0.00 0.00 54.13 54.08 1ttn s LEU 26 Cb -0.04 -1.04 -0.08 0.00 -0.43 0.00 0.00 46.19 44.60 1ttn s LEU 26 CO -0.15 0.24 0.83 -0.60 -0.29 0.00 0.00 176.35 176.38 1ttn s ARG 27 N -0.59 4.65 -0.28 1.98 3.52 -0.94 -1.03 118.95 126.27 1ttn s ARG 27 Ca 0.08 1.26 0.00 0.00 -0.13 0.00 0.00 55.73 56.94 1ttn s ARG 27 Cb -0.08 -3.26 0.06 0.00 -1.56 0.00 0.00 34.95 30.10 1ttn s ARG 27 CO -0.00 0.55 -0.05 -0.51 -0.81 0.00 0.00 175.30 174.48 1ttn s LEU 28 N -1.17 3.70 -0.66 -0.88 2.01 -0.63 0.26 118.68 121.31 1ttn s LEU 28 Ca 0.37 -1.34 -0.22 0.00 0.01 0.00 0.00 54.13 52.96 1ttn s LEU 28 Cb -0.24 -1.64 0.08 0.00 0.01 0.00 0.00 46.19 44.40 1ttn s LEU 28 CO 0.28 -0.23 0.93 -0.60 1.01 0.00 0.00 176.35 177.74 1ttn s ARG 29 N 1.18 3.13 0.27 1.70 3.52 -0.86 -1.63 118.95 126.26 1ttn s ARG 29 Ca -0.07 -0.97 -0.21 0.00 -0.13 0.00 0.00 55.73 54.36 1ttn s ARG 29 Cb -0.20 -4.28 -0.09 0.00 -1.56 0.00 0.00 34.95 28.83 1ttn s ARG 29 CO -0.03 -1.77 0.79 -0.51 -0.81 0.00 0.00 175.30 172.97 1ttn s LEU 30 N 3.77 4.28 0.63 -0.88 2.01 0.15 -2.20 118.68 126.44 1ttn s LEU 30 Ca 0.21 1.52 0.26 0.00 0.01 0.00 0.00 54.13 56.13 1ttn s LEU 30 Cb -0.17 -3.82 1.38 0.00 0.01 0.00 0.00 46.19 43.59 1ttn s LEU 30 CO 0.08 -0.05 1.79 0.77 1.01 0.00 0.00 176.35 179.95 1ttn h SER 31 N 3.09 0.00 -0.40 2.29 4.64 -1.88 0.91 113.55 122.20 1ttn h SER 31 Ca -0.48 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.82 1ttn h SER 31 Cb 1.19 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 1ttn h SER 31 CO 0.65 0.00 0.03 0.35 -0.87 0.00 0.00 176.83 176.99 1ttn n THR 32 N -3.18 1.88 -2.91 2.95 -2.24 -1.26 -4.84 114.28 104.68 1ttn n THR 32 Ca 0.03 -0.95 -0.12 0.00 -2.27 0.00 0.00 64.05 60.74 1ttn n THR 32 Cb 0.61 -0.38 0.03 0.00 -2.10 0.00 0.00 70.33 68.49 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 0.33 0.13 3.13 3.38 0.00 0.31 -4.98 105.19 107.50 1ttn n GLY 33 Ca 0.20 -0.24 -0.38 0.00 0.00 0.00 0.00 46.02 45.60 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 -5.47 2.89 -0.56 1.61 2.36 -0.78 -4.85 119.74 114.94 1ttn s LYS 34 Ca 0.25 -2.69 -0.15 0.00 -2.55 0.00 0.00 55.97 50.83 1ttn s LYS 34 Cb -0.11 -3.89 0.14 0.00 -1.05 0.00 0.00 37.83 32.92 1ttn s LYS 34 CO 0.31 -1.21 0.50 0.16 1.55 0.00 0.00 175.35 176.66 1ttn s ASP 35 N 0.73 6.17 -0.10 1.43 -4.77 -1.16 0.35 116.67 119.32 1ttn s ASP 35 Ca 0.19 -1.89 0.00 0.00 -3.30 0.00 0.00 52.55 47.56 1ttn s ASP 35 Cb -0.16 -2.18 0.02 0.00 -1.09 0.00 0.00 42.92 39.51 1ttn s ASP 35 CO -0.06 -0.81 -0.09 -0.22 0.70 0.00 0.00 175.17 174.69 1ttn s LEU 36 N 1.44 1.34 -0.65 2.11 2.96 -0.65 -4.82 118.68 120.43 1ttn s LEU 36 Ca 0.05 -0.30 -0.26 0.00 -0.22 0.00 0.00 54.13 53.40 1ttn s LEU 36 Cb -0.28 -0.83 0.04 0.00 0.50 0.00 0.00 46.19 45.62 1ttn s LEU 36 CO 0.02 -0.07 1.13 -0.75 -1.32 0.00 0.00 176.35 175.36 1ttn s LYS 37 N 1.35 3.29 0.21 1.98 2.20 -1.26 -1.60 119.74 125.90 1ttn s LYS 37 Ca -0.02 -0.23 -0.29 0.00 -0.36 0.00 0.00 55.97 55.07 1ttn s LYS 37 Cb -0.14 -4.12 -0.08 0.00 -1.51 0.00 0.00 37.83 31.98 1ttn s LYS 37 CO -0.04 -1.84 0.91 -1.17 -0.36 0.00 0.00 175.35 172.86 1ttn s LEU 38 N 4.88 4.62 0.39 5.43 2.96 -0.19 -4.75 118.68 132.01 1ttn s LEU 38 Ca 0.34 1.88 -0.26 0.00 -0.22 0.00 0.00 54.13 55.87 1ttn s LEU 38 Cb -0.10 -3.55 -0.09 0.00 0.50 0.00 0.00 46.19 42.95 1ttn s LEU 38 CO 0.18 0.14 1.18 0.54 -1.32 0.00 0.00 176.35 177.07 1ttn s VAL 39 N -1.02 3.12 0.22 1.68 0.11 -1.26 -2.05 120.40 121.20 1ttn s VAL 39 Ca 0.41 0.97 -0.12 0.00 -2.93 0.00 0.00 61.98 60.30 1ttn s VAL 39 Cb -0.25 -3.56 -0.00 0.00 -1.53 0.00 0.00 36.38 31.04 1ttn s VAL 39 CO 0.31 0.11 0.43 0.68 -3.33 0.00 0.00 175.10 173.30 1ttn s VAL 40 N -1.37 0.02 -0.33 2.04 -7.23 0.66 -4.91 120.40 109.27 1ttn s VAL 40 Ca 0.55 -1.33 0.05 0.00 -1.81 0.00 0.00 61.98 59.44 1ttn s VAL 40 Cb -0.32 -2.04 0.17 0.00 0.56 0.00 0.00 36.38 34.75 1ttn s VAL 40 CO 0.40 -0.08 0.50 -0.60 -0.31 0.00 0.00 175.10 175.01 1ttn s ARG 41 N -3.99 0.59 0.00 4.82 3.00 -1.26 -1.15 118.95 120.96 1ttn s ARG 41 Ca 0.20 -0.06 0.00 0.00 -1.00 0.00 0.00 55.73 54.87 1ttn s ARG 41 Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 34.95 34.80 1ttn s ARG 41 CO 0.05 -1.11 0.00 0.45 0.00 0.00 0.00 175.30 174.70 1ttn n SER 42 N 4.93 0.00 0.12 -2.12 2.88 -1.26 -1.91 113.62 116.26 1ttn n SER 42 Ca 0.06 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.73 1ttn n SER 42 Cb 0.51 0.00 0.42 0.00 -0.75 0.00 0.00 64.21 64.40 1ttn n SER 42 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ttn h THR 43 N 0.00 0.00 0.00 2.46 1.03 -2.00 -3.37 112.91 111.04 1ttn h THR 43 Ca 0.00 -0.44 0.00 0.00 -0.01 0.00 0.00 66.41 65.96 1ttn h THR 43 Cb 0.00 1.37 0.00 0.00 -1.07 0.00 0.00 68.15 68.45 1ttn h THR 43 CO 0.00 0.00 0.00 0.47 -0.01 0.00 0.00 175.52 175.98 1ttn n ASP 44 N -2.32 0.00 -1.49 0.00 8.00 -0.80 -4.77 116.55 115.16 1ttn n ASP 44 Ca 0.04 0.21 0.12 0.00 0.71 0.00 0.00 54.79 55.87 1ttn n ASP 44 Cb 0.38 -0.11 -0.07 0.00 -0.02 0.00 0.00 41.12 41.31 1ttn n ASP 44 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1ttn n THR 45 N -0.82 -1.54 -0.19 -3.53 -2.24 -1.26 -1.68 114.28 103.01 1ttn n THR 45 Ca 0.00 1.10 0.16 0.00 -2.27 0.00 0.00 64.05 63.03 1ttn n THR 45 Cb 0.00 -1.72 0.25 0.00 -2.10 0.00 0.00 70.33 66.76 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 -3.81 -0.06 0.00 2.28 0.31 -1.26 0.50 118.33 116.29 1ttn n VAL 46 Ca -0.07 0.61 0.00 0.00 -0.01 0.00 0.00 64.34 64.87 1ttn n VAL 46 Cb 0.61 -1.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.55 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 -3.16 0.00 -0.35 3.52 -0.00 -1.25 0.19 117.46 116.41 1ttn n PHE 47 Ca 0.15 0.00 -0.02 0.00 -0.00 0.00 0.00 57.45 57.58 1ttn n PHE 47 Cb 0.60 -0.50 0.11 0.00 -0.00 0.00 0.00 39.48 39.69 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 1.16 -0.94 -5.13 3.86 0.37 0.96 115.15 115.42 1ttn h HIS 48 Ca 0.00 0.03 0.24 0.00 -1.16 0.00 0.00 60.37 59.48 1ttn h HIS 48 Cb 0.00 -0.39 -0.13 0.00 1.06 0.00 0.00 27.41 27.95 1ttn h HIS 48 CO 0.20 0.70 0.47 1.98 0.86 0.00 0.00 177.93 182.14 1ttn h MET 49 N 1.23 0.44 -0.05 2.45 4.05 0.10 1.07 114.93 124.22 1ttn h MET 49 Ca 0.36 -0.03 -0.19 0.00 -0.28 0.00 0.00 59.70 59.56 1ttn h MET 49 Cb -0.08 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.62 1ttn h MET 49 CO -0.10 0.29 -0.77 -0.22 0.23 0.00 0.00 176.91 176.35 1ttn h LYS 50 N 0.45 0.33 -0.02 0.39 3.11 0.61 0.89 116.57 122.33 1ttn h LYS 50 Ca 0.60 -0.29 0.03 0.00 -2.81 0.00 0.00 60.65 58.19 1ttn h LYS 50 Cb 1.17 0.07 -0.05 0.00 -1.00 0.00 0.00 32.23 32.42 1ttn h LYS 50 CO -0.52 0.95 -0.25 -0.09 -2.81 0.00 0.00 179.45 176.73 1ttn h ARG 51 N 0.21 -0.36 0.00 1.90 9.65 0.83 -0.26 114.38 126.36 1ttn h ARG 51 Ca -0.04 0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1ttn h ARG 51 Cb 1.35 0.08 0.00 0.00 -1.39 0.00 0.00 29.97 30.01 1ttn h ARG 51 CO 0.13 -0.24 0.00 0.00 2.80 0.00 0.00 179.97 182.66 1ttn h ARG 52 N -0.37 0.00 -0.47 0.20 3.08 -0.74 -2.74 114.38 113.33 1ttn h ARG 52 Ca 0.07 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 1ttn h ARG 52 Cb 0.46 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 1ttn h ARG 52 CO -0.23 0.00 0.25 1.25 -1.07 0.00 0.00 179.97 180.17 1ttn h LEU 53 N 0.00 0.57 0.14 3.04 5.85 0.92 0.36 115.31 126.19 1ttn h LEU 53 Ca 0.00 -0.04 -0.27 0.00 0.84 0.00 0.00 57.88 58.41 1ttn h LEU 53 Cb 0.78 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 41.67 1ttn h LEU 53 CO 0.00 0.47 -1.34 1.12 -0.34 0.00 0.00 178.44 178.35 1ttn h HIS 54 N 0.65 0.54 -0.40 1.25 2.07 -1.21 -1.92 115.15 116.13 1ttn h HIS 54 Ca 0.17 -0.39 0.04 0.00 -2.85 0.00 0.00 60.37 57.33 1ttn h HIS 54 Cb 0.03 -0.02 -0.04 0.00 2.57 0.00 0.00 27.41 29.95 1ttn h HIS 54 CO 0.00 1.52 0.17 0.00 -3.07 0.00 0.00 177.93 176.56 1ttn h ALA 55 N 0.01 0.48 0.15 6.11 0.00 -1.18 0.80 119.26 125.64 1ttn h ALA 55 Ca -0.27 0.03 -0.25 0.00 0.00 0.00 0.00 54.91 54.42 1ttn h ALA 55 Cb 1.81 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.60 1ttn h ALA 55 CO 0.11 -0.20 -1.18 0.00 0.00 0.00 0.00 179.25 177.98 1ttn h ALA 56 N 1.23 0.01 0.00 0.00 0.00 -0.44 -3.42 119.26 116.65 1ttn h ALA 56 Ca 0.18 -0.89 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1ttn h ALA 56 Cb 0.12 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1ttn h ALA 56 CO -0.15 0.62 -0.46 0.93 0.00 0.00 0.00 179.25 180.19 1ttn h GLU 57 N -0.25 0.00 0.00 0.00 4.39 -1.34 -3.50 114.58 113.88 1ttn h GLU 57 Ca -0.23 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.47 1ttn h GLU 57 Cb 1.78 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.43 1ttn h GLU 57 CO 0.13 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.39 1ttn n GLY 58 N 1.63 -0.65 3.46 -3.84 0.00 0.28 -4.98 105.19 101.08 1ttn n GLY 58 Ca -0.06 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.34 4.78 -0.27 1.61 1.01 -1.25 -4.76 120.40 121.18 1ttn s VAL 59 Ca 0.00 -1.87 -0.09 0.00 0.00 0.00 0.00 61.98 60.03 1ttn s VAL 59 Cb 0.00 -4.83 -0.14 0.00 0.00 0.00 0.00 36.38 31.41 1ttn s VAL 59 CO 0.00 -1.56 -0.31 1.21 0.00 0.00 0.00 175.10 174.43 1ttn n GLU 60 N 6.39 0.61 0.00 2.72 0.00 -1.26 -3.48 120.64 125.62 1ttn n GLU 60 Ca 0.28 0.22 0.00 0.00 0.00 0.00 0.00 57.16 57.67 1ttn n GLU 60 Cb 0.47 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.41 1ttn n GLU 60 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 1ttn n PRO 61 N -3.91 1.68 0.00 5.31 -0.02 -1.26 -4.74 135.00 132.05 1ttn n PRO 61 Ca -0.52 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.05 1ttn n PRO 61 Cb 0.92 0.00 0.54 0.00 -0.02 0.00 0.00 33.50 34.94 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 0.00 -0.59 0.00 -1.23 0.00 -1.26 -3.18 105.19 98.93 1ttn n GLY 62 Ca 0.00 -0.11 0.04 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.02 0.00 -4.54 1.61 7.64 -1.26 -4.38 113.62 111.68 1ttn n SER 63 Ca 0.13 0.42 -0.42 0.00 1.01 0.00 0.00 58.87 60.01 1ttn n SER 63 Cb 0.07 -0.45 -0.02 0.00 -1.01 0.00 0.00 64.21 62.80 1ttn n SER 63 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1ttn s GLN 64 N -2.89 3.77 -0.56 1.43 -0.21 -1.19 -3.30 119.66 116.70 1ttn s GLN 64 Ca 0.05 -1.66 -0.11 0.00 0.02 0.00 0.00 55.36 53.66 1ttn s GLN 64 Cb 0.06 -5.30 0.14 0.00 1.00 0.00 0.00 33.01 28.91 1ttn s GLN 64 CO 0.15 -2.10 0.46 1.03 -2.12 0.00 0.00 175.29 172.72 1ttn s ARG 65 N 3.97 2.80 0.03 2.91 0.52 -0.67 -4.96 118.95 123.54 1ttn s ARG 65 Ca 0.46 -1.94 -0.24 0.00 -0.52 0.00 0.00 55.73 53.49 1ttn s ARG 65 Cb 0.00 -4.08 -0.05 0.00 0.52 0.00 0.00 34.95 31.33 1ttn s ARG 65 CO -0.04 -1.24 0.73 -1.58 0.02 0.00 0.00 175.30 173.19 1ttn s TRP 66 N 1.09 3.72 -0.20 -0.53 0.51 -1.26 -0.79 118.94 121.47 1ttn s TRP 66 Ca 0.08 1.41 -0.09 0.00 -2.12 0.00 0.00 56.10 55.38 1ttn s TRP 66 Cb -0.24 -2.78 0.08 0.00 -0.81 0.00 0.00 33.47 29.72 1ttn s TRP 66 CO -0.01 0.27 0.45 -0.06 -0.51 0.00 0.00 176.95 177.09 1ttn s PHE 67 N -0.02 -0.77 -0.07 -1.98 0.40 0.44 -1.88 117.98 114.11 1ttn s PHE 67 Ca 0.37 1.52 0.03 0.00 -0.60 0.00 0.00 56.93 58.26 1ttn s PHE 67 Cb -0.20 0.35 0.00 0.00 0.51 0.00 0.00 43.02 43.68 1ttn s PHE 67 CO 0.22 -0.43 -0.17 0.12 0.70 0.00 0.00 175.22 175.65 1ttn s PHE 68 N 1.99 1.85 0.00 0.36 5.36 0.11 0.16 117.98 127.81 1ttn s PHE 68 Ca -0.06 -0.66 0.00 0.00 -0.96 0.00 0.00 56.93 55.24 1ttn s PHE 68 Cb -0.10 -1.28 0.00 0.00 -0.34 0.00 0.00 43.02 41.30 1ttn s PHE 68 CO -0.14 -0.28 0.00 0.45 -1.46 0.00 0.00 175.22 173.79 1ttn n SER 69 N 3.52 -3.21 0.00 6.13 2.88 -1.26 -1.68 113.62 120.00 1ttn n SER 69 Ca -0.20 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.34 1ttn n SER 69 Cb 0.52 -2.21 0.00 0.00 -0.75 0.00 0.00 64.21 61.77 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 -0.92 0.59 3.51 0.46 0.00 -1.26 -5.09 105.19 102.47 1ttn n GLY 70 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.77 1.87 -0.09 1.61 3.00 -0.68 -5.07 118.95 118.81 1ttn s ARG 71 Ca 0.00 -1.14 -0.30 0.00 0.00 0.00 0.00 55.73 54.29 1ttn s ARG 71 Cb 0.00 -2.16 -0.04 0.00 0.00 0.00 0.00 34.95 32.75 1ttn s ARG 71 CO 0.00 0.49 1.54 -1.25 0.00 0.00 0.00 175.30 176.07 1ttn s PRO 72 N -2.14 4.19 0.76 3.54 0.04 -1.26 0.05 135.00 140.18 1ttn s PRO 72 Ca 0.19 2.02 -0.11 0.00 0.04 0.00 0.00 61.00 63.14 1ttn s PRO 72 Cb -0.11 -3.92 0.05 0.00 0.04 0.00 0.00 34.50 30.56 1ttn s PRO 72 CO 0.11 -0.81 1.08 -0.51 0.04 0.00 0.00 177.00 176.91 1ttn s LEU 73 N 3.90 2.97 0.00 -3.56 1.43 -0.79 -4.89 118.68 117.74 1ttn s LEU 73 Ca 0.68 1.72 0.04 0.00 -1.03 0.00 0.00 54.13 55.54 1ttn s LEU 73 Cb -0.30 -4.44 0.04 0.00 0.03 0.00 0.00 46.19 41.53 1ttn s LEU 73 CO 0.25 -1.93 0.34 0.35 0.23 0.00 0.00 176.35 175.59 1ttn n THR 74 N -3.45 0.00 -0.10 5.49 -2.24 -1.26 -4.87 114.28 107.86 1ttn n THR 74 Ca 0.08 -0.97 -0.03 0.00 -2.27 0.00 0.00 64.05 60.87 1ttn n THR 74 Cb 0.53 -0.64 0.17 0.00 -2.10 0.00 0.00 70.33 68.29 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 -2.48 3.50 -2.26 3.42 5.75 -1.26 -3.93 116.55 119.29 1ttn n ASP 75 Ca 0.06 -2.65 -0.03 0.00 -0.01 0.00 0.00 54.79 52.16 1ttn n ASP 75 Cb 0.29 -0.64 0.07 0.00 -1.03 0.00 0.00 41.12 39.82 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 0.04 1.04 0.11 0.11 5.02 -1.26 -4.30 118.16 118.92 1ttn n LYS 76 Ca 0.22 -1.53 -0.21 0.00 -2.02 0.00 0.00 58.31 54.77 1ttn n LYS 76 Cb 0.92 0.13 -0.15 0.00 -0.02 0.00 0.00 35.03 35.91 1ttn n LYS 76 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 1ttn h MET 77 N 1.00 0.41 0.37 1.97 2.86 -1.91 -3.26 114.93 116.37 1ttn h MET 77 Ca -0.42 -0.69 -0.02 0.00 -2.06 0.00 0.00 59.70 56.51 1ttn h MET 77 Cb 1.35 0.26 -0.00 0.00 0.06 0.00 0.00 31.60 33.27 1ttn h MET 77 CO -0.14 1.32 -0.22 -0.22 1.06 0.00 0.00 176.91 178.71 1ttn h LYS 78 N 0.11 -0.52 0.00 1.72 3.11 -1.90 0.05 116.57 119.13 1ttn h LYS 78 Ca -0.23 0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.64 1ttn h LYS 78 Cb 2.09 0.12 0.00 0.00 -1.00 0.00 0.00 32.23 33.43 1ttn h LYS 78 CO 0.23 -0.35 0.14 0.35 -2.81 0.00 0.00 179.45 177.01 1ttn h PHE 79 N -0.54 0.00 0.00 1.91 3.57 -1.76 -0.17 116.94 119.94 1ttn h PHE 79 Ca -0.05 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.33 1ttn h PHE 79 Cb 0.43 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 1ttn h PHE 79 CO 0.04 0.00 -1.34 0.39 -2.23 0.00 0.00 178.31 175.17 1ttn n GLU 80 N -2.25 0.62 -0.08 1.11 1.02 -0.62 -4.48 120.64 115.96 1ttn n GLU 80 Ca -0.01 0.19 -0.07 0.00 -0.02 0.00 0.00 57.16 57.25 1ttn n GLU 80 Cb 0.18 -1.80 -0.03 0.00 -0.02 0.00 0.00 31.44 29.77 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 -2.82 0.47 0.00 3.49 4.07 -0.09 -4.95 120.64 120.81 1ttn n GLU 81 Ca -0.07 0.48 0.00 0.00 -0.06 0.00 0.00 57.16 57.50 1ttn n GLU 81 Cb 0.77 -1.65 0.00 0.00 -0.06 0.00 0.00 31.44 30.49 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 -4.58 0.00 -0.99 4.31 7.99 -0.51 -4.68 117.00 118.54 1ttn n LEU 82 Ca -0.10 0.00 0.11 0.00 -0.01 0.00 0.00 56.01 56.01 1ttn n LEU 82 Cb 0.34 -0.09 0.15 0.00 -0.11 0.00 0.00 43.42 43.71 1ttn n LEU 82 CO 0.13 0.00 0.64 0.29 -1.51 0.00 0.00 177.39 176.94 1ttn n LYS 83 N -1.88 2.26 0.24 3.23 4.76 -1.26 -4.43 118.16 121.08 1ttn n LYS 83 Ca 0.00 -2.03 0.09 0.00 -2.87 0.00 0.00 58.31 53.50 1ttn n LYS 83 Cb 0.00 -1.46 0.59 0.00 -1.84 0.00 0.00 35.03 32.33 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 4.27 0.82 0.00 -0.18 -0.00 -1.85 -3.35 117.51 117.23 1ttn h ILE 84 Ca 0.00 -0.73 -0.35 0.00 -0.00 0.00 0.00 64.86 63.78 1ttn h ILE 84 Cb 0.94 1.43 0.02 0.00 -0.00 0.00 0.00 36.82 39.21 1ttn h ILE 84 CO 0.00 0.18 2.42 -2.65 -0.00 0.00 0.00 178.15 178.10 1ttn n PRO 85 N -3.86 1.82 0.00 0.16 -0.02 -1.11 -3.98 135.00 128.01 1ttn n PRO 85 Ca -0.02 -1.37 0.00 0.00 -2.02 0.00 0.00 63.50 60.09 1ttn n PRO 85 Cb 0.28 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 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 4.44 0.00 -0.02 -0.52 0.00 -1.26 -4.90 118.16 115.92 1ttn n LYS 86 Ca 0.40 0.00 -0.00 0.00 0.00 0.00 0.00 58.31 58.71 1ttn n LYS 86 Cb 0.13 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.11 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 -0.05 3.60 -4.50 3.14 2.03 -1.26 -4.99 116.55 114.52 1ttn n ASP 87 Ca 0.00 0.00 -0.50 0.00 0.52 0.00 0.00 54.79 54.81 1ttn n ASP 87 Cb 0.00 0.94 -0.04 0.00 -0.72 0.00 0.00 41.12 41.30 1ttn n ASP 87 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1ttn n TYR 88 N -1.98 0.50 -3.72 -0.67 4.02 -1.26 -4.82 117.16 109.24 1ttn n TYR 88 Ca -0.05 0.86 -0.15 0.00 -0.01 0.00 0.00 57.90 58.55 1ttn n TYR 88 Cb 0.44 -2.12 -0.15 0.00 -0.02 0.00 0.00 39.34 37.49 1ttn n TYR 88 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1ttn s VAL 89 N -0.61 -0.13 -0.04 -0.72 0.11 -1.26 -2.21 120.40 115.54 1ttn s VAL 89 Ca 0.70 0.25 -0.23 0.00 -2.93 0.00 0.00 61.98 59.78 1ttn s VAL 89 Cb -0.93 -0.25 -0.04 0.00 -1.53 0.00 0.00 36.38 33.62 1ttn s VAL 89 CO 0.56 0.11 0.70 -0.69 -3.33 0.00 0.00 175.10 172.44 1ttn s VAL 90 N 1.62 4.97 -0.12 2.04 1.01 0.14 -4.85 120.40 125.21 1ttn s VAL 90 Ca -0.04 1.45 -0.25 0.00 0.00 0.00 0.00 61.98 63.14 1ttn s VAL 90 Cb -0.12 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 1ttn s VAL 90 CO -0.06 0.30 0.78 -1.58 0.00 0.00 0.00 175.10 174.54 1ttn s GLN 91 N 0.50 4.36 0.38 2.72 -0.44 0.41 -2.03 119.66 125.55 1ttn s GLN 91 Ca 0.37 0.96 0.08 0.00 -2.50 0.00 0.00 55.36 54.27 1ttn s GLN 91 Cb -0.18 -3.52 -0.05 0.00 -1.64 0.00 0.00 33.01 27.62 1ttn s GLN 91 CO 0.19 -0.17 0.17 0.14 0.50 0.00 0.00 175.29 176.12 1ttn s VAL 92 N 1.58 2.65 -0.15 1.34 -7.23 -0.94 0.17 120.40 117.83 1ttn s VAL 92 Ca 0.38 -1.68 -0.07 0.00 -1.81 0.00 0.00 61.98 58.80 1ttn s VAL 92 Cb -0.17 -2.97 0.06 0.00 0.56 0.00 0.00 36.38 33.85 1ttn s VAL 92 CO 0.15 -0.09 0.34 -0.63 -0.31 0.00 0.00 175.10 174.56 1ttn s ILE 93 N -2.51 -0.15 -0.27 -0.62 1.01 0.03 -4.01 121.20 114.68 1ttn s ILE 93 Ca 0.40 0.14 -0.02 0.00 0.00 0.00 0.00 60.65 61.18 1ttn s ILE 93 Cb 0.00 -0.52 0.09 0.00 0.01 0.00 0.00 42.46 42.04 1ttn s ILE 93 CO 0.23 0.06 0.08 0.68 0.00 0.00 0.00 174.94 175.98 1ttn s VAL 94 N 1.62 0.67 -0.36 2.92 -7.23 -1.21 -1.67 120.40 115.14 1ttn s VAL 94 Ca -0.07 -1.05 0.14 0.00 -1.81 0.00 0.00 61.98 59.19 1ttn s VAL 94 Cb -0.10 -1.39 0.41 0.00 0.56 0.00 0.00 36.38 35.86 1ttn s VAL 94 CO -0.11 -0.51 1.01 -0.24 -0.31 0.00 0.00 175.10 174.94 1ttn n SER 95 N 4.95 0.24 -3.24 4.85 2.88 -1.26 -4.96 113.62 117.09 1ttn n SER 95 Ca -0.05 -2.80 -0.26 0.00 -1.33 0.00 0.00 58.87 54.43 1ttn n SER 95 Cb 0.44 0.01 -0.06 0.00 -0.75 0.00 0.00 64.21 63.85 1ttn n SER 95 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ttn n GLN 96 N -0.07 2.19 -0.05 -1.46 1.13 -1.26 -4.92 117.38 112.93 1ttn n GLN 96 Ca 0.09 -4.31 -0.13 0.00 -1.94 0.00 0.00 57.00 50.72 1ttn n GLN 96 Cb 0.78 -1.99 -0.07 0.00 0.11 0.00 0.00 30.24 29.07 1ttn n GLN 96 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1ttn h PRO 97 N 3.74 0.32 -1.03 -1.09 0.13 -2.02 -3.36 132.00 128.69 1ttn h PRO 97 Ca 0.15 -0.15 -0.43 0.00 -0.87 0.00 0.00 66.00 64.70 1ttn h PRO 97 Cb 0.70 -0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.41 1ttn h PRO 97 CO 0.73 0.67 -1.01 0.28 -0.23 0.00 0.00 178.00 178.43 1ttn n VAL 98 N -4.62 1.59 0.37 1.56 0.31 -1.26 -4.78 118.33 111.50 1ttn n VAL 98 Ca -0.06 -3.69 0.07 0.00 -0.01 0.00 0.00 64.34 60.65 1ttn n VAL 98 Cb 0.32 0.04 -0.09 0.00 -0.91 0.00 0.00 33.84 33.19 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 -0.33 1.50 0.00 5.55 -0.06 -1.26 -5.28 117.38 117.50 1ttn n GLN 99 Ca 0.21 -0.06 0.00 0.00 -2.00 0.00 0.00 57.00 55.15 1ttn n GLN 99 Cb 0.79 -1.25 0.00 0.00 -4.06 0.00 0.00 30.24 25.72 1ttn n GLN 99 CO 0.00 0.00 0.00 0.27 -0.20 0.00 0.00 177.06 177.13