#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tt8 s HIS 2 N 0.00 3.52 0.53 7.33 5.04 -1.26 -4.97 115.29 125.48 1tt8 s HIS 2 Ca 0.00 0.71 0.19 0.00 -1.54 0.00 0.00 55.06 54.43 1tt8 s HIS 2 Cb 0.00 -2.12 1.33 0.00 0.04 0.00 0.00 32.58 31.84 1tt8 s HIS 2 CO 0.00 0.45 2.11 -1.35 -2.34 0.00 0.00 174.74 173.60 1tt8 h PRO 3 N 3.18 0.00 -0.82 2.88 0.11 -2.05 0.49 132.00 135.79 1tt8 h PRO 3 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1tt8 h PRO 3 Cb 1.18 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 1tt8 h PRO 3 CO 0.69 0.00 0.42 0.00 -0.21 0.00 0.00 178.00 178.90 1tt8 h ALA 4 N 1.92 1.19 -0.23 -0.75 0.00 -1.99 -0.58 119.26 118.81 1tt8 h ALA 4 Ca 0.08 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 1tt8 h ALA 4 Cb 0.31 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1tt8 h ALA 4 CO -0.00 0.63 -0.56 -0.07 0.00 0.00 0.00 179.25 179.25 1tt8 h LEU 5 N 1.16 0.79 -0.66 0.00 -0.00 -1.32 -0.37 115.31 114.91 1tt8 h LEU 5 Ca 0.29 -0.42 -0.00 0.00 -0.00 0.00 0.00 57.88 57.74 1tt8 h LEU 5 Cb 0.08 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 40.48 1tt8 h LEU 5 CO -0.04 1.18 0.41 0.74 -0.00 0.00 0.00 178.44 180.73 1tt8 h THR 6 N 0.54 1.19 -0.04 0.22 2.02 -1.12 -0.52 112.91 115.19 1tt8 h THR 6 Ca 0.01 -0.40 -0.00 0.00 0.77 0.00 0.00 66.41 66.79 1tt8 h THR 6 Cb 1.13 0.26 -0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1tt8 h THR 6 CO 0.11 0.19 0.02 -0.61 0.37 0.00 0.00 175.52 175.60 1tt8 h GLN 7 N 0.90 0.06 -0.64 6.66 4.15 -1.05 -2.63 115.11 122.56 1tt8 h GLN 7 Ca 0.24 -0.01 0.14 0.00 0.77 0.00 0.00 58.65 59.78 1tt8 h GLN 7 Cb -0.04 -0.01 -0.11 0.00 0.21 0.00 0.00 27.48 27.53 1tt8 h GLN 7 CO -0.05 0.21 0.02 1.25 -1.93 0.00 0.00 178.83 178.33 1tt8 h LEU 8 N -0.10 -0.25 -1.27 -2.39 6.46 -0.74 -2.17 115.31 114.85 1tt8 h LEU 8 Ca 0.01 0.16 -0.07 0.00 -0.12 0.00 0.00 57.88 57.86 1tt8 h LEU 8 Cb 0.17 0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.36 1tt8 h LEU 8 CO -0.00 -0.11 -0.35 0.03 -0.62 0.00 0.00 178.44 177.39 1tt8 h ARG 9 N 0.13 0.00 -0.02 1.25 3.08 -0.83 -3.13 114.38 114.87 1tt8 h ARG 9 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 1tt8 h ARG 9 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.61 1tt8 h ARG 9 CO -0.54 0.35 -0.25 0.00 -1.07 0.00 0.00 179.97 178.46 1tt8 n ALA 10 N -2.41 3.07 -1.57 0.04 0.00 -0.86 -4.93 120.51 113.84 1tt8 n ALA 10 Ca -0.02 -0.55 -0.40 0.00 0.00 0.00 0.00 53.44 52.48 1tt8 n ALA 10 Cb 0.41 -0.95 0.03 0.00 0.00 0.00 0.00 19.45 18.93 1tt8 n ALA 10 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1tt8 n LEU 11 N 0.07 2.42 -4.39 0.00 4.32 -0.94 -4.90 117.00 113.59 1tt8 n LEU 11 Ca 0.12 0.89 -0.45 0.00 -0.02 0.00 0.00 56.01 56.56 1tt8 n LEU 11 Cb 0.44 -1.31 -0.03 0.00 -1.62 0.00 0.00 43.42 40.89 1tt8 n LEU 11 CO 0.23 -2.00 0.59 -0.13 -1.22 0.00 0.00 177.39 174.86 1tt8 s ARG 12 N -2.23 3.29 0.24 3.23 1.81 -1.26 -5.01 118.95 119.02 1tt8 s ARG 12 Ca 0.68 -1.60 -0.21 0.00 -1.72 0.00 0.00 55.73 52.88 1tt8 s ARG 12 Cb -0.49 -4.46 -0.09 0.00 -0.45 0.00 0.00 34.95 29.46 1tt8 s ARG 12 CO 0.53 -1.58 0.77 0.71 -0.68 0.00 0.00 175.30 175.05 1tt8 s TYR 13 N 2.35 3.66 0.25 -0.53 1.51 -1.26 -4.43 117.35 118.91 1tt8 s TYR 13 Ca 0.19 1.48 -0.12 0.00 -1.01 0.00 0.00 57.07 57.61 1tt8 s TYR 13 Cb -0.16 -2.69 -0.00 0.00 -0.11 0.00 0.00 41.96 39.00 1tt8 s TYR 13 CO -0.00 0.31 0.49 -1.54 -1.11 0.00 0.00 175.55 173.69 1tt8 s SER 14 N -1.64 -0.05 0.00 2.29 1.04 -0.68 -4.92 113.70 109.75 1tt8 s SER 14 Ca 0.45 -0.96 0.20 0.00 0.48 0.00 0.00 55.95 56.12 1tt8 s SER 14 Cb -0.17 0.60 1.21 0.00 0.10 0.00 0.00 66.02 67.76 1tt8 s SER 14 CO 0.22 -1.16 1.75 0.29 0.98 0.00 0.00 173.24 175.32 1tt8 n LYS 15 N -0.39 0.95 -2.18 4.02 5.02 -1.26 -0.57 118.16 123.75 1tt8 n LYS 15 Ca -0.02 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.85 1tt8 n LYS 15 Cb 0.62 -1.33 -0.02 0.00 -0.02 0.00 0.00 35.03 34.27 1tt8 n LYS 15 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1tt8 s GLU 16 N -2.00 4.19 -0.40 1.97 0.41 -1.26 -4.86 118.70 116.75 1tt8 s GLU 16 Ca 0.31 1.96 -0.15 0.00 -0.41 0.00 0.00 54.97 56.68 1tt8 s GLU 16 Cb 0.14 -3.90 0.01 0.00 -1.78 0.00 0.00 34.13 28.61 1tt8 s GLU 16 CO 0.24 -0.80 0.29 0.42 -0.49 0.00 0.00 175.26 174.91 1tt8 s ILE 17 N 3.86 5.26 0.87 -1.63 1.01 -1.26 -4.25 121.20 125.06 1tt8 s ILE 17 Ca 0.66 -0.59 -0.11 0.00 0.00 0.00 0.00 60.65 60.61 1tt8 s ILE 17 Cb -0.28 -3.90 0.11 0.00 0.01 0.00 0.00 42.46 38.40 1tt8 s ILE 17 CO 0.23 -0.26 1.10 -2.84 0.00 0.00 0.00 174.94 173.18 1tt8 s PRO 18 N 1.69 1.46 -1.34 2.79 0.02 -1.26 -4.88 135.00 133.47 1tt8 s PRO 18 Ca 0.05 1.18 -0.17 0.00 0.02 0.00 0.00 61.00 62.09 1tt8 s PRO 18 Cb -0.19 -1.80 0.06 0.00 0.02 0.00 0.00 34.50 32.59 1tt8 s PRO 18 CO 0.10 -2.21 1.88 0.00 -0.33 0.00 0.00 177.00 176.44 1tt8 n ALA 19 N -3.91 4.10 -2.32 -1.55 0.00 -1.26 -4.94 120.51 110.62 1tt8 n ALA 19 Ca 0.09 -3.85 -0.20 0.00 0.00 0.00 0.00 53.44 49.48 1tt8 n ALA 19 Cb 0.53 -3.59 0.01 0.00 0.00 0.00 0.00 19.45 16.40 1tt8 n ALA 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1tt8 s LEU 20 N 3.70 3.77 0.25 0.00 1.43 -1.26 -5.04 118.68 121.53 1tt8 s LEU 20 Ca 0.52 -0.06 -0.30 0.00 -1.03 0.00 0.00 54.13 53.26 1tt8 s LEU 20 Cb 0.07 -2.87 -0.15 0.00 0.03 0.00 0.00 46.19 43.27 1tt8 s LEU 20 CO 0.03 -0.62 1.06 -0.67 0.23 0.00 0.00 176.35 176.39 1tt8 n ASP 21 N -1.86 1.33 -0.30 2.29 -0.08 -1.26 -4.66 116.55 112.01 1tt8 n ASP 21 Ca 0.02 1.17 0.14 0.00 -1.51 0.00 0.00 54.79 54.61 1tt8 n ASP 21 Cb 0.58 -1.27 0.39 0.00 2.34 0.00 0.00 41.12 43.16 1tt8 n ASP 21 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1tt8 h PRO 22 N 2.50 0.64 -0.37 -0.67 0.11 -1.98 -0.34 132.00 131.89 1tt8 h PRO 22 Ca -0.41 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.57 1tt8 h PRO 22 Cb 1.34 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1tt8 h PRO 22 CO 0.64 0.42 -0.17 0.37 -0.21 0.00 0.00 178.00 179.05 1tt8 h GLN 23 N 0.66 0.68 -0.43 1.05 4.15 -1.99 0.08 115.11 119.31 1tt8 h GLN 23 Ca 0.51 -0.24 -0.14 0.00 0.77 0.00 0.00 58.65 59.55 1tt8 h GLN 23 Cb 0.92 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.55 1tt8 h GLN 23 CO -0.27 0.82 -0.29 1.25 -1.93 0.00 0.00 178.83 178.41 1tt8 h LEU 24 N 0.61 0.98 -0.96 -2.39 5.85 -1.48 -2.01 115.31 115.91 1tt8 h LEU 24 Ca 0.10 -0.40 0.05 0.00 0.84 0.00 0.00 57.88 58.47 1tt8 h LEU 24 Cb 0.64 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.33 1tt8 h LEU 24 CO 0.04 1.19 0.62 -0.07 -0.34 0.00 0.00 178.44 179.88 1tt8 h LEU 25 N 0.79 1.01 -0.89 2.25 3.38 -0.85 -0.35 115.31 120.64 1tt8 h LEU 25 Ca 0.09 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 1tt8 h LEU 25 Cb 0.87 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1tt8 h LEU 25 CO 0.08 0.66 -0.14 0.44 0.09 0.00 0.00 178.44 179.57 1tt8 h ASP 26 N 1.16 0.66 0.46 -0.43 3.45 -0.62 0.13 116.42 121.23 1tt8 h ASP 26 Ca 0.40 -0.19 -0.02 0.00 0.43 0.00 0.00 57.03 57.65 1tt8 h ASP 26 Cb 0.10 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 38.70 1tt8 h ASP 26 CO -0.15 0.82 -0.22 -0.50 -1.57 0.00 0.00 179.24 177.61 1tt8 h TRP 27 N 0.60 -0.58 -0.21 4.55 4.06 -0.88 -2.84 115.95 120.66 1tt8 h TRP 27 Ca 0.10 -0.01 -0.05 0.00 2.06 0.00 0.00 58.89 60.99 1tt8 h TRP 27 Cb 0.58 0.19 -0.01 0.00 -1.00 0.00 0.00 29.16 28.92 1tt8 h TRP 27 CO 0.03 -0.31 -0.09 -0.07 -3.56 0.00 0.00 178.44 174.43 1tt8 h LEU 28 N -0.72 0.31 -0.41 -4.49 3.38 -0.60 -3.07 115.31 109.71 1tt8 h LEU 28 Ca -0.06 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1tt8 h LEU 28 Cb 0.52 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1tt8 h LEU 28 CO 0.10 0.45 -0.28 0.18 0.09 0.00 0.00 178.44 178.98 1tt8 n LEU 29 N -4.27 0.92 -4.59 1.67 4.77 0.42 -4.97 117.00 110.95 1tt8 n LEU 29 Ca -0.00 -0.21 -0.53 0.00 -0.03 0.00 0.00 56.01 55.24 1tt8 n LEU 29 Cb 0.26 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.15 1tt8 n LEU 29 CO 0.38 0.18 0.89 -0.11 -1.33 0.00 0.00 177.39 177.40 1tt8 n LEU 30 N -0.79 1.53 -3.52 2.23 7.94 -1.07 -4.82 117.00 118.49 1tt8 n LEU 30 Ca 0.11 1.12 -0.40 0.00 -1.11 0.00 0.00 56.01 55.73 1tt8 n LEU 30 Cb 0.34 -1.16 -0.00 0.00 0.53 0.00 0.00 43.42 43.13 1tt8 n LEU 30 CO 0.27 -1.09 2.23 -0.62 -1.11 0.00 0.00 177.39 177.06 1tt8 n GLU 31 N 2.57 4.70 -3.69 1.96 1.02 -1.26 -4.78 120.64 121.16 1tt8 n GLU 31 Ca 0.19 -3.66 -0.03 0.00 -0.02 0.00 0.00 57.16 53.64 1tt8 n GLU 31 Cb 0.18 -2.62 -0.01 0.00 -0.02 0.00 0.00 31.44 28.97 1tt8 n GLU 31 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1tt8 s ASP 32 N 0.10 -0.17 1.35 1.62 -1.08 -1.26 -4.97 116.67 112.26 1tt8 s ASP 32 Ca 0.51 -0.28 -0.22 0.00 -0.52 0.00 0.00 52.55 52.04 1tt8 s ASP 32 Cb 0.18 0.39 0.34 0.00 -1.46 0.00 0.00 42.92 42.37 1tt8 s ASP 32 CO -0.10 -0.71 1.01 -0.94 0.52 0.00 0.00 175.17 174.96 1tt8 s SER 33 N -2.87 -0.41 0.00 -0.34 1.04 -1.26 -4.96 113.70 104.90 1tt8 s SER 33 Ca 0.12 0.68 0.28 0.00 0.48 0.00 0.00 55.95 57.51 1tt8 s SER 33 Cb 0.00 -0.93 0.99 0.00 0.10 0.00 0.00 66.02 66.18 1tt8 s SER 33 CO -0.01 -4.95 1.71 0.23 0.98 0.00 0.00 173.24 171.21 1tt8 n MET 34 N -5.33 1.18 0.28 4.02 2.81 -1.26 -4.61 117.12 114.22 1tt8 n MET 34 Ca 0.14 -0.64 -0.17 0.00 -1.81 0.00 0.00 57.70 55.22 1tt8 n MET 34 Cb 0.60 -1.49 -0.09 0.00 -0.71 0.00 0.00 33.22 31.54 1tt8 n MET 34 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1tt8 h THR 35 N 1.57 0.15 -0.04 2.03 2.02 -1.94 0.10 112.91 116.82 1tt8 h THR 35 Ca 0.00 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 66.98 1tt8 h THR 35 Cb 0.46 0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.02 1tt8 h THR 35 CO 0.00 0.00 -0.84 0.11 0.37 0.00 0.00 175.52 175.16 1tt8 h LYS 36 N -0.90 0.38 -0.44 6.66 1.79 -1.89 -1.73 116.57 120.44 1tt8 h LYS 36 Ca -0.05 -0.36 -0.07 0.00 -2.18 0.00 0.00 60.65 57.99 1tt8 h LYS 36 Cb 0.78 0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 31.50 1tt8 h LYS 36 CO -0.04 1.02 -0.02 -0.09 -1.08 0.00 0.00 179.45 179.25 1tt8 h ARG 37 N 0.24 0.73 -0.63 3.15 2.43 -1.81 -1.18 114.38 117.31 1tt8 h ARG 37 Ca -0.05 -0.20 -0.08 0.00 -0.81 0.00 0.00 59.98 58.84 1tt8 h ARG 37 Cb 1.44 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.88 1tt8 h ARG 37 CO 0.14 0.76 0.07 0.74 -1.51 0.00 0.00 179.97 180.17 1tt8 h PHE 38 N 0.69 1.15 -0.64 2.20 0.04 -0.58 -2.68 116.94 117.12 1tt8 h PHE 38 Ca 0.13 -0.18 0.05 0.00 2.80 0.00 0.00 57.97 60.78 1tt8 h PHE 38 Cb 0.45 -0.31 -0.04 0.00 2.20 0.00 0.00 35.95 38.25 1tt8 h PHE 38 CO 0.02 0.99 0.42 0.93 -0.60 0.00 0.00 178.31 180.08 1tt8 h GLU 39 N 0.98 0.67 0.00 1.51 5.08 -0.66 -0.86 114.58 121.31 1tt8 h GLU 39 Ca 0.19 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1tt8 h GLU 39 Cb 0.49 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1tt8 h GLU 39 CO 0.02 0.44 0.00 1.04 -1.00 0.00 0.00 179.01 179.51 1tt8 n GLN 40 N -4.47 0.21 0.00 2.33 6.02 -0.51 -0.58 117.38 120.38 1tt8 n GLN 40 Ca 0.09 0.15 0.16 0.00 -0.01 0.00 0.00 57.00 57.38 1tt8 n GLN 40 Cb 0.19 -1.50 0.94 0.00 1.02 0.00 0.00 30.24 30.89 1tt8 n GLN 40 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1tt8 n GLN 41 N -1.29 0.99 -1.32 -1.09 1.13 -0.33 -4.88 117.38 110.60 1tt8 n GLN 41 Ca 0.07 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.13 1tt8 n GLN 41 Cb 0.12 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 28.97 1tt8 n GLN 41 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1tt8 n GLY 42 N 0.99 0.84 3.03 1.08 0.00 0.26 -5.07 105.19 106.31 1tt8 n GLY 42 Ca 0.24 -0.35 -0.12 0.00 0.00 0.00 0.00 46.02 45.79 1tt8 n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tt8 s LYS 43 N -2.52 0.45 -0.16 1.61 -0.14 -0.89 -5.00 119.74 113.10 1tt8 s LYS 43 Ca 0.00 -0.70 -0.21 0.00 -1.36 0.00 0.00 55.97 53.70 1tt8 s LYS 43 Cb 0.00 -0.16 -0.03 0.00 -1.68 0.00 0.00 37.83 35.96 1tt8 s LYS 43 CO 0.00 0.02 0.62 0.95 -0.76 0.00 0.00 175.35 176.18 1tt8 s THR 44 N -1.38 5.05 -0.16 2.17 -4.23 -1.26 -4.29 115.64 111.53 1tt8 s THR 44 Ca -0.12 1.21 -0.07 0.00 -1.18 0.00 0.00 61.69 61.53 1tt8 s THR 44 Cb -0.10 -3.95 -0.04 0.00 1.34 0.00 0.00 72.50 69.76 1tt8 s THR 44 CO -0.00 0.18 0.07 -0.69 -0.54 0.00 0.00 174.62 173.63 1tt8 s VAL 45 N 1.46 4.87 0.11 2.29 1.01 -1.26 -0.12 120.40 128.76 1tt8 s VAL 45 Ca 0.30 -0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.28 1tt8 s VAL 45 Cb -0.16 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 1tt8 s VAL 45 CO 0.12 0.50 -0.03 -0.94 0.00 0.00 0.00 175.10 174.75 1tt8 s SER 46 N 0.00 0.95 -0.13 3.32 1.04 -0.35 -4.93 113.70 113.60 1tt8 s SER 46 Ca 0.06 -1.06 -0.03 0.00 0.48 0.00 0.00 55.95 55.41 1tt8 s SER 46 Cb -0.12 0.14 -0.03 0.00 0.10 0.00 0.00 66.02 66.11 1tt8 s SER 46 CO 0.01 -0.54 -0.03 -0.69 0.98 0.00 0.00 173.24 172.97 1tt8 s VAL 47 N -3.73 3.96 -0.28 5.02 1.01 -1.26 -0.84 120.40 124.29 1tt8 s VAL 47 Ca 0.14 -0.35 -0.08 0.00 0.00 0.00 0.00 61.98 61.69 1tt8 s VAL 47 Cb 0.06 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.71 1tt8 s VAL 47 CO -0.03 0.53 0.11 -0.89 0.00 0.00 0.00 175.10 174.81 1tt8 s THR 48 N -0.01 4.47 -0.31 3.92 2.01 0.45 -4.95 115.64 121.22 1tt8 s THR 48 Ca 0.01 -0.28 -0.27 0.00 0.31 0.00 0.00 61.69 61.46 1tt8 s THR 48 Cb -0.13 -3.18 0.01 0.00 0.01 0.00 0.00 72.50 69.21 1tt8 s THR 48 CO 0.03 0.21 0.96 -0.32 -0.69 0.00 0.00 174.62 174.81 1tt8 s MET 49 N 1.62 4.02 -0.19 4.92 1.75 -1.26 -0.98 119.30 129.17 1tt8 s MET 49 Ca 0.05 0.88 -0.09 0.00 -1.25 0.00 0.00 55.69 55.28 1tt8 s MET 49 Cb -0.16 -3.73 -0.21 0.00 2.84 0.00 0.00 34.83 33.57 1tt8 s MET 49 CO 0.05 -0.82 0.11 -0.89 -0.65 0.00 0.00 175.02 172.82 1tt8 n ILE 50 N 5.74 1.63 -3.61 10.11 2.08 0.10 -4.97 119.36 130.45 1tt8 n ILE 50 Ca 0.09 -0.46 -0.15 0.00 0.56 0.00 0.00 62.75 62.79 1tt8 n ILE 50 Cb 0.47 -1.76 -0.07 0.00 -0.75 0.00 0.00 39.64 37.54 1tt8 n ILE 50 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1tt8 s ARG 51 N -2.50 0.88 -0.17 0.38 1.70 -0.70 -4.96 118.95 113.57 1tt8 s ARG 51 Ca -0.29 0.61 -0.15 0.00 -0.47 0.00 0.00 55.73 55.43 1tt8 s ARG 51 Cb 0.08 0.42 0.05 0.00 -0.57 0.00 0.00 34.95 34.93 1tt8 s ARG 51 CO 0.66 -0.19 0.45 -1.83 -1.08 0.00 0.00 175.30 173.31 1tt8 s GLU 52 N -0.33 0.52 0.00 3.89 -1.05 -1.26 -0.29 118.70 120.19 1tt8 s GLU 52 Ca -0.05 0.65 0.00 0.00 -0.15 0.00 0.00 54.97 55.42 1tt8 s GLU 52 Cb -0.03 0.23 0.00 0.00 -0.44 0.00 0.00 34.13 33.90 1tt8 s GLU 52 CO 0.05 -0.07 0.00 0.41 0.95 0.00 0.00 175.26 176.59 1tt8 n GLY 53 N 2.97 0.54 3.76 -3.83 0.00 -0.66 -5.00 105.19 102.96 1tt8 n GLY 53 Ca -0.14 -1.11 -0.39 0.00 0.00 0.00 0.00 46.02 44.37 1tt8 n GLY 53 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1tt8 s PHE 54 N -2.00 3.88 0.15 1.61 0.40 -1.26 -0.85 117.98 119.91 1tt8 s PHE 54 Ca 0.00 1.87 0.00 0.00 -0.60 0.00 0.00 56.93 58.20 1tt8 s PHE 54 Cb 0.00 -2.99 -0.04 0.00 0.51 0.00 0.00 43.02 40.50 1tt8 s PHE 54 CO 0.00 0.32 0.02 0.14 0.70 0.00 0.00 175.22 176.40 1tt8 s VAL 55 N -1.28 0.41 0.60 -0.44 -7.23 0.68 -4.92 120.40 108.22 1tt8 s VAL 55 Ca 0.44 -1.94 0.03 0.00 -1.81 0.00 0.00 61.98 58.70 1tt8 s VAL 55 Cb -0.25 -2.06 0.08 0.00 0.56 0.00 0.00 36.38 34.71 1tt8 s VAL 55 CO 0.31 -0.50 0.84 -1.61 -0.31 0.00 0.00 175.10 173.83 1tt8 s GLU 56 N -3.97 2.20 0.46 4.82 2.02 -1.26 -1.26 118.70 121.71 1tt8 s GLU 56 Ca 0.23 -1.15 0.17 0.00 0.02 0.00 0.00 54.97 54.24 1tt8 s GLU 56 Cb 0.07 -2.50 1.14 0.00 0.10 0.00 0.00 34.13 32.94 1tt8 s GLU 56 CO 0.02 -0.97 1.98 1.96 0.02 0.00 0.00 175.26 178.28 1tt8 h GLN 57 N -0.06 0.27 0.00 1.61 4.20 -1.83 -1.52 115.11 117.78 1tt8 h GLN 57 Ca -0.37 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.32 1tt8 h GLN 57 Cb 1.28 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.00 1tt8 h GLN 57 CO 0.44 0.18 0.00 0.27 -0.67 0.00 0.00 178.83 179.05 1tt8 n ASN 58 N -4.45 0.00 -0.92 1.46 0.23 -1.26 -1.71 115.26 108.61 1tt8 n ASN 58 Ca 0.10 0.49 0.10 0.00 -0.53 0.00 0.00 54.58 54.74 1tt8 n ASN 58 Cb 0.44 -0.50 0.15 0.00 -2.08 0.00 0.00 39.78 37.79 1tt8 n ASN 58 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1tt8 n GLU 59 N -1.50 2.11 -2.64 -3.83 1.02 -0.57 -4.53 120.64 110.70 1tt8 n GLU 59 Ca 0.03 -1.96 -0.21 0.00 -0.02 0.00 0.00 57.16 55.00 1tt8 n GLU 59 Cb 0.13 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 1tt8 n GLU 59 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1tt8 n ILE 60 N 1.20 1.84 0.11 -3.67 -5.35 -0.70 -4.90 119.36 107.89 1tt8 n ILE 60 Ca 0.15 -4.40 0.03 0.00 -0.27 0.00 0.00 62.75 58.26 1tt8 n ILE 60 Cb 0.52 -0.60 0.40 0.00 -1.74 0.00 0.00 39.64 38.22 1tt8 n ILE 60 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1tt8 h PRO 61 N 2.79 0.27 -0.26 6.28 0.13 -1.80 0.92 132.00 140.32 1tt8 h PRO 61 Ca 0.14 -0.05 -0.14 0.00 -0.87 0.00 0.00 66.00 65.08 1tt8 h PRO 61 Cb 0.96 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.04 1tt8 h PRO 61 CO 0.71 0.36 -0.38 0.93 -0.23 0.00 0.00 178.00 179.39 1tt8 h GLU 62 N 0.26 0.72 0.00 0.86 3.07 -1.94 -3.33 114.58 114.22 1tt8 h GLU 62 Ca 0.06 -0.43 -0.17 0.00 -0.50 0.00 0.00 59.36 58.32 1tt8 h GLU 62 Cb 0.31 0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 28.23 1tt8 h GLU 62 CO 0.02 1.05 -1.19 0.93 -1.40 0.00 0.00 179.01 178.42 1tt8 h GLU 63 N 0.46 0.00 -0.81 2.33 3.07 -1.83 -3.39 114.58 114.40 1tt8 h GLU 63 Ca 0.03 0.00 0.08 0.00 -0.50 0.00 0.00 59.36 58.97 1tt8 h GLU 63 Cb 0.97 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.81 1tt8 h GLU 63 CO 0.09 0.43 0.47 1.25 -1.40 0.00 0.00 179.01 179.85 1tt8 h LEU 64 N 0.00 0.70 -2.75 1.33 5.85 -0.94 0.62 115.31 120.12 1tt8 h LEU 64 Ca -0.12 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 1tt8 h LEU 64 Cb 1.60 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.53 1tt8 h LEU 64 CO 0.06 0.42 -0.00 -0.65 -0.34 0.00 0.00 178.44 177.93 1tt8 h PRO 65 N 0.82 0.00 -0.03 5.25 0.11 -1.77 -2.61 132.00 133.78 1tt8 h PRO 65 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 1tt8 h PRO 65 Cb 0.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.40 1tt8 h PRO 65 CO -0.22 0.00 -0.03 1.28 -0.21 0.00 0.00 178.00 178.83 1tt8 n LEU 66 N -3.36 2.79 -4.33 2.35 4.77 0.18 -4.98 117.00 114.41 1tt8 n LEU 66 Ca -0.03 -0.98 -0.17 0.00 -0.03 0.00 0.00 56.01 54.79 1tt8 n LEU 66 Cb 0.08 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.07 1tt8 n LEU 66 CO 0.23 0.47 -0.35 -0.76 -1.33 0.00 0.00 177.39 175.65 1tt8 s LEU 67 N -1.88 2.32 0.54 2.23 1.43 -0.98 -5.00 118.68 117.33 1tt8 s LEU 67 Ca 0.25 -1.17 -0.21 0.00 -1.03 0.00 0.00 54.13 51.97 1tt8 s LEU 67 Cb 0.18 -0.37 -0.06 0.00 0.03 0.00 0.00 46.19 45.98 1tt8 s LEU 67 CO 0.29 -0.44 1.12 -2.65 0.23 0.00 0.00 176.35 174.91 1tt8 n PRO 68 N -0.41 1.30 -3.07 1.29 -0.02 -1.26 -4.91 135.00 127.93 1tt8 n PRO 68 Ca -0.06 0.48 -0.42 0.00 -2.02 0.00 0.00 63.50 61.48 1tt8 n PRO 68 Cb 0.63 -2.29 -0.06 0.00 -0.02 0.00 0.00 33.50 31.75 1tt8 n PRO 68 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1tt8 s LYS 69 N -2.63 3.53 0.35 -0.52 -0.14 -1.26 -5.00 119.74 114.07 1tt8 s LYS 69 Ca 0.71 -0.06 -0.05 0.00 -1.36 0.00 0.00 55.97 55.21 1tt8 s LYS 69 Cb -0.45 -3.87 0.01 0.00 -1.68 0.00 0.00 37.83 31.84 1tt8 s LYS 69 CO 0.50 -0.89 0.53 -1.83 -0.76 0.00 0.00 175.35 172.90 1tt8 s GLU 70 N 2.89 1.98 0.16 1.68 -1.05 -1.26 -5.08 118.70 118.01 1tt8 s GLU 70 Ca 0.26 -1.71 -0.05 0.00 -0.15 0.00 0.00 54.97 53.32 1tt8 s GLU 70 Cb -0.14 0.48 0.00 0.00 -0.44 0.00 0.00 34.13 34.03 1tt8 s GLU 70 CO 0.18 -0.84 1.41 1.03 0.95 0.00 0.00 175.26 177.98 1tt8 h SER 71 N 2.08 0.64 -4.99 0.83 0.87 -1.96 -3.43 113.55 107.60 1tt8 h SER 71 Ca -0.29 -0.41 -0.15 0.00 -1.23 0.00 0.00 61.79 59.71 1tt8 h SER 71 Cb 1.24 -0.19 -0.21 0.00 -0.44 0.00 0.00 62.40 62.81 1tt8 h SER 71 CO 0.39 1.16 -0.59 -0.13 -0.53 0.00 0.00 176.83 177.14 1tt8 s ARG 72 N -3.72 0.42 0.02 2.24 1.81 -1.26 -4.42 118.95 114.04 1tt8 s ARG 72 Ca -0.07 -0.52 0.00 0.00 -1.72 0.00 0.00 55.73 53.42 1tt8 s ARG 72 Cb 0.10 0.16 -0.01 0.00 -0.45 0.00 0.00 34.95 34.75 1tt8 s ARG 72 CO 0.86 -0.09 -0.03 0.71 -0.68 0.00 0.00 175.30 176.07 1tt8 s TYR 73 N -1.51 0.27 -0.18 -0.53 1.51 -0.39 -1.71 117.35 114.81 1tt8 s TYR 73 Ca -0.15 -0.33 -0.24 0.00 -1.01 0.00 0.00 57.07 55.35 1tt8 s TYR 73 Cb -0.08 -0.18 -0.02 0.00 -0.11 0.00 0.00 41.96 41.57 1tt8 s TYR 73 CO 0.00 -0.10 0.79 -0.46 -1.11 0.00 0.00 175.55 174.67 1tt8 s TRP 74 N -0.89 3.41 -0.17 2.71 -0.11 0.73 -0.23 118.94 124.39 1tt8 s TRP 74 Ca -0.09 1.18 -0.03 0.00 1.22 0.00 0.00 56.10 58.39 1tt8 s TRP 74 Cb -0.06 -2.97 -0.02 0.00 -1.50 0.00 0.00 33.47 28.93 1tt8 s TRP 74 CO -0.00 -0.23 -0.07 -1.17 -4.62 0.00 0.00 176.95 170.86 1tt8 s LEU 75 N 2.10 2.93 -0.11 5.86 2.96 -0.03 -0.60 118.68 131.80 1tt8 s LEU 75 Ca 0.36 -0.30 -0.00 0.00 -0.22 0.00 0.00 54.13 53.97 1tt8 s LEU 75 Cb -0.16 -1.71 0.02 0.00 0.50 0.00 0.00 46.19 44.84 1tt8 s LEU 75 CO 0.12 0.09 -0.07 -0.60 -1.32 0.00 0.00 176.35 174.57 1tt8 s ARG 76 N 0.81 1.43 -0.12 1.98 3.52 -0.12 -1.66 118.95 124.79 1tt8 s ARG 76 Ca -0.02 -0.22 0.03 0.00 -0.13 0.00 0.00 55.73 55.38 1tt8 s ARG 76 Cb -0.15 -1.51 0.00 0.00 -1.56 0.00 0.00 34.95 31.74 1tt8 s ARG 76 CO 0.01 -0.26 -0.22 -1.21 -0.81 0.00 0.00 175.30 172.82 1tt8 s GLU 77 N 1.68 3.09 0.11 5.12 2.02 0.61 -0.38 118.70 130.95 1tt8 s GLU 77 Ca 0.04 -0.84 0.01 0.00 0.02 0.00 0.00 54.97 54.20 1tt8 s GLU 77 Cb -0.13 -2.40 -0.04 0.00 0.10 0.00 0.00 34.13 31.66 1tt8 s GLU 77 CO -0.07 0.12 -0.04 0.96 0.02 0.00 0.00 175.26 176.24 1tt8 s ILE 78 N 0.50 0.61 -0.11 -1.63 -4.36 0.05 -0.72 121.20 115.55 1tt8 s ILE 78 Ca -0.14 -1.93 -0.03 0.00 -0.26 0.00 0.00 60.65 58.29 1tt8 s ILE 78 Cb -0.17 -1.77 -0.03 0.00 1.25 0.00 0.00 42.46 41.74 1tt8 s ILE 78 CO 0.05 -0.79 -0.01 -0.76 0.24 0.00 0.00 174.94 173.68 1tt8 s LEU 79 N -3.06 3.50 -0.20 0.37 1.43 -0.16 -0.95 118.68 119.62 1tt8 s LEU 79 Ca 0.14 0.07 -0.04 0.00 -1.03 0.00 0.00 54.13 53.27 1tt8 s LEU 79 Cb 0.06 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.44 1tt8 s LEU 79 CO -0.03 0.31 -0.02 -0.22 0.23 0.00 0.00 176.35 176.62 1tt8 s LEU 80 N -0.49 3.15 0.18 1.79 2.96 0.91 -0.41 118.68 126.77 1tt8 s LEU 80 Ca 0.08 -0.24 0.10 0.00 -0.22 0.00 0.00 54.13 53.85 1tt8 s LEU 80 Cb -0.12 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.74 1tt8 s LEU 80 CO 0.02 0.06 -0.15 -0.44 -1.32 0.00 0.00 176.35 174.52 1tt8 s SER 81 N 1.01 3.93 -0.19 3.68 0.01 -0.02 -0.43 113.70 121.70 1tt8 s SER 81 Ca 0.01 -0.67 0.01 0.00 1.31 0.00 0.00 55.95 56.61 1tt8 s SER 81 Cb -0.14 -0.54 0.04 0.00 0.21 0.00 0.00 66.02 65.58 1tt8 s SER 81 CO 0.01 0.12 -0.13 0.00 0.41 0.00 0.00 173.24 173.65 1tt8 s ALA 82 N -1.62 2.05 -1.67 1.44 0.00 -0.12 -1.21 121.76 120.63 1tt8 s ALA 82 Ca 0.23 -1.18 -0.17 0.00 0.00 0.00 0.00 51.96 50.84 1tt8 s ALA 82 Cb -0.09 -1.23 0.14 0.00 0.00 0.00 0.00 23.12 21.94 1tt8 s ALA 82 CO 0.13 -0.68 0.83 -0.25 0.00 0.00 0.00 175.76 175.79 1tt8 n ASP 83 N 4.68 -3.62 0.00 0.00 9.92 0.83 -1.43 116.55 126.93 1tt8 n ASP 83 Ca -0.16 -0.96 0.00 0.00 -0.53 0.00 0.00 54.79 53.14 1tt8 n ASP 83 Cb 0.47 -3.01 0.00 0.00 -0.64 0.00 0.00 41.12 37.94 1tt8 n ASP 83 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1tt8 n GLY 84 N -1.47 0.88 3.67 0.44 0.00 -1.26 -5.02 105.19 102.42 1tt8 n GLY 84 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 1tt8 n GLY 84 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1tt8 s GLU 85 N -0.08 4.07 0.08 1.61 2.12 -0.51 -5.00 118.70 120.99 1tt8 s GLU 85 Ca 0.00 -0.28 -0.31 0.00 0.36 0.00 0.00 54.97 54.74 1tt8 s GLU 85 Cb 0.00 -3.44 -0.07 0.00 0.26 0.00 0.00 34.13 30.88 1tt8 s GLU 85 CO 0.00 0.15 1.42 -1.25 -0.54 0.00 0.00 175.26 175.04 1tt8 s PRO 86 N 0.77 4.30 -0.01 4.30 0.04 -1.26 -0.94 135.00 142.20 1tt8 s PRO 86 Ca 0.07 2.07 0.03 0.00 0.04 0.00 0.00 61.00 63.21 1tt8 s PRO 86 Cb -0.13 -3.36 -0.04 0.00 0.04 0.00 0.00 34.50 31.01 1tt8 s PRO 86 CO 0.02 -0.50 0.05 0.91 0.04 0.00 0.00 177.00 177.52 1tt8 n TRP 87 N 4.46 0.00 -3.68 0.56 7.02 0.42 -4.40 117.44 121.82 1tt8 n TRP 87 Ca 0.12 0.00 -0.15 0.00 -1.02 0.00 0.00 57.50 56.46 1tt8 n TRP 87 Cb 0.42 -0.08 -0.08 0.00 -2.42 0.00 0.00 31.31 29.15 1tt8 n TRP 87 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 1tt8 s LEU 88 N -3.42 0.22 -0.13 -0.99 0.20 -0.90 -0.81 118.68 112.85 1tt8 s LEU 88 Ca -0.01 0.54 -0.03 0.00 0.69 0.00 0.00 54.13 55.32 1tt8 s LEU 88 Cb 0.02 1.74 -0.03 0.00 -0.43 0.00 0.00 46.19 47.49 1tt8 s LEU 88 CO 0.12 -0.41 -0.01 0.00 -0.29 0.00 0.00 176.35 175.77 1tt8 s ALA 89 N -0.80 3.17 -0.02 5.97 0.00 0.13 -0.06 121.76 130.16 1tt8 s ALA 89 Ca -0.09 -0.81 0.05 0.00 0.00 0.00 0.00 51.96 51.12 1tt8 s ALA 89 Cb -0.03 -1.56 -0.01 0.00 0.00 0.00 0.00 23.12 21.52 1tt8 s ALA 89 CO 0.05 0.38 -0.17 0.20 0.00 0.00 0.00 175.76 176.22 1tt8 s GLY 90 N -0.21 0.84 -0.13 0.00 0.00 -0.13 -0.56 107.32 107.13 1tt8 s GLY 90 Ca 0.05 -0.70 -0.02 0.00 0.00 0.00 0.00 44.72 44.05 1tt8 s GLY 90 CO 0.02 -0.52 -0.00 -1.60 0.00 0.00 0.00 173.10 171.00 1tt8 s ARG 91 N -0.27 0.83 -0.07 2.90 3.52 0.22 -0.77 118.95 125.32 1tt8 s ARG 91 Ca 0.04 -0.19 0.04 0.00 -0.13 0.00 0.00 55.73 55.48 1tt8 s ARG 91 Cb -0.08 -1.55 -0.02 0.00 -1.56 0.00 0.00 34.95 31.74 1tt8 s ARG 91 CO 0.00 -0.43 -0.17 0.99 -0.81 0.00 0.00 175.30 174.88 1tt8 s THR 92 N 1.86 2.77 -0.14 4.11 2.01 0.49 -0.63 115.64 126.11 1tt8 s THR 92 Ca 0.02 -0.81 -0.00 0.00 0.31 0.00 0.00 61.69 61.21 1tt8 s THR 92 Cb -0.14 -2.08 0.03 0.00 0.01 0.00 0.00 72.50 70.31 1tt8 s THR 92 CO -0.07 0.57 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.64 1tt8 s VAL 93 N -0.36 1.29 -0.23 3.82 1.01 0.31 -0.94 120.40 125.30 1tt8 s VAL 93 Ca 0.03 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.51 1tt8 s VAL 93 Cb -0.12 -1.29 0.04 0.00 0.00 0.00 0.00 36.38 35.01 1tt8 s VAL 93 CO 0.02 0.35 -0.14 -0.69 0.00 0.00 0.00 175.10 174.64 1tt8 s VAL 94 N 1.59 2.18 0.49 2.92 1.01 0.23 -0.78 120.40 128.04 1tt8 s VAL 94 Ca 0.04 -1.35 -0.23 0.00 0.00 0.00 0.00 61.98 60.43 1tt8 s VAL 94 Cb -0.13 -2.15 -0.07 0.00 0.00 0.00 0.00 36.38 34.03 1tt8 s VAL 94 CO -0.09 0.18 1.31 -2.65 0.00 0.00 0.00 175.10 173.85 1tt8 n PRO 95 N 4.51 1.81 0.12 2.72 -0.02 -1.26 -0.19 135.00 142.69 1tt8 n PRO 95 Ca -0.17 0.66 0.06 0.00 -2.02 0.00 0.00 63.50 62.03 1tt8 n PRO 95 Cb 0.45 -2.49 0.54 0.00 -0.02 0.00 0.00 33.50 31.98 1tt8 n PRO 95 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1tt8 h VAL 96 N 1.74 1.04 0.00 -1.45 2.07 -1.69 -0.07 116.25 117.89 1tt8 h VAL 96 Ca -0.50 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 66.93 1tt8 h VAL 96 Cb 1.30 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1tt8 h VAL 96 CO 0.58 0.05 0.00 0.77 0.02 0.00 0.00 177.57 178.99 1tt8 h SER 97 N 0.28 0.00 1.90 0.57 4.64 -1.89 -0.57 113.55 118.48 1tt8 h SER 97 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1tt8 h SER 97 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1tt8 h SER 97 CO -0.02 0.00 0.00 0.74 -0.87 0.00 0.00 176.83 176.68 1tt8 h THR 98 N 0.00 0.00 -0.88 2.95 2.02 -1.30 -3.42 112.91 112.28 1tt8 h THR 98 Ca 0.00 -0.93 -0.68 0.00 0.77 0.00 0.00 66.41 65.57 1tt8 h THR 98 Cb 0.10 1.92 -0.08 0.00 -1.74 0.00 0.00 68.15 68.36 1tt8 h THR 98 CO 0.00 0.00 2.20 0.18 0.37 0.00 0.00 175.52 178.27 1tt8 n LEU 99 N -3.02 4.95 -3.87 2.58 4.77 -0.22 -4.63 117.00 117.57 1tt8 n LEU 99 Ca 0.04 -3.93 -0.10 0.00 -0.03 0.00 0.00 56.01 51.99 1tt8 n LEU 99 Cb 0.51 -1.75 -0.08 0.00 -2.33 0.00 0.00 43.42 39.77 1tt8 n LEU 99 CO 0.33 0.16 -0.12 -0.94 -1.33 0.00 0.00 177.39 175.50 1tt8 s SER 100 N 4.20 0.08 0.90 -1.43 1.04 -1.26 -4.62 113.70 112.61 1tt8 s SER 100 Ca 0.54 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.51 1tt8 s SER 100 Cb 0.04 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.45 1tt8 s SER 100 CO 0.08 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.33 1tt8 n GLY 101 N 0.56 1.66 0.33 7.32 0.00 -1.26 -1.73 105.19 112.06 1tt8 n GLY 101 Ca -0.18 -0.51 0.16 0.00 0.00 0.00 0.00 46.02 45.49 1tt8 n GLY 101 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1tt8 h PRO 102 N 0.00 0.00 0.00 1.61 0.11 -1.97 -1.40 132.00 130.35 1tt8 h PRO 102 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1tt8 h PRO 102 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1tt8 h PRO 102 CO 0.00 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.18 1tt8 n GLU 103 N -4.00 0.04 -0.06 1.05 4.71 -0.71 -1.53 120.64 120.14 1tt8 n GLU 103 Ca 0.02 0.22 0.21 0.00 -0.01 0.00 0.00 57.16 57.60 1tt8 n GLU 103 Cb 0.32 -1.50 0.68 0.00 -1.01 0.00 0.00 31.44 29.92 1tt8 n GLU 103 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 1tt8 h LEU 104 N 0.00 0.05 -2.57 -4.62 3.38 -1.22 -1.25 115.31 109.08 1tt8 h LEU 104 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1tt8 h LEU 104 Cb 0.24 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1tt8 h LEU 104 CO 0.00 0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.55 1tt8 h ALA 105 N 1.68 1.00 0.00 1.53 0.00 -1.50 -2.62 119.26 119.36 1tt8 h ALA 105 Ca 0.31 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 1tt8 h ALA 105 Cb 1.15 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1tt8 h ALA 105 CO -0.02 0.00 -0.01 -0.07 0.00 0.00 0.00 179.25 179.15 1tt8 h LEU 106 N 0.00 0.00 -0.84 0.00 3.38 -1.45 -0.14 115.31 116.26 1tt8 h LEU 106 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1tt8 h LEU 106 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1tt8 h LEU 106 CO 0.00 0.01 -0.27 0.00 0.09 0.00 0.00 178.44 178.27 1tt8 n GLN 107 N -3.46 1.20 -0.06 1.13 10.64 -0.98 -4.39 117.38 121.46 1tt8 n GLN 107 Ca -0.03 -0.84 0.06 0.00 -1.83 0.00 0.00 57.00 54.37 1tt8 n GLN 107 Cb 0.10 -1.48 0.09 0.00 -0.86 0.00 0.00 30.24 28.09 1tt8 n GLN 107 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1tt8 n LYS 108 N -0.17 1.72 0.04 2.61 4.76 -0.08 -4.76 118.16 122.28 1tt8 n LYS 108 Ca 0.12 -2.16 -0.04 0.00 -2.87 0.00 0.00 58.31 53.36 1tt8 n LYS 108 Cb 0.41 -1.30 0.17 0.00 -1.84 0.00 0.00 35.03 32.47 1tt8 n LYS 108 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1tt8 h LEU 109 N 0.00 0.43 0.00 -0.35 3.38 -1.71 -3.48 115.31 113.58 1tt8 h LEU 109 Ca 0.00 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1tt8 h LEU 109 Cb 0.87 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1tt8 h LEU 109 CO 0.00 0.77 0.00 0.61 0.09 0.00 0.00 178.44 179.91 1tt8 n GLY 110 N -0.16 2.91 0.36 0.83 0.00 -1.26 -1.12 105.19 106.75 1tt8 n GLY 110 Ca -0.01 -0.17 0.03 0.00 0.00 0.00 0.00 46.02 45.87 1tt8 n GLY 110 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tt8 n LYS 111 N 14.00 1.45 -2.52 1.61 5.02 -1.26 -4.76 118.16 131.70 1tt8 n LYS 111 Ca 0.00 -0.67 -0.42 0.00 -2.02 0.00 0.00 58.31 55.20 1tt8 n LYS 111 Cb 0.00 -1.17 -0.03 0.00 -0.02 0.00 0.00 35.03 33.82 1tt8 n LYS 111 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1tt8 s THR 112 N -1.74 4.38 0.18 -0.18 2.01 -0.28 -4.26 115.64 115.75 1tt8 s THR 112 Ca 0.12 1.69 -0.30 0.00 0.31 0.00 0.00 61.69 63.52 1tt8 s THR 112 Cb 0.07 -4.09 -0.08 0.00 0.01 0.00 0.00 72.50 68.41 1tt8 s THR 112 CO 0.08 0.02 1.11 -2.16 -0.69 0.00 0.00 174.62 172.98 1tt8 s PRO 113 N 2.02 4.58 0.53 4.92 0.04 -1.26 -4.87 135.00 140.96 1tt8 s PRO 113 Ca 0.54 1.73 -0.21 0.00 0.04 0.00 0.00 61.00 63.10 1tt8 s PRO 113 Cb -0.23 -3.28 -0.06 0.00 0.04 0.00 0.00 34.50 30.97 1tt8 s PRO 113 CO 0.22 0.06 1.19 -0.11 0.04 0.00 0.00 177.00 178.39 1tt8 n LEU 114 N 2.40 4.46 0.00 -3.56 7.94 -1.26 -4.97 117.00 122.02 1tt8 n LEU 114 Ca 0.03 0.95 0.00 0.00 -1.11 0.00 0.00 56.01 55.88 1tt8 n LEU 114 Cb 0.46 -1.48 0.00 0.00 0.53 0.00 0.00 43.42 42.93 1tt8 n LEU 114 CO 0.54 -1.08 0.00 0.61 -1.11 0.00 0.00 177.39 176.35 1tt8 n GLY 115 N 0.97 0.46 0.31 -3.96 0.00 -1.26 -4.40 105.19 97.32 1tt8 n GLY 115 Ca 0.11 -0.76 0.19 0.00 0.00 0.00 0.00 46.02 45.55 1tt8 n GLY 115 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1tt8 h ARG 116 N 0.00 0.00 0.00 1.61 3.08 -1.93 -2.10 114.38 115.04 1tt8 h ARG 116 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1tt8 h ARG 116 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1tt8 h ARG 116 CO 0.00 0.02 0.02 0.10 -1.07 0.00 0.00 179.97 179.04 1tt8 h TYR 117 N 0.00 0.00 0.00 3.04 -0.00 -1.96 -0.03 116.97 118.02 1tt8 h TYR 117 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1tt8 h TYR 117 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.83 1tt8 h TYR 117 CO 0.00 0.00 -0.37 1.28 -0.00 0.00 0.00 178.16 179.07 1tt8 n LEU 118 N -2.91 0.50 -3.42 0.10 4.77 -0.79 -4.51 117.00 110.74 1tt8 n LEU 118 Ca -0.03 0.26 -0.27 0.00 -0.03 0.00 0.00 56.01 55.95 1tt8 n LEU 118 Cb 0.09 -0.29 -0.08 0.00 -2.33 0.00 0.00 43.42 40.80 1tt8 n LEU 118 CO 0.18 -0.00 0.00 0.49 -1.33 0.00 0.00 177.39 176.72 1tt8 n PHE 119 N -1.81 2.89 1.30 -1.77 3.01 -0.02 -4.92 117.46 116.13 1tt8 n PHE 119 Ca 0.05 -4.06 0.14 0.00 1.01 0.00 0.00 57.45 54.59 1tt8 n PHE 119 Cb 0.38 -0.52 0.69 0.00 -0.01 0.00 0.00 39.48 40.03 1tt8 n PHE 119 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1tt8 n THR 120 N 1.05 0.10 -0.97 4.37 -2.24 -1.26 -2.80 114.28 112.53 1tt8 n THR 120 Ca 0.28 0.02 0.06 0.00 -2.27 0.00 0.00 64.05 62.15 1tt8 n THR 120 Cb 0.43 -0.57 0.09 0.00 -2.10 0.00 0.00 70.33 68.18 1tt8 n THR 120 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1tt8 n SER 121 N -1.29 1.92 -4.11 3.42 3.41 -1.26 -5.03 113.62 110.68 1tt8 n SER 121 Ca 0.13 -2.67 -0.27 0.00 -0.26 0.00 0.00 58.87 55.80 1tt8 n SER 121 Cb 0.22 -0.30 -0.17 0.00 -0.26 0.00 0.00 64.21 63.71 1tt8 n SER 121 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1tt8 s SER 122 N -2.18 2.24 0.43 4.04 0.01 -1.12 -5.00 113.70 112.11 1tt8 s SER 122 Ca 0.21 -0.38 -0.25 0.00 1.31 0.00 0.00 55.95 56.83 1tt8 s SER 122 Cb 0.18 -0.92 -0.08 0.00 0.21 0.00 0.00 66.02 65.41 1tt8 s SER 122 CO 0.02 0.10 1.33 0.42 0.41 0.00 0.00 173.24 175.52 1tt8 s THR 123 N 0.41 2.47 -0.13 1.44 -4.23 -1.26 -4.76 115.64 109.57 1tt8 s THR 123 Ca -0.13 0.41 0.02 0.00 -1.18 0.00 0.00 61.69 60.81 1tt8 s THR 123 Cb -0.15 -3.24 -0.00 0.00 1.34 0.00 0.00 72.50 70.45 1tt8 s THR 123 CO 0.05 0.05 -0.19 -0.22 -0.54 0.00 0.00 174.62 173.77 1tt8 s LEU 124 N -2.60 2.33 0.26 4.79 1.98 -1.26 -0.86 118.68 123.33 1tt8 s LEU 124 Ca 0.59 -0.50 0.03 0.00 -2.89 0.00 0.00 54.13 51.35 1tt8 s LEU 124 Cb -0.39 -1.50 -0.05 0.00 0.66 0.00 0.00 46.19 44.90 1tt8 s LEU 124 CO 0.50 0.11 0.05 0.28 -1.89 0.00 0.00 176.35 175.41 1tt8 s THR 125 N 0.63 0.85 -0.13 3.68 -1.32 -0.33 -4.97 115.64 114.04 1tt8 s THR 125 Ca -0.10 -2.01 0.01 0.00 -1.21 0.00 0.00 61.69 58.38 1tt8 s THR 125 Cb -0.16 -2.55 0.02 0.00 -1.51 0.00 0.00 72.50 68.29 1tt8 s THR 125 CO 0.03 -0.13 -0.15 -0.60 -2.21 0.00 0.00 174.62 171.56 1tt8 s ARG 126 N -3.94 2.28 0.14 7.08 3.52 -1.26 -0.22 118.95 126.55 1tt8 s ARG 126 Ca 0.34 -0.57 -0.08 0.00 -0.13 0.00 0.00 55.73 55.30 1tt8 s ARG 126 Cb 0.07 -2.01 -0.04 0.00 -1.56 0.00 0.00 34.95 31.42 1tt8 s ARG 126 CO 0.12 -0.15 1.39 -0.44 -0.81 0.00 0.00 175.30 175.42 1tt8 h ASP 127 N 7.73 0.76 -4.99 -2.12 3.32 -0.98 -3.48 116.42 116.66 1tt8 h ASP 127 Ca -0.35 -0.47 0.06 0.00 0.02 0.00 0.00 57.03 56.30 1tt8 h ASP 127 Cb 1.16 -0.22 -0.10 0.00 0.22 0.00 0.00 39.33 40.39 1tt8 h ASP 127 CO 0.51 1.24 0.31 0.72 -1.72 0.00 0.00 179.24 180.30 1tt8 s PHE 128 N -3.81 -0.34 -0.02 4.55 -0.12 -1.24 -5.01 117.98 112.00 1tt8 s PHE 128 Ca -0.08 0.05 0.01 0.00 -0.05 0.00 0.00 56.93 56.85 1tt8 s PHE 128 Cb 0.10 0.61 0.01 0.00 -0.63 0.00 0.00 43.02 43.12 1tt8 s PHE 128 CO 0.87 -0.91 -0.03 -1.50 -0.05 0.00 0.00 175.22 173.61 1tt8 s ILE 129 N -3.61 0.33 0.11 -4.49 2.07 -1.26 -2.73 121.20 111.62 1tt8 s ILE 129 Ca 0.06 -0.07 0.09 0.00 -1.41 0.00 0.00 60.65 59.32 1tt8 s ILE 129 Cb -0.03 -0.35 -0.04 0.00 0.13 0.00 0.00 42.46 42.18 1tt8 s ILE 129 CO -0.04 0.15 -0.17 -1.61 -1.91 0.00 0.00 174.94 171.35 1tt8 s GLU 130 N 0.56 1.82 0.07 3.50 2.02 0.87 -4.54 118.70 122.99 1tt8 s GLU 130 Ca -0.06 -1.16 0.09 0.00 0.02 0.00 0.00 54.97 53.86 1tt8 s GLU 130 Cb -0.09 -2.13 -0.03 0.00 0.10 0.00 0.00 34.13 31.97 1tt8 s GLU 130 CO -0.01 0.48 -0.25 0.42 0.02 0.00 0.00 175.26 175.92 1tt8 s ILE 131 N -1.14 2.07 0.22 -1.63 -1.09 0.26 -0.42 121.20 119.48 1tt8 s ILE 131 Ca 0.18 -1.48 -0.04 0.00 -2.23 0.00 0.00 60.65 57.08 1tt8 s ILE 131 Cb -0.11 -1.80 -0.03 0.00 -1.58 0.00 0.00 42.46 38.94 1tt8 s ILE 131 CO 0.10 0.23 0.25 -0.83 -1.23 0.00 0.00 174.94 173.47 1tt8 s GLY 132 N -1.52 1.21 -0.09 6.18 0.00 -0.37 -1.68 107.32 111.05 1tt8 s GLY 132 Ca 0.11 -1.46 -0.15 0.00 0.00 0.00 0.00 44.72 43.22 1tt8 s GLY 132 CO 0.03 -1.16 0.39 -1.60 0.00 0.00 0.00 173.10 170.76 1tt8 s ARG 133 N -4.05 0.58 -0.18 2.90 3.52 -1.26 -0.79 118.95 119.68 1tt8 s ARG 133 Ca 0.34 0.26 -0.13 0.00 -0.13 0.00 0.00 55.73 56.07 1tt8 s ARG 133 Cb 0.04 0.27 0.05 0.00 -1.56 0.00 0.00 34.95 33.76 1tt8 s ARG 133 CO 0.12 -0.12 0.46 0.34 -0.81 0.00 0.00 175.30 175.29 1tt8 s ASP 134 N -0.45 -0.54 -1.42 -2.12 -1.08 -0.17 -4.66 116.67 106.23 1tt8 s ASP 134 Ca -0.06 0.96 -0.06 0.00 -0.52 0.00 0.00 52.55 52.87 1tt8 s ASP 134 Cb -0.03 0.90 0.03 0.00 -1.46 0.00 0.00 42.92 42.35 1tt8 s ASP 134 CO 0.03 -0.18 0.51 0.00 0.52 0.00 0.00 175.17 176.05 1tt8 n ALA 135 N 3.67 -0.99 -0.85 3.66 0.00 -1.26 -0.67 120.51 124.07 1tt8 n ALA 135 Ca -0.19 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1tt8 n ALA 135 Cb 0.56 -3.27 0.00 0.00 0.00 0.00 0.00 19.45 16.74 1tt8 n ALA 135 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tt8 n GLY 136 N -1.33 0.90 3.54 0.00 0.00 -1.26 -5.03 105.19 102.00 1tt8 n GLY 136 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 1tt8 n GLY 136 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tt8 s LEU 137 N 0.00 3.15 0.29 0.99 1.43 0.16 -5.08 118.68 119.61 1tt8 s LEU 137 Ca 0.00 -0.08 -0.23 0.00 -1.03 0.00 0.00 54.13 52.78 1tt8 s LEU 137 Cb 0.00 -1.71 -0.09 0.00 0.03 0.00 0.00 46.19 44.42 1tt8 s LEU 137 CO 0.00 0.29 0.86 0.26 0.23 0.00 0.00 176.35 177.98 1tt8 s TRP 138 N -0.34 3.67 0.16 0.29 0.52 -1.26 -1.00 118.94 120.98 1tt8 s TRP 138 Ca 0.05 1.62 0.00 0.00 0.02 0.00 0.00 56.10 57.79 1tt8 s TRP 138 Cb -0.12 -2.80 -0.04 0.00 -1.15 0.00 0.00 33.47 29.35 1tt8 s TRP 138 CO 0.02 0.25 0.04 0.20 0.02 0.00 0.00 176.95 177.49 1tt8 s GLY 139 N -1.65 1.17 0.05 0.98 0.00 0.03 -1.05 107.32 106.86 1tt8 s GLY 139 Ca 0.48 -1.57 -0.04 0.00 0.00 0.00 0.00 44.72 43.59 1tt8 s GLY 139 CO 0.22 -1.45 0.06 1.09 0.00 0.00 0.00 173.10 173.02 1tt8 s ARG 140 N -4.00 0.64 -0.03 2.90 1.70 0.51 -1.23 118.95 119.43 1tt8 s ARG 140 Ca 0.26 -0.98 -0.01 0.00 -0.47 0.00 0.00 55.73 54.53 1tt8 s ARG 140 Cb 0.07 0.24 0.03 0.00 -0.57 0.00 0.00 34.95 34.72 1tt8 s ARG 140 CO 0.04 -0.15 0.06 0.50 -1.08 0.00 0.00 175.30 174.66 1tt8 s ARG 141 N -3.36 -0.05 -0.02 3.89 3.52 0.44 -0.53 118.95 122.84 1tt8 s ARG 141 Ca 0.02 0.31 0.04 0.00 -0.13 0.00 0.00 55.73 55.96 1tt8 s ARG 141 Cb 0.03 -0.37 -0.01 0.00 -1.56 0.00 0.00 34.95 33.05 1tt8 s ARG 141 CO -0.08 -0.25 -0.12 -1.12 -0.81 0.00 0.00 175.30 172.91 1tt8 s SER 142 N 1.66 1.50 -0.42 -2.12 0.01 0.25 -0.09 113.70 114.49 1tt8 s SER 142 Ca -0.02 -0.23 -0.17 0.00 1.31 0.00 0.00 55.95 56.84 1tt8 s SER 142 Cb -0.12 -0.24 0.02 0.00 0.21 0.00 0.00 66.02 65.89 1tt8 s SER 142 CO -0.03 0.14 0.43 -0.60 0.41 0.00 0.00 173.24 173.58 1tt8 s ARG 143 N -0.16 3.08 0.25 12.44 3.52 -1.11 -1.12 118.95 135.85 1tt8 s ARG 143 Ca 0.02 -0.79 0.01 0.00 -0.13 0.00 0.00 55.73 54.85 1tt8 s ARG 143 Cb -0.06 -3.97 -0.04 0.00 -1.56 0.00 0.00 34.95 29.32 1tt8 s ARG 143 CO -0.00 -0.85 0.42 -0.51 -0.81 0.00 0.00 175.30 173.55 1tt8 s LEU 144 N 2.10 4.20 -0.07 -0.88 1.43 -0.06 -0.28 118.68 125.11 1tt8 s LEU 144 Ca 0.11 0.33 0.02 0.00 -1.03 0.00 0.00 54.13 53.57 1tt8 s LEU 144 Cb -0.17 -3.13 0.02 0.00 0.03 0.00 0.00 46.19 42.93 1tt8 s LEU 144 CO 0.13 -0.11 -0.11 -0.13 0.23 0.00 0.00 176.35 176.36 1tt8 s ARG 145 N -3.72 1.68 -0.21 1.70 0.52 0.70 -0.88 118.95 118.74 1tt8 s ARG 145 Ca 0.38 -0.39 -0.04 0.00 -0.52 0.00 0.00 55.73 55.16 1tt8 s ARG 145 Cb -0.10 -1.45 -0.01 0.00 0.52 0.00 0.00 34.95 33.91 1tt8 s ARG 145 CO 0.31 -0.03 -0.03 -0.51 0.02 0.00 0.00 175.30 175.06 1tt8 s LEU 146 N 0.86 3.00 -1.72 2.53 1.43 -0.43 -1.19 118.68 123.15 1tt8 s LEU 146 Ca -0.11 -0.33 -0.18 0.00 -1.03 0.00 0.00 54.13 52.48 1tt8 s LEU 146 Cb -0.15 -1.76 0.16 0.00 0.03 0.00 0.00 46.19 44.47 1tt8 s LEU 146 CO 0.01 0.01 0.69 -1.20 0.23 0.00 0.00 176.35 176.10 1tt8 n SER 147 N 4.59 -2.63 0.00 2.29 7.64 -0.04 -1.25 113.62 124.22 1tt8 n SER 147 Ca -0.18 -1.07 0.00 0.00 1.01 0.00 0.00 58.87 58.63 1tt8 n SER 147 Cb 0.51 -2.48 0.00 0.00 -1.01 0.00 0.00 64.21 61.24 1tt8 n SER 147 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1tt8 n GLY 148 N -1.41 1.23 3.61 0.23 0.00 -1.26 -5.01 105.19 102.57 1tt8 n GLY 148 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 1tt8 n GLY 148 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tt8 s LYS 149 N -0.40 3.54 0.45 1.61 1.02 -0.38 -4.96 119.74 120.62 1tt8 s LYS 149 Ca 0.00 -0.42 -0.20 0.00 0.02 0.00 0.00 55.97 55.37 1tt8 s LYS 149 Cb 0.00 -2.97 -0.10 0.00 -0.52 0.00 0.00 37.83 34.24 1tt8 s LYS 149 CO 0.00 0.41 0.96 -1.25 -0.92 0.00 0.00 175.35 174.55 1tt8 s PRO 150 N -0.07 4.14 0.09 -1.68 0.04 -1.26 -1.32 135.00 134.95 1tt8 s PRO 150 Ca 0.04 1.09 -0.13 0.00 0.04 0.00 0.00 61.00 62.04 1tt8 s PRO 150 Cb -0.13 -2.16 0.02 0.00 0.04 0.00 0.00 34.50 32.27 1tt8 s PRO 150 CO 0.02 -0.11 0.31 -0.48 0.04 0.00 0.00 177.00 176.78 1tt8 s LEU 151 N -3.42 0.83 -0.14 -3.56 2.34 -0.06 -4.35 118.68 110.32 1tt8 s LEU 151 Ca 0.61 -0.37 -0.02 0.00 0.06 0.00 0.00 54.13 54.41 1tt8 s LEU 151 Cb -0.10 1.47 -0.03 0.00 -0.56 0.00 0.00 46.19 46.98 1tt8 s LEU 151 CO 0.18 -0.75 -0.06 -0.22 -1.06 0.00 0.00 176.35 174.44 1tt8 s LEU 152 N -2.60 3.16 -0.10 1.48 1.98 0.04 -0.88 118.68 121.76 1tt8 s LEU 152 Ca 0.01 -0.14 0.00 0.00 -2.89 0.00 0.00 54.13 51.12 1tt8 s LEU 152 Cb 0.02 -1.74 0.02 0.00 0.66 0.00 0.00 46.19 45.15 1tt8 s LEU 152 CO -0.09 0.20 -0.10 -0.22 -1.89 0.00 0.00 176.35 174.25 1tt8 s LEU 153 N 0.17 1.39 -0.06 -0.68 2.96 -0.27 -0.53 118.68 121.66 1tt8 s LEU 153 Ca -0.03 -0.33 0.05 0.00 -0.22 0.00 0.00 54.13 53.61 1tt8 s LEU 153 Cb -0.14 -0.88 -0.01 0.00 0.50 0.00 0.00 46.19 45.65 1tt8 s LEU 153 CO 0.03 -0.06 -0.23 -0.89 -1.32 0.00 0.00 176.35 173.88 1tt8 s THR 154 N 1.36 2.24 -0.01 3.68 2.01 0.19 -0.58 115.64 124.53 1tt8 s THR 154 Ca -0.01 -1.00 0.02 0.00 0.31 0.00 0.00 61.69 61.01 1tt8 s THR 154 Cb -0.14 -1.83 -0.00 0.00 0.01 0.00 0.00 72.50 70.54 1tt8 s THR 154 CO -0.05 0.57 -0.07 -1.61 -0.69 0.00 0.00 174.62 172.77 1tt8 s GLU 155 N -0.17 0.61 -0.12 4.92 2.02 0.31 -0.61 118.70 125.65 1tt8 s GLU 155 Ca -0.03 -0.24 0.03 0.00 0.02 0.00 0.00 54.97 54.75 1tt8 s GLU 155 Cb -0.14 -0.59 0.00 0.00 0.10 0.00 0.00 34.13 33.51 1tt8 s GLU 155 CO 0.04 0.13 -0.23 -1.17 0.02 0.00 0.00 175.26 174.05 1tt8 s LEU 156 N -0.07 2.11 -0.40 1.80 2.96 0.28 -0.36 118.68 125.00 1tt8 s LEU 156 Ca 0.01 -0.58 -0.22 0.00 -0.22 0.00 0.00 54.13 53.13 1tt8 s LEU 156 Cb -0.04 -1.43 0.01 0.00 0.50 0.00 0.00 46.19 45.24 1tt8 s LEU 156 CO -0.00 0.12 0.69 -0.36 -1.32 0.00 0.00 176.35 175.49 1tt8 s PHE 157 N 0.55 3.09 0.73 5.38 0.40 -0.22 -0.69 117.98 127.22 1tt8 s PHE 157 Ca -0.14 0.24 -0.11 0.00 -0.60 0.00 0.00 56.93 56.32 1tt8 s PHE 157 Cb -0.17 -3.35 0.03 0.00 0.51 0.00 0.00 43.02 40.04 1tt8 s PHE 157 CO 0.04 -0.78 1.09 -0.51 0.70 0.00 0.00 175.22 175.75 1tt8 s LEU 158 N 2.93 2.85 0.54 -0.37 1.43 0.01 -4.35 118.68 121.73 1tt8 s LEU 158 Ca 0.26 1.29 0.23 0.00 -1.03 0.00 0.00 54.13 54.88 1tt8 s LEU 158 Cb -0.14 -4.05 1.42 0.00 0.03 0.00 0.00 46.19 43.45 1tt8 s LEU 158 CO 0.18 -1.53 2.07 -0.65 0.23 0.00 0.00 176.35 176.65 1tt8 h PRO 159 N -0.78 0.00 -0.00 1.29 0.11 -1.86 -0.70 132.00 130.06 1tt8 h PRO 159 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1tt8 h PRO 159 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1tt8 h PRO 159 CO 0.61 0.00 -0.07 0.00 -0.21 0.00 0.00 178.00 178.33 1tt8 n ALA 160 N -2.53 2.61 -1.29 -0.75 0.00 -1.26 -4.82 120.51 112.46 1tt8 n ALA 160 Ca 0.04 -0.18 -0.31 0.00 0.00 0.00 0.00 53.44 52.98 1tt8 n ALA 160 Cb 0.37 -1.41 0.09 0.00 0.00 0.00 0.00 19.45 18.50 1tt8 n ALA 160 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1tt8 s SER 161 N -2.69 4.53 0.00 0.00 1.04 -0.27 -4.90 113.70 111.41 1tt8 s SER 161 Ca 0.23 1.77 0.22 0.00 0.48 0.00 0.00 55.95 58.65 1tt8 s SER 161 Cb 0.20 -2.49 1.33 0.00 0.10 0.00 0.00 66.02 65.16 1tt8 s SER 161 CO 0.50 -2.01 1.71 -0.81 0.98 0.00 0.00 173.24 173.61 1tt8 n PRO 162 N -3.50 0.72 0.20 4.02 -0.04 -1.26 -2.82 135.00 132.31 1tt8 n PRO 162 Ca 0.09 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.61 1tt8 n PRO 162 Cb 0.53 -1.48 0.42 0.00 -0.04 0.00 0.00 33.50 32.93 1tt8 n PRO 162 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1tt8 h LEU 163 N 0.00 0.00 -1.81 1.53 4.07 -1.92 -3.51 115.31 113.67 1tt8 h LEU 163 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1tt8 h LEU 163 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1tt8 h LEU 163 CO 0.00 0.33 0.00 -1.22 -1.08 0.00 0.00 178.44 176.47