#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ttn s TYR 22 N 0.00 3.57 0.00 1.61 2.02 -1.26 -4.88 117.35 118.41 1ttn s TYR 22 Ca 0.00 -1.79 0.00 0.00 -0.37 0.00 0.00 57.07 54.91 1ttn s TYR 22 Cb 0.00 -3.92 0.00 0.00 -0.40 0.00 0.00 41.96 37.64 1ttn s TYR 22 CO 0.00 -1.11 0.00 0.39 -1.57 0.00 0.00 175.55 173.26 1ttn n GLU 23 N 4.66 0.00 -3.79 -0.62 1.02 -1.26 -4.90 120.64 115.76 1ttn n GLU 23 Ca 0.13 0.09 -0.36 0.00 -0.02 0.00 0.00 57.16 57.00 1ttn n GLU 23 Cb 0.47 -0.42 -0.12 0.00 -0.02 0.00 0.00 31.44 31.35 1ttn n GLU 23 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ttn s GLN 25 N 1.20 2.43 -0.02 0.00 1.11 -1.24 0.14 119.66 123.29 1ttn s GLN 25 Ca 0.04 -1.61 -0.15 0.00 0.01 0.00 0.00 55.36 53.66 1ttn s GLN 25 Cb -0.22 -3.75 -0.05 0.00 -1.01 0.00 0.00 33.01 27.98 1ttn s GLN 25 CO -0.03 -1.03 0.40 -1.17 0.01 0.00 0.00 175.29 173.48 1ttn s LEU 26 N 1.34 4.44 0.04 2.90 0.20 -0.67 -2.23 118.68 124.71 1ttn s LEU 26 Ca 0.04 0.91 -0.20 0.00 0.69 0.00 0.00 54.13 55.58 1ttn s LEU 26 Cb -0.24 -2.57 -0.06 0.00 -0.43 0.00 0.00 46.19 42.89 1ttn s LEU 26 CO -0.00 0.29 0.58 -0.60 -0.29 0.00 0.00 176.35 176.33 1ttn s ARG 27 N -0.84 4.26 0.14 1.98 6.06 -0.94 -0.49 118.95 129.12 1ttn s ARG 27 Ca 0.23 0.75 0.08 0.00 -2.50 0.00 0.00 55.73 54.28 1ttn s ARG 27 Cb -0.16 -3.28 -0.04 0.00 0.06 0.00 0.00 34.95 31.53 1ttn s ARG 27 CO 0.12 0.53 -0.07 -0.51 -2.50 0.00 0.00 175.30 172.87 1ttn s LEU 28 N -0.74 3.11 -0.32 -0.88 2.01 -0.50 0.33 118.68 121.68 1ttn s LEU 28 Ca 0.30 -0.44 -0.02 0.00 0.01 0.00 0.00 54.13 53.98 1ttn s LEU 28 Cb -0.19 -1.83 0.12 0.00 0.01 0.00 0.00 46.19 44.30 1ttn s LEU 28 CO 0.18 0.13 0.17 -0.60 1.01 0.00 0.00 176.35 177.24 1ttn s ARG 29 N -2.58 0.40 0.39 1.70 3.52 -0.81 -1.40 118.95 120.17 1ttn s ARG 29 Ca 0.24 -0.94 -0.17 0.00 -0.13 0.00 0.00 55.73 54.73 1ttn s ARG 29 Cb -0.10 -1.29 -0.09 0.00 -1.56 0.00 0.00 34.95 31.90 1ttn s ARG 29 CO 0.16 -1.10 0.85 -0.51 -0.81 0.00 0.00 175.30 173.88 1ttn s LEU 30 N 1.59 3.95 0.66 -0.88 2.01 0.13 0.14 118.68 126.27 1ttn s LEU 30 Ca 0.13 1.45 0.43 0.00 0.01 0.00 0.00 54.13 56.15 1ttn s LEU 30 Cb -0.19 -4.29 2.34 0.00 0.01 0.00 0.00 46.19 44.05 1ttn s LEU 30 CO -0.19 -0.32 2.34 -1.28 1.01 0.00 0.00 176.35 177.91 1ttn h SER 31 N 1.90 0.00 -0.41 2.29 0.87 -1.32 0.20 113.55 117.08 1ttn h SER 31 Ca -0.48 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.06 1ttn h SER 31 Cb 1.18 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.13 1ttn h SER 31 CO 0.63 0.00 0.03 0.35 -0.53 0.00 0.00 176.83 177.31 1ttn n THR 32 N -3.15 1.95 -2.64 2.23 -2.24 -1.26 -4.84 114.28 104.32 1ttn n THR 32 Ca -0.03 -0.99 -0.09 0.00 -2.27 0.00 0.00 64.05 60.68 1ttn n THR 32 Cb 0.09 -0.36 0.02 0.00 -2.10 0.00 0.00 70.33 67.97 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 0.37 0.27 3.25 3.38 0.00 0.67 -4.97 105.19 108.16 1ttn n GLY 33 Ca 0.20 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 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 -5.10 3.61 -0.38 1.61 2.36 -0.93 -4.86 119.74 116.06 1ttn s LYS 34 Ca 0.14 -2.95 -0.12 0.00 -2.55 0.00 0.00 55.97 50.50 1ttn s LYS 34 Cb -0.06 -4.27 0.02 0.00 -1.05 0.00 0.00 37.83 32.47 1ttn s LYS 34 CO 0.18 -1.25 0.22 0.34 1.55 0.00 0.00 175.35 176.39 1ttn s ASP 35 N 1.10 5.80 -0.14 1.43 2.15 -1.25 0.19 116.67 125.96 1ttn s ASP 35 Ca 0.25 -0.92 -0.06 0.00 0.43 0.00 0.00 52.55 52.24 1ttn s ASP 35 Cb -0.11 -2.05 0.06 0.00 -0.30 0.00 0.00 42.92 40.52 1ttn s ASP 35 CO -0.09 -0.38 0.31 -0.22 -0.17 0.00 0.00 175.17 174.62 1ttn s LEU 36 N 1.59 0.00 -0.60 -1.34 0.20 -0.49 -4.90 118.68 113.14 1ttn s LEU 36 Ca 0.03 0.68 -0.25 0.00 0.69 0.00 0.00 54.13 55.28 1ttn s LEU 36 Cb -0.19 0.95 0.04 0.00 -0.43 0.00 0.00 46.19 46.56 1ttn s LEU 36 CO 0.07 -0.20 1.04 -0.75 -0.29 0.00 0.00 176.35 176.23 1ttn s LYS 37 N 1.71 3.30 0.20 1.98 2.20 -1.26 -1.41 119.74 126.47 1ttn s LYS 37 Ca -0.06 -0.28 -0.19 0.00 -0.36 0.00 0.00 55.97 55.08 1ttn s LYS 37 Cb -0.10 -4.10 -0.08 0.00 -1.51 0.00 0.00 37.83 32.04 1ttn s LYS 37 CO -0.10 -1.68 0.69 -1.17 -0.36 0.00 0.00 175.35 172.72 1ttn s LEU 38 N 4.42 4.36 0.32 5.43 2.96 0.35 -4.78 118.68 131.74 1ttn s LEU 38 Ca 0.32 1.35 -0.28 0.00 -0.22 0.00 0.00 54.13 55.31 1ttn s LEU 38 Cb -0.12 -3.48 -0.09 0.00 0.50 0.00 0.00 46.19 43.00 1ttn s LEU 38 CO 0.18 0.06 1.09 0.54 -1.32 0.00 0.00 176.35 176.90 1ttn s VAL 39 N -1.48 3.54 0.22 1.68 0.11 -1.26 -1.67 120.40 121.54 1ttn s VAL 39 Ca 0.41 1.43 -0.17 0.00 -2.93 0.00 0.00 61.98 60.72 1ttn s VAL 39 Cb -0.17 -3.86 0.02 0.00 -1.53 0.00 0.00 36.38 30.85 1ttn s VAL 39 CO 0.21 0.25 0.54 0.68 -3.33 0.00 0.00 175.10 173.44 1ttn s VAL 40 N -1.32 0.02 -0.28 2.04 -7.23 0.38 -4.90 120.40 109.10 1ttn s VAL 40 Ca 0.49 -0.94 0.02 0.00 -1.81 0.00 0.00 61.98 59.74 1ttn s VAL 40 Cb -0.29 -1.77 0.17 0.00 0.56 0.00 0.00 36.38 35.05 1ttn s VAL 40 CO 0.37 -0.08 0.48 -0.60 -0.31 0.00 0.00 175.10 174.96 1ttn s ARG 41 N -3.91 0.46 0.00 4.82 3.00 -1.26 -1.33 118.95 120.74 1ttn s ARG 41 Ca 0.12 0.43 0.00 0.00 -1.00 0.00 0.00 55.73 55.28 1ttn s ARG 41 Cb -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 34.95 34.87 1ttn s ARG 41 CO 0.01 -0.92 0.00 -1.13 0.00 0.00 0.00 175.30 173.26 1ttn n SER 42 N 5.38 0.00 0.01 -2.12 3.41 -1.26 -1.83 113.62 117.21 1ttn n SER 42 Ca 0.01 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.74 1ttn n SER 42 Cb 0.51 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.71 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 0.04 -1.33 6.66 -2.24 -1.26 -3.78 114.28 112.36 1ttn n THR 43 Ca 0.00 -0.03 -0.31 0.00 -2.27 0.00 0.00 64.05 61.44 1ttn n THR 43 Cb 0.00 0.19 0.06 0.00 -2.10 0.00 0.00 70.33 68.48 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 -1.57 7.36 -4.10 3.42 8.00 -0.76 -4.68 116.55 124.22 1ttn n ASP 44 Ca 0.05 -3.61 -0.29 0.00 0.71 0.00 0.00 54.79 51.66 1ttn n ASP 44 Cb 0.35 -1.02 0.26 0.00 -0.02 0.00 0.00 41.12 40.68 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 -0.49 0.00 -0.34 -3.53 -2.24 -1.26 -2.77 114.28 103.65 1ttn n THR 45 Ca 0.54 -0.34 0.26 0.00 -2.27 0.00 0.00 64.05 62.24 1ttn n THR 45 Cb 0.58 -0.92 0.40 0.00 -2.10 0.00 0.00 70.33 68.28 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 -5.16 -0.01 0.23 2.28 0.31 -1.26 0.61 118.33 115.33 1ttn n VAL 46 Ca 0.05 0.73 -0.09 0.00 -0.01 0.00 0.00 64.34 65.02 1ttn n VAL 46 Cb 0.56 -1.22 -0.04 0.00 -0.91 0.00 0.00 33.84 32.22 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 -0.56 -0.76 3.52 3.04 -1.76 1.81 116.94 122.23 1ttn h PHE 47 Ca 0.46 -0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.35 1ttn h PHE 47 Cb 1.83 0.18 -0.03 0.00 2.56 0.00 0.00 35.95 40.49 1ttn h PHE 47 CO -0.00 -0.35 0.31 0.45 -2.02 0.00 0.00 178.31 176.70 1ttn h HIS 48 N -0.82 1.16 -1.01 0.41 3.86 -0.13 0.87 115.15 119.50 1ttn h HIS 48 Ca -0.06 -0.09 0.23 0.00 -1.16 0.00 0.00 60.37 59.29 1ttn h HIS 48 Cb 0.46 -0.35 -0.11 0.00 1.06 0.00 0.00 27.41 28.47 1ttn h HIS 48 CO 0.05 0.88 0.62 1.98 0.86 0.00 0.00 177.93 182.32 1ttn h MET 49 N 1.10 0.60 -0.25 2.45 4.05 0.36 0.97 114.93 124.20 1ttn h MET 49 Ca 0.25 -0.04 -0.17 0.00 -0.28 0.00 0.00 59.70 59.46 1ttn h MET 49 Cb 0.21 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 30.87 1ttn h MET 49 CO -0.02 0.39 -0.54 -0.22 0.23 0.00 0.00 176.91 176.76 1ttn h LYS 50 N 0.61 0.75 0.09 0.39 3.64 0.57 0.31 116.57 122.94 1ttn h LYS 50 Ca 0.60 -0.47 0.02 0.00 -1.27 0.00 0.00 60.65 59.53 1ttn h LYS 50 Cb 1.14 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.98 1ttn h LYS 50 CO -0.39 1.09 -0.23 0.00 -2.27 0.00 0.00 179.45 177.65 1ttn h ARG 51 N 0.58 -0.40 0.00 1.90 2.47 0.77 -1.19 114.38 118.51 1ttn h ARG 51 Ca 0.02 0.03 -0.06 0.00 -1.26 0.00 0.00 59.98 58.70 1ttn h ARG 51 Cb 1.12 0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 29.52 1ttn h ARG 51 CO 0.11 -0.26 -0.27 0.00 0.56 0.00 0.00 179.97 180.11 1ttn h ARG 52 N -0.41 0.00 -0.07 0.04 -0.00 -0.50 -2.69 114.38 110.75 1ttn h ARG 52 Ca 0.03 0.00 -0.00 0.00 -0.50 0.00 0.00 59.98 59.51 1ttn h ARG 52 Cb 0.44 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 30.41 1ttn h ARG 52 CO -0.14 0.27 0.03 -0.07 0.00 0.00 0.00 179.97 180.07 1ttn h LEU 53 N 0.00 0.09 -0.43 3.04 -0.00 0.16 0.84 115.31 119.01 1ttn h LEU 53 Ca -0.00 -0.11 -0.05 0.00 -0.00 0.00 0.00 57.88 57.72 1ttn h LEU 53 Cb 1.13 -0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 41.76 1ttn h LEU 53 CO 0.04 0.17 0.07 1.12 -0.00 0.00 0.00 178.44 179.84 1ttn h HIS 54 N 0.00 0.76 -0.43 1.13 2.07 -1.03 -1.41 115.15 116.24 1ttn h HIS 54 Ca 0.02 -0.10 -0.01 0.00 -2.85 0.00 0.00 60.37 57.43 1ttn h HIS 54 Cb 0.10 -0.21 -0.02 0.00 2.57 0.00 0.00 27.41 29.85 1ttn h HIS 54 CO -0.04 0.73 0.21 0.00 -3.07 0.00 0.00 177.93 175.76 1ttn h ALA 55 N 0.94 1.56 0.23 6.11 0.00 -1.20 0.60 119.26 127.50 1ttn h ALA 55 Ca 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1ttn h ALA 55 Cb 0.37 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ttn h ALA 55 CO 0.01 0.36 -0.11 0.00 0.00 0.00 0.00 179.25 179.51 1ttn h ALA 56 N 1.63 -0.48 0.00 0.00 0.00 0.11 -3.42 119.26 117.10 1ttn h ALA 56 Ca 0.15 -0.07 -0.22 0.00 0.00 0.00 0.00 54.91 54.78 1ttn h ALA 56 Cb 0.06 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1ttn h ALA 56 CO -0.02 -0.46 -1.22 -0.85 0.00 0.00 0.00 179.25 176.71 1ttn n GLU 57 N -3.77 0.55 0.00 0.00 0.28 -0.56 -5.02 120.64 112.12 1ttn n GLU 57 Ca -0.04 0.57 0.00 0.00 -0.16 0.00 0.00 57.16 57.53 1ttn n GLU 57 Cb 0.12 -1.74 0.00 0.00 1.43 0.00 0.00 31.44 31.25 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 1.45 -0.83 3.46 -1.84 0.00 0.21 -5.04 105.19 102.60 1ttn n GLY 58 Ca -0.30 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.12 4.47 -0.11 1.61 1.01 -1.24 -4.87 120.40 121.16 1ttn s VAL 59 Ca 0.00 -0.25 -0.12 0.00 0.00 0.00 0.00 61.98 61.61 1ttn s VAL 59 Cb 0.00 -4.57 -0.05 0.00 0.00 0.00 0.00 36.38 31.77 1ttn s VAL 59 CO 0.00 -1.23 -0.24 1.21 0.00 0.00 0.00 175.10 174.84 1ttn n GLU 60 N 7.28 0.37 0.00 2.72 0.00 -1.26 -2.71 120.64 127.04 1ttn n GLU 60 Ca -0.03 0.15 0.00 0.00 0.00 0.00 0.00 57.16 57.28 1ttn n GLU 60 Cb 0.46 -1.15 0.00 0.00 0.00 0.00 0.00 31.44 30.75 1ttn n GLU 60 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 1ttn n PRO 61 N -4.13 1.05 0.00 5.31 -0.04 -1.26 -4.60 135.00 131.32 1ttn n PRO 61 Ca -0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 1ttn n PRO 61 Cb 0.41 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.87 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 -0.32 0.25 0.55 0.00 -1.26 -2.37 105.19 102.04 1ttn n GLY 62 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1ttn n GLY 62 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ttn h SER 63 N 0.00 0.00 -2.00 1.61 0.02 -1.86 -3.19 113.55 108.13 1ttn h SER 63 Ca 0.00 0.00 -0.78 0.00 -0.84 0.00 0.00 61.79 60.17 1ttn h SER 63 Cb 0.14 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 62.47 1ttn h SER 63 CO 0.00 0.00 1.52 0.00 -1.14 0.00 0.00 176.83 177.21 1ttn n GLN 64 N -2.53 3.98 -2.82 3.45 6.02 -1.00 -2.50 117.38 121.97 1ttn n GLN 64 Ca -0.02 -3.95 -0.43 0.00 -0.01 0.00 0.00 57.00 52.60 1ttn n GLN 64 Cb 0.25 -2.75 -0.03 0.00 1.02 0.00 0.00 30.24 28.73 1ttn n GLN 64 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1ttn s ARG 65 N -0.93 3.40 0.37 -1.09 3.52 -0.95 -4.87 118.95 118.40 1ttn s ARG 65 Ca 0.36 -1.24 -0.26 0.00 -0.13 0.00 0.00 55.73 54.46 1ttn s ARG 65 Cb 0.08 -4.69 -0.09 0.00 -1.56 0.00 0.00 34.95 28.68 1ttn s ARG 65 CO 0.05 -1.88 1.20 -1.58 -0.81 0.00 0.00 175.30 172.28 1ttn s TRP 66 N 3.72 3.11 -0.21 5.12 0.52 -1.26 -1.31 118.94 128.62 1ttn s TRP 66 Ca 0.31 1.53 -0.08 0.00 0.02 0.00 0.00 56.10 57.89 1ttn s TRP 66 Cb -0.09 -3.46 0.09 0.00 -1.15 0.00 0.00 33.47 28.86 1ttn s TRP 66 CO -0.01 -1.39 0.45 -0.06 0.02 0.00 0.00 176.95 175.96 1ttn s PHE 67 N -1.32 -0.82 -0.27 -1.98 0.08 0.50 -2.24 117.98 111.93 1ttn s PHE 67 Ca 0.54 1.58 0.02 0.00 0.12 0.00 0.00 56.93 59.19 1ttn s PHE 67 Cb -0.33 0.36 0.06 0.00 -0.57 0.00 0.00 43.02 42.53 1ttn s PHE 67 CO 0.42 -0.48 -0.07 0.12 -0.10 0.00 0.00 175.22 175.11 1ttn s PHE 68 N 2.38 3.30 -0.81 0.36 2.19 0.12 0.15 117.98 125.67 1ttn s PHE 68 Ca -0.04 -2.26 0.00 0.00 0.33 0.00 0.00 56.93 54.96 1ttn s PHE 68 Cb -0.11 -2.03 0.00 0.00 -1.31 0.00 0.00 43.02 39.57 1ttn s PHE 68 CO -0.14 -0.87 0.00 0.43 1.83 0.00 0.00 175.22 176.48 1ttn n SER 69 N 4.47 -5.29 0.00 6.13 7.64 -1.26 -1.81 113.62 123.50 1ttn n SER 69 Ca -0.13 0.19 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1ttn n SER 69 Cb 0.42 -3.46 0.00 0.00 -1.01 0.00 0.00 64.21 60.16 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 -0.23 1.17 3.27 0.23 0.00 -1.26 -5.11 105.19 103.26 1ttn n GLY 70 Ca -0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.61 2.90 -0.01 1.61 1.81 -0.75 -5.09 118.95 118.80 1ttn s ARG 71 Ca 0.00 -0.85 -0.30 0.00 -1.72 0.00 0.00 55.73 52.85 1ttn s ARG 71 Cb 0.00 -2.30 -0.06 0.00 -0.45 0.00 0.00 34.95 32.14 1ttn s ARG 71 CO 0.00 0.28 1.47 -2.14 -0.68 0.00 0.00 175.30 174.22 1ttn s PRO 72 N 0.12 4.25 0.16 3.54 0.02 -1.26 0.12 135.00 141.94 1ttn s PRO 72 Ca -0.11 2.03 -0.30 0.00 0.02 0.00 0.00 61.00 62.64 1ttn s PRO 72 Cb -0.16 -3.66 -0.07 0.00 0.02 0.00 0.00 34.50 30.63 1ttn s PRO 72 CO 0.06 -0.65 0.97 -0.51 -0.33 0.00 0.00 177.00 176.54 1ttn s LEU 73 N 2.79 4.55 0.00 -5.54 2.01 -0.95 -4.93 118.68 116.61 1ttn s LEU 73 Ca 0.66 1.88 0.00 0.00 0.01 0.00 0.00 54.13 56.68 1ttn s LEU 73 Cb -0.32 -3.60 0.00 0.00 0.01 0.00 0.00 46.19 42.28 1ttn s LEU 73 CO 0.27 -0.01 0.00 1.07 1.01 0.00 0.00 176.35 178.69 1ttn n THR 74 N 2.30 0.00 -0.23 5.49 5.66 -1.26 -4.70 114.28 121.53 1ttn n THR 74 Ca 0.01 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.88 1ttn n THR 74 Cb 0.48 -1.49 0.09 0.00 -1.55 0.00 0.00 70.33 67.86 1ttn n THR 74 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1ttn n ASP 75 N -2.70 3.66 -1.63 1.09 8.00 -1.26 -3.81 116.55 119.90 1ttn n ASP 75 Ca 0.00 -2.87 -0.05 0.00 0.71 0.00 0.00 54.79 52.58 1ttn n ASP 75 Cb 0.00 -0.71 0.01 0.00 -0.02 0.00 0.00 41.12 40.40 1ttn n ASP 75 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1ttn n LYS 76 N -0.32 0.52 0.01 -1.24 4.76 -1.26 -4.35 118.16 116.28 1ttn n LYS 76 Ca 0.32 -1.03 -0.09 0.00 -2.87 0.00 0.00 58.31 54.64 1ttn n LYS 76 Cb 1.07 0.46 -0.13 0.00 -1.84 0.00 0.00 35.03 34.59 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 0.38 0.02 0.00 1.97 2.86 -1.91 -3.27 114.93 114.99 1ttn h MET 77 Ca -0.50 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.11 1ttn h MET 77 Cb 1.33 0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.01 1ttn h MET 77 CO -0.24 0.72 0.00 1.17 1.06 0.00 0.00 176.91 179.62 1ttn n LYS 78 N -3.18 0.00 0.00 1.72 0.00 -1.26 -0.37 118.16 115.06 1ttn n LYS 78 Ca -0.11 0.53 0.00 0.00 0.00 0.00 0.00 58.31 58.73 1ttn n LYS 78 Cb 1.01 -1.48 0.00 0.00 0.00 0.00 0.00 35.03 34.56 1ttn n LYS 78 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1ttn n PHE 79 N -2.04 0.00 0.04 5.64 7.35 -1.25 -1.36 117.46 125.85 1ttn n PHE 79 Ca 0.00 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.71 1ttn n PHE 79 Cb 0.00 -0.50 -0.07 0.00 0.35 0.00 0.00 39.48 39.26 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 -1.50 0.62 -0.08 -4.13 2.13 -0.59 -4.48 120.64 112.62 1ttn n GLU 80 Ca 0.00 0.20 -0.06 0.00 0.66 0.00 0.00 57.16 57.96 1ttn n GLU 80 Cb 0.00 -1.81 -0.02 0.00 0.27 0.00 0.00 31.44 29.88 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 -2.84 0.47 -0.24 5.31 4.07 0.50 -4.95 120.64 122.95 1ttn n GLU 81 Ca -0.08 0.47 0.00 0.00 -0.06 0.00 0.00 57.16 57.49 1ttn n GLU 81 Cb 0.79 -1.65 0.00 0.00 -0.06 0.00 0.00 31.44 30.52 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 0.14 -2.45 4.31 7.99 -0.79 -4.82 117.00 116.80 1ttn n LEU 82 Ca -0.10 0.00 -0.35 0.00 -0.01 0.00 0.00 56.01 55.55 1ttn n LEU 82 Cb 0.33 -0.36 0.06 0.00 -0.11 0.00 0.00 43.42 43.35 1ttn n LEU 82 CO 0.13 -0.07 1.27 0.29 -1.51 0.00 0.00 177.39 177.50 1ttn n LYS 83 N -2.00 2.85 -2.23 3.23 4.76 -1.26 -4.65 118.16 118.86 1ttn n LYS 83 Ca 0.00 -3.52 -0.28 0.00 -2.87 0.00 0.00 58.31 51.64 1ttn n LYS 83 Cb 0.00 -2.28 0.01 0.00 -1.84 0.00 0.00 35.03 30.92 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 -0.77 2.61 -1.00 -0.18 -5.35 -1.26 -3.96 119.36 109.45 1ttn n ILE 84 Ca 0.57 -4.56 -0.30 0.00 -0.27 0.00 0.00 62.75 58.19 1ttn n ILE 84 Cb 0.58 -1.22 -0.02 0.00 -1.74 0.00 0.00 39.64 37.24 1ttn n ILE 84 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1ttn n PRO 85 N -0.58 2.62 -1.27 6.28 -0.04 -1.26 -3.60 135.00 137.15 1ttn n PRO 85 Ca 0.43 -1.78 -0.09 0.00 -0.04 0.00 0.00 63.50 62.02 1ttn n PRO 85 Cb 0.70 -2.63 -0.04 0.00 -0.04 0.00 0.00 33.50 31.49 1ttn n PRO 85 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1ttn n LYS 86 N 4.26 -1.06 0.00 0.54 5.02 -0.94 -4.84 118.16 121.13 1ttn n LYS 86 Ca 0.57 0.77 -0.01 0.00 -2.02 0.00 0.00 58.31 57.62 1ttn n LYS 86 Cb 0.19 -4.82 -0.00 0.00 -0.02 0.00 0.00 35.03 30.38 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 -0.35 0.31 -4.55 4.39 9.92 -1.26 -4.94 116.55 120.08 1ttn n ASP 87 Ca -0.09 0.05 -0.37 0.00 -0.53 0.00 0.00 54.79 53.84 1ttn n ASP 87 Cb 0.41 -0.22 0.05 0.00 -0.64 0.00 0.00 41.12 40.72 1ttn n ASP 87 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1ttn n TYR 88 N -2.80 0.08 -3.79 1.24 4.02 -1.25 -4.79 117.16 109.86 1ttn n TYR 88 Ca -0.01 0.42 -0.13 0.00 -0.01 0.00 0.00 57.90 58.17 1ttn n TYR 88 Cb 0.04 -2.04 -0.14 0.00 -0.02 0.00 0.00 39.34 37.18 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 -1.66 -0.03 -0.39 -0.72 0.11 -1.26 -2.21 120.40 114.25 1ttn s VAL 89 Ca 0.72 0.09 -0.16 0.00 -2.93 0.00 0.00 61.98 59.71 1ttn s VAL 89 Cb -0.41 -0.18 0.01 0.00 -1.53 0.00 0.00 36.38 34.27 1ttn s VAL 89 CO 0.51 0.04 0.38 -0.69 -3.33 0.00 0.00 175.10 172.01 1ttn s VAL 90 N 0.60 5.15 -0.38 2.04 1.01 0.15 -4.81 120.40 124.16 1ttn s VAL 90 Ca -0.05 -0.28 -0.29 0.00 0.00 0.00 0.00 61.98 61.36 1ttn s VAL 90 Cb -0.06 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.37 1ttn s VAL 90 CO -0.03 -0.29 1.49 -1.58 0.00 0.00 0.00 175.10 174.69 1ttn s GLN 91 N 2.01 3.56 0.29 2.72 -0.44 0.39 -1.93 119.66 126.26 1ttn s GLN 91 Ca 0.11 1.08 0.08 0.00 -2.50 0.00 0.00 55.36 54.13 1ttn s GLN 91 Cb -0.17 -4.05 -0.04 0.00 -1.64 0.00 0.00 33.01 27.11 1ttn s GLN 91 CO 0.12 -1.58 0.19 0.54 0.50 0.00 0.00 175.29 175.06 1ttn s VAL 92 N 5.63 3.88 -0.04 1.34 0.11 0.36 0.19 120.40 131.87 1ttn s VAL 92 Ca 0.65 -1.51 -0.01 0.00 -2.93 0.00 0.00 61.98 58.18 1ttn s VAL 92 Cb -0.16 -3.21 0.03 0.00 -1.53 0.00 0.00 36.38 31.51 1ttn s VAL 92 CO 0.32 -0.29 0.09 0.27 -3.33 0.00 0.00 175.10 172.16 1ttn s ILE 93 N -2.24 -0.05 -0.48 7.04 -4.36 -0.43 -0.85 121.20 119.82 1ttn s ILE 93 Ca 0.35 0.20 0.02 0.00 -0.26 0.00 0.00 60.65 60.96 1ttn s ILE 93 Cb -0.06 -0.16 0.13 0.00 1.25 0.00 0.00 42.46 43.61 1ttn s ILE 93 CO 0.24 0.08 0.23 0.54 0.24 0.00 0.00 174.94 176.28 1ttn s VAL 94 N 1.12 2.83 -0.46 8.37 0.11 -1.04 -2.23 120.40 129.10 1ttn s VAL 94 Ca -0.09 -2.81 -0.01 0.00 -2.93 0.00 0.00 61.98 56.14 1ttn s VAL 94 Cb -0.12 -2.96 0.37 0.00 -1.53 0.00 0.00 36.38 32.13 1ttn s VAL 94 CO -0.05 -0.75 1.95 -0.24 -3.33 0.00 0.00 175.10 172.69 1ttn n SER 95 N 3.70 6.32 -3.36 3.54 2.88 -1.26 -4.61 113.62 120.82 1ttn n SER 95 Ca 0.04 -3.37 -0.26 0.00 -1.33 0.00 0.00 58.87 53.95 1ttn n SER 95 Cb 0.37 -0.96 -0.09 0.00 -0.75 0.00 0.00 64.21 62.78 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 -0.37 0.86 -0.05 -1.46 6.02 -1.26 -4.95 117.38 116.16 1ttn n GLN 96 Ca 0.46 -3.51 -0.13 0.00 -0.01 0.00 0.00 57.00 53.81 1ttn n GLN 96 Cb 0.78 -1.62 -0.01 0.00 1.02 0.00 0.00 30.24 30.42 1ttn n GLN 96 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1ttn h PRO 97 N 4.75 0.77 -0.31 -1.09 0.13 -2.03 -3.37 132.00 130.85 1ttn h PRO 97 Ca 0.17 -0.49 -0.22 0.00 -0.87 0.00 0.00 66.00 64.58 1ttn h PRO 97 Cb 0.85 0.06 -0.34 0.00 0.13 0.00 0.00 31.00 31.69 1ttn h PRO 97 CO 0.50 1.12 -0.93 1.55 -0.23 0.00 0.00 178.00 180.01 1ttn n VAL 98 N -3.99 0.93 -3.11 1.56 3.14 -1.26 -5.04 118.33 110.56 1ttn n VAL 98 Ca -0.04 -2.39 -0.45 0.00 -2.96 0.00 0.00 64.34 58.50 1ttn n VAL 98 Cb 0.62 1.22 -0.02 0.00 -1.06 0.00 0.00 33.84 34.60 1ttn n VAL 98 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 1ttn s GLN 99 N -2.75 3.61 0.00 1.45 -1.52 -1.26 -5.30 119.66 113.89 1ttn s GLN 99 Ca 0.23 -2.09 0.29 0.00 -1.95 0.00 0.00 55.36 51.84 1ttn s GLN 99 Cb 0.35 -4.70 1.37 0.00 -0.22 0.00 0.00 33.01 29.80 1ttn s GLN 99 CO -0.06 -1.55 1.92 0.27 -0.25 0.00 0.00 175.29 175.62