#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 -2.50 1.61 4.01 -1.26 -5.12 117.16 113.89 1ttn n TYR 22 Ca 0.00 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.71 1ttn n TYR 22 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.01 1ttn n TYR 22 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1ttn n GLU 23 N -2.85 -4.62 -4.32 -0.72 4.71 -1.26 -5.05 120.64 106.53 1ttn n GLU 23 Ca 0.00 3.42 -0.25 0.00 -0.01 0.00 0.00 57.16 60.31 1ttn n GLU 23 Cb 0.50 -4.63 -0.09 0.00 -1.01 0.00 0.00 31.44 26.22 1ttn n GLU 23 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1ttn s GLN 25 N -3.78 0.60 -0.04 0.00 -0.21 -1.26 -0.56 119.66 114.41 1ttn s GLN 25 Ca 0.37 1.29 0.06 0.00 0.02 0.00 0.00 55.36 57.10 1ttn s GLN 25 Cb 0.03 0.47 -0.01 0.00 1.00 0.00 0.00 33.01 34.50 1ttn s GLN 25 CO 0.20 -0.18 -0.24 -1.17 -2.12 0.00 0.00 175.29 171.78 1ttn s LEU 26 N 2.25 2.04 -0.09 2.90 0.20 -0.97 -2.27 118.68 122.75 1ttn s LEU 26 Ca -0.08 -0.47 -0.26 0.00 0.69 0.00 0.00 54.13 54.01 1ttn s LEU 26 Cb -0.09 -1.29 -0.03 0.00 -0.43 0.00 0.00 46.19 44.35 1ttn s LEU 26 CO -0.19 0.25 0.84 -0.13 -0.29 0.00 0.00 176.35 176.83 1ttn s ARG 27 N -0.26 4.42 -0.47 1.98 0.52 -1.02 -1.14 118.95 122.98 1ttn s ARG 27 Ca 0.00 1.10 -0.12 0.00 -0.52 0.00 0.00 55.73 56.19 1ttn s ARG 27 Cb -0.12 -3.50 0.10 0.00 0.52 0.00 0.00 34.95 31.95 1ttn s ARG 27 CO 0.02 -0.12 0.37 -0.51 0.02 0.00 0.00 175.30 175.08 1ttn s LEU 28 N 1.38 5.65 -0.63 2.53 2.01 -0.80 0.11 118.68 128.93 1ttn s LEU 28 Ca 0.42 -1.63 -0.22 0.00 0.01 0.00 0.00 54.13 52.71 1ttn s LEU 28 Cb -0.18 -2.09 0.07 0.00 0.01 0.00 0.00 46.19 43.99 1ttn s LEU 28 CO 0.19 -0.68 0.92 -0.60 1.01 0.00 0.00 176.35 177.19 1ttn s ARG 29 N 1.50 3.14 0.21 1.70 3.00 -0.80 -1.65 118.95 126.05 1ttn s ARG 29 Ca 0.04 -0.78 -0.28 0.00 -1.00 0.00 0.00 55.73 53.71 1ttn s ARG 29 Cb -0.26 -4.19 -0.09 0.00 0.00 0.00 0.00 34.95 30.41 1ttn s ARG 29 CO 0.03 -1.70 0.87 -0.51 0.00 0.00 0.00 175.30 173.98 1ttn s LEU 30 N 3.85 4.60 0.58 -0.88 2.01 0.23 -1.91 118.68 127.16 1ttn s LEU 30 Ca 0.22 1.80 0.28 0.00 0.01 0.00 0.00 54.13 56.45 1ttn s LEU 30 Cb -0.17 -3.51 1.53 0.00 0.01 0.00 0.00 46.19 44.06 1ttn s LEU 30 CO 0.11 0.16 1.99 0.77 1.01 0.00 0.00 176.35 180.40 1ttn h SER 31 N 4.14 0.00 0.20 2.29 4.64 -1.85 0.85 113.55 123.80 1ttn h SER 31 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1ttn h SER 31 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1ttn h SER 31 CO 0.67 0.00 -0.03 1.07 -0.87 0.00 0.00 176.83 177.67 1ttn n THR 32 N -3.87 0.00 -0.64 2.95 5.66 -1.26 -4.85 114.28 112.26 1ttn n THR 32 Ca 0.06 -0.05 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 1ttn n THR 32 Cb 0.52 -0.25 0.00 0.00 -1.55 0.00 0.00 70.33 69.05 1ttn n THR 32 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ttn n GLY 33 N 1.15 1.00 2.97 1.09 0.00 0.29 -5.06 105.19 106.62 1ttn n GLY 33 Ca 0.19 -0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.29 2.03 -0.46 1.61 2.47 -0.85 -4.88 119.74 118.36 1ttn s LYS 34 Ca 0.00 -2.60 -0.11 0.00 -1.56 0.00 0.00 55.97 51.70 1ttn s LYS 34 Cb 0.00 -3.36 0.10 0.00 -1.46 0.00 0.00 37.83 33.11 1ttn s LYS 34 CO 0.00 -1.11 0.35 0.16 0.16 0.00 0.00 175.35 174.91 1ttn s ASP 35 N -0.16 5.84 -0.05 1.43 -4.77 -1.20 0.77 116.67 118.53 1ttn s ASP 35 Ca 0.17 -1.62 -0.01 0.00 -3.30 0.00 0.00 52.55 47.79 1ttn s ASP 35 Cb -0.25 -2.07 0.03 0.00 -1.09 0.00 0.00 42.92 39.54 1ttn s ASP 35 CO -0.01 -0.65 0.01 -0.22 0.70 0.00 0.00 175.17 175.00 1ttn s LEU 36 N 1.48 0.71 -0.41 2.11 0.20 -0.66 -4.86 118.68 117.24 1ttn s LEU 36 Ca 0.04 -0.05 -0.27 0.00 0.69 0.00 0.00 54.13 54.54 1ttn s LEU 36 Cb -0.25 -0.35 0.02 0.00 -0.43 0.00 0.00 46.19 45.18 1ttn s LEU 36 CO 0.02 -0.17 1.02 -0.75 -0.29 0.00 0.00 176.35 176.18 1ttn s LYS 37 N 1.70 3.77 0.11 1.98 2.20 -1.26 -1.91 119.74 126.34 1ttn s LYS 37 Ca 0.00 0.57 -0.25 0.00 -0.36 0.00 0.00 55.97 55.93 1ttn s LYS 37 Cb -0.13 -3.85 -0.07 0.00 -1.51 0.00 0.00 37.83 32.27 1ttn s LYS 37 CO -0.04 -1.14 0.76 -1.17 -0.36 0.00 0.00 175.35 173.41 1ttn s LEU 38 N 3.87 4.53 0.07 5.43 2.96 -0.29 -4.78 118.68 130.47 1ttn s LEU 38 Ca 0.42 1.54 -0.31 0.00 -0.22 0.00 0.00 54.13 55.57 1ttn s LEU 38 Cb -0.10 -3.25 -0.06 0.00 0.50 0.00 0.00 46.19 43.28 1ttn s LEU 38 CO 0.24 0.13 1.30 0.54 -1.32 0.00 0.00 176.35 177.24 1ttn s VAL 39 N -0.69 3.72 0.17 1.68 0.11 -1.26 -2.28 120.40 121.85 1ttn s VAL 39 Ca 0.37 1.22 -0.05 0.00 -2.93 0.00 0.00 61.98 60.58 1ttn s VAL 39 Cb -0.22 -3.78 -0.03 0.00 -1.53 0.00 0.00 36.38 30.83 1ttn s VAL 39 CO 0.24 0.08 0.19 0.68 -3.33 0.00 0.00 175.10 172.97 1ttn s VAL 40 N 1.28 0.05 -0.30 2.04 -7.23 0.27 -4.96 120.40 111.55 1ttn s VAL 40 Ca 0.61 -1.73 0.02 0.00 -1.81 0.00 0.00 61.98 59.07 1ttn s VAL 40 Cb -0.32 -2.14 0.16 0.00 0.56 0.00 0.00 36.38 34.64 1ttn s VAL 40 CO 0.29 -0.23 0.40 -0.60 -0.31 0.00 0.00 175.10 174.65 1ttn s ARG 41 N -4.05 0.44 0.00 4.82 3.00 -1.26 0.12 118.95 122.01 1ttn s ARG 41 Ca 0.26 -0.03 0.00 0.00 -1.00 0.00 0.00 55.73 54.96 1ttn s ARG 41 Cb 0.05 -0.38 0.00 0.00 0.00 0.00 0.00 34.95 34.62 1ttn s ARG 41 CO 0.05 -1.06 0.00 0.43 0.00 0.00 0.00 175.30 174.72 1ttn n SER 42 N 5.19 0.00 0.25 -2.12 7.64 -1.26 -1.91 113.62 121.41 1ttn n SER 42 Ca 0.02 0.00 0.16 0.00 1.01 0.00 0.00 58.87 60.06 1ttn n SER 42 Cb 0.49 0.00 0.60 0.00 -1.01 0.00 0.00 64.21 64.28 1ttn n SER 42 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1ttn h THR 43 N 0.00 0.00 0.00 0.44 2.02 -1.99 -3.35 112.91 110.02 1ttn h THR 43 Ca 0.00 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 66.64 1ttn h THR 43 Cb 0.00 1.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1ttn h THR 43 CO 0.00 0.00 0.00 0.47 0.37 0.00 0.00 175.52 176.36 1ttn n ASP 44 N -2.97 0.00 -1.50 4.18 9.92 -0.80 -4.81 116.55 120.56 1ttn n ASP 44 Ca 0.01 0.27 0.14 0.00 -0.53 0.00 0.00 54.79 54.68 1ttn n ASP 44 Cb 0.33 -0.23 -0.08 0.00 -0.64 0.00 0.00 41.12 40.50 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 -1.20 -1.41 -0.18 -3.53 -2.24 -1.26 -1.80 114.28 102.66 1ttn n THR 45 Ca 0.00 1.08 0.15 0.00 -2.27 0.00 0.00 64.05 63.01 1ttn n THR 45 Cb 0.00 -1.68 0.25 0.00 -2.10 0.00 0.00 70.33 66.80 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 -3.99 -0.08 0.00 2.28 0.31 -1.26 0.55 118.33 116.14 1ttn n VAL 46 Ca -0.08 0.64 0.00 0.00 -0.01 0.00 0.00 64.34 64.89 1ttn n VAL 46 Cb 0.64 -1.04 0.00 0.00 -0.91 0.00 0.00 33.84 32.53 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 -3.30 0.00 -0.37 3.52 7.35 -1.25 0.14 117.46 123.54 1ttn n PHE 47 Ca 0.15 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.85 1ttn n PHE 47 Cb 0.58 -0.50 0.15 0.00 0.35 0.00 0.00 39.48 40.06 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 1.23 -0.79 -5.13 3.86 0.19 0.78 115.15 115.29 1ttn h HIS 48 Ca 0.00 0.03 0.19 0.00 -1.16 0.00 0.00 60.37 59.43 1ttn h HIS 48 Cb 0.00 -0.41 -0.13 0.00 1.06 0.00 0.00 27.41 27.93 1ttn h HIS 48 CO 0.19 0.69 0.09 1.98 0.86 0.00 0.00 177.93 181.73 1ttn h MET 49 N 1.25 0.14 -0.15 2.45 1.85 0.16 1.06 114.93 121.68 1ttn h MET 49 Ca 0.41 -0.01 -0.15 0.00 -0.61 0.00 0.00 59.70 59.34 1ttn h MET 49 Cb 0.05 -0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.04 1ttn h MET 49 CO -0.14 0.09 -0.55 -0.22 -0.40 0.00 0.00 176.91 175.69 1ttn h LYS 50 N 0.15 0.45 0.21 0.39 3.11 0.44 -0.14 116.57 121.18 1ttn h LYS 50 Ca 0.46 -0.29 -0.01 0.00 -2.81 0.00 0.00 60.65 58.00 1ttn h LYS 50 Cb 0.84 0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 32.10 1ttn h LYS 50 CO -0.65 0.89 -0.15 0.00 -2.81 0.00 0.00 179.45 176.72 1ttn h ARG 51 N 0.35 -0.33 0.00 1.90 2.47 0.72 -0.54 114.38 118.95 1ttn h ARG 51 Ca 0.01 0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.75 1ttn h ARG 51 Cb 1.07 0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 29.47 1ttn h ARG 51 CO 0.10 -0.22 -0.00 -0.09 0.56 0.00 0.00 179.97 180.31 1ttn h ARG 52 N -0.35 0.00 0.84 0.04 1.12 -0.08 -2.30 114.38 113.65 1ttn h ARG 52 Ca -0.03 0.00 -0.04 0.00 -1.11 0.00 0.00 59.98 58.80 1ttn h ARG 52 Cb 0.28 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 30.25 1ttn h ARG 52 CO 0.02 0.00 -0.40 -0.07 -3.11 0.00 0.00 179.97 176.40 1ttn h LEU 53 N 0.00 -0.96 -1.03 3.80 -0.00 -0.21 1.68 115.31 118.59 1ttn h LEU 53 Ca -0.00 0.03 0.22 0.00 -0.00 0.00 0.00 57.88 58.12 1ttn h LEU 53 Cb 0.01 0.25 -0.11 0.00 -0.00 0.00 0.00 40.66 40.80 1ttn h LEU 53 CO 0.00 -0.66 0.61 -0.74 -0.00 0.00 0.00 178.44 177.65 1ttn h HIS 54 N -1.18 1.03 0.00 1.13 2.76 -0.56 0.59 115.15 118.92 1ttn h HIS 54 Ca -0.12 0.03 -0.11 0.00 -2.20 0.00 0.00 60.37 57.98 1ttn h HIS 54 Cb 0.87 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 29.51 1ttn h HIS 54 CO -0.01 0.16 -0.52 0.00 -1.30 0.00 0.00 177.93 176.26 1ttn h ALA 55 N 1.68 0.80 0.02 5.26 0.00 -1.17 -1.92 119.26 123.93 1ttn h ALA 55 Ca 0.61 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ttn h ALA 55 Cb 1.05 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1ttn h ALA 55 CO -0.41 0.65 -0.01 0.00 0.00 0.00 0.00 179.25 179.48 1ttn h ALA 56 N 1.48 -0.07 0.05 0.00 0.00 0.76 -3.43 119.26 118.05 1ttn h ALA 56 Ca -0.01 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.62 1ttn h ALA 56 Cb 1.19 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1ttn h ALA 56 CO 0.07 -0.07 -1.54 -0.85 0.00 0.00 0.00 179.25 176.86 1ttn n GLU 57 N -2.76 0.64 0.00 0.00 0.28 0.57 -5.02 120.64 114.35 1ttn n GLU 57 Ca -0.00 0.46 0.00 0.00 -0.16 0.00 0.00 57.16 57.46 1ttn n GLU 57 Cb 0.01 -1.73 0.00 0.00 1.43 0.00 0.00 31.44 31.15 1ttn n GLU 57 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ttn n GLY 58 N 1.63 0.08 3.50 -1.84 0.00 -0.72 -5.04 105.19 102.81 1ttn n GLY 58 Ca -0.32 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 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 -0.67 4.59 0.81 1.61 1.01 -1.26 -4.88 120.40 121.62 1ttn s VAL 59 Ca 0.00 0.04 -0.11 0.00 0.00 0.00 0.00 61.98 61.92 1ttn s VAL 59 Cb 0.00 -4.42 0.08 0.00 0.00 0.00 0.00 36.38 32.04 1ttn s VAL 59 CO 0.00 -0.94 1.10 -1.83 0.00 0.00 0.00 175.10 173.42 1ttn s GLU 60 N 3.40 1.90 0.32 2.72 -1.05 -1.26 -3.21 118.70 121.52 1ttn s GLU 60 Ca 0.25 1.18 0.06 0.00 -0.15 0.00 0.00 54.97 56.31 1ttn s GLU 60 Cb -0.15 -1.86 0.90 0.00 -0.44 0.00 0.00 34.13 32.58 1ttn s GLU 60 CO 0.17 -1.89 1.58 -1.35 0.95 0.00 0.00 175.26 174.72 1ttn h PRO 61 N -1.31 0.02 0.00 -4.83 0.10 -1.84 1.70 132.00 125.84 1ttn h PRO 61 Ca -0.44 -0.00 -0.02 0.00 0.10 0.00 0.00 66.00 65.63 1ttn h PRO 61 Cb 1.24 -0.01 -0.00 0.00 0.10 0.00 0.00 31.00 32.34 1ttn h PRO 61 CO 0.50 0.02 -0.12 0.78 0.10 0.00 0.00 178.00 179.28 1ttn h GLY 62 N 0.02 0.00 0.00 -0.55 0.00 -1.99 -2.86 103.07 97.69 1ttn h GLY 62 Ca 0.66 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.65 1ttn h GLY 62 CO -0.86 0.00 -2.34 1.44 0.00 0.00 0.00 176.54 174.78 1ttn n SER 63 N -3.74 0.10 -4.44 0.19 7.64 0.41 -4.81 113.62 108.98 1ttn n SER 63 Ca -0.02 0.00 -0.44 0.00 1.01 0.00 0.00 58.87 59.42 1ttn n SER 63 Cb 0.23 1.05 -0.06 0.00 -1.01 0.00 0.00 64.21 64.42 1ttn n SER 63 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ttn s GLN 64 N -2.54 3.12 -0.38 1.43 1.03 0.48 -2.57 119.66 120.22 1ttn s GLN 64 Ca -0.10 -0.93 -0.11 0.00 0.04 0.00 0.00 55.36 54.26 1ttn s GLN 64 Cb 0.06 -4.12 0.04 0.00 0.03 0.00 0.00 33.01 29.02 1ttn s GLN 64 CO 0.82 -1.28 0.22 1.03 -2.54 0.00 0.00 175.29 173.53 1ttn s ARG 65 N 2.69 2.79 0.16 9.60 0.52 -0.61 -4.61 118.95 129.49 1ttn s ARG 65 Ca 0.15 -1.14 -0.31 0.00 -0.52 0.00 0.00 55.73 53.92 1ttn s ARG 65 Cb -0.20 -3.74 -0.08 0.00 0.52 0.00 0.00 34.95 31.45 1ttn s ARG 65 CO 0.11 -0.74 1.33 1.67 0.02 0.00 0.00 175.30 177.69 1ttn s TRP 66 N 1.54 3.26 -0.22 -0.53 -2.14 -1.26 -1.59 118.94 118.00 1ttn s TRP 66 Ca 0.02 1.13 -0.10 0.00 2.66 0.00 0.00 56.10 59.81 1ttn s TRP 66 Cb -0.20 -3.62 0.09 0.00 -3.10 0.00 0.00 33.47 26.64 1ttn s TRP 66 CO 0.06 -2.02 0.51 -0.06 -2.66 0.00 0.00 176.95 172.78 1ttn s PHE 67 N 0.52 -0.90 -0.04 1.66 0.08 0.34 -2.19 117.98 117.47 1ttn s PHE 67 Ca 0.60 1.73 0.02 0.00 0.12 0.00 0.00 56.93 59.39 1ttn s PHE 67 Cb -0.36 0.45 0.01 0.00 -0.57 0.00 0.00 43.02 42.55 1ttn s PHE 67 CO 0.35 -0.49 -0.08 0.12 -0.10 0.00 0.00 175.22 175.03 1ttn s PHE 68 N 2.13 0.90 0.00 0.36 5.36 0.65 0.20 117.98 127.57 1ttn s PHE 68 Ca -0.06 -0.25 0.00 0.00 -0.96 0.00 0.00 56.93 55.66 1ttn s PHE 68 Cb -0.10 -0.69 0.00 0.00 -0.34 0.00 0.00 43.02 41.89 1ttn s PHE 68 CO -0.15 -0.15 0.00 0.45 -1.46 0.00 0.00 175.22 173.91 1ttn n SER 69 N 3.60 -4.95 0.00 6.13 2.88 -1.26 -1.49 113.62 118.53 1ttn n SER 69 Ca -0.21 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.33 1ttn n SER 69 Cb 0.53 -3.03 0.00 0.00 -0.75 0.00 0.00 64.21 60.96 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 0.21 1.37 2.94 0.46 0.00 -1.26 -5.10 105.19 103.81 1ttn n GLY 70 Ca 0.00 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.69 0.15 -0.03 1.61 0.52 -0.56 -5.13 118.95 114.82 1ttn s ARG 71 Ca 0.00 -0.16 -0.30 0.00 -0.52 0.00 0.00 55.73 54.75 1ttn s ARG 71 Cb 0.00 0.06 -0.05 0.00 0.52 0.00 0.00 34.95 35.48 1ttn s ARG 71 CO 0.00 -0.03 1.48 -1.25 0.02 0.00 0.00 175.30 175.52 1ttn s PRO 72 N -0.48 4.24 0.94 3.54 0.04 -1.26 -0.25 135.00 141.77 1ttn s PRO 72 Ca -0.05 2.02 -0.12 0.00 0.04 0.00 0.00 61.00 62.89 1ttn s PRO 72 Cb -0.03 -3.72 0.16 0.00 0.04 0.00 0.00 34.50 30.94 1ttn s PRO 72 CO -0.00 -0.69 1.09 -0.51 0.04 0.00 0.00 177.00 176.93 1ttn s LEU 73 N 3.05 1.95 0.00 -3.56 2.01 -0.93 -4.92 118.68 116.28 1ttn s LEU 73 Ca 0.66 1.35 0.03 0.00 0.01 0.00 0.00 54.13 56.18 1ttn s LEU 73 Cb -0.31 -3.66 0.03 0.00 0.01 0.00 0.00 46.19 42.26 1ttn s LEU 73 CO 0.26 -2.87 0.25 0.35 1.01 0.00 0.00 176.35 175.35 1ttn n THR 74 N -4.02 0.00 -0.08 5.49 -2.24 -1.26 -4.91 114.28 107.26 1ttn n THR 74 Ca 0.06 -1.69 -0.07 0.00 -2.27 0.00 0.00 64.05 60.08 1ttn n THR 74 Cb 0.56 -0.04 0.13 0.00 -2.10 0.00 0.00 70.33 68.88 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 -1.75 3.39 -1.90 3.42 5.68 -1.26 -3.80 116.55 120.34 1ttn n ASP 75 Ca -0.04 -2.71 -0.03 0.00 -0.50 0.00 0.00 54.79 51.51 1ttn n ASP 75 Cb 0.48 -0.65 0.03 0.00 -1.14 0.00 0.00 41.12 39.84 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 -0.13 0.71 0.04 0.11 4.76 -1.26 -4.54 118.16 117.85 1ttn n LYS 76 Ca 0.25 -1.49 -0.15 0.00 -2.87 0.00 0.00 58.31 54.06 1ttn n LYS 76 Cb 0.98 0.17 -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 0.52 -1.37 0.00 0.00 177.40 176.55 1ttn h MET 77 N 0.80 0.18 0.76 1.97 2.86 -1.92 -3.23 114.93 116.35 1ttn h MET 77 Ca -0.43 -0.30 -0.03 0.00 -2.06 0.00 0.00 59.70 56.87 1ttn h MET 77 Cb 1.41 0.11 0.00 0.00 0.06 0.00 0.00 31.60 33.18 1ttn h MET 77 CO -0.15 0.98 -0.43 -0.22 1.06 0.00 0.00 176.91 178.16 1ttn h LYS 78 N 0.05 -1.05 0.00 1.72 1.63 -1.89 0.31 116.57 117.33 1ttn h LYS 78 Ca -0.25 0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.62 1ttn h LYS 78 Cb 1.99 0.24 0.00 0.00 -0.60 0.00 0.00 32.23 33.86 1ttn h LYS 78 CO 0.13 -0.70 0.00 0.34 -3.45 0.00 0.00 179.45 175.77 1ttn n PHE 79 N -5.14 0.00 -0.02 1.91 7.35 -1.26 -1.56 117.46 118.74 1ttn n PHE 79 Ca -0.13 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.47 1ttn n PHE 79 Cb 0.45 -0.48 -0.14 0.00 0.35 0.00 0.00 39.48 39.65 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 -1.48 0.64 -0.05 -4.13 2.13 -0.60 -4.58 120.64 112.57 1ttn n GLU 80 Ca 0.02 0.30 -0.04 0.00 0.66 0.00 0.00 57.16 58.10 1ttn n GLU 80 Cb 0.09 -1.79 -0.01 0.00 0.27 0.00 0.00 31.44 30.00 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 -3.06 0.33 0.00 5.31 4.07 -0.00 -4.95 120.64 122.34 1ttn n GLU 81 Ca -0.17 0.39 0.00 0.00 -0.06 0.00 0.00 57.16 57.32 1ttn n GLU 81 Cb 1.05 -1.37 0.00 0.00 -0.06 0.00 0.00 31.44 31.06 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 -3.92 0.00 -1.66 4.31 7.99 -0.60 -4.73 117.00 118.39 1ttn n LEU 82 Ca -0.06 0.00 0.02 0.00 -0.01 0.00 0.00 56.01 55.96 1ttn n LEU 82 Cb 0.22 -0.05 0.33 0.00 -0.11 0.00 0.00 43.42 43.81 1ttn n LEU 82 CO 0.09 0.00 0.89 0.29 -1.51 0.00 0.00 177.39 177.15 1ttn n LYS 83 N -1.80 3.86 0.03 3.23 4.76 -1.26 -4.41 118.16 122.57 1ttn n LYS 83 Ca 0.00 -3.07 -0.01 0.00 -2.87 0.00 0.00 58.31 52.36 1ttn n LYS 83 Cb 0.00 -2.13 -0.09 0.00 -1.84 0.00 0.00 35.03 30.97 1ttn n LYS 83 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 1ttn h ILE 84 N 2.85 0.56 -0.28 -0.18 2.04 -1.84 -3.35 117.51 117.30 1ttn h ILE 84 Ca 0.11 -2.09 -0.47 0.00 1.00 0.00 0.00 64.86 63.41 1ttn h ILE 84 Cb 1.97 2.10 -0.07 0.00 -0.74 0.00 0.00 36.82 40.07 1ttn h ILE 84 CO 0.51 0.32 1.72 -2.65 0.00 0.00 0.00 178.15 178.06 1ttn n PRO 85 N -2.92 0.19 -1.05 2.37 -0.02 -0.96 0.63 135.00 133.24 1ttn n PRO 85 Ca -0.10 -0.02 -0.02 0.00 -2.02 0.00 0.00 63.50 61.34 1ttn n PRO 85 Cb 0.86 -1.84 -0.01 0.00 -0.02 0.00 0.00 33.50 32.50 1ttn n PRO 85 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1ttn n LYS 86 N 8.28 -1.54 -0.03 -0.52 5.02 -1.21 -4.77 118.16 123.40 1ttn n LYS 86 Ca 0.61 0.47 -0.07 0.00 -2.02 0.00 0.00 58.31 57.29 1ttn n LYS 86 Cb 0.14 -4.66 -0.02 0.00 -0.02 0.00 0.00 35.03 30.47 1ttn n LYS 86 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1ttn n ASP 87 N -0.78 0.71 -4.85 4.39 -0.08 0.20 -5.07 116.55 111.07 1ttn n ASP 87 Ca -0.02 0.11 -0.24 0.00 -1.51 0.00 0.00 54.79 53.13 1ttn n ASP 87 Cb 0.41 -0.27 -0.04 0.00 2.34 0.00 0.00 41.12 43.55 1ttn n ASP 87 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1ttn s TYR 88 N -2.17 3.24 -0.04 -0.67 2.02 -0.46 -5.00 117.35 114.27 1ttn s TYR 88 Ca -0.10 -0.02 -0.01 0.00 -0.37 0.00 0.00 57.07 56.57 1ttn s TYR 88 Cb 0.04 -1.52 0.03 0.00 -0.40 0.00 0.00 41.96 40.11 1ttn s TYR 88 CO 0.14 0.51 0.03 0.54 -1.57 0.00 0.00 175.55 175.20 1ttn s VAL 89 N -1.88 0.07 -0.14 0.71 0.11 -1.26 -2.44 120.40 115.57 1ttn s VAL 89 Ca 0.32 0.26 -0.24 0.00 -2.93 0.00 0.00 61.98 59.40 1ttn s VAL 89 Cb -0.09 -0.26 -0.02 0.00 -1.53 0.00 0.00 36.38 34.47 1ttn s VAL 89 CO 0.25 0.18 0.74 -0.69 -3.33 0.00 0.00 175.10 172.25 1ttn s VAL 90 N 1.76 4.97 0.48 2.04 1.01 0.29 -4.85 120.40 126.10 1ttn s VAL 90 Ca 0.00 1.46 -0.21 0.00 0.00 0.00 0.00 61.98 63.24 1ttn s VAL 90 Cb -0.12 -4.06 -0.09 0.00 0.00 0.00 0.00 36.38 32.11 1ttn s VAL 90 CO -0.03 0.12 1.04 -1.58 0.00 0.00 0.00 175.10 174.65 1ttn s GLN 91 N 1.63 3.85 0.10 2.72 0.74 0.52 -1.91 119.66 127.32 1ttn s GLN 91 Ca 0.36 1.37 0.03 0.00 0.05 0.00 0.00 55.36 57.16 1ttn s GLN 91 Cb -0.17 -2.13 -0.04 0.00 1.10 0.00 0.00 33.01 31.77 1ttn s GLN 91 CO 0.14 -0.39 -0.08 0.14 -0.55 0.00 0.00 175.29 174.54 1ttn s VAL 92 N -1.96 0.85 -0.03 1.34 -7.23 -0.80 0.13 120.40 112.70 1ttn s VAL 92 Ca 0.66 -1.81 -0.01 0.00 -1.81 0.00 0.00 61.98 59.02 1ttn s VAL 92 Cb -0.17 -1.54 0.03 0.00 0.56 0.00 0.00 36.38 35.27 1ttn s VAL 92 CO 0.20 -0.72 0.04 -0.63 -0.31 0.00 0.00 175.10 173.68 1ttn s ILE 93 N -3.04 -0.05 -0.33 -0.62 1.01 -0.62 -3.11 121.20 114.44 1ttn s ILE 93 Ca 0.09 0.30 0.01 0.00 0.00 0.00 0.00 60.65 61.06 1ttn s ILE 93 Cb 0.01 -0.14 0.10 0.00 0.01 0.00 0.00 42.46 42.44 1ttn s ILE 93 CO -0.02 0.14 0.09 0.54 0.00 0.00 0.00 174.94 175.69 1ttn s VAL 94 N 1.60 1.50 -0.37 2.92 0.11 -1.06 -1.57 120.40 123.52 1ttn s VAL 94 Ca -0.02 -1.88 0.12 0.00 -2.93 0.00 0.00 61.98 57.27 1ttn s VAL 94 Cb -0.13 -2.12 0.44 0.00 -1.53 0.00 0.00 36.38 33.05 1ttn s VAL 94 CO -0.03 -0.66 1.03 -1.20 -3.33 0.00 0.00 175.10 170.91 1ttn n SER 95 N 4.50 2.96 0.14 3.54 7.64 -1.26 -4.87 113.62 126.27 1ttn n SER 95 Ca 0.01 -3.17 -0.01 0.00 1.01 0.00 0.00 58.87 56.71 1ttn n SER 95 Cb 0.41 -0.50 0.19 0.00 -1.01 0.00 0.00 64.21 63.31 1ttn n SER 95 CO 0.00 0.00 0.00 0.06 -3.01 0.00 0.00 175.04 172.09 1ttn h GLN 96 N 2.79 0.01 -0.31 1.43 3.07 -1.87 -2.32 115.11 117.91 1ttn h GLN 96 Ca 0.09 -0.01 0.09 0.00 0.09 0.00 0.00 58.65 58.91 1ttn h GLN 96 Cb 1.07 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.62 1ttn h GLN 96 CO 0.66 0.60 0.47 -1.35 0.09 0.00 0.00 178.83 179.29 1ttn h PRO 97 N 0.01 0.00 0.00 0.06 0.11 -1.94 -2.10 132.00 128.14 1ttn h PRO 97 Ca -0.01 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.03 1ttn h PRO 97 Cb 1.05 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1ttn h PRO 97 CO 0.08 0.00 -1.35 1.33 -0.21 0.00 0.00 178.00 177.84 1ttn n VAL 98 N -3.40 0.27 -3.18 3.15 0.24 -1.19 -5.05 118.33 109.16 1ttn n VAL 98 Ca 0.05 -0.21 -0.20 0.00 -2.04 0.00 0.00 64.34 61.94 1ttn n VAL 98 Cb 0.61 -0.48 0.03 0.00 -1.47 0.00 0.00 33.84 32.53 1ttn n VAL 98 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1ttn s GLN 99 N -2.22 2.43 0.00 7.34 -0.21 -0.79 -5.19 119.66 121.02 1ttn s GLN 99 Ca -0.03 -1.60 0.00 0.00 0.02 0.00 0.00 55.36 53.75 1ttn s GLN 99 Cb 0.02 -2.58 0.00 0.00 1.00 0.00 0.00 33.01 31.46 1ttn s GLN 99 CO 0.24 -0.65 0.00 0.09 -2.12 0.00 0.00 175.29 172.85