#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 3.83 -0.78 1.39 1.01 0.84 -2.83 120.40 123.85 1toc s VAL 17 Ca 0.00 1.10 0.00 0.00 0.00 0.00 0.00 61.98 63.08 1toc s VAL 17 Cb 0.00 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1toc s VAL 17 CO 0.00 -0.06 0.00 -0.62 0.00 0.00 0.00 175.10 174.42 1toc n GLU 18 N 6.24 -0.98 0.00 2.72 -0.58 -1.26 -2.17 120.64 124.60 1toc n GLU 18 Ca 0.15 0.68 0.00 0.00 -0.42 0.00 0.00 57.16 57.56 1toc n GLU 18 Cb 0.44 -4.64 0.00 0.00 -0.57 0.00 0.00 31.44 26.66 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 -1.14 0.24 3.43 0.62 0.00 -1.13 -4.82 105.19 102.40 1toc n GLY 19 Ca -0.07 -1.63 -0.10 0.00 0.00 0.00 0.00 46.02 44.21 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 0.52 1.25 0.19 1.61 -2.07 -0.07 -4.92 119.66 116.16 1toc s GLN 20 Ca 0.00 -0.81 -0.33 0.00 -1.82 0.00 0.00 55.36 52.40 1toc s GLN 20 Cb 0.00 0.49 -0.14 0.00 -1.09 0.00 0.00 33.01 32.27 1toc s GLN 20 CO 0.00 -0.51 1.46 -0.25 -1.32 0.00 0.00 175.29 174.67 1toc n ASP 21 N -0.29 2.74 -4.79 12.60 8.00 -1.26 0.17 116.55 133.72 1toc n ASP 21 Ca -0.12 1.12 -0.39 0.00 0.71 0.00 0.00 54.79 56.11 1toc n ASP 21 Cb 0.63 -1.40 -0.06 0.00 -0.02 0.00 0.00 41.12 40.27 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 0.39 3.56 0.43 2.24 0.00 -0.54 -4.73 121.76 123.10 1toc s ALA 22 Ca 0.74 -0.03 -0.25 0.00 0.00 0.00 0.00 51.96 52.42 1toc s ALA 22 Cb -0.70 -2.64 -0.08 0.00 0.00 0.00 0.00 23.12 19.70 1toc s ALA 22 CO 0.45 0.29 1.36 -1.21 0.00 0.00 0.00 175.76 176.64 1toc s GLU 23 N -0.60 3.81 0.02 0.00 2.02 -1.26 -4.84 118.70 117.85 1toc s GLU 23 Ca 0.29 2.27 -0.35 0.00 0.02 0.00 0.00 54.97 57.19 1toc s GLU 23 Cb -0.18 -2.69 -0.14 0.00 0.10 0.00 0.00 34.13 31.23 1toc s GLU 23 CO 0.17 -0.66 1.68 0.28 0.02 0.00 0.00 175.26 176.75 1toc n VAL 24 N -0.07 0.25 -0.80 2.63 0.31 -1.26 -0.74 118.33 118.66 1toc n VAL 24 Ca 0.05 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1toc n VAL 24 Cb 0.43 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 31.80 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 3.77 1.02 0.30 2.92 0.00 -1.26 -4.91 105.19 107.01 1toc n GLY 25 Ca 0.20 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.33 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 0.06 -6.18 0.99 5.85 -1.29 -3.31 115.31 111.43 1toc h LEU 26 Ca 0.00 -0.00 -0.58 0.00 0.84 0.00 0.00 57.88 58.14 1toc h LEU 26 Cb 0.00 -0.01 -0.40 0.00 0.37 0.00 0.00 40.66 40.62 1toc h LEU 26 CO 0.00 0.04 -0.94 -0.24 -0.34 0.00 0.00 178.44 176.96 1toc n SER 27 N -4.50 0.99 0.00 1.25 2.88 -1.26 -4.97 113.62 108.02 1toc n SER 27 Ca 0.01 -2.82 0.00 0.00 -1.33 0.00 0.00 58.87 54.73 1toc n SER 27 Cb 0.21 -0.64 0.00 0.00 -0.75 0.00 0.00 64.21 63.03 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 1.60 0.00 0.00 -1.46 -0.04 -1.25 -1.38 135.00 132.47 1toc n PRO 28 Ca 0.24 0.43 0.10 0.00 -0.04 0.00 0.00 63.50 64.23 1toc n PRO 28 Cb 0.48 -1.53 -0.07 0.00 -0.04 0.00 0.00 33.50 32.34 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 -1.42 0.00 -1.72 0.54 2.14 -0.93 -0.82 117.44 115.24 1toc n TRP 29 Ca 0.00 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.15 1toc n TRP 29 Cb 0.03 -0.03 -0.01 0.00 -0.81 0.00 0.00 31.31 30.50 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 -1.41 2.29 -3.59 -2.67 -0.06 -0.48 0.07 117.38 111.53 1toc n GLN 30 Ca 0.05 0.81 -0.27 0.00 -2.00 0.00 0.00 57.00 55.58 1toc n GLN 30 Cb 0.34 -2.45 -0.16 0.00 -4.06 0.00 0.00 30.24 23.91 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 -0.90 -0.03 0.32 1.69 1.01 0.33 -3.38 120.40 119.44 1toc s VAL 31 Ca 0.57 -0.44 -0.29 0.00 0.00 0.00 0.00 61.98 61.82 1toc s VAL 31 Cb -0.55 -0.78 -0.10 0.00 0.00 0.00 0.00 36.38 34.95 1toc s VAL 31 CO 0.60 -0.46 1.27 -0.32 0.00 0.00 0.00 175.10 176.19 1toc s MET 32 N 2.10 4.40 -0.41 2.72 1.75 -0.46 -0.95 119.30 128.44 1toc s MET 32 Ca 0.05 2.14 -0.07 0.00 -1.25 0.00 0.00 55.69 56.57 1toc s MET 32 Cb -0.16 -3.08 0.09 0.00 2.84 0.00 0.00 34.83 34.52 1toc s MET 32 CO -0.20 -0.12 0.23 -1.17 -0.65 0.00 0.00 175.02 173.11 1toc s LEU 33 N -1.75 5.17 0.39 4.11 1.98 -1.25 -2.37 118.68 124.96 1toc s LEU 33 Ca 0.48 -1.72 -0.04 0.00 -2.89 0.00 0.00 54.13 49.97 1toc s LEU 33 Cb -0.38 -1.92 -0.04 0.00 0.66 0.00 0.00 46.19 44.51 1toc s LEU 33 CO 0.51 -0.54 0.66 0.12 -1.89 0.00 0.00 176.35 175.20 1toc s PHE 34 N 1.31 3.51 -0.17 5.38 2.19 0.21 -1.76 117.98 128.66 1toc s PHE 34 Ca 0.04 0.65 0.00 0.00 0.33 0.00 0.00 56.93 57.96 1toc s PHE 34 Cb -0.23 -2.14 0.01 0.00 -1.31 0.00 0.00 43.02 39.34 1toc s PHE 34 CO -0.01 -0.03 -0.16 0.50 1.83 0.00 0.00 175.22 177.35 1toc s ARG 35 N -4.24 3.14 0.12 10.12 3.52 -0.14 -0.38 118.95 131.09 1toc s ARG 35 Ca 0.45 -0.77 -0.28 0.00 -0.13 0.00 0.00 55.73 55.00 1toc s ARG 35 Cb -0.10 -2.63 -0.09 0.00 -1.56 0.00 0.00 34.95 30.57 1toc s ARG 35 CO 0.37 -0.08 1.47 0.87 -0.81 0.00 0.00 175.30 177.12 1toc h LYS 36 N 7.59 -0.27 -2.86 5.12 1.57 -0.87 -2.68 116.57 124.17 1toc h LYS 36 Ca -0.37 0.02 -0.33 0.00 -1.87 0.00 0.00 60.65 58.09 1toc h LYS 36 Cb 1.17 0.06 -0.37 0.00 0.08 0.00 0.00 32.23 33.18 1toc h LYS 36 CO 0.59 -0.18 -0.65 -1.12 -0.57 0.00 0.00 179.45 177.52 1toc s SER 37 N -4.80 1.29 0.70 0.86 0.01 -1.26 -3.25 113.70 107.26 1toc s SER 37 Ca -0.12 -0.05 -0.12 0.00 1.31 0.00 0.00 55.95 56.96 1toc s SER 37 Cb 0.08 0.22 0.02 0.00 0.21 0.00 0.00 66.02 66.55 1toc s SER 37 CO 0.53 -0.30 1.09 -2.84 0.41 0.00 0.00 173.24 172.13 1toc s PRO 37 N 2.28 2.65 -0.98 12.44 0.02 -1.26 -5.04 135.00 145.12 1toc s PRO 37 Ca 0.04 1.20 -0.24 0.00 0.02 0.00 0.00 61.00 62.03 1toc s PRO 37 Cb -0.14 -1.94 -0.01 0.00 0.02 0.00 0.00 34.50 32.42 1toc s PRO 37 CO -0.09 -1.34 1.77 -0.65 -0.33 0.00 0.00 177.00 176.37 1toc s GLN 38 N -4.59 2.95 0.36 5.54 -0.21 -1.20 -4.57 119.66 117.94 1toc s GLN 38 Ca 0.63 -0.70 0.04 0.00 0.02 0.00 0.00 55.36 55.35 1toc s GLN 38 Cb -0.17 -5.19 -0.03 0.00 1.00 0.00 0.00 33.01 28.61 1toc s GLN 38 CO 0.49 -2.99 0.16 -1.83 -2.12 0.00 0.00 175.29 169.01 1toc s GLU 39 N 6.18 1.78 -0.25 2.91 -1.05 -1.01 -4.96 118.70 122.30 1toc s GLU 39 Ca 0.61 -2.05 -0.12 0.00 -0.15 0.00 0.00 54.97 53.26 1toc s GLU 39 Cb -0.04 -0.29 -0.05 0.00 -0.44 0.00 0.00 34.13 33.32 1toc s GLU 39 CO -0.02 -0.49 0.24 -1.17 0.95 0.00 0.00 175.26 174.77 1toc s LEU 40 N -3.48 4.08 -0.23 1.83 2.96 -1.26 -0.97 118.68 121.60 1toc s LEU 40 Ca 0.31 0.16 -0.04 0.00 -0.22 0.00 0.00 54.13 54.35 1toc s LEU 40 Cb 0.04 -2.23 -0.18 0.00 0.50 0.00 0.00 46.19 44.32 1toc s LEU 40 CO 0.18 -0.04 -0.10 0.18 -1.32 0.00 0.00 176.35 175.26 1toc n LEU 41 N 4.75 2.68 0.00 -0.68 4.32 -0.72 -4.96 117.00 122.38 1toc n LEU 41 Ca -0.13 0.04 0.00 0.00 -0.02 0.00 0.00 56.01 55.91 1toc n LEU 41 Cb 0.52 -0.95 0.00 0.00 -1.62 0.00 0.00 43.42 41.37 1toc n LEU 41 CO 0.35 0.83 0.00 0.00 -1.22 0.00 0.00 177.39 177.35 1toc s GLY 43 N 0.00 -0.07 -0.10 0.00 0.00 -0.96 -3.78 107.32 102.40 1toc s GLY 43 Ca 0.00 -0.24 -0.33 0.00 0.00 0.00 0.00 44.72 44.15 1toc s GLY 43 CO 0.00 -0.01 1.41 0.00 0.00 0.00 0.00 173.10 174.51 1toc s ALA 44 N -3.53 -2.44 0.07 3.20 0.00 -0.13 -3.82 121.76 115.11 1toc s ALA 44 Ca 0.12 1.03 0.03 0.00 0.00 0.00 0.00 51.96 53.14 1toc s ALA 44 Cb -0.05 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1toc s ALA 44 CO 0.06 -1.00 0.06 -1.54 0.00 0.00 0.00 175.76 173.34 1toc s SER 45 N -2.89 5.44 -0.54 0.00 1.04 -0.81 0.12 113.70 116.06 1toc s SER 45 Ca 0.14 -0.02 -0.17 0.00 0.48 0.00 0.00 55.95 56.39 1toc s SER 45 Cb 0.06 -1.45 0.11 0.00 0.10 0.00 0.00 66.02 64.85 1toc s SER 45 CO -0.06 0.19 0.53 -0.22 0.98 0.00 0.00 173.24 174.66 1toc s LEU 46 N -2.26 5.91 0.07 2.42 0.20 0.11 -1.14 118.68 123.99 1toc s LEU 46 Ca 0.27 -1.62 0.27 0.00 0.69 0.00 0.00 54.13 53.74 1toc s LEU 46 Cb -0.12 -2.23 1.07 0.00 -0.43 0.00 0.00 46.19 44.47 1toc s LEU 46 CO 0.20 -0.89 1.85 2.30 -0.29 0.00 0.00 176.35 179.52 1toc n ILE 47 N 5.32 0.26 -3.65 6.68 -5.35 -1.01 -2.90 119.36 118.71 1toc n ILE 47 Ca -0.13 -0.06 -0.02 0.00 -0.27 0.00 0.00 62.75 62.28 1toc n ILE 47 Cb 0.41 -0.58 -0.05 0.00 -1.74 0.00 0.00 39.64 37.69 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 -3.48 -0.01 0.57 7.28 1.04 -1.11 -4.70 113.70 113.29 1toc s SER 48 Ca 0.12 0.02 0.44 0.00 0.48 0.00 0.00 55.95 57.02 1toc s SER 48 Cb 0.16 0.02 1.57 0.00 0.10 0.00 0.00 66.02 67.87 1toc s SER 48 CO 0.53 -0.01 1.56 -2.24 0.98 0.00 0.00 173.24 174.06 1toc h ASP 49 N 2.25 0.00 0.00 7.02 2.03 -1.89 0.12 116.42 125.95 1toc h ASP 49 Ca -0.12 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.08 1toc h ASP 49 Cb 1.19 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.68 1toc h ASP 49 CO 0.21 0.00 -0.64 -0.09 -1.03 0.00 0.00 179.24 177.69 1toc h ARG 50 N 0.00 0.00 -6.13 4.15 9.65 -1.92 0.11 114.38 120.24 1toc h ARG 50 Ca 0.80 0.00 -0.52 0.00 -1.10 0.00 0.00 59.98 59.16 1toc h ARG 50 Cb 3.40 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 31.96 1toc h ARG 50 CO -0.01 0.77 -0.42 -1.58 2.80 0.00 0.00 179.97 181.53 1toc s TRP 51 N -2.22 3.48 -0.05 2.20 0.52 0.03 -1.40 118.94 121.50 1toc s TRP 51 Ca -0.21 0.15 0.02 0.00 0.02 0.00 0.00 56.10 56.08 1toc s TRP 51 Cb 0.02 -1.70 0.01 0.00 -1.15 0.00 0.00 33.47 30.65 1toc s TRP 51 CO 0.51 0.46 -0.09 0.08 0.02 0.00 0.00 176.95 177.94 1toc s VAL 52 N -1.83 0.82 -0.24 4.03 1.01 -0.41 -2.41 120.40 121.37 1toc s VAL 52 Ca 0.35 -0.32 -0.07 0.00 0.00 0.00 0.00 61.98 61.94 1toc s VAL 52 Cb -0.11 -0.77 -0.03 0.00 0.00 0.00 0.00 36.38 35.48 1toc s VAL 52 CO 0.29 0.28 0.06 -0.22 0.00 0.00 0.00 175.10 175.51 1toc s LEU 53 N 0.59 3.45 0.30 3.92 2.96 -0.29 -0.62 118.68 128.99 1toc s LEU 53 Ca -0.10 -0.19 0.03 0.00 -0.22 0.00 0.00 54.13 53.66 1toc s LEU 53 Cb -0.13 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.60 1toc s LEU 53 CO 0.02 -0.01 0.18 0.28 -1.32 0.00 0.00 176.35 175.49 1toc s THR 54 N 1.48 0.22 -0.22 3.68 -1.32 -0.47 -1.93 115.64 117.08 1toc s THR 54 Ca 0.06 -2.00 -0.22 0.00 -1.21 0.00 0.00 61.69 58.31 1toc s THR 54 Cb -0.15 -2.50 -0.02 0.00 -1.51 0.00 0.00 72.50 68.32 1toc s THR 54 CO 0.03 0.00 0.72 0.00 -2.21 0.00 0.00 174.62 173.16 1toc s ALA 55 N -3.65 3.59 0.20 11.08 0.00 -1.26 -0.98 121.76 130.73 1toc s ALA 55 Ca 0.37 -0.23 -0.23 0.00 0.00 0.00 0.00 51.96 51.87 1toc s ALA 55 Cb 0.05 -3.12 0.11 0.00 0.00 0.00 0.00 23.12 20.16 1toc s ALA 55 CO 0.19 -0.75 1.56 0.00 0.00 0.00 0.00 175.76 176.75 1toc h ALA 56 N 7.64 -0.14 0.00 0.00 0.00 -1.67 0.29 119.26 125.38 1toc h ALA 56 Ca -0.27 0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1toc h ALA 56 Cb 1.12 1.06 0.00 0.00 0.00 0.00 0.00 17.79 19.97 1toc h ALA 56 CO 0.81 -0.75 0.22 -2.39 0.00 0.00 0.00 179.25 177.14 1toc n HIS 57 N -5.41 0.14 0.05 0.00 1.44 -1.26 -0.16 115.22 110.02 1toc n HIS 57 Ca 0.06 0.07 0.01 0.00 -2.01 0.00 0.00 57.72 55.85 1toc n HIS 57 Cb 0.35 -0.42 0.35 0.00 0.12 0.00 0.00 29.99 30.39 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 -4.30 0.76 -3.96 0.00 4.77 0.77 -4.92 117.00 110.12 1toc n LEU 59 Ca 0.01 -0.02 -0.30 0.00 -0.03 0.00 0.00 56.01 55.67 1toc n LEU 59 Cb 0.23 0.09 -0.16 0.00 -2.33 0.00 0.00 43.42 41.25 1toc n LEU 59 CO 0.38 0.44 -0.45 -0.22 -1.33 0.00 0.00 177.39 176.21 1toc s LEU 60 N -5.22 2.06 0.05 2.23 2.96 -0.87 -0.90 118.68 118.99 1toc s LEU 60 Ca -0.11 -0.81 -0.27 0.00 -0.22 0.00 0.00 54.13 52.72 1toc s LEU 60 Cb 0.04 -1.13 0.09 0.00 0.50 0.00 0.00 46.19 45.70 1toc s LEU 60 CO 0.50 -0.16 0.78 -0.47 -1.32 0.00 0.00 176.35 175.68 1toc s TYR 60 N 1.48 -0.43 0.00 5.38 5.04 0.10 -4.11 117.35 124.81 1toc s TYR 60 Ca -0.01 0.28 0.00 0.00 -2.44 0.00 0.00 57.07 54.91 1toc s TYR 60 Cb -0.16 0.54 0.00 0.00 0.35 0.00 0.00 41.96 42.69 1toc s TYR 60 CO -0.08 -0.66 0.00 -2.30 -1.34 0.00 0.00 175.55 171.17 1toc n PRO 60 N -0.25 0.00 -1.31 4.97 -0.02 -1.26 -3.09 135.00 134.04 1toc n PRO 60 Ca -0.12 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.36 1toc n PRO 60 Cb 0.63 -0.09 0.11 0.00 -0.02 0.00 0.00 33.50 34.13 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 -0.04 0.58 -3.91 6.00 8.01 -1.26 -4.97 117.44 121.85 1toc n TRP 60 Ca 0.00 -1.41 -0.25 0.00 -1.31 0.00 0.00 57.50 54.53 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 -0.55 -0.62 -3.88 -0.99 9.92 -1.25 -4.94 116.55 114.23 1toc n ASP 60 Ca 0.18 -0.97 -0.30 0.00 -0.53 0.00 0.00 54.79 53.18 1toc n ASP 60 Cb 0.87 -3.24 -0.14 0.00 -0.64 0.00 0.00 41.12 37.98 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 -6.46 1.82 -0.33 -1.24 2.20 -1.18 -5.00 119.74 109.56 1toc s LYS 60 Ca 0.04 -2.51 -0.01 0.00 -0.36 0.00 0.00 55.97 53.12 1toc s LYS 60 Cb -0.02 -3.06 0.12 0.00 -1.51 0.00 0.00 37.83 33.36 1toc s LYS 60 CO 0.87 -1.14 0.17 1.21 -0.36 0.00 0.00 175.35 176.11 1toc s ASN 60 N -0.20 3.34 -0.09 1.43 2.47 -1.22 0.01 114.94 120.69 1toc s ASN 60 Ca 0.18 -1.83 -0.18 0.00 0.42 0.00 0.00 52.86 51.45 1toc s ASN 60 Cb -0.24 -0.48 -0.05 0.00 -1.45 0.00 0.00 41.25 39.04 1toc s ASN 60 CO -0.01 -0.37 0.46 -0.36 -3.72 0.00 0.00 177.10 173.11 1toc s PHE 60 N 1.46 3.56 0.27 0.43 0.08 -0.08 -5.03 117.98 118.67 1toc s PHE 60 Ca 0.14 0.92 0.07 0.00 0.12 0.00 0.00 56.93 58.18 1toc s PHE 60 Cb -0.20 -2.50 -0.03 0.00 -0.57 0.00 0.00 43.02 39.72 1toc s PHE 60 CO -0.16 0.27 0.21 -0.08 -0.10 0.00 0.00 175.22 175.36 1toc s THR 60 N 0.25 4.19 0.62 0.64 -1.32 -1.26 -4.89 115.64 113.88 1toc s THR 60 Ca 0.25 -1.42 0.28 0.00 -1.21 0.00 0.00 61.69 59.59 1toc s THR 60 Cb -0.15 -3.33 0.33 0.00 -1.51 0.00 0.00 72.50 67.84 1toc s THR 60 CO 0.11 -0.31 1.83 -0.37 -2.21 0.00 0.00 174.62 173.67 1toc h VAL 61 N 1.45 0.19 -0.31 5.08 -1.51 -1.95 -1.81 116.25 117.39 1toc h VAL 61 Ca -0.47 0.00 -0.20 0.00 -1.23 0.00 0.00 66.70 64.80 1toc h VAL 61 Cb 1.24 0.58 -0.09 0.00 -2.13 0.00 0.00 31.29 30.89 1toc h VAL 61 CO 0.60 0.00 0.25 0.47 -1.23 0.00 0.00 177.57 177.67 1toc n ASP 62 N -3.32 5.27 0.00 4.19 8.00 -1.26 -3.45 116.55 125.97 1toc n ASP 62 Ca 0.05 -2.74 0.00 0.00 0.71 0.00 0.00 54.79 52.80 1toc n ASP 62 Cb 0.62 -0.95 0.00 0.00 -0.02 0.00 0.00 41.12 40.77 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 0.53 0.00 -4.77 -2.24 9.92 -0.68 -4.99 116.55 114.31 1toc n ASP 63 Ca 0.19 0.00 -0.39 0.00 -0.53 0.00 0.00 54.79 54.07 1toc n ASP 63 Cb 0.64 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 41.06 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 -1.57 4.45 0.06 0.64 1.43 -1.22 -0.16 118.68 122.31 1toc s LEU 64 Ca 0.00 1.22 0.07 0.00 -1.03 0.00 0.00 54.13 54.40 1toc s LEU 64 Cb 0.00 -2.95 -0.03 0.00 0.03 0.00 0.00 46.19 43.24 1toc s LEU 64 CO 0.00 0.14 -0.21 -0.76 0.23 0.00 0.00 176.35 175.75 1toc s LEU 65 N -0.43 2.20 -0.35 1.79 1.43 0.49 -4.41 118.68 119.40 1toc s LEU 65 Ca 0.31 -0.56 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 1toc s LEU 65 Cb -0.19 -0.94 0.09 0.00 0.03 0.00 0.00 46.19 45.18 1toc s LEU 65 CO 0.18 0.13 0.07 -0.69 0.23 0.00 0.00 176.35 176.27 1toc s VAL 66 N -0.89 2.63 -0.25 -1.59 1.01 0.97 0.66 120.40 122.94 1toc s VAL 66 Ca 0.07 -2.07 -0.24 0.00 0.00 0.00 0.00 61.98 59.74 1toc s VAL 66 Cb -0.09 -2.81 -0.01 0.00 0.00 0.00 0.00 36.38 33.48 1toc s VAL 66 CO 0.02 -0.50 0.80 -0.13 0.00 0.00 0.00 175.10 175.29 1toc s ARG 67 N 1.03 4.16 -0.00 2.72 0.52 -1.00 -0.87 118.95 125.51 1toc s ARG 67 Ca 0.06 0.86 0.04 0.00 -0.52 0.00 0.00 55.73 56.17 1toc s ARG 67 Cb -0.20 -3.65 -0.03 0.00 0.52 0.00 0.00 34.95 31.58 1toc s ARG 67 CO -0.06 -0.52 -0.10 0.42 0.02 0.00 0.00 175.30 175.06 1toc s ILE 68 N 2.82 3.37 -0.37 1.52 1.01 -1.25 -1.36 121.20 126.94 1toc s ILE 68 Ca 0.34 -0.83 -0.00 0.00 0.00 0.00 0.00 60.65 60.15 1toc s ILE 68 Cb -0.15 -2.43 0.00 0.00 0.01 0.00 0.00 42.46 39.89 1toc s ILE 68 CO 0.08 0.43 0.02 0.61 0.00 0.00 0.00 174.94 176.08 1toc n GLY 69 N 1.73 0.22 3.87 6.18 0.00 -1.22 -0.98 105.19 115.00 1toc n GLY 69 Ca -0.16 -0.69 -0.27 0.00 0.00 0.00 0.00 46.02 44.90 1toc n GLY 69 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1toc n LYS 70 N -1.42 -0.91 0.12 1.61 5.02 -1.26 -4.03 118.16 117.28 1toc n LYS 70 Ca -0.05 -2.28 0.00 0.00 -2.02 0.00 0.00 58.31 53.96 1toc n LYS 70 Cb 0.54 -1.14 0.00 0.00 -0.02 0.00 0.00 35.03 34.41 1toc n LYS 70 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 1toc n HIS 71 N -3.52 -2.81 -2.10 2.13 -0.00 -1.26 -4.95 115.22 102.71 1toc n HIS 71 Ca 0.17 0.66 -0.33 0.00 -0.00 0.00 0.00 57.72 58.22 1toc n HIS 71 Cb 0.58 1.71 0.01 0.00 -0.00 0.00 0.00 29.99 32.29 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 -3.31 5.83 0.08 0.26 0.15 -1.26 0.29 113.70 115.74 1toc s SER 72 Ca 0.00 1.84 -0.14 0.00 0.70 0.00 0.00 55.95 58.35 1toc s SER 72 Cb 0.00 -2.54 -0.22 0.00 -1.71 0.00 0.00 66.02 61.56 1toc s SER 72 CO 0.00 -1.13 1.21 -0.09 1.20 0.00 0.00 173.24 174.43 1toc h ARG 73 N 0.56 0.73 0.00 5.44 2.43 -1.14 -3.44 114.38 118.96 1toc h ARG 73 Ca -0.47 -0.74 0.00 0.00 -0.81 0.00 0.00 59.98 57.96 1toc h ARG 73 Cb 1.22 0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.97 1toc h ARG 73 CO 0.57 1.32 -0.30 0.25 -1.51 0.00 0.00 179.97 180.30 1toc n THR 74 N -3.87 0.78 -1.59 0.20 -2.24 -1.26 -5.04 114.28 101.26 1toc n THR 74 Ca -0.10 0.27 -0.56 0.00 -2.27 0.00 0.00 64.05 61.38 1toc n THR 74 Cb 0.85 -1.68 -0.07 0.00 -2.10 0.00 0.00 70.33 67.34 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 -3.35 0.66 -1.83 -0.78 1.74 -1.26 -4.87 116.66 106.97 1toc n ARG 75 Ca -0.04 0.24 -0.42 0.00 -0.77 0.00 0.00 57.85 56.86 1toc n ARG 75 Cb 0.16 -1.83 -0.03 0.00 -1.02 0.00 0.00 32.46 29.74 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 0.86 2.64 -1.12 -1.55 5.04 -1.26 -4.77 117.35 117.18 1toc s TYR 76 Ca 0.90 0.33 -0.08 0.00 -2.44 0.00 0.00 57.07 55.77 1toc s TYR 76 Cb -1.12 -4.04 0.28 0.00 0.35 0.00 0.00 41.96 37.42 1toc s TYR 76 CO 0.55 -4.08 1.26 0.39 -1.34 0.00 0.00 175.55 172.33 1toc n GLU 77 N 4.81 3.78 0.00 4.97 1.02 -1.26 -5.00 120.64 128.96 1toc n GLU 77 Ca 0.16 -4.41 0.00 0.00 -0.02 0.00 0.00 57.16 52.89 1toc n GLU 77 Cb 0.38 -2.59 0.00 0.00 -0.02 0.00 0.00 31.44 29.21 1toc n GLU 77 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1toc n ARG 77 N 2.61 0.00 -0.48 3.49 0.00 -1.26 -0.85 116.66 120.17 1toc n ARG 77 Ca 0.26 0.00 0.08 0.00 -0.00 0.00 0.00 57.85 58.19 1toc n ARG 77 Cb 0.38 0.00 0.27 0.00 0.00 0.00 0.00 32.46 33.10 1toc n ARG 77 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 1toc n LYS 78 N 0.00 2.98 -0.03 -0.14 0.00 -1.26 -4.74 118.16 114.97 1toc n LYS 78 Ca 0.00 -2.87 -0.04 0.00 -0.00 0.00 0.00 58.31 55.40 1toc n LYS 78 Cb 0.00 -1.87 -0.01 0.00 -0.00 0.00 0.00 35.03 33.15 1toc n LYS 78 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1toc n VAL 79 N -0.48 0.80 -2.03 0.58 0.31 -0.03 -4.97 118.33 112.51 1toc n VAL 79 Ca 0.22 0.28 -0.41 0.00 -0.01 0.00 0.00 64.34 64.43 1toc n VAL 79 Cb 0.92 -1.82 -0.02 0.00 -0.91 0.00 0.00 33.84 32.01 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 -1.95 4.29 -0.74 5.55 -1.05 -1.13 -4.84 118.70 118.82 1toc s GLU 80 Ca -0.12 2.31 0.04 0.00 -0.15 0.00 0.00 54.97 57.04 1toc s GLU 80 Cb 0.02 -3.05 0.18 0.00 -0.44 0.00 0.00 34.13 30.84 1toc s GLU 80 CO 0.18 -0.28 0.55 1.63 0.95 0.00 0.00 175.26 178.29 1toc n LYS 81 N 0.78 2.00 -0.95 -4.83 4.76 -0.16 -4.91 118.16 114.84 1toc n LYS 81 Ca 0.00 -4.50 -0.35 0.00 -2.87 0.00 0.00 58.31 50.59 1toc n LYS 81 Cb 0.41 -2.31 0.06 0.00 -1.84 0.00 0.00 35.03 31.35 1toc n LYS 81 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1toc n ILE 82 N 1.99 0.00 -3.55 -0.18 5.41 -1.26 -3.75 119.36 118.02 1toc n ILE 82 Ca 0.20 -0.43 -0.11 0.00 1.00 0.00 0.00 62.75 63.42 1toc n ILE 82 Cb 0.35 -0.14 -0.04 0.00 -0.71 0.00 0.00 39.64 39.10 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 -1.23 -0.40 0.25 4.38 0.15 -0.05 -4.87 113.70 111.93 1toc s SER 83 Ca 0.44 0.32 0.08 0.00 0.70 0.00 0.00 55.95 57.49 1toc s SER 83 Cb -0.19 0.35 -0.04 0.00 -1.71 0.00 0.00 66.02 64.44 1toc s SER 83 CO 0.79 -0.46 0.15 -0.04 1.20 0.00 0.00 173.24 174.88 1toc s MET 84 N -1.71 2.77 0.01 5.44 -1.94 -1.26 -0.02 119.30 122.59 1toc s MET 84 Ca -0.01 -1.14 0.00 0.00 -1.71 0.00 0.00 55.69 52.84 1toc s MET 84 Cb -0.01 -2.47 0.00 0.00 2.01 0.00 0.00 34.83 34.37 1toc s MET 84 CO -0.01 0.39 0.02 1.28 -0.01 0.00 0.00 175.02 176.70 1toc n LEU 85 N -1.09 0.00 0.00 -0.03 4.77 -1.26 -1.39 117.00 118.00 1toc n LEU 85 Ca -0.08 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 1toc n LEU 85 Cb 0.58 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1toc n LEU 85 CO 0.42 -0.51 -0.08 -0.67 -1.33 0.00 0.00 177.39 175.23 1toc n ASP 86 N -2.99 0.04 -4.00 -1.43 2.03 0.29 -3.95 116.55 106.54 1toc n ASP 86 Ca 0.00 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.21 1toc n ASP 86 Cb 0.01 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.30 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 -1.95 0.36 -0.18 -0.67 -0.14 -1.23 -4.97 119.74 110.96 1toc s LYS 87 Ca 0.00 -0.62 0.01 0.00 -1.36 0.00 0.00 55.97 54.00 1toc s LYS 87 Cb 0.00 -0.02 0.03 0.00 -1.68 0.00 0.00 37.83 36.16 1toc s LYS 87 CO 0.00 -0.02 -0.17 0.42 -0.76 0.00 0.00 175.35 174.82 1toc s ILE 88 N -1.36 1.93 -0.14 2.17 1.01 -1.26 -0.87 121.20 122.68 1toc s ILE 88 Ca -0.13 -0.96 0.02 0.00 0.00 0.00 0.00 60.65 59.58 1toc s ILE 88 Cb -0.09 -1.81 0.01 0.00 0.01 0.00 0.00 42.46 40.58 1toc s ILE 88 CO -0.01 0.43 -0.22 -0.31 0.00 0.00 0.00 174.94 174.84 1toc s TYR 89 N 1.32 2.67 0.15 3.97 2.02 -0.04 -4.98 117.35 122.46 1toc s TYR 89 Ca 0.03 -1.38 0.08 0.00 -0.37 0.00 0.00 57.07 55.44 1toc s TYR 89 Cb -0.14 -1.82 -0.04 0.00 -0.40 0.00 0.00 41.96 39.56 1toc s TYR 89 CO -0.11 -0.63 -0.10 0.96 -1.57 0.00 0.00 175.55 174.09 1toc s ILE 90 N 0.87 3.24 0.19 2.71 -4.36 -1.26 0.08 121.20 122.68 1toc s ILE 90 Ca -0.06 -1.49 -0.32 0.00 -0.26 0.00 0.00 60.65 58.52 1toc s ILE 90 Cb -0.15 -2.56 -0.11 0.00 1.25 0.00 0.00 42.46 40.88 1toc s ILE 90 CO -0.03 -0.01 1.71 -2.28 0.24 0.00 0.00 174.94 174.57 1toc s HIS 91 N -1.47 2.83 0.46 1.37 5.65 -1.06 -4.87 115.29 118.20 1toc s HIS 91 Ca 0.23 0.34 0.13 0.00 0.25 0.00 0.00 55.06 56.01 1toc s HIS 91 Cb -0.10 -4.11 1.08 0.00 -1.18 0.00 0.00 32.58 28.27 1toc s HIS 91 CO 0.14 -4.25 2.07 -1.35 -0.65 0.00 0.00 174.74 170.70 1toc h PRO 92 N 7.03 0.28 -1.14 2.88 0.11 -1.95 -1.66 132.00 137.56 1toc h PRO 92 Ca -0.43 -0.02 -0.47 0.00 0.11 0.00 0.00 66.00 65.19 1toc h PRO 92 Cb 1.20 -0.06 -0.23 0.00 0.11 0.00 0.00 31.00 32.02 1toc h PRO 92 CO 0.95 0.18 0.60 0.54 -0.21 0.00 0.00 178.00 180.07 1toc n ARG 93 N -4.49 2.15 -2.43 1.05 1.74 -1.26 -4.91 116.66 108.52 1toc n ARG 93 Ca 0.03 -2.43 -0.43 0.00 -0.77 0.00 0.00 57.85 54.26 1toc n ARG 93 Cb 0.19 -1.95 -0.02 0.00 -1.02 0.00 0.00 32.46 29.65 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 -2.76 2.46 -1.17 -1.55 5.04 -0.63 -4.66 117.35 114.08 1toc s TYR 94 Ca 0.47 0.60 -0.06 0.00 -2.44 0.00 0.00 57.07 55.64 1toc s TYR 94 Cb 0.38 -4.38 0.25 0.00 0.35 0.00 0.00 41.96 38.56 1toc s TYR 94 CO 0.03 -1.81 1.65 -1.71 -1.34 0.00 0.00 175.55 172.37 1toc n ASN 95 N 8.84 5.86 0.03 4.32 2.85 -0.93 -4.80 115.26 131.44 1toc n ASN 95 Ca 0.14 -3.28 0.01 0.00 -0.11 0.00 0.00 54.58 51.34 1toc n ASN 95 Cb 0.49 -1.36 0.35 0.00 1.24 0.00 0.00 39.78 40.49 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 5.58 0.45 -0.32 1.20 5.08 -1.91 0.13 115.95 126.17 1toc h TRP 96 Ca 0.28 -0.04 -0.12 0.00 1.08 0.00 0.00 58.89 60.09 1toc h TRP 96 Cb 0.62 -0.14 -0.01 0.00 -3.00 0.00 0.00 29.16 26.64 1toc h TRP 96 CO 1.11 0.45 -0.31 -0.22 -1.28 0.00 0.00 178.44 178.20 1toc h LYS 97 N 0.43 0.68 0.00 0.12 3.64 -2.00 -3.38 116.57 116.06 1toc h LYS 97 Ca 0.10 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1toc h LYS 97 Cb 0.27 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1toc h LYS 97 CO 0.01 0.90 0.00 0.39 -2.27 0.00 0.00 179.45 178.48 1toc n GLU 97 N -4.08 0.00 -2.29 1.90 1.02 -1.17 -4.93 120.64 111.08 1toc n GLU 97 Ca -0.01 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.10 1toc n GLU 97 Cb 0.47 -0.15 0.05 0.00 -0.02 0.00 0.00 31.44 31.78 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 -0.94 2.11 -4.15 1.62 6.94 -1.18 -4.97 115.26 114.69 1toc n ASN 98 Ca 0.00 -2.47 -0.34 0.00 -0.02 0.00 0.00 54.58 51.76 1toc n ASN 98 Cb 0.00 -0.42 -0.02 0.00 -2.36 0.00 0.00 39.78 36.97 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 -1.85 -4.76 -4.53 4.77 0.44 -4.89 117.00 105.74 1toc n LEU 99 Ca 0.15 -1.00 -0.41 0.00 -0.03 0.00 0.00 56.01 54.72 1toc n LEU 99 Cb 0.89 -2.13 -0.02 0.00 -2.33 0.00 0.00 43.42 39.82 1toc n LEU 99 CO 0.11 0.34 0.99 -0.62 -1.33 0.00 0.00 177.39 176.88 1toc s ASP 100 N -3.54 6.80 -1.01 -1.43 2.15 -1.22 -3.32 116.67 115.11 1toc s ASP 100 Ca 0.57 2.60 -0.04 0.00 0.43 0.00 0.00 52.55 56.11 1toc s ASP 100 Cb -0.31 -2.63 -0.04 0.00 -0.30 0.00 0.00 42.92 39.64 1toc s ASP 100 CO 0.92 -0.54 0.87 0.54 -0.17 0.00 0.00 175.17 176.78 1toc n ARG 101 N 1.53 -3.50 -2.00 4.34 1.74 -1.26 -2.18 116.66 115.32 1toc n ARG 101 Ca 0.03 0.79 -0.42 0.00 -0.77 0.00 0.00 57.85 57.47 1toc n ARG 101 Cb 0.42 -5.51 0.00 0.00 -1.02 0.00 0.00 32.46 26.35 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 -3.03 4.38 -4.08 0.55 -0.08 -1.21 -4.62 116.55 108.45 1toc n ASP 102 Ca -0.14 -2.94 -0.16 0.00 -1.51 0.00 0.00 54.79 50.03 1toc n ASP 102 Cb 0.63 -1.60 -0.13 0.00 2.34 0.00 0.00 41.12 42.36 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 2.18 0.77 -0.12 5.18 2.07 -1.26 -2.92 121.20 127.10 1toc s ILE 103 Ca 0.44 -0.92 -0.23 0.00 -1.41 0.00 0.00 60.65 58.53 1toc s ILE 103 Cb 0.12 -0.74 0.06 0.00 0.13 0.00 0.00 42.46 42.02 1toc s ILE 103 CO -0.05 -0.14 0.57 0.00 -1.91 0.00 0.00 174.94 173.41 1toc s ALA 104 N -0.96 -1.45 -0.09 1.50 0.00 -0.16 -2.58 121.76 118.02 1toc s ALA 104 Ca -0.03 1.30 0.02 0.00 0.00 0.00 0.00 51.96 53.24 1toc s ALA 104 Cb -0.08 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 22.60 1toc s ALA 104 CO 0.01 -0.31 -0.15 -0.51 0.00 0.00 0.00 175.76 174.80 1toc s LEU 105 N -0.55 2.67 -0.22 0.00 1.43 0.11 -1.37 118.68 120.76 1toc s LEU 105 Ca -0.07 -0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 52.73 1toc s LEU 105 Cb -0.03 -1.57 0.02 0.00 0.03 0.00 0.00 46.19 44.64 1toc s LEU 105 CO 0.05 0.25 -0.11 -0.76 0.23 0.00 0.00 176.35 176.01 1toc s LEU 106 N -0.13 2.73 -0.47 1.79 1.43 0.21 -0.86 118.68 123.39 1toc s LEU 106 Ca -0.01 -0.68 -0.25 0.00 -1.03 0.00 0.00 54.13 52.16 1toc s LEU 106 Cb -0.14 -1.61 0.03 0.00 0.03 0.00 0.00 46.19 44.50 1toc s LEU 106 CO 0.04 -0.05 0.89 -0.75 0.23 0.00 0.00 176.35 176.70 1toc s LYS 107 N 1.35 3.47 0.40 1.70 2.20 -0.05 -1.28 119.74 127.52 1toc s LYS 107 Ca 0.03 0.04 -0.27 0.00 -0.36 0.00 0.00 55.97 55.42 1toc s LYS 107 Cb -0.15 -3.94 -0.09 0.00 -1.51 0.00 0.00 37.83 32.14 1toc s LYS 107 CO -0.07 -1.22 1.35 -0.51 -0.36 0.00 0.00 175.35 174.54 1toc s LEU 108 N 3.64 4.24 0.16 5.43 1.43 -0.49 0.11 118.68 133.20 1toc s LEU 108 Ca 0.34 2.76 -0.14 0.00 -1.03 0.00 0.00 54.13 56.06 1toc s LEU 108 Cb -0.11 -3.84 0.05 0.00 0.03 0.00 0.00 46.19 42.32 1toc s LEU 108 CO 0.25 -0.86 1.79 0.50 0.23 0.00 0.00 176.35 178.25 1toc h LYS 109 N 2.77 0.69 -4.31 1.70 3.64 -1.35 -3.42 116.57 116.28 1toc h LYS 109 Ca -0.50 -0.07 -0.54 0.00 -1.27 0.00 0.00 60.65 58.28 1toc h LYS 109 Cb 1.25 -0.14 -0.37 0.00 -0.41 0.00 0.00 32.23 32.56 1toc h LYS 109 CO 0.63 0.51 -0.81 1.03 -2.27 0.00 0.00 179.45 178.54 1toc s ARG 110 N -5.94 1.64 -0.47 1.90 0.52 -1.26 -5.00 118.95 110.32 1toc s ARG 110 Ca -0.13 -0.30 -0.45 0.00 -0.52 0.00 0.00 55.73 54.33 1toc s ARG 110 Cb 0.12 -1.64 -0.19 0.00 0.52 0.00 0.00 34.95 33.76 1toc s ARG 110 CO 0.75 -0.24 1.53 -2.30 0.02 0.00 0.00 175.30 175.06 1toc n PRO 111 N 4.83 0.00 -1.57 3.54 -0.02 -1.26 -4.83 135.00 135.69 1toc n PRO 111 Ca -0.14 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 60.96 1toc n PRO 111 Cb 0.50 -1.42 0.05 0.00 -0.02 0.00 0.00 33.50 32.60 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 3.84 3.20 -2.94 4.25 2.08 0.03 -4.89 119.36 124.93 1toc n ILE 112 Ca 0.30 -0.50 -0.44 0.00 0.56 0.00 0.00 62.75 62.67 1toc n ILE 112 Cb -0.06 -0.99 -0.03 0.00 -0.75 0.00 0.00 39.64 37.81 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 -2.51 3.29 0.40 0.38 2.56 -1.26 -4.88 118.70 116.68 1toc s GLU 113 Ca 0.73 -1.30 -0.25 0.00 0.00 0.00 0.00 54.97 54.15 1toc s GLU 113 Cb -0.43 -4.50 -0.11 0.00 2.00 0.00 0.00 34.13 31.08 1toc s GLU 113 CO 0.50 -1.74 0.94 1.28 -0.56 0.00 0.00 175.26 175.68 1toc n LEU 114 N 6.96 2.13 0.00 2.70 4.77 -1.26 -4.90 117.00 127.40 1toc n LEU 114 Ca 0.06 1.04 -0.05 0.00 -0.03 0.00 0.00 56.01 57.03 1toc n LEU 114 Cb 0.46 -1.31 0.02 0.00 -2.33 0.00 0.00 43.42 40.26 1toc n LEU 114 CO 0.57 -1.67 0.33 -1.54 -1.33 0.00 0.00 177.39 173.75 1toc n SER 115 N 0.71 -1.31 0.26 -1.43 3.41 -0.43 -4.98 113.62 109.85 1toc n SER 115 Ca 0.10 -1.89 0.16 0.00 -0.26 0.00 0.00 58.87 56.99 1toc n SER 115 Cb 0.38 2.18 0.77 0.00 -0.26 0.00 0.00 64.21 67.27 1toc n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1toc h ASP 116 N 1.15 0.00 0.00 4.04 5.19 -2.01 -2.33 116.42 122.47 1toc h ASP 116 Ca -0.19 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.21 1toc h ASP 116 Cb 0.72 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.23 1toc h ASP 116 CO 0.24 0.00 -1.20 -1.22 -3.12 0.00 0.00 179.24 173.95 1toc n TYR 117 N -3.14 0.00 -3.58 4.55 4.02 -1.26 -4.92 117.16 112.83 1toc n TYR 117 Ca 0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.50 1toc n TYR 117 Cb 0.48 -0.11 -0.10 0.00 -0.02 0.00 0.00 39.34 39.60 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 -2.26 4.37 -0.12 -0.72 1.09 -0.88 -4.08 121.20 118.61 1toc s ILE 118 Ca -0.02 -1.28 -0.12 0.00 -1.10 0.00 0.00 60.65 58.14 1toc s ILE 118 Cb 0.02 -3.63 0.03 0.00 -1.06 0.00 0.00 42.46 37.83 1toc s ILE 118 CO 0.17 -0.47 0.33 -2.28 -0.10 0.00 0.00 174.94 172.59 1toc s HIS 119 N 1.46 -0.36 0.55 3.97 2.46 0.00 -1.31 115.29 122.07 1toc s HIS 119 Ca 0.03 0.86 -0.18 0.00 0.47 0.00 0.00 55.06 56.24 1toc s HIS 119 Cb -0.22 0.12 -0.05 0.00 -0.13 0.00 0.00 32.58 32.29 1toc s HIS 119 CO 0.03 -0.18 1.06 -1.25 -2.47 0.00 0.00 174.74 171.93 1toc s PRO 120 N 0.11 3.46 0.00 2.88 0.04 -1.26 -2.18 135.00 138.06 1toc s PRO 120 Ca -0.01 1.33 0.00 0.00 0.04 0.00 0.00 61.00 62.36 1toc s PRO 120 Cb -0.02 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1toc s PRO 120 CO 0.01 -0.71 0.00 1.33 0.04 0.00 0.00 177.00 177.67 1toc n VAL 121 N -1.58 0.00 -3.69 -0.36 0.24 -1.14 -4.95 118.33 106.85 1toc n VAL 121 Ca 0.09 0.00 -0.18 0.00 -2.04 0.00 0.00 64.34 62.22 1toc n VAL 121 Cb 0.52 -1.27 -0.17 0.00 -1.47 0.00 0.00 33.84 31.46 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 1.98 4.26 0.66 0.00 1.43 -1.26 -2.20 118.68 123.54 1toc s LEU 123 Ca 0.01 2.42 -0.12 0.00 -1.03 0.00 0.00 54.13 55.41 1toc s LEU 123 Cb -0.12 -3.93 -0.01 0.00 0.03 0.00 0.00 46.19 42.16 1toc s LEU 123 CO -0.04 -0.63 1.06 -2.16 0.23 0.00 0.00 176.35 174.80 1toc s PRO 124 N -2.15 3.10 0.14 1.29 0.04 -1.26 -4.91 135.00 131.25 1toc s PRO 124 Ca 0.55 1.02 0.02 0.00 0.04 0.00 0.00 61.00 62.63 1toc s PRO 124 Cb -0.33 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.16 1toc s PRO 124 CO 0.42 -0.97 -0.05 0.16 0.04 0.00 0.00 177.00 176.59 1toc s ASP 125 N -3.49 1.34 0.01 6.66 -4.77 -1.26 -4.84 116.67 110.32 1toc s ASP 125 Ca 0.59 -1.07 -0.02 0.00 -3.30 0.00 0.00 52.55 48.76 1toc s ASP 125 Cb -0.14 0.07 -0.00 0.00 -1.09 0.00 0.00 42.92 41.76 1toc s ASP 125 CO 0.49 -0.47 0.32 1.17 0.70 0.00 0.00 175.17 177.38 1toc n LYS 126 N -0.15 -0.03 0.02 2.11 4.81 -1.26 -1.31 118.16 122.35 1toc n LYS 126 Ca -0.10 0.32 -0.05 0.00 -0.87 0.00 0.00 58.31 57.60 1toc n LYS 126 Cb 0.62 -0.47 -0.03 0.00 0.02 0.00 0.00 35.03 35.16 1toc n LYS 126 CO 0.00 0.00 0.00 0.37 1.17 0.00 0.00 177.40 178.94 1toc h GLN 127 N 0.00 -0.23 0.00 1.64 4.15 -2.04 0.18 115.11 118.82 1toc h GLN 127 Ca 0.01 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1toc h GLN 127 Cb 0.03 0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.77 1toc h GLN 127 CO -0.06 -0.15 0.00 2.41 -1.93 0.00 0.00 178.83 179.10 1toc n THR 128 N -3.49 0.00 0.00 2.39 -1.04 -0.43 -2.17 114.28 109.54 1toc n THR 128 Ca -0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 1toc n THR 128 Cb 0.14 -0.14 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 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 0.11 0.00 -0.03 2.41 0.00 0.63 -2.27 120.51 121.35 1toc n ALA 129 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 1toc n ALA 129 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 1toc n ALA 129 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1toc h LYS 129 N 0.00 0.73 0.00 0.00 2.10 -1.68 -3.36 116.57 114.37 1toc h LYS 129 Ca 0.00 -0.57 -0.16 0.00 -2.00 0.00 0.00 60.65 57.92 1toc h LYS 129 Cb 0.00 0.11 -0.03 0.00 -0.90 0.00 0.00 32.23 31.41 1toc h LYS 129 CO 0.00 1.19 -1.10 -0.07 -2.00 0.00 0.00 179.45 177.47 1toc h LEU 129 N 0.44 0.00 -6.02 7.07 3.38 -1.72 -3.41 115.31 115.05 1toc h LEU 129 Ca -0.04 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 57.21 1toc h LEU 129 Cb 1.29 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.96 1toc h LEU 129 CO 0.14 0.62 2.74 0.18 0.09 0.00 0.00 178.44 182.22 1toc n LEU 130 N -3.05 7.11 -4.04 1.67 4.77 -1.26 -4.88 117.00 117.31 1toc n LEU 130 Ca -0.05 -4.42 -0.22 0.00 -0.03 0.00 0.00 56.01 51.28 1toc n LEU 130 Cb 0.83 -1.55 -0.16 0.00 -2.33 0.00 0.00 43.42 40.21 1toc n LEU 130 CO 0.43 1.40 -0.46 -1.00 -1.33 0.00 0.00 177.39 176.43 1toc s HIS 131 N 1.65 1.22 0.27 -1.77 3.76 -1.26 -4.98 115.29 114.19 1toc s HIS 131 Ca 0.47 -0.33 -0.31 0.00 -0.15 0.00 0.00 55.06 54.75 1toc s HIS 131 Cb 0.13 -0.85 -0.12 0.00 1.11 0.00 0.00 32.58 32.85 1toc s HIS 131 CO -0.05 -0.13 1.61 0.00 -0.85 0.00 0.00 174.74 175.32 1toc n ALA 132 N 3.27 2.51 0.00 -1.40 0.00 -1.26 -2.43 120.51 121.19 1toc n ALA 132 Ca -0.18 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1toc n ALA 132 Cb 0.54 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.52 1toc n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1toc n GLY 133 N 2.49 3.16 3.72 0.00 0.00 0.37 -4.95 105.19 109.98 1toc n GLY 133 Ca 0.10 -1.05 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 1toc n GLY 133 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1toc n PHE 134 N 0.00 2.63 -2.27 1.61 3.72 -1.02 -4.43 117.46 117.70 1toc n PHE 134 Ca 0.00 0.27 -0.25 0.00 -0.05 0.00 0.00 57.45 57.42 1toc n PHE 134 Cb 0.00 -2.57 0.06 0.00 -0.94 0.00 0.00 39.48 36.03 1toc n PHE 134 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1toc s LYS 135 N -0.17 2.31 0.21 -1.08 1.02 -1.26 -0.46 119.74 120.32 1toc s LYS 135 Ca 0.67 -0.29 -0.09 0.00 0.02 0.00 0.00 55.97 56.28 1toc s LYS 135 Cb -0.55 -2.22 -0.01 0.00 -0.52 0.00 0.00 37.83 34.53 1toc s LYS 135 CO 0.46 -1.12 0.35 0.20 -0.92 0.00 0.00 175.35 174.31 1toc s GLY 136 N -4.48 0.69 -0.16 -3.33 0.00 0.37 -4.84 107.32 95.56 1toc s GLY 136 Ca 0.59 -1.03 0.01 0.00 0.00 0.00 0.00 44.72 44.29 1toc s GLY 136 CO 0.44 -0.84 -0.19 -1.60 0.00 0.00 0.00 173.10 170.90 1toc s ARG 137 N -4.03 3.06 -0.16 2.90 3.52 0.10 0.43 118.95 124.77 1toc s ARG 137 Ca 0.24 -0.82 -0.01 0.00 -0.13 0.00 0.00 55.73 55.01 1toc s ARG 137 Cb 0.02 -2.54 -0.01 0.00 -1.56 0.00 0.00 34.95 30.86 1toc s ARG 137 CO 0.07 -0.09 -0.12 0.08 -0.81 0.00 0.00 175.30 174.43 1toc s VAL 138 N 1.03 3.01 -0.05 7.11 1.01 -0.68 -1.20 120.40 130.62 1toc s VAL 138 Ca -0.02 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.32 1toc s VAL 138 Cb -0.14 -2.29 0.02 0.00 0.00 0.00 0.00 36.38 33.97 1toc s VAL 138 CO -0.06 0.50 -0.04 0.42 0.00 0.00 0.00 175.10 175.92 1toc s THR 139 N 0.79 0.51 0.28 3.92 -4.23 -1.26 -2.46 115.64 113.19 1toc s THR 139 Ca -0.04 -0.07 -0.18 0.00 -1.18 0.00 0.00 61.69 60.21 1toc s THR 139 Cb -0.15 -0.56 0.02 0.00 1.34 0.00 0.00 72.50 73.14 1toc s THR 139 CO 0.01 0.23 0.66 -0.83 -0.54 0.00 0.00 174.62 174.15 1toc s GLY 140 N 1.15 0.14 -0.19 3.99 0.00 -1.16 -4.44 107.32 106.81 1toc s GLY 140 Ca -0.07 -0.52 0.15 0.00 0.00 0.00 0.00 44.72 44.28 1toc s GLY 140 CO -0.01 -0.26 1.67 0.79 0.00 0.00 0.00 173.10 175.28 1toc n TRP 141 N -0.45 1.83 -1.14 1.90 8.01 -1.26 -2.80 117.44 123.54 1toc n TRP 141 Ca -0.04 -0.66 -0.30 0.00 -1.31 0.00 0.00 57.50 55.20 1toc n TRP 141 Cb 0.60 -0.42 0.22 0.00 -2.01 0.00 0.00 31.31 29.70 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 -0.78 1.58 0.84 6.99 0.00 -1.26 -4.63 107.32 110.06 1toc s GLY 142 Ca 0.51 -0.80 -0.11 0.00 0.00 0.00 0.00 44.72 44.32 1toc s GLY 142 CO 0.18 0.00 1.13 -1.31 0.00 0.00 0.00 173.10 173.11 1toc s ASN 143 N -3.82 3.61 0.14 1.64 -0.87 -1.03 -2.71 114.94 111.90 1toc s ASN 143 Ca 0.69 2.09 0.17 0.00 -1.57 0.00 0.00 52.86 54.25 1toc s ASN 143 Cb -0.12 -2.55 -0.06 0.00 -0.02 0.00 0.00 41.25 38.49 1toc s ASN 143 CO 0.56 -2.64 1.01 0.03 -2.57 0.00 0.00 177.10 173.49 1toc h ARG 144 N -1.42 0.00 -5.09 -0.60 3.08 -0.85 0.54 114.38 110.04 1toc h ARG 144 Ca -0.44 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.27 1toc h ARG 144 Cb 1.26 0.00 -0.17 0.00 0.08 0.00 0.00 29.97 31.13 1toc h ARG 144 CO 0.46 0.28 -0.74 1.03 -1.07 0.00 0.00 179.97 179.93 1toc s ARG 145 N -3.01 0.92 0.12 0.04 1.81 -1.26 -4.02 118.95 113.56 1toc s ARG 145 Ca -0.01 -1.22 -0.12 0.00 -1.72 0.00 0.00 55.73 52.66 1toc s ARG 145 Cb 0.08 -0.63 -0.11 0.00 -0.45 0.00 0.00 34.95 33.84 1toc s ARG 145 CO 0.79 0.10 1.37 1.49 -0.68 0.00 0.00 175.30 178.37 1toc h GLU 146 N 3.42 0.86 -3.69 3.54 4.81 -1.93 -3.46 114.58 118.13 1toc h GLU 146 Ca -0.38 -0.60 -0.08 0.00 -0.13 0.00 0.00 59.36 58.18 1toc h GLU 146 Cb 1.19 0.09 -0.12 0.00 0.63 0.00 0.00 28.75 30.54 1toc h GLU 146 CO 0.54 1.22 -0.22 0.95 -0.73 0.00 0.00 179.01 180.78 1toc s THR 147 N -3.99 0.07 0.00 0.32 -4.23 -1.26 -4.98 115.64 101.56 1toc s THR 147 Ca -0.11 -1.14 0.00 0.00 -1.18 0.00 0.00 61.69 59.26 1toc s THR 147 Cb 0.10 -1.66 0.00 0.00 1.34 0.00 0.00 72.50 72.28 1toc s THR 147 CO 0.90 -0.30 0.00 -2.67 -0.54 0.00 0.00 174.62 172.01 1toc n TRP 148 N -0.23 0.00 -0.01 3.99 2.14 -1.26 -5.13 117.44 116.94 1toc n TRP 148 Ca -0.10 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.47 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 -2.68 -1.67 -1.04 -1.26 -4.99 114.28 102.65 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 0.28 -3.19 -4.64 8.00 7.64 -1.26 -4.83 113.62 115.62 1toc n SER 149 Ca 0.00 0.12 -0.53 0.00 1.01 0.00 0.00 58.87 59.47 1toc n SER 149 Cb 0.00 -2.73 -0.06 0.00 -1.01 0.00 0.00 64.21 60.41 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 -3.32 0.12 -1.58 0.44 3.14 -1.26 0.17 118.33 116.05 1toc n VAL 149 Ca -0.08 -0.02 -0.19 0.00 -2.96 0.00 0.00 64.34 61.09 1toc n VAL 149 Cb 0.57 -1.03 -0.08 0.00 -1.06 0.00 0.00 33.84 32.24 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 3.66 -0.30 -1.93 1.55 0.00 -1.26 -4.32 120.51 117.91 1toc n ALA 149 Ca 0.21 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1toc n ALA 149 Cb 0.18 -1.90 0.00 0.00 0.00 0.00 0.00 19.45 17.73 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 -2.28 -3.54 -0.03 0.00 4.07 0.13 -4.99 120.64 113.99 1toc n GLU 149 Ca -0.19 2.50 -0.09 0.00 -0.06 0.00 0.00 57.16 59.32 1toc n GLU 149 Cb 0.62 -2.94 -0.08 0.00 -0.06 0.00 0.00 31.44 28.99 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 3.96 0.99 -3.14 6.31 2.07 -1.75 -3.45 116.25 121.24 1toc h VAL 150 Ca 0.00 -1.61 -0.57 0.00 0.82 0.00 0.00 66.70 65.34 1toc h VAL 150 Cb 0.00 1.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.54 1toc h VAL 150 CO 0.00 0.32 0.72 -1.10 0.02 0.00 0.00 177.57 177.52 1toc s GLN 151 N -2.33 4.32 0.43 1.57 -0.21 -1.26 -0.21 119.66 121.98 1toc s GLN 151 Ca -0.11 1.40 -0.24 0.00 0.02 0.00 0.00 55.36 56.42 1toc s GLN 151 Cb -0.01 -3.61 -0.08 0.00 1.00 0.00 0.00 33.01 30.31 1toc s GLN 151 CO 0.42 -0.51 1.22 -1.25 -2.12 0.00 0.00 175.29 173.05 1toc s PRO 152 N 2.75 3.85 0.01 2.91 0.04 -1.26 -4.99 135.00 138.31 1toc s PRO 152 Ca 0.46 1.95 -0.25 0.00 0.04 0.00 0.00 61.00 63.20 1toc s PRO 152 Cb -0.17 -2.57 -0.16 0.00 0.04 0.00 0.00 34.50 31.64 1toc s PRO 152 CO 0.11 -0.53 1.21 0.66 0.04 0.00 0.00 177.00 178.50 1toc h SER 153 N 2.35 -0.46 -0.45 6.66 4.64 -1.96 -3.42 113.55 120.92 1toc h SER 153 Ca -0.49 -0.12 -0.68 0.00 -0.47 0.00 0.00 61.79 60.03 1toc h SER 153 Cb 1.25 0.12 -0.13 0.00 -0.31 0.00 0.00 62.40 63.33 1toc h SER 153 CO 0.61 -0.10 -0.52 0.68 -0.87 0.00 0.00 176.83 176.63 1toc s VAL 154 N -4.70 1.20 0.36 0.95 -7.23 -1.26 -0.65 120.40 109.08 1toc s VAL 154 Ca -0.14 -2.00 -0.26 0.00 -1.81 0.00 0.00 61.98 57.77 1toc s VAL 154 Cb 0.02 -2.21 -0.12 0.00 0.56 0.00 0.00 36.38 34.63 1toc s VAL 154 CO 0.52 0.00 0.95 -0.11 -0.31 0.00 0.00 175.10 176.14 1toc n LEU 155 N -1.25 1.92 -4.60 1.32 7.94 0.15 -4.81 117.00 117.67 1toc n LEU 155 Ca -0.18 1.08 -0.24 0.00 -1.11 0.00 0.00 56.01 55.56 1toc n LEU 155 Cb 0.67 -1.29 -0.08 0.00 0.53 0.00 0.00 43.42 43.24 1toc n LEU 155 CO 0.39 -1.63 -0.37 -1.10 -1.11 0.00 0.00 177.39 173.57 1toc s GLN 156 N -1.76 2.13 0.05 1.96 -1.52 -1.12 -1.47 119.66 117.92 1toc s GLN 156 Ca 0.61 -1.47 0.01 0.00 -1.95 0.00 0.00 55.36 52.56 1toc s GLN 156 Cb -0.62 -2.08 -0.03 0.00 -0.22 0.00 0.00 33.01 30.06 1toc s GLN 156 CO 0.58 0.37 -0.05 0.54 -0.25 0.00 0.00 175.29 176.48 1toc s VAL 157 N -2.26 0.36 -0.30 1.09 0.11 0.13 -2.97 120.40 116.56 1toc s VAL 157 Ca 0.30 -1.40 -0.13 0.00 -2.93 0.00 0.00 61.98 57.82 1toc s VAL 157 Cb -0.06 -0.97 0.15 0.00 -1.53 0.00 0.00 36.38 33.97 1toc s VAL 157 CO 0.18 -0.68 0.85 0.54 -3.33 0.00 0.00 175.10 172.66 1toc s VAL 158 N -2.53 -0.67 -0.36 2.04 0.11 -1.03 -0.89 120.40 117.07 1toc s VAL 158 Ca -0.03 0.00 -0.22 0.00 -2.93 0.00 0.00 61.98 58.80 1toc s VAL 158 Cb -0.02 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.83 1toc s VAL 158 CO -0.04 0.00 0.71 0.20 -3.33 0.00 0.00 175.10 172.65 1toc s ASN 159 N 2.58 6.50 -0.07 3.54 -0.87 -1.25 -1.69 114.94 123.68 1toc s ASN 159 Ca -0.04 0.27 0.01 0.00 -1.57 0.00 0.00 52.86 51.53 1toc s ASN 159 Cb -0.08 -2.36 -0.03 0.00 -0.02 0.00 0.00 41.25 38.75 1toc s ASN 159 CO -0.18 -0.66 -0.07 -0.76 -2.57 0.00 0.00 177.10 172.86 1toc s LEU 160 N 2.91 3.15 0.30 0.60 1.43 0.17 -4.76 118.68 122.47 1toc s LEU 160 Ca 0.28 -0.03 -0.15 0.00 -1.03 0.00 0.00 54.13 53.20 1toc s LEU 160 Cb -0.14 -1.68 -0.09 0.00 0.03 0.00 0.00 46.19 44.31 1toc s LEU 160 CO 0.16 0.36 0.71 -2.16 0.23 0.00 0.00 176.35 175.65 1toc s PRO 161 N -0.82 4.01 0.35 1.29 0.04 -1.26 0.14 135.00 138.75 1toc s PRO 161 Ca 0.12 0.65 -0.26 0.00 0.04 0.00 0.00 61.00 61.55 1toc s PRO 161 Cb -0.11 -2.51 -0.09 0.00 0.04 0.00 0.00 34.50 31.83 1toc s PRO 161 CO 0.01 0.20 1.03 -0.51 0.04 0.00 0.00 177.00 177.78 1toc s LEU 162 N -2.84 4.29 0.25 -3.56 1.43 0.39 -1.57 118.68 117.08 1toc s LEU 162 Ca 0.52 2.03 0.08 0.00 -1.03 0.00 0.00 54.13 55.73 1toc s LEU 162 Cb -0.11 -4.01 -0.04 0.00 0.03 0.00 0.00 46.19 42.06 1toc s LEU 162 CO 0.18 -0.30 0.13 0.68 0.23 0.00 0.00 176.35 177.27 1toc s VAL 163 N -1.53 4.11 0.36 -1.59 -7.23 -1.17 -0.48 120.40 112.87 1toc s VAL 163 Ca 0.53 -1.57 -0.28 0.00 -1.81 0.00 0.00 61.98 58.85 1toc s VAL 163 Cb -0.23 -3.21 -0.11 0.00 0.56 0.00 0.00 36.38 33.39 1toc s VAL 163 CO 0.30 -0.35 1.44 -1.61 -0.31 0.00 0.00 175.10 174.56 1toc s GLU 164 N -3.76 4.18 0.22 4.82 8.01 -1.26 -4.75 118.70 126.15 1toc s GLU 164 Ca 0.32 2.47 -0.08 0.00 0.01 0.00 0.00 54.97 57.70 1toc s GLU 164 Cb -0.07 -3.00 0.26 0.00 -4.31 0.00 0.00 34.13 27.01 1toc s GLU 164 CO 0.23 -0.44 1.85 0.00 0.01 0.00 0.00 175.26 176.90 1toc h ARG 165 N 3.20 0.87 -0.16 1.61 3.08 -1.98 -1.08 114.38 119.92 1toc h ARG 165 Ca -0.50 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 59.54 1toc h ARG 165 Cb 1.23 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 31.08 1toc h ARG 165 CO 0.65 0.58 0.21 -1.00 -1.07 0.00 0.00 179.97 179.33 1toc h PRO 166 N 0.90 0.00 0.19 0.04 0.13 -2.00 0.73 132.00 131.99 1toc h PRO 166 Ca 0.33 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 65.14 1toc h PRO 166 Cb 0.11 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.26 1toc h PRO 166 CO -0.15 0.00 -1.44 0.28 -0.23 0.00 0.00 178.00 176.46 1toc h VAL 167 N 0.00 1.30 -0.18 1.56 2.07 -1.58 -2.42 116.25 117.00 1toc h VAL 167 Ca 0.08 -2.81 -0.02 0.00 0.82 0.00 0.00 66.70 64.77 1toc h VAL 167 Cb 0.49 2.95 -0.01 0.00 -1.52 0.00 0.00 31.29 33.20 1toc h VAL 167 CO -0.00 0.84 0.04 0.00 0.02 0.00 0.00 177.57 178.47 1toc h LYS 169 N 0.10 0.38 -0.01 0.00 1.79 -1.05 -1.95 116.57 115.82 1toc h LYS 169 Ca 0.06 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1toc h LYS 169 Cb 0.27 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 1toc h LYS 169 CO 0.00 0.25 0.00 0.00 -1.08 0.00 0.00 179.45 178.62 1toc n ALA 170 N -2.34 2.34 0.05 3.86 0.00 -0.91 -3.39 120.51 120.13 1toc n ALA 170 Ca 0.03 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.50 1toc n ALA 170 Cb 0.14 -1.00 0.05 0.00 0.00 0.00 0.00 19.45 18.64 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 -0.49 1.95 -3.69 0.00 3.41 -0.73 -5.01 113.62 109.05 1toc n SER 171 Ca 0.00 -1.63 -0.14 0.00 -0.26 0.00 0.00 58.87 56.84 1toc n SER 171 Cb 0.00 -0.06 -0.09 0.00 -0.26 0.00 0.00 64.21 63.81 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 0.01 0.33 6.66 -1.32 -1.22 -4.86 115.64 114.52 1toc s THR 172 Ca 0.08 -0.08 0.14 0.00 -1.21 0.00 0.00 61.69 60.62 1toc s THR 172 Cb 0.05 -0.72 0.09 0.00 -1.51 0.00 0.00 72.50 70.41 1toc s THR 172 CO 0.07 -0.05 1.79 0.08 -2.21 0.00 0.00 174.62 174.30 1toc h ARG 173 N 4.80 0.00 -6.84 7.08 -0.00 -1.95 -3.45 114.38 114.02 1toc h ARG 173 Ca -0.28 0.00 -0.57 0.00 -0.00 0.00 0.00 59.98 59.13 1toc h ARG 173 Cb 1.17 0.00 0.14 0.00 -0.00 0.00 0.00 29.97 31.29 1toc h ARG 173 CO 0.25 0.40 0.30 -0.89 -0.00 0.00 0.00 179.97 180.04 1toc n ILE 174 N -3.93 3.27 -2.17 0.08 5.41 -1.26 -4.95 119.36 115.80 1toc n ILE 174 Ca -0.02 -0.50 -0.41 0.00 1.00 0.00 0.00 62.75 62.83 1toc n ILE 174 Cb 0.45 -1.34 -0.03 0.00 -0.71 0.00 0.00 39.64 38.01 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 -2.54 4.40 -0.07 0.38 3.52 -1.26 -5.03 118.95 118.35 1toc s ARG 175 Ca 0.70 2.14 0.05 0.00 -0.13 0.00 0.00 55.73 58.49 1toc s ARG 175 Cb -0.46 -3.10 -0.00 0.00 -1.56 0.00 0.00 34.95 29.82 1toc s ARG 175 CO 0.51 -0.14 -0.23 0.42 -0.81 0.00 0.00 175.30 175.05 1toc s ILE 176 N -0.97 1.94 0.50 4.11 -1.09 -1.26 -4.89 121.20 119.53 1toc s ILE 176 Ca 0.49 -0.98 0.04 0.00 -2.23 0.00 0.00 60.65 57.98 1toc s ILE 176 Cb -0.38 -1.66 0.04 0.00 -1.58 0.00 0.00 42.46 38.88 1toc s ILE 176 CO 0.49 0.54 0.34 0.35 -1.23 0.00 0.00 174.94 175.43 1toc n THR 177 N 3.26 0.00 1.11 2.92 -2.24 -1.26 -5.00 114.28 113.07 1toc n THR 177 Ca -0.18 -2.00 0.03 0.00 -2.27 0.00 0.00 64.05 59.63 1toc n THR 177 Cb 0.52 -0.03 0.10 0.00 -2.10 0.00 0.00 70.33 68.83 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 -1.80 1.45 -1.31 3.42 2.03 -1.26 -3.38 116.55 115.69 1toc n ASP 178 Ca -0.03 -2.06 -0.07 0.00 0.52 0.00 0.00 54.79 53.15 1toc n ASP 178 Cb 0.57 -0.23 0.20 0.00 -0.72 0.00 0.00 41.12 40.94 1toc n ASP 178 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1toc n ASN 179 N 0.16 2.69 -3.15 1.67 3.02 -1.26 -4.89 115.26 113.50 1toc n ASN 179 Ca 0.08 -3.74 0.04 0.00 -0.03 0.00 0.00 54.58 50.93 1toc n ASN 179 Cb 0.26 -0.66 -0.01 0.00 -0.61 0.00 0.00 39.78 38.75 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 -3.25 0.48 0.51 3.52 0.23 -1.22 -2.47 119.30 117.11 1toc s MET 180 Ca 0.46 0.82 0.02 0.00 -1.03 0.00 0.00 55.69 55.96 1toc s MET 180 Cb 0.42 0.45 0.02 0.00 -1.53 0.00 0.00 34.83 34.19 1toc s MET 180 CO 0.01 -0.54 0.72 -0.59 -2.03 0.00 0.00 175.02 172.60 1toc s PHE 181 N 2.88 2.90 0.15 3.16 -0.12 -0.81 -4.71 117.98 121.43 1toc s PHE 181 Ca 0.15 -0.04 0.06 0.00 -0.05 0.00 0.00 56.93 57.05 1toc s PHE 181 Cb -0.13 -2.63 -0.04 0.00 -0.63 0.00 0.00 43.02 39.59 1toc s PHE 181 CO -0.19 -0.72 -0.13 0.00 -0.05 0.00 0.00 175.22 174.13 1toc s ALA 183 N -2.79 -0.91 0.00 0.00 0.00 -0.33 -3.06 121.76 114.67 1toc s ALA 183 Ca 0.15 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.78 1toc s ALA 183 Cb -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.93 1toc s ALA 183 CO 0.03 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 175.96 1toc n GLY 184 N 1.82 3.11 3.83 0.00 0.00 -0.61 -1.87 105.19 111.47 1toc n GLY 184 Ca -0.18 -0.95 -0.32 0.00 0.00 0.00 0.00 46.02 44.57 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 3.23 0.45 1.61 2.02 -1.26 -4.70 117.35 116.71 1toc s TYR 184 Ca 0.00 1.43 0.01 0.00 -0.37 0.00 0.00 57.07 58.14 1toc s TYR 184 Cb 0.00 -2.87 0.00 0.00 -0.40 0.00 0.00 41.96 38.69 1toc s TYR 184 CO 0.00 -0.94 0.67 0.15 -1.57 0.00 0.00 175.55 173.86 1toc s LYS 185 N -4.61 2.99 0.61 -0.62 1.02 -1.26 -4.84 119.74 113.03 1toc s LYS 185 Ca 0.59 -0.59 -0.18 0.00 0.02 0.00 0.00 55.97 55.80 1toc s LYS 185 Cb -0.13 -2.58 -0.03 0.00 -0.52 0.00 0.00 37.83 34.58 1toc s LYS 185 CO 0.45 -0.31 1.22 -2.14 -0.92 0.00 0.00 175.35 173.66 1toc s PRO 186 N -4.55 2.84 0.00 -1.68 0.02 -1.26 -2.14 135.00 128.23 1toc s PRO 186 Ca 0.50 1.86 0.00 0.00 0.02 0.00 0.00 61.00 63.38 1toc s PRO 186 Cb -0.10 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.51 1toc s PRO 186 CO 0.37 -1.32 0.00 0.41 -0.33 0.00 0.00 177.00 176.13 1toc n GLY 186 N 0.56 1.68 0.00 0.52 0.00 -1.26 -4.78 105.19 101.92 1toc n GLY 186 Ca 0.14 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.20 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 -1.92 0.03 0.00 1.61 2.13 -0.91 -4.87 120.64 116.71 1toc n GLU 186 Ca 0.00 0.34 0.00 0.00 0.66 0.00 0.00 57.16 58.16 1toc n GLU 186 Cb 0.00 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.21 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 -0.73 2.09 3.74 8.31 0.00 -1.26 -4.98 105.19 112.36 1toc n GLY 186 Ca 0.02 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.34 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 4.33 0.00 1.61 1.02 -1.26 -5.08 119.74 120.36 1toc s LYS 186 Ca 0.00 0.64 0.00 0.00 0.02 0.00 0.00 55.97 56.63 1toc s LYS 186 Cb 0.00 -3.39 0.00 0.00 -0.52 0.00 0.00 37.83 33.92 1toc s LYS 186 CO 0.00 0.24 0.00 0.54 -0.92 0.00 0.00 175.35 175.21 1toc n ARG 187 N 3.26 2.52 0.00 1.68 1.74 -1.26 -4.62 116.66 119.98 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 3.73 3.61 -0.13 0.00 -1.25 -4.87 105.19 111.29 1toc n GLY 188 Ca 0.00 -1.35 -0.06 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.19 1.35 1.61 2.15 -0.92 -4.59 116.67 116.08 1toc s ASP 189 Ca 0.00 0.18 -0.22 0.00 0.43 0.00 0.00 52.55 52.94 1toc s ASP 189 Cb 0.00 0.16 0.34 0.00 -0.30 0.00 0.00 42.92 43.12 1toc s ASP 189 CO 0.00 -0.20 0.97 0.00 -0.17 0.00 0.00 175.17 175.78 1toc n ALA 190 N 0.52 -4.21 -3.80 3.66 0.00 -1.26 -0.11 120.51 115.31 1toc n ALA 190 Ca -0.04 -1.56 -0.01 0.00 0.00 0.00 0.00 53.44 51.82 1toc n ALA 190 Cb 0.58 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.92 1toc n ALA 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1toc n GLU 192 N -0.62 0.09 0.00 0.00 4.07 -1.26 -0.98 120.64 121.94 1toc n GLU 192 Ca -0.04 0.03 0.00 0.00 -0.06 0.00 0.00 57.16 57.09 1toc n GLU 192 Cb 0.60 -1.57 0.00 0.00 -0.06 0.00 0.00 31.44 30.42 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 6.41 1.65 0.63 8.31 0.00 -1.26 -2.45 105.19 118.48 1toc n GLY 193 Ca 0.47 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.59 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 2.28 -4.55 1.61 8.00 -0.15 -4.03 116.55 119.71 1toc n ASP 194 Ca 0.00 -1.64 -0.50 0.00 0.71 0.00 0.00 54.79 53.36 1toc n ASP 194 Cb 0.00 0.23 -0.06 0.00 -0.02 0.00 0.00 41.12 41.27 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 0.56 2.56 0.00 -2.24 7.64 -1.26 0.62 113.62 121.49 1toc n SER 195 Ca 0.10 0.60 0.00 0.00 1.01 0.00 0.00 58.87 60.58 1toc n SER 195 Cb 0.46 -1.30 0.00 0.00 -1.01 0.00 0.00 64.21 62.36 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 5.71 2.38 3.57 0.23 0.00 -0.71 -2.27 105.19 114.11 1toc n GLY 196 Ca 0.34 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.39 -0.39 3.71 -0.02 0.00 0.20 -3.68 105.19 104.62 1toc n GLY 197 Ca 0.00 0.32 -0.41 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.52 4.48 -0.60 1.61 0.04 -1.26 -1.64 135.00 136.11 1toc s PRO 198 Ca 0.59 1.14 -0.18 0.00 0.04 0.00 0.00 61.00 62.59 1toc s PRO 198 Cb -0.72 -3.46 0.12 0.00 0.04 0.00 0.00 34.50 30.48 1toc s PRO 198 CO 0.60 -0.02 0.65 0.12 0.04 0.00 0.00 177.00 178.38 1toc s PHE 199 N 1.01 3.13 0.29 0.56 2.19 0.13 -4.10 117.98 121.20 1toc s PHE 199 Ca 0.44 -1.15 0.06 0.00 0.33 0.00 0.00 56.93 56.61 1toc s PHE 199 Cb -0.19 -3.94 -0.02 0.00 -1.31 0.00 0.00 43.02 37.56 1toc s PHE 199 CO 0.22 -1.19 0.41 0.14 1.83 0.00 0.00 175.22 176.64 1toc s VAL 200 N 2.15 4.63 -0.13 3.12 -7.23 -0.34 -1.41 120.40 121.19 1toc s VAL 200 Ca 0.09 -1.00 -0.06 0.00 -1.81 0.00 0.00 61.98 59.20 1toc s VAL 200 Cb -0.25 -3.62 0.06 0.00 0.56 0.00 0.00 36.38 33.13 1toc s VAL 200 CO 0.04 -0.24 0.29 -0.04 -0.31 0.00 0.00 175.10 174.84 1toc s MET 201 N -4.08 0.21 0.01 4.82 -1.94 0.12 0.00 119.30 118.45 1toc s MET 201 Ca 0.40 0.71 -0.30 0.00 -1.71 0.00 0.00 55.69 54.79 1toc s MET 201 Cb -0.09 -0.02 -0.04 0.00 2.01 0.00 0.00 34.83 36.69 1toc s MET 201 CO 0.30 -0.23 1.10 0.21 -0.01 0.00 0.00 175.02 176.39 1toc s LYS 202 N 1.95 4.47 0.24 2.03 2.20 -1.26 -0.30 119.74 129.06 1toc s LYS 202 Ca -0.04 1.59 -0.30 0.00 -0.36 0.00 0.00 55.97 56.86 1toc s LYS 202 Cb -0.11 -3.44 -0.09 0.00 -1.51 0.00 0.00 37.83 32.68 1toc s LYS 202 CO -0.09 -0.21 1.05 0.45 -0.36 0.00 0.00 175.35 176.19 1toc s SER 203 N 1.11 7.38 0.00 1.43 0.15 0.45 -4.93 113.70 119.28 1toc s SER 203 Ca 0.55 2.13 0.25 0.00 0.70 0.00 0.00 55.95 59.58 1toc s SER 203 Cb -0.24 -2.62 1.02 0.00 -1.71 0.00 0.00 66.02 62.47 1toc s SER 203 CO 0.27 -0.08 1.71 -0.81 1.20 0.00 0.00 173.24 175.53 1toc n PRO 204 N 1.60 1.60 0.00 5.44 -0.04 -1.26 -3.24 135.00 139.10 1toc n PRO 204 Ca -0.00 -0.88 0.00 0.00 -0.04 0.00 0.00 63.50 62.58 1toc n PRO 204 Cb 0.46 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 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 0.08 0.00 1.23 0.54 4.01 -1.26 -4.72 117.16 117.04 1toc n TYR 204 Ca 0.18 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 58.00 1toc n TYR 204 Cb 0.31 0.00 0.27 0.00 -0.31 0.00 0.00 39.34 39.61 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 -2.48 1.44 -1.03 7.72 0.23 -1.26 -4.93 115.26 114.95 1toc n ASN 204 Ca 0.00 -1.82 -0.13 0.00 -0.53 0.00 0.00 54.58 52.10 1toc n ASN 204 Cb 0.00 -0.14 -0.06 0.00 -2.08 0.00 0.00 39.78 37.51 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 0.22 -5.34 -4.85 0.53 2.85 -1.20 -4.97 115.26 102.50 1toc n ASN 205 Ca 0.13 0.32 -0.37 0.00 -0.11 0.00 0.00 54.58 54.55 1toc n ASN 205 Cb 0.26 -4.16 -0.06 0.00 1.24 0.00 0.00 39.78 37.06 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 -3.05 3.87 -0.40 1.20 0.52 -1.26 -4.72 118.95 115.11 1toc s ARG 206 Ca 0.00 0.34 -0.27 0.00 -0.52 0.00 0.00 55.73 55.28 1toc s ARG 206 Cb 0.00 -3.12 0.02 0.00 0.52 0.00 0.00 34.95 32.37 1toc s ARG 206 CO 0.00 0.63 1.01 -1.58 0.02 0.00 0.00 175.30 175.38 1toc s TRP 207 N -1.23 3.00 0.17 -0.53 0.52 -1.26 -0.41 118.94 119.19 1toc s TRP 207 Ca 0.28 0.78 0.02 0.00 0.02 0.00 0.00 56.10 57.20 1toc s TRP 207 Cb -0.16 -3.91 -0.04 0.00 -1.15 0.00 0.00 33.47 28.21 1toc s TRP 207 CO 0.16 -0.97 0.31 0.71 0.02 0.00 0.00 176.95 177.18 1toc s TYR 208 N 3.81 3.48 -0.31 -1.98 1.51 0.58 -3.11 117.35 121.34 1toc s TYR 208 Ca 0.42 0.17 -0.05 0.00 -1.01 0.00 0.00 57.07 56.60 1toc s TYR 208 Cb -0.10 -1.71 0.04 0.00 -0.11 0.00 0.00 41.96 40.07 1toc s TYR 208 CO 0.23 0.48 0.06 -1.14 -1.11 0.00 0.00 175.55 174.06 1toc s GLN 209 N -3.29 2.67 -0.11 -0.62 0.74 -0.94 0.14 119.66 118.26 1toc s GLN 209 Ca 0.36 -1.13 0.03 0.00 0.05 0.00 0.00 55.36 54.67 1toc s GLN 209 Cb -0.11 -3.34 -0.24 0.00 1.10 0.00 0.00 33.01 30.42 1toc s GLN 209 CO 0.29 -0.59 0.39 -1.33 -0.55 0.00 0.00 175.29 173.49 1toc n MET 210 N 4.76 0.70 -3.99 1.67 2.81 -0.50 -4.23 117.12 118.34 1toc n MET 210 Ca -0.13 0.24 -0.09 0.00 -1.81 0.00 0.00 57.70 55.91 1toc n MET 210 Cb 0.45 -1.70 -0.10 0.00 -0.71 0.00 0.00 33.22 31.15 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 -5.51 0.28 -0.15 3.03 0.00 -0.96 -0.63 107.32 103.39 1toc s GLY 211 Ca -0.16 -0.74 -0.06 0.00 0.00 0.00 0.00 44.72 43.75 1toc s GLY 211 CO 0.78 -0.85 0.07 -0.42 0.00 0.00 0.00 173.10 172.67 1toc s ILE 212 N -2.53 4.84 -0.23 0.90 1.01 -0.46 0.19 121.20 124.93 1toc s ILE 212 Ca -0.06 -0.03 -0.29 0.00 0.00 0.00 0.00 60.65 60.27 1toc s ILE 212 Cb -0.02 -3.14 -0.06 0.00 0.01 0.00 0.00 42.46 39.25 1toc s ILE 212 CO -0.05 0.52 2.21 0.52 0.00 0.00 0.00 174.94 178.15 1toc n VAL 213 N 2.91 0.34 0.00 2.92 0.31 -0.65 -0.31 118.33 123.85 1toc n VAL 213 Ca -0.18 -0.42 0.00 0.00 -0.01 0.00 0.00 64.34 63.73 1toc n VAL 213 Cb 0.53 -2.43 0.00 0.00 -0.91 0.00 0.00 33.84 31.03 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 11.30 0.00 -4.26 4.52 2.88 -0.51 -1.73 113.62 125.82 1toc n SER 214 Ca 0.31 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.64 1toc n SER 214 Cb 0.42 -0.02 -0.10 0.00 -0.75 0.00 0.00 64.21 63.76 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 -0.06 1.75 -0.22 0.66 1.48 -0.88 -4.91 118.94 116.77 1toc s TRP 215 Ca 0.00 -1.16 -0.32 0.00 -1.06 0.00 0.00 56.10 53.56 1toc s TRP 215 Cb 0.00 -1.09 0.16 0.00 -1.16 0.00 0.00 33.47 31.38 1toc s TRP 215 CO 0.00 -0.24 1.22 0.20 -4.06 0.00 0.00 176.95 174.07 1toc s GLY 216 N -3.45 -0.15 -0.75 3.67 0.00 -1.26 -1.30 107.32 104.07 1toc s GLY 216 Ca 0.34 2.12 -0.16 0.00 0.00 0.00 0.00 44.72 47.02 1toc s GLY 216 CO 0.15 0.83 0.79 -0.54 0.00 0.00 0.00 173.10 174.34 1toc s GLU 217 N -1.66 3.39 0.19 2.90 2.02 -1.26 -4.95 118.70 119.31 1toc s GLU 217 Ca 0.07 -1.94 0.00 0.00 0.02 0.00 0.00 54.97 53.12 1toc s GLU 217 Cb -0.01 -4.47 0.00 0.00 0.10 0.00 0.00 34.13 29.75 1toc s GLU 217 CO -0.05 -1.46 0.00 0.41 0.02 0.00 0.00 175.26 174.19 1toc n GLY 219 N 4.77 -1.63 3.29 -1.39 0.00 -1.26 -4.74 105.19 104.23 1toc n GLY 219 Ca 0.07 -1.33 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 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 3.42 0.00 -4.65 0.00 2.03 -1.26 -4.66 116.55 111.43 1toc n ASP 221 Ca -0.18 0.00 -0.57 0.00 0.52 0.00 0.00 54.79 54.55 1toc n ASP 221 Cb 0.53 -1.35 -0.07 0.00 -0.72 0.00 0.00 41.12 39.50 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 -2.00 0.83 -1.81 -0.67 1.74 -1.26 -4.88 116.66 108.60 1toc n ARG 221 Ca 0.00 0.30 -0.42 0.00 -0.77 0.00 0.00 57.85 56.96 1toc n ARG 221 Cb 0.00 -1.92 -0.03 0.00 -1.02 0.00 0.00 32.46 29.49 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 1.92 6.45 0.00 0.55 1.11 -1.26 -1.83 116.67 123.62 1toc s ASP 222 Ca 0.93 2.80 0.00 0.00 0.18 0.00 0.00 52.55 56.46 1toc s ASP 222 Cb -1.12 -2.60 0.00 0.00 1.07 0.00 0.00 42.92 40.27 1toc s ASP 222 CO 0.60 -0.90 0.00 0.61 1.18 0.00 0.00 175.17 176.66 1toc n GLY 223 N 3.52 0.98 3.45 0.21 0.00 -1.26 -5.04 105.19 107.04 1toc n GLY 223 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.50 1.62 0.10 1.61 -0.14 -0.76 -4.89 119.74 116.78 1toc s LYS 224 Ca 0.00 -1.54 0.02 0.00 -1.36 0.00 0.00 55.97 53.09 1toc s LYS 224 Cb 0.00 -1.87 -0.04 0.00 -1.68 0.00 0.00 37.83 34.24 1toc s LYS 224 CO 0.00 0.39 -0.07 0.71 -0.76 0.00 0.00 175.35 175.62 1toc s TYR 225 N -1.84 0.93 0.05 3.18 1.51 -1.26 -4.80 117.35 115.11 1toc s TYR 225 Ca 0.23 -0.88 -0.21 0.00 -1.01 0.00 0.00 57.07 55.20 1toc s TYR 225 Cb -0.07 -0.53 -0.06 0.00 -0.11 0.00 0.00 41.96 41.19 1toc s TYR 225 CO 0.11 -0.12 0.61 0.20 -1.11 0.00 0.00 175.55 175.24 1toc s GLY 226 N -3.00 2.67 -0.24 0.71 0.00 -0.78 -4.59 107.32 102.09 1toc s GLY 226 Ca 0.12 0.07 -0.09 0.00 0.00 0.00 0.00 44.72 44.82 1toc s GLY 226 CO -0.04 0.65 0.12 -1.36 0.00 0.00 0.00 173.10 172.48 1toc s PHE 227 N -0.66 3.22 -0.14 1.90 0.40 -0.42 -1.18 117.98 121.10 1toc s PHE 227 Ca 0.31 0.02 -0.02 0.00 -0.60 0.00 0.00 56.93 56.63 1toc s PHE 227 Cb -0.19 -2.24 -0.02 0.00 0.51 0.00 0.00 43.02 41.07 1toc s PHE 227 CO 0.19 -0.06 -0.08 0.71 0.70 0.00 0.00 175.22 176.68 1toc s TYR 228 N 1.19 2.93 0.24 0.36 2.02 0.24 -1.43 117.35 122.90 1toc s TYR 228 Ca 0.06 -0.45 -0.31 0.00 -0.37 0.00 0.00 57.07 56.00 1toc s TYR 228 Cb -0.14 -1.90 -0.13 0.00 -0.40 0.00 0.00 41.96 39.39 1toc s TYR 228 CO 0.05 -0.11 1.57 2.41 -1.57 0.00 0.00 175.55 177.90 1toc n THR 229 N 3.51 0.62 -2.57 -0.71 -1.04 0.58 -1.92 114.28 112.75 1toc n THR 229 Ca -0.18 -0.15 -0.41 0.00 -2.04 0.00 0.00 64.05 61.27 1toc n THR 229 Cb 0.53 -1.78 -0.03 0.00 -1.82 0.00 0.00 70.33 67.23 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 0.38 2.36 0.15 -1.42 2.46 -1.03 -1.35 115.29 116.84 1toc s HIS 230 Ca 0.70 -0.26 -0.21 0.00 0.47 0.00 0.00 55.06 55.75 1toc s HIS 230 Cb -0.57 -4.62 0.02 0.00 -0.13 0.00 0.00 32.58 27.29 1toc s HIS 230 CO 0.44 -2.02 1.65 0.28 -2.47 0.00 0.00 174.74 172.62 1toc h VAL 231 N 6.19 0.51 -0.59 0.89 2.07 -1.19 -2.97 116.25 121.15 1toc h VAL 231 Ca -0.17 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.47 1toc h VAL 231 Cb 1.04 0.51 -0.10 0.00 -1.52 0.00 0.00 31.29 31.22 1toc h VAL 231 CO 1.30 0.00 -0.04 0.15 0.02 0.00 0.00 177.57 179.00 1toc h PHE 232 N -0.18 -0.12 -0.62 1.57 3.57 -1.88 0.30 116.94 119.58 1toc h PHE 232 Ca 0.13 0.05 0.07 0.00 3.53 0.00 0.00 57.97 61.75 1toc h PHE 232 Cb 0.38 0.14 -0.06 0.00 2.79 0.00 0.00 35.95 39.20 1toc h PHE 232 CO -0.34 -0.19 0.31 0.00 -2.23 0.00 0.00 178.31 175.86 1toc h ARG 233 N 0.08 0.55 -0.00 1.11 2.47 -1.88 -1.82 114.38 114.88 1toc h ARG 233 Ca 0.30 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.99 1toc h ARG 233 Cb 0.48 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.68 1toc h ARG 233 CO -0.54 0.36 -0.01 1.28 0.56 0.00 0.00 179.97 181.62 1toc n LEU 234 N -4.87 0.14 -0.20 3.04 4.77 0.12 -4.17 117.00 115.83 1toc n LEU 234 Ca 0.08 0.04 0.01 0.00 -0.03 0.00 0.00 56.01 56.11 1toc n LEU 234 Cb 0.20 -0.09 0.11 0.00 -2.33 0.00 0.00 43.42 41.31 1toc n LEU 234 CO 0.27 0.02 0.87 0.50 -1.33 0.00 0.00 177.39 177.72 1toc h LYS 235 N 0.20 0.17 -0.71 3.23 3.64 0.38 -0.07 116.57 123.41 1toc h LYS 235 Ca 0.00 -0.01 0.16 0.00 -1.27 0.00 0.00 60.65 59.53 1toc h LYS 235 Cb 0.14 -0.04 -0.11 0.00 -0.41 0.00 0.00 32.23 31.81 1toc h LYS 235 CO 0.00 0.11 0.13 -0.22 -2.27 0.00 0.00 179.45 177.20 1toc h LYS 236 N 0.18 0.22 0.89 1.90 3.64 -1.78 -1.29 116.57 120.34 1toc h LYS 236 Ca 0.32 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.64 1toc h LYS 236 Cb 0.50 -0.05 0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1toc h LYS 236 CO -0.47 0.14 -0.43 2.35 -2.27 0.00 0.00 179.45 178.78 1toc h TRP 237 N 0.22 -1.11 -0.97 1.91 7.01 -1.33 -0.66 115.95 121.02 1toc h TRP 237 Ca 0.40 -0.03 0.25 0.00 2.11 0.00 0.00 58.89 61.62 1toc h TRP 237 Cb 0.68 0.37 -0.18 0.00 -2.10 0.00 0.00 29.16 27.92 1toc h TRP 237 CO -0.30 -0.69 -0.06 -0.89 -2.79 0.00 0.00 178.44 173.72 1toc n ILE 238 N -5.60 -0.41 0.48 2.65 5.41 -0.68 0.29 119.36 121.49 1toc n ILE 238 Ca -0.16 2.16 -0.19 0.00 1.00 0.00 0.00 62.75 65.57 1toc n ILE 238 Cb 0.48 -3.11 -0.09 0.00 -0.71 0.00 0.00 39.64 36.21 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 -1.17 -1.12 0.38 1.08 -0.87 -2.07 115.11 111.33 1toc h GLN 239 Ca 0.55 0.08 0.38 0.00 -1.45 0.00 0.00 58.65 58.21 1toc h GLN 239 Cb 1.07 0.27 -0.14 0.00 -0.05 0.00 0.00 27.48 28.62 1toc h GLN 239 CO -0.94 -0.78 0.68 -0.22 -0.95 0.00 0.00 178.83 176.62 1toc h LYS 240 N -1.32 0.18 0.62 1.46 3.64 0.14 0.50 116.57 121.79 1toc h LYS 240 Ca -0.12 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.21 1toc h LYS 240 Cb 0.93 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.72 1toc h LYS 240 CO 0.20 0.12 -0.30 0.28 -2.27 0.00 0.00 179.45 177.49 1toc h VAL 241 N 0.19 0.07 -0.35 2.00 2.07 -0.49 -3.23 116.25 116.51 1toc h VAL 241 Ca 0.77 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.91 1toc h VAL 241 Cb 2.09 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.94 1toc h VAL 241 CO -0.54 0.01 0.22 0.40 0.02 0.00 0.00 177.57 177.69 1toc h ILE 242 N -1.19 1.10 0.00 4.57 2.04 -0.28 -3.04 117.51 120.72 1toc h ILE 242 Ca -0.09 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1toc h ILE 242 Cb 0.66 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 1toc h ILE 242 CO 0.14 0.10 0.00 0.44 0.00 0.00 0.00 178.15 178.83 1toc h ASP 243 N 0.47 0.00 1.61 1.72 5.19 -1.18 -2.17 116.42 122.05 1toc h ASP 243 Ca 0.13 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.54 1toc h ASP 243 Cb -0.03 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.48 1toc h ASP 243 CO -0.03 0.00 -0.30 0.03 -3.12 0.00 0.00 179.24 175.82 1toc h ARG 244 N 0.00 0.00 -0.00 3.56 3.08 -1.54 -3.31 114.38 116.16 1toc h ARG 244 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1toc h ARG 244 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1toc h ARG 244 CO 0.00 0.00 -0.25 -0.07 -1.07 0.00 0.00 179.97 178.58 1toc h LEU 245 N 0.00 0.01 0.00 3.04 -0.00 -1.52 -3.49 115.31 113.35 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 0.95 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.61 1toc h LEU 245 CO 0.00 0.26 0.00 0.61 -0.00 0.00 0.00 178.44 179.31 1toc n GLY 246 N -0.81 -0.41 0.00 0.83 0.00 -1.25 -5.20 105.19 98.35 1toc n GLY 246 Ca -0.02 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1toc n GLY 246 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06