#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1toc s VAL 17 N 0.00 3.65 -0.11 1.39 1.01 0.11 -2.77 120.40 123.68 1toc s VAL 17 Ca 0.00 1.24 0.00 0.00 0.00 0.00 0.00 61.98 63.22 1toc s VAL 17 Cb 0.00 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.59 1toc s VAL 17 CO 0.00 0.13 0.00 -0.62 0.00 0.00 0.00 175.10 174.61 1toc n GLU 18 N 3.50 -1.67 0.00 2.72 -0.58 -1.26 -2.08 120.64 121.27 1toc n GLU 18 Ca 0.08 0.46 0.00 0.00 -0.42 0.00 0.00 57.16 57.29 1toc n GLU 18 Cb 0.44 -4.73 0.00 0.00 -0.57 0.00 0.00 31.44 26.58 1toc n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1toc n GLY 19 N 0.32 -0.36 3.39 0.62 0.00 -1.11 -4.81 105.19 103.23 1toc n GLY 19 Ca -0.01 -1.60 -0.10 0.00 0.00 0.00 0.00 46.02 44.31 1toc n GLY 19 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1toc s GLN 20 N 0.02 1.18 0.18 1.61 -2.07 0.07 -4.92 119.66 115.73 1toc s GLN 20 Ca 0.00 -0.80 -0.33 0.00 -1.82 0.00 0.00 55.36 52.41 1toc s GLN 20 Cb 0.00 0.48 -0.14 0.00 -1.09 0.00 0.00 33.01 32.26 1toc s GLN 20 CO 0.00 -0.48 1.52 -0.25 -1.32 0.00 0.00 175.29 174.76 1toc n ASP 21 N -0.27 2.92 -4.75 12.60 8.00 -1.26 0.05 116.55 133.84 1toc n ASP 21 Ca -0.13 1.10 -0.39 0.00 0.71 0.00 0.00 54.79 56.08 1toc n ASP 21 Cb 0.63 -1.42 -0.06 0.00 -0.02 0.00 0.00 41.12 40.26 1toc n ASP 21 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1toc s ALA 22 N 0.60 3.47 0.51 2.24 0.00 -0.97 -4.74 121.76 122.87 1toc s ALA 22 Ca 0.76 -0.01 -0.23 0.00 0.00 0.00 0.00 51.96 52.49 1toc s ALA 22 Cb -0.68 -2.75 -0.06 0.00 0.00 0.00 0.00 23.12 19.63 1toc s ALA 22 CO 0.42 0.10 1.34 0.39 0.00 0.00 0.00 175.76 178.00 1toc n GLU 23 N 3.06 1.80 -1.67 0.00 1.02 -1.26 -4.83 120.64 118.76 1toc n GLU 23 Ca -0.06 0.65 -0.47 0.00 -0.02 0.00 0.00 57.16 57.26 1toc n GLU 23 Cb 0.51 -2.53 -0.04 0.00 -0.02 0.00 0.00 31.44 29.35 1toc n GLU 23 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1toc n VAL 24 N -0.78 0.18 -0.94 2.62 0.31 -1.26 -1.09 118.33 117.37 1toc n VAL 24 Ca 0.09 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1toc n VAL 24 Cb 0.43 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 1toc n VAL 24 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1toc n GLY 25 N 3.68 0.91 0.30 2.92 0.00 -1.26 -4.91 105.19 106.83 1toc n GLY 25 Ca 0.19 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.26 1toc n GLY 25 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1toc h LEU 26 N 0.00 0.39 -6.34 0.99 5.85 -1.46 -3.32 115.31 111.42 1toc h LEU 26 Ca 0.00 -0.01 -0.59 0.00 0.84 0.00 0.00 57.88 58.12 1toc h LEU 26 Cb 0.00 -0.10 -0.40 0.00 0.37 0.00 0.00 40.66 40.54 1toc h LEU 26 CO 0.00 0.28 -0.88 -0.24 -0.34 0.00 0.00 178.44 177.26 1toc n SER 27 N -4.49 1.13 0.13 1.25 2.88 -1.26 -4.96 113.62 108.29 1toc n SER 27 Ca 0.02 -2.82 0.08 0.00 -1.33 0.00 0.00 58.87 54.82 1toc n SER 27 Cb 0.07 -0.64 0.44 0.00 -0.75 0.00 0.00 64.21 63.33 1toc n SER 27 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1toc n PRO 28 N 1.84 0.10 0.00 -1.46 -0.04 -1.25 -1.49 135.00 132.70 1toc n PRO 28 Ca 0.25 0.60 0.11 0.00 -0.04 0.00 0.00 63.50 64.42 1toc n PRO 28 Cb 0.46 -1.88 0.14 0.00 -0.04 0.00 0.00 33.50 32.18 1toc n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1toc n TRP 29 N -2.07 0.00 -1.73 0.54 2.14 -0.84 -1.05 117.44 114.43 1toc n TRP 29 Ca -0.01 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.14 1toc n TRP 29 Cb 0.06 -0.13 -0.01 0.00 -0.81 0.00 0.00 31.31 30.42 1toc n TRP 29 CO 0.00 0.00 0.00 0.94 2.07 0.00 0.00 177.69 180.70 1toc n GLN 30 N -1.19 2.42 -3.64 -2.67 -0.06 -0.56 -0.23 117.38 111.46 1toc n GLN 30 Ca 0.07 0.85 -0.27 0.00 -2.00 0.00 0.00 57.00 55.65 1toc n GLN 30 Cb 0.35 -2.54 -0.17 0.00 -4.06 0.00 0.00 30.24 23.83 1toc n GLN 30 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 1toc s VAL 31 N -0.67 0.08 0.36 1.69 1.01 0.31 -3.18 120.40 120.00 1toc s VAL 31 Ca 0.59 -0.34 -0.27 0.00 0.00 0.00 0.00 61.98 61.96 1toc s VAL 31 Cb -0.54 -0.74 -0.09 0.00 0.00 0.00 0.00 36.38 35.01 1toc s VAL 31 CO 0.57 -0.31 1.22 -0.32 0.00 0.00 0.00 175.10 176.26 1toc s MET 32 N 2.06 4.21 -0.43 2.72 1.75 -0.29 -0.86 119.30 128.46 1toc s MET 32 Ca 0.02 1.99 -0.07 0.00 -1.25 0.00 0.00 55.69 56.38 1toc s MET 32 Cb -0.16 -2.88 0.10 0.00 2.84 0.00 0.00 34.83 34.73 1toc s MET 32 CO -0.12 -0.23 0.26 -1.17 -0.65 0.00 0.00 175.02 173.12 1toc s LEU 33 N -2.13 5.32 0.33 4.11 1.98 -1.25 -2.62 118.68 124.41 1toc s LEU 33 Ca 0.53 -1.80 -0.04 0.00 -2.89 0.00 0.00 54.13 49.93 1toc s LEU 33 Cb -0.35 -1.93 -0.05 0.00 0.66 0.00 0.00 46.19 44.52 1toc s LEU 33 CO 0.45 -0.58 0.58 0.12 -1.89 0.00 0.00 176.35 175.03 1toc s PHE 34 N 1.31 3.49 -0.18 5.38 2.19 0.33 -1.84 117.98 128.66 1toc s PHE 34 Ca 0.05 0.60 -0.00 0.00 0.33 0.00 0.00 56.93 57.91 1toc s PHE 34 Cb -0.24 -2.09 0.01 0.00 -1.31 0.00 0.00 43.02 39.39 1toc s PHE 34 CO -0.01 0.10 -0.15 0.50 1.83 0.00 0.00 175.22 177.50 1toc s ARG 35 N -3.87 3.15 0.08 10.12 3.52 -0.39 -0.39 118.95 131.17 1toc s ARG 35 Ca 0.44 -0.76 -0.16 0.00 -0.13 0.00 0.00 55.73 55.12 1toc s ARG 35 Cb -0.10 -2.70 -0.04 0.00 -1.56 0.00 0.00 34.95 30.55 1toc s ARG 35 CO 0.33 -0.15 1.27 1.63 -0.81 0.00 0.00 175.30 177.57 1toc n LYS 36 N 4.53 -0.23 -3.61 5.12 5.02 0.85 -2.48 118.16 127.36 1toc n LYS 36 Ca -0.20 1.25 -0.21 0.00 -2.02 0.00 0.00 58.31 57.14 1toc n LYS 36 Cb 0.51 -1.85 -0.16 0.00 -0.02 0.00 0.00 35.03 33.50 1toc n LYS 36 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1toc s SER 37 N -4.32 1.51 0.79 4.39 0.01 -1.26 -3.28 113.70 111.53 1toc s SER 37 Ca -0.06 -0.16 -0.11 0.00 1.31 0.00 0.00 55.95 56.93 1toc s SER 37 Cb 0.06 0.04 0.06 0.00 0.21 0.00 0.00 66.02 66.39 1toc s SER 37 CO 0.32 -0.30 1.09 -2.16 0.41 0.00 0.00 173.24 172.60 1toc s PRO 37 N 2.22 2.16 -0.88 12.44 0.04 -1.26 -5.04 135.00 144.68 1toc s PRO 37 Ca 0.04 0.96 -0.25 0.00 0.04 0.00 0.00 61.00 61.80 1toc s PRO 37 Cb -0.14 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.52 1toc s PRO 37 CO -0.08 -1.66 1.51 -0.65 0.04 0.00 0.00 177.00 176.17 1toc s GLN 38 N -4.98 3.22 0.24 4.56 -0.21 -1.20 -4.59 119.66 116.70 1toc s GLN 38 Ca 0.61 -0.56 0.01 0.00 0.02 0.00 0.00 55.36 55.44 1toc s GLN 38 Cb -0.16 -4.86 -0.04 0.00 1.00 0.00 0.00 33.01 28.95 1toc s GLN 38 CO 0.56 -2.41 0.17 -1.83 -2.12 0.00 0.00 175.29 169.65 1toc s GLU 39 N 5.71 1.38 -0.24 2.91 -1.05 -1.04 -4.97 118.70 121.39 1toc s GLU 39 Ca 0.48 -1.75 -0.17 0.00 -0.15 0.00 0.00 54.97 53.38 1toc s GLU 39 Cb -0.05 0.24 -0.03 0.00 -0.44 0.00 0.00 34.13 33.85 1toc s GLU 39 CO 0.02 -0.46 0.45 -1.17 0.95 0.00 0.00 175.26 175.06 1toc s LEU 40 N -3.23 4.08 -0.23 1.83 2.96 -1.26 -1.26 118.68 121.57 1toc s LEU 40 Ca 0.39 0.48 -0.02 0.00 -0.22 0.00 0.00 54.13 54.76 1toc s LEU 40 Cb 0.06 -2.58 -0.19 0.00 0.50 0.00 0.00 46.19 43.99 1toc s LEU 40 CO 0.16 -0.20 -0.09 0.18 -1.32 0.00 0.00 176.35 175.08 1toc n LEU 41 N 5.16 2.78 0.00 -0.68 4.32 -0.76 -4.97 117.00 122.84 1toc n LEU 41 Ca -0.06 -0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.93 1toc n LEU 41 Cb 0.50 -0.95 0.00 0.00 -1.62 0.00 0.00 43.42 41.35 1toc n LEU 41 CO 0.40 0.87 0.00 0.00 -1.22 0.00 0.00 177.39 177.44 1toc s GLY 43 N 0.00 -0.20 -0.07 0.00 0.00 -1.04 -3.90 107.32 102.11 1toc s GLY 43 Ca 0.00 0.03 -0.32 0.00 0.00 0.00 0.00 44.72 44.43 1toc s GLY 43 CO 0.00 -0.02 1.38 0.00 0.00 0.00 0.00 173.10 174.46 1toc s ALA 44 N -3.42 -2.39 0.10 3.20 0.00 -0.04 -3.85 121.76 115.35 1toc s ALA 44 Ca 0.12 0.90 0.03 0.00 0.00 0.00 0.00 51.96 53.00 1toc s ALA 44 Cb -0.02 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.31 1toc s ALA 44 CO 0.03 -1.04 0.11 -1.54 0.00 0.00 0.00 175.76 173.33 1toc s SER 45 N -2.95 5.66 -0.58 0.00 1.04 -0.74 0.11 113.70 116.25 1toc s SER 45 Ca 0.14 0.01 -0.14 0.00 0.48 0.00 0.00 55.95 56.44 1toc s SER 45 Cb 0.06 -1.55 0.14 0.00 0.10 0.00 0.00 66.02 64.78 1toc s SER 45 CO -0.06 0.15 0.51 -0.22 0.98 0.00 0.00 173.24 174.60 1toc s LEU 46 N -2.58 6.17 0.15 2.42 0.20 0.68 -0.78 118.68 124.94 1toc s LEU 46 Ca 0.30 -1.99 0.24 0.00 0.69 0.00 0.00 54.13 53.38 1toc s LEU 46 Cb -0.12 -2.16 0.92 0.00 -0.43 0.00 0.00 46.19 44.40 1toc s LEU 46 CO 0.23 -0.77 1.75 2.30 -0.29 0.00 0.00 176.35 179.57 1toc n ILE 47 N 4.93 0.59 -3.64 6.68 -5.35 -1.01 -3.06 119.36 118.51 1toc n ILE 47 Ca -0.08 -0.00 -0.03 0.00 -0.27 0.00 0.00 62.75 62.37 1toc n ILE 47 Cb 0.41 -0.78 -0.04 0.00 -1.74 0.00 0.00 39.64 37.48 1toc n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1toc s SER 48 N -3.89 -0.07 0.48 7.28 1.04 -1.13 -4.66 113.70 112.76 1toc s SER 48 Ca 0.09 0.08 0.36 0.00 0.48 0.00 0.00 55.95 56.96 1toc s SER 48 Cb 0.13 0.06 1.52 0.00 0.10 0.00 0.00 66.02 67.83 1toc s SER 48 CO 0.48 -0.06 1.63 -2.24 0.98 0.00 0.00 173.24 174.03 1toc h ASP 49 N 2.19 0.16 0.00 7.02 2.03 -1.89 -0.19 116.42 125.74 1toc h ASP 49 Ca -0.11 0.08 -0.00 0.00 -0.73 0.00 0.00 57.03 56.27 1toc h ASP 49 Cb 1.19 0.07 -0.00 0.00 -0.83 0.00 0.00 39.33 39.76 1toc h ASP 49 CO 0.22 -0.11 -0.03 -0.09 -1.03 0.00 0.00 179.24 178.21 1toc h ARG 50 N 0.06 0.00 -6.22 4.15 9.65 -1.92 -1.38 114.38 118.72 1toc h ARG 50 Ca 0.82 0.00 -0.54 0.00 -1.10 0.00 0.00 59.98 59.16 1toc h ARG 50 Cb 2.84 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 31.40 1toc h ARG 50 CO -0.26 0.55 -0.33 -1.58 2.80 0.00 0.00 179.97 181.15 1toc s TRP 51 N -1.94 3.48 -0.06 2.20 0.52 -0.08 -1.29 118.94 121.77 1toc s TRP 51 Ca -0.11 0.36 0.03 0.00 0.02 0.00 0.00 56.10 56.40 1toc s TRP 51 Cb -0.01 -1.87 0.01 0.00 -1.15 0.00 0.00 33.47 30.45 1toc s TRP 51 CO 0.38 0.38 -0.14 0.08 0.02 0.00 0.00 176.95 177.68 1toc s VAL 52 N -1.85 1.26 -0.23 4.03 1.01 -0.05 -2.40 120.40 122.16 1toc s VAL 52 Ca 0.39 -0.56 -0.07 0.00 0.00 0.00 0.00 61.98 61.73 1toc s VAL 52 Cb -0.11 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 1toc s VAL 52 CO 0.29 0.38 0.06 -0.22 0.00 0.00 0.00 175.10 175.61 1toc s LEU 53 N 0.54 3.50 0.30 3.92 2.96 0.04 -0.42 118.68 129.52 1toc s LEU 53 Ca -0.13 -0.14 0.04 0.00 -0.22 0.00 0.00 54.13 53.67 1toc s LEU 53 Cb -0.15 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.58 1toc s LEU 53 CO 0.04 0.03 0.18 0.28 -1.32 0.00 0.00 176.35 175.55 1toc s THR 54 N 1.26 0.25 -0.24 3.68 -1.32 -0.60 -1.78 115.64 116.88 1toc s THR 54 Ca 0.05 -2.00 -0.24 0.00 -1.21 0.00 0.00 61.69 58.28 1toc s THR 54 Cb -0.15 -2.50 -0.01 0.00 -1.51 0.00 0.00 72.50 68.34 1toc s THR 54 CO 0.03 0.00 0.81 0.00 -2.21 0.00 0.00 174.62 173.25 1toc s ALA 55 N -3.61 3.63 0.15 11.08 0.00 -1.26 -0.52 121.76 131.24 1toc s ALA 55 Ca 0.36 -0.15 -0.32 0.00 0.00 0.00 0.00 51.96 51.86 1toc s ALA 55 Cb 0.05 -3.25 -0.08 0.00 0.00 0.00 0.00 23.12 19.83 1toc s ALA 55 CO 0.19 -0.89 1.54 0.00 0.00 0.00 0.00 175.76 176.60 1toc h ALA 56 N 7.66 -0.62 0.00 0.00 0.00 -1.63 0.62 119.26 125.29 1toc h ALA 56 Ca -0.24 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1toc h ALA 56 Cb 1.10 1.29 0.00 0.00 0.00 0.00 0.00 17.79 20.18 1toc h ALA 56 CO 0.86 -1.00 0.23 -2.39 0.00 0.00 0.00 179.25 176.95 1toc n HIS 57 N -5.29 0.00 -0.06 0.00 1.44 -1.26 -0.25 115.22 109.80 1toc n HIS 57 Ca 0.00 0.00 -0.06 0.00 -2.01 0.00 0.00 57.72 55.65 1toc n HIS 57 Cb 0.29 -0.26 0.14 0.00 0.12 0.00 0.00 29.99 30.28 1toc n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1toc n LEU 59 N -4.13 2.66 -4.08 0.00 4.77 0.65 -4.90 117.00 111.98 1toc n LEU 59 Ca 0.00 -0.09 -0.32 0.00 -0.03 0.00 0.00 56.01 55.57 1toc n LEU 59 Cb 0.40 -0.79 -0.16 0.00 -2.33 0.00 0.00 43.42 40.54 1toc n LEU 59 CO 0.43 0.89 -0.50 -0.22 -1.33 0.00 0.00 177.39 176.66 1toc s LEU 60 N -6.47 2.44 0.04 2.23 2.96 -0.96 -0.90 118.68 118.01 1toc s LEU 60 Ca -0.31 -0.86 -0.27 0.00 -0.22 0.00 0.00 54.13 52.47 1toc s LEU 60 Cb 0.08 -1.42 0.09 0.00 0.50 0.00 0.00 46.19 45.44 1toc s LEU 60 CO 0.64 -0.08 0.78 -0.47 -1.32 0.00 0.00 176.35 175.90 1toc s TYR 60 N 1.28 -0.44 0.00 5.38 5.04 0.12 -4.09 117.35 124.64 1toc s TYR 60 Ca 0.00 0.35 0.00 0.00 -2.44 0.00 0.00 57.07 54.99 1toc s TYR 60 Cb -0.15 0.53 0.00 0.00 0.35 0.00 0.00 41.96 42.69 1toc s TYR 60 CO -0.10 -0.64 0.00 -2.30 -1.34 0.00 0.00 175.55 171.17 1toc n PRO 60 N -0.13 0.00 -1.37 4.97 -0.02 -1.26 -2.86 135.00 134.32 1toc n PRO 60 Ca -0.13 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.34 1toc n PRO 60 Cb 0.62 0.00 0.11 0.00 -0.02 0.00 0.00 33.50 34.21 1toc n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1toc n TRP 60 N 0.00 0.72 -3.95 6.00 8.01 -1.26 -4.97 117.44 121.99 1toc n TRP 60 Ca 0.00 -1.48 -0.26 0.00 -1.31 0.00 0.00 57.50 54.44 1toc n TRP 60 Cb 0.00 -0.24 -0.01 0.00 -2.01 0.00 0.00 31.31 29.05 1toc n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1toc n ASP 60 N -0.59 -1.04 -3.90 -0.99 9.92 -1.25 -4.93 116.55 113.78 1toc n ASP 60 Ca 0.20 -0.97 -0.30 0.00 -0.53 0.00 0.00 54.79 53.19 1toc n ASP 60 Cb 0.87 -3.20 -0.14 0.00 -0.64 0.00 0.00 41.12 38.02 1toc n ASP 60 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1toc s LYS 60 N -6.53 1.90 -0.36 -1.24 2.20 -1.14 -4.99 119.74 109.58 1toc s LYS 60 Ca 0.13 -2.59 0.00 0.00 -0.36 0.00 0.00 55.97 53.15 1toc s LYS 60 Cb -0.07 -3.14 0.13 0.00 -1.51 0.00 0.00 37.83 33.24 1toc s LYS 60 CO 0.88 -1.14 0.21 1.21 -0.36 0.00 0.00 175.35 176.15 1toc s ASN 60 N -0.30 3.19 -0.03 1.43 2.47 -1.22 0.11 114.94 120.60 1toc s ASN 60 Ca 0.18 -2.19 -0.23 0.00 0.42 0.00 0.00 52.86 51.05 1toc s ASN 60 Cb -0.23 -0.55 -0.04 0.00 -1.45 0.00 0.00 41.25 38.98 1toc s ASN 60 CO -0.02 -0.31 0.67 -0.36 -3.72 0.00 0.00 177.10 173.36 1toc s PHE 60 N 1.02 3.63 0.27 0.43 0.08 -0.08 -5.03 117.98 118.30 1toc s PHE 60 Ca 0.17 1.26 0.07 0.00 0.12 0.00 0.00 56.93 58.55 1toc s PHE 60 Cb -0.23 -2.74 -0.03 0.00 -0.57 0.00 0.00 43.02 39.45 1toc s PHE 60 CO -0.03 0.20 0.23 -0.08 -0.10 0.00 0.00 175.22 175.44 1toc s THR 60 N 0.36 4.30 0.59 0.64 -1.32 -1.26 -4.89 115.64 114.05 1toc s THR 60 Ca 0.35 -1.37 0.29 0.00 -1.21 0.00 0.00 61.69 59.76 1toc s THR 60 Cb -0.18 -3.38 0.39 0.00 -1.51 0.00 0.00 72.50 67.82 1toc s THR 60 CO 0.18 -0.31 1.80 -0.37 -2.21 0.00 0.00 174.62 173.72 1toc h VAL 61 N 1.41 0.31 -0.32 5.08 -1.51 -1.95 -1.53 116.25 117.74 1toc h VAL 61 Ca -0.48 0.00 -0.21 0.00 -1.23 0.00 0.00 66.70 64.78 1toc h VAL 61 Cb 1.24 0.51 -0.09 0.00 -2.13 0.00 0.00 31.29 30.82 1toc h VAL 61 CO 0.60 0.00 0.27 0.47 -1.23 0.00 0.00 177.57 177.69 1toc n ASP 62 N -3.66 5.77 0.00 4.19 8.00 -1.26 -3.48 116.55 126.11 1toc n ASP 62 Ca 0.12 -2.81 0.00 0.00 0.71 0.00 0.00 54.79 52.80 1toc n ASP 62 Cb 0.83 -1.03 0.00 0.00 -0.02 0.00 0.00 41.12 40.90 1toc n ASP 62 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1toc n ASP 63 N 0.63 0.00 -4.77 -2.24 9.92 -0.57 -5.00 116.55 114.53 1toc n ASP 63 Ca 0.20 0.00 -0.39 0.00 -0.53 0.00 0.00 54.79 54.07 1toc n ASP 63 Cb 0.59 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 41.01 1toc n ASP 63 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1toc s LEU 64 N -1.61 4.43 0.07 0.64 1.43 -1.23 -0.10 118.68 122.31 1toc s LEU 64 Ca 0.00 1.19 0.08 0.00 -1.03 0.00 0.00 54.13 54.38 1toc s LEU 64 Cb 0.00 -2.94 -0.03 0.00 0.03 0.00 0.00 46.19 43.25 1toc s LEU 64 CO 0.00 0.12 -0.23 -0.76 0.23 0.00 0.00 176.35 175.71 1toc s LEU 65 N -0.32 2.21 -0.34 1.79 1.43 0.48 -4.41 118.68 119.52 1toc s LEU 65 Ca 0.31 -0.60 0.02 0.00 -1.03 0.00 0.00 54.13 52.83 1toc s LEU 65 Cb -0.19 -1.06 0.09 0.00 0.03 0.00 0.00 46.19 45.06 1toc s LEU 65 CO 0.18 0.17 0.06 -0.69 0.23 0.00 0.00 176.35 176.29 1toc s VAL 66 N -0.91 2.55 -0.26 -1.59 1.01 0.23 0.12 120.40 121.56 1toc s VAL 66 Ca 0.09 -2.12 -0.22 0.00 0.00 0.00 0.00 61.98 59.73 1toc s VAL 66 Cb -0.09 -2.77 -0.01 0.00 0.00 0.00 0.00 36.38 33.51 1toc s VAL 66 CO 0.03 -0.51 0.72 -0.13 0.00 0.00 0.00 175.10 175.21 1toc s ARG 67 N 1.01 4.09 -0.07 2.72 0.52 -1.08 -1.19 118.95 124.96 1toc s ARG 67 Ca 0.07 0.66 0.01 0.00 -0.52 0.00 0.00 55.73 55.95 1toc s ARG 67 Cb -0.20 -3.67 -0.03 0.00 0.52 0.00 0.00 34.95 31.57 1toc s ARG 67 CO -0.06 -0.50 -0.08 0.42 0.02 0.00 0.00 175.30 175.09 1toc s ILE 68 N 2.70 3.62 -0.17 1.52 1.01 -1.23 -1.14 121.20 127.51 1toc s ILE 68 Ca 0.30 -0.51 -0.00 0.00 0.00 0.00 0.00 60.65 60.44 1toc s ILE 68 Cb -0.15 -2.48 0.00 0.00 0.01 0.00 0.00 42.46 39.84 1toc s ILE 68 CO 0.09 0.59 0.03 0.61 0.00 0.00 0.00 174.94 176.26 1toc n GLY 69 N 2.29 0.41 3.96 6.18 0.00 -1.19 -1.25 105.19 115.60 1toc n GLY 69 Ca -0.18 -0.75 -0.28 0.00 0.00 0.00 0.00 46.02 44.81 1toc n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1toc s LYS 70 N -4.35 0.78 0.22 1.61 1.02 -1.26 -4.12 119.74 113.64 1toc s LYS 70 Ca 0.01 -0.79 0.00 0.00 0.02 0.00 0.00 55.97 55.21 1toc s LYS 70 Cb -0.01 -2.01 0.00 0.00 -0.52 0.00 0.00 37.83 35.30 1toc s LYS 70 CO 0.02 -2.22 0.00 1.58 -0.92 0.00 0.00 175.35 173.81 1toc n HIS 71 N -3.51 -2.57 -2.43 3.18 -0.00 -1.26 -4.95 115.22 103.68 1toc n HIS 71 Ca 0.17 0.59 -0.34 0.00 -0.00 0.00 0.00 57.72 58.14 1toc n HIS 71 Cb 0.60 1.49 -0.02 0.00 -0.00 0.00 0.00 29.99 32.05 1toc n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1toc s SER 72 N -3.66 6.19 0.11 0.26 0.15 -1.26 0.45 113.70 115.94 1toc s SER 72 Ca 0.00 1.93 -0.13 0.00 0.70 0.00 0.00 55.95 58.45 1toc s SER 72 Cb 0.00 -2.56 -0.13 0.00 -1.71 0.00 0.00 66.02 61.62 1toc s SER 72 CO 0.00 -0.89 1.34 -0.09 1.20 0.00 0.00 173.24 174.80 1toc h ARG 73 N 1.32 0.83 0.00 5.44 2.43 -1.18 -3.43 114.38 119.79 1toc h ARG 73 Ca -0.49 -0.62 -0.07 0.00 -0.81 0.00 0.00 59.98 58.00 1toc h ARG 73 Cb 1.22 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.87 1toc h ARG 73 CO 0.59 1.23 -0.86 0.25 -1.51 0.00 0.00 179.97 179.67 1toc n THR 74 N -3.97 1.19 -1.65 0.20 -2.24 -1.26 -5.04 114.28 101.50 1toc n THR 74 Ca -0.06 0.14 -0.48 0.00 -2.27 0.00 0.00 64.05 61.38 1toc n THR 74 Cb 0.70 -1.88 -0.05 0.00 -2.10 0.00 0.00 70.33 67.00 1toc n THR 74 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1toc n ARG 75 N -3.87 1.87 -1.83 -0.78 1.74 -1.26 -4.90 116.66 107.63 1toc n ARG 75 Ca -0.13 0.68 -0.42 0.00 -0.77 0.00 0.00 57.85 57.21 1toc n ARG 75 Cb 0.38 -2.42 -0.03 0.00 -1.02 0.00 0.00 32.46 29.38 1toc n ARG 75 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1toc s TYR 76 N 1.10 2.07 -1.12 -1.55 5.04 -1.26 -4.75 117.35 116.88 1toc s TYR 76 Ca 0.82 0.06 -0.09 0.00 -2.44 0.00 0.00 57.07 55.42 1toc s TYR 76 Cb -0.76 -4.07 0.27 0.00 0.35 0.00 0.00 41.96 37.75 1toc s TYR 76 CO 0.42 -4.46 1.13 -1.21 -1.34 0.00 0.00 175.55 170.09 1toc s GLU 77 N 3.19 4.20 0.00 4.97 2.02 -1.26 -4.97 118.70 126.85 1toc s GLU 77 Ca 0.78 -3.19 0.00 0.00 0.02 0.00 0.00 54.97 52.58 1toc s GLU 77 Cb -0.41 -4.58 0.00 0.00 0.10 0.00 0.00 34.13 29.23 1toc s GLU 77 CO 0.35 -1.27 0.00 -2.13 0.02 0.00 0.00 175.26 172.23 1toc n ARG 77 N 2.84 0.00 -0.26 1.61 0.63 -1.26 -0.98 116.66 119.24 1toc n ARG 77 Ca 0.24 0.00 0.09 0.00 -0.92 0.00 0.00 57.85 57.27 1toc n ARG 77 Cb 0.39 0.00 0.20 0.00 0.45 0.00 0.00 32.46 33.50 1toc n ARG 77 CO 0.00 0.00 0.00 0.36 -2.51 0.00 0.00 177.63 175.48 1toc n LYS 78 N -1.18 2.12 -0.05 -0.14 2.85 -1.26 -4.71 118.16 115.79 1toc n LYS 78 Ca 0.00 -2.70 -0.06 0.00 -1.05 0.00 0.00 58.31 54.50 1toc n LYS 78 Cb 0.00 -1.67 -0.02 0.00 -0.65 0.00 0.00 35.03 32.69 1toc n LYS 78 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1toc n VAL 79 N -0.96 1.42 -2.11 0.58 0.31 -0.16 -4.97 118.33 112.45 1toc n VAL 79 Ca 0.18 0.22 -0.41 0.00 -0.01 0.00 0.00 64.34 64.32 1toc n VAL 79 Cb 0.76 -2.12 -0.02 0.00 -0.91 0.00 0.00 33.84 31.54 1toc n VAL 79 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1toc s GLU 80 N -2.64 4.34 -0.88 5.55 -1.05 -1.15 -4.84 118.70 118.03 1toc s GLU 80 Ca -0.20 2.20 -0.01 0.00 -0.15 0.00 0.00 54.97 56.80 1toc s GLU 80 Cb 0.03 -3.12 0.22 0.00 -0.44 0.00 0.00 34.13 30.81 1toc s GLU 80 CO 0.30 -0.29 0.76 0.15 0.95 0.00 0.00 175.26 177.13 1toc s LYS 81 N -0.79 3.22 1.04 -4.83 -0.14 -0.38 -4.91 119.74 112.95 1toc s LYS 81 Ca 0.55 -3.30 -0.21 0.00 -1.36 0.00 0.00 55.97 51.65 1toc s LYS 81 Cb -0.40 -3.91 -0.06 0.00 -1.68 0.00 0.00 37.83 31.79 1toc s LYS 81 CO 0.45 -1.27 -0.65 -0.89 -0.76 0.00 0.00 175.35 172.24 1toc n ILE 82 N 2.28 0.00 -3.59 2.17 5.41 -1.26 -3.54 119.36 120.83 1toc n ILE 82 Ca 0.21 -0.21 -0.06 0.00 1.00 0.00 0.00 62.75 63.70 1toc n ILE 82 Cb 0.37 -0.29 -0.03 0.00 -0.71 0.00 0.00 39.64 38.97 1toc n ILE 82 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1toc s SER 83 N -1.42 -0.20 0.23 4.38 0.15 -0.33 -4.84 113.70 111.67 1toc s SER 83 Ca 0.46 0.11 0.08 0.00 0.70 0.00 0.00 55.95 57.30 1toc s SER 83 Cb -0.06 0.18 -0.04 0.00 -1.71 0.00 0.00 66.02 64.40 1toc s SER 83 CO 0.69 -0.26 0.07 -0.04 1.20 0.00 0.00 173.24 174.90 1toc s MET 84 N -1.86 2.56 0.00 5.44 -1.94 -1.26 -0.60 119.30 121.63 1toc s MET 84 Ca 0.06 -1.19 0.00 0.00 -1.71 0.00 0.00 55.69 52.85 1toc s MET 84 Cb -0.01 -2.37 0.00 0.00 2.01 0.00 0.00 34.83 34.46 1toc s MET 84 CO -0.04 0.41 0.00 1.28 -0.01 0.00 0.00 175.02 176.65 1toc n LEU 85 N -0.74 0.00 0.02 -0.03 4.77 -1.26 -1.48 117.00 118.28 1toc n LEU 85 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1toc n LEU 85 Cb 0.57 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1toc n LEU 85 CO 0.41 -0.39 -0.01 -0.67 -1.33 0.00 0.00 177.39 175.40 1toc n ASP 86 N -2.34 -0.02 -4.05 -1.43 2.03 0.26 -3.89 116.55 107.11 1toc n ASP 86 Ca 0.00 0.06 -0.14 0.00 0.52 0.00 0.00 54.79 55.23 1toc n ASP 86 Cb 0.00 0.05 -0.12 0.00 -0.72 0.00 0.00 41.12 40.33 1toc n ASP 86 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1toc s LYS 87 N -2.00 0.54 -0.15 -0.67 -0.14 -1.22 -4.98 119.74 111.11 1toc s LYS 87 Ca 0.00 -0.66 0.01 0.00 -1.36 0.00 0.00 55.97 53.96 1toc s LYS 87 Cb 0.00 -0.36 0.02 0.00 -1.68 0.00 0.00 37.83 35.80 1toc s LYS 87 CO 0.00 0.07 -0.18 0.42 -0.76 0.00 0.00 175.35 174.91 1toc s ILE 88 N -1.12 1.83 -0.12 2.17 1.01 -1.26 -1.39 121.20 122.31 1toc s ILE 88 Ca -0.07 -0.81 0.02 0.00 0.00 0.00 0.00 60.65 59.79 1toc s ILE 88 Cb -0.08 -1.67 0.01 0.00 0.01 0.00 0.00 42.46 40.73 1toc s ILE 88 CO 0.00 0.50 -0.19 -0.31 0.00 0.00 0.00 174.94 174.95 1toc s TYR 89 N 1.23 2.35 0.13 3.97 2.02 0.06 -4.98 117.35 122.14 1toc s TYR 89 Ca 0.01 -1.14 0.09 0.00 -0.37 0.00 0.00 57.07 55.66 1toc s TYR 89 Cb -0.14 -1.63 -0.04 0.00 -0.40 0.00 0.00 41.96 39.75 1toc s TYR 89 CO -0.09 -0.54 -0.15 0.96 -1.57 0.00 0.00 175.55 174.16 1toc s ILE 90 N 0.86 2.97 0.22 2.71 -4.36 -1.26 0.30 121.20 122.64 1toc s ILE 90 Ca -0.08 -1.51 -0.32 0.00 -0.26 0.00 0.00 60.65 58.48 1toc s ILE 90 Cb -0.15 -2.39 -0.12 0.00 1.25 0.00 0.00 42.46 41.04 1toc s ILE 90 CO -0.01 0.05 1.72 1.57 0.24 0.00 0.00 174.94 178.51 1toc n HIS 91 N 0.62 2.77 -0.09 1.37 -0.00 -1.14 -4.88 115.22 113.87 1toc n HIS 91 Ca -0.14 0.05 0.08 0.00 -0.00 0.00 0.00 57.72 57.70 1toc n HIS 91 Cb 0.53 -2.67 0.43 0.00 -0.00 0.00 0.00 29.99 28.28 1toc n HIS 91 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1toc h PRO 92 N 6.64 0.54 -1.21 1.57 0.11 -1.95 -1.93 132.00 135.78 1toc h PRO 92 Ca -0.43 -0.03 -0.47 0.00 0.11 0.00 0.00 66.00 65.18 1toc h PRO 92 Cb 1.20 -0.12 -0.21 0.00 0.11 0.00 0.00 31.00 31.97 1toc h PRO 92 CO 0.95 0.36 0.60 0.54 -0.21 0.00 0.00 178.00 180.24 1toc n ARG 93 N -4.47 2.15 -2.44 1.05 1.74 -1.26 -4.92 116.66 108.51 1toc n ARG 93 Ca 0.08 -2.34 -0.42 0.00 -0.77 0.00 0.00 57.85 54.39 1toc n ARG 93 Cb 0.23 -1.92 -0.02 0.00 -1.02 0.00 0.00 32.46 29.73 1toc n ARG 93 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1toc s TYR 94 N -2.69 2.47 -1.19 -1.55 5.04 -0.73 -4.65 117.35 114.04 1toc s TYR 94 Ca 0.46 0.60 -0.08 0.00 -2.44 0.00 0.00 57.07 55.61 1toc s TYR 94 Cb 0.37 -4.39 0.23 0.00 0.35 0.00 0.00 41.96 38.51 1toc s TYR 94 CO 0.01 -1.79 1.68 -1.71 -1.34 0.00 0.00 175.55 172.40 1toc n ASN 95 N 8.81 5.63 -0.13 4.32 2.85 -0.83 -4.79 115.26 131.12 1toc n ASN 95 Ca 0.14 -3.22 -0.02 0.00 -0.11 0.00 0.00 54.58 51.37 1toc n ASN 95 Cb 0.49 -1.40 0.21 0.00 1.24 0.00 0.00 39.78 40.32 1toc n ASN 95 CO 0.00 0.00 0.00 4.11 -2.11 0.00 0.00 177.26 179.26 1toc h TRP 96 N 5.73 0.84 -0.38 1.20 5.08 -1.91 0.15 115.95 126.65 1toc h TRP 96 Ca 0.31 -0.06 -0.07 0.00 1.08 0.00 0.00 58.89 60.15 1toc h TRP 96 Cb 0.64 -0.25 -0.02 0.00 -3.00 0.00 0.00 29.16 26.53 1toc h TRP 96 CO 1.14 0.67 -0.06 -0.22 -1.28 0.00 0.00 178.44 178.69 1toc h LYS 97 N 0.81 0.63 0.00 0.12 1.63 -2.00 -3.38 116.57 114.38 1toc h LYS 97 Ca 0.19 -0.17 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1toc h LYS 97 Cb 0.22 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.78 1toc h LYS 97 CO -0.01 0.70 0.00 0.39 -3.45 0.00 0.00 179.45 177.08 1toc n GLU 97 N -4.21 0.00 -1.99 1.90 1.02 -1.18 -4.94 120.64 111.24 1toc n GLU 97 Ca 0.01 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.11 1toc n GLU 97 Cb 0.31 -0.09 0.06 0.00 -0.02 0.00 0.00 31.44 31.70 1toc n GLU 97 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1toc n ASN 98 N -0.63 2.28 -4.08 1.62 6.94 -1.20 -4.98 115.26 115.20 1toc n ASN 98 Ca 0.00 -2.73 -0.32 0.00 -0.02 0.00 0.00 54.58 51.52 1toc n ASN 98 Cb 0.00 -0.41 -0.02 0.00 -2.36 0.00 0.00 39.78 36.99 1toc n ASN 98 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1toc n LEU 99 N -0.45 -2.02 -4.76 -4.53 4.77 0.50 -4.88 117.00 105.62 1toc n LEU 99 Ca 0.18 -0.97 -0.41 0.00 -0.03 0.00 0.00 56.01 54.78 1toc n LEU 99 Cb 0.91 -2.22 -0.03 0.00 -2.33 0.00 0.00 43.42 39.75 1toc n LEU 99 CO 0.11 0.37 0.96 -0.62 -1.33 0.00 0.00 177.39 176.88 1toc s ASP 100 N -3.63 6.86 -1.05 -1.43 2.15 -1.21 -3.28 116.67 115.08 1toc s ASP 100 Ca 0.50 2.57 -0.04 0.00 0.43 0.00 0.00 52.55 56.01 1toc s ASP 100 Cb -0.27 -2.64 -0.05 0.00 -0.30 0.00 0.00 42.92 39.67 1toc s ASP 100 CO 0.90 -0.49 0.91 0.54 -0.17 0.00 0.00 175.17 176.86 1toc n ARG 101 N 1.31 -3.47 -1.93 4.34 1.74 -1.26 -1.97 116.66 115.42 1toc n ARG 101 Ca 0.01 0.83 -0.42 0.00 -0.77 0.00 0.00 57.85 57.50 1toc n ARG 101 Cb 0.42 -5.69 0.00 0.00 -1.02 0.00 0.00 32.46 26.17 1toc n ARG 101 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1toc n ASP 102 N -3.13 4.58 -4.07 0.55 -0.08 -1.21 -4.61 116.55 108.59 1toc n ASP 102 Ca -0.13 -2.93 -0.15 0.00 -1.51 0.00 0.00 54.79 50.06 1toc n ASP 102 Cb 0.63 -1.58 -0.12 0.00 2.34 0.00 0.00 41.12 42.38 1toc n ASP 102 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1toc s ILE 103 N 2.05 0.65 -0.11 5.18 2.07 -1.26 -2.60 121.20 127.18 1toc s ILE 103 Ca 0.45 -0.96 -0.23 0.00 -1.41 0.00 0.00 60.65 58.51 1toc s ILE 103 Cb 0.13 -0.67 0.05 0.00 0.13 0.00 0.00 42.46 42.10 1toc s ILE 103 CO -0.06 -0.24 0.55 0.00 -1.91 0.00 0.00 174.94 173.28 1toc s ALA 104 N -1.10 -1.39 -0.13 1.50 0.00 0.33 -2.91 121.76 118.05 1toc s ALA 104 Ca -0.06 1.19 -0.02 0.00 0.00 0.00 0.00 51.96 53.07 1toc s ALA 104 Cb -0.08 -0.35 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 1toc s ALA 104 CO 0.01 -0.30 -0.06 -0.51 0.00 0.00 0.00 175.76 174.89 1toc s LEU 105 N -0.64 3.13 -0.26 0.00 1.43 0.15 -1.56 118.68 120.93 1toc s LEU 105 Ca -0.07 -0.15 -0.02 0.00 -1.03 0.00 0.00 54.13 52.86 1toc s LEU 105 Cb -0.03 -1.73 0.03 0.00 0.03 0.00 0.00 46.19 44.49 1toc s LEU 105 CO 0.05 0.20 -0.05 -0.76 0.23 0.00 0.00 176.35 176.02 1toc s LEU 106 N 0.15 3.29 -0.37 1.79 1.43 0.44 -0.76 118.68 124.65 1toc s LEU 106 Ca -0.03 -0.92 -0.22 0.00 -1.03 0.00 0.00 54.13 51.93 1toc s LEU 106 Cb -0.14 -1.67 0.01 0.00 0.03 0.00 0.00 46.19 44.41 1toc s LEU 106 CO 0.03 -0.15 0.70 -0.75 0.23 0.00 0.00 176.35 176.42 1toc s LYS 107 N 1.32 3.67 0.41 1.70 2.20 -0.49 -0.87 119.74 127.68 1toc s LYS 107 Ca -0.01 0.12 -0.26 0.00 -0.36 0.00 0.00 55.97 55.47 1toc s LYS 107 Cb -0.17 -3.82 -0.09 0.00 -1.51 0.00 0.00 37.83 32.24 1toc s LYS 107 CO -0.04 -0.81 1.33 -0.51 -0.36 0.00 0.00 175.35 174.96 1toc s LEU 108 N 2.89 4.20 0.15 5.43 1.43 -0.41 0.90 118.68 133.28 1toc s LEU 108 Ca 0.27 2.72 -0.15 0.00 -1.03 0.00 0.00 54.13 55.94 1toc s LEU 108 Cb -0.14 -3.90 0.03 0.00 0.03 0.00 0.00 46.19 42.21 1toc s LEU 108 CO 0.16 -0.91 1.78 0.50 0.23 0.00 0.00 176.35 178.12 1toc h LYS 109 N 2.63 0.60 -4.63 1.70 3.64 -1.37 -3.42 116.57 115.72 1toc h LYS 109 Ca -0.50 -0.06 -0.60 0.00 -1.27 0.00 0.00 60.65 58.22 1toc h LYS 109 Cb 1.25 -0.13 -0.36 0.00 -0.41 0.00 0.00 32.23 32.58 1toc h LYS 109 CO 0.62 0.45 -0.83 1.03 -2.27 0.00 0.00 179.45 178.45 1toc s ARG 110 N -5.98 2.21 -0.42 1.90 0.52 -1.26 -5.01 118.95 110.90 1toc s ARG 110 Ca -0.13 -0.61 -0.46 0.00 -0.52 0.00 0.00 55.73 54.01 1toc s ARG 110 Cb 0.11 -2.16 -0.20 0.00 0.52 0.00 0.00 34.95 33.23 1toc s ARG 110 CO 0.74 -0.28 1.54 -2.30 0.02 0.00 0.00 175.30 175.02 1toc n PRO 111 N 4.76 0.08 -1.63 3.54 -0.02 -1.26 -4.83 135.00 135.63 1toc n PRO 111 Ca -0.16 0.03 -0.39 0.00 -2.02 0.00 0.00 63.50 60.96 1toc n PRO 111 Cb 0.49 -1.54 0.04 0.00 -0.02 0.00 0.00 33.50 32.47 1toc n PRO 111 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1toc n ILE 112 N 3.73 3.35 -2.83 4.25 2.08 -0.52 -4.90 119.36 124.52 1toc n ILE 112 Ca 0.29 -0.50 -0.43 0.00 0.56 0.00 0.00 62.75 62.67 1toc n ILE 112 Cb -0.03 -1.22 -0.03 0.00 -0.75 0.00 0.00 39.64 37.61 1toc n ILE 112 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 1toc s GLU 113 N -2.57 3.31 0.43 0.38 2.56 -1.26 -4.87 118.70 116.68 1toc s GLU 113 Ca 0.72 -1.11 -0.24 0.00 0.00 0.00 0.00 54.97 54.34 1toc s GLU 113 Cb -0.45 -4.55 -0.11 0.00 2.00 0.00 0.00 34.13 31.02 1toc s GLU 113 CO 0.50 -1.87 0.92 1.28 -0.56 0.00 0.00 175.26 175.54 1toc n LEU 114 N 7.58 2.18 -3.82 2.70 4.77 -1.26 -4.90 117.00 124.26 1toc n LEU 114 Ca 0.09 1.00 -0.08 0.00 -0.03 0.00 0.00 56.01 56.99 1toc n LEU 114 Cb 0.47 -1.31 0.03 0.00 -2.33 0.00 0.00 43.42 40.28 1toc n LEU 114 CO 0.61 -1.76 0.58 -0.94 -1.33 0.00 0.00 177.39 174.55 1toc s SER 115 N -0.81 0.02 0.64 -1.43 1.04 -0.43 -4.97 113.70 107.76 1toc s SER 115 Ca 0.64 -1.11 0.23 0.00 0.48 0.00 0.00 55.95 56.19 1toc s SER 115 Cb -0.56 0.80 1.16 0.00 0.10 0.00 0.00 66.02 67.53 1toc s SER 115 CO 0.56 -1.60 1.65 0.44 0.98 0.00 0.00 173.24 175.27 1toc h ASP 116 N 2.00 0.00 0.00 7.02 5.19 -2.00 -1.82 116.42 126.81 1toc h ASP 116 Ca -0.32 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.07 1toc h ASP 116 Cb 1.24 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.75 1toc h ASP 116 CO 0.41 0.00 -1.20 -1.22 -3.12 0.00 0.00 179.24 174.11 1toc n TYR 117 N -3.01 0.00 -3.56 4.55 4.02 -1.26 -4.92 117.16 112.98 1toc n TYR 117 Ca 0.03 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.51 1toc n TYR 117 Cb 0.69 -0.12 -0.09 0.00 -0.02 0.00 0.00 39.34 39.80 1toc n TYR 117 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1toc s ILE 118 N -2.21 4.42 -0.09 -0.72 1.09 -0.68 -4.09 121.20 118.91 1toc s ILE 118 Ca -0.02 -1.37 -0.07 0.00 -1.10 0.00 0.00 60.65 58.09 1toc s ILE 118 Cb 0.02 -3.71 0.03 0.00 -1.06 0.00 0.00 42.46 37.74 1toc s ILE 118 CO 0.16 -0.55 0.23 -2.28 -0.10 0.00 0.00 174.94 172.41 1toc s HIS 119 N 1.46 -0.28 0.62 3.97 2.46 -0.22 -1.32 115.29 121.98 1toc s HIS 119 Ca 0.03 0.67 -0.16 0.00 0.47 0.00 0.00 55.06 56.07 1toc s HIS 119 Cb -0.24 0.07 -0.02 0.00 -0.13 0.00 0.00 32.58 32.26 1toc s HIS 119 CO 0.03 -0.16 1.10 -1.25 -2.47 0.00 0.00 174.74 171.99 1toc s PRO 120 N 0.51 3.04 0.00 2.88 0.04 -1.26 -1.98 135.00 138.23 1toc s PRO 120 Ca -0.03 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.40 1toc s PRO 120 Cb -0.05 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.51 1toc s PRO 120 CO -0.03 -1.06 0.00 1.33 0.04 0.00 0.00 177.00 177.28 1toc n VAL 121 N -2.09 0.00 -3.70 -0.36 0.24 -1.17 -4.93 118.33 106.32 1toc n VAL 121 Ca 0.10 0.00 -0.19 0.00 -2.04 0.00 0.00 64.34 62.21 1toc n VAL 121 Cb 0.52 -1.47 -0.17 0.00 -1.47 0.00 0.00 33.84 31.24 1toc n VAL 121 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1toc s LEU 123 N 1.89 4.33 0.67 0.00 1.43 -1.26 -2.19 118.68 123.55 1toc s LEU 123 Ca 0.01 2.47 -0.12 0.00 -1.03 0.00 0.00 54.13 55.46 1toc s LEU 123 Cb -0.12 -3.82 -0.00 0.00 0.03 0.00 0.00 46.19 42.27 1toc s LEU 123 CO -0.03 -0.55 1.06 -2.16 0.23 0.00 0.00 176.35 174.89 1toc s PRO 124 N -1.98 3.04 0.16 1.29 0.04 -1.26 -4.90 135.00 131.38 1toc s PRO 124 Ca 0.52 0.99 0.05 0.00 0.04 0.00 0.00 61.00 62.60 1toc s PRO 124 Cb -0.34 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.15 1toc s PRO 124 CO 0.44 -1.02 -0.11 0.16 0.04 0.00 0.00 177.00 176.51 1toc s ASP 125 N -3.63 1.96 0.20 6.66 -4.77 -1.26 -4.83 116.67 111.01 1toc s ASP 125 Ca 0.59 -1.02 -0.15 0.00 -3.30 0.00 0.00 52.55 48.67 1toc s ASP 125 Cb -0.14 -0.04 0.22 0.00 -1.09 0.00 0.00 42.92 41.87 1toc s ASP 125 CO 0.52 -0.30 1.36 0.29 0.70 0.00 0.00 175.17 177.73 1toc n LYS 126 N -0.24 -0.20 0.22 2.11 5.02 -1.26 -1.47 118.16 122.34 1toc n LYS 126 Ca -0.10 1.35 -0.10 0.00 -2.02 0.00 0.00 58.31 57.44 1toc n LYS 126 Cb 0.61 -2.00 -0.05 0.00 -0.02 0.00 0.00 35.03 33.57 1toc n LYS 126 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 1toc h GLN 127 N 0.00 -0.60 0.00 1.97 -0.00 -2.04 0.29 115.11 114.73 1toc h GLN 127 Ca 0.31 0.04 0.00 0.00 -0.00 0.00 0.00 58.65 59.00 1toc h GLN 127 Cb 0.53 0.14 0.00 0.00 0.00 0.00 0.00 27.48 28.14 1toc h GLN 127 CO -0.87 -0.40 0.00 2.41 0.00 0.00 0.00 178.83 179.97 1toc n THR 128 N -3.89 0.00 0.00 2.39 -1.04 -0.55 -2.19 114.28 109.00 1toc n THR 128 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 1toc n THR 128 Cb 0.26 -0.05 0.00 0.00 -1.82 0.00 0.00 70.33 68.72 1toc n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1toc n ALA 129 N 0.17 0.00 0.01 2.41 0.00 0.10 -2.16 120.51 121.04 1toc n ALA 129 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1toc n ALA 129 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 1toc n ALA 129 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1toc h LYS 129 N 0.00 0.72 0.00 0.00 1.79 -1.68 -3.36 116.57 114.04 1toc h LYS 129 Ca 0.00 -0.69 -0.08 0.00 -2.18 0.00 0.00 60.65 57.70 1toc h LYS 129 Cb 0.00 0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1toc h LYS 129 CO 0.00 1.28 -0.84 -0.07 -1.08 0.00 0.00 179.45 178.73 1toc h LEU 129 N 0.41 0.00 -6.34 2.94 3.38 -1.70 -3.40 115.31 110.60 1toc h LEU 129 Ca -0.09 0.00 -0.75 0.00 0.09 0.00 0.00 57.88 57.13 1toc h LEU 129 Cb 1.54 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 42.15 1toc h LEU 129 CO 0.18 0.33 2.17 0.18 0.09 0.00 0.00 178.44 181.39 1toc n LEU 130 N -2.96 6.78 -4.05 1.67 4.77 -1.26 -4.88 117.00 117.06 1toc n LEU 130 Ca -0.02 -4.61 -0.23 0.00 -0.03 0.00 0.00 56.01 51.12 1toc n LEU 130 Cb 0.69 -1.49 -0.16 0.00 -2.33 0.00 0.00 43.42 40.13 1toc n LEU 130 CO 0.40 1.40 -0.47 -1.00 -1.33 0.00 0.00 177.39 176.40 1toc s HIS 131 N 0.57 1.35 0.32 -1.77 3.76 -1.26 -4.98 115.29 113.28 1toc s HIS 131 Ca 0.41 -0.40 -0.29 0.00 -0.15 0.00 0.00 55.06 54.63 1toc s HIS 131 Cb 0.11 -0.95 -0.11 0.00 1.11 0.00 0.00 32.58 32.74 1toc s HIS 131 CO -0.01 -0.17 1.49 0.00 -0.85 0.00 0.00 174.74 175.19 1toc s ALA 132 N 0.29 3.63 0.00 -1.40 0.00 -1.26 -2.38 121.76 120.64 1toc s ALA 132 Ca -0.07 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.37 1toc s ALA 132 Cb -0.12 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1toc s ALA 132 CO 0.02 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.28 1toc n GLY 133 N 1.40 3.12 3.72 0.00 0.00 -0.08 -4.94 105.19 108.40 1toc n GLY 133 Ca 0.04 -1.10 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 1toc n GLY 133 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1toc s PHE 134 N -0.08 2.89 0.78 1.61 0.08 -1.00 -4.45 117.98 117.81 1toc s PHE 134 Ca 0.00 0.35 -0.10 0.00 0.12 0.00 0.00 56.93 57.30 1toc s PHE 134 Cb 0.00 -4.12 0.07 0.00 -0.57 0.00 0.00 43.02 38.40 1toc s PHE 134 CO 0.00 -4.26 1.13 0.15 -0.10 0.00 0.00 175.22 172.14 1toc s LYS 135 N 1.25 2.05 0.22 0.44 1.02 -1.26 -0.23 119.74 123.23 1toc s LYS 135 Ca 0.75 0.02 -0.12 0.00 0.02 0.00 0.00 55.97 56.63 1toc s LYS 135 Cb -0.49 -2.01 -0.00 0.00 -0.52 0.00 0.00 37.83 34.80 1toc s LYS 135 CO 0.32 -1.48 0.43 0.20 -0.92 0.00 0.00 175.35 173.90 1toc s GLY 136 N -4.56 0.50 -0.15 -3.33 0.00 0.29 -4.82 107.32 95.26 1toc s GLY 136 Ca 0.61 -0.85 0.02 0.00 0.00 0.00 0.00 44.72 44.51 1toc s GLY 136 CO 0.48 -0.67 -0.21 -1.60 0.00 0.00 0.00 173.10 171.11 1toc s ARG 137 N -4.00 3.05 -0.13 2.90 3.52 0.82 0.77 118.95 125.88 1toc s ARG 137 Ca 0.21 -0.84 0.01 0.00 -0.13 0.00 0.00 55.73 54.99 1toc s ARG 137 Cb 0.00 -2.48 -0.01 0.00 -1.56 0.00 0.00 34.95 30.90 1toc s ARG 137 CO 0.06 -0.04 -0.17 0.08 -0.81 0.00 0.00 175.30 174.42 1toc s VAL 138 N 0.88 2.63 -0.04 7.11 1.01 -0.52 -0.98 120.40 130.48 1toc s VAL 138 Ca -0.05 -0.81 -0.00 0.00 0.00 0.00 0.00 61.98 61.12 1toc s VAL 138 Cb -0.15 -2.08 0.03 0.00 0.00 0.00 0.00 36.38 34.18 1toc s VAL 138 CO -0.03 0.53 0.00 0.42 0.00 0.00 0.00 175.10 176.03 1toc s THR 139 N 0.48 0.23 0.24 3.92 -4.23 -1.26 -2.36 115.64 112.66 1toc s THR 139 Ca -0.12 0.12 -0.18 0.00 -1.18 0.00 0.00 61.69 60.33 1toc s THR 139 Cb -0.16 -0.36 0.02 0.00 1.34 0.00 0.00 72.50 73.33 1toc s THR 139 CO 0.05 0.19 0.60 -0.83 -0.54 0.00 0.00 174.62 174.09 1toc s GLY 140 N 1.42 0.03 -0.23 3.99 0.00 -1.18 -4.44 107.32 106.92 1toc s GLY 140 Ca -0.04 -0.38 0.10 0.00 0.00 0.00 0.00 44.72 44.40 1toc s GLY 140 CO -0.03 -0.25 1.56 0.79 0.00 0.00 0.00 173.10 175.17 1toc n TRP 141 N -0.40 1.85 -1.40 1.90 8.01 -1.26 -3.02 117.44 123.12 1toc n TRP 141 Ca -0.06 -0.78 -0.29 0.00 -1.31 0.00 0.00 57.50 55.06 1toc n TRP 141 Cb 0.61 -0.51 0.17 0.00 -2.01 0.00 0.00 31.31 29.57 1toc n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1toc s GLY 142 N -0.67 1.60 0.81 6.99 0.00 -1.26 -4.67 107.32 110.12 1toc s GLY 142 Ca 0.45 -0.67 -0.14 0.00 0.00 0.00 0.00 44.72 44.36 1toc s GLY 142 CO 0.12 -0.00 1.10 0.70 0.00 0.00 0.00 173.10 175.02 1toc n ASN 143 N -4.09 0.68 0.11 1.64 4.13 -1.06 -2.51 115.26 114.17 1toc n ASN 143 Ca 0.09 0.58 0.09 0.00 1.68 0.00 0.00 54.58 57.01 1toc n ASN 143 Cb 0.59 -1.47 0.01 0.00 -1.54 0.00 0.00 39.78 37.37 1toc n ASN 143 CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 1toc h ARG 144 N -0.88 0.00 -4.72 3.52 3.08 -1.29 0.37 114.38 114.45 1toc h ARG 144 Ca -0.46 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.34 1toc h ARG 144 Cb 1.30 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 31.20 1toc h ARG 144 CO 0.45 0.07 -0.71 1.03 -1.07 0.00 0.00 179.97 179.75 1toc s ARG 145 N -3.25 0.83 0.01 0.04 1.81 -1.26 -4.01 118.95 113.12 1toc s ARG 145 Ca 0.00 -1.27 -0.22 0.00 -1.72 0.00 0.00 55.73 52.53 1toc s ARG 145 Cb 0.09 -0.29 -0.17 0.00 -0.45 0.00 0.00 34.95 34.12 1toc s ARG 145 CO 0.78 0.01 1.27 1.49 -0.68 0.00 0.00 175.30 178.17 1toc h GLU 146 N 3.17 0.27 -4.09 3.54 4.81 -1.93 -3.46 114.58 116.89 1toc h GLU 146 Ca -0.36 -0.17 -0.13 0.00 -0.13 0.00 0.00 59.36 58.58 1toc h GLU 146 Cb 1.17 0.02 -0.14 0.00 0.63 0.00 0.00 28.75 30.44 1toc h GLU 146 CO 0.61 0.74 -0.46 0.95 -0.73 0.00 0.00 179.01 180.13 1toc s THR 147 N -4.06 0.09 0.00 0.32 -4.23 -1.26 -5.00 115.64 101.50 1toc s THR 147 Ca -0.15 -1.58 0.00 0.00 -1.18 0.00 0.00 61.69 58.79 1toc s THR 147 Cb 0.04 -1.86 0.00 0.00 1.34 0.00 0.00 72.50 72.02 1toc s THR 147 CO 0.74 -0.42 0.00 -2.67 -0.54 0.00 0.00 174.62 171.73 1toc n TRP 148 N -0.14 0.00 -0.02 3.99 2.14 -1.26 -5.13 117.44 117.02 1toc n TRP 148 Ca -0.08 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.49 1toc n TRP 148 Cb 0.63 0.00 0.00 0.00 -0.81 0.00 0.00 31.31 31.13 1toc n TRP 148 CO 0.00 0.00 0.00 2.41 2.07 0.00 0.00 177.69 182.17 1toc n THR 149 N 0.00 0.00 -2.28 -1.67 -1.04 -1.26 -4.98 114.28 103.05 1toc n THR 149 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.89 1toc n THR 149 Cb 0.00 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.50 1toc n THR 149 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1toc n SER 149 N 0.51 -3.68 -4.61 8.00 7.64 -1.26 -4.84 113.62 115.38 1toc n SER 149 Ca 0.00 0.22 -0.55 0.00 1.01 0.00 0.00 58.87 59.55 1toc n SER 149 Cb 0.00 -3.18 -0.07 0.00 -1.01 0.00 0.00 64.21 59.95 1toc n SER 149 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1toc n VAL 149 N -3.12 0.07 -1.49 0.44 3.14 -1.26 0.30 118.33 116.42 1toc n VAL 149 Ca -0.14 -0.01 -0.17 0.00 -2.96 0.00 0.00 64.34 61.06 1toc n VAL 149 Cb 0.57 -0.79 -0.07 0.00 -1.06 0.00 0.00 33.84 32.50 1toc n VAL 149 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1toc n ALA 149 N 3.09 -0.26 -1.97 1.55 0.00 -1.26 -4.33 120.51 117.34 1toc n ALA 149 Ca 0.21 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1toc n ALA 149 Cb 0.15 -1.80 0.00 0.00 0.00 0.00 0.00 19.45 17.80 1toc n ALA 149 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1toc n GLU 149 N -2.00 -4.07 0.01 0.00 4.07 0.15 -5.00 120.64 113.80 1toc n GLU 149 Ca -0.17 2.87 -0.02 0.00 -0.06 0.00 0.00 57.16 59.78 1toc n GLU 149 Cb 0.59 -3.28 -0.01 0.00 -0.06 0.00 0.00 31.44 28.68 1toc n GLU 149 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1toc h VAL 150 N 4.08 0.00 -2.98 6.31 2.07 -1.75 -3.45 116.25 120.52 1toc h VAL 150 Ca 0.00 -0.79 -0.56 0.00 0.82 0.00 0.00 66.70 66.17 1toc h VAL 150 Cb 0.00 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.74 1toc h VAL 150 CO 0.00 0.00 0.82 -1.10 0.02 0.00 0.00 177.57 177.31 1toc s GLN 151 N -1.93 4.28 0.54 1.57 -0.21 -1.26 -0.91 119.66 121.74 1toc s GLN 151 Ca -0.02 1.67 -0.21 0.00 0.02 0.00 0.00 55.36 56.82 1toc s GLN 151 Cb 0.00 -3.68 -0.05 0.00 1.00 0.00 0.00 33.01 30.28 1toc s GLN 151 CO 0.06 -0.60 1.25 -1.25 -2.12 0.00 0.00 175.29 172.62 1toc s PRO 152 N 2.98 3.24 -0.03 2.91 0.04 -1.26 -5.00 135.00 137.87 1toc s PRO 152 Ca 0.55 1.96 -0.22 0.00 0.04 0.00 0.00 61.00 63.33 1toc s PRO 152 Cb -0.23 -2.17 -0.16 0.00 0.04 0.00 0.00 34.50 31.98 1toc s PRO 152 CO 0.18 -1.03 1.00 0.66 0.04 0.00 0.00 177.00 177.85 1toc h SER 153 N 1.39 -0.24 -0.81 6.66 4.64 -1.96 -3.42 113.55 119.82 1toc h SER 153 Ca -0.50 -0.29 -0.66 0.00 -0.47 0.00 0.00 61.79 59.86 1toc h SER 153 Cb 1.29 0.06 -0.13 0.00 -0.31 0.00 0.00 62.40 63.31 1toc h SER 153 CO 0.57 0.25 -0.51 0.68 -0.87 0.00 0.00 176.83 176.95 1toc s VAL 154 N -3.85 1.04 0.62 0.95 -7.23 -1.26 -0.73 120.40 109.93 1toc s VAL 154 Ca -0.13 -2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 57.86 1toc s VAL 154 Cb 0.01 -2.17 -0.09 0.00 0.56 0.00 0.00 36.38 34.70 1toc s VAL 154 CO 0.50 0.00 0.35 -0.11 -0.31 0.00 0.00 175.10 175.53 1toc n LEU 155 N -1.21 -0.33 -4.41 1.32 7.94 0.17 -4.81 117.00 115.67 1toc n LEU 155 Ca -0.17 0.65 -0.26 0.00 -1.11 0.00 0.00 56.01 55.12 1toc n LEU 155 Cb 0.67 -1.11 -0.12 0.00 0.53 0.00 0.00 43.42 43.39 1toc n LEU 155 CO 0.37 -3.52 -0.52 -1.10 -1.11 0.00 0.00 177.39 171.50 1toc s GLN 156 N -2.09 1.47 0.06 1.96 -1.52 -1.17 -2.28 119.66 116.10 1toc s GLN 156 Ca 0.64 -1.50 0.01 0.00 -1.95 0.00 0.00 55.36 52.57 1toc s GLN 156 Cb -0.41 -1.76 -0.03 0.00 -0.22 0.00 0.00 33.01 30.59 1toc s GLN 156 CO 0.59 0.38 -0.06 0.54 -0.25 0.00 0.00 175.29 176.48 1toc s VAL 157 N -1.71 0.52 -0.30 1.09 0.11 0.11 -3.07 120.40 117.15 1toc s VAL 157 Ca 0.20 -1.48 -0.14 0.00 -2.93 0.00 0.00 61.98 57.63 1toc s VAL 157 Cb -0.08 -1.10 0.14 0.00 -1.53 0.00 0.00 36.38 33.81 1toc s VAL 157 CO 0.09 -0.66 0.83 0.54 -3.33 0.00 0.00 175.10 172.58 1toc s VAL 158 N -2.55 -0.50 -0.42 2.04 0.11 -1.00 -0.75 120.40 117.33 1toc s VAL 158 Ca -0.00 0.00 -0.21 0.00 -2.93 0.00 0.00 61.98 58.84 1toc s VAL 158 Cb -0.02 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.85 1toc s VAL 158 CO -0.03 0.00 0.64 0.20 -3.33 0.00 0.00 175.10 172.58 1toc s ASN 159 N 2.29 6.35 -0.10 3.54 -0.87 -1.25 -1.44 114.94 123.45 1toc s ASN 159 Ca -0.06 -0.21 -0.02 0.00 -1.57 0.00 0.00 52.86 51.00 1toc s ASN 159 Cb -0.07 -2.32 -0.03 0.00 -0.02 0.00 0.00 41.25 38.81 1toc s ASN 159 CO -0.18 -0.72 -0.02 -0.76 -2.57 0.00 0.00 177.10 172.85 1toc s LEU 160 N 2.78 3.42 0.39 0.60 1.43 0.23 -4.75 118.68 122.78 1toc s LEU 160 Ca 0.23 0.05 -0.19 0.00 -1.03 0.00 0.00 54.13 53.19 1toc s LEU 160 Cb -0.14 -1.79 -0.10 0.00 0.03 0.00 0.00 46.19 44.19 1toc s LEU 160 CO 0.18 0.32 0.87 -2.16 0.23 0.00 0.00 176.35 175.79 1toc s PRO 161 N -0.56 4.15 0.34 1.29 0.04 -1.26 0.11 135.00 139.10 1toc s PRO 161 Ca 0.09 0.95 -0.26 0.00 0.04 0.00 0.00 61.00 61.82 1toc s PRO 161 Cb -0.12 -2.28 -0.09 0.00 0.04 0.00 0.00 34.50 32.05 1toc s PRO 161 CO 0.02 0.04 1.02 -0.51 0.04 0.00 0.00 177.00 177.61 1toc s LEU 162 N -3.10 4.33 0.26 -3.56 1.43 0.68 -1.84 118.68 116.88 1toc s LEU 162 Ca 0.59 2.02 0.09 0.00 -1.03 0.00 0.00 54.13 55.79 1toc s LEU 162 Cb -0.09 -3.97 -0.04 0.00 0.03 0.00 0.00 46.19 42.12 1toc s LEU 162 CO 0.15 -0.23 0.06 0.68 0.23 0.00 0.00 176.35 177.23 1toc s VAL 163 N -1.50 3.74 0.33 -1.59 -7.23 -1.16 -0.91 120.40 112.09 1toc s VAL 163 Ca 0.51 -1.76 -0.29 0.00 -1.81 0.00 0.00 61.98 58.63 1toc s VAL 163 Cb -0.23 -3.01 -0.11 0.00 0.56 0.00 0.00 36.38 33.59 1toc s VAL 163 CO 0.29 -0.37 1.50 -1.61 -0.31 0.00 0.00 175.10 174.61 1toc s GLU 164 N -3.73 4.16 0.21 4.82 8.01 -1.26 -4.75 118.70 126.17 1toc s GLU 164 Ca 0.32 2.50 -0.09 0.00 0.01 0.00 0.00 54.97 57.71 1toc s GLU 164 Cb -0.07 -3.02 0.28 0.00 -4.31 0.00 0.00 34.13 27.02 1toc s GLU 164 CO 0.21 -0.51 1.77 0.00 0.01 0.00 0.00 175.26 176.73 1toc h ARG 165 N 3.95 0.49 -0.12 1.61 3.08 -1.97 -1.36 114.38 120.06 1toc h ARG 165 Ca -0.49 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 59.57 1toc h ARG 165 Cb 1.23 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 31.16 1toc h ARG 165 CO 0.71 0.33 0.28 -1.00 -1.07 0.00 0.00 179.97 179.22 1toc h PRO 166 N 0.51 0.00 0.18 0.04 0.13 -2.00 0.19 132.00 131.05 1toc h PRO 166 Ca 0.31 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 65.12 1toc h PRO 166 Cb 0.34 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.48 1toc h PRO 166 CO -0.27 0.00 -1.56 0.28 -0.23 0.00 0.00 178.00 176.22 1toc h VAL 167 N 0.00 1.15 0.17 1.56 2.07 -1.63 -2.48 116.25 117.09 1toc h VAL 167 Ca 0.06 -2.71 -0.01 0.00 0.82 0.00 0.00 66.70 64.86 1toc h VAL 167 Cb 0.62 2.86 0.00 0.00 -1.52 0.00 0.00 31.29 33.24 1toc h VAL 167 CO -0.00 0.84 -0.08 0.00 0.02 0.00 0.00 177.57 178.35 1toc h LYS 169 N -0.46 0.34 0.00 0.00 1.79 -1.00 -1.05 116.57 116.19 1toc h LYS 169 Ca -0.02 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 1toc h LYS 169 Cb 0.36 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.93 1toc h LYS 169 CO 0.04 0.23 0.00 0.00 -1.08 0.00 0.00 179.45 178.63 1toc n ALA 170 N -2.54 2.43 0.22 3.86 0.00 -0.93 -3.51 120.51 120.03 1toc n ALA 170 Ca 0.11 -0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.55 1toc n ALA 170 Cb 0.34 -1.09 0.05 0.00 0.00 0.00 0.00 19.45 18.75 1toc n ALA 170 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1toc n SER 171 N -0.60 1.88 -3.72 0.00 3.41 -0.40 -5.01 113.62 109.19 1toc n SER 171 Ca 0.04 -1.48 -0.14 0.00 -0.26 0.00 0.00 58.87 57.04 1toc n SER 171 Cb 0.02 -0.04 -0.09 0.00 -0.26 0.00 0.00 64.21 63.84 1toc n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1toc s THR 172 N -0.73 0.02 0.31 6.66 -1.32 -1.23 -4.85 115.64 114.50 1toc s THR 172 Ca 0.11 -0.13 0.05 0.00 -1.21 0.00 0.00 61.69 60.50 1toc s THR 172 Cb 0.07 -0.64 0.10 0.00 -1.51 0.00 0.00 72.50 70.52 1toc s THR 172 CO 0.10 -0.07 1.79 0.08 -2.21 0.00 0.00 174.62 174.31 1toc h ARG 173 N 4.81 0.41 -6.70 7.08 -0.00 -1.95 -3.46 114.38 114.57 1toc h ARG 173 Ca -0.28 -0.13 -0.58 0.00 -0.00 0.00 0.00 59.98 58.99 1toc h ARG 173 Cb 1.18 -0.04 0.14 0.00 -0.00 0.00 0.00 29.97 31.25 1toc h ARG 173 CO 0.29 0.59 0.13 -0.89 -0.00 0.00 0.00 179.97 180.09 1toc n ILE 174 N -4.17 2.81 -2.24 0.08 5.41 -1.26 -4.94 119.36 115.05 1toc n ILE 174 Ca -0.00 -0.50 -0.40 0.00 1.00 0.00 0.00 62.75 62.84 1toc n ILE 174 Cb 0.36 -1.14 -0.03 0.00 -0.71 0.00 0.00 39.64 38.12 1toc n ILE 174 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 1toc s ARG 175 N -2.26 4.41 -0.06 0.38 3.52 -1.26 -5.03 118.95 118.66 1toc s ARG 175 Ca 0.67 2.05 0.06 0.00 -0.13 0.00 0.00 55.73 58.38 1toc s ARG 175 Cb -0.50 -3.07 -0.01 0.00 -1.56 0.00 0.00 34.95 29.81 1toc s ARG 175 CO 0.54 -0.08 -0.23 0.42 -0.81 0.00 0.00 175.30 175.14 1toc s ILE 176 N -1.17 1.91 0.38 4.11 -1.09 -1.26 -4.88 121.20 119.19 1toc s ILE 176 Ca 0.48 -0.98 0.03 0.00 -2.23 0.00 0.00 60.65 57.96 1toc s ILE 176 Cb -0.36 -1.62 0.03 0.00 -1.58 0.00 0.00 42.46 38.93 1toc s ILE 176 CO 0.48 0.53 0.27 0.35 -1.23 0.00 0.00 174.94 175.34 1toc n THR 177 N 3.05 0.00 1.15 2.92 -2.24 -1.26 -5.00 114.28 112.89 1toc n THR 177 Ca -0.18 -1.53 0.04 0.00 -2.27 0.00 0.00 64.05 60.12 1toc n THR 177 Cb 0.52 -0.14 0.12 0.00 -2.10 0.00 0.00 70.33 68.72 1toc n THR 177 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1toc n ASP 178 N -1.85 1.42 -1.40 3.42 -0.08 -1.26 -3.50 116.55 113.30 1toc n ASP 178 Ca -0.02 -2.01 -0.08 0.00 -1.51 0.00 0.00 54.79 51.18 1toc n ASP 178 Cb 0.44 -0.18 0.20 0.00 2.34 0.00 0.00 41.12 43.92 1toc n ASP 178 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1toc n ASN 179 N 0.27 2.92 -3.15 1.67 3.02 -1.26 -4.87 115.26 113.85 1toc n ASN 179 Ca 0.09 -3.67 0.04 0.00 -0.03 0.00 0.00 54.58 51.01 1toc n ASN 179 Cb 0.23 -0.68 -0.01 0.00 -0.61 0.00 0.00 39.78 38.71 1toc n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1toc s MET 180 N -3.22 0.49 0.53 3.52 0.23 -1.23 -2.57 119.30 117.05 1toc s MET 180 Ca 0.47 0.75 -0.01 0.00 -1.03 0.00 0.00 55.69 55.87 1toc s MET 180 Cb 0.42 0.40 0.01 0.00 -1.53 0.00 0.00 34.83 34.13 1toc s MET 180 CO 0.03 -0.65 0.77 -0.59 -2.03 0.00 0.00 175.02 172.55 1toc s PHE 181 N 2.87 3.10 0.18 3.16 -0.12 -0.77 -4.72 117.98 121.68 1toc s PHE 181 Ca 0.15 0.26 0.07 0.00 -0.05 0.00 0.00 56.93 57.36 1toc s PHE 181 Cb -0.12 -2.59 -0.04 0.00 -0.63 0.00 0.00 43.02 39.63 1toc s PHE 181 CO -0.21 -0.68 -0.15 0.00 -0.05 0.00 0.00 175.22 174.14 1toc s ALA 183 N -2.66 -0.79 0.00 0.00 0.00 -0.29 -2.96 121.76 115.07 1toc s ALA 183 Ca 0.18 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.44 1toc s ALA 183 Cb -0.02 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.21 1toc s ALA 183 CO 0.06 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1toc n GLY 184 N 1.17 2.66 3.85 0.00 0.00 -0.77 -1.81 105.19 110.29 1toc n GLY 184 Ca -0.21 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.41 1toc n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1toc s TYR 184 N -2.00 3.42 0.49 1.61 2.02 -1.26 -4.68 117.35 116.95 1toc s TYR 184 Ca 0.00 1.30 -0.03 0.00 -0.37 0.00 0.00 57.07 57.97 1toc s TYR 184 Cb 0.00 -2.63 -0.01 0.00 -0.40 0.00 0.00 41.96 38.91 1toc s TYR 184 CO 0.00 -0.15 0.75 0.15 -1.57 0.00 0.00 175.55 174.73 1toc s LYS 185 N -3.65 3.17 0.65 -0.62 1.02 -1.26 -4.82 119.74 114.23 1toc s LYS 185 Ca 0.56 -0.17 -0.17 0.00 0.02 0.00 0.00 55.97 56.21 1toc s LYS 185 Cb -0.10 -2.44 -0.00 0.00 -0.52 0.00 0.00 37.83 34.77 1toc s LYS 185 CO 0.26 -0.34 1.25 -2.14 -0.92 0.00 0.00 175.35 173.45 1toc s PRO 186 N -4.71 2.56 0.00 -1.68 0.02 -1.26 -2.16 135.00 127.77 1toc s PRO 186 Ca 0.49 1.92 0.00 0.00 0.02 0.00 0.00 61.00 63.43 1toc s PRO 186 Cb -0.10 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.55 1toc s PRO 186 CO 0.41 -1.55 0.00 0.41 -0.33 0.00 0.00 177.00 175.94 1toc n GLY 186 N 0.66 1.17 0.11 0.52 0.00 -1.26 -4.77 105.19 101.62 1toc n GLY 186 Ca 0.15 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.26 1toc n GLY 186 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1toc n GLU 186 N -2.00 0.13 0.00 1.61 2.13 -0.92 -4.88 120.64 116.71 1toc n GLU 186 Ca 0.00 0.48 0.00 0.00 0.66 0.00 0.00 57.16 58.30 1toc n GLU 186 Cb 0.00 -1.81 0.00 0.00 0.27 0.00 0.00 31.44 29.90 1toc n GLU 186 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1toc n GLY 186 N -0.59 2.42 3.76 8.31 0.00 -1.26 -4.99 105.19 112.84 1toc n GLY 186 Ca 0.01 -0.49 -0.39 0.00 0.00 0.00 0.00 46.02 45.14 1toc n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1toc s LYS 186 N 0.00 4.36 0.00 1.61 1.02 -1.26 -5.07 119.74 120.41 1toc s LYS 186 Ca 0.00 0.82 0.00 0.00 0.02 0.00 0.00 55.97 56.81 1toc s LYS 186 Cb 0.00 -3.35 0.00 0.00 -0.52 0.00 0.00 37.83 33.96 1toc s LYS 186 CO 0.00 0.35 0.00 0.54 -0.92 0.00 0.00 175.35 175.32 1toc n ARG 187 N 2.75 2.85 0.00 1.68 1.74 -1.26 -4.64 116.66 119.77 1toc n ARG 187 Ca -0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 1toc n ARG 187 Cb 0.51 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.95 1toc n ARG 187 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1toc n GLY 188 N 5.00 3.78 3.61 -0.13 0.00 -1.25 -4.87 105.19 111.33 1toc n GLY 188 Ca 0.00 -1.37 -0.05 0.00 0.00 0.00 0.00 46.02 44.59 1toc n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1toc s ASP 189 N 0.00 -0.17 1.24 1.61 2.15 -0.88 -4.58 116.67 116.04 1toc s ASP 189 Ca 0.00 0.16 -0.19 0.00 0.43 0.00 0.00 52.55 52.95 1toc s ASP 189 Cb 0.00 0.15 0.30 0.00 -0.30 0.00 0.00 42.92 43.06 1toc s ASP 189 CO 0.00 -0.18 1.06 0.00 -0.17 0.00 0.00 175.17 175.89 1toc s ALA 190 N -1.29 0.27 0.19 3.66 0.00 -1.26 0.06 121.76 123.38 1toc s ALA 190 Ca 0.05 -0.85 -0.23 0.00 0.00 0.00 0.00 51.96 50.94 1toc s ALA 190 Cb -0.01 -2.93 0.07 0.00 0.00 0.00 0.00 23.12 20.25 1toc s ALA 190 CO -0.04 -3.79 0.99 0.00 0.00 0.00 0.00 175.76 172.92 1toc n GLU 192 N -0.59 0.26 0.00 0.00 4.07 -1.26 -1.27 120.64 121.85 1toc n GLU 192 Ca -0.05 0.08 0.00 0.00 -0.06 0.00 0.00 57.16 57.13 1toc n GLU 192 Cb 0.60 -1.70 0.00 0.00 -0.06 0.00 0.00 31.44 30.28 1toc n GLU 192 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1toc n GLY 193 N 6.49 1.46 0.71 8.31 0.00 -1.26 -2.55 105.19 118.34 1toc n GLY 193 Ca 0.47 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.57 1toc n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1toc n ASP 194 N 0.00 2.49 -4.61 1.61 8.00 -0.40 -3.98 116.55 119.66 1toc n ASP 194 Ca 0.00 -1.74 -0.49 0.00 0.71 0.00 0.00 54.79 53.27 1toc n ASP 194 Cb 0.00 -0.01 -0.05 0.00 -0.02 0.00 0.00 41.12 41.04 1toc n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1toc n SER 195 N 0.99 2.97 0.00 -2.24 7.64 -1.26 0.58 113.62 122.30 1toc n SER 195 Ca 0.10 0.71 0.00 0.00 1.01 0.00 0.00 58.87 60.70 1toc n SER 195 Cb 0.44 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.29 1toc n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1toc n GLY 196 N 5.19 1.51 3.56 0.23 0.00 -0.69 -2.49 105.19 112.51 1toc n GLY 196 Ca 0.29 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.86 1toc n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1toc n GLY 197 N -0.13 -0.45 3.69 -0.02 0.00 0.20 -3.85 105.19 104.64 1toc n GLY 197 Ca 0.00 0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 1toc n GLY 197 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1toc s PRO 198 N -1.30 4.42 -0.57 1.61 0.04 -1.26 -1.59 135.00 136.36 1toc s PRO 198 Ca 0.62 1.49 -0.20 0.00 0.04 0.00 0.00 61.00 62.95 1toc s PRO 198 Cb -0.76 -3.52 0.07 0.00 0.04 0.00 0.00 34.50 30.33 1toc s PRO 198 CO 0.58 -0.31 0.75 0.12 0.04 0.00 0.00 177.00 178.19 1toc s PHE 199 N 1.86 2.93 0.26 0.56 2.19 0.18 -4.11 117.98 121.84 1toc s PHE 199 Ca 0.52 -0.62 0.07 0.00 0.33 0.00 0.00 56.93 57.22 1toc s PHE 199 Cb -0.21 -3.90 -0.03 0.00 -1.31 0.00 0.00 43.02 37.57 1toc s PHE 199 CO 0.21 -1.27 0.25 0.14 1.83 0.00 0.00 175.22 176.38 1toc s VAL 200 N 3.07 4.53 -0.07 3.12 -7.23 -0.16 -1.17 120.40 122.50 1toc s VAL 200 Ca 0.17 -1.29 -0.03 0.00 -1.81 0.00 0.00 61.98 59.02 1toc s VAL 200 Cb -0.20 -3.49 0.04 0.00 0.56 0.00 0.00 36.38 33.30 1toc s VAL 200 CO 0.11 -0.32 0.14 -0.32 -0.31 0.00 0.00 175.10 174.39 1toc s MET 201 N -3.90 0.06 0.12 4.82 1.75 0.18 -0.13 119.30 122.20 1toc s MET 201 Ca 0.34 0.41 -0.30 0.00 -1.25 0.00 0.00 55.69 54.90 1toc s MET 201 Cb -0.08 -0.22 -0.06 0.00 2.84 0.00 0.00 34.83 37.30 1toc s MET 201 CO 0.26 -0.21 1.04 0.21 -0.65 0.00 0.00 175.02 175.67 1toc s LYS 202 N 1.52 4.62 -0.00 4.11 2.20 -1.26 -0.20 119.74 130.73 1toc s LYS 202 Ca -0.05 1.59 -0.29 0.00 -0.36 0.00 0.00 55.97 56.86 1toc s LYS 202 Cb -0.12 -3.34 -0.03 0.00 -1.51 0.00 0.00 37.83 32.83 1toc s LYS 202 CO -0.06 0.09 0.93 0.45 -0.36 0.00 0.00 175.35 176.40 1toc s SER 203 N 0.14 7.32 0.00 1.43 0.15 0.42 -4.92 113.70 118.24 1toc s SER 203 Ca 0.49 1.59 0.16 0.00 0.70 0.00 0.00 55.95 58.89 1toc s SER 203 Cb -0.26 -2.54 0.81 0.00 -1.71 0.00 0.00 66.02 62.31 1toc s SER 203 CO 0.32 -0.22 1.54 -0.81 1.20 0.00 0.00 173.24 175.27 1toc n PRO 204 N 3.77 1.20 0.00 5.44 -0.04 -1.26 -2.68 135.00 141.42 1toc n PRO 204 Ca 0.04 -0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.20 1toc n PRO 204 Cb 0.51 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 32.70 1toc n PRO 204 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1toc n TYR 204 N -0.43 0.00 1.54 0.54 4.01 -1.26 -4.75 117.16 116.81 1toc n TYR 204 Ca 0.12 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.96 1toc n TYR 204 Cb 0.12 0.00 0.44 0.00 -0.31 0.00 0.00 39.34 39.59 1toc n TYR 204 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1toc n ASN 204 N -2.36 0.98 -0.45 7.72 0.23 -1.26 -4.92 115.26 115.21 1toc n ASN 204 Ca 0.00 -1.60 -0.06 0.00 -0.53 0.00 0.00 54.58 52.39 1toc n ASN 204 Cb 0.00 -0.06 -0.02 0.00 -2.08 0.00 0.00 39.78 37.61 1toc n ASN 204 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1toc n ASN 205 N -0.13 -5.64 -4.83 0.53 2.85 -1.09 -4.97 115.26 101.97 1toc n ASN 205 Ca 0.15 0.14 -0.37 0.00 -0.11 0.00 0.00 54.58 54.39 1toc n ASN 205 Cb 0.22 -3.65 -0.06 0.00 1.24 0.00 0.00 39.78 37.53 1toc n ASN 205 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 1toc s ARG 206 N -2.38 4.00 -0.45 1.20 0.52 -1.26 -4.70 118.95 115.87 1toc s ARG 206 Ca 0.00 0.50 -0.28 0.00 -0.52 0.00 0.00 55.73 55.43 1toc s ARG 206 Cb 0.00 -3.14 0.03 0.00 0.52 0.00 0.00 34.95 32.35 1toc s ARG 206 CO 0.00 0.62 1.08 -1.58 0.02 0.00 0.00 175.30 175.44 1toc s TRP 207 N -1.20 2.89 0.16 -0.53 0.52 -1.26 -0.43 118.94 119.08 1toc s TRP 207 Ca 0.29 0.71 0.02 0.00 0.02 0.00 0.00 56.10 57.14 1toc s TRP 207 Cb -0.17 -4.22 -0.04 0.00 -1.15 0.00 0.00 33.47 27.90 1toc s TRP 207 CO 0.17 -1.16 0.30 0.71 0.02 0.00 0.00 176.95 176.99 1toc s TYR 208 N 4.17 3.48 -0.29 -1.98 1.51 0.72 -3.12 117.35 121.85 1toc s TYR 208 Ca 0.45 0.14 -0.06 0.00 -1.01 0.00 0.00 57.07 56.59 1toc s TYR 208 Cb -0.09 -1.69 0.01 0.00 -0.11 0.00 0.00 41.96 40.09 1toc s TYR 208 CO 0.28 0.49 0.06 -1.14 -1.11 0.00 0.00 175.55 174.13 1toc s GLN 209 N -3.28 3.02 -0.16 -0.62 0.74 -0.93 0.47 119.66 118.90 1toc s GLN 209 Ca 0.35 -0.89 0.08 0.00 0.05 0.00 0.00 55.36 54.95 1toc s GLN 209 Cb -0.11 -3.32 -0.23 0.00 1.10 0.00 0.00 33.01 30.45 1toc s GLN 209 CO 0.29 -0.45 0.20 -1.33 -0.55 0.00 0.00 175.29 173.45 1toc n MET 210 N 4.83 0.68 -3.95 1.67 2.81 -0.32 -4.21 117.12 118.63 1toc n MET 210 Ca -0.15 0.16 -0.09 0.00 -1.81 0.00 0.00 57.70 55.81 1toc n MET 210 Cb 0.48 -1.62 -0.10 0.00 -0.71 0.00 0.00 33.22 31.26 1toc n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1toc s GLY 211 N -5.66 0.20 -0.17 3.03 0.00 -0.84 -0.75 107.32 103.13 1toc s GLY 211 Ca -0.17 -0.55 -0.06 0.00 0.00 0.00 0.00 44.72 43.94 1toc s GLY 211 CO 0.76 -0.66 0.03 -0.42 0.00 0.00 0.00 173.10 172.81 1toc s ILE 212 N -2.11 4.51 -0.28 0.90 1.01 -0.55 0.47 121.20 125.15 1toc s ILE 212 Ca -0.09 -0.14 -0.32 0.00 0.00 0.00 0.00 60.65 60.10 1toc s ILE 212 Cb -0.04 -3.01 -0.08 0.00 0.01 0.00 0.00 42.46 39.33 1toc s ILE 212 CO -0.03 0.48 2.21 0.52 0.00 0.00 0.00 174.94 178.12 1toc n VAL 213 N 3.49 0.27 0.00 2.92 0.31 -0.62 -0.12 118.33 124.58 1toc n VAL 213 Ca -0.17 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 63.80 1toc n VAL 213 Cb 0.52 -2.12 0.00 0.00 -0.91 0.00 0.00 33.84 31.33 1toc n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1toc n SER 214 N 10.80 0.00 -4.36 4.52 2.88 -0.52 -1.70 113.62 125.24 1toc n SER 214 Ca 0.35 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.71 1toc n SER 214 Cb 0.34 -0.11 -0.10 0.00 -0.75 0.00 0.00 64.21 63.59 1toc n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1toc s TRP 215 N -0.28 1.68 -0.23 0.66 1.48 -0.92 -4.90 118.94 116.43 1toc s TRP 215 Ca 0.00 -1.04 -0.30 0.00 -1.06 0.00 0.00 56.10 53.70 1toc s TRP 215 Cb 0.00 -1.03 0.16 0.00 -1.16 0.00 0.00 33.47 31.45 1toc s TRP 215 CO 0.00 -0.14 1.20 0.20 -4.06 0.00 0.00 176.95 174.15 1toc s GLY 216 N -3.37 -0.09 -0.86 3.67 0.00 -1.26 -1.35 107.32 104.06 1toc s GLY 216 Ca 0.35 2.40 -0.18 0.00 0.00 0.00 0.00 44.72 47.29 1toc s GLY 216 CO 0.13 1.02 0.98 -0.54 0.00 0.00 0.00 173.10 174.69 1toc s GLU 217 N -1.19 3.52 0.26 2.90 2.02 -1.26 -4.95 118.70 120.00 1toc s GLU 217 Ca 0.05 -1.85 0.00 0.00 0.02 0.00 0.00 54.97 53.19 1toc s GLU 217 Cb -0.01 -4.69 0.00 0.00 0.10 0.00 0.00 34.13 29.53 1toc s GLU 217 CO -0.04 -1.63 0.00 0.41 0.02 0.00 0.00 175.26 174.02 1toc n GLY 219 N 5.08 -1.85 3.44 -1.39 0.00 -1.26 -4.71 105.19 104.50 1toc n GLY 219 Ca 0.17 -1.25 -0.33 0.00 0.00 0.00 0.00 46.02 44.60 1toc n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1toc n ASP 221 N 3.24 -1.20 -4.66 0.00 2.03 -1.26 -4.67 116.55 110.03 1toc n ASP 221 Ca -0.18 0.00 -0.51 0.00 0.52 0.00 0.00 54.79 54.62 1toc n ASP 221 Cb 0.53 -2.35 -0.06 0.00 -0.72 0.00 0.00 41.12 38.52 1toc n ASP 221 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1toc n ARG 221 N -1.48 1.61 -1.75 -0.67 1.74 -1.26 -4.88 116.66 109.98 1toc n ARG 221 Ca 0.00 0.59 -0.42 0.00 -0.77 0.00 0.00 57.85 57.25 1toc n ARG 221 Cb 0.09 -2.31 -0.02 0.00 -1.02 0.00 0.00 32.46 29.20 1toc n ARG 221 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1toc s ASP 222 N 2.01 6.35 0.00 0.55 1.11 -1.26 -1.66 116.67 123.77 1toc s ASP 222 Ca 0.88 2.96 0.00 0.00 0.18 0.00 0.00 52.55 56.56 1toc s ASP 222 Cb -0.86 -2.63 0.00 0.00 1.07 0.00 0.00 42.92 40.50 1toc s ASP 222 CO 0.50 -0.94 0.00 0.61 1.18 0.00 0.00 175.17 176.51 1toc n GLY 223 N 2.54 1.39 3.65 0.21 0.00 -1.26 -5.03 105.19 106.69 1toc n GLY 223 Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 1toc n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1toc s LYS 224 N -0.51 2.35 0.09 1.61 -0.14 -0.67 -4.88 119.74 117.59 1toc s LYS 224 Ca 0.00 -1.21 0.02 0.00 -1.36 0.00 0.00 55.97 53.43 1toc s LYS 224 Cb 0.00 -2.29 -0.04 0.00 -1.68 0.00 0.00 37.83 33.83 1toc s LYS 224 CO 0.00 0.43 -0.08 0.71 -0.76 0.00 0.00 175.35 175.65 1toc s TYR 225 N -1.89 0.92 0.05 3.18 1.51 -1.26 -4.81 117.35 115.04 1toc s TYR 225 Ca 0.28 -0.78 -0.22 0.00 -1.01 0.00 0.00 57.07 55.34 1toc s TYR 225 Cb -0.08 -0.52 -0.06 0.00 -0.11 0.00 0.00 41.96 41.18 1toc s TYR 225 CO 0.19 -0.09 0.64 0.20 -1.11 0.00 0.00 175.55 175.38 1toc s GLY 226 N -2.71 2.70 -0.22 0.71 0.00 -0.75 -4.61 107.32 102.45 1toc s GLY 226 Ca 0.08 0.12 -0.09 0.00 0.00 0.00 0.00 44.72 44.83 1toc s GLY 226 CO -0.03 0.75 0.10 -1.36 0.00 0.00 0.00 173.10 172.57 1toc s PHE 227 N -0.55 3.23 -0.11 1.90 0.40 -0.46 -1.13 117.98 121.25 1toc s PHE 227 Ca 0.32 0.01 0.00 0.00 -0.60 0.00 0.00 56.93 56.66 1toc s PHE 227 Cb -0.20 -2.20 -0.02 0.00 0.51 0.00 0.00 43.02 41.11 1toc s PHE 227 CO 0.20 -0.02 -0.11 0.71 0.70 0.00 0.00 175.22 176.70 1toc s TYR 228 N 0.99 2.84 0.20 0.36 2.02 0.28 -1.43 117.35 122.61 1toc s TYR 228 Ca 0.05 -0.40 -0.32 0.00 -0.37 0.00 0.00 57.07 56.04 1toc s TYR 228 Cb -0.14 -1.80 -0.12 0.00 -0.40 0.00 0.00 41.96 39.50 1toc s TYR 228 CO 0.03 -0.03 1.73 2.41 -1.57 0.00 0.00 175.55 178.13 1toc n THR 229 N 3.11 0.04 -2.49 -0.71 -1.04 0.84 -1.85 114.28 112.18 1toc n THR 229 Ca -0.18 -0.01 -0.40 0.00 -2.04 0.00 0.00 64.05 61.42 1toc n THR 229 Cb 0.53 -1.98 -0.03 0.00 -1.82 0.00 0.00 70.33 67.03 1toc n THR 229 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1toc s HIS 230 N 1.33 2.26 0.16 -1.42 2.46 -1.06 -1.48 115.29 117.53 1toc s HIS 230 Ca 0.76 -0.11 -0.22 0.00 0.47 0.00 0.00 55.06 55.96 1toc s HIS 230 Cb -0.51 -4.58 0.04 0.00 -0.13 0.00 0.00 32.58 27.40 1toc s HIS 230 CO 0.33 -2.07 1.62 0.28 -2.47 0.00 0.00 174.74 172.43 1toc h VAL 231 N 6.29 0.34 -0.67 0.89 2.07 -1.26 -2.91 116.25 121.01 1toc h VAL 231 Ca -0.18 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.48 1toc h VAL 231 Cb 1.05 0.34 -0.10 0.00 -1.52 0.00 0.00 31.29 31.07 1toc h VAL 231 CO 1.30 0.00 0.15 0.15 0.02 0.00 0.00 177.57 179.19 1toc h PHE 232 N -0.25 0.23 -0.42 1.57 3.57 -1.88 0.24 116.94 120.00 1toc h PHE 232 Ca 0.15 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.74 1toc h PHE 232 Cb 0.49 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.18 1toc h PHE 232 CO -0.44 -0.06 0.16 0.00 -2.23 0.00 0.00 178.31 175.75 1toc h ARG 233 N 0.27 0.33 -0.01 1.11 2.47 -1.88 -1.95 114.38 114.71 1toc h ARG 233 Ca 0.36 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 59.06 1toc h ARG 233 Cb 0.57 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.82 1toc h ARG 233 CO -0.45 0.22 0.00 1.28 0.56 0.00 0.00 179.97 181.57 1toc n LEU 234 N -4.99 0.16 -0.24 3.04 4.77 0.11 -4.10 117.00 115.74 1toc n LEU 234 Ca 0.03 -0.06 0.04 0.00 -0.03 0.00 0.00 56.01 55.98 1toc n LEU 234 Cb 0.14 -0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.39 1toc n LEU 234 CO 0.27 0.03 0.98 0.50 -1.33 0.00 0.00 177.39 177.84 1toc h LYS 235 N 0.23 0.37 -0.71 3.23 3.64 0.17 -0.43 116.57 123.08 1toc h LYS 235 Ca 0.00 -0.02 0.14 0.00 -1.27 0.00 0.00 60.65 59.50 1toc h LYS 235 Cb 0.05 -0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 31.69 1toc h LYS 235 CO 0.00 0.25 0.24 -0.22 -2.27 0.00 0.00 179.45 177.45 1toc h LYS 236 N 0.38 0.36 0.62 1.90 3.64 -1.77 -1.92 116.57 119.78 1toc h LYS 236 Ca 0.38 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.71 1toc h LYS 236 Cb 0.56 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.31 1toc h LYS 236 CO -0.40 0.24 -0.30 2.35 -2.27 0.00 0.00 179.45 179.07 1toc h TRP 237 N 0.37 -0.77 -0.98 1.91 7.01 -1.39 -0.84 115.95 121.25 1toc h TRP 237 Ca 0.39 -0.02 0.23 0.00 2.11 0.00 0.00 58.89 61.60 1toc h TRP 237 Cb 0.60 0.26 -0.19 0.00 -2.10 0.00 0.00 29.16 27.73 1toc h TRP 237 CO -0.20 -0.44 -0.12 -0.89 -2.79 0.00 0.00 178.44 174.00 1toc n ILE 238 N -5.40 -0.41 0.45 2.65 5.41 -0.83 -0.08 119.36 121.14 1toc n ILE 238 Ca -0.13 2.21 -0.18 0.00 1.00 0.00 0.00 62.75 65.66 1toc n ILE 238 Cb 0.36 -3.14 -0.08 0.00 -0.71 0.00 0.00 39.64 36.06 1toc n ILE 238 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 1toc h GLN 239 N 0.00 -1.11 -1.04 0.38 1.08 -1.01 -2.07 115.11 111.34 1toc h GLN 239 Ca 0.53 0.08 0.37 0.00 -1.45 0.00 0.00 58.65 58.17 1toc h GLN 239 Cb 0.96 0.25 -0.16 0.00 -0.05 0.00 0.00 27.48 28.48 1toc h GLN 239 CO -0.97 -0.74 0.60 -0.22 -0.95 0.00 0.00 178.83 176.55 1toc h LYS 240 N -1.19 0.18 0.71 1.46 3.64 0.97 -0.40 116.57 121.96 1toc h LYS 240 Ca -0.12 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.22 1toc h LYS 240 Cb 0.88 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.66 1toc h LYS 240 CO 0.19 0.12 -0.34 0.28 -2.27 0.00 0.00 179.45 177.43 1toc h VAL 241 N 0.19 0.00 -0.11 2.00 2.07 -0.46 -3.20 116.25 116.74 1toc h VAL 241 Ca 0.78 -0.27 0.02 0.00 0.82 0.00 0.00 66.70 68.05 1toc h VAL 241 Cb 1.98 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 1toc h VAL 241 CO -0.63 0.00 -0.00 0.40 0.02 0.00 0.00 177.57 177.36 1toc h ILE 242 N -1.22 0.92 -0.07 4.57 2.04 -0.42 -3.05 117.51 120.27 1toc h ILE 242 Ca -0.10 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 65.77 1toc h ILE 242 Cb 0.73 0.89 -0.00 0.00 -0.74 0.00 0.00 36.82 37.70 1toc h ILE 242 CO 0.16 0.01 0.11 0.44 0.00 0.00 0.00 178.15 178.86 1toc h ASP 243 N 0.03 0.00 1.60 1.72 5.19 -1.37 -2.06 116.42 121.53 1toc h ASP 243 Ca 0.05 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 1toc h ASP 243 Cb 0.06 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.57 1toc h ASP 243 CO -0.09 0.00 0.00 0.03 -3.12 0.00 0.00 179.24 176.06 1toc h ARG 244 N 0.00 0.00 0.00 3.56 3.08 -1.52 -3.24 114.38 116.26 1toc h ARG 244 Ca 0.03 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 1toc h ARG 244 Cb 0.25 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1toc h ARG 244 CO -0.00 0.00 -0.24 -0.07 -1.07 0.00 0.00 179.97 178.59 1toc h LEU 245 N 0.00 0.00 0.00 3.04 -0.00 -1.50 -3.49 115.31 113.37 1toc h LEU 245 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1toc h LEU 245 Cb 0.80 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.46 1toc h LEU 245 CO 0.00 0.24 0.00 0.61 -0.00 0.00 0.00 178.44 179.29 1toc n GLY 246 N -0.74 -0.38 0.00 0.83 0.00 -1.22 -5.20 105.19 98.48 1toc n GLY 246 Ca -0.02 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1toc n GLY 246 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06