#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ca6 s ARG 3 N 0.00 1.71 -0.13 0.00 3.52 -1.26 -0.25 118.95 122.53 2ca6 s ARG 3 Ca 0.00 -1.46 -0.06 0.00 -0.13 0.00 0.00 55.73 54.08 2ca6 s ARG 3 Cb 0.00 -1.94 0.06 0.00 -1.56 0.00 0.00 34.95 31.50 2ca6 s ARG 3 CO 0.00 0.41 0.31 0.12 -0.81 0.00 0.00 175.30 175.32 2ca6 s PHE 4 N -1.73 -0.46 0.08 5.12 5.36 -0.72 -4.96 117.98 120.67 2ca6 s PHE 4 Ca 0.23 1.01 -0.07 0.00 -0.96 0.00 0.00 56.93 57.14 2ca6 s PHE 4 Cb -0.08 0.11 -0.01 0.00 -0.34 0.00 0.00 43.02 42.70 2ca6 s PHE 4 CO 0.12 -0.30 0.15 0.45 -1.46 0.00 0.00 175.22 174.18 2ca6 s SER 5 N 1.61 0.18 0.00 6.13 0.15 -1.26 -0.97 113.70 119.53 2ca6 s SER 5 Ca -0.07 -0.69 0.00 0.00 0.70 0.00 0.00 55.95 55.89 2ca6 s SER 5 Cb -0.10 0.31 0.00 0.00 -1.71 0.00 0.00 66.02 64.52 2ca6 s SER 5 CO -0.10 -0.69 0.41 2.30 1.20 0.00 0.00 173.24 176.35 2ca6 n ILE 6 N 0.02 0.00 -1.71 6.45 -5.35 -1.08 -4.99 119.36 112.69 2ca6 n ILE 6 Ca -0.15 0.00 -0.42 0.00 -0.27 0.00 0.00 62.75 61.91 2ca6 n ILE 6 Cb 0.62 0.24 0.00 0.00 -1.74 0.00 0.00 39.64 38.76 2ca6 n ILE 6 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 2ca6 n GLU 7 N 0.00 2.17 -0.88 6.28 2.13 -1.25 -2.38 120.64 126.71 2ca6 n GLU 7 Ca 0.00 0.76 0.00 0.00 0.66 0.00 0.00 57.16 58.58 2ca6 n GLU 7 Cb 0.53 -2.41 0.00 0.00 0.27 0.00 0.00 31.44 29.83 2ca6 n GLU 7 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ca6 n GLY 8 N 0.72 0.43 0.38 8.31 0.00 -1.11 -4.83 105.19 109.08 2ca6 n GLY 8 Ca 0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.19 2ca6 n GLY 8 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ca6 n LYS 9 N -1.64 1.50 -3.72 1.61 5.02 -1.00 -4.93 118.16 115.00 2ca6 n LYS 9 Ca 0.00 -0.75 -0.22 0.00 -2.02 0.00 0.00 58.31 55.32 2ca6 n LYS 9 Cb 0.10 -1.42 -0.05 0.00 -0.02 0.00 0.00 35.03 33.65 2ca6 n LYS 9 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2ca6 n SER 10 N -0.06 -0.07 -4.59 4.39 3.41 -0.20 -4.83 113.62 111.67 2ca6 n SER 10 Ca 0.18 -0.82 -0.43 0.00 -0.26 0.00 0.00 58.87 57.54 2ca6 n SER 10 Cb 0.27 -1.01 -0.04 0.00 -0.26 0.00 0.00 64.21 63.17 2ca6 n SER 10 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2ca6 s LEU 11 N -5.96 4.00 -0.43 1.04 1.43 -1.26 -4.89 118.68 112.62 2ca6 s LEU 11 Ca 0.07 0.44 -0.29 0.00 -1.03 0.00 0.00 54.13 53.32 2ca6 s LEU 11 Cb -0.04 -3.23 0.01 0.00 0.03 0.00 0.00 46.19 42.96 2ca6 s LEU 11 CO 0.63 -0.91 1.42 -0.75 0.23 0.00 0.00 176.35 176.97 2ca6 s LYS 12 N 3.54 3.54 -0.15 1.70 2.20 -1.26 -2.34 119.74 126.96 2ca6 s LYS 12 Ca 0.38 0.90 0.01 0.00 -0.36 0.00 0.00 55.97 56.89 2ca6 s LYS 12 Cb -0.11 -4.04 0.02 0.00 -1.51 0.00 0.00 37.83 32.19 2ca6 s LYS 12 CO 0.21 -1.61 -0.17 -0.51 -0.36 0.00 0.00 175.35 172.91 2ca6 s LEU 13 N 5.54 1.85 -0.02 5.43 1.43 -0.31 -4.91 118.68 127.69 2ca6 s LEU 13 Ca 0.61 -0.54 0.17 0.00 -1.03 0.00 0.00 54.13 53.34 2ca6 s LEU 13 Cb -0.13 -1.28 -0.25 0.00 0.03 0.00 0.00 46.19 44.56 2ca6 s LEU 13 CO 0.32 -0.02 0.46 0.47 0.23 0.00 0.00 176.35 177.81 2ca6 n ASP 14 N 4.62 0.99 -3.64 2.29 10.43 -1.26 0.11 116.55 130.09 2ca6 n ASP 14 Ca -0.19 -0.21 -0.02 0.00 2.57 0.00 0.00 54.79 56.94 2ca6 n ASP 14 Cb 0.50 1.60 -0.04 0.00 1.84 0.00 0.00 41.12 45.02 2ca6 n ASP 14 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2ca6 s ALA 15 N -3.05 -2.11 -0.58 2.24 0.00 -1.26 -2.75 121.76 114.25 2ca6 s ALA 15 Ca -0.03 1.88 -0.25 0.00 0.00 0.00 0.00 51.96 53.55 2ca6 s ALA 15 Cb 0.11 -1.46 0.04 0.00 0.00 0.00 0.00 23.12 21.82 2ca6 s ALA 15 CO 0.71 -0.25 1.01 0.42 0.00 0.00 0.00 175.76 177.65 2ca6 s ILE 16 N -1.03 4.28 0.00 0.00 1.01 -1.26 -4.78 121.20 119.41 2ca6 s ILE 16 Ca 0.08 0.34 0.00 0.00 0.00 0.00 0.00 60.65 61.07 2ca6 s ILE 16 Cb -0.01 -4.60 0.00 0.00 0.01 0.00 0.00 42.46 37.86 2ca6 s ILE 16 CO -0.07 -1.22 0.00 0.35 0.00 0.00 0.00 174.94 173.99 2ca6 n THR 17 N 6.26 0.00 0.00 2.92 -2.24 -1.26 -4.82 114.28 115.14 2ca6 n THR 17 Ca 0.02 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.77 2ca6 n THR 17 Cb 0.48 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.69 2ca6 n THR 17 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2ca6 n THR 18 N 0.00 0.86 0.08 4.28 -2.24 -1.26 -4.62 114.28 111.38 2ca6 n THR 18 Ca 0.00 0.17 -0.07 0.00 -2.27 0.00 0.00 64.05 61.88 2ca6 n THR 18 Cb 0.00 -1.66 -0.06 0.00 -2.10 0.00 0.00 70.33 66.51 2ca6 n THR 18 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2ca6 h GLU 19 N -0.19 0.06 0.00 -0.78 4.11 -1.94 -3.20 114.58 112.64 2ca6 h GLU 19 Ca -0.06 -0.09 -0.01 0.00 0.07 0.00 0.00 59.36 59.28 2ca6 h GLU 19 Cb 0.59 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2ca6 h GLU 19 CO -0.03 0.96 -0.03 0.38 0.07 0.00 0.00 179.01 180.36 2ca6 h ASP 20 N 0.03 0.00 0.80 3.06 3.04 -1.95 -2.01 116.42 119.39 2ca6 h ASP 20 Ca -0.03 0.00 -0.09 0.00 -3.24 0.00 0.00 57.03 53.67 2ca6 h ASP 20 Cb 1.65 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.92 2ca6 h ASP 20 CO 0.13 0.03 -0.43 1.05 -2.04 0.00 0.00 179.24 177.98 2ca6 h GLU 21 N 0.00 0.00 -0.93 4.15 4.11 -1.81 -0.27 114.58 119.83 2ca6 h GLU 21 Ca -0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.88 2ca6 h GLU 21 Cb 0.54 0.00 -0.43 0.00 0.50 0.00 0.00 28.75 29.36 2ca6 h GLU 21 CO 0.00 0.43 -0.81 1.63 0.07 0.00 0.00 179.01 180.33 2ca6 n LYS 22 N -3.59 3.47 0.00 1.06 4.76 -0.81 -2.54 118.16 120.50 2ca6 n LYS 22 Ca -0.00 -4.22 0.00 0.00 -2.87 0.00 0.00 58.31 51.22 2ca6 n LYS 22 Cb 0.54 -2.23 0.00 0.00 -1.84 0.00 0.00 35.03 31.49 2ca6 n LYS 22 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2ca6 n SER 23 N -0.64 0.00 0.00 4.39 3.41 -0.87 -4.82 113.62 115.09 2ca6 n SER 23 Ca 0.41 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 2ca6 n SER 23 Cb 0.89 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.84 2ca6 n SER 23 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2ca6 n VAL 24 N -0.25 0.00 -1.23 -3.33 0.31 -0.15 -4.77 118.33 108.90 2ca6 n VAL 24 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 2ca6 n VAL 24 Cb 0.00 -1.18 0.22 0.00 -0.91 0.00 0.00 33.84 31.97 2ca6 n VAL 24 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2ca6 n PHE 25 N -2.83 2.28 1.27 3.52 3.01 -0.97 -4.46 117.46 119.28 2ca6 n PHE 25 Ca 0.00 -1.58 0.10 0.00 1.01 0.00 0.00 57.45 56.99 2ca6 n PHE 25 Cb 0.47 -0.73 0.61 0.00 -0.01 0.00 0.00 39.48 39.82 2ca6 n PHE 25 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ca6 n ALA 26 N -0.88 2.25 0.01 4.37 0.00 -1.05 -2.48 120.51 122.74 2ca6 n ALA 26 Ca 0.46 -0.13 -0.21 0.00 0.00 0.00 0.00 53.44 53.56 2ca6 n ALA 26 Cb 1.40 -1.34 -0.14 0.00 0.00 0.00 0.00 19.45 19.37 2ca6 n ALA 26 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2ca6 h VAL 27 N 0.00 0.66 0.00 0.00 2.07 -1.87 -2.89 116.25 114.22 2ca6 h VAL 27 Ca 0.00 -2.37 0.00 0.00 0.82 0.00 0.00 66.70 65.15 2ca6 h VAL 27 Cb 0.02 2.54 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 2ca6 h VAL 27 CO 0.00 0.90 0.00 0.18 0.02 0.00 0.00 177.57 178.67 2ca6 n LEU 28 N -3.49 0.00 -0.38 2.57 4.77 -1.03 -1.07 117.00 118.36 2ca6 n LEU 28 Ca -0.31 0.31 0.03 0.00 -0.03 0.00 0.00 56.01 56.02 2ca6 n LEU 28 Cb 1.05 -0.31 0.08 0.00 -2.33 0.00 0.00 43.42 41.91 2ca6 n LEU 28 CO 0.44 -0.14 0.54 0.18 -1.33 0.00 0.00 177.39 177.08 2ca6 n LEU 29 N -1.31 2.40 -0.00 2.23 4.77 -1.20 -4.77 117.00 119.11 2ca6 n LEU 29 Ca 0.07 -1.82 -0.04 0.00 -0.03 0.00 0.00 56.01 54.20 2ca6 n LEU 29 Cb 0.14 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.10 2ca6 n LEU 29 CO 0.13 0.59 -0.46 1.21 -1.33 0.00 0.00 177.39 177.52 2ca6 n GLU 30 N 0.18 0.09 -3.81 3.23 4.07 -0.23 -5.04 120.64 119.14 2ca6 n GLU 30 Ca 0.07 0.04 -0.24 0.00 -0.06 0.00 0.00 57.16 56.96 2ca6 n GLU 30 Cb 0.33 -0.66 -0.17 0.00 -0.06 0.00 0.00 31.44 30.87 2ca6 n GLU 30 CO 0.00 0.00 0.00 0.16 -0.06 0.00 0.00 177.13 177.23 2ca6 s ASP 31 N -5.62 1.83 -0.13 4.31 -4.77 -1.03 -4.98 116.67 106.29 2ca6 s ASP 31 Ca -0.06 -0.19 0.04 0.00 -3.30 0.00 0.00 52.55 49.04 2ca6 s ASP 31 Cb 0.02 -0.56 0.31 0.00 -1.09 0.00 0.00 42.92 41.60 2ca6 s ASP 31 CO 0.08 -0.18 1.15 -0.90 0.70 0.00 0.00 175.17 176.02 2ca6 n ASP 32 N 5.09 3.07 -0.23 2.11 5.68 -1.26 -3.20 116.55 127.81 2ca6 n ASP 32 Ca -0.09 -2.48 0.12 0.00 -0.50 0.00 0.00 54.79 51.84 2ca6 n ASP 32 Cb 0.50 -0.60 0.24 0.00 -1.14 0.00 0.00 41.12 40.12 2ca6 n ASP 32 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2ca6 n SER 33 N 0.09 1.12 -4.48 -1.12 3.41 -1.26 -3.95 113.62 107.42 2ca6 n SER 33 Ca 0.16 -0.90 -0.43 0.00 -0.26 0.00 0.00 58.87 57.45 2ca6 n SER 33 Cb 0.77 0.29 -0.00 0.00 -0.26 0.00 0.00 64.21 65.01 2ca6 n SER 33 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2ca6 n VAL 34 N -0.76 1.87 0.00 -3.33 0.31 -1.20 -2.34 118.33 112.89 2ca6 n VAL 34 Ca 0.10 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 2ca6 n VAL 34 Cb 0.37 -0.60 0.00 0.00 -0.91 0.00 0.00 33.84 32.70 2ca6 n VAL 34 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2ca6 n LYS 35 N 0.65 2.31 -4.60 5.55 5.02 0.65 -3.03 118.16 124.71 2ca6 n LYS 35 Ca 0.12 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.18 2ca6 n LYS 35 Cb 0.36 -0.90 -0.16 0.00 -0.02 0.00 0.00 35.03 34.31 2ca6 n LYS 35 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2ca6 s GLU 36 N -1.72 1.27 -0.07 1.97 2.12 -0.78 -0.10 118.70 121.39 2ca6 s GLU 36 Ca 0.00 -0.45 -0.01 0.00 0.36 0.00 0.00 54.97 54.87 2ca6 s GLU 36 Cb 0.00 -1.16 0.03 0.00 0.26 0.00 0.00 34.13 33.25 2ca6 s GLU 36 CO 0.00 0.20 -0.02 0.42 -0.54 0.00 0.00 175.26 175.32 2ca6 s ILE 37 N 0.02 0.48 -0.17 -3.70 1.01 -1.00 -1.75 121.20 116.08 2ca6 s ILE 37 Ca -0.01 0.02 0.01 0.00 0.00 0.00 0.00 60.65 60.66 2ca6 s ILE 37 Cb -0.09 -0.58 0.02 0.00 0.01 0.00 0.00 42.46 41.82 2ca6 s ILE 37 CO 0.01 0.26 -0.18 -0.69 0.00 0.00 0.00 174.94 174.33 2ca6 s VAL 38 N 1.63 1.93 -0.49 2.92 1.01 -0.14 -1.10 120.40 126.16 2ca6 s VAL 38 Ca 0.00 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.15 2ca6 s VAL 38 Cb -0.13 -1.77 0.07 0.00 0.00 0.00 0.00 36.38 34.55 2ca6 s VAL 38 CO -0.04 0.51 0.80 0.18 0.00 0.00 0.00 175.10 176.55 2ca6 n LEU 39 N 4.66 1.72 -4.51 3.92 4.77 -0.93 -2.65 117.00 123.97 2ca6 n LEU 39 Ca -0.20 -1.35 -0.32 0.00 -0.03 0.00 0.00 56.01 54.11 2ca6 n LEU 39 Cb 0.50 -0.03 0.14 0.00 -2.33 0.00 0.00 43.42 41.70 2ca6 n LEU 39 CO 0.25 0.40 0.20 -1.20 -1.33 0.00 0.00 177.39 175.71 2ca6 n SER 40 N 0.13 -1.18 -2.78 -1.43 7.64 -1.24 -3.54 113.62 111.21 2ca6 n SER 40 Ca 0.03 0.35 -0.20 0.00 1.01 0.00 0.00 58.87 60.06 2ca6 n SER 40 Cb 0.18 -1.30 0.04 0.00 -1.01 0.00 0.00 64.21 62.12 2ca6 n SER 40 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ca6 n GLY 41 N 1.04 -0.37 3.49 0.23 0.00 0.20 -2.75 105.19 107.03 2ca6 n GLY 41 Ca 0.08 0.04 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 2ca6 n GLY 41 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ca6 s ASN 42 N -2.85 0.29 -0.23 1.61 0.01 -1.17 -1.03 114.94 111.56 2ca6 s ASN 42 Ca 0.32 -1.20 0.02 0.00 -0.71 0.00 0.00 52.86 51.29 2ca6 s ASN 42 Cb -0.14 0.58 0.05 0.00 0.41 0.00 0.00 41.25 42.15 2ca6 s ASN 42 CO 0.39 -1.15 -0.10 -0.89 -1.51 0.00 0.00 177.10 173.84 2ca6 s THR 43 N -3.69 1.87 -0.32 1.60 2.01 -0.99 -3.65 115.64 112.46 2ca6 s THR 43 Ca 0.28 -1.30 -0.10 0.00 0.31 0.00 0.00 61.69 60.88 2ca6 s THR 43 Cb 0.01 -1.97 -0.00 0.00 0.01 0.00 0.00 72.50 70.54 2ca6 s THR 43 CO 0.13 0.07 0.16 -0.63 -0.69 0.00 0.00 174.62 173.67 2ca6 s ILE 44 N 1.27 4.64 0.68 1.82 1.01 0.93 -1.16 121.20 130.39 2ca6 s ILE 44 Ca -0.05 -0.45 -0.04 0.00 0.00 0.00 0.00 60.65 60.11 2ca6 s ILE 44 Cb -0.18 -3.39 0.07 0.00 0.01 0.00 0.00 42.46 38.97 2ca6 s ILE 44 CO -0.07 0.03 0.96 -0.83 0.00 0.00 0.00 174.94 175.03 2ca6 s GLY 45 N 1.61 1.74 0.13 6.18 0.00 0.31 -4.82 107.32 112.47 2ca6 s GLY 45 Ca 0.04 -1.16 -0.28 0.00 0.00 0.00 0.00 44.72 43.33 2ca6 s GLY 45 CO 0.07 -0.74 1.47 -0.84 0.00 0.00 0.00 173.10 173.06 2ca6 h THR 46 N -0.46 0.00 0.00 0.90 2.02 -1.85 -1.23 112.91 112.29 2ca6 h THR 46 Ca -0.43 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.68 2ca6 h THR 46 Cb 1.30 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 2ca6 h THR 46 CO 0.54 0.00 -0.33 -0.33 0.37 0.00 0.00 175.52 175.78 2ca6 h GLU 47 N -0.12 0.00 -0.35 6.66 4.39 -1.90 -2.42 114.58 120.85 2ca6 h GLU 47 Ca 0.11 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.68 2ca6 h GLU 47 Cb 0.41 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 2ca6 h GLU 47 CO -0.72 0.33 -0.31 0.00 -1.16 0.00 0.00 179.01 177.15 2ca6 h ALA 48 N 1.67 0.80 -0.04 3.43 0.00 -1.29 -1.98 119.26 121.85 2ca6 h ALA 48 Ca -0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.40 2ca6 h ALA 48 Cb 0.64 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2ca6 h ALA 48 CO 0.04 0.65 -0.44 0.00 0.00 0.00 0.00 179.25 179.50 2ca6 h ALA 49 N 1.01 1.18 -0.17 0.00 0.00 -0.91 -1.94 119.26 118.44 2ca6 h ALA 49 Ca 0.07 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 2ca6 h ALA 49 Cb 0.83 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 2ca6 h ALA 49 CO 0.07 0.58 -0.24 -0.09 0.00 0.00 0.00 179.25 179.58 2ca6 h ARG 50 N 0.08 0.47 -0.29 0.00 2.43 -1.18 0.13 114.38 116.03 2ca6 h ARG 50 Ca 0.00 -0.27 0.01 0.00 -0.81 0.00 0.00 59.98 58.91 2ca6 h ARG 50 Cb 0.82 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.37 2ca6 h ARG 50 CO 0.06 0.86 0.17 2.35 -1.51 0.00 0.00 179.97 181.90 2ca6 h TRP 51 N 0.11 0.32 -0.52 2.20 7.01 -1.21 -2.65 115.95 121.21 2ca6 h TRP 51 Ca 0.02 0.01 -0.04 0.00 2.11 0.00 0.00 58.89 60.99 2ca6 h TRP 51 Cb 0.80 -0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 27.74 2ca6 h TRP 51 CO 0.09 0.19 0.18 -0.07 -2.79 0.00 0.00 178.44 176.04 2ca6 h LEU 52 N 0.35 0.74 -0.72 0.65 3.38 -1.34 -2.83 115.31 115.53 2ca6 h LEU 52 Ca 0.11 -0.20 0.13 0.00 0.09 0.00 0.00 57.88 58.02 2ca6 h LEU 52 Cb -0.01 -0.19 -0.13 0.00 0.09 0.00 0.00 40.66 40.41 2ca6 h LEU 52 CO -0.05 0.74 -0.29 0.28 0.09 0.00 0.00 178.44 179.21 2ca6 h SER 53 N 0.70 -1.05 -0.53 -0.43 0.02 -0.62 0.89 113.55 112.53 2ca6 h SER 53 Ca 0.17 0.24 0.11 0.00 -0.84 0.00 0.00 61.79 61.47 2ca6 h SER 53 Cb 0.25 0.57 -0.10 0.00 0.14 0.00 0.00 62.40 63.26 2ca6 h SER 53 CO -0.01 -0.29 -0.18 -0.33 -1.14 0.00 0.00 176.83 174.88 2ca6 h GLU 54 N -0.08 -0.06 0.00 3.45 5.08 -1.24 -2.19 114.58 119.54 2ca6 h GLU 54 Ca 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 2ca6 h GLU 54 Cb 0.56 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2ca6 h GLU 54 CO -0.77 -0.04 -0.47 -0.91 -1.00 0.00 0.00 179.01 175.82 2ca6 h ASN 55 N -0.06 0.00 -0.04 1.42 2.35 -0.82 -3.33 115.58 115.11 2ca6 h ASN 55 Ca 0.25 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.95 2ca6 h ASN 55 Cb 0.45 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.82 2ca6 h ASN 55 CO -0.58 0.00 -0.17 0.40 -1.65 0.00 0.00 177.43 175.44 2ca6 h ILE 56 N 0.00 1.48 -0.02 2.81 2.04 0.11 -3.21 117.51 120.72 2ca6 h ILE 56 Ca 0.00 -1.65 0.01 0.00 1.00 0.00 0.00 64.86 64.22 2ca6 h ILE 56 Cb 0.99 2.45 -0.00 0.00 -0.74 0.00 0.00 36.82 39.52 2ca6 h ILE 56 CO 0.00 0.45 0.03 0.00 0.00 0.00 0.00 178.15 178.63 2ca6 h ALA 57 N 0.38 1.64 0.00 1.87 0.00 -1.55 -1.65 119.26 119.96 2ca6 h ALA 57 Ca -0.01 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2ca6 h ALA 57 Cb 0.83 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2ca6 h ALA 57 CO 0.03 -0.04 -0.36 0.66 0.00 0.00 0.00 179.25 179.55 2ca6 h SER 58 N 0.00 0.00 -0.84 0.00 4.64 -1.65 -3.40 113.55 112.30 2ca6 h SER 58 Ca 0.01 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.75 2ca6 h SER 58 Cb 0.06 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.08 2ca6 h SER 58 CO -0.00 0.36 1.75 -0.54 -0.87 0.00 0.00 176.83 177.53 2ca6 s LYS 59 N -3.47 3.55 0.00 4.77 -0.14 -0.62 -4.80 119.74 119.03 2ca6 s LYS 59 Ca 0.01 -1.54 0.12 0.00 -1.36 0.00 0.00 55.97 53.20 2ca6 s LYS 59 Cb 0.10 -5.42 0.55 0.00 -1.68 0.00 0.00 37.83 31.38 2ca6 s LYS 59 CO 0.69 -2.61 1.34 1.63 -0.76 0.00 0.00 175.35 175.63 2ca6 n LYS 60 N 8.53 0.08 -0.33 1.68 4.76 -1.25 -2.17 118.16 129.45 2ca6 n LYS 60 Ca 0.44 0.24 0.08 0.00 -2.87 0.00 0.00 58.31 56.19 2ca6 n LYS 60 Cb 0.47 -1.50 0.23 0.00 -1.84 0.00 0.00 35.03 32.40 2ca6 n LYS 60 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2ca6 n ASP 61 N -1.40 3.59 -4.73 4.39 8.00 -1.26 -4.36 116.55 120.79 2ca6 n ASP 61 Ca 0.04 -2.26 -0.42 0.00 0.71 0.00 0.00 54.79 52.86 2ca6 n ASP 61 Cb 0.12 -0.39 -0.02 0.00 -0.02 0.00 0.00 41.12 40.80 2ca6 n ASP 61 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2ca6 s LEU 62 N -1.48 4.36 0.00 0.64 2.96 -0.92 -4.22 118.68 120.03 2ca6 s LEU 62 Ca 0.35 2.83 0.00 0.00 -0.22 0.00 0.00 54.13 57.10 2ca6 s LEU 62 Cb 0.22 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 43.30 2ca6 s LEU 62 CO 0.19 -0.91 0.00 -0.62 -1.32 0.00 0.00 176.35 173.69 2ca6 n GLU 63 N 3.27 2.94 -4.83 1.98 1.02 0.86 -1.29 120.64 124.59 2ca6 n GLU 63 Ca 0.12 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.99 2ca6 n GLU 63 Cb 0.37 -0.89 -0.17 0.00 -0.02 0.00 0.00 31.44 30.74 2ca6 n GLU 63 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2ca6 s ILE 64 N -1.77 1.48 -0.36 -3.67 1.01 -0.40 -0.66 121.20 116.84 2ca6 s ILE 64 Ca 0.00 -0.69 0.02 0.00 0.00 0.00 0.00 60.65 59.98 2ca6 s ILE 64 Cb 0.00 -1.31 0.11 0.00 0.01 0.00 0.00 42.46 41.27 2ca6 s ILE 64 CO 0.00 0.43 0.11 0.00 0.00 0.00 0.00 174.94 175.48 2ca6 s ALA 65 N 0.47 2.32 -1.00 9.38 0.00 0.07 -2.39 121.76 130.63 2ca6 s ALA 65 Ca -0.15 -2.28 -0.18 0.00 0.00 0.00 0.00 51.96 49.35 2ca6 s ALA 65 Cb -0.16 -1.84 0.13 0.00 0.00 0.00 0.00 23.12 21.25 2ca6 s ALA 65 CO 0.05 -1.76 1.22 -2.00 0.00 0.00 0.00 175.76 173.28 2ca6 s GLU 66 N 1.00 3.71 -0.46 0.00 -6.30 -0.26 -1.35 118.70 115.03 2ca6 s GLU 66 Ca 0.12 -1.89 0.03 0.00 -2.50 0.00 0.00 54.97 50.73 2ca6 s GLU 66 Cb -0.20 -4.99 0.48 0.00 0.00 0.00 0.00 34.13 29.43 2ca6 s GLU 66 CO -0.13 -1.81 1.65 1.19 0.02 0.00 0.00 175.26 176.18 2ca6 n PHE 67 N 6.56 2.67 -3.02 5.30 3.01 0.59 -2.19 117.46 130.38 2ca6 n PHE 67 Ca 0.28 -2.41 -0.33 0.00 1.01 0.00 0.00 57.45 55.99 2ca6 n PHE 67 Cb 0.48 -0.88 -0.06 0.00 -0.01 0.00 0.00 39.48 39.01 2ca6 n PHE 67 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2ca6 s SER 68 N -2.49 6.90 -0.54 4.37 0.01 -1.12 -4.41 113.70 116.41 2ca6 s SER 68 Ca 0.56 1.46 -0.26 0.00 1.31 0.00 0.00 55.95 59.02 2ca6 s SER 68 Cb 0.46 -2.44 0.04 0.00 0.21 0.00 0.00 66.02 64.28 2ca6 s SER 68 CO 0.02 -0.21 0.65 -0.67 0.41 0.00 0.00 173.24 173.44 2ca6 n ASP 69 N -0.23 -5.87 0.00 2.44 2.03 -0.44 -3.72 116.55 110.75 2ca6 n ASP 69 Ca 0.04 -0.21 0.00 0.00 0.52 0.00 0.00 54.79 55.13 2ca6 n ASP 69 Cb 0.53 -2.44 0.00 0.00 -0.72 0.00 0.00 41.12 38.49 2ca6 n ASP 69 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2ca6 n ILE 70 N -0.80 0.12 -2.10 5.18 -5.35 -1.24 -0.63 119.36 114.55 2ca6 n ILE 70 Ca -0.10 -0.13 0.05 0.00 -0.27 0.00 0.00 62.75 62.30 2ca6 n ILE 70 Cb 0.64 1.00 0.11 0.00 -1.74 0.00 0.00 39.64 39.65 2ca6 n ILE 70 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2ca6 n PHE 71 N -0.06 0.01 -2.18 4.28 0.99 -1.25 -0.05 117.46 119.21 2ca6 n PHE 71 Ca 0.00 -0.96 -0.42 0.00 -0.00 0.00 0.00 57.45 56.07 2ca6 n PHE 71 Cb 0.45 -0.20 -0.03 0.00 -1.00 0.00 0.00 39.48 38.70 2ca6 n PHE 71 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 2ca6 s THR 72 N -1.48 3.54 0.00 4.37 2.01 -1.26 -2.81 115.64 120.01 2ca6 s THR 72 Ca 0.36 0.99 0.00 0.00 0.31 0.00 0.00 61.69 63.35 2ca6 s THR 72 Cb 0.38 -3.64 0.00 0.00 0.01 0.00 0.00 72.50 69.25 2ca6 s THR 72 CO -0.12 0.02 0.00 0.61 -0.69 0.00 0.00 174.62 174.43 2ca6 n GLY 73 N 3.64 2.95 3.74 4.40 0.00 -1.26 -4.77 105.19 113.90 2ca6 n GLY 73 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2ca6 n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ca6 s ARG 74 N -0.02 4.55 0.35 1.61 1.81 -1.12 -5.00 118.95 121.13 2ca6 s ARG 74 Ca 0.00 1.82 -0.26 0.00 -1.72 0.00 0.00 55.73 55.58 2ca6 s ARG 74 Cb 0.00 -3.23 -0.09 0.00 -0.45 0.00 0.00 34.95 31.18 2ca6 s ARG 74 CO 0.00 0.03 1.04 0.14 -0.68 0.00 0.00 175.30 175.83 2ca6 s VAL 75 N -0.42 3.77 0.24 3.52 -7.23 -1.26 -4.93 120.40 114.09 2ca6 s VAL 75 Ca 0.50 1.47 -0.13 0.00 -1.81 0.00 0.00 61.98 62.01 2ca6 s VAL 75 Cb -0.32 -3.82 0.33 0.00 0.56 0.00 0.00 36.38 33.13 2ca6 s VAL 75 CO 0.38 0.12 1.50 1.17 -0.31 0.00 0.00 175.10 177.96 2ca6 n LYS 76 N 0.36 -0.16 0.00 4.82 4.81 -1.26 -0.43 118.16 126.30 2ca6 n LYS 76 Ca 0.03 1.49 0.09 0.00 -0.87 0.00 0.00 58.31 59.06 2ca6 n LYS 76 Cb 0.49 -2.22 0.56 0.00 0.02 0.00 0.00 35.03 33.87 2ca6 n LYS 76 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2ca6 n ASP 77 N -5.49 0.00 -0.25 3.14 5.68 -1.26 -2.78 116.55 115.59 2ca6 n ASP 77 Ca 0.12 -0.74 0.05 0.00 -0.50 0.00 0.00 54.79 53.72 2ca6 n ASP 77 Cb 0.43 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.42 2ca6 n ASP 77 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2ca6 n GLU 78 N -0.94 1.88 0.03 0.11 1.02 0.43 -4.68 120.64 118.48 2ca6 n GLU 78 Ca 0.14 -0.67 -0.19 0.00 -0.02 0.00 0.00 57.16 56.42 2ca6 n GLU 78 Cb 0.06 -1.10 -0.11 0.00 -0.02 0.00 0.00 31.44 30.28 2ca6 n GLU 78 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2ca6 h ILE 79 N 1.24 1.34 -0.77 -3.67 2.04 -1.45 -3.38 117.51 112.85 2ca6 h ILE 79 Ca 0.00 -2.18 0.25 0.00 1.00 0.00 0.00 64.86 63.93 2ca6 h ILE 79 Cb 0.35 2.48 -0.14 0.00 -0.74 0.00 0.00 36.82 38.77 2ca6 h ILE 79 CO 0.00 0.66 0.15 -2.65 0.00 0.00 0.00 178.15 176.31 2ca6 n PRO 80 N -4.01 -0.06 -0.03 2.37 -0.02 -1.26 -1.53 135.00 130.47 2ca6 n PRO 80 Ca -0.11 1.13 -0.12 0.00 -2.02 0.00 0.00 63.50 62.38 2ca6 n PRO 80 Cb 0.80 -1.87 -0.07 0.00 -0.02 0.00 0.00 33.50 32.34 2ca6 n PRO 80 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2ca6 h GLU 81 N 0.00 0.17 -0.07 -0.52 4.81 -1.92 0.76 114.58 117.81 2ca6 h GLU 81 Ca 0.53 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.63 2ca6 h GLU 81 Cb 1.22 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 2ca6 h GLU 81 CO -0.68 0.36 -0.35 0.00 -0.73 0.00 0.00 179.01 177.60 2ca6 h ALA 82 N 0.81 1.27 -0.19 2.92 0.00 -1.52 -1.95 119.26 120.60 2ca6 h ALA 82 Ca 0.03 -0.35 -0.15 0.00 0.00 0.00 0.00 54.91 54.44 2ca6 h ALA 82 Cb 0.27 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2ca6 h ALA 82 CO 0.00 0.51 -0.51 1.25 0.00 0.00 0.00 179.25 180.50 2ca6 h LEU 83 N 0.13 0.60 -0.03 0.00 5.85 -1.06 -2.58 115.31 118.21 2ca6 h LEU 83 Ca 0.02 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.41 2ca6 h LEU 83 Cb 0.69 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 2ca6 h LEU 83 CO 0.05 1.00 -0.05 -0.09 -0.34 0.00 0.00 178.44 179.01 2ca6 h ARG 84 N 0.42 0.10 -0.93 1.25 2.43 -0.60 -2.26 114.38 114.80 2ca6 h ARG 84 Ca 0.02 -0.06 0.07 0.00 -0.81 0.00 0.00 59.98 59.20 2ca6 h ARG 84 Cb 1.04 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.54 2ca6 h ARG 84 CO 0.10 0.62 0.60 -0.07 -1.51 0.00 0.00 179.97 179.70 2ca6 h LEU 85 N -0.41 0.92 -0.00 3.80 3.38 -1.39 -0.18 115.31 121.42 2ca6 h LEU 85 Ca 0.00 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2ca6 h LEU 85 Cb 0.61 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.18 2ca6 h LEU 85 CO 0.01 0.57 -0.01 -0.07 0.09 0.00 0.00 178.44 179.04 2ca6 h LEU 86 N 1.03 0.01 -0.71 1.67 3.38 -1.51 -3.15 115.31 116.03 2ca6 h LEU 86 Ca 0.41 -0.70 0.01 0.00 0.09 0.00 0.00 57.88 57.69 2ca6 h LEU 86 Cb 0.24 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 2ca6 h LEU 86 CO -0.16 0.70 0.46 -0.07 0.09 0.00 0.00 178.44 179.46 2ca6 h LEU 87 N -0.68 0.82 -1.74 1.67 3.38 -1.24 -1.27 115.31 116.24 2ca6 h LEU 87 Ca -0.00 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.96 2ca6 h LEU 87 Cb 0.70 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2ca6 h LEU 87 CO 0.00 0.60 0.20 1.56 0.09 0.00 0.00 178.44 180.90 2ca6 h GLN 88 N 0.96 0.34 -0.17 1.13 4.20 -1.14 -1.31 115.11 119.11 2ca6 h GLN 88 Ca 0.26 -0.02 -0.21 0.00 0.06 0.00 0.00 58.65 58.73 2ca6 h GLN 88 Cb -0.10 -0.08 0.01 0.00 0.30 0.00 0.00 27.48 27.61 2ca6 h GLN 88 CO -0.05 0.22 -0.74 0.00 -0.67 0.00 0.00 178.83 177.59 2ca6 h ALA 89 N 1.82 0.37 -0.23 3.87 0.00 -1.27 -3.14 119.26 120.68 2ca6 h ALA 89 Ca 0.12 -0.59 -0.06 0.00 0.00 0.00 0.00 54.91 54.39 2ca6 h ALA 89 Cb 0.06 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2ca6 h ALA 89 CO -0.03 0.69 -0.10 -0.07 0.00 0.00 0.00 179.25 179.74 2ca6 h LEU 90 N 0.54 0.36 0.00 0.00 3.38 -0.30 -2.15 115.31 117.13 2ca6 h LEU 90 Ca -0.04 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2ca6 h LEU 90 Cb 1.36 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.01 2ca6 h LEU 90 CO 0.15 0.50 0.00 -0.11 0.09 0.00 0.00 178.44 179.07 2ca6 n LEU 91 N -4.25 0.00 -1.05 1.67 7.94 -0.59 -1.15 117.00 119.57 2ca6 n LEU 91 Ca 0.00 0.48 0.12 0.00 -1.11 0.00 0.00 56.01 55.50 2ca6 n LEU 91 Cb 0.28 -0.48 0.21 0.00 0.53 0.00 0.00 43.42 43.96 2ca6 n LEU 91 CO 0.39 -0.34 0.70 0.29 -1.11 0.00 0.00 177.39 177.31 2ca6 n LYS 92 N -1.48 2.39 -3.60 1.96 5.02 -0.81 -4.76 118.16 116.88 2ca6 n LYS 92 Ca 0.02 -2.08 -0.40 0.00 -2.02 0.00 0.00 58.31 53.83 2ca6 n LYS 92 Cb 0.09 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 33.52 2ca6 n LYS 92 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ca6 h PRO 94 N 8.39 0.25 -0.52 0.00 0.11 -1.84 -2.78 132.00 135.61 2ca6 h PRO 94 Ca -0.21 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2ca6 h PRO 94 Cb 1.08 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2ca6 h PRO 94 CO 0.80 0.28 0.00 1.63 -0.21 0.00 0.00 178.00 180.50 2ca6 n LYS 95 N -4.38 2.33 -2.26 1.05 5.02 -1.25 -4.68 118.16 113.98 2ca6 n LYS 95 Ca -0.00 -2.06 -0.39 0.00 -2.02 0.00 0.00 58.31 53.84 2ca6 n LYS 95 Cb 0.18 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 33.69 2ca6 n LYS 95 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2ca6 s LEU 96 N -1.13 3.23 -0.04 -0.35 2.96 -0.41 -3.84 118.68 119.11 2ca6 s LEU 96 Ca 0.39 -0.02 0.20 0.00 -0.22 0.00 0.00 54.13 54.47 2ca6 s LEU 96 Cb 0.21 -2.54 -0.30 0.00 0.50 0.00 0.00 46.19 44.05 2ca6 s LEU 96 CO 0.28 -2.15 0.41 0.00 -1.32 0.00 0.00 176.35 173.56 2ca6 n HIS 97 N 11.32 0.00 -4.36 5.38 1.44 -0.02 -3.65 115.22 125.33 2ca6 n HIS 97 Ca 0.13 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.55 2ca6 n HIS 97 Cb 0.51 -0.49 -0.17 0.00 0.12 0.00 0.00 29.99 29.96 2ca6 n HIS 97 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 2ca6 s THR 98 N -3.31 1.62 -0.12 0.61 2.01 0.17 -0.69 115.64 115.94 2ca6 s THR 98 Ca -0.07 -0.70 -0.00 0.00 0.31 0.00 0.00 61.69 61.22 2ca6 s THR 98 Cb 0.12 -1.48 0.02 0.00 0.01 0.00 0.00 72.50 71.17 2ca6 s THR 98 CO 0.82 0.47 -0.08 -0.69 -0.69 0.00 0.00 174.62 174.45 2ca6 s VAL 99 N 1.10 1.07 -0.20 3.82 1.01 -0.87 -0.75 120.40 125.59 2ca6 s VAL 99 Ca -0.03 -0.31 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 2ca6 s VAL 99 Cb -0.14 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 2ca6 s VAL 99 CO -0.04 0.37 -0.06 -0.13 0.00 0.00 0.00 175.10 175.25 2ca6 s ARG 100 N 1.69 3.42 -0.08 2.72 0.52 -0.46 -1.98 118.95 124.78 2ca6 s ARG 100 Ca 0.05 -0.62 0.13 0.00 -0.52 0.00 0.00 55.73 54.77 2ca6 s ARG 100 Cb -0.13 -2.94 0.25 0.00 0.52 0.00 0.00 34.95 32.65 2ca6 s ARG 100 CO -0.08 -0.07 1.12 1.28 0.02 0.00 0.00 175.30 177.56 2ca6 n LEU 101 N 4.42 1.39 -4.61 2.53 4.77 0.43 -0.30 117.00 125.64 2ca6 n LEU 101 Ca -0.18 -2.35 -0.29 0.00 -0.03 0.00 0.00 56.01 53.15 2ca6 n LEU 101 Cb 0.51 -0.23 0.19 0.00 -2.33 0.00 0.00 43.42 41.57 2ca6 n LEU 101 CO 0.30 0.65 0.61 -0.44 -1.33 0.00 0.00 177.39 177.17 2ca6 s SER 102 N -2.17 2.26 -1.26 -1.43 0.01 -1.15 -4.09 113.70 105.88 2ca6 s SER 102 Ca 0.23 1.68 -0.19 0.00 1.31 0.00 0.00 55.95 58.99 2ca6 s SER 102 Cb 0.23 -2.33 0.01 0.00 0.21 0.00 0.00 66.02 64.14 2ca6 s SER 102 CO -0.04 -3.43 0.60 0.47 0.41 0.00 0.00 173.24 171.25 2ca6 n ASP 103 N -4.42 -3.26 -3.68 2.44 8.00 -0.54 -1.33 116.55 113.77 2ca6 n ASP 103 Ca 0.07 -1.13 -0.13 0.00 0.71 0.00 0.00 54.79 54.31 2ca6 n ASP 103 Cb 0.54 -2.60 -0.13 0.00 -0.02 0.00 0.00 41.12 38.91 2ca6 n ASP 103 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2ca6 s ASN 104 N -3.77 0.14 -0.38 -2.24 0.01 -1.20 -2.77 114.94 104.72 2ca6 s ASN 104 Ca 0.33 0.63 -0.29 0.00 -0.71 0.00 0.00 52.86 52.83 2ca6 s ASN 104 Cb -0.15 0.71 0.01 0.00 0.41 0.00 0.00 41.25 42.23 2ca6 s ASN 104 CO 0.92 -0.22 1.36 0.00 -1.51 0.00 0.00 177.10 177.64 2ca6 s ALA 105 N 2.17 3.16 -0.70 0.60 0.00 -1.26 -4.35 121.76 121.37 2ca6 s ALA 105 Ca -0.02 -0.09 -0.05 0.00 0.00 0.00 0.00 51.96 51.80 2ca6 s ALA 105 Cb -0.12 -3.88 0.18 0.00 0.00 0.00 0.00 23.12 19.30 2ca6 s ALA 105 CO -0.09 -2.18 0.56 -0.06 0.00 0.00 0.00 175.76 173.99 2ca6 s PHE 106 N 5.01 3.53 0.25 0.00 0.08 -0.89 -4.84 117.98 121.12 2ca6 s PHE 106 Ca 0.59 -2.58 -0.04 0.00 0.12 0.00 0.00 56.93 55.02 2ca6 s PHE 106 Cb -0.14 -3.36 0.06 0.00 -0.57 0.00 0.00 43.02 39.02 2ca6 s PHE 106 CO 0.29 -0.87 0.21 0.41 -0.10 0.00 0.00 175.22 175.17 2ca6 n GLY 107 N 3.47 -2.66 0.35 4.36 0.00 -1.26 -4.55 105.19 104.91 2ca6 n GLY 107 Ca 0.11 -1.43 0.14 0.00 0.00 0.00 0.00 46.02 44.84 2ca6 n GLY 107 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ca6 h PRO 108 N 0.00 0.70 -0.02 1.61 0.11 -1.95 -1.49 132.00 130.96 2ca6 h PRO 108 Ca -0.08 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.99 2ca6 h PRO 108 Cb 0.25 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.20 2ca6 h PRO 108 CO 0.05 0.46 0.00 0.25 -0.21 0.00 0.00 178.00 178.55 2ca6 n THR 109 N -4.78 0.03 0.94 -1.15 -2.24 -1.26 -3.20 114.28 102.61 2ca6 n THR 109 Ca 0.24 -0.08 0.10 0.00 -2.27 0.00 0.00 64.05 62.04 2ca6 n THR 109 Cb 0.61 -0.18 -0.06 0.00 -2.10 0.00 0.00 70.33 68.60 2ca6 n THR 109 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ca6 n ALA 110 N -0.61 4.07 -0.05 6.98 0.00 -0.56 -4.50 120.51 125.84 2ca6 n ALA 110 Ca 0.19 -0.59 -0.13 0.00 0.00 0.00 0.00 53.44 52.91 2ca6 n ALA 110 Cb 0.15 -0.73 -0.07 0.00 0.00 0.00 0.00 19.45 18.80 2ca6 n ALA 110 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2ca6 h GLN 111 N 1.09 0.27 -0.59 0.00 1.08 -1.61 -2.98 115.11 112.38 2ca6 h GLN 111 Ca 0.00 -0.13 0.12 0.00 -1.45 0.00 0.00 58.65 57.19 2ca6 h GLN 111 Cb 0.59 -0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 27.91 2ca6 h GLN 111 CO 0.00 0.63 -0.07 1.49 -0.95 0.00 0.00 178.83 179.93 2ca6 h GLU 112 N -0.08 0.06 0.00 1.46 4.81 -1.80 0.26 114.58 119.28 2ca6 h GLU 112 Ca 0.03 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 2ca6 h GLU 112 Cb 0.56 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 2ca6 h GLU 112 CO 0.02 0.04 -0.30 -1.35 -0.73 0.00 0.00 179.01 176.69 2ca6 h PRO 113 N 0.06 0.00 0.07 0.92 0.11 -1.85 -2.42 132.00 128.89 2ca6 h PRO 113 Ca 0.30 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.40 2ca6 h PRO 113 Cb 0.47 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.58 2ca6 h PRO 113 CO -0.55 0.30 -0.03 -0.07 -0.21 0.00 0.00 178.00 177.43 2ca6 h LEU 114 N 0.00 -0.07 -1.64 2.35 3.38 -0.83 -3.16 115.31 115.34 2ca6 h LEU 114 Ca -0.00 -0.45 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 2ca6 h LEU 114 Cb 0.59 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2ca6 h LEU 114 CO 0.04 0.61 -0.20 0.16 0.09 0.00 0.00 178.44 179.14 2ca6 h ILE 115 N -0.95 0.81 -0.09 1.22 3.07 -0.65 0.91 117.51 121.83 2ca6 h ILE 115 Ca -0.01 -0.78 -0.12 0.00 1.55 0.00 0.00 64.86 65.50 2ca6 h ILE 115 Cb 0.52 1.47 -0.01 0.00 -0.27 0.00 0.00 36.82 38.53 2ca6 h ILE 115 CO 0.01 0.19 -0.48 -0.78 -1.05 0.00 0.00 178.15 176.05 2ca6 h ASP 116 N 0.00 0.25 0.08 2.16 1.82 -1.55 -1.81 116.42 117.36 2ca6 h ASP 116 Ca -0.00 -0.12 -0.23 0.00 -0.39 0.00 0.00 57.03 56.29 2ca6 h ASP 116 Cb 0.45 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.38 2ca6 h ASP 116 CO 0.03 0.69 -1.20 0.15 -1.61 0.00 0.00 179.24 177.30 2ca6 h PHE 117 N 0.19 0.30 0.00 0.28 3.57 -1.36 -3.33 116.94 116.58 2ca6 h PHE 117 Ca 0.01 -0.22 -0.01 0.00 3.53 0.00 0.00 57.97 61.28 2ca6 h PHE 117 Cb 0.91 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.64 2ca6 h PHE 117 CO 0.02 1.47 -0.06 -0.07 -2.23 0.00 0.00 178.31 177.43 2ca6 h LEU 118 N -0.53 0.00 0.00 0.59 3.38 -0.86 -0.33 115.31 117.56 2ca6 h LEU 118 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2ca6 h LEU 118 Cb 1.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.32 2ca6 h LEU 118 CO -0.00 0.06 -0.64 0.77 0.09 0.00 0.00 178.44 178.72 2ca6 h SER 119 N 0.00 0.00 0.00 -0.43 4.64 -1.46 -3.39 113.55 112.92 2ca6 h SER 119 Ca -0.00 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 2ca6 h SER 119 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2ca6 h SER 119 CO 0.01 0.06 -0.44 0.29 -0.87 0.00 0.00 176.83 175.87 2ca6 n LYS 120 N -2.41 4.28 -2.69 4.77 5.02 -0.93 -3.80 118.16 122.39 2ca6 n LYS 120 Ca 0.02 -0.01 -0.43 0.00 -2.02 0.00 0.00 58.31 55.87 2ca6 n LYS 120 Cb 0.48 -0.83 -0.00 0.00 -0.02 0.00 0.00 35.03 34.66 2ca6 n LYS 120 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2ca6 s HIS 121 N -1.68 2.96 0.48 2.13 2.46 -0.18 -4.78 115.29 116.69 2ca6 s HIS 121 Ca 0.01 -1.66 0.17 0.00 0.47 0.00 0.00 55.06 54.05 2ca6 s HIS 121 Cb 0.04 -4.61 1.20 0.00 -0.13 0.00 0.00 32.58 29.08 2ca6 s HIS 121 CO 0.23 -1.70 2.08 1.79 -2.47 0.00 0.00 174.74 174.67 2ca6 h THR 122 N 5.48 0.99 0.00 0.89 1.35 -1.89 -2.33 112.91 117.41 2ca6 h THR 122 Ca 0.37 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.89 2ca6 h THR 122 Cb 0.90 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.50 2ca6 h THR 122 CO 1.38 0.09 0.00 -0.65 -0.25 0.00 0.00 175.52 176.09 2ca6 h PRO 123 N 0.00 0.00 -6.27 4.72 0.11 -1.83 -3.40 132.00 125.33 2ca6 h PRO 123 Ca -0.00 0.00 -0.67 0.00 0.11 0.00 0.00 66.00 65.44 2ca6 h PRO 123 Cb 0.18 0.00 0.07 0.00 0.11 0.00 0.00 31.00 31.36 2ca6 h PRO 123 CO 0.01 0.00 0.28 -0.11 -0.21 0.00 0.00 178.00 177.98 2ca6 n LEU 124 N -2.85 1.33 0.00 2.35 7.94 -0.88 -4.33 117.00 120.56 2ca6 n LEU 124 Ca 0.00 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.04 2ca6 n LEU 124 Cb 0.24 -1.17 0.00 0.00 0.53 0.00 0.00 43.42 43.02 2ca6 n LEU 124 CO 0.23 -1.33 -0.19 -0.62 -1.11 0.00 0.00 177.39 174.38 2ca6 n GLU 125 N 1.97 0.92 -3.92 1.96 1.02 0.13 -4.19 120.64 118.53 2ca6 n GLU 125 Ca 0.17 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 57.03 2ca6 n GLU 125 Cb 0.21 -0.69 -0.17 0.00 -0.02 0.00 0.00 31.44 30.78 2ca6 n GLU 125 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2ca6 s HIS 126 N -1.38 1.74 -0.14 -0.32 3.76 -0.64 0.11 115.29 118.42 2ca6 s HIS 126 Ca 0.00 -1.01 -0.01 0.00 -0.15 0.00 0.00 55.06 53.89 2ca6 s HIS 126 Cb 0.00 -1.35 -0.01 0.00 1.11 0.00 0.00 32.58 32.33 2ca6 s HIS 126 CO 0.00 -0.60 -0.12 -1.17 -0.85 0.00 0.00 174.74 172.00 2ca6 s LEU 127 N 1.62 2.71 -0.35 0.89 2.96 0.15 -2.05 118.68 124.61 2ca6 s LEU 127 Ca 0.03 -0.35 0.03 0.00 -0.22 0.00 0.00 54.13 53.61 2ca6 s LEU 127 Cb -0.14 -1.62 0.10 0.00 0.50 0.00 0.00 46.19 45.03 2ca6 s LEU 127 CO -0.08 0.13 0.09 -0.31 -1.32 0.00 0.00 176.35 174.86 2ca6 s TYR 128 N 0.54 3.07 -0.47 5.38 1.51 -0.84 -0.78 117.35 125.76 2ca6 s TYR 128 Ca -0.08 -2.66 0.08 0.00 -1.01 0.00 0.00 57.07 53.41 2ca6 s TYR 128 Cb -0.16 -2.54 0.37 0.00 -0.11 0.00 0.00 41.96 39.52 2ca6 s TYR 128 CO 0.04 -0.90 0.90 -0.11 -1.11 0.00 0.00 175.55 174.37 2ca6 n LEU 129 N 4.26 3.12 -4.87 -1.29 7.94 0.11 -0.42 117.00 125.85 2ca6 n LEU 129 Ca 0.03 -5.23 -0.37 0.00 -1.11 0.00 0.00 56.01 49.32 2ca6 n LEU 129 Cb 0.41 -0.06 -0.06 0.00 0.53 0.00 0.00 43.42 44.24 2ca6 n LEU 129 CO 0.20 2.25 -0.07 -2.28 -1.11 0.00 0.00 177.39 176.38 2ca6 s HIS 130 N -3.13 3.64 -0.65 1.96 5.65 -1.20 -4.07 115.29 117.48 2ca6 s HIS 130 Ca 0.44 0.68 -0.03 0.00 0.25 0.00 0.00 55.06 56.40 2ca6 s HIS 130 Cb 0.33 -2.05 0.00 0.00 -1.18 0.00 0.00 32.58 29.69 2ca6 s HIS 130 CO -0.11 0.69 0.65 -1.71 -0.65 0.00 0.00 174.74 173.61 2ca6 n ASN 131 N 1.80 -7.59 0.00 9.88 5.15 0.62 -1.46 115.26 123.66 2ca6 n ASN 131 Ca -0.17 0.05 0.00 0.00 -0.60 0.00 0.00 54.58 53.86 2ca6 n ASN 131 Cb 0.54 -5.15 0.00 0.00 -0.53 0.00 0.00 39.78 34.64 2ca6 n ASN 131 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2ca6 n ASN 132 N -1.46 0.45 -2.96 1.20 4.13 -1.19 -2.50 115.26 112.93 2ca6 n ASN 132 Ca 0.02 -1.21 -0.21 0.00 1.68 0.00 0.00 54.58 54.86 2ca6 n ASN 132 Cb 0.49 0.00 0.01 0.00 -1.54 0.00 0.00 39.78 38.74 2ca6 n ASN 132 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2ca6 n GLY 133 N -0.11 -0.51 0.43 7.41 0.00 -1.25 -2.10 105.19 109.06 2ca6 n GLY 133 Ca 0.00 0.08 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 2ca6 n GLY 133 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ca6 h LEU 134 N -0.87 -1.21 0.00 0.99 3.38 -1.80 -3.46 115.31 112.35 2ca6 h LEU 134 Ca -0.45 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2ca6 h LEU 134 Cb 1.32 0.40 0.00 0.00 0.09 0.00 0.00 40.66 42.47 2ca6 h LEU 134 CO 0.52 -0.57 0.00 0.61 0.09 0.00 0.00 178.44 179.09 2ca6 n GLY 135 N -1.48 0.48 0.28 0.83 0.00 0.71 -4.25 105.19 101.76 2ca6 n GLY 135 Ca -0.10 -1.79 -0.04 0.00 0.00 0.00 0.00 46.02 44.09 2ca6 n GLY 135 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ca6 h PRO 136 N 0.00 -0.12 0.46 1.61 0.11 -1.27 -1.16 132.00 131.63 2ca6 h PRO 136 Ca 0.00 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 2ca6 h PRO 136 Cb 0.00 0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.14 2ca6 h PRO 136 CO 0.00 -0.08 -0.22 1.96 -0.21 0.00 0.00 178.00 179.45 2ca6 h GLN 137 N -0.12 -0.59 0.00 1.05 4.20 -1.88 -2.33 115.11 115.43 2ca6 h GLN 137 Ca 0.23 0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.98 2ca6 h GLN 137 Cb 0.48 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.40 2ca6 h GLN 137 CO -0.58 -0.29 0.00 0.00 -0.67 0.00 0.00 178.83 177.30 2ca6 h ALA 138 N -0.52 1.00 -0.20 3.87 0.00 -1.73 -2.15 119.26 119.53 2ca6 h ALA 138 Ca -0.06 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.64 2ca6 h ALA 138 Cb 0.58 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.37 2ca6 h ALA 138 CO 0.10 0.00 -0.70 0.78 0.00 0.00 0.00 179.25 179.43 2ca6 h GLY 139 N 0.58 0.90 2.00 0.00 0.00 -0.89 -2.54 103.07 103.12 2ca6 h GLY 139 Ca 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 47.33 46.13 2ca6 h GLY 139 CO 0.00 1.07 0.00 0.00 0.00 0.00 0.00 176.54 177.61 2ca6 h ALA 140 N 0.59 1.00 0.03 3.60 0.00 -0.86 -2.52 119.26 121.10 2ca6 h ALA 140 Ca -0.03 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 2ca6 h ALA 140 Cb 1.33 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2ca6 h ALA 140 CO 0.15 0.00 -0.97 0.87 0.00 0.00 0.00 179.25 179.29 2ca6 h LYS 141 N 0.00 0.24 -0.04 0.00 1.57 -1.35 -0.55 116.57 116.43 2ca6 h LYS 141 Ca 0.00 -0.29 -0.22 0.00 -1.87 0.00 0.00 60.65 58.27 2ca6 h LYS 141 Cb 0.72 0.09 0.02 0.00 0.08 0.00 0.00 32.23 33.14 2ca6 h LYS 141 CO 0.00 1.04 -0.81 0.82 -0.57 0.00 0.00 179.45 179.93 2ca6 h ILE 142 N 0.12 1.33 -0.32 1.86 1.08 -1.28 -2.29 117.51 118.00 2ca6 h ILE 142 Ca -0.07 -2.10 -0.12 0.00 -0.39 0.00 0.00 64.86 62.19 2ca6 h ILE 142 Cb 1.64 2.33 -0.01 0.00 -3.07 0.00 0.00 36.82 37.71 2ca6 h ILE 142 CO 0.15 0.64 -0.28 0.00 -0.69 0.00 0.00 178.15 177.98 2ca6 h ALA 143 N 0.42 0.91 -0.35 1.87 0.00 -1.49 -1.43 119.26 119.19 2ca6 h ALA 143 Ca -0.09 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 2ca6 h ALA 143 Cb 1.48 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2ca6 h ALA 143 CO 0.16 0.62 0.07 -0.09 0.00 0.00 0.00 179.25 180.01 2ca6 h ARG 144 N 0.57 0.57 -0.66 0.00 2.43 -1.10 -2.43 114.38 113.77 2ca6 h ARG 144 Ca 0.07 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 59.06 2ca6 h ARG 144 Cb 0.77 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.21 2ca6 h ARG 144 CO 0.06 0.63 0.26 0.00 -1.51 0.00 0.00 179.97 179.42 2ca6 h ALA 145 N 0.92 1.22 0.00 2.80 0.00 -1.21 -2.22 119.26 120.77 2ca6 h ALA 145 Ca 0.11 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2ca6 h ALA 145 Cb 0.33 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2ca6 h ALA 145 CO 0.00 0.57 -0.16 -0.07 0.00 0.00 0.00 179.25 179.59 2ca6 h LEU 146 N 0.95 0.00 -0.20 0.00 3.38 -1.06 -1.26 115.31 117.11 2ca6 h LEU 146 Ca 0.22 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.07 2ca6 h LEU 146 Cb 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2ca6 h LEU 146 CO -0.02 0.16 -0.35 1.56 0.09 0.00 0.00 178.44 179.88 2ca6 h GLN 147 N 0.00 0.60 -0.08 1.13 4.20 -0.91 -2.78 115.11 117.26 2ca6 h GLN 147 Ca -0.00 -0.37 -0.06 0.00 0.06 0.00 0.00 58.65 58.28 2ca6 h GLN 147 Cb 0.45 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 2ca6 h GLN 147 CO 0.02 0.98 -0.21 1.49 -0.67 0.00 0.00 178.83 180.45 2ca6 h GLU 148 N 0.28 0.14 -0.94 1.46 4.81 -1.21 -2.40 114.58 116.72 2ca6 h GLU 148 Ca 0.01 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.26 2ca6 h GLU 148 Cb 0.94 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.25 2ca6 h GLU 148 CO 0.08 0.35 0.60 1.25 -0.73 0.00 0.00 179.01 180.56 2ca6 h LEU 149 N 0.13 0.98 -0.74 1.64 5.85 -0.98 -1.12 115.31 121.07 2ca6 h LEU 149 Ca 0.02 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.70 2ca6 h LEU 149 Cb 0.44 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 2ca6 h LEU 149 CO 0.03 0.65 0.30 0.00 -0.34 0.00 0.00 178.44 179.08 2ca6 h ALA 150 N 1.41 0.96 -0.26 1.25 0.00 -1.24 -0.97 119.26 120.41 2ca6 h ALA 150 Ca 0.39 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.14 2ca6 h ALA 150 Cb 0.09 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2ca6 h ALA 150 CO -0.15 0.58 0.08 0.28 0.00 0.00 0.00 179.25 180.05 2ca6 h VAL 151 N 1.07 0.93 -0.12 0.00 2.07 -1.12 -0.84 116.25 118.24 2ca6 h VAL 151 Ca 0.25 -0.07 -0.12 0.00 0.82 0.00 0.00 66.70 67.58 2ca6 h VAL 151 Cb 0.20 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2ca6 h VAL 151 CO -0.02 0.04 -0.44 0.78 0.02 0.00 0.00 177.57 177.94 2ca6 h ASN 152 N 0.20 0.29 -0.40 0.57 2.35 -1.13 -1.14 115.58 116.32 2ca6 h ASN 152 Ca 0.11 -0.13 -0.07 0.00 -0.55 0.00 0.00 56.30 55.67 2ca6 h ASN 152 Cb 0.08 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2ca6 h ASN 152 CO -0.12 0.70 -0.00 0.11 -1.65 0.00 0.00 177.43 176.47 2ca6 h LYS 153 N 0.22 0.72 0.92 0.81 1.57 -0.85 0.25 116.57 120.21 2ca6 h LYS 153 Ca 0.02 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.52 2ca6 h LYS 153 Cb 0.87 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 33.13 2ca6 h LYS 153 CO 0.07 0.80 -0.44 -0.22 -0.57 0.00 0.00 179.45 179.09 2ca6 h LYS 154 N 0.54 -1.19 -1.12 3.15 3.64 -1.03 0.32 116.57 120.89 2ca6 h LYS 154 Ca 0.11 0.08 0.31 0.00 -1.27 0.00 0.00 60.65 59.89 2ca6 h LYS 154 Cb 0.48 0.27 -0.07 0.00 -0.41 0.00 0.00 32.23 32.50 2ca6 h LYS 154 CO 0.02 -0.79 0.77 0.00 -2.27 0.00 0.00 179.45 177.17 2ca6 h ALA 155 N -1.37 2.74 -0.18 5.00 0.00 -1.13 -0.64 119.26 123.68 2ca6 h ALA 155 Ca -0.13 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2ca6 h ALA 155 Cb 0.95 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2ca6 h ALA 155 CO 0.21 -1.11 0.00 1.63 0.00 0.00 0.00 179.25 179.98 2ca6 n LYS 156 N -4.38 2.02 -3.39 0.00 5.02 0.87 -4.96 118.16 113.34 2ca6 n LYS 156 Ca 0.25 -1.90 -0.24 0.00 -2.02 0.00 0.00 58.31 54.41 2ca6 n LYS 156 Cb 1.09 -1.41 0.06 0.00 -0.02 0.00 0.00 35.03 34.75 2ca6 n LYS 156 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2ca6 n ASN 157 N 1.17 -6.11 -4.88 4.39 3.02 0.89 -4.97 115.26 108.76 2ca6 n ASN 157 Ca 0.14 -0.46 -0.30 0.00 -0.03 0.00 0.00 54.58 53.94 2ca6 n ASN 157 Cb 0.51 -4.87 -0.02 0.00 -0.61 0.00 0.00 39.78 34.80 2ca6 n ASN 157 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ca6 s ALA 158 N -3.25 3.30 0.82 5.41 0.00 0.20 -5.04 121.76 123.20 2ca6 s ALA 158 Ca 0.48 -0.23 -0.11 0.00 0.00 0.00 0.00 51.96 52.10 2ca6 s ALA 158 Cb -0.22 -2.76 0.09 0.00 0.00 0.00 0.00 23.12 20.23 2ca6 s ALA 158 CO 0.59 -0.20 1.13 -1.25 0.00 0.00 0.00 175.76 176.04 2ca6 s PRO 159 N -4.25 1.73 0.46 0.00 0.04 -1.26 -4.78 135.00 126.93 2ca6 s PRO 159 Ca 0.51 1.43 -0.20 0.00 0.04 0.00 0.00 61.00 62.79 2ca6 s PRO 159 Cb -0.10 -1.82 -0.10 0.00 0.04 0.00 0.00 34.50 32.52 2ca6 s PRO 159 CO 0.37 -2.08 0.97 -1.25 0.04 0.00 0.00 177.00 175.05 2ca6 s PRO 160 N -4.60 4.08 0.23 0.56 0.04 -1.26 -4.89 135.00 129.16 2ca6 s PRO 160 Ca 0.66 1.12 -0.30 0.00 0.04 0.00 0.00 61.00 62.52 2ca6 s PRO 160 Cb -0.21 -2.15 -0.09 0.00 0.04 0.00 0.00 34.50 32.08 2ca6 s PRO 160 CO 0.54 -0.16 1.25 -1.17 0.04 0.00 0.00 177.00 177.51 2ca6 s LEU 161 N -3.46 4.45 0.00 -3.56 2.96 -1.26 -4.66 118.68 113.14 2ca6 s LEU 161 Ca 0.62 2.40 0.00 0.00 -0.22 0.00 0.00 54.13 56.93 2ca6 s LEU 161 Cb -0.10 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 42.97 2ca6 s LEU 161 CO 0.19 -0.44 0.00 0.54 -1.32 0.00 0.00 176.35 175.32 2ca6 n ARG 162 N 2.04 0.15 -4.03 1.98 1.74 0.30 -3.73 116.66 115.10 2ca6 n ARG 162 Ca 0.03 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.89 2ca6 n ARG 162 Cb 0.43 -0.99 -0.17 0.00 -1.02 0.00 0.00 32.46 30.72 2ca6 n ARG 162 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2ca6 s SER 163 N -1.96 1.43 -0.24 0.55 0.01 -0.09 -0.47 113.70 112.92 2ca6 s SER 163 Ca 0.00 -0.16 0.01 0.00 1.31 0.00 0.00 55.95 57.11 2ca6 s SER 163 Cb 0.00 -0.54 0.06 0.00 0.21 0.00 0.00 66.02 65.75 2ca6 s SER 163 CO 0.00 -0.10 -0.04 -0.63 0.41 0.00 0.00 173.24 172.88 2ca6 s ILE 164 N 1.36 1.46 -0.45 1.44 1.01 -0.00 0.29 121.20 126.31 2ca6 s ILE 164 Ca -0.04 -1.21 0.02 0.00 0.00 0.00 0.00 60.65 59.43 2ca6 s ILE 164 Cb -0.13 -1.76 0.12 0.00 0.01 0.00 0.00 42.46 40.69 2ca6 s ILE 164 CO -0.03 -0.14 0.20 -0.63 0.00 0.00 0.00 174.94 174.34 2ca6 s ILE 165 N 1.42 2.71 -0.32 2.92 1.09 0.04 -1.22 121.20 127.85 2ca6 s ILE 165 Ca -0.05 -2.74 0.00 0.00 -1.10 0.00 0.00 60.65 56.77 2ca6 s ILE 165 Cb -0.19 -2.90 0.10 0.00 -1.06 0.00 0.00 42.46 38.41 2ca6 s ILE 165 CO -0.07 -0.72 0.08 0.00 -0.10 0.00 0.00 174.94 174.13 2ca6 s GLY 167 N 1.43 2.44 -1.48 0.00 0.00 -1.26 -3.90 107.32 104.55 2ca6 s GLY 167 Ca 0.10 -1.54 -0.03 0.00 0.00 0.00 0.00 44.72 43.25 2ca6 s GLY 167 CO -0.20 -1.70 0.16 0.54 0.00 0.00 0.00 173.10 171.90 2ca6 n ARG 168 N -0.78 -1.48 -1.12 2.90 1.74 0.08 -0.28 116.66 117.73 2ca6 n ARG 168 Ca -0.01 0.17 0.03 0.00 -0.77 0.00 0.00 57.85 57.27 2ca6 n ARG 168 Cb 0.64 -3.75 0.03 0.00 -1.02 0.00 0.00 32.46 28.37 2ca6 n ARG 168 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2ca6 n ASN 169 N -2.86 0.82 -3.95 0.55 3.02 -1.26 -3.15 115.26 108.43 2ca6 n ASN 169 Ca -0.31 -2.17 -0.29 0.00 -0.03 0.00 0.00 54.58 51.78 2ca6 n ASN 169 Cb 0.69 -0.29 -0.04 0.00 -0.61 0.00 0.00 39.78 39.53 2ca6 n ASN 169 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2ca6 n ARG 170 N 0.19 -0.71 -0.11 3.52 1.74 -1.26 -0.21 116.66 119.82 2ca6 n ARG 170 Ca 0.06 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.04 2ca6 n ARG 170 Cb 0.98 -2.27 -0.02 0.00 -1.02 0.00 0.00 32.46 30.13 2ca6 n ARG 170 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2ca6 h LEU 171 N -1.23 0.48 -0.21 0.55 3.38 -1.76 -0.78 115.31 115.73 2ca6 h LEU 171 Ca -0.53 -0.16 0.30 0.00 0.09 0.00 0.00 57.88 57.58 2ca6 h LEU 171 Cb 1.08 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 41.63 2ca6 h LEU 171 CO 0.48 0.51 -0.41 -0.62 0.09 0.00 0.00 178.44 178.49 2ca6 n GLU 172 N -4.70 -2.23 -0.27 1.13 1.02 0.12 -3.11 120.64 112.61 2ca6 n GLU 172 Ca -0.01 1.48 -0.00 0.00 -0.02 0.00 0.00 57.16 58.60 2ca6 n GLU 172 Cb 0.14 -2.72 0.20 0.00 -0.02 0.00 0.00 31.44 29.04 2ca6 n GLU 172 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2ca6 h ASN 173 N -1.03 0.96 -0.94 1.62 2.35 -1.86 -3.13 115.58 113.55 2ca6 h ASN 173 Ca 0.02 -0.02 0.26 0.00 -0.55 0.00 0.00 56.30 56.01 2ca6 h ASN 173 Cb 1.26 -0.24 -0.17 0.00 0.05 0.00 0.00 38.32 39.22 2ca6 h ASN 173 CO 0.01 0.70 0.09 1.23 -1.65 0.00 0.00 177.43 177.80 2ca6 h GLY 174 N 1.14 1.28 -3.03 2.83 0.00 -1.93 -0.25 103.07 103.10 2ca6 h GLY 174 Ca 0.31 0.10 -0.18 0.00 0.00 0.00 0.00 47.33 47.56 2ca6 h GLY 174 CO -0.07 -0.48 0.18 -1.14 0.00 0.00 0.00 176.54 175.03 2ca6 n SER 175 N -5.42 4.25 0.13 0.19 3.41 -1.18 -4.53 113.62 110.48 2ca6 n SER 175 Ca 0.23 -3.29 -0.22 0.00 -0.26 0.00 0.00 58.87 55.33 2ca6 n SER 175 Cb 0.74 -0.69 -0.15 0.00 -0.26 0.00 0.00 64.21 63.85 2ca6 n SER 175 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 2ca6 h MET 176 N 2.18 0.46 -0.99 4.33 -1.53 -1.12 -2.62 114.93 115.64 2ca6 h MET 176 Ca 0.22 -0.79 0.08 0.00 -3.44 0.00 0.00 59.70 55.77 2ca6 h MET 176 Cb 2.09 0.29 -0.07 0.00 -0.55 0.00 0.00 31.60 33.36 2ca6 h MET 176 CO 0.60 1.38 0.64 -0.22 0.14 0.00 0.00 176.91 179.45 2ca6 h LYS 177 N 0.13 1.08 0.23 0.39 3.64 -1.80 -1.50 116.57 118.74 2ca6 h LYS 177 Ca -0.23 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.08 2ca6 h LYS 177 Cb 2.12 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 33.69 2ca6 h LYS 177 CO 0.25 0.72 -0.11 1.49 -2.27 0.00 0.00 179.45 179.53 2ca6 h GLU 178 N 1.11 -0.30 -0.68 1.90 4.57 -1.88 -3.19 114.58 116.12 2ca6 h GLU 178 Ca 0.44 0.02 0.20 0.00 -1.18 0.00 0.00 59.36 58.84 2ca6 h GLU 178 Cb 0.24 0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 2ca6 h GLU 178 CO -0.19 0.04 0.53 -1.49 -1.18 0.00 0.00 179.01 176.72 2ca6 h TRP 179 N -0.95 0.00 -0.09 0.92 4.06 -1.37 0.53 115.95 119.05 2ca6 h TRP 179 Ca -0.03 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 60.83 2ca6 h TRP 179 Cb 0.48 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.62 2ca6 h TRP 179 CO 0.06 0.00 -0.36 0.00 -3.56 0.00 0.00 178.44 174.58 2ca6 h ALA 180 N 1.59 1.24 0.00 1.49 0.00 -1.30 -1.52 119.26 120.76 2ca6 h ALA 180 Ca 0.32 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 2ca6 h ALA 180 Cb 1.37 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 2ca6 h ALA 180 CO -0.00 0.53 -0.63 0.87 0.00 0.00 0.00 179.25 180.01 2ca6 h LYS 181 N 0.15 0.00 0.00 0.00 1.57 0.03 -2.99 116.57 115.33 2ca6 h LYS 181 Ca 0.02 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.71 2ca6 h LYS 181 Cb 0.71 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 2ca6 h LYS 181 CO 0.05 0.63 -0.43 1.15 -0.57 0.00 0.00 179.45 180.28 2ca6 h THR 182 N 0.00 1.29 0.00 -0.16 2.02 -0.39 -2.37 112.91 113.30 2ca6 h THR 182 Ca -0.01 -1.50 -0.00 0.00 0.77 0.00 0.00 66.41 65.68 2ca6 h THR 182 Cb 1.39 1.81 -0.00 0.00 -1.74 0.00 0.00 68.15 69.61 2ca6 h THR 182 CO 0.08 0.42 -0.33 -0.26 0.37 0.00 0.00 175.52 175.81 2ca6 h PHE 183 N 0.00 0.00 0.00 3.16 0.04 -1.18 -2.66 116.94 116.30 2ca6 h PHE 183 Ca -0.00 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.64 2ca6 h PHE 183 Cb 0.78 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.91 2ca6 h PHE 183 CO 0.00 0.00 -0.60 1.96 -0.60 0.00 0.00 178.31 179.07 2ca6 h GLN 184 N 0.00 0.00 -0.12 1.51 4.20 -1.35 -3.22 115.11 116.13 2ca6 h GLN 184 Ca -0.00 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.48 2ca6 h GLN 184 Cb 1.00 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.79 2ca6 h GLN 184 CO 0.00 0.60 -0.83 0.77 -0.67 0.00 0.00 178.83 178.70 2ca6 h SER 185 N 0.00 0.90 -3.61 1.46 0.02 -1.35 -3.38 113.55 107.59 2ca6 h SER 185 Ca -0.01 -0.62 -0.68 0.00 -0.84 0.00 0.00 61.79 59.65 2ca6 h SER 185 Cb 1.45 -0.27 -0.37 0.00 0.14 0.00 0.00 62.40 63.35 2ca6 h SER 185 CO 0.08 1.42 -0.33 -1.00 -1.14 0.00 0.00 176.83 175.85 2ca6 s HIS 186 N -3.66 3.62 -1.83 3.45 3.76 -1.01 -4.89 115.29 114.73 2ca6 s HIS 186 Ca -0.10 -3.04 0.28 0.00 -0.15 0.00 0.00 55.06 52.06 2ca6 s HIS 186 Cb 0.08 -3.07 1.10 0.00 1.11 0.00 0.00 32.58 31.81 2ca6 s HIS 186 CO 0.90 -0.72 1.78 0.54 -0.85 0.00 0.00 174.74 176.39 2ca6 n ARG 187 N 2.62 0.90 -0.63 1.40 1.74 -1.25 -3.89 116.66 117.55 2ca6 n ARG 187 Ca 0.16 -0.41 0.09 0.00 -0.77 0.00 0.00 57.85 56.92 2ca6 n ARG 187 Cb 0.36 -1.49 0.35 0.00 -1.02 0.00 0.00 32.46 30.66 2ca6 n ARG 187 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2ca6 n LEU 188 N -0.70 4.78 -4.76 0.55 4.77 -1.26 -3.71 117.00 116.67 2ca6 n LEU 188 Ca 0.15 -2.60 -0.34 0.00 -0.03 0.00 0.00 56.01 53.19 2ca6 n LEU 188 Cb 0.30 -0.58 0.05 0.00 -2.33 0.00 0.00 43.42 40.86 2ca6 n LEU 188 CO 0.23 0.75 0.77 -0.76 -1.33 0.00 0.00 177.39 177.05 2ca6 s LEU 189 N -2.12 3.45 -0.08 2.23 1.43 -1.24 -4.70 118.68 117.66 2ca6 s LEU 189 Ca 0.49 2.15 0.01 0.00 -1.03 0.00 0.00 54.13 55.75 2ca6 s LEU 189 Cb 0.34 -4.57 -0.05 0.00 0.03 0.00 0.00 46.19 41.94 2ca6 s LEU 189 CO 0.20 -1.71 -0.07 1.41 0.23 0.00 0.00 176.35 176.41 2ca6 n HIS 190 N -2.23 0.00 -4.96 0.29 8.25 0.37 -2.58 115.22 114.37 2ca6 n HIS 190 Ca 0.12 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.29 2ca6 n HIS 190 Cb 0.51 -0.31 -0.17 0.00 1.12 0.00 0.00 29.99 31.14 2ca6 n HIS 190 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2ca6 s THR 191 N -2.16 1.66 -0.06 1.59 2.01 -0.59 0.18 115.64 118.27 2ca6 s THR 191 Ca -0.11 -0.80 -0.02 0.00 0.31 0.00 0.00 61.69 61.07 2ca6 s THR 191 Cb 0.03 -1.45 0.03 0.00 0.01 0.00 0.00 72.50 71.12 2ca6 s THR 191 CO 0.19 0.47 0.06 -0.69 -0.69 0.00 0.00 174.62 173.96 2ca6 s VAL 192 N 0.39 -0.09 -0.13 3.82 1.01 -0.49 -0.82 120.40 124.09 2ca6 s VAL 192 Ca -0.15 0.32 -0.01 0.00 0.00 0.00 0.00 61.98 62.14 2ca6 s VAL 192 Cb -0.16 -0.24 0.03 0.00 0.00 0.00 0.00 36.38 36.01 2ca6 s VAL 192 CO 0.06 0.11 -0.05 -0.54 0.00 0.00 0.00 175.10 174.67 2ca6 s LYS 193 N 2.16 1.34 -0.37 2.72 1.02 -0.36 -1.65 119.74 124.60 2ca6 s LYS 193 Ca 0.04 -0.28 0.13 0.00 0.02 0.00 0.00 55.97 55.88 2ca6 s LYS 193 Cb -0.13 -1.64 0.42 0.00 -0.52 0.00 0.00 37.83 35.96 2ca6 s LYS 193 CO -0.04 -0.33 0.94 -1.33 -0.92 0.00 0.00 175.35 173.66 2ca6 n MET 194 N 4.96 1.71 -2.41 1.68 2.81 -0.73 -0.67 117.12 124.47 2ca6 n MET 194 Ca -0.11 -3.64 -0.35 0.00 -1.81 0.00 0.00 57.70 51.78 2ca6 n MET 194 Cb 0.49 -1.61 -0.02 0.00 -0.71 0.00 0.00 33.22 31.38 2ca6 n MET 194 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2ca6 s VAL 195 N -3.56 3.48 -1.39 2.03 -7.23 -1.25 -4.07 120.40 108.42 2ca6 s VAL 195 Ca 0.35 0.94 -0.04 0.00 -1.81 0.00 0.00 61.98 61.42 2ca6 s VAL 195 Cb 0.41 -3.38 0.02 0.00 0.56 0.00 0.00 36.38 33.99 2ca6 s VAL 195 CO -0.04 -0.18 0.73 0.00 -0.31 0.00 0.00 175.10 175.29 2ca6 n GLN 196 N -1.06 -4.78 -0.74 4.82 6.02 0.15 -0.74 117.38 121.05 2ca6 n GLN 196 Ca 0.10 0.58 -0.00 0.00 -0.01 0.00 0.00 57.00 57.66 2ca6 n GLN 196 Cb 0.52 -5.15 0.25 0.00 1.02 0.00 0.00 30.24 26.87 2ca6 n GLN 196 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2ca6 n ASN 197 N -2.98 3.71 -1.70 1.08 3.02 -1.26 -3.19 115.26 113.94 2ca6 n ASN 197 Ca -0.21 -3.32 -0.14 0.00 -0.03 0.00 0.00 54.58 50.87 2ca6 n ASN 197 Cb 0.64 -0.64 -0.04 0.00 -0.61 0.00 0.00 39.78 39.13 2ca6 n ASN 197 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ca6 n GLY 198 N -0.63 0.80 3.75 7.41 0.00 -1.26 0.15 105.19 115.41 2ca6 n GLY 198 Ca 0.32 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.93 2ca6 n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ca6 s ILE 199 N -2.33 3.54 0.48 -0.61 1.01 -1.26 -4.44 121.20 117.59 2ca6 s ILE 199 Ca 0.00 1.48 0.07 0.00 0.00 0.00 0.00 60.65 62.21 2ca6 s ILE 199 Cb 0.00 -3.94 0.01 0.00 0.01 0.00 0.00 42.46 38.54 2ca6 s ILE 199 CO 0.00 0.32 0.46 -0.13 0.00 0.00 0.00 174.94 175.60 2ca6 s ARG 200 N -1.13 2.43 0.28 2.79 0.52 -1.26 -0.77 118.95 121.81 2ca6 s ARG 200 Ca 0.46 -1.68 0.04 0.00 -0.52 0.00 0.00 55.73 54.03 2ca6 s ARG 200 Cb -0.32 -2.36 0.73 0.00 0.52 0.00 0.00 34.95 33.52 2ca6 s ARG 200 CO 0.40 -0.43 1.38 -2.30 0.02 0.00 0.00 175.30 174.37 2ca6 n PRO 201 N -1.74 -0.07 0.03 3.54 -0.02 0.11 -1.21 135.00 135.64 2ca6 n PRO 201 Ca 0.04 1.31 -0.12 0.00 -2.02 0.00 0.00 63.50 62.71 2ca6 n PRO 201 Cb 0.62 -2.11 -0.00 0.00 -0.02 0.00 0.00 33.50 31.99 2ca6 n PRO 201 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2ca6 h GLU 202 N 0.00 0.53 -0.36 -0.52 5.08 -1.89 -2.15 114.58 115.27 2ca6 h GLU 202 Ca 0.56 -0.43 -0.12 0.00 -1.00 0.00 0.00 59.36 58.36 2ca6 h GLU 202 Cb 1.20 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 2ca6 h GLU 202 CO -0.81 1.06 -0.25 0.78 -1.00 0.00 0.00 179.01 178.78 2ca6 h GLY 203 N 1.05 0.87 0.78 -3.84 0.00 -1.50 -2.54 103.07 97.89 2ca6 h GLY 203 Ca -0.04 -0.84 -0.02 0.00 0.00 0.00 0.00 47.33 46.43 2ca6 h GLY 203 CO 0.14 0.76 -0.42 -2.22 0.00 0.00 0.00 176.54 174.79 2ca6 h ILE 204 N 0.59 0.15 -0.84 2.60 1.08 -1.25 0.13 117.51 119.96 2ca6 h ILE 204 Ca 0.07 0.00 0.19 0.00 -0.39 0.00 0.00 64.86 64.73 2ca6 h ILE 204 Cb 0.82 0.15 -0.11 0.00 -3.07 0.00 0.00 36.82 34.60 2ca6 h ILE 204 CO 0.07 0.00 0.34 -0.08 -0.69 0.00 0.00 178.15 177.79 2ca6 h GLU 205 N -1.01 0.40 -0.05 2.37 4.81 -1.42 0.19 114.58 119.86 2ca6 h GLU 205 Ca -0.08 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.10 2ca6 h GLU 205 Cb 0.83 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.12 2ca6 h GLU 205 CO 0.06 0.26 -0.06 1.25 -0.73 0.00 0.00 179.01 179.80 2ca6 h HIS 206 N 0.41 0.16 -0.78 0.92 2.76 -1.26 -0.73 115.15 116.63 2ca6 h HIS 206 Ca 0.50 -0.05 0.11 0.00 -2.20 0.00 0.00 60.37 58.73 2ca6 h HIS 206 Cb 0.88 -0.03 -0.08 0.00 1.55 0.00 0.00 27.41 29.73 2ca6 h HIS 206 CO -0.16 0.59 0.41 1.25 -1.30 0.00 0.00 177.93 178.72 2ca6 h LEU 207 N -0.32 0.53 0.35 0.26 5.85 0.14 0.31 115.31 122.43 2ca6 h LEU 207 Ca 0.01 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 2ca6 h LEU 207 Cb 0.57 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.58 2ca6 h LEU 207 CO 0.01 0.28 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.16 2ca6 h LEU 208 N 0.66 -0.40 -0.79 2.25 3.38 -0.65 -0.73 115.31 119.03 2ca6 h LEU 208 Ca 0.40 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.35 2ca6 h LEU 208 Cb 0.45 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 2ca6 h LEU 208 CO -0.29 -0.11 0.39 -0.07 0.09 0.00 0.00 178.44 178.45 2ca6 h LEU 209 N -0.82 1.02 0.00 1.67 3.38 -1.04 -1.01 115.31 118.52 2ca6 h LEU 209 Ca -0.05 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2ca6 h LEU 209 Cb 0.36 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2ca6 h LEU 209 CO 0.08 0.86 -1.57 -0.62 0.09 0.00 0.00 178.44 177.28 2ca6 n GLU 210 N -4.38 0.61 0.00 1.13 -0.58 0.11 -4.64 120.64 112.89 2ca6 n GLU 210 Ca 0.07 -0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2ca6 n GLU 210 Cb 0.13 -1.64 0.00 0.00 -0.57 0.00 0.00 31.44 29.36 2ca6 n GLU 210 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ca6 n GLY 211 N 1.24 0.02 0.41 0.62 0.00 -0.80 -4.76 105.19 101.92 2ca6 n GLY 211 Ca -0.02 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.21 2ca6 n GLY 211 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ca6 h LEU 212 N 0.00 0.26 -1.74 0.99 -0.00 -1.15 -1.51 115.31 112.17 2ca6 h LEU 212 Ca 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 57.88 57.91 2ca6 h LEU 212 Cb 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 40.66 40.64 2ca6 h LEU 212 CO 0.00 0.11 0.20 0.00 -0.00 0.00 0.00 178.44 178.75 2ca6 h ALA 213 N 1.61 1.18 -0.00 1.53 0.00 -1.42 0.24 119.26 122.40 2ca6 h ALA 213 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 2ca6 h ALA 213 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2ca6 h ALA 213 CO -0.11 -0.18 -0.45 0.66 0.00 0.00 0.00 179.25 179.17 2ca6 n TYR 214 N -2.56 0.00 -3.12 0.00 4.01 -0.57 -4.62 117.16 110.29 2ca6 n TYR 214 Ca -0.02 0.00 -0.45 0.00 -0.16 0.00 0.00 57.90 57.27 2ca6 n TYR 214 Cb 0.24 -0.22 -0.01 0.00 -0.31 0.00 0.00 39.34 39.04 2ca6 n TYR 214 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2ca6 h GLN 216 N 7.78 0.00 -0.01 0.00 4.20 -1.73 -2.98 115.11 122.37 2ca6 h GLN 216 Ca 0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2ca6 h GLN 216 Cb 0.97 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.75 2ca6 h GLN 216 CO 1.02 0.00 -0.32 0.39 -0.67 0.00 0.00 178.83 179.25 2ca6 n GLU 217 N -2.34 0.81 -1.58 1.46 -0.58 -1.26 -4.49 120.64 112.65 2ca6 n GLU 217 Ca 0.03 -0.51 -0.54 0.00 -0.42 0.00 0.00 57.16 55.73 2ca6 n GLU 217 Cb 0.33 -1.49 -0.06 0.00 -0.57 0.00 0.00 31.44 29.65 2ca6 n GLU 217 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 2ca6 n LEU 218 N -0.65 1.31 -0.00 -4.62 7.94 -1.06 -4.57 117.00 115.34 2ca6 n LEU 218 Ca 0.11 1.13 -0.00 0.00 -1.11 0.00 0.00 56.01 56.14 2ca6 n LEU 218 Cb 0.36 -1.13 -0.00 0.00 0.53 0.00 0.00 43.42 43.18 2ca6 n LEU 218 CO 0.27 -1.21 -0.51 0.29 -1.11 0.00 0.00 177.39 175.12 2ca6 n LYS 219 N 2.40 1.48 -4.15 1.96 5.02 0.13 -3.03 118.16 121.97 2ca6 n LYS 219 Ca 0.19 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.18 2ca6 n LYS 219 Cb 0.16 -1.00 -0.17 0.00 -0.02 0.00 0.00 35.03 34.00 2ca6 n LYS 219 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2ca6 s VAL 220 N -2.00 1.55 -0.12 -0.18 1.01 -0.05 0.91 120.40 121.53 2ca6 s VAL 220 Ca -0.00 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.33 2ca6 s VAL 220 Cb 0.00 -1.45 0.03 0.00 0.00 0.00 0.00 36.38 34.96 2ca6 s VAL 220 CO 0.00 0.45 -0.06 -0.22 0.00 0.00 0.00 175.10 175.28 2ca6 s LEU 221 N 1.34 1.14 -0.18 3.92 2.96 -0.56 -1.40 118.68 125.90 2ca6 s LEU 221 Ca 0.02 -0.33 -0.00 0.00 -0.22 0.00 0.00 54.13 53.59 2ca6 s LEU 221 Cb -0.13 -0.78 0.05 0.00 0.50 0.00 0.00 46.19 45.83 2ca6 s LEU 221 CO -0.08 -0.15 -0.06 -0.62 -1.32 0.00 0.00 176.35 174.13 2ca6 s ASP 222 N 1.75 3.10 -0.30 3.68 -1.08 -0.66 0.12 116.67 123.28 2ca6 s ASP 222 Ca 0.04 -0.79 0.08 0.00 -0.52 0.00 0.00 52.55 51.35 2ca6 s ASP 222 Cb -0.13 -1.00 0.46 0.00 -1.46 0.00 0.00 42.92 40.79 2ca6 s ASP 222 CO -0.08 -0.19 1.31 0.18 0.52 0.00 0.00 175.17 176.91 2ca6 n LEU 223 N 4.81 4.41 -4.67 -1.34 4.77 0.27 -1.78 117.00 123.48 2ca6 n LEU 223 Ca -0.12 -4.33 -0.53 0.00 -0.03 0.00 0.00 56.01 51.00 2ca6 n LEU 223 Cb 0.47 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 41.01 2ca6 n LEU 223 CO 0.17 1.73 1.26 1.67 -1.33 0.00 0.00 177.39 180.89 2ca6 n GLN 224 N -0.91 1.53 -2.72 3.23 0.00 -1.21 -3.33 117.38 113.98 2ca6 n GLN 224 Ca 0.37 0.56 -0.10 0.00 -0.00 0.00 0.00 57.00 57.83 2ca6 n GLN 224 Cb 0.88 -2.28 0.05 0.00 0.00 0.00 0.00 30.24 28.89 2ca6 n GLN 224 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2ca6 n ASP 225 N 4.81 -3.94 -3.98 1.69 2.03 0.19 0.32 116.55 117.67 2ca6 n ASP 225 Ca 0.23 -0.43 -0.11 0.00 0.52 0.00 0.00 54.79 54.99 2ca6 n ASP 225 Cb 0.20 -3.49 -0.12 0.00 -0.72 0.00 0.00 41.12 36.99 2ca6 n ASP 225 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2ca6 s ASN 226 N -3.47 0.39 -0.50 1.67 0.01 -1.21 -3.29 114.94 108.54 2ca6 s ASN 226 Ca 0.19 -0.39 -0.23 0.00 -0.71 0.00 0.00 52.86 51.73 2ca6 s ASN 226 Cb -0.02 0.05 0.04 0.00 0.41 0.00 0.00 41.25 41.72 2ca6 s ASN 226 CO 0.47 -0.19 0.82 -0.89 -1.51 0.00 0.00 177.10 175.80 2ca6 s THR 227 N -1.06 4.58 -0.12 1.60 2.01 0.05 -4.17 115.64 118.53 2ca6 s THR 227 Ca -0.10 0.23 -0.06 0.00 0.31 0.00 0.00 61.69 62.06 2ca6 s THR 227 Cb -0.07 -4.41 -0.05 0.00 0.01 0.00 0.00 72.50 67.98 2ca6 s THR 227 CO -0.00 -0.89 0.05 -0.26 -0.69 0.00 0.00 174.62 172.83 2ca6 h PHE 228 N 9.12 0.00 -2.68 4.92 -1.00 -0.90 0.31 116.94 126.71 2ca6 h PHE 228 Ca -0.26 0.00 0.33 0.00 2.81 0.00 0.00 57.97 60.85 2ca6 h PHE 228 Cb 1.08 0.00 -0.08 0.00 3.61 0.00 0.00 35.95 40.56 2ca6 h PHE 228 CO 0.84 0.18 -0.44 0.25 -1.61 0.00 0.00 178.31 177.52 2ca6 n THR 229 N -4.71 0.00 0.32 -1.55 -2.24 -0.14 0.06 114.28 106.02 2ca6 n THR 229 Ca -0.04 0.01 0.20 0.00 -2.27 0.00 0.00 64.05 61.95 2ca6 n THR 229 Cb 0.15 -0.42 1.06 0.00 -2.10 0.00 0.00 70.33 69.02 2ca6 n THR 229 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 2ca6 h HIS 230 N -1.11 0.00 -0.38 4.78 2.76 -1.76 -1.38 115.15 118.06 2ca6 h HIS 230 Ca 0.02 0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.09 2ca6 h HIS 230 Cb 1.10 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.05 2ca6 h HIS 230 CO -2.79 0.01 -0.15 1.25 -1.30 0.00 0.00 177.93 174.95 2ca6 h LEU 231 N 0.00 0.78 -0.24 0.26 5.85 -1.87 -0.38 115.31 119.70 2ca6 h LEU 231 Ca -0.00 -0.39 -0.21 0.00 0.84 0.00 0.00 57.88 58.12 2ca6 h LEU 231 Cb 0.07 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.89 2ca6 h LEU 231 CO 0.00 1.00 -0.77 1.23 -0.34 0.00 0.00 178.44 179.56 2ca6 h GLY 232 N 0.56 0.71 0.99 3.75 0.00 0.56 -3.03 103.07 106.62 2ca6 h GLY 232 Ca 0.09 -1.02 0.01 0.00 0.00 0.00 0.00 47.33 46.41 2ca6 h GLY 232 CO 0.05 0.91 0.45 1.76 0.00 0.00 0.00 176.54 179.70 2ca6 h SER 233 N 0.44 0.77 -0.63 0.19 0.02 -1.18 -0.83 113.55 112.32 2ca6 h SER 233 Ca -0.05 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.85 2ca6 h SER 233 Cb 1.38 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 63.70 2ca6 h SER 233 CO 0.15 0.55 0.28 0.28 -1.14 0.00 0.00 176.83 176.95 2ca6 h SER 234 N 0.91 0.87 -0.20 3.07 0.02 -1.07 0.37 113.55 117.53 2ca6 h SER 234 Ca 0.25 -0.11 -0.08 0.00 -0.84 0.00 0.00 61.79 61.01 2ca6 h SER 234 Cb -0.09 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.22 2ca6 h SER 234 CO -0.06 0.77 -0.19 0.00 -1.14 0.00 0.00 176.83 176.20 2ca6 h ALA 235 N 1.36 0.29 -0.40 3.77 0.00 -1.34 -2.81 119.26 120.13 2ca6 h ALA 235 Ca 0.23 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2ca6 h ALA 235 Cb 0.15 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2ca6 h ALA 235 CO -0.02 0.22 0.25 1.25 0.00 0.00 0.00 179.25 180.95 2ca6 h LEU 236 N 0.16 0.47 -1.08 0.00 5.85 -0.78 -1.03 115.31 118.90 2ca6 h LEU 236 Ca 0.03 -0.04 0.16 0.00 0.84 0.00 0.00 57.88 58.87 2ca6 h LEU 236 Cb 0.74 -0.12 -0.09 0.00 0.37 0.00 0.00 40.66 41.56 2ca6 h LEU 236 CO 0.05 0.37 0.62 0.00 -0.34 0.00 0.00 178.44 179.13 2ca6 h ALA 237 N 1.12 1.67 -0.20 1.25 0.00 -0.23 -0.89 119.26 121.99 2ca6 h ALA 237 Ca 0.14 0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 2ca6 h ALA 237 Cb -0.03 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.63 2ca6 h ALA 237 CO -0.03 0.03 -0.60 0.82 0.00 0.00 0.00 179.25 179.47 2ca6 h ILE 238 N 0.83 1.30 0.00 0.00 2.04 -1.13 -3.32 117.51 117.22 2ca6 h ILE 238 Ca 0.52 -1.82 0.00 0.00 1.00 0.00 0.00 64.86 64.57 2ca6 h ILE 238 Cb 0.73 1.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.69 2ca6 h ILE 238 CO -0.30 0.58 0.00 0.00 0.00 0.00 0.00 178.15 178.43 2ca6 h ALA 239 N 0.59 1.00 -0.99 1.87 0.00 -0.27 -3.34 119.26 118.12 2ca6 h ALA 239 Ca -0.02 0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.03 2ca6 h ALA 239 Cb 1.22 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.92 2ca6 h ALA 239 CO 0.13 0.00 0.61 -0.07 0.00 0.00 0.00 179.25 179.92 2ca6 h LEU 240 N 0.00 0.87 -0.97 0.00 3.38 -1.30 -1.46 115.31 115.83 2ca6 h LEU 240 Ca 0.00 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2ca6 h LEU 240 Cb 0.80 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2ca6 h LEU 240 CO 0.00 0.42 0.00 2.29 0.09 0.00 0.00 178.44 181.24 2ca6 n LYS 241 N -4.67 0.12 0.00 1.13 2.85 -1.25 -1.92 118.16 114.41 2ca6 n LYS 241 Ca 0.20 0.55 0.14 0.00 -1.05 0.00 0.00 58.31 58.15 2ca6 n LYS 241 Cb 0.41 -1.84 0.48 0.00 -0.65 0.00 0.00 35.03 33.43 2ca6 n LYS 241 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 2ca6 n SER 242 N -2.08 0.99 -3.06 -5.58 7.64 -0.55 -4.40 113.62 106.57 2ca6 n SER 242 Ca -0.00 -0.97 -0.27 0.00 1.01 0.00 0.00 58.87 58.64 2ca6 n SER 242 Cb 0.07 0.06 -0.05 0.00 -1.01 0.00 0.00 64.21 63.28 2ca6 n SER 242 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 2ca6 n TRP 243 N -0.53 3.82 -0.09 1.43 8.01 -0.81 -4.21 117.44 125.05 2ca6 n TRP 243 Ca 0.15 -4.03 0.22 0.00 -1.31 0.00 0.00 57.50 52.53 2ca6 n TRP 243 Cb 0.33 -0.50 0.67 0.00 -2.01 0.00 0.00 31.31 29.79 2ca6 n TRP 243 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2ca6 h PRO 244 N 3.27 0.07 -0.60 -0.99 0.13 -1.79 0.45 132.00 132.55 2ca6 h PRO 244 Ca 0.15 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2ca6 h PRO 244 Cb 0.56 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.67 2ca6 h PRO 244 CO 0.81 0.05 0.00 0.09 -0.23 0.00 0.00 178.00 178.72 2ca6 n ASN 245 N -4.36 3.45 -4.76 1.44 5.03 -1.26 -4.50 115.26 110.31 2ca6 n ASN 245 Ca 0.14 -2.22 -0.41 0.00 0.87 0.00 0.00 54.58 52.95 2ca6 n ASN 245 Cb 0.72 -0.46 -0.01 0.00 -1.02 0.00 0.00 39.78 39.01 2ca6 n ASN 245 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 2ca6 s LEU 246 N -1.34 4.35 0.00 3.41 2.96 0.15 -4.36 118.68 123.85 2ca6 s LEU 246 Ca 0.38 2.89 0.00 0.00 -0.22 0.00 0.00 54.13 57.18 2ca6 s LEU 246 Cb 0.23 -3.64 0.00 0.00 0.50 0.00 0.00 46.19 43.28 2ca6 s LEU 246 CO 0.21 -0.84 0.00 0.54 -1.32 0.00 0.00 176.35 174.93 2ca6 n ARG 247 N 1.85 1.12 -4.66 1.98 1.74 0.26 -3.35 116.66 115.60 2ca6 n ARG 247 Ca 0.06 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.89 2ca6 n ARG 247 Cb 0.39 -0.98 -0.17 0.00 -1.02 0.00 0.00 32.46 30.67 2ca6 n ARG 247 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2ca6 s GLU 248 N -1.97 1.84 -0.21 5.56 2.12 -0.38 0.49 118.70 126.15 2ca6 s GLU 248 Ca 0.00 -0.46 0.01 0.00 0.36 0.00 0.00 54.97 54.88 2ca6 s GLU 248 Cb 0.00 -1.50 0.05 0.00 0.26 0.00 0.00 34.13 32.94 2ca6 s GLU 248 CO 0.00 0.05 -0.09 -1.17 -0.54 0.00 0.00 175.26 173.51 2ca6 s LEU 249 N 0.62 2.41 -0.42 2.70 2.96 0.73 -1.50 118.68 126.18 2ca6 s LEU 249 Ca -0.15 -0.98 -0.11 0.00 -0.22 0.00 0.00 54.13 52.67 2ca6 s LEU 249 Cb -0.16 -1.24 0.07 0.00 0.50 0.00 0.00 46.19 45.36 2ca6 s LEU 249 CO 0.04 -0.17 0.29 -0.83 -1.32 0.00 0.00 176.35 174.36 2ca6 s GLY 250 N 1.38 1.98 -0.17 7.98 0.00 0.12 -1.37 107.32 117.24 2ca6 s GLY 250 Ca -0.03 -2.05 0.15 0.00 0.00 0.00 0.00 44.72 42.80 2ca6 s GLY 250 CO -0.08 0.97 1.19 1.04 0.00 0.00 0.00 173.10 176.23 2ca6 n LEU 251 N 5.01 2.49 -4.72 0.66 4.77 -0.16 -0.57 117.00 124.49 2ca6 n LEU 251 Ca -0.11 -3.45 -0.42 0.00 -0.03 0.00 0.00 56.01 52.00 2ca6 n LEU 251 Cb 0.44 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 2ca6 n LEU 251 CO 0.41 1.24 1.02 0.20 -1.33 0.00 0.00 177.39 178.93 2ca6 s ASN 252 N -3.00 6.88 -1.24 -1.43 0.01 -1.14 -3.18 114.94 111.84 2ca6 s ASN 252 Ca 0.38 2.29 -0.05 0.00 -0.71 0.00 0.00 52.86 54.77 2ca6 s ASN 252 Cb 0.38 -2.59 0.01 0.00 0.41 0.00 0.00 41.25 39.45 2ca6 s ASN 252 CO -0.08 -0.60 1.06 0.47 -1.51 0.00 0.00 177.10 176.44 2ca6 n ASP 253 N 3.72 -4.51 -0.54 -1.22 8.00 0.32 -0.64 116.55 121.67 2ca6 n ASP 253 Ca 0.10 -0.55 0.07 0.00 0.71 0.00 0.00 54.79 55.12 2ca6 n ASP 253 Cb 0.43 -4.88 0.06 0.00 -0.02 0.00 0.00 41.12 36.72 2ca6 n ASP 253 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ca6 n LEU 255 N 0.74 -1.84 -0.35 0.00 4.77 -1.25 -0.39 117.00 118.67 2ca6 n LEU 255 Ca 0.08 -1.10 0.02 0.00 -0.03 0.00 0.00 56.01 54.98 2ca6 n LEU 255 Cb 0.34 -2.06 0.16 0.00 -2.33 0.00 0.00 43.42 39.53 2ca6 n LEU 255 CO 0.08 0.50 1.24 -0.07 -1.33 0.00 0.00 177.39 177.81 2ca6 h LEU 256 N -1.95 0.97 0.00 2.23 3.38 -1.84 -0.36 115.31 117.74 2ca6 h LEU 256 Ca -0.65 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.33 2ca6 h LEU 256 Cb 1.38 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2ca6 h LEU 256 CO 0.60 0.61 0.00 -1.54 0.09 0.00 0.00 178.44 178.20 2ca6 n SER 257 N -4.55 0.00 0.17 -0.43 3.41 -0.79 -2.67 113.62 108.77 2ca6 n SER 257 Ca 0.14 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.82 2ca6 n SER 257 Cb 0.18 0.12 0.55 0.00 -0.26 0.00 0.00 64.21 64.80 2ca6 n SER 257 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ca6 h ALA 258 N 0.00 1.86 0.15 7.33 0.00 -1.50 0.60 119.26 127.70 2ca6 h ALA 258 Ca 0.00 -0.03 -0.29 0.00 0.00 0.00 0.00 54.91 54.59 2ca6 h ALA 258 Cb 0.00 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.74 2ca6 h ALA 258 CO 0.00 0.12 -1.28 0.00 0.00 0.00 0.00 179.25 178.09 2ca6 h ARG 259 N 0.19 0.35 0.25 0.00 -0.00 -1.86 -2.42 114.38 110.89 2ca6 h ARG 259 Ca 0.05 -0.58 -0.01 0.00 -0.50 0.00 0.00 59.98 58.94 2ca6 h ARG 259 Cb 0.02 0.21 0.00 0.00 0.00 0.00 0.00 29.97 30.21 2ca6 h ARG 259 CO -0.01 1.27 -0.12 0.78 0.00 0.00 0.00 179.97 181.89 2ca6 h GLY 260 N 1.20 -0.34 0.36 0.04 0.00 -1.23 -2.51 103.07 100.59 2ca6 h GLY 260 Ca -0.16 0.13 0.12 0.00 0.00 0.00 0.00 47.33 47.42 2ca6 h GLY 260 CO 0.22 -0.13 0.45 0.00 0.00 0.00 0.00 176.54 177.09 2ca6 h ALA 261 N -0.18 1.23 -0.71 3.60 0.00 0.04 -0.53 119.26 122.70 2ca6 h ALA 261 Ca -0.03 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2ca6 h ALA 261 Cb 0.50 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 2ca6 h ALA 261 CO 0.06 -0.01 0.45 0.00 0.00 0.00 0.00 179.25 179.75 2ca6 h ALA 262 N 1.51 1.45 -0.07 0.00 0.00 -1.41 0.40 119.26 121.14 2ca6 h ALA 262 Ca 0.43 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 55.11 2ca6 h ALA 262 Cb 0.52 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.04 2ca6 h ALA 262 CO -0.31 0.49 -0.63 0.00 0.00 0.00 0.00 179.25 178.80 2ca6 h ALA 263 N 1.52 0.17 -0.77 0.00 0.00 -0.70 -2.12 119.26 117.36 2ca6 h ALA 263 Ca 0.26 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2ca6 h ALA 263 Cb -0.08 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2ca6 h ALA 263 CO -0.05 0.45 0.50 0.28 0.00 0.00 0.00 179.25 180.42 2ca6 h VAL 264 N 0.14 1.20 -0.25 0.00 2.07 -0.83 0.11 116.25 118.69 2ca6 h VAL 264 Ca -0.06 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 2ca6 h VAL 264 Cb 1.29 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2ca6 h VAL 264 CO 0.13 0.20 0.11 0.58 0.02 0.00 0.00 177.57 178.61 2ca6 h VAL 265 N 1.05 1.16 -0.89 2.57 2.07 -0.95 -2.50 116.25 118.76 2ca6 h VAL 265 Ca 0.28 -0.48 0.12 0.00 0.82 0.00 0.00 66.70 67.44 2ca6 h VAL 265 Cb -0.10 1.01 -0.08 0.00 -1.52 0.00 0.00 31.29 30.60 2ca6 h VAL 265 CO -0.06 0.16 0.51 -0.78 0.02 0.00 0.00 177.57 177.43 2ca6 h ASP 266 N 0.26 0.71 0.31 0.57 3.58 -0.65 0.56 116.42 121.76 2ca6 h ASP 266 Ca 0.08 0.06 -0.05 0.00 0.42 0.00 0.00 57.03 57.54 2ca6 h ASP 266 Cb 0.16 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.13 2ca6 h ASP 266 CO -0.01 0.36 -0.26 0.00 -2.88 0.00 0.00 179.24 176.46 2ca6 h ALA 267 N 1.52 1.48 -0.11 -0.78 0.00 -0.50 -2.16 119.26 118.71 2ca6 h ALA 267 Ca 0.45 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.97 2ca6 h ALA 267 Cb 0.51 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2ca6 h ALA 267 CO -0.29 0.32 -0.63 0.74 0.00 0.00 0.00 179.25 179.39 2ca6 h PHE 268 N 0.00 0.51 0.00 0.00 0.04 -0.48 -3.03 116.94 113.98 2ca6 h PHE 268 Ca -0.00 -0.20 0.00 0.00 2.80 0.00 0.00 57.97 60.57 2ca6 h PHE 268 Cb 0.48 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.54 2ca6 h PHE 268 CO 0.00 0.92 0.00 -1.13 -0.60 0.00 0.00 178.31 177.50 2ca6 n SER 269 N -3.89 0.00 0.00 2.17 3.41 -0.79 -2.12 113.62 112.40 2ca6 n SER 269 Ca -0.03 -1.31 0.00 0.00 -0.26 0.00 0.00 58.87 57.27 2ca6 n SER 269 Cb 0.64 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.59 2ca6 n SER 269 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2ca6 n LYS 270 N -0.56 0.25 -3.82 4.33 5.02 -1.15 -5.03 118.16 117.20 2ca6 n LYS 270 Ca 0.02 -0.64 -0.26 0.00 -2.02 0.00 0.00 58.31 55.41 2ca6 n LYS 270 Cb 0.01 -0.85 -0.03 0.00 -0.02 0.00 0.00 35.03 34.14 2ca6 n LYS 270 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2ca6 s LEU 271 N -0.24 4.28 0.36 -0.35 1.43 -0.90 -5.11 118.68 118.15 2ca6 s LEU 271 Ca 0.00 0.27 0.08 0.00 -1.03 0.00 0.00 54.13 53.45 2ca6 s LEU 271 Cb 0.00 -3.03 -0.07 0.00 0.03 0.00 0.00 46.19 43.12 2ca6 s LEU 271 CO 0.00 -0.01 -0.06 -1.61 0.23 0.00 0.00 176.35 174.90 2ca6 s GLU 272 N -3.36 1.83 -1.60 1.70 2.02 -1.26 -4.72 118.70 113.30 2ca6 s GLU 272 Ca 0.36 -1.97 -0.10 0.00 0.02 0.00 0.00 54.97 53.28 2ca6 s GLU 272 Cb -0.11 -1.62 0.09 0.00 0.10 0.00 0.00 34.13 32.59 2ca6 s GLU 272 CO 0.29 0.08 0.51 0.09 0.02 0.00 0.00 175.26 176.24 2ca6 n ASN 273 N -0.82 -1.42 -4.63 -0.19 3.02 -1.26 -4.82 115.26 105.14 2ca6 n ASN 273 Ca -0.05 -1.08 -0.43 0.00 -0.03 0.00 0.00 54.58 52.99 2ca6 n ASN 273 Cb 0.64 -2.52 -0.03 0.00 -0.61 0.00 0.00 39.78 37.27 2ca6 n ASN 273 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2ca6 s ILE 274 N -3.70 3.58 -0.30 2.41 1.01 -1.26 -4.88 121.20 118.07 2ca6 s ILE 274 Ca 0.38 0.66 0.11 0.00 0.00 0.00 0.00 60.65 61.80 2ca6 s ILE 274 Cb -0.21 -3.59 0.68 0.00 0.01 0.00 0.00 42.46 39.35 2ca6 s ILE 274 CO 0.94 -0.24 1.70 0.61 0.00 0.00 0.00 174.94 177.94 2ca6 n GLY 275 N 4.73 3.91 3.75 6.18 0.00 -1.26 -4.45 105.19 118.05 2ca6 n GLY 275 Ca 0.20 -1.04 -0.41 0.00 0.00 0.00 0.00 46.02 44.76 2ca6 n GLY 275 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ca6 s LEU 276 N -3.01 4.38 -0.09 0.99 2.96 -1.21 -4.60 118.68 118.10 2ca6 s LEU 276 Ca 0.52 2.72 0.03 0.00 -0.22 0.00 0.00 54.13 57.17 2ca6 s LEU 276 Cb 0.42 -3.63 -0.07 0.00 0.50 0.00 0.00 46.19 43.41 2ca6 s LEU 276 CO 0.11 -0.74 -0.04 0.00 -1.32 0.00 0.00 176.35 174.36 2ca6 n GLN 277 N 2.30 1.20 -3.95 1.98 6.02 0.18 -2.84 117.38 122.28 2ca6 n GLN 277 Ca 0.07 0.03 -0.29 0.00 -0.01 0.00 0.00 57.00 56.80 2ca6 n GLN 277 Cb 0.40 -1.19 -0.16 0.00 1.02 0.00 0.00 30.24 30.31 2ca6 n GLN 277 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2ca6 s THR 278 N -2.18 1.38 -0.33 5.09 2.01 -0.16 -0.37 115.64 121.08 2ca6 s THR 278 Ca -0.09 -0.79 0.03 0.00 0.31 0.00 0.00 61.69 61.14 2ca6 s THR 278 Cb 0.03 -1.49 0.09 0.00 0.01 0.00 0.00 72.50 71.14 2ca6 s THR 278 CO 0.25 0.18 0.03 -0.22 -0.69 0.00 0.00 174.62 174.16 2ca6 s LEU 279 N 1.52 4.50 -0.51 4.42 2.96 -0.86 -0.19 118.68 130.51 2ca6 s LEU 279 Ca 0.00 -1.94 -0.17 0.00 -0.22 0.00 0.00 54.13 51.80 2ca6 s LEU 279 Cb -0.15 -1.64 0.08 0.00 0.50 0.00 0.00 46.19 44.97 2ca6 s LEU 279 CO -0.08 -0.35 0.54 -0.13 -1.32 0.00 0.00 176.35 175.00 2ca6 s ARG 280 N 0.98 3.05 -0.22 1.98 0.52 -0.47 -1.80 118.95 122.98 2ca6 s ARG 280 Ca 0.06 -1.20 0.11 0.00 -0.52 0.00 0.00 55.73 54.17 2ca6 s ARG 280 Cb -0.20 -4.15 0.43 0.00 0.52 0.00 0.00 34.95 31.55 2ca6 s ARG 280 CO -0.07 -1.20 1.25 1.28 0.02 0.00 0.00 175.30 176.58 2ca6 n LEU 281 N 5.74 2.96 -4.77 2.53 4.77 0.11 -0.99 117.00 127.35 2ca6 n LEU 281 Ca -0.10 -3.93 -0.38 0.00 -0.03 0.00 0.00 56.01 51.57 2ca6 n LEU 281 Cb 0.44 -0.54 -0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2ca6 n LEU 281 CO 0.52 1.42 0.91 -1.10 -1.33 0.00 0.00 177.39 177.80 2ca6 s GLN 282 N -3.26 3.80 -1.22 3.23 -0.21 -1.14 -4.05 119.66 116.82 2ca6 s GLN 282 Ca 0.39 2.01 -0.16 0.00 0.02 0.00 0.00 55.36 57.63 2ca6 s GLN 282 Cb 0.38 -2.57 -0.00 0.00 1.00 0.00 0.00 33.01 31.81 2ca6 s GLN 282 CO -0.06 -0.58 0.68 0.66 -2.12 0.00 0.00 175.29 173.87 2ca6 n TYR 283 N -0.22 -1.80 -1.17 0.91 4.01 -0.74 -0.53 117.16 117.63 2ca6 n TYR 283 Ca 0.06 0.52 0.09 0.00 -0.16 0.00 0.00 57.90 58.40 2ca6 n TYR 283 Cb 0.45 -3.51 0.13 0.00 -0.31 0.00 0.00 39.34 36.10 2ca6 n TYR 283 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2ca6 n ASN 284 N -2.74 2.13 -3.38 7.72 3.02 -1.26 -3.87 115.26 116.89 2ca6 n ASN 284 Ca -0.16 -3.03 -0.24 0.00 -0.03 0.00 0.00 54.58 51.12 2ca6 n ASN 284 Cb 0.62 -0.41 0.01 0.00 -0.61 0.00 0.00 39.78 39.38 2ca6 n ASN 284 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2ca6 n GLU 285 N -1.30 -4.15 -2.84 3.52 1.02 -1.26 -1.88 120.64 113.74 2ca6 n GLU 285 Ca 0.15 0.60 -0.33 0.00 -0.02 0.00 0.00 57.16 57.56 2ca6 n GLU 285 Cb 0.65 -5.39 -0.07 0.00 -0.02 0.00 0.00 31.44 26.62 2ca6 n GLU 285 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2ca6 s ILE 286 N -3.06 4.45 0.25 -3.67 1.01 -1.26 -1.86 121.20 117.05 2ca6 s ILE 286 Ca 0.42 1.38 0.01 0.00 0.00 0.00 0.00 60.65 62.46 2ca6 s ILE 286 Cb -0.21 -3.61 0.01 0.00 0.01 0.00 0.00 42.46 38.66 2ca6 s ILE 286 CO 0.52 -0.32 0.10 -0.62 0.00 0.00 0.00 174.94 174.61 2ca6 n GLU 287 N -0.66 1.27 -0.15 2.79 1.02 -1.26 0.45 120.64 124.10 2ca6 n GLU 287 Ca 0.06 -1.66 -0.10 0.00 -0.02 0.00 0.00 57.16 55.44 2ca6 n GLU 287 Cb 0.54 0.32 -0.01 0.00 -0.02 0.00 0.00 31.44 32.27 2ca6 n GLU 287 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2ca6 h LEU 288 N 0.00 0.71 -0.34 -4.62 5.85 -1.98 -3.00 115.31 111.93 2ca6 h LEU 288 Ca -0.18 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 2ca6 h LEU 288 Cb 0.59 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 2ca6 h LEU 288 CO 0.29 0.80 0.17 0.44 -0.34 0.00 0.00 178.44 179.80 2ca6 h ASP 289 N 0.59 0.44 0.01 1.25 5.19 -1.97 0.15 116.42 122.08 2ca6 h ASP 289 Ca 0.13 -0.11 -0.05 0.00 -0.62 0.00 0.00 57.03 56.38 2ca6 h ASP 289 Cb 0.40 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.79 2ca6 h ASP 289 CO 0.01 0.43 -0.12 0.00 -3.12 0.00 0.00 179.24 176.44 2ca6 h ALA 290 N 1.03 1.53 -0.05 3.45 0.00 -1.92 -0.85 119.26 122.45 2ca6 h ALA 290 Ca 0.12 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.65 2ca6 h ALA 290 Cb 0.10 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2ca6 h ALA 290 CO -0.02 0.34 -0.76 0.28 0.00 0.00 0.00 179.25 179.09 2ca6 h VAL 291 N 0.23 1.41 -0.45 0.00 2.07 -1.30 -0.16 116.25 118.05 2ca6 h VAL 291 Ca 0.05 -2.27 -0.07 0.00 0.82 0.00 0.00 66.70 65.23 2ca6 h VAL 291 Cb 0.35 2.22 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 2ca6 h VAL 291 CO 0.02 0.67 0.01 0.03 0.02 0.00 0.00 177.57 178.32 2ca6 h ARG 292 N 0.20 0.79 -0.23 1.57 3.08 0.16 0.45 114.38 120.40 2ca6 h ARG 292 Ca -0.03 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.75 2ca6 h ARG 292 Cb 1.34 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.31 2ca6 h ARG 292 CO 0.12 0.85 0.05 1.15 -1.07 0.00 0.00 179.97 181.07 2ca6 h THR 293 N 0.64 1.22 -0.96 2.04 2.02 -1.11 -2.54 112.91 114.21 2ca6 h THR 293 Ca 0.13 -0.71 0.10 0.00 0.77 0.00 0.00 66.41 66.70 2ca6 h THR 293 Cb 0.48 1.24 -0.07 0.00 -1.74 0.00 0.00 68.15 68.06 2ca6 h THR 293 CO 0.02 0.23 0.61 0.25 0.37 0.00 0.00 175.52 177.00 2ca6 h LEU 294 N 0.20 0.89 -0.55 2.58 5.85 -0.84 0.83 115.31 124.26 2ca6 h LEU 294 Ca 0.07 0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.88 2ca6 h LEU 294 Cb 0.29 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 2ca6 h LEU 294 CO 0.00 0.51 0.26 0.50 -0.34 0.00 0.00 178.44 179.38 2ca6 h LYS 295 N 0.98 0.48 -0.16 1.25 3.11 -0.50 0.21 116.57 121.94 2ca6 h LYS 295 Ca 0.45 -0.03 -0.08 0.00 -2.81 0.00 0.00 60.65 58.18 2ca6 h LYS 295 Cb 0.40 -0.11 -0.00 0.00 -1.00 0.00 0.00 32.23 31.52 2ca6 h LYS 295 CO -0.21 0.32 -0.20 1.15 -2.81 0.00 0.00 179.45 177.70 2ca6 h THR 296 N 0.49 1.35 -0.38 1.00 2.02 -0.86 -2.12 112.91 114.41 2ca6 h THR 296 Ca 0.26 -1.40 0.06 0.00 0.77 0.00 0.00 66.41 66.10 2ca6 h THR 296 Cb 0.21 1.90 -0.05 0.00 -1.74 0.00 0.00 68.15 68.47 2ca6 h THR 296 CO -0.20 0.41 0.08 0.58 0.37 0.00 0.00 175.52 176.76 2ca6 h VAL 297 N 0.04 0.80 0.25 3.16 2.07 -0.44 0.24 116.25 122.37 2ca6 h VAL 297 Ca 0.02 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 2ca6 h VAL 297 Cb 0.75 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 2ca6 h VAL 297 CO 0.05 0.04 -0.12 0.40 0.02 0.00 0.00 177.57 177.95 2ca6 h ILE 298 N 0.20 0.77 -0.98 4.57 2.04 -0.61 1.19 117.51 124.68 2ca6 h ILE 298 Ca 0.18 -0.07 0.01 0.00 1.00 0.00 0.00 64.86 65.98 2ca6 h ILE 298 Cb 0.22 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.05 2ca6 h ILE 298 CO -0.24 0.02 0.64 -0.78 0.00 0.00 0.00 178.15 177.78 2ca6 h ASP 299 N -0.37 1.14 0.02 1.72 3.58 -1.03 -1.02 116.42 120.47 2ca6 h ASP 299 Ca -0.03 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.37 2ca6 h ASP 299 Cb 0.28 -0.29 -0.00 0.00 1.72 0.00 0.00 39.33 41.04 2ca6 h ASP 299 CO 0.06 0.84 -1.99 -0.62 -2.88 0.00 0.00 179.24 174.65 2ca6 n GLU 300 N -4.38 0.66 0.00 0.28 1.02 0.81 -4.68 120.64 114.34 2ca6 n GLU 300 Ca 0.11 -0.19 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 2ca6 n GLU 300 Cb 0.02 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 29.91 2ca6 n GLU 300 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2ca6 n LYS 301 N -2.28 0.41 -3.25 3.49 5.02 0.41 -4.89 118.16 117.07 2ca6 n LYS 301 Ca -0.05 -0.58 -0.25 0.00 -2.02 0.00 0.00 58.31 55.42 2ca6 n LYS 301 Cb 0.58 -0.74 -0.07 0.00 -0.02 0.00 0.00 35.03 34.79 2ca6 n LYS 301 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2ca6 n MET 302 N -0.11 1.58 0.26 1.97 2.81 -0.39 -4.10 117.12 119.14 2ca6 n MET 302 Ca 0.00 -3.88 0.14 0.00 -1.81 0.00 0.00 57.70 52.15 2ca6 n MET 302 Cb 0.25 -1.71 0.71 0.00 -0.71 0.00 0.00 33.22 31.75 2ca6 n MET 302 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2ca6 h PRO 303 N 3.86 0.00 -0.56 0.03 0.13 -1.78 -3.01 132.00 130.68 2ca6 h PRO 303 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2ca6 h PRO 303 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 2ca6 h PRO 303 CO 0.62 0.11 0.00 -0.25 -0.23 0.00 0.00 178.00 178.26 2ca6 n ASP 304 N -3.42 5.05 -4.73 1.44 8.00 -1.26 -4.99 116.55 116.64 2ca6 n ASP 304 Ca -0.01 -2.73 -0.41 0.00 0.71 0.00 0.00 54.79 52.35 2ca6 n ASP 304 Cb 0.28 -0.61 -0.04 0.00 -0.02 0.00 0.00 41.12 40.72 2ca6 n ASP 304 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2ca6 s LEU 305 N -2.36 4.50 -0.02 0.64 2.96 -1.13 -4.03 118.68 119.24 2ca6 s LEU 305 Ca 0.51 1.87 0.01 0.00 -0.22 0.00 0.00 54.13 56.30 2ca6 s LEU 305 Cb 0.36 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 43.44 2ca6 s LEU 305 CO 0.18 -0.09 -0.01 0.18 -1.32 0.00 0.00 176.35 175.30 2ca6 n LEU 306 N 2.64 1.23 -3.97 -0.68 4.77 0.50 -4.08 117.00 117.41 2ca6 n LEU 306 Ca 0.02 -0.01 -0.23 0.00 -0.03 0.00 0.00 56.01 55.77 2ca6 n LEU 306 Cb 0.48 -0.01 -0.16 0.00 -2.33 0.00 0.00 43.42 41.40 2ca6 n LEU 306 CO 0.52 0.25 -0.44 -0.36 -1.33 0.00 0.00 177.39 176.02 2ca6 s PHE 307 N -2.05 1.19 -0.11 -1.77 0.08 -0.53 -0.69 117.98 114.10 2ca6 s PHE 307 Ca -0.02 -0.42 0.01 0.00 0.12 0.00 0.00 56.93 56.62 2ca6 s PHE 307 Cb 0.01 -0.92 0.02 0.00 -0.57 0.00 0.00 43.02 41.56 2ca6 s PHE 307 CO 0.07 -0.25 -0.12 -1.17 -0.10 0.00 0.00 175.22 173.65 2ca6 s LEU 308 N 0.80 1.50 -0.25 -0.37 2.96 -0.21 -2.04 118.68 121.08 2ca6 s LEU 308 Ca -0.12 -0.37 -0.02 0.00 -0.22 0.00 0.00 54.13 53.40 2ca6 s LEU 308 Cb -0.15 -0.96 0.02 0.00 0.50 0.00 0.00 46.19 45.60 2ca6 s LEU 308 CO 0.02 -0.05 -0.05 -1.61 -1.32 0.00 0.00 176.35 173.34 2ca6 s GLU 309 N 1.29 2.85 -0.01 1.98 2.02 -0.75 -1.35 118.70 124.73 2ca6 s GLU 309 Ca -0.02 -0.97 0.02 0.00 0.02 0.00 0.00 54.97 54.02 2ca6 s GLU 309 Cb -0.14 -3.00 0.03 0.00 0.10 0.00 0.00 34.13 31.12 2ca6 s GLU 309 CO -0.05 -0.40 0.79 1.28 0.02 0.00 0.00 175.26 176.91 2ca6 n LEU 310 N 4.68 0.51 -4.76 1.80 4.77 -1.26 0.09 117.00 122.82 2ca6 n LEU 310 Ca -0.16 -0.90 -0.39 0.00 -0.03 0.00 0.00 56.01 54.53 2ca6 n LEU 310 Cb 0.47 -0.04 0.03 0.00 -2.33 0.00 0.00 43.42 41.55 2ca6 n LEU 310 CO 0.27 0.22 0.98 0.21 -1.33 0.00 0.00 177.39 177.74 2ca6 s ASN 311 N -0.74 5.53 0.00 -1.43 3.84 -1.26 -3.26 114.94 117.62 2ca6 s ASN 311 Ca 0.03 2.73 0.00 0.00 0.21 0.00 0.00 52.86 55.83 2ca6 s ASN 311 Cb 0.03 -2.64 0.00 0.00 -0.55 0.00 0.00 41.25 38.09 2ca6 s ASN 311 CO 0.00 -1.39 0.00 0.61 -2.79 0.00 0.00 177.10 173.54 2ca6 n GLY 312 N 0.66 0.58 3.97 1.21 0.00 -1.19 -1.78 105.19 108.63 2ca6 n GLY 312 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.87 2ca6 n GLY 312 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ca6 n ASN 313 N 0.00 1.42 -2.76 1.61 3.02 -1.20 -4.14 115.26 113.20 2ca6 n ASN 313 Ca 0.00 -2.18 -0.30 0.00 -0.03 0.00 0.00 54.58 52.07 2ca6 n ASN 313 Cb 0.00 -0.65 -0.05 0.00 -0.61 0.00 0.00 39.78 38.47 2ca6 n ASN 313 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2ca6 n ARG 314 N -2.86 3.06 -3.59 3.52 1.74 0.17 0.53 116.66 119.23 2ca6 n ARG 314 Ca 0.17 -2.51 -0.13 0.00 -0.77 0.00 0.00 57.85 54.61 2ca6 n ARG 314 Cb 0.60 -2.30 -0.05 0.00 -1.02 0.00 0.00 32.46 29.69 2ca6 n ARG 314 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 2ca6 s PHE 315 N -1.05 -0.35 0.30 -1.55 -0.12 -1.26 -4.22 117.98 109.73 2ca6 s PHE 315 Ca 0.59 0.26 -0.14 0.00 -0.05 0.00 0.00 56.93 57.58 2ca6 s PHE 315 Cb 0.31 0.32 -0.09 0.00 -0.63 0.00 0.00 43.02 42.93 2ca6 s PHE 315 CO -0.15 -0.66 0.71 0.45 -0.05 0.00 0.00 175.22 175.51 2ca6 s SER 316 N -2.27 6.77 0.53 1.98 0.15 -1.26 -4.62 113.70 114.98 2ca6 s SER 316 Ca -0.03 1.23 0.31 0.00 0.70 0.00 0.00 55.95 58.16 2ca6 s SER 316 Cb -0.00 -2.35 1.43 0.00 -1.71 0.00 0.00 66.02 63.39 2ca6 s SER 316 CO -0.06 -0.17 2.03 -0.08 1.20 0.00 0.00 173.24 176.16 2ca6 h GLU 317 N 2.37 0.00 0.00 5.44 4.22 -1.99 -2.37 114.58 122.25 2ca6 h GLU 317 Ca -0.48 0.00 -0.05 0.00 0.08 0.00 0.00 59.36 58.92 2ca6 h GLU 317 Cb 1.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2ca6 h GLU 317 CO 0.66 0.10 -0.32 0.93 -2.18 0.00 0.00 179.01 178.19 2ca6 h GLU 318 N 0.00 0.00 -6.36 1.92 5.08 -1.97 -3.44 114.58 109.82 2ca6 h GLU 318 Ca -0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 2ca6 h GLU 318 Cb 0.44 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.74 2ca6 h GLU 318 CO 0.01 0.21 0.59 -0.25 -1.00 0.00 0.00 179.01 178.57 2ca6 n ASP 319 N -3.11 2.21 -0.45 1.42 8.00 -0.89 -4.79 116.55 118.93 2ca6 n ASP 319 Ca 0.02 1.10 0.41 0.00 0.71 0.00 0.00 54.79 57.04 2ca6 n ASP 319 Cb 0.62 -1.28 0.76 0.00 -0.02 0.00 0.00 41.12 41.21 2ca6 n ASP 319 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2ca6 h ASP 320 N 5.12 0.00 -0.23 -2.24 3.32 -1.90 -0.08 116.42 120.42 2ca6 h ASP 320 Ca -0.47 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.58 2ca6 h ASP 320 Cb 1.30 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 2ca6 h ASP 320 CO 0.82 0.00 0.13 1.62 -1.72 0.00 0.00 179.24 180.09 2ca6 h VAL 321 N 0.00 1.09 -0.80 -1.35 3.04 -1.94 -2.65 116.25 113.64 2ca6 h VAL 321 Ca 0.69 -0.24 0.03 0.00 -1.01 0.00 0.00 66.70 66.17 2ca6 h VAL 321 Cb 2.83 0.76 -0.05 0.00 -2.01 0.00 0.00 31.29 32.82 2ca6 h VAL 321 CO -0.01 0.10 0.51 0.58 -1.01 0.00 0.00 177.57 177.74 2ca6 h VAL 322 N 0.35 1.13 0.00 1.51 2.07 -1.28 -0.42 116.25 119.62 2ca6 h VAL 322 Ca 0.09 -0.34 -0.14 0.00 0.82 0.00 0.00 66.70 67.13 2ca6 h VAL 322 Cb 0.03 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 29.82 2ca6 h VAL 322 CO -0.01 0.18 -0.66 0.44 0.02 0.00 0.00 177.57 177.54 2ca6 h ASP 323 N 1.00 0.00 -0.55 0.57 3.32 -1.67 -2.10 116.42 116.99 2ca6 h ASP 323 Ca 0.32 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.29 2ca6 h ASP 323 Cb -0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 2ca6 h ASP 323 CO -0.11 0.66 0.05 -0.33 -1.72 0.00 0.00 179.24 177.79 2ca6 h GLU 324 N 0.00 0.98 -0.13 3.56 5.08 -1.04 0.32 114.58 123.35 2ca6 h GLU 324 Ca -0.01 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.06 2ca6 h GLU 324 Cb 1.35 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.49 2ca6 h GLU 324 CO 0.09 0.94 -0.02 0.82 -1.00 0.00 0.00 179.01 179.84 2ca6 h ILE 325 N 0.91 1.27 -0.87 3.13 2.04 -1.00 -2.33 117.51 120.67 2ca6 h ILE 325 Ca 0.18 -0.90 0.07 0.00 1.00 0.00 0.00 64.86 65.21 2ca6 h ILE 325 Cb 0.47 1.61 -0.06 0.00 -0.74 0.00 0.00 36.82 38.09 2ca6 h ILE 325 CO 0.02 0.26 0.53 0.03 0.00 0.00 0.00 178.15 178.99 2ca6 h ARG 326 N -0.05 0.93 -0.49 2.37 3.08 -0.95 -1.66 114.38 117.61 2ca6 h ARG 326 Ca 0.04 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 2ca6 h ARG 326 Cb 0.41 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 2ca6 h ARG 326 CO 0.01 0.61 0.21 1.49 -1.07 0.00 0.00 179.97 181.23 2ca6 h GLU 327 N 0.95 0.69 -0.22 0.04 4.81 -0.13 0.66 114.58 121.38 2ca6 h GLU 327 Ca 0.39 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.52 2ca6 h GLU 327 Cb 0.22 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2ca6 h GLU 327 CO -0.19 0.56 0.09 0.28 -0.73 0.00 0.00 179.01 179.02 2ca6 h VAL 328 N 0.69 1.17 -0.45 0.32 2.07 -0.76 0.92 116.25 120.21 2ca6 h VAL 328 Ca 0.17 -0.50 -0.13 0.00 0.82 0.00 0.00 66.70 67.06 2ca6 h VAL 328 Cb 0.11 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2ca6 h VAL 328 CO -0.02 0.16 -0.21 -0.26 0.02 0.00 0.00 177.57 177.26 2ca6 h PHE 329 N 0.21 1.05 -0.72 1.57 0.04 -1.18 0.83 116.94 118.74 2ca6 h PHE 329 Ca 0.07 -0.25 -0.02 0.00 2.80 0.00 0.00 57.97 60.58 2ca6 h PHE 329 Cb 0.18 -0.25 -0.03 0.00 2.20 0.00 0.00 35.95 38.04 2ca6 h PHE 329 CO -0.01 1.04 0.38 0.77 -0.60 0.00 0.00 178.31 179.89 2ca6 h SER 330 N 0.80 0.89 0.93 2.17 0.02 0.80 0.27 113.55 119.42 2ca6 h SER 330 Ca 0.11 -0.08 -0.21 0.00 -0.84 0.00 0.00 61.79 60.77 2ca6 h SER 330 Cb 0.77 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.06 2ca6 h SER 330 CO 0.06 0.73 -0.97 0.74 -1.14 0.00 0.00 176.83 176.25 2ca6 h THR 331 N 1.00 1.67 0.00 -2.27 2.02 0.12 -3.31 112.91 112.14 2ca6 h THR 331 Ca 0.25 -3.26 -0.16 0.00 0.77 0.00 0.00 66.41 64.01 2ca6 h THR 331 Cb 0.05 2.78 -0.03 0.00 -1.74 0.00 0.00 68.15 69.21 2ca6 h THR 331 CO -0.04 0.93 -1.02 0.03 0.37 0.00 0.00 175.52 175.79 2ca6 h ARG 332 N 0.01 0.00 0.00 6.66 3.08 -0.46 -3.48 114.38 120.19 2ca6 h ARG 332 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2ca6 h ARG 332 Cb 1.71 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.76 2ca6 h ARG 332 CO 0.13 0.52 0.00 0.41 -1.07 0.00 0.00 179.97 179.96 2ca6 n GLY 333 N 1.34 2.79 3.27 0.04 0.00 0.91 -4.99 105.19 108.55 2ca6 n GLY 333 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 2ca6 n GLY 333 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ca6 s ARG 334 N -0.32 1.80 0.00 1.61 0.52 -1.23 -5.00 118.95 116.33 2ca6 s ARG 334 Ca 0.00 -0.89 0.00 0.00 -0.52 0.00 0.00 55.73 54.32 2ca6 s ARG 334 Cb 0.00 -1.80 0.00 0.00 0.52 0.00 0.00 34.95 33.67 2ca6 s ARG 334 CO 0.00 0.48 0.00 0.41 0.02 0.00 0.00 175.30 176.21 2ca6 n GLY 335 N 2.31 2.64 3.51 -3.53 0.00 -1.26 -4.56 105.19 104.30 2ca6 n GLY 335 Ca -0.16 -1.83 -0.17 0.00 0.00 0.00 0.00 46.02 43.86 2ca6 n GLY 335 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2ca6 s GLU 336 N -3.52 1.05 0.24 1.61 -1.05 0.14 -4.83 118.70 112.33 2ca6 s GLU 336 Ca 0.00 0.18 0.06 0.00 -0.15 0.00 0.00 54.97 55.06 2ca6 s GLU 336 Cb 0.00 0.49 -0.03 0.00 -0.44 0.00 0.00 34.13 34.15 2ca6 s GLU 336 CO 0.00 -0.34 0.27 -1.17 0.95 0.00 0.00 175.26 174.97 2ca6 s LEU 337 N -1.34 4.06 0.60 1.83 2.96 -1.26 -1.04 118.68 124.48 2ca6 s LEU 337 Ca -0.09 -0.09 -0.03 0.00 -0.22 0.00 0.00 54.13 53.70 2ca6 s LEU 337 Cb -0.00 -2.60 0.03 0.00 0.50 0.00 0.00 46.19 44.12 2ca6 s LEU 337 CO 0.07 -0.04 0.88 1.51 -1.32 0.00 0.00 176.35 177.45 2ca6 s ASP 338 N -3.83 5.28 -0.08 3.68 -4.77 -0.46 -4.89 116.67 111.60 2ca6 s ASP 338 Ca 0.33 0.39 -0.30 0.00 -3.30 0.00 0.00 52.55 49.67 2ca6 s ASP 338 Cb -0.09 -1.27 -0.04 0.00 -1.09 0.00 0.00 42.92 40.43 2ca6 s ASP 338 CO 0.27 -1.21 1.43 -0.70 0.70 0.00 0.00 175.17 175.65 2ca6 s GLU 339 N -4.96 4.23 -1.15 2.11 2.12 -1.26 -4.87 118.70 114.92 2ca6 s GLU 339 Ca 0.56 1.92 -0.04 0.00 0.36 0.00 0.00 54.97 57.77 2ca6 s GLU 339 Cb -0.10 -3.79 0.15 0.00 0.26 0.00 0.00 34.13 30.64 2ca6 s GLU 339 CO 0.42 -0.72 2.34 1.28 -0.54 0.00 0.00 175.26 178.05 2ca6 n LEU 340 N 6.47 7.73 -0.52 2.70 4.77 -1.26 -4.64 117.00 132.24 2ca6 n LEU 340 Ca 0.15 -4.86 0.14 0.00 -0.03 0.00 0.00 56.01 51.40 2ca6 n LEU 340 Cb 0.44 -1.31 0.48 0.00 -2.33 0.00 0.00 43.42 40.70 2ca6 n LEU 340 CO 0.59 2.01 0.84 -0.90 -1.33 0.00 0.00 177.39 178.60 2ca6 n ASP 341 N 1.27 1.63 -2.75 -1.43 5.68 -1.26 -4.37 116.55 115.32 2ca6 n ASP 341 Ca 0.58 -1.56 -0.04 0.00 -0.50 0.00 0.00 54.79 53.27 2ca6 n ASP 341 Cb 0.29 -0.01 0.04 0.00 -1.14 0.00 0.00 41.12 40.30 2ca6 n ASP 341 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2ca6 n ASP 342 N 0.28 1.50 -4.71 -1.12 2.03 -1.26 -5.05 116.55 108.23 2ca6 n ASP 342 Ca 0.18 -2.36 -0.30 0.00 0.52 0.00 0.00 54.79 52.83 2ca6 n ASP 342 Cb 0.37 -0.50 0.14 0.00 -0.72 0.00 0.00 41.12 40.41 2ca6 n ASP 342 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 2ca6 s MET 343 N -3.47 1.35 -0.09 -0.67 -1.94 -1.26 -3.19 119.30 110.03 2ca6 s MET 343 Ca 0.27 1.04 -0.12 0.00 -1.71 0.00 0.00 55.69 55.17 2ca6 s MET 343 Cb 0.39 -1.80 -0.04 0.00 2.01 0.00 0.00 34.83 35.39 2ca6 s MET 343 CO -0.00 -2.24 -0.23 -1.91 -0.01 0.00 0.00 175.02 170.63 2ca6 n GLU 344 N -3.91 0.35 0.00 2.03 2.13 0.19 -4.88 120.64 116.54 2ca6 n GLU 344 Ca 0.08 0.14 0.00 0.00 0.66 0.00 0.00 57.16 58.04 2ca6 n GLU 344 Cb 0.54 -1.11 0.00 0.00 0.27 0.00 0.00 31.44 31.14 2ca6 n GLU 344 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87