#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 3.26 -0.18 0.00 3.52 -1.26 0.12 118.95 124.42 2ca6 s ARG 3 Ca 0.00 -0.72 -0.04 0.00 -0.13 0.00 0.00 55.73 54.83 2ca6 s ARG 3 Cb 0.00 -2.67 -0.03 0.00 -1.56 0.00 0.00 34.95 30.69 2ca6 s ARG 3 CO 0.00 0.02 -0.02 0.12 -0.81 0.00 0.00 175.30 174.61 2ca6 s PHE 4 N 0.82 3.04 -0.05 5.12 5.36 0.87 -4.95 117.98 128.18 2ca6 s PHE 4 Ca -0.05 -0.37 -0.04 0.00 -0.96 0.00 0.00 56.93 55.51 2ca6 s PHE 4 Cb -0.15 -2.02 0.02 0.00 -0.34 0.00 0.00 43.02 40.53 2ca6 s PHE 4 CO 0.00 -0.13 0.13 0.45 -1.46 0.00 0.00 175.22 174.21 2ca6 s SER 5 N 0.67 -0.12 -0.07 6.13 0.15 -1.26 0.37 113.70 119.57 2ca6 s SER 5 Ca -0.01 0.26 0.10 0.00 0.70 0.00 0.00 55.95 56.99 2ca6 s SER 5 Cb -0.14 0.23 0.15 0.00 -1.71 0.00 0.00 66.02 64.55 2ca6 s SER 5 CO 0.02 -0.07 1.05 2.30 1.20 0.00 0.00 173.24 177.75 2ca6 n ILE 6 N 3.34 1.06 -1.53 6.45 -5.35 -0.77 -4.98 119.36 117.58 2ca6 n ILE 6 Ca -0.16 -1.26 -0.50 0.00 -0.27 0.00 0.00 62.75 60.55 2ca6 n ILE 6 Cb 0.57 0.14 -0.04 0.00 -1.74 0.00 0.00 39.64 38.56 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 -0.79 0.76 -1.17 6.28 2.13 -1.24 -1.78 120.64 124.82 2ca6 n GLU 7 Ca 0.08 0.27 -0.08 0.00 0.66 0.00 0.00 57.16 58.09 2ca6 n GLU 7 Cb 0.63 -1.67 -0.04 0.00 0.27 0.00 0.00 31.44 30.63 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 1.88 0.78 0.00 8.31 0.00 -0.20 -4.81 105.19 111.14 2ca6 n GLY 8 Ca 0.16 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.28 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 -0.50 0.19 -3.69 1.61 5.02 -0.73 -4.93 118.16 115.13 2ca6 n LYS 9 Ca -0.08 0.11 -0.28 0.00 -2.02 0.00 0.00 58.31 56.04 2ca6 n LYS 9 Cb 0.51 -1.50 0.02 0.00 -0.02 0.00 0.00 35.03 34.05 2ca6 n LYS 9 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2ca6 n SER 10 N -1.36 -5.38 -4.46 4.39 2.88 -0.75 -4.95 113.62 103.99 2ca6 n SER 10 Ca 0.08 -0.92 -0.37 0.00 -1.33 0.00 0.00 58.87 56.34 2ca6 n SER 10 Cb 0.19 -2.93 -0.12 0.00 -0.75 0.00 0.00 64.21 60.60 2ca6 n SER 10 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2ca6 s LEU 11 N -5.89 3.58 -1.31 2.46 1.43 -1.26 -4.94 118.68 112.76 2ca6 s LEU 11 Ca 0.29 -0.23 -0.14 0.00 -1.03 0.00 0.00 54.13 53.02 2ca6 s LEU 11 Cb -0.12 -1.95 0.11 0.00 0.03 0.00 0.00 46.19 44.26 2ca6 s LEU 11 CO 0.87 -0.06 1.81 1.17 0.23 0.00 0.00 176.35 180.38 2ca6 n LYS 12 N 4.94 3.25 -3.01 1.70 3.00 -1.26 -1.10 118.16 125.69 2ca6 n LYS 12 Ca -0.16 -3.31 -0.44 0.00 -0.00 0.00 0.00 58.31 54.40 2ca6 n LYS 12 Cb 0.51 -3.22 -0.03 0.00 0.00 0.00 0.00 35.03 32.30 2ca6 n LYS 12 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2ca6 s LEU 13 N 2.16 5.29 0.30 3.14 1.43 -0.35 -4.78 118.68 125.87 2ca6 s LEU 13 Ca 0.47 -1.92 0.16 0.00 -1.03 0.00 0.00 54.13 51.81 2ca6 s LEU 13 Cb 0.06 -2.36 0.13 0.00 0.03 0.00 0.00 46.19 44.05 2ca6 s LEU 13 CO 0.00 -1.04 1.48 0.44 0.23 0.00 0.00 176.35 177.46 2ca6 h ASP 14 N 8.82 0.00 -5.07 2.29 3.32 -1.88 0.68 116.42 124.59 2ca6 h ASP 14 Ca 0.03 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 2ca6 h ASP 14 Cb 1.04 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.57 2ca6 h ASP 14 CO 1.06 0.45 0.20 0.00 -1.72 0.00 0.00 179.24 179.23 2ca6 s ALA 15 N -3.02 -0.64 -0.36 3.45 0.00 -1.26 -1.25 121.76 118.68 2ca6 s ALA 15 Ca 0.04 -0.77 -0.06 0.00 0.00 0.00 0.00 51.96 51.18 2ca6 s ALA 15 Cb 0.07 0.77 0.06 0.00 0.00 0.00 0.00 23.12 24.03 2ca6 s ALA 15 CO 0.73 -0.97 0.14 0.42 0.00 0.00 0.00 175.76 176.08 2ca6 s ILE 16 N -2.73 3.68 0.00 0.00 -1.09 -1.26 -4.64 121.20 115.16 2ca6 s ILE 16 Ca 0.17 -1.37 0.00 0.00 -2.23 0.00 0.00 60.65 57.21 2ca6 s ILE 16 Cb -0.05 -3.19 0.00 0.00 -1.58 0.00 0.00 42.46 37.64 2ca6 s ILE 16 CO 0.12 -0.32 0.00 0.41 -1.23 0.00 0.00 174.94 173.92 2ca6 n THR 17 N 4.77 0.00 -0.06 2.92 -1.04 -1.26 -4.78 114.28 114.83 2ca6 n THR 17 Ca -0.10 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 61.87 2ca6 n THR 17 Cb 0.44 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.93 2ca6 n THR 17 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 2ca6 h THR 18 N -1.26 0.00 0.00 12.58 2.02 -1.98 -3.19 112.91 121.08 2ca6 h THR 18 Ca 0.00 -0.88 -0.02 0.00 0.77 0.00 0.00 66.41 66.27 2ca6 h THR 18 Cb 0.00 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.41 2ca6 h THR 18 CO 0.00 0.00 -0.11 -0.33 0.37 0.00 0.00 175.52 175.45 2ca6 h GLU 19 N -0.88 0.00 0.00 6.66 5.08 -1.96 -1.10 114.58 122.37 2ca6 h GLU 19 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2ca6 h GLU 19 Cb 0.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 2ca6 h GLU 19 CO 0.00 0.11 -0.06 0.22 -1.00 0.00 0.00 179.01 178.28 2ca6 h ASP 20 N 0.00 0.00 0.39 1.42 3.58 -1.93 1.28 116.42 121.16 2ca6 h ASP 20 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2ca6 h ASP 20 Cb 0.90 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.95 2ca6 h ASP 20 CO 0.01 0.06 -1.58 1.21 -2.88 0.00 0.00 179.24 176.07 2ca6 n GLU 21 N -3.19 0.62 -0.01 0.28 2.13 -0.77 -2.74 120.64 116.96 2ca6 n GLU 21 Ca 0.00 -0.07 0.10 0.00 0.66 0.00 0.00 57.16 57.85 2ca6 n GLU 21 Cb 0.33 -1.64 -0.17 0.00 0.27 0.00 0.00 31.44 30.24 2ca6 n GLU 21 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2ca6 n LYS 22 N -2.39 0.66 0.00 5.31 3.00 -0.49 -3.77 118.16 120.48 2ca6 n LYS 22 Ca -0.02 -0.19 0.00 0.00 -0.00 0.00 0.00 58.31 58.10 2ca6 n LYS 22 Cb 0.55 -1.52 0.00 0.00 0.00 0.00 0.00 35.03 34.06 2ca6 n LYS 22 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2ca6 n SER 23 N -2.29 0.89 0.04 3.14 3.41 0.43 -4.62 113.62 114.63 2ca6 n SER 23 Ca -0.06 -0.94 0.00 0.00 -0.26 0.00 0.00 58.87 57.61 2ca6 n SER 23 Cb 0.60 0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.68 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 -0.12 0.91 -1.47 -3.33 0.31 -1.11 -4.82 118.33 108.70 2ca6 n VAL 24 Ca 0.00 0.30 -0.28 0.00 -0.01 0.00 0.00 64.34 64.35 2ca6 n VAL 24 Cb 0.00 -1.51 0.09 0.00 -0.91 0.00 0.00 33.84 31.52 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 -3.39 2.91 -0.10 3.52 3.01 -1.21 -4.59 117.46 117.61 2ca6 n PHE 25 Ca 0.00 -2.58 -0.11 0.00 1.01 0.00 0.00 57.45 55.77 2ca6 n PHE 25 Cb 0.10 -1.07 -0.03 0.00 -0.01 0.00 0.00 39.48 38.47 2ca6 n PHE 25 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ca6 h ALA 26 N 1.81 0.40 -0.62 4.37 0.00 -1.82 0.92 119.26 124.32 2ca6 h ALA 26 Ca 0.53 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 2ca6 h ALA 26 Cb 1.32 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 2ca6 h ALA 26 CO 1.25 0.11 0.15 0.28 0.00 0.00 0.00 179.25 181.04 2ca6 h VAL 27 N 0.31 1.25 0.00 0.00 2.07 -1.92 0.19 116.25 118.16 2ca6 h VAL 27 Ca 0.09 -0.92 -0.03 0.00 0.82 0.00 0.00 66.70 66.67 2ca6 h VAL 27 Cb 0.38 0.67 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2ca6 h VAL 27 CO 0.01 0.34 -0.12 0.25 0.02 0.00 0.00 177.57 178.07 2ca6 h LEU 28 N 0.90 0.00 0.00 2.57 7.12 -1.83 0.15 115.31 124.22 2ca6 h LEU 28 Ca 0.19 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.20 2ca6 h LEU 28 Cb 0.35 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.48 2ca6 h LEU 28 CO 0.00 0.12 -0.90 -0.11 -0.13 0.00 0.00 178.44 177.43 2ca6 n LEU 29 N -3.25 0.75 -0.03 2.25 7.94 0.30 -4.53 117.00 120.43 2ca6 n LEU 29 Ca 0.01 -0.26 -0.04 0.00 -1.11 0.00 0.00 56.01 54.61 2ca6 n LEU 29 Cb 0.39 -0.09 -0.04 0.00 0.53 0.00 0.00 43.42 44.21 2ca6 n LEU 29 CO 0.31 0.17 -0.71 1.21 -1.11 0.00 0.00 177.39 177.26 2ca6 n GLU 30 N -1.60 1.96 -3.30 1.96 2.13 0.62 -5.03 120.64 117.39 2ca6 n GLU 30 Ca 0.04 0.01 -0.38 0.00 0.66 0.00 0.00 57.16 57.49 2ca6 n GLU 30 Cb 0.36 -1.15 -0.06 0.00 0.27 0.00 0.00 31.44 30.86 2ca6 n GLU 30 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2ca6 s ASP 31 N -4.09 7.04 -0.00 4.31 -1.08 0.49 -4.98 116.67 118.36 2ca6 s ASP 31 Ca -0.06 1.23 0.09 0.00 -0.52 0.00 0.00 52.55 53.30 2ca6 s ASP 31 Cb 0.02 -2.35 -0.11 0.00 -1.46 0.00 0.00 42.92 39.02 2ca6 s ASP 31 CO 0.21 0.28 0.32 0.47 0.52 0.00 0.00 175.17 176.97 2ca6 n ASP 32 N 1.71 1.27 -0.60 -0.34 8.00 -1.26 -4.45 116.55 120.88 2ca6 n ASP 32 Ca -0.11 -0.47 0.06 0.00 0.71 0.00 0.00 54.79 54.98 2ca6 n ASP 32 Cb 0.51 1.15 0.17 0.00 -0.02 0.00 0.00 41.12 42.92 2ca6 n ASP 32 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2ca6 n SER 33 N -1.43 1.73 -4.69 -2.24 3.41 -1.26 -4.37 113.62 104.77 2ca6 n SER 33 Ca 0.01 -1.97 -0.51 0.00 -0.26 0.00 0.00 58.87 56.13 2ca6 n SER 33 Cb 0.18 -0.21 -0.06 0.00 -0.26 0.00 0.00 64.21 63.86 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 0.44 0.49 0.07 -3.33 0.31 -1.26 -3.32 118.33 111.72 2ca6 n VAL 34 Ca 0.11 -0.09 0.08 0.00 -0.01 0.00 0.00 64.34 64.44 2ca6 n VAL 34 Cb 0.28 -1.66 -0.12 0.00 -0.91 0.00 0.00 33.84 31.43 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 6.20 0.62 -4.09 5.55 5.02 0.33 -3.50 118.16 128.29 2ca6 n LYS 35 Ca 0.24 -0.14 -0.14 0.00 -2.02 0.00 0.00 58.31 56.25 2ca6 n LYS 35 Cb 0.24 -1.38 -0.13 0.00 -0.02 0.00 0.00 35.03 33.74 2ca6 n LYS 35 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2ca6 s GLU 36 N -3.08 0.46 -0.07 1.97 2.02 -0.83 -1.62 118.70 117.55 2ca6 s GLU 36 Ca -0.05 -0.49 -0.02 0.00 0.02 0.00 0.00 54.97 54.44 2ca6 s GLU 36 Cb 0.11 -0.31 0.03 0.00 0.10 0.00 0.00 34.13 34.05 2ca6 s GLU 36 CO 0.68 0.07 0.05 0.42 0.02 0.00 0.00 175.26 176.50 2ca6 s ILE 37 N -0.81 0.05 -0.27 -1.63 1.01 -1.04 -0.09 121.20 118.41 2ca6 s ILE 37 Ca -0.05 0.26 -0.03 0.00 0.00 0.00 0.00 60.65 60.83 2ca6 s ILE 37 Cb -0.06 -0.32 0.02 0.00 0.01 0.00 0.00 42.46 42.11 2ca6 s ILE 37 CO 0.00 0.15 -0.00 -0.69 0.00 0.00 0.00 174.94 174.40 2ca6 s VAL 38 N 2.10 3.26 -0.84 2.92 1.01 0.16 -1.50 120.40 127.51 2ca6 s VAL 38 Ca 0.05 -0.97 0.07 0.00 0.00 0.00 0.00 61.98 61.13 2ca6 s VAL 38 Cb -0.13 -2.70 0.08 0.00 0.00 0.00 0.00 36.38 33.64 2ca6 s VAL 38 CO -0.04 0.11 0.80 0.18 0.00 0.00 0.00 175.10 176.14 2ca6 n LEU 39 N 4.73 1.76 -4.73 3.92 4.77 -0.84 -1.84 117.00 124.77 2ca6 n LEU 39 Ca -0.15 -1.16 -0.42 0.00 -0.03 0.00 0.00 56.01 54.24 2ca6 n LEU 39 Cb 0.47 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.51 2ca6 n LEU 39 CO 0.28 0.38 1.28 -1.20 -1.33 0.00 0.00 177.39 176.81 2ca6 n SER 40 N 0.36 3.87 0.00 -1.43 7.64 -1.24 -3.60 113.62 119.23 2ca6 n SER 40 Ca 0.05 1.12 0.00 0.00 1.01 0.00 0.00 58.87 61.04 2ca6 n SER 40 Cb 0.21 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 61.83 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 2.81 1.11 3.14 0.23 0.00 0.11 -1.04 105.19 111.56 2ca6 n GLY 41 Ca 0.11 -0.22 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.21 0.34 -0.37 1.61 0.01 -1.22 -1.82 114.94 111.28 2ca6 s ASN 42 Ca 0.00 -1.11 -0.08 0.00 -0.71 0.00 0.00 52.86 50.96 2ca6 s ASN 42 Cb 0.00 0.28 0.05 0.00 0.41 0.00 0.00 41.25 41.99 2ca6 s ASN 42 CO 0.00 -0.70 0.18 -0.89 -1.51 0.00 0.00 177.10 174.18 2ca6 s THR 43 N -4.00 4.07 -0.39 1.60 2.01 -0.25 -3.77 115.64 114.91 2ca6 s THR 43 Ca 0.18 -1.20 -0.18 0.00 0.31 0.00 0.00 61.69 60.80 2ca6 s THR 43 Cb 0.07 -3.38 0.01 0.00 0.01 0.00 0.00 72.50 69.22 2ca6 s THR 43 CO -0.02 -0.32 0.51 -0.63 -0.69 0.00 0.00 174.62 173.48 2ca6 s ILE 44 N 1.43 5.00 0.83 1.82 1.01 -0.01 -1.22 121.20 130.07 2ca6 s ILE 44 Ca 0.01 0.10 -0.10 0.00 0.00 0.00 0.00 60.65 60.65 2ca6 s ILE 44 Cb -0.21 -4.03 0.14 0.00 0.01 0.00 0.00 42.46 38.37 2ca6 s ILE 44 CO 0.03 -0.34 1.17 -0.83 0.00 0.00 0.00 174.94 174.96 2ca6 s GLY 45 N 1.83 1.73 0.09 6.18 0.00 0.24 -4.85 107.32 112.53 2ca6 s GLY 45 Ca 0.17 -1.16 -0.34 0.00 0.00 0.00 0.00 44.72 43.40 2ca6 s GLY 45 CO 0.15 -0.55 1.58 -0.84 0.00 0.00 0.00 173.10 173.44 2ca6 h THR 46 N -1.10 0.12 -0.56 0.90 2.02 -1.84 -1.80 112.91 110.65 2ca6 h THR 46 Ca -0.43 0.00 0.07 0.00 0.77 0.00 0.00 66.41 66.82 2ca6 h THR 46 Cb 1.27 0.12 -0.06 0.00 -1.74 0.00 0.00 68.15 67.74 2ca6 h THR 46 CO 0.48 0.00 0.23 -0.08 0.37 0.00 0.00 175.52 176.52 2ca6 h GLU 47 N -0.88 0.42 -0.85 6.66 4.57 -1.78 -0.94 114.58 121.78 2ca6 h GLU 47 Ca -0.04 -0.03 0.03 0.00 -1.18 0.00 0.00 59.36 58.14 2ca6 h GLU 47 Cb 0.79 -0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 29.23 2ca6 h GLU 47 CO -0.08 0.28 0.55 0.00 -1.18 0.00 0.00 179.01 178.58 2ca6 h ALA 48 N 1.35 1.10 -0.87 2.92 0.00 -1.11 -1.57 119.26 121.08 2ca6 h ALA 48 Ca 0.27 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2ca6 h ALA 48 Cb 0.27 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 2ca6 h ALA 48 CO -0.24 0.41 0.50 0.00 0.00 0.00 0.00 179.25 179.92 2ca6 h ALA 49 N 1.34 1.24 -0.60 0.00 0.00 -0.36 -1.21 119.26 119.66 2ca6 h ALA 49 Ca 0.33 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 2ca6 h ALA 49 Cb -0.04 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.38 2ca6 h ALA 49 CO -0.10 0.63 0.14 -0.09 0.00 0.00 0.00 179.25 179.84 2ca6 h ARG 50 N 1.21 0.93 0.70 0.00 2.43 -0.28 -0.57 114.38 118.80 2ca6 h ARG 50 Ca 0.31 -0.20 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 2ca6 h ARG 50 Cb -0.01 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 29.41 2ca6 h ARG 50 CO -0.05 0.83 -0.34 2.35 -1.51 0.00 0.00 179.97 181.25 2ca6 h TRP 51 N 0.89 -0.87 -0.99 2.20 7.01 -0.67 -3.07 115.95 120.45 2ca6 h TRP 51 Ca 0.19 -0.02 0.17 0.00 2.11 0.00 0.00 58.89 61.34 2ca6 h TRP 51 Cb 0.32 0.29 -0.10 0.00 -2.10 0.00 0.00 29.16 27.57 2ca6 h TRP 51 CO 0.02 -0.51 0.60 -0.07 -2.79 0.00 0.00 178.44 175.69 2ca6 h LEU 52 N -1.14 0.80 -0.43 0.65 3.38 -1.15 -2.13 115.31 115.29 2ca6 h LEU 52 Ca -0.10 0.09 0.07 0.00 0.09 0.00 0.00 57.88 58.03 2ca6 h LEU 52 Cb 0.75 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.37 2ca6 h LEU 52 CO 0.16 0.32 0.05 0.28 0.09 0.00 0.00 178.44 179.34 2ca6 h SER 53 N 0.81 -0.07 0.41 -0.43 0.02 -1.04 0.22 113.55 113.46 2ca6 h SER 53 Ca 0.55 0.08 -0.08 0.00 -0.84 0.00 0.00 61.79 61.50 2ca6 h SER 53 Cb 0.78 0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.44 2ca6 h SER 53 CO -0.35 -0.00 -0.38 -0.33 -1.14 0.00 0.00 176.83 174.62 2ca6 h GLU 54 N 0.17 0.00 -0.27 3.45 5.08 -1.31 -1.72 114.58 119.97 2ca6 h GLU 54 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2ca6 h GLU 54 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2ca6 h GLU 54 CO -0.31 0.38 0.00 0.09 -1.00 0.00 0.00 179.01 178.17 2ca6 n ASN 55 N -4.04 2.18 -0.04 1.42 3.02 -0.38 -4.00 115.26 113.42 2ca6 n ASN 55 Ca -0.02 -1.84 -0.04 0.00 -0.03 0.00 0.00 54.58 52.65 2ca6 n ASN 55 Cb 0.42 -0.18 -0.05 0.00 -0.61 0.00 0.00 39.78 39.36 2ca6 n ASN 55 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2ca6 n ILE 56 N 0.67 0.50 0.43 2.41 5.41 0.62 -4.53 119.36 124.87 2ca6 n ILE 56 Ca 0.16 -0.27 0.11 0.00 1.00 0.00 0.00 62.75 63.75 2ca6 n ILE 56 Cb 0.39 -0.81 0.46 0.00 -0.71 0.00 0.00 39.64 38.97 2ca6 n ILE 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2ca6 n ALA 57 N -2.43 1.69 0.48 -1.39 0.00 -0.69 -1.87 120.51 116.30 2ca6 n ALA 57 Ca -0.13 0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.49 2ca6 n ALA 57 Cb 0.71 -1.37 0.20 0.00 0.00 0.00 0.00 19.45 19.00 2ca6 n ALA 57 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2ca6 h SER 58 N 0.00 0.00 -1.40 0.00 4.64 -1.80 -3.41 113.55 111.59 2ca6 h SER 58 Ca 0.00 -0.11 -0.66 0.00 -0.47 0.00 0.00 61.79 60.55 2ca6 h SER 58 Cb 0.36 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.34 2ca6 h SER 58 CO 0.00 0.05 1.62 -0.54 -0.87 0.00 0.00 176.83 177.10 2ca6 s LYS 59 N -3.18 3.81 0.00 4.77 -0.14 -0.78 -4.78 119.74 119.44 2ca6 s LYS 59 Ca 0.06 -1.77 0.15 0.00 -1.36 0.00 0.00 55.97 53.06 2ca6 s LYS 59 Cb 0.12 -5.31 0.74 0.00 -1.68 0.00 0.00 37.83 31.70 2ca6 s LYS 59 CO 0.70 -2.09 1.46 1.63 -0.76 0.00 0.00 175.35 176.28 2ca6 n LYS 60 N 7.82 0.15 -0.28 1.68 4.76 -1.26 -2.33 118.16 128.70 2ca6 n LYS 60 Ca 0.38 0.17 0.09 0.00 -2.87 0.00 0.00 58.31 56.08 2ca6 n LYS 60 Cb 0.48 -1.50 0.21 0.00 -1.84 0.00 0.00 35.03 32.37 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 -1.36 3.21 -4.72 4.39 9.92 -1.26 -4.32 116.55 122.41 2ca6 n ASP 61 Ca 0.06 -3.05 -0.42 0.00 -0.53 0.00 0.00 54.79 50.85 2ca6 n ASP 61 Cb 0.14 -0.50 -0.03 0.00 -0.64 0.00 0.00 41.12 40.09 2ca6 n ASP 61 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2ca6 s LEU 62 N -2.86 4.40 0.00 0.64 2.96 -0.98 -4.31 118.68 118.53 2ca6 s LEU 62 Ca 0.38 2.04 0.00 0.00 -0.22 0.00 0.00 54.13 56.33 2ca6 s LEU 62 Cb 0.32 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 43.42 2ca6 s LEU 62 CO 0.06 -0.42 0.00 -0.62 -1.32 0.00 0.00 176.35 174.06 2ca6 n GLU 63 N 3.52 3.36 -5.10 1.98 1.02 -0.64 -1.47 120.64 123.31 2ca6 n GLU 63 Ca 0.07 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.91 2ca6 n GLU 63 Cb 0.46 -0.93 -0.17 0.00 -0.02 0.00 0.00 31.44 30.79 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 -1.85 1.90 -0.35 -3.67 1.01 -1.03 -0.83 121.20 116.39 2ca6 s ILE 64 Ca 0.00 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.74 2ca6 s ILE 64 Cb 0.00 -1.65 0.10 0.00 0.01 0.00 0.00 42.46 40.92 2ca6 s ILE 64 CO 0.00 0.52 0.10 0.00 0.00 0.00 0.00 174.94 175.56 2ca6 s ALA 65 N 0.40 2.30 -0.83 9.38 0.00 -0.27 -2.51 121.76 130.23 2ca6 s ALA 65 Ca -0.18 -2.24 -0.18 0.00 0.00 0.00 0.00 51.96 49.37 2ca6 s ALA 65 Cb -0.18 -1.83 0.14 0.00 0.00 0.00 0.00 23.12 21.25 2ca6 s ALA 65 CO 0.08 -1.73 0.97 -2.00 0.00 0.00 0.00 175.76 173.07 2ca6 s GLU 66 N 1.07 3.48 -0.22 0.00 2.56 -0.56 -0.84 118.70 124.19 2ca6 s GLU 66 Ca 0.11 -1.79 0.14 0.00 0.00 0.00 0.00 54.97 53.44 2ca6 s GLU 66 Cb -0.19 -4.65 0.49 0.00 2.00 0.00 0.00 34.13 31.77 2ca6 s GLU 66 CO -0.14 -1.63 1.40 1.19 -0.56 0.00 0.00 175.26 175.52 2ca6 n PHE 67 N 6.01 0.85 -1.73 5.30 3.01 0.12 -1.98 117.46 129.05 2ca6 n PHE 67 Ca 0.14 -1.18 -0.34 0.00 1.01 0.00 0.00 57.45 57.09 2ca6 n PHE 67 Cb 0.47 -0.36 0.06 0.00 -0.01 0.00 0.00 39.48 39.64 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 -2.32 4.89 -0.62 4.37 0.01 -1.05 -4.15 113.70 114.83 2ca6 s SER 68 Ca 0.42 2.15 -0.17 0.00 1.31 0.00 0.00 55.95 59.66 2ca6 s SER 68 Cb 0.36 -2.57 0.03 0.00 0.21 0.00 0.00 66.02 64.04 2ca6 s SER 68 CO 0.04 -1.78 0.64 -0.67 0.41 0.00 0.00 173.24 171.88 2ca6 n ASP 69 N -2.34 -5.93 -0.49 2.44 2.03 -0.01 -3.79 116.55 108.45 2ca6 n ASP 69 Ca 0.12 -0.33 0.00 0.00 0.52 0.00 0.00 54.79 55.10 2ca6 n ASP 69 Cb 0.51 -2.69 0.00 0.00 -0.72 0.00 0.00 41.12 38.22 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 -1.26 0.00 -2.01 5.18 -5.35 -1.25 0.09 119.36 114.75 2ca6 n ILE 70 Ca -0.13 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.35 2ca6 n ILE 70 Cb 0.63 0.49 0.00 0.00 -1.74 0.00 0.00 39.64 39.02 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 0.00 0.00 -2.21 4.28 3.72 -1.25 -0.83 117.46 121.17 2ca6 n PHE 71 Ca 0.00 -0.02 -0.43 0.00 -0.05 0.00 0.00 57.45 56.96 2ca6 n PHE 71 Cb 0.69 -0.02 -0.02 0.00 -0.94 0.00 0.00 39.48 39.18 2ca6 n PHE 71 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2ca6 s THR 72 N 0.00 3.93 0.00 4.37 2.01 -1.26 -2.09 115.64 122.59 2ca6 s THR 72 Ca 0.01 1.11 0.00 0.00 0.31 0.00 0.00 61.69 63.12 2ca6 s THR 72 Cb 0.01 -3.73 0.00 0.00 0.01 0.00 0.00 72.50 68.79 2ca6 s THR 72 CO -0.00 -0.12 0.00 0.61 -0.69 0.00 0.00 174.62 174.42 2ca6 n GLY 73 N 3.92 2.19 3.77 4.40 0.00 -1.26 -4.76 105.19 113.45 2ca6 n GLY 73 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.23 2.95 -0.13 1.61 1.81 -0.89 -4.96 118.95 119.10 2ca6 s ARG 74 Ca 0.00 1.43 -0.29 0.00 -1.72 0.00 0.00 55.73 55.14 2ca6 s ARG 74 Cb 0.00 -1.97 -0.02 0.00 -0.45 0.00 0.00 34.95 32.52 2ca6 s ARG 74 CO 0.00 -1.14 1.17 0.08 -0.68 0.00 0.00 175.30 174.72 2ca6 s VAL 75 N -2.22 4.42 0.28 3.52 1.01 -1.26 -4.90 120.40 121.23 2ca6 s VAL 75 Ca 0.68 1.72 -0.03 0.00 0.00 0.00 0.00 61.98 64.35 2ca6 s VAL 75 Cb -0.21 -4.11 0.41 0.00 0.00 0.00 0.00 36.38 32.48 2ca6 s VAL 75 CO 0.38 -0.08 1.46 1.17 0.00 0.00 0.00 175.10 178.03 2ca6 n LYS 76 N 5.87 -0.08 -0.47 2.72 4.81 -1.26 -0.10 118.16 129.66 2ca6 n LYS 76 Ca 0.12 1.43 -0.05 0.00 -0.87 0.00 0.00 58.31 58.93 2ca6 n LYS 76 Cb 0.46 -2.20 0.11 0.00 0.02 0.00 0.00 35.03 33.42 2ca6 n LYS 76 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2ca6 n ASP 77 N -5.46 3.20 0.00 3.14 10.43 -1.26 -3.29 116.55 123.32 2ca6 n ASP 77 Ca 0.18 -2.57 0.00 0.00 2.57 0.00 0.00 54.79 54.97 2ca6 n ASP 77 Cb 0.59 -0.62 0.00 0.00 1.84 0.00 0.00 41.12 42.93 2ca6 n ASP 77 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2ca6 n GLU 78 N -0.03 -0.05 0.08 -1.24 1.02 0.86 -4.74 120.64 116.55 2ca6 n GLU 78 Ca 0.20 -0.23 -0.05 0.00 -0.02 0.00 0.00 57.16 57.06 2ca6 n GLU 78 Cb 0.87 -0.71 -0.08 0.00 -0.02 0.00 0.00 31.44 31.51 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 0.42 1.53 -0.89 -3.67 2.04 -1.53 -3.38 117.51 112.03 2ca6 h ILE 79 Ca 0.00 -3.13 0.23 0.00 1.00 0.00 0.00 64.86 62.97 2ca6 h ILE 79 Cb 0.21 2.73 -0.13 0.00 -0.74 0.00 0.00 36.82 38.89 2ca6 h ILE 79 CO 0.00 0.86 0.32 -0.65 0.00 0.00 0.00 178.15 178.68 2ca6 h PRO 80 N 0.00 0.28 -0.43 2.37 0.11 -1.85 -1.20 132.00 131.28 2ca6 h PRO 80 Ca -0.01 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 2ca6 h PRO 80 Cb 1.66 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.69 2ca6 h PRO 80 CO 0.11 0.19 0.21 1.49 -0.21 0.00 0.00 178.00 179.79 2ca6 h GLU 81 N 0.29 0.61 -0.27 1.05 4.81 -1.95 -0.44 114.58 118.68 2ca6 h GLU 81 Ca 0.56 -0.09 -0.15 0.00 -0.13 0.00 0.00 59.36 59.56 2ca6 h GLU 81 Cb 1.12 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.39 2ca6 h GLU 81 CO -0.60 0.52 -0.42 0.00 -0.73 0.00 0.00 179.01 177.78 2ca6 h ALA 82 N 1.06 0.42 0.26 2.92 0.00 -1.69 -2.17 119.26 120.06 2ca6 h ALA 82 Ca 0.15 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2ca6 h ALA 82 Cb 0.10 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2ca6 h ALA 82 CO -0.02 0.54 -0.24 1.25 0.00 0.00 0.00 179.25 180.78 2ca6 h LEU 83 N 0.52 -0.65 -0.43 0.00 5.85 -1.09 -0.38 115.31 119.13 2ca6 h LEU 83 Ca 0.02 0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.88 2ca6 h LEU 83 Cb 1.02 0.22 -0.07 0.00 0.37 0.00 0.00 40.66 42.21 2ca6 h LEU 83 CO 0.10 -0.36 0.03 -0.09 -0.34 0.00 0.00 178.44 177.78 2ca6 h ARG 84 N -0.53 0.14 -0.98 1.25 2.43 -1.09 0.24 114.38 115.84 2ca6 h ARG 84 Ca -0.01 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.21 2ca6 h ARG 84 Cb 0.49 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.94 2ca6 h ARG 84 CO -0.04 0.09 0.64 -0.07 -1.51 0.00 0.00 179.97 179.08 2ca6 h LEU 85 N 0.15 1.02 -0.00 3.80 3.38 -1.11 -0.11 115.31 122.43 2ca6 h LEU 85 Ca 0.21 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 2ca6 h LEU 85 Cb 0.29 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2ca6 h LEU 85 CO -0.32 0.66 -0.07 -0.07 0.09 0.00 0.00 178.44 178.73 2ca6 h LEU 86 N 1.16 0.06 -1.40 1.67 3.38 -0.15 -3.11 115.31 116.92 2ca6 h LEU 86 Ca 0.41 -0.77 -0.05 0.00 0.09 0.00 0.00 57.88 57.57 2ca6 h LEU 86 Cb 0.14 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2ca6 h LEU 86 CO -0.16 0.82 -0.08 -0.07 0.09 0.00 0.00 178.44 179.04 2ca6 h LEU 87 N -0.69 0.28 -0.71 1.67 3.38 -0.44 -2.03 115.31 116.78 2ca6 h LEU 87 Ca -0.01 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2ca6 h LEU 87 Cb 0.83 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 2ca6 h LEU 87 CO 0.01 0.40 -0.33 1.56 0.09 0.00 0.00 178.44 180.17 2ca6 h GLN 88 N 0.29 0.00 0.05 1.13 4.20 -1.12 -2.13 115.11 117.52 2ca6 h GLN 88 Ca 0.06 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.53 2ca6 h GLN 88 Cb 0.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 2ca6 h GLN 88 CO 0.02 0.33 -1.05 0.00 -0.67 0.00 0.00 178.83 177.46 2ca6 h ALA 89 N 1.67 0.27 -0.13 3.87 0.00 -1.35 -3.23 119.26 120.35 2ca6 h ALA 89 Ca -0.00 -0.76 -0.11 0.00 0.00 0.00 0.00 54.91 54.03 2ca6 h ALA 89 Cb 0.98 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2ca6 h ALA 89 CO 0.04 0.85 -0.43 -0.07 0.00 0.00 0.00 179.25 179.65 2ca6 h LEU 90 N 0.18 0.32 0.00 0.00 3.38 -1.19 -2.49 115.31 115.51 2ca6 h LEU 90 Ca -0.10 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2ca6 h LEU 90 Cb 1.71 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.37 2ca6 h LEU 90 CO 0.18 0.71 0.00 -0.11 0.09 0.00 0.00 178.44 179.31 2ca6 n LEU 91 N -4.01 0.00 -0.90 1.67 7.94 -0.82 -0.57 117.00 120.31 2ca6 n LEU 91 Ca -0.02 0.33 0.11 0.00 -1.11 0.00 0.00 56.01 55.33 2ca6 n LEU 91 Cb 0.50 -0.33 0.10 0.00 0.53 0.00 0.00 43.42 44.21 2ca6 n LEU 91 CO 0.43 -0.25 0.61 0.29 -1.11 0.00 0.00 177.39 177.35 2ca6 n LYS 92 N -1.33 2.09 -3.39 1.96 5.02 -0.94 -4.78 118.16 116.80 2ca6 n LYS 92 Ca 0.03 -1.85 -0.44 0.00 -2.02 0.00 0.00 58.31 54.03 2ca6 n LYS 92 Cb 0.06 -1.43 -0.06 0.00 -0.02 0.00 0.00 35.03 33.58 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 8.73 0.00 -0.67 0.00 0.13 -1.84 -2.60 132.00 135.75 2ca6 h PRO 94 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2ca6 h PRO 94 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2ca6 h PRO 94 CO 0.98 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.38 2ca6 n LYS 95 N -4.28 2.70 -2.40 0.86 5.02 -1.26 -4.73 118.16 114.08 2ca6 n LYS 95 Ca -0.03 -2.59 -0.41 0.00 -2.02 0.00 0.00 58.31 53.26 2ca6 n LYS 95 Cb 0.09 -1.55 -0.03 0.00 -0.02 0.00 0.00 35.03 33.52 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 -1.08 3.28 -0.09 -0.35 2.96 -0.54 -3.97 118.68 118.89 2ca6 s LEU 96 Ca 0.47 -0.03 0.20 0.00 -0.22 0.00 0.00 54.13 54.55 2ca6 s LEU 96 Cb 0.25 -2.75 -0.28 0.00 0.50 0.00 0.00 46.19 43.91 2ca6 s LEU 96 CO 0.33 -1.88 0.35 0.00 -1.32 0.00 0.00 176.35 173.82 2ca6 n HIS 97 N 10.05 0.10 -4.84 5.38 1.44 -0.01 -3.67 115.22 123.67 2ca6 n HIS 97 Ca 0.10 0.03 -0.31 0.00 -2.01 0.00 0.00 57.72 55.53 2ca6 n HIS 97 Cb 0.50 -0.77 -0.17 0.00 0.12 0.00 0.00 29.99 29.67 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 -3.03 1.87 -0.07 0.61 2.01 -0.36 0.25 115.64 116.91 2ca6 s THR 98 Ca -0.08 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.04 2ca6 s THR 98 Cb 0.10 -1.65 0.02 0.00 0.01 0.00 0.00 72.50 70.98 2ca6 s THR 98 CO 0.87 0.52 -0.07 -0.69 -0.69 0.00 0.00 174.62 174.55 2ca6 s VAL 99 N 0.65 0.79 -0.13 3.82 1.01 -0.34 -1.11 120.40 125.08 2ca6 s VAL 99 Ca -0.12 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.65 2ca6 s VAL 99 Cb -0.16 -0.80 0.00 0.00 0.00 0.00 0.00 36.38 35.42 2ca6 s VAL 99 CO 0.03 0.30 -0.19 -0.13 0.00 0.00 0.00 175.10 175.10 2ca6 s ARG 100 N 1.14 3.14 -0.04 2.72 0.52 -0.02 -1.27 118.95 125.14 2ca6 s ARG 100 Ca -0.07 -0.81 0.20 0.00 -0.52 0.00 0.00 55.73 54.53 2ca6 s ARG 100 Cb -0.14 -2.48 0.36 0.00 0.52 0.00 0.00 34.95 33.21 2ca6 s ARG 100 CO -0.01 0.08 1.15 1.28 0.02 0.00 0.00 175.30 177.82 2ca6 n LEU 101 N 3.85 1.18 -4.70 2.53 4.77 0.60 -0.71 117.00 124.51 2ca6 n LEU 101 Ca -0.19 -2.20 -0.29 0.00 -0.03 0.00 0.00 56.01 53.30 2ca6 n LEU 101 Cb 0.52 -0.10 0.16 0.00 -2.33 0.00 0.00 43.42 41.67 2ca6 n LEU 101 CO 0.28 0.62 0.66 -0.44 -1.33 0.00 0.00 177.39 177.18 2ca6 s SER 102 N -2.09 2.91 -1.58 -1.43 0.01 -1.21 -4.06 113.70 106.25 2ca6 s SER 102 Ca 0.30 1.17 -0.15 0.00 1.31 0.00 0.00 55.95 58.58 2ca6 s SER 102 Cb 0.33 -1.83 0.11 0.00 0.21 0.00 0.00 66.02 64.84 2ca6 s SER 102 CO -0.12 -2.95 0.92 0.47 0.41 0.00 0.00 173.24 171.97 2ca6 n ASP 103 N -4.06 -4.30 -3.84 2.44 8.00 0.29 -0.83 116.55 114.26 2ca6 n ASP 103 Ca 0.06 -0.85 -0.24 0.00 0.71 0.00 0.00 54.79 54.47 2ca6 n ASP 103 Cb 0.57 -3.55 -0.17 0.00 -0.02 0.00 0.00 41.12 37.95 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 -3.33 1.67 -0.53 -2.24 0.01 -1.13 -3.31 114.94 106.09 2ca6 s ASN 104 Ca 0.67 -0.17 -0.28 0.00 -0.71 0.00 0.00 52.86 52.38 2ca6 s ASN 104 Cb -0.35 -0.58 0.01 0.00 0.41 0.00 0.00 41.25 40.75 2ca6 s ASN 104 CO 0.86 -0.14 1.42 0.00 -1.51 0.00 0.00 177.10 177.73 2ca6 s ALA 105 N 1.67 2.86 -0.48 0.60 0.00 -1.26 -4.18 121.76 120.96 2ca6 s ALA 105 Ca 0.02 -0.55 -0.10 0.00 0.00 0.00 0.00 51.96 51.33 2ca6 s ALA 105 Cb -0.13 -4.06 0.12 0.00 0.00 0.00 0.00 23.12 19.05 2ca6 s ALA 105 CO -0.05 -2.81 0.36 -0.06 0.00 0.00 0.00 175.76 173.20 2ca6 s PHE 106 N 5.95 3.42 1.01 0.00 0.08 -0.91 -4.92 117.98 122.60 2ca6 s PHE 106 Ca 0.55 -1.84 -0.14 0.00 0.12 0.00 0.00 56.93 55.61 2ca6 s PHE 106 Cb -0.11 -3.52 0.19 0.00 -0.57 0.00 0.00 43.02 39.00 2ca6 s PHE 106 CO 0.27 -1.00 1.13 0.20 -0.10 0.00 0.00 175.22 175.72 2ca6 s GLY 107 N 2.72 1.59 0.62 4.36 0.00 -1.26 -4.65 107.32 110.70 2ca6 s GLY 107 Ca 0.06 -0.61 0.27 0.00 0.00 0.00 0.00 44.72 44.44 2ca6 s GLY 107 CO -0.01 0.05 1.81 -2.55 0.00 0.00 0.00 173.10 172.40 2ca6 h PRO 108 N -1.88 0.00 0.08 2.90 0.11 -1.97 -1.38 132.00 129.87 2ca6 h PRO 108 Ca -0.51 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.45 2ca6 h PRO 108 Cb 1.32 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.44 2ca6 h PRO 108 CO 0.53 0.00 -0.73 1.15 -0.21 0.00 0.00 178.00 178.75 2ca6 h THR 109 N 0.00 1.46 0.00 -1.15 2.02 -1.95 -3.24 112.91 110.04 2ca6 h THR 109 Ca 0.13 -2.43 0.00 0.00 0.77 0.00 0.00 66.41 64.88 2ca6 h THR 109 Cb 1.14 3.09 0.00 0.00 -1.74 0.00 0.00 68.15 70.64 2ca6 h THR 109 CO -0.00 0.65 0.00 0.00 0.37 0.00 0.00 175.52 176.54 2ca6 h ALA 110 N -0.01 1.00 0.00 6.16 0.00 -1.60 -2.45 119.26 122.36 2ca6 h ALA 110 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2ca6 h ALA 110 Cb 1.45 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2ca6 h ALA 110 CO 0.06 0.00 0.00 1.96 0.00 0.00 0.00 179.25 181.27 2ca6 h GLN 111 N 0.00 0.00 0.63 0.00 4.20 -1.43 -3.25 115.11 115.26 2ca6 h GLN 111 Ca 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 2ca6 h GLN 111 Cb 0.14 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.93 2ca6 h GLN 111 CO 0.00 0.00 -0.30 0.93 -0.67 0.00 0.00 178.83 178.79 2ca6 h GLU 112 N 0.00 -0.81 0.00 1.46 4.39 -1.59 0.26 114.58 118.28 2ca6 h GLU 112 Ca 0.00 0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 2ca6 h GLU 112 Cb 0.59 0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 29.43 2ca6 h GLU 112 CO 0.00 -0.53 -0.03 -1.00 -1.16 0.00 0.00 179.01 176.30 2ca6 h PRO 113 N -1.20 0.00 -0.37 2.33 0.13 -1.78 -1.12 132.00 129.99 2ca6 h PRO 113 Ca -0.09 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.99 2ca6 h PRO 113 Cb 0.66 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.78 2ca6 h PRO 113 CO 0.14 0.03 0.01 1.25 -0.23 0.00 0.00 178.00 179.20 2ca6 h LEU 114 N 0.00 0.63 -0.12 1.56 5.85 -1.56 -1.72 115.31 119.95 2ca6 h LEU 114 Ca -0.00 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 2ca6 h LEU 114 Cb 0.05 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 40.91 2ca6 h LEU 114 CO 0.00 0.77 -0.00 0.40 -0.34 0.00 0.00 178.44 179.28 2ca6 h ILE 115 N 0.47 1.25 -0.09 4.05 2.04 0.00 -1.08 117.51 124.16 2ca6 h ILE 115 Ca 0.11 -0.82 0.02 0.00 1.00 0.00 0.00 64.86 65.17 2ca6 h ILE 115 Cb 0.44 1.57 -0.02 0.00 -0.74 0.00 0.00 36.82 38.07 2ca6 h ILE 115 CO 0.02 0.23 -0.03 -0.78 0.00 0.00 0.00 178.15 177.59 2ca6 h ASP 116 N -0.07 -0.12 0.70 1.72 1.82 -1.23 -0.82 116.42 118.42 2ca6 h ASP 116 Ca 0.03 0.03 -0.03 0.00 -0.39 0.00 0.00 57.03 56.67 2ca6 h ASP 116 Cb 0.36 0.07 -0.00 0.00 0.68 0.00 0.00 39.33 40.44 2ca6 h ASP 116 CO 0.01 -0.05 -0.44 0.15 -1.61 0.00 0.00 179.24 177.30 2ca6 h PHE 117 N -0.02 -1.16 -0.88 0.28 3.57 -1.32 -1.53 116.94 115.88 2ca6 h PHE 117 Ca 0.05 -0.01 0.23 0.00 3.53 0.00 0.00 57.97 61.76 2ca6 h PHE 117 Cb 0.09 0.41 -0.05 0.00 2.79 0.00 0.00 35.95 39.19 2ca6 h PHE 117 CO -0.15 -0.66 0.61 -0.07 -2.23 0.00 0.00 178.31 175.81 2ca6 h LEU 118 N -1.07 0.20 0.00 0.59 3.38 -1.07 0.16 115.31 117.50 2ca6 h LEU 118 Ca -0.09 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2ca6 h LEU 118 Cb 0.87 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2ca6 h LEU 118 CO 0.09 0.08 -0.37 0.77 0.09 0.00 0.00 178.44 179.09 2ca6 h SER 119 N 0.20 0.00 0.00 -0.43 4.64 -0.83 -3.39 113.55 113.74 2ca6 h SER 119 Ca 0.44 -0.06 -0.07 0.00 -0.47 0.00 0.00 61.79 61.63 2ca6 h SER 119 Cb 1.42 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.49 2ca6 h SER 119 CO -0.10 0.03 -1.64 0.29 -0.87 0.00 0.00 176.83 174.54 2ca6 n LYS 120 N -2.51 0.96 -2.42 4.77 5.02 0.36 -3.45 118.16 120.88 2ca6 n LYS 120 Ca 0.03 -0.08 -0.38 0.00 -2.02 0.00 0.00 58.31 55.87 2ca6 n LYS 120 Cb 0.48 -1.29 -0.03 0.00 -0.02 0.00 0.00 35.03 34.17 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 -2.66 2.45 0.12 2.13 2.46 -0.02 -4.82 115.29 114.95 2ca6 s HIS 121 Ca -0.05 -0.77 0.33 0.00 0.47 0.00 0.00 55.06 55.04 2ca6 s HIS 121 Cb 0.06 -4.52 1.63 0.00 -0.13 0.00 0.00 32.58 29.62 2ca6 s HIS 121 CO 0.50 -1.73 2.00 1.79 -2.47 0.00 0.00 174.74 174.83 2ca6 h THR 122 N 6.22 0.00 -0.01 0.89 1.35 -1.90 -2.45 112.91 117.02 2ca6 h THR 122 Ca 0.30 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.99 2ca6 h THR 122 Cb 0.94 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 2ca6 h THR 122 CO 1.38 0.00 -0.03 -0.81 -0.25 0.00 0.00 175.52 175.81 2ca6 n PRO 123 N -2.74 1.22 -1.92 4.72 -0.04 -1.26 -4.33 135.00 130.66 2ca6 n PRO 123 Ca -0.01 -0.49 -0.41 0.00 -0.04 0.00 0.00 63.50 62.54 2ca6 n PRO 123 Cb 0.15 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.10 2ca6 n PRO 123 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2ca6 s LEU 124 N -2.12 4.37 0.00 1.53 2.96 -0.92 -3.95 118.68 120.55 2ca6 s LEU 124 Ca 0.39 2.81 0.00 0.00 -0.22 0.00 0.00 54.13 57.11 2ca6 s LEU 124 Cb 0.21 -3.64 0.00 0.00 0.50 0.00 0.00 46.19 43.27 2ca6 s LEU 124 CO 0.38 -0.77 0.00 -0.62 -1.32 0.00 0.00 176.35 174.02 2ca6 n GLU 125 N 1.90 0.78 -3.95 1.98 1.02 0.14 -4.28 120.64 118.23 2ca6 n GLU 125 Ca 0.06 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.92 2ca6 n GLU 125 Cb 0.39 -0.66 -0.17 0.00 -0.02 0.00 0.00 31.44 30.99 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 -1.32 1.79 -0.05 -0.32 3.76 0.05 0.49 115.29 119.68 2ca6 s HIS 126 Ca 0.00 -0.98 0.06 0.00 -0.15 0.00 0.00 55.06 54.00 2ca6 s HIS 126 Cb 0.00 -1.39 -0.01 0.00 1.11 0.00 0.00 32.58 32.29 2ca6 s HIS 126 CO 0.00 -0.59 -0.24 -1.17 -0.85 0.00 0.00 174.74 171.89 2ca6 s LEU 127 N 1.61 2.14 -0.20 0.89 2.96 -0.90 -1.20 118.68 123.97 2ca6 s LEU 127 Ca 0.04 -0.47 0.00 0.00 -0.22 0.00 0.00 54.13 53.48 2ca6 s LEU 127 Cb -0.13 -1.39 0.05 0.00 0.50 0.00 0.00 46.19 45.22 2ca6 s LEU 127 CO -0.09 0.26 -0.06 -0.31 -1.32 0.00 0.00 176.35 174.84 2ca6 s TYR 128 N -0.28 2.07 -0.43 5.38 1.51 -0.39 -1.13 117.35 124.07 2ca6 s TYR 128 Ca 0.00 -1.44 0.06 0.00 -1.01 0.00 0.00 57.07 54.68 2ca6 s TYR 128 Cb -0.13 -1.46 0.22 0.00 -0.11 0.00 0.00 41.96 40.48 2ca6 s TYR 128 CO 0.03 -0.71 0.47 -0.11 -1.11 0.00 0.00 175.55 174.12 2ca6 n LEU 129 N 4.77 0.33 -4.37 -1.29 7.94 0.11 -0.29 117.00 124.19 2ca6 n LEU 129 Ca -0.12 -4.65 -0.33 0.00 -1.11 0.00 0.00 56.01 49.80 2ca6 n LEU 129 Cb 0.46 0.43 -0.14 0.00 0.53 0.00 0.00 43.42 44.70 2ca6 n LEU 129 CO 0.17 1.97 -0.45 -2.28 -1.11 0.00 0.00 177.39 175.69 2ca6 s HIS 130 N -0.82 2.79 -0.45 1.96 2.46 -1.26 -3.88 115.29 116.10 2ca6 s HIS 130 Ca 0.34 -0.61 -0.05 0.00 0.47 0.00 0.00 55.06 55.21 2ca6 s HIS 130 Cb 0.11 -1.81 0.01 0.00 -0.13 0.00 0.00 32.58 30.75 2ca6 s HIS 130 CO -0.14 -0.18 0.48 -1.71 -2.47 0.00 0.00 174.74 170.72 2ca6 n ASN 131 N 3.39 -6.28 0.00 9.88 5.15 -0.55 -0.54 115.26 126.31 2ca6 n ASN 131 Ca -0.18 0.13 0.00 0.00 -0.60 0.00 0.00 54.58 53.93 2ca6 n ASN 131 Cb 0.53 -4.17 0.00 0.00 -0.53 0.00 0.00 39.78 35.60 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 -1.06 0.57 -2.59 1.20 4.13 -1.24 -2.00 115.26 114.26 2ca6 n ASN 132 Ca 0.04 -1.16 -0.21 0.00 1.68 0.00 0.00 54.58 54.92 2ca6 n ASN 132 Cb 0.43 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.68 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 -0.08 -0.51 0.07 7.41 0.00 -1.26 -2.15 105.19 108.67 2ca6 n GLY 133 Ca 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.41 -0.19 0.00 0.99 3.38 -1.83 -3.47 115.31 113.79 2ca6 h LEU 134 Ca -0.51 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2ca6 h LEU 134 Cb 1.37 0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.17 2ca6 h LEU 134 CO 0.58 -0.11 0.00 0.61 0.09 0.00 0.00 178.44 179.61 2ca6 n GLY 135 N -1.09 0.54 0.09 0.83 0.00 0.16 -4.22 105.19 101.51 2ca6 n GLY 135 Ca -0.02 -2.11 -0.11 0.00 0.00 0.00 0.00 46.02 43.78 2ca6 n GLY 135 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ca6 h PRO 136 N 0.00 0.19 0.51 1.61 0.13 -1.55 0.23 132.00 133.12 2ca6 h PRO 136 Ca 0.00 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.08 2ca6 h PRO 136 Cb 0.00 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.08 2ca6 h PRO 136 CO 0.00 0.30 -0.48 0.37 -0.23 0.00 0.00 178.00 177.96 2ca6 h GLN 137 N 0.04 -0.95 0.00 0.86 5.75 -1.88 -1.64 115.11 117.30 2ca6 h GLN 137 Ca 0.04 0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.56 2ca6 h GLN 137 Cb 0.18 0.22 -0.01 0.00 1.07 0.00 0.00 27.48 28.94 2ca6 h GLN 137 CO -0.00 -0.63 -0.21 0.00 -2.65 0.00 0.00 178.83 175.33 2ca6 h ALA 138 N -0.79 1.17 -0.36 3.38 0.00 -1.73 -2.91 119.26 118.01 2ca6 h ALA 138 Ca -0.06 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 2ca6 h ALA 138 Cb 0.85 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2ca6 h ALA 138 CO -0.05 0.26 0.01 0.78 0.00 0.00 0.00 179.25 180.25 2ca6 h GLY 139 N 1.43 0.68 2.00 0.00 0.00 -0.04 -2.38 103.07 104.76 2ca6 h GLY 139 Ca -0.00 -0.50 -0.05 0.00 0.00 0.00 0.00 47.33 46.78 2ca6 h GLY 139 CO 0.03 0.46 -0.26 0.00 0.00 0.00 0.00 176.54 176.76 2ca6 h ALA 140 N 0.87 1.53 -0.49 3.60 0.00 -1.12 -1.83 119.26 121.83 2ca6 h ALA 140 Ca 0.10 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 2ca6 h ALA 140 Cb 0.45 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2ca6 h ALA 140 CO 0.02 0.33 -0.08 0.87 0.00 0.00 0.00 179.25 180.39 2ca6 h LYS 141 N 0.00 0.87 -0.12 0.00 1.57 -1.32 0.29 116.57 117.85 2ca6 h LYS 141 Ca -0.00 -0.28 -0.03 0.00 -1.87 0.00 0.00 60.65 58.47 2ca6 h LYS 141 Cb 0.47 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.70 2ca6 h LYS 141 CO 0.03 0.91 -0.02 0.82 -0.57 0.00 0.00 179.45 180.62 2ca6 h ILE 142 N 0.79 1.28 0.00 1.86 1.08 -0.93 -1.24 117.51 120.35 2ca6 h ILE 142 Ca 0.14 -0.94 0.03 0.00 -0.39 0.00 0.00 64.86 63.70 2ca6 h ILE 142 Cb 0.58 1.65 -0.05 0.00 -3.07 0.00 0.00 36.82 35.93 2ca6 h ILE 142 CO 0.04 0.27 -0.32 0.00 -0.69 0.00 0.00 178.15 177.45 2ca6 h ALA 143 N 0.71 -0.46 -0.38 1.87 0.00 -1.05 0.62 119.26 120.56 2ca6 h ALA 143 Ca 0.03 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.98 2ca6 h ALA 143 Cb 0.43 0.56 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 2ca6 h ALA 143 CO 0.01 -0.83 0.09 -0.09 0.00 0.00 0.00 179.25 178.43 2ca6 h ARG 144 N -0.47 0.21 -0.64 0.00 2.43 -0.39 -1.47 114.38 114.05 2ca6 h ARG 144 Ca 0.06 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2ca6 h ARG 144 Cb 0.55 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 2ca6 h ARG 144 CO -0.26 0.14 0.40 0.00 -1.51 0.00 0.00 179.97 178.74 2ca6 h ALA 145 N 1.28 0.82 0.00 2.80 0.00 -0.83 -1.64 119.26 121.70 2ca6 h ALA 145 Ca 0.18 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2ca6 h ALA 145 Cb 0.21 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2ca6 h ALA 145 CO -0.23 0.28 -0.05 -0.07 0.00 0.00 0.00 179.25 179.18 2ca6 h LEU 146 N 0.87 0.00 -0.44 0.00 3.38 -0.25 -0.13 115.31 118.75 2ca6 h LEU 146 Ca 0.23 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.03 2ca6 h LEU 146 Cb -0.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2ca6 h LEU 146 CO -0.05 0.05 -0.77 1.56 0.09 0.00 0.00 178.44 179.32 2ca6 h GLN 147 N 0.00 0.12 -0.04 1.13 4.20 -0.32 -2.94 115.11 117.27 2ca6 h GLN 147 Ca -0.00 -0.12 -0.12 0.00 0.06 0.00 0.00 58.65 58.47 2ca6 h GLN 147 Cb 0.21 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 2ca6 h GLN 147 CO 0.01 0.83 -0.55 0.93 -0.67 0.00 0.00 178.83 179.38 2ca6 h GLU 148 N 0.08 0.10 -0.70 1.46 5.08 -0.71 -3.02 114.58 116.87 2ca6 h GLU 148 Ca -0.02 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 2ca6 h GLU 148 Cb 1.36 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.58 2ca6 h GLU 148 CO 0.11 0.63 0.32 1.25 -1.00 0.00 0.00 179.01 180.32 2ca6 h LEU 149 N 0.08 0.93 -0.54 1.33 5.85 -1.24 -2.14 115.31 119.58 2ca6 h LEU 149 Ca -0.00 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.59 2ca6 h LEU 149 Cb 1.00 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.76 2ca6 h LEU 149 CO 0.08 0.82 0.33 0.00 -0.34 0.00 0.00 178.44 179.33 2ca6 h ALA 150 N 1.15 0.69 -0.09 1.25 0.00 -1.40 0.28 119.26 121.13 2ca6 h ALA 150 Ca 0.24 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2ca6 h ALA 150 Cb 0.15 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2ca6 h ALA 150 CO -0.03 0.06 0.05 0.28 0.00 0.00 0.00 179.25 179.62 2ca6 h VAL 151 N 0.67 1.07 -0.45 0.00 2.07 -1.47 0.12 116.25 118.25 2ca6 h VAL 151 Ca 0.21 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 2ca6 h VAL 151 Cb -0.01 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2ca6 h VAL 151 CO -0.08 0.06 0.17 0.78 0.02 0.00 0.00 177.57 178.53 2ca6 h ASN 152 N 0.07 0.63 -0.55 0.57 2.35 -1.11 -1.36 115.58 116.18 2ca6 h ASN 152 Ca 0.03 -0.18 0.03 0.00 -0.55 0.00 0.00 56.30 55.64 2ca6 h ASN 152 Cb 0.06 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.22 2ca6 h ASN 152 CO -0.01 0.63 0.32 0.11 -1.65 0.00 0.00 177.43 176.83 2ca6 h LYS 153 N 0.58 0.60 -0.85 0.81 1.57 -0.30 -1.36 116.57 117.62 2ca6 h LYS 153 Ca 0.15 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 2ca6 h LYS 153 Cb 0.21 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.34 2ca6 h LYS 153 CO -0.01 0.40 0.49 -0.22 -0.57 0.00 0.00 179.45 179.53 2ca6 h LYS 154 N 0.62 1.17 -0.00 3.15 3.64 -0.41 0.76 116.57 125.50 2ca6 h LYS 154 Ca 0.23 -0.12 -0.18 0.00 -1.27 0.00 0.00 60.65 59.31 2ca6 h LYS 154 Cb 0.07 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.63 2ca6 h LYS 154 CO -0.12 0.84 -0.81 0.00 -2.27 0.00 0.00 179.45 177.09 2ca6 h ALA 155 N 1.35 0.65 -0.02 5.00 0.00 -0.95 -3.25 119.26 122.04 2ca6 h ALA 155 Ca 0.30 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2ca6 h ALA 155 Cb -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2ca6 h ALA 155 CO -0.05 0.93 -0.03 1.63 0.00 0.00 0.00 179.25 181.73 2ca6 n LYS 156 N -3.65 1.93 -1.17 0.00 5.02 -0.54 -4.94 118.16 114.81 2ca6 n LYS 156 Ca -0.02 -1.40 -0.06 0.00 -2.02 0.00 0.00 58.31 54.81 2ca6 n LYS 156 Cb 0.76 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 34.28 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 0.68 -4.95 -4.51 4.39 3.02 0.16 -4.97 115.26 109.08 2ca6 n ASN 157 Ca 0.16 0.15 -0.32 0.00 -0.03 0.00 0.00 54.58 54.54 2ca6 n ASN 157 Cb 0.47 -2.97 0.16 0.00 -0.61 0.00 0.00 39.78 36.83 2ca6 n ASN 157 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ca6 n ALA 158 N 1.11 -2.09 -1.27 5.41 0.00 -0.59 -4.96 120.51 118.13 2ca6 n ALA 158 Ca -0.06 -0.73 -0.33 0.00 0.00 0.00 0.00 53.44 52.32 2ca6 n ALA 158 Cb 0.40 -1.96 0.09 0.00 0.00 0.00 0.00 19.45 17.99 2ca6 n ALA 158 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2ca6 s PRO 159 N -4.11 2.16 0.55 0.00 0.02 -1.26 -4.84 135.00 127.52 2ca6 s PRO 159 Ca 0.62 1.50 -0.14 0.00 0.02 0.00 0.00 61.00 63.00 2ca6 s PRO 159 Cb -0.21 -1.86 -0.06 0.00 0.02 0.00 0.00 34.50 32.38 2ca6 s PRO 159 CO 0.63 -1.77 1.00 -1.25 -0.33 0.00 0.00 177.00 175.28 2ca6 s PRO 160 N -4.29 3.81 0.04 5.54 0.04 -1.26 -4.88 135.00 133.99 2ca6 s PRO 160 Ca 0.68 0.86 -0.30 0.00 0.04 0.00 0.00 61.00 62.28 2ca6 s PRO 160 Cb -0.23 -2.12 -0.06 0.00 0.04 0.00 0.00 34.50 32.13 2ca6 s PRO 160 CO 0.48 -0.38 1.32 -1.17 0.04 0.00 0.00 177.00 177.29 2ca6 s LEU 161 N -4.50 4.34 -0.19 -3.56 2.96 -1.26 -4.63 118.68 111.84 2ca6 s LEU 161 Ca 0.57 2.10 0.02 0.00 -0.22 0.00 0.00 54.13 56.60 2ca6 s LEU 161 Cb -0.10 -3.57 -0.13 0.00 0.50 0.00 0.00 46.19 42.88 2ca6 s LEU 161 CO 0.40 -0.62 -0.15 0.54 -1.32 0.00 0.00 176.35 175.20 2ca6 n ARG 162 N 4.65 0.57 -4.65 1.98 5.12 0.18 -3.83 116.66 120.67 2ca6 n ARG 162 Ca 0.11 0.10 -0.26 0.00 -1.93 0.00 0.00 57.85 55.87 2ca6 n ARG 162 Cb 0.44 -1.39 -0.14 0.00 -1.16 0.00 0.00 32.46 30.22 2ca6 n ARG 162 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2ca6 s SER 163 N -5.79 2.67 -0.29 0.55 0.01 0.11 -0.49 113.70 110.47 2ca6 s SER 163 Ca -0.25 -0.56 -0.03 0.00 1.31 0.00 0.00 55.95 56.42 2ca6 s SER 163 Cb 0.07 -0.22 0.11 0.00 0.21 0.00 0.00 66.02 66.19 2ca6 s SER 163 CO 0.46 0.17 0.19 -0.63 0.41 0.00 0.00 173.24 173.84 2ca6 s ILE 164 N -0.85 -0.18 -0.39 1.44 1.01 -0.65 -2.13 121.20 119.45 2ca6 s ILE 164 Ca 0.09 -0.69 -0.09 0.00 0.00 0.00 0.00 60.65 59.96 2ca6 s ILE 164 Cb -0.09 -0.98 0.06 0.00 0.01 0.00 0.00 42.46 41.45 2ca6 s ILE 164 CO 0.02 -0.64 0.22 -0.63 0.00 0.00 0.00 174.94 173.91 2ca6 s ILE 165 N 2.16 4.27 -0.33 2.92 -1.09 -0.28 -1.22 121.20 127.62 2ca6 s ILE 165 Ca 0.09 -1.20 0.00 0.00 -2.23 0.00 0.00 60.65 57.31 2ca6 s ILE 165 Cb -0.15 -3.52 0.14 0.00 -1.58 0.00 0.00 42.46 37.35 2ca6 s ILE 165 CO -0.35 -0.38 0.27 0.00 -1.23 0.00 0.00 174.94 173.25 2ca6 s GLY 167 N 1.62 2.25 -1.28 0.00 0.00 -1.25 -4.00 107.32 104.66 2ca6 s GLY 167 Ca 0.14 -1.65 -0.10 0.00 0.00 0.00 0.00 44.72 43.11 2ca6 s GLY 167 CO -0.14 -1.66 0.62 -2.13 0.00 0.00 0.00 173.10 169.79 2ca6 n ARG 168 N -0.69 -2.57 -0.45 2.90 0.63 0.11 -1.48 116.66 115.11 2ca6 n ARG 168 Ca -0.01 0.45 0.00 0.00 -0.92 0.00 0.00 57.85 57.37 2ca6 n ARG 168 Cb 0.65 -4.40 0.00 0.00 0.45 0.00 0.00 32.46 29.15 2ca6 n ARG 168 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 2ca6 n ASN 169 N -2.85 0.00 -4.18 6.15 3.02 -1.25 -2.03 115.26 114.13 2ca6 n ASN 169 Ca -0.21 -1.65 -0.33 0.00 -0.03 0.00 0.00 54.58 52.35 2ca6 n ASN 169 Cb 0.64 -0.13 -0.04 0.00 -0.61 0.00 0.00 39.78 39.64 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 0.00 -2.75 -0.17 3.52 1.74 -1.26 0.40 116.66 118.14 2ca6 n ARG 170 Ca 0.00 0.33 -0.03 0.00 -0.77 0.00 0.00 57.85 57.38 2ca6 n ARG 170 Cb 0.63 -4.70 0.18 0.00 -1.02 0.00 0.00 32.46 27.55 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 -1.60 0.84 0.00 0.55 3.38 -1.73 -2.25 115.31 114.50 2ca6 h LEU 171 Ca -0.61 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.23 2ca6 h LEU 171 Cb 1.38 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2ca6 h LEU 171 CO 0.73 0.77 0.00 -1.84 0.09 0.00 0.00 178.44 178.19 2ca6 n GLU 172 N -4.30 0.00 -0.01 1.13 0.28 -0.70 -3.42 120.64 113.62 2ca6 n GLU 172 Ca 0.05 0.00 -0.04 0.00 -0.16 0.00 0.00 57.16 57.01 2ca6 n GLU 172 Cb 0.19 0.00 0.17 0.00 1.43 0.00 0.00 31.44 33.23 2ca6 n GLU 172 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 2ca6 h ASN 173 N 0.00 0.55 0.00 -1.84 2.35 -1.89 -3.30 115.58 111.45 2ca6 h ASN 173 Ca 0.00 -0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 2ca6 h ASN 173 Cb 0.00 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.22 2ca6 h ASN 173 CO 0.00 0.79 0.04 0.61 -1.65 0.00 0.00 177.43 177.22 2ca6 n GLY 174 N -0.35 -0.43 0.00 2.83 0.00 -1.26 -1.78 105.19 104.21 2ca6 n GLY 174 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ca6 n GLY 174 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ca6 n SER 175 N -1.43 1.32 0.21 1.61 3.41 -1.22 -4.78 113.62 112.74 2ca6 n SER 175 Ca 0.00 -1.60 0.07 0.00 -0.26 0.00 0.00 58.87 57.07 2ca6 n SER 175 Cb 0.04 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 64.43 2ca6 n SER 175 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 2ca6 h MET 176 N 0.00 0.00 0.00 4.33 2.07 -1.49 -2.52 114.93 117.32 2ca6 h MET 176 Ca 0.00 0.00 -0.11 0.00 -2.07 0.00 0.00 59.70 57.52 2ca6 h MET 176 Cb 0.57 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.28 2ca6 h MET 176 CO 0.00 0.31 -0.54 1.57 1.07 0.00 0.00 176.91 179.32 2ca6 h LYS 177 N 0.00 0.00 -0.08 1.72 2.10 -1.86 -2.27 116.57 116.18 2ca6 h LYS 177 Ca -0.00 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.48 2ca6 h LYS 177 Cb 0.70 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.04 2ca6 h LYS 177 CO 0.04 0.54 -0.59 1.49 -2.00 0.00 0.00 179.45 178.93 2ca6 h GLU 178 N 0.00 0.54 -0.55 0.07 4.57 -1.83 -3.02 114.58 114.35 2ca6 h GLU 178 Ca -0.01 -0.47 -0.10 0.00 -1.18 0.00 0.00 59.36 57.60 2ca6 h GLU 178 Cb 0.99 0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.67 2ca6 h GLU 178 CO 0.07 1.10 -0.05 -1.49 -1.18 0.00 0.00 179.01 177.46 2ca6 h TRP 179 N 0.13 1.08 -0.61 0.92 4.06 -1.43 -0.01 115.95 120.09 2ca6 h TRP 179 Ca -0.05 -0.20 0.11 0.00 2.06 0.00 0.00 58.89 60.81 2ca6 h TRP 179 Cb 1.25 -0.28 -0.09 0.00 -1.00 0.00 0.00 29.16 29.05 2ca6 h TRP 179 CO 0.12 0.99 0.14 0.00 -3.56 0.00 0.00 178.44 176.13 2ca6 h ALA 180 N 1.04 0.73 -0.48 1.49 0.00 -1.45 0.47 119.26 121.05 2ca6 h ALA 180 Ca 0.15 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 2ca6 h ALA 180 Cb 0.59 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2ca6 h ALA 180 CO 0.04 -0.29 0.06 0.87 0.00 0.00 0.00 179.25 179.93 2ca6 h LYS 181 N 0.28 0.76 -0.17 0.00 1.57 -1.26 -1.36 116.57 116.39 2ca6 h LYS 181 Ca 0.32 -0.17 -0.09 0.00 -1.87 0.00 0.00 60.65 58.84 2ca6 h LYS 181 Cb 0.47 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2ca6 h LYS 181 CO -0.40 0.73 -0.30 1.15 -0.57 0.00 0.00 179.45 180.07 2ca6 h THR 182 N 0.73 1.27 0.00 -0.16 2.02 0.16 -1.83 112.91 115.09 2ca6 h THR 182 Ca 0.15 -1.29 -0.12 0.00 0.77 0.00 0.00 66.41 65.93 2ca6 h THR 182 Cb 0.35 1.47 -0.02 0.00 -1.74 0.00 0.00 68.15 68.21 2ca6 h THR 182 CO 0.01 0.40 -0.57 -0.26 0.37 0.00 0.00 175.52 175.47 2ca6 h PHE 183 N 0.30 0.00 -0.16 3.16 0.04 0.08 -2.42 116.94 117.93 2ca6 h PHE 183 Ca 0.04 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.69 2ca6 h PHE 183 Cb 0.68 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.82 2ca6 h PHE 183 CO 0.02 0.57 -0.43 1.96 -0.60 0.00 0.00 178.31 179.82 2ca6 h GLN 184 N 0.00 0.39 0.00 1.51 4.20 -0.90 -2.83 115.11 117.47 2ca6 h GLN 184 Ca -0.01 -0.20 -0.14 0.00 0.06 0.00 0.00 58.65 58.37 2ca6 h GLN 184 Cb 1.40 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.16 2ca6 h GLN 184 CO 0.07 0.75 -0.66 0.77 -0.67 0.00 0.00 178.83 179.10 2ca6 h SER 185 N 0.32 0.00 -2.84 1.46 0.02 -1.20 -3.37 113.55 107.94 2ca6 h SER 185 Ca 0.02 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 60.34 2ca6 h SER 185 Cb 0.89 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 63.03 2ca6 h SER 185 CO 0.07 0.66 -0.47 1.41 -1.14 0.00 0.00 176.83 177.37 2ca6 n HIS 186 N -3.72 3.49 1.61 3.45 8.25 -0.93 -4.88 115.22 122.50 2ca6 n HIS 186 Ca -0.01 -4.19 0.10 0.00 -0.26 0.00 0.00 57.72 53.36 2ca6 n HIS 186 Cb 0.66 -0.70 0.44 0.00 1.12 0.00 0.00 29.99 31.52 2ca6 n HIS 186 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2ca6 n ARG 187 N 1.63 1.37 -0.48 -0.41 1.74 -1.23 -3.44 116.66 115.84 2ca6 n ARG 187 Ca 0.23 -0.55 0.08 0.00 -0.77 0.00 0.00 57.85 56.84 2ca6 n ARG 187 Cb 0.37 -1.33 0.27 0.00 -1.02 0.00 0.00 32.46 30.75 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 -0.22 4.08 -4.77 0.55 4.77 -1.26 -3.80 117.00 116.35 2ca6 n LEU 188 Ca 0.15 -2.73 -0.39 0.00 -0.03 0.00 0.00 56.01 53.00 2ca6 n LEU 188 Cb 0.19 -0.51 0.01 0.00 -2.33 0.00 0.00 43.42 40.78 2ca6 n LEU 188 CO 0.11 0.70 1.00 -0.76 -1.33 0.00 0.00 177.39 177.11 2ca6 s LEU 189 N -2.33 4.15 -0.14 2.23 1.43 -1.22 -4.73 118.68 118.06 2ca6 s LEU 189 Ca 0.42 2.75 0.04 0.00 -1.03 0.00 0.00 54.13 56.31 2ca6 s LEU 189 Cb 0.31 -3.95 -0.11 0.00 0.03 0.00 0.00 46.19 42.47 2ca6 s LEU 189 CO 0.13 -1.02 -0.08 1.41 0.23 0.00 0.00 176.35 177.02 2ca6 n HIS 190 N -0.08 0.00 -4.38 0.29 8.25 0.36 -2.48 115.22 117.18 2ca6 n HIS 190 Ca 0.05 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.30 2ca6 n HIS 190 Cb 0.43 -0.58 -0.15 0.00 1.12 0.00 0.00 29.99 30.81 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 -2.30 0.77 -0.03 1.59 2.01 -0.33 -0.77 115.64 116.58 2ca6 s THR 191 Ca -0.16 -0.35 -0.01 0.00 0.31 0.00 0.00 61.69 61.49 2ca6 s THR 191 Cb 0.05 -0.69 0.03 0.00 0.01 0.00 0.00 72.50 71.90 2ca6 s THR 191 CO 0.38 0.24 0.03 -0.69 -0.69 0.00 0.00 174.62 173.90 2ca6 s VAL 192 N 0.23 -0.01 -0.12 3.82 1.01 -0.24 -1.63 120.40 123.46 2ca6 s VAL 192 Ca -0.04 0.26 -0.03 0.00 0.00 0.00 0.00 61.98 62.17 2ca6 s VAL 192 Cb -0.09 -0.16 0.05 0.00 0.00 0.00 0.00 36.38 36.18 2ca6 s VAL 192 CO 0.00 0.14 0.07 -0.54 0.00 0.00 0.00 175.10 174.77 2ca6 s LYS 193 N 1.48 0.11 -0.44 2.72 1.02 -0.36 -1.53 119.74 122.74 2ca6 s LYS 193 Ca -0.04 0.07 0.10 0.00 0.02 0.00 0.00 55.97 56.12 2ca6 s LYS 193 Cb -0.13 -1.31 0.35 0.00 -0.52 0.00 0.00 37.83 36.22 2ca6 s LYS 193 CO -0.03 -0.52 0.81 -1.33 -0.92 0.00 0.00 175.35 173.37 2ca6 n MET 194 N 5.26 1.78 -2.11 1.68 2.81 -0.80 -0.12 117.12 125.62 2ca6 n MET 194 Ca -0.06 -3.90 -0.32 0.00 -1.81 0.00 0.00 57.70 51.61 2ca6 n MET 194 Cb 0.49 -1.89 -0.01 0.00 -0.71 0.00 0.00 33.22 31.11 2ca6 n MET 194 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2ca6 s VAL 195 N -3.18 4.38 -1.26 2.03 0.11 -1.25 -4.39 120.40 116.84 2ca6 s VAL 195 Ca 0.43 1.01 -0.25 0.00 -2.93 0.00 0.00 61.98 60.23 2ca6 s VAL 195 Cb 0.33 -3.65 0.03 0.00 -1.53 0.00 0.00 36.38 31.55 2ca6 s VAL 195 CO -0.10 -0.78 0.59 0.00 -3.33 0.00 0.00 175.10 171.48 2ca6 n GLN 196 N -2.12 -0.71 0.00 1.54 6.02 -0.35 0.07 117.38 121.84 2ca6 n GLN 196 Ca 0.07 0.16 0.04 0.00 -0.01 0.00 0.00 57.00 57.27 2ca6 n GLN 196 Cb 0.54 -3.08 0.02 0.00 1.02 0.00 0.00 30.24 28.73 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 -2.40 1.43 -0.16 1.08 3.02 -1.26 -1.81 115.26 115.16 2ca6 n ASN 197 Ca -0.15 -1.21 -0.02 0.00 -0.03 0.00 0.00 54.58 53.17 2ca6 n ASN 197 Cb 0.59 0.23 -0.01 0.00 -0.61 0.00 0.00 39.78 39.99 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 0.66 0.55 3.75 7.41 0.00 -1.26 -1.73 105.19 114.58 2ca6 n GLY 198 Ca 0.04 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.97 2.28 0.42 -0.61 1.01 -1.26 -4.52 121.20 116.55 2ca6 s ILE 199 Ca 0.00 0.24 0.08 0.00 0.00 0.00 0.00 60.65 60.97 2ca6 s ILE 199 Cb 0.00 -3.16 -0.02 0.00 0.01 0.00 0.00 42.46 39.29 2ca6 s ILE 199 CO 0.00 0.04 0.37 -0.13 0.00 0.00 0.00 174.94 175.22 2ca6 s ARG 200 N -0.58 2.50 0.14 2.79 0.52 -1.26 -0.84 118.95 122.22 2ca6 s ARG 200 Ca 0.61 -1.57 -0.10 0.00 -0.52 0.00 0.00 55.73 54.15 2ca6 s ARG 200 Cb -0.45 -2.34 0.16 0.00 0.52 0.00 0.00 34.95 32.84 2ca6 s ARG 200 CO 0.47 -0.20 0.92 -2.30 0.02 0.00 0.00 175.30 174.21 2ca6 n PRO 201 N -1.53 -0.13 0.21 3.54 -0.02 -0.14 0.18 135.00 137.12 2ca6 n PRO 201 Ca 0.03 0.91 0.09 0.00 -2.02 0.00 0.00 63.50 62.51 2ca6 n PRO 201 Cb 0.62 -1.36 0.45 0.00 -0.02 0.00 0.00 33.50 33.19 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 0.00 0.03 -0.52 5.08 -1.89 -0.80 114.58 116.48 2ca6 h GLU 202 Ca 0.22 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.33 2ca6 h GLU 202 Cb 0.37 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2ca6 h GLU 202 CO -0.59 0.26 -1.27 0.78 -1.00 0.00 0.00 179.01 177.20 2ca6 h GLY 203 N 1.88 0.07 0.71 -3.84 0.00 -0.61 -2.77 103.07 98.50 2ca6 h GLY 203 Ca -0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 2ca6 h GLY 203 CO 0.03 0.16 -0.19 -2.22 0.00 0.00 0.00 176.54 174.32 2ca6 h ILE 204 N 0.02 1.38 -0.27 2.60 1.08 -0.81 -1.35 117.51 120.16 2ca6 h ILE 204 Ca -0.12 -1.45 0.04 0.00 -0.39 0.00 0.00 64.86 62.94 2ca6 h ILE 204 Cb 1.88 2.05 -0.04 0.00 -3.07 0.00 0.00 36.82 37.64 2ca6 h ILE 204 CO 0.13 0.42 0.03 -0.08 -0.69 0.00 0.00 178.15 177.96 2ca6 h GLU 205 N -0.09 0.12 -0.11 2.37 4.81 -1.24 -1.04 114.58 119.40 2ca6 h GLU 205 Ca 0.01 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2ca6 h GLU 205 Cb 0.77 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.12 2ca6 h GLU 205 CO 0.04 0.08 0.04 1.25 -0.73 0.00 0.00 179.01 179.69 2ca6 h HIS 206 N 0.12 0.17 -0.98 0.92 2.76 -1.51 -1.99 115.15 114.63 2ca6 h HIS 206 Ca 0.13 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.34 2ca6 h HIS 206 Cb 0.15 -0.05 -0.06 0.00 1.55 0.00 0.00 27.41 29.00 2ca6 h HIS 206 CO -0.18 0.28 0.64 1.25 -1.30 0.00 0.00 177.93 178.62 2ca6 h LEU 207 N 0.01 1.03 0.21 0.26 5.85 -1.05 0.15 115.31 121.76 2ca6 h LEU 207 Ca 0.04 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2ca6 h LEU 207 Cb 0.19 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.00 2ca6 h LEU 207 CO -0.00 0.67 -0.10 -0.07 -0.34 0.00 0.00 178.44 178.60 2ca6 h LEU 208 N 1.17 -0.24 -0.34 2.25 3.38 -1.12 -0.81 115.31 119.61 2ca6 h LEU 208 Ca 0.41 -0.26 -0.19 0.00 0.09 0.00 0.00 57.88 57.92 2ca6 h LEU 208 Cb 0.13 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2ca6 h LEU 208 CO -0.15 0.29 -0.81 -0.07 0.09 0.00 0.00 178.44 177.78 2ca6 h LEU 209 N -0.92 0.42 -0.52 1.67 3.38 -1.35 0.11 115.31 118.10 2ca6 h LEU 209 Ca -0.03 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2ca6 h LEU 209 Cb 0.49 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2ca6 h LEU 209 CO 0.05 1.07 -0.57 -0.62 0.09 0.00 0.00 178.44 178.46 2ca6 n GLU 210 N -3.77 0.68 0.00 1.13 -0.58 0.53 -4.60 120.64 114.02 2ca6 n GLU 210 Ca -0.05 -0.52 0.00 0.00 -0.42 0.00 0.00 57.16 56.18 2ca6 n GLU 210 Cb 0.76 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 30.14 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 1.43 0.17 0.38 0.62 0.00 -0.99 -4.61 105.19 102.19 2ca6 n GLY 211 Ca 0.08 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.33 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 0.51 -1.99 0.99 4.07 -1.13 -1.02 115.31 116.75 2ca6 h LEU 212 Ca 0.00 0.13 0.15 0.00 0.08 0.00 0.00 57.88 58.24 2ca6 h LEU 212 Cb 0.00 0.06 -0.02 0.00 1.08 0.00 0.00 40.66 41.78 2ca6 h LEU 212 CO 0.00 0.01 0.46 0.00 -1.08 0.00 0.00 178.44 177.84 2ca6 h ALA 213 N 1.70 2.31 -0.00 1.53 0.00 -1.02 0.35 119.26 124.12 2ca6 h ALA 213 Ca 0.67 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.56 2ca6 h ALA 213 Cb 1.57 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.40 2ca6 h ALA 213 CO -0.44 -0.73 -0.15 0.66 0.00 0.00 0.00 179.25 178.60 2ca6 n TYR 214 N -3.93 0.00 -3.00 0.00 4.01 -0.39 -4.60 117.16 109.25 2ca6 n TYR 214 Ca 0.10 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.39 2ca6 n TYR 214 Cb 0.67 -0.39 -0.02 0.00 -0.31 0.00 0.00 39.34 39.29 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 8.54 0.00 -0.09 0.00 4.20 -1.77 -3.16 115.11 122.82 2ca6 h GLN 216 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 2ca6 h GLN 216 Cb 1.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.80 2ca6 h GLN 216 CO 1.05 0.00 0.00 0.39 -0.67 0.00 0.00 178.83 179.60 2ca6 n GLU 217 N -3.02 1.74 -1.66 1.46 -0.58 -1.26 -4.38 120.64 112.95 2ca6 n GLU 217 Ca 0.03 -1.10 -0.49 0.00 -0.42 0.00 0.00 57.16 55.19 2ca6 n GLU 217 Cb 0.45 -1.44 -0.05 0.00 -0.57 0.00 0.00 31.44 29.83 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 0.32 2.77 -0.05 -4.62 7.94 -1.03 -4.50 117.00 117.83 2ca6 n LEU 218 Ca 0.18 1.07 -0.08 0.00 -1.11 0.00 0.00 56.01 56.06 2ca6 n LEU 218 Cb 0.36 -1.33 -0.05 0.00 0.53 0.00 0.00 43.42 42.93 2ca6 n LEU 218 CO 0.15 -0.43 -0.84 0.29 -1.11 0.00 0.00 177.39 175.45 2ca6 n LYS 219 N 4.09 0.26 -4.19 1.96 5.02 0.05 -3.09 118.16 122.26 2ca6 n LYS 219 Ca 0.19 0.07 -0.29 0.00 -2.02 0.00 0.00 58.31 56.26 2ca6 n LYS 219 Cb 0.25 -1.17 -0.17 0.00 -0.02 0.00 0.00 35.03 33.93 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 -2.21 1.49 -0.09 -0.18 1.01 -0.68 0.25 120.40 120.00 2ca6 s VAL 220 Ca -0.14 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.24 2ca6 s VAL 220 Cb 0.04 -1.39 0.02 0.00 0.00 0.00 0.00 36.38 35.05 2ca6 s VAL 220 CO 0.23 0.44 -0.08 -0.22 0.00 0.00 0.00 175.10 175.47 2ca6 s LEU 221 N 1.30 1.30 -0.25 3.92 2.96 -0.42 -1.08 118.68 126.41 2ca6 s LEU 221 Ca 0.00 -0.28 0.00 0.00 -0.22 0.00 0.00 54.13 53.64 2ca6 s LEU 221 Cb -0.14 -0.79 0.07 0.00 0.50 0.00 0.00 46.19 45.84 2ca6 s LEU 221 CO -0.07 -0.07 -0.00 -0.62 -1.32 0.00 0.00 176.35 174.27 2ca6 s ASP 222 N 1.36 3.79 -0.28 3.68 2.15 -0.58 0.59 116.67 127.38 2ca6 s ASP 222 Ca -0.02 -1.28 0.10 0.00 0.43 0.00 0.00 52.55 51.78 2ca6 s ASP 222 Cb -0.14 -1.05 0.52 0.00 -0.30 0.00 0.00 42.92 41.95 2ca6 s ASP 222 CO -0.04 -0.29 1.48 0.18 -0.17 0.00 0.00 175.17 176.33 2ca6 n LEU 223 N 4.74 4.22 -4.39 -1.34 4.77 -0.81 -1.90 117.00 122.28 2ca6 n LEU 223 Ca -0.08 -3.65 -0.43 0.00 -0.03 0.00 0.00 56.01 51.82 2ca6 n LEU 223 Cb 0.44 -0.63 -0.00 0.00 -2.33 0.00 0.00 43.42 40.90 2ca6 n LEU 223 CO 0.16 1.15 -0.13 1.67 -1.33 0.00 0.00 177.39 178.92 2ca6 n GLN 224 N -1.03 0.28 -3.77 3.23 0.00 -1.25 -3.62 117.38 111.22 2ca6 n GLN 224 Ca 0.33 0.10 -0.29 0.00 -0.00 0.00 0.00 57.00 57.14 2ca6 n GLN 224 Cb 1.05 -1.24 0.01 0.00 0.00 0.00 0.00 30.24 30.06 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 1.80 -5.07 -3.78 1.69 2.03 0.09 -1.21 116.55 112.09 2ca6 n ASP 225 Ca 0.12 -0.97 -0.13 0.00 0.52 0.00 0.00 54.79 54.34 2ca6 n ASP 225 Cb 0.37 -2.36 -0.10 0.00 -0.72 0.00 0.00 41.12 38.31 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 -3.22 -0.18 -0.34 1.67 0.01 -1.23 -3.11 114.94 108.53 2ca6 s ASN 226 Ca 0.22 0.18 -0.29 0.00 -0.71 0.00 0.00 52.86 52.25 2ca6 s ASN 226 Cb -0.10 0.38 0.02 0.00 0.41 0.00 0.00 41.25 41.95 2ca6 s ASN 226 CO 0.90 -0.33 1.14 -0.89 -1.51 0.00 0.00 177.10 176.40 2ca6 s THR 227 N -0.91 4.37 -0.13 1.60 2.01 -0.02 -4.25 115.64 118.31 2ca6 s THR 227 Ca -0.10 1.54 -0.10 0.00 0.31 0.00 0.00 61.69 63.34 2ca6 s THR 227 Cb -0.05 -4.39 -0.03 0.00 0.01 0.00 0.00 72.50 68.03 2ca6 s THR 227 CO 0.03 -0.58 -0.20 0.49 -0.69 0.00 0.00 174.62 173.67 2ca6 n PHE 228 N 7.22 0.54 -3.67 4.92 3.01 -0.14 -0.97 117.46 128.37 2ca6 n PHE 228 Ca 0.13 0.23 0.05 0.00 1.01 0.00 0.00 57.45 58.87 2ca6 n PHE 228 Cb 0.47 -0.61 -0.01 0.00 -0.01 0.00 0.00 39.48 39.32 2ca6 n PHE 228 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2ca6 n THR 229 N -4.22 0.00 -0.17 4.37 -2.24 -0.09 -0.82 114.28 111.11 2ca6 n THR 229 Ca -0.08 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.69 2ca6 n THR 229 Cb 0.29 -0.13 0.22 0.00 -2.10 0.00 0.00 70.33 68.62 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 -0.35 0.89 0.64 4.78 2.76 -1.82 -2.10 115.15 119.95 2ca6 h HIS 230 Ca 0.01 -0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.12 2ca6 h HIS 230 Cb 0.34 -0.28 -0.00 0.00 1.55 0.00 0.00 27.41 29.02 2ca6 h HIS 230 CO 0.00 0.66 -0.39 1.25 -1.30 0.00 0.00 177.93 178.14 2ca6 h LEU 231 N 0.90 -0.99 -1.02 0.26 5.85 -1.90 0.13 115.31 118.54 2ca6 h LEU 231 Ca 0.22 0.06 0.11 0.00 0.84 0.00 0.00 57.88 59.11 2ca6 h LEU 231 Cb 0.10 0.29 -0.08 0.00 0.37 0.00 0.00 40.66 41.34 2ca6 h LEU 231 CO -0.03 -0.60 0.63 1.23 -0.34 0.00 0.00 178.44 179.33 2ca6 h GLY 232 N -0.96 1.61 0.93 3.75 0.00 -0.95 -1.90 103.07 105.55 2ca6 h GLY 232 Ca -0.09 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 2ca6 h GLY 232 CO 0.08 0.19 0.15 1.76 0.00 0.00 0.00 176.54 178.72 2ca6 h SER 233 N 1.02 0.45 0.24 0.19 0.02 -1.15 -1.55 113.55 112.77 2ca6 h SER 233 Ca 0.49 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 61.26 2ca6 h SER 233 Cb 0.44 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 2ca6 h SER 233 CO -0.25 0.47 -0.15 0.28 -1.14 0.00 0.00 176.83 176.05 2ca6 h SER 234 N 0.40 0.00 0.85 3.07 0.02 -0.23 0.71 113.55 118.37 2ca6 h SER 234 Ca 0.11 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.95 2ca6 h SER 234 Cb 0.15 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 2ca6 h SER 234 CO -0.01 0.15 -0.55 0.00 -1.14 0.00 0.00 176.83 175.28 2ca6 h ALA 235 N 1.85 0.88 0.12 3.77 0.00 -0.61 -3.03 119.26 122.23 2ca6 h ALA 235 Ca -0.00 -0.50 -0.21 0.00 0.00 0.00 0.00 54.91 54.20 2ca6 h ALA 235 Cb 0.31 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.03 2ca6 h ALA 235 CO 0.02 0.68 -0.91 1.25 0.00 0.00 0.00 179.25 180.30 2ca6 h LEU 236 N 0.00 0.59 -1.97 0.00 5.85 -0.25 -2.54 115.31 116.99 2ca6 h LEU 236 Ca -0.01 -0.89 0.12 0.00 0.84 0.00 0.00 57.88 57.94 2ca6 h LEU 236 Cb 1.12 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 2ca6 h LEU 236 CO 0.07 1.42 0.44 0.00 -0.34 0.00 0.00 178.44 180.04 2ca6 h ALA 237 N 0.17 2.10 0.11 1.25 0.00 -0.88 -0.48 119.26 121.53 2ca6 h ALA 237 Ca -0.15 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.39 2ca6 h ALA 237 Cb 1.67 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.47 2ca6 h ALA 237 CO 0.17 -0.65 -2.01 -0.89 0.00 0.00 0.00 179.25 175.87 2ca6 n ILE 238 N -3.69 1.75 0.02 0.00 5.41 -1.15 -4.32 119.36 117.38 2ca6 n ILE 238 Ca 0.07 -0.66 -0.03 0.00 1.00 0.00 0.00 62.75 63.13 2ca6 n ILE 238 Cb 0.62 -1.66 0.21 0.00 -0.71 0.00 0.00 39.64 38.10 2ca6 n ILE 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2ca6 h ALA 239 N 0.14 1.12 -0.87 -1.39 0.00 -0.77 -3.32 119.26 114.18 2ca6 h ALA 239 Ca -0.42 -0.34 0.15 0.00 0.00 0.00 0.00 54.91 54.29 2ca6 h ALA 239 Cb 2.03 -0.12 -0.15 0.00 0.00 0.00 0.00 17.79 19.55 2ca6 h ALA 239 CO 0.08 0.55 -0.34 -0.07 0.00 0.00 0.00 179.25 179.47 2ca6 h LEU 240 N 0.41 -1.24 -1.31 0.00 3.38 -1.33 0.32 115.31 115.54 2ca6 h LEU 240 Ca 0.06 0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.31 2ca6 h LEU 240 Cb 0.65 0.67 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2ca6 h LEU 240 CO 0.05 -0.29 0.22 0.07 0.09 0.00 0.00 178.44 178.58 2ca6 h LYS 241 N -0.05 0.00 0.00 1.13 2.10 -1.83 0.01 116.57 117.93 2ca6 h LYS 241 Ca 0.33 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.98 2ca6 h LYS 241 Cb 0.60 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.93 2ca6 h LYS 241 CO -0.89 0.00 -0.10 0.77 -2.00 0.00 0.00 179.45 177.22 2ca6 h SER 242 N 0.00 0.00 -2.94 7.07 0.02 -0.59 -3.39 113.55 113.72 2ca6 h SER 242 Ca 0.00 -0.00 -0.70 0.00 -0.84 0.00 0.00 61.79 60.24 2ca6 h SER 242 Cb 0.45 0.00 -0.35 0.00 0.14 0.00 0.00 62.40 62.64 2ca6 h SER 242 CO 0.00 0.00 -0.01 0.79 -1.14 0.00 0.00 176.83 176.47 2ca6 n TRP 243 N -2.94 3.64 0.32 3.45 8.01 -0.01 -4.40 117.44 125.49 2ca6 n TRP 243 Ca 0.04 -3.78 0.21 0.00 -1.31 0.00 0.00 57.50 52.65 2ca6 n TRP 243 Cb 0.52 -1.02 1.04 0.00 -2.01 0.00 0.00 31.31 29.84 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 5.40 0.00 -0.62 -0.99 0.13 -1.78 -2.07 132.00 132.07 2ca6 h PRO 244 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2ca6 h PRO 244 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 2ca6 h PRO 244 CO 0.97 0.01 0.00 0.09 -0.23 0.00 0.00 178.00 178.83 2ca6 n ASN 245 N -3.13 4.13 -4.68 1.44 5.03 -1.26 -4.57 115.26 112.21 2ca6 n ASN 245 Ca -0.02 -2.23 -0.44 0.00 0.87 0.00 0.00 54.58 52.77 2ca6 n ASN 245 Cb 0.15 -0.49 -0.04 0.00 -1.02 0.00 0.00 39.78 38.38 2ca6 n ASN 245 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 2ca6 n LEU 246 N 1.16 3.83 -0.07 3.41 7.94 -0.78 -4.37 117.00 128.11 2ca6 n LEU 246 Ca 0.23 0.99 -0.15 0.00 -1.11 0.00 0.00 56.01 55.97 2ca6 n LEU 246 Cb 0.71 -1.50 -0.05 0.00 0.53 0.00 0.00 43.42 43.11 2ca6 n LEU 246 CO 0.18 0.08 -1.00 -1.14 -1.11 0.00 0.00 177.39 174.40 2ca6 n ARG 247 N 5.72 0.31 -4.33 1.96 0.63 0.14 -2.73 116.66 118.36 2ca6 n ARG 247 Ca 0.19 0.13 -0.30 0.00 -0.92 0.00 0.00 57.85 56.95 2ca6 n ARG 247 Cb 0.35 -1.04 -0.17 0.00 0.45 0.00 0.00 32.46 32.06 2ca6 n ARG 247 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 2ca6 s GLU 248 N -2.27 2.43 -0.29 -0.14 2.12 -0.50 0.42 118.70 120.47 2ca6 s GLU 248 Ca -0.20 -0.63 0.01 0.00 0.36 0.00 0.00 54.97 54.51 2ca6 s GLU 248 Cb 0.08 -2.09 0.07 0.00 0.26 0.00 0.00 34.13 32.44 2ca6 s GLU 248 CO 0.26 -0.12 -0.04 -1.17 -0.54 0.00 0.00 175.26 173.66 2ca6 s LEU 249 N 1.14 3.88 -0.25 2.70 2.96 -0.07 -1.30 118.68 127.74 2ca6 s LEU 249 Ca -0.02 -1.51 -0.16 0.00 -0.22 0.00 0.00 54.13 52.21 2ca6 s LEU 249 Cb -0.14 -1.63 -0.03 0.00 0.50 0.00 0.00 46.19 44.89 2ca6 s LEU 249 CO -0.05 -0.26 0.43 -0.83 -1.32 0.00 0.00 176.35 174.32 2ca6 s GLY 250 N 1.16 1.91 -0.00 7.98 0.00 0.20 -1.65 107.32 116.91 2ca6 s GLY 250 Ca -0.04 -0.68 0.16 0.00 0.00 0.00 0.00 44.72 44.17 2ca6 s GLY 250 CO -0.04 1.05 1.11 1.04 0.00 0.00 0.00 173.10 176.26 2ca6 n LEU 251 N 5.25 0.64 -4.75 0.66 4.77 -0.25 -1.93 117.00 121.39 2ca6 n LEU 251 Ca -0.07 -1.64 -0.41 0.00 -0.03 0.00 0.00 56.01 53.86 2ca6 n LEU 251 Cb 0.50 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 2ca6 n LEU 251 CO 0.39 0.41 1.15 0.20 -1.33 0.00 0.00 177.39 178.21 2ca6 s ASN 252 N -1.64 6.57 -1.35 -1.43 0.01 -1.21 -3.16 114.94 112.73 2ca6 s ASN 252 Ca 0.22 2.75 -0.06 0.00 -0.71 0.00 0.00 52.86 55.06 2ca6 s ASN 252 Cb 0.25 -2.63 0.02 0.00 0.41 0.00 0.00 41.25 39.31 2ca6 s ASN 252 CO -0.11 -0.77 0.97 0.47 -1.51 0.00 0.00 177.10 176.16 2ca6 n ASP 253 N 2.33 -3.72 -0.73 -1.22 8.00 0.23 -0.74 116.55 120.71 2ca6 n ASP 253 Ca 0.07 -0.69 0.07 0.00 0.71 0.00 0.00 54.79 54.96 2ca6 n ASP 253 Cb 0.39 -4.53 0.15 0.00 -0.02 0.00 0.00 41.12 37.12 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 0.78 -0.64 0.10 0.00 4.77 -1.24 -0.97 117.00 119.79 2ca6 n LEU 255 Ca 0.13 -1.25 0.14 0.00 -0.03 0.00 0.00 56.01 54.99 2ca6 n LEU 255 Cb 0.43 -1.53 0.64 0.00 -2.33 0.00 0.00 43.42 40.63 2ca6 n LEU 255 CO 0.10 0.57 1.14 -0.07 -1.33 0.00 0.00 177.39 177.80 2ca6 h LEU 256 N -1.96 0.06 0.00 2.23 3.38 -1.84 -0.22 115.31 116.97 2ca6 h LEU 256 Ca -0.66 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.31 2ca6 h LEU 256 Cb 1.35 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.09 2ca6 h LEU 256 CO 0.62 0.04 0.00 -1.54 0.09 0.00 0.00 178.44 177.65 2ca6 n SER 257 N -4.46 0.00 0.09 -0.43 3.41 -0.64 -3.28 113.62 108.32 2ca6 n SER 257 Ca 0.04 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.56 2ca6 n SER 257 Cb 0.35 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.23 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 -0.32 0.00 7.33 0.00 -1.73 -2.27 119.26 122.28 2ca6 h ALA 258 Ca 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 2ca6 h ALA 258 Cb 0.00 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2ca6 h ALA 258 CO 0.00 -0.36 -0.26 0.00 0.00 0.00 0.00 179.25 178.63 2ca6 h ARG 259 N -0.95 0.00 0.37 0.00 3.08 -1.90 -1.34 114.38 113.64 2ca6 h ARG 259 Ca -0.03 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 2ca6 h ARG 259 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.53 2ca6 h ARG 259 CO 0.05 0.26 -0.18 0.78 -1.07 0.00 0.00 179.97 179.82 2ca6 h GLY 260 N 0.92 -0.52 1.56 0.04 0.00 -1.61 -1.10 103.07 102.37 2ca6 h GLY 260 Ca -0.00 0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.52 2ca6 h GLY 260 CO 0.03 -0.19 0.27 0.00 0.00 0.00 0.00 176.54 176.66 2ca6 h ALA 261 N 0.14 1.65 -0.43 3.60 0.00 -1.07 -1.02 119.26 122.13 2ca6 h ALA 261 Ca -0.05 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2ca6 h ALA 261 Cb 0.38 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2ca6 h ALA 261 CO 0.08 0.31 0.13 0.00 0.00 0.00 0.00 179.25 179.78 2ca6 h ALA 262 N 1.70 0.56 -0.67 0.00 0.00 -0.87 0.74 119.26 120.72 2ca6 h ALA 262 Ca 0.16 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2ca6 h ALA 262 Cb -0.04 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2ca6 h ALA 262 CO -0.03 0.21 0.22 0.00 0.00 0.00 0.00 179.25 179.64 2ca6 h ALA 263 N 0.98 1.13 -0.25 0.00 0.00 -0.46 -0.24 119.26 120.42 2ca6 h ALA 263 Ca 0.14 -0.20 -0.18 0.00 0.00 0.00 0.00 54.91 54.67 2ca6 h ALA 263 Cb 0.26 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2ca6 h ALA 263 CO -0.00 0.61 -0.54 0.28 0.00 0.00 0.00 179.25 179.59 2ca6 h VAL 264 N 0.98 1.29 -0.55 0.00 2.07 -0.89 -2.23 116.25 116.92 2ca6 h VAL 264 Ca 0.22 -1.74 -0.09 0.00 0.82 0.00 0.00 66.70 65.91 2ca6 h VAL 264 Cb 0.26 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 2ca6 h VAL 264 CO -0.01 0.56 0.01 0.58 0.02 0.00 0.00 177.57 178.73 2ca6 h VAL 265 N 0.57 1.26 0.00 2.57 2.07 -0.65 -2.61 116.25 119.47 2ca6 h VAL 265 Ca 0.00 -1.11 -0.03 0.00 0.82 0.00 0.00 66.70 66.39 2ca6 h VAL 265 Cb 1.16 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 31.80 2ca6 h VAL 265 CO 0.12 0.40 -0.14 -0.78 0.02 0.00 0.00 177.57 177.19 2ca6 h ASP 266 N 0.85 0.00 -0.18 0.57 3.58 -1.00 -1.64 116.42 118.61 2ca6 h ASP 266 Ca 0.16 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.53 2ca6 h ASP 266 Cb 0.53 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.58 2ca6 h ASP 266 CO 0.03 0.14 -0.21 0.00 -2.88 0.00 0.00 179.24 176.32 2ca6 h ALA 267 N 1.86 0.26 -0.41 -0.78 0.00 -1.03 -3.14 119.26 116.02 2ca6 h ALA 267 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2ca6 h ALA 267 Cb 0.28 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2ca6 h ALA 267 CO 0.02 0.20 0.26 0.74 0.00 0.00 0.00 179.25 180.47 2ca6 h PHE 268 N 0.10 0.53 -0.79 0.00 0.04 -1.14 -1.79 116.94 113.89 2ca6 h PHE 268 Ca 0.02 0.00 0.23 0.00 2.80 0.00 0.00 57.97 61.03 2ca6 h PHE 268 Cb 0.76 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.70 2ca6 h PHE 268 CO 0.08 0.36 0.65 0.66 -0.60 0.00 0.00 178.31 179.47 2ca6 h SER 269 N 0.55 0.00 -0.01 2.17 4.64 -1.28 0.27 113.55 119.89 2ca6 h SER 269 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2ca6 h SER 269 Cb -0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2ca6 h SER 269 CO -0.03 0.00 -0.00 0.29 -0.87 0.00 0.00 176.83 176.22 2ca6 n LYS 270 N -4.00 1.57 -4.09 4.77 5.02 -0.68 -4.86 118.16 115.89 2ca6 n LYS 270 Ca 0.16 -0.84 -0.34 0.00 -2.02 0.00 0.00 58.31 55.27 2ca6 n LYS 270 Cb 0.94 -1.48 -0.10 0.00 -0.02 0.00 0.00 35.03 34.36 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 -2.00 3.70 0.05 -0.35 1.43 0.96 -5.09 118.68 117.37 2ca6 s LEU 271 Ca 0.39 0.04 -0.02 0.00 -1.03 0.00 0.00 54.13 53.51 2ca6 s LEU 271 Cb 0.21 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 2ca6 s LEU 271 CO 0.34 0.18 0.24 -1.61 0.23 0.00 0.00 176.35 175.72 2ca6 s GLU 272 N 0.34 3.49 -0.98 1.70 2.02 -1.26 -4.52 118.70 119.49 2ca6 s GLU 272 Ca 0.02 -0.30 -0.02 0.00 0.02 0.00 0.00 54.97 54.68 2ca6 s GLU 272 Cb -0.13 -3.03 -0.02 0.00 0.10 0.00 0.00 34.13 31.05 2ca6 s GLU 272 CO 0.01 0.61 0.83 0.09 0.02 0.00 0.00 175.26 176.82 2ca6 n ASN 273 N 0.56 -3.61 -4.59 -0.19 3.02 -1.26 -4.94 115.26 104.25 2ca6 n ASN 273 Ca -0.07 -0.56 -0.43 0.00 -0.03 0.00 0.00 54.58 53.49 2ca6 n ASN 273 Cb 0.52 -4.51 -0.02 0.00 -0.61 0.00 0.00 39.78 35.16 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 -3.32 4.13 -0.83 2.41 1.01 -1.25 -4.88 121.20 118.47 2ca6 s ILE 274 Ca 0.16 1.03 0.05 0.00 0.00 0.00 0.00 60.65 61.89 2ca6 s ILE 274 Cb -0.02 -4.66 0.30 0.00 0.01 0.00 0.00 42.46 38.09 2ca6 s ILE 274 CO 0.63 -1.17 0.98 0.61 0.00 0.00 0.00 174.94 176.00 2ca6 n GLY 275 N 4.96 1.90 3.72 6.18 0.00 -1.26 -4.36 105.19 116.34 2ca6 n GLY 275 Ca 0.10 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.02 4.37 -0.04 0.99 2.96 -1.11 -4.55 118.68 120.29 2ca6 s LEU 276 Ca 0.20 2.81 0.04 0.00 -0.22 0.00 0.00 54.13 56.97 2ca6 s LEU 276 Cb 0.15 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 43.17 2ca6 s LEU 276 CO 0.06 -0.93 0.03 0.00 -1.32 0.00 0.00 176.35 174.20 2ca6 n GLN 277 N 3.76 2.69 -4.21 1.98 6.02 0.17 -2.13 117.38 125.65 2ca6 n GLN 277 Ca 0.14 -0.01 -0.24 0.00 -0.01 0.00 0.00 57.00 56.88 2ca6 n GLN 277 Cb 0.36 -1.12 -0.17 0.00 1.02 0.00 0.00 30.24 30.33 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 -2.16 0.94 -0.21 5.09 2.01 -0.37 -0.43 115.64 120.51 2ca6 s THR 278 Ca -0.02 -0.30 -0.01 0.00 0.31 0.00 0.00 61.69 61.66 2ca6 s THR 278 Cb 0.02 -0.92 0.06 0.00 0.01 0.00 0.00 72.50 71.67 2ca6 s THR 278 CO 0.20 0.33 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.23 2ca6 s LEU 279 N 1.18 1.78 -0.34 4.42 2.96 -0.41 -0.89 118.68 127.38 2ca6 s LEU 279 Ca -0.06 -0.96 -0.09 0.00 -0.22 0.00 0.00 54.13 52.80 2ca6 s LEU 279 Cb -0.14 -0.85 0.02 0.00 0.50 0.00 0.00 46.19 45.71 2ca6 s LEU 279 CO -0.02 -0.27 0.16 -0.13 -1.32 0.00 0.00 176.35 174.77 2ca6 s ARG 280 N 1.66 3.00 -0.24 1.98 0.52 -0.66 -1.73 118.95 123.48 2ca6 s ARG 280 Ca -0.03 -0.95 0.15 0.00 -0.52 0.00 0.00 55.73 54.38 2ca6 s ARG 280 Cb -0.18 -3.59 0.47 0.00 0.52 0.00 0.00 34.95 32.17 2ca6 s ARG 280 CO -0.07 -0.57 1.16 1.28 0.02 0.00 0.00 175.30 177.12 2ca6 n LEU 281 N 4.95 3.04 -4.75 2.53 4.77 -0.10 -1.09 117.00 126.35 2ca6 n LEU 281 Ca -0.13 -3.74 -0.41 0.00 -0.03 0.00 0.00 56.01 51.71 2ca6 n LEU 281 Cb 0.47 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 2ca6 n LEU 281 CO 0.34 1.47 0.88 -1.10 -1.33 0.00 0.00 177.39 177.65 2ca6 s GLN 282 N -3.25 4.51 -0.74 3.23 -0.21 -1.16 -4.13 119.66 117.91 2ca6 s GLN 282 Ca 0.39 1.94 -0.03 0.00 0.02 0.00 0.00 55.36 57.68 2ca6 s GLN 282 Cb 0.37 -3.18 0.00 0.00 1.00 0.00 0.00 33.01 31.21 2ca6 s GLN 282 CO -0.02 0.00 0.65 0.66 -2.12 0.00 0.00 175.29 174.46 2ca6 n TYR 283 N 1.57 -2.59 -1.11 0.91 4.01 -0.70 0.76 117.16 120.00 2ca6 n TYR 283 Ca 0.01 1.03 0.02 0.00 -0.16 0.00 0.00 57.90 58.79 2ca6 n TYR 283 Cb 0.44 -3.39 0.02 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 -1.95 0.75 -1.95 7.72 3.02 -1.26 -3.43 115.26 118.16 2ca6 n ASN 284 Ca -0.14 -1.82 -0.20 0.00 -0.03 0.00 0.00 54.58 52.39 2ca6 n ASN 284 Cb 0.59 -0.13 -0.05 0.00 -0.61 0.00 0.00 39.78 39.59 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 -0.32 -1.52 -2.38 3.52 1.02 -1.26 -1.62 120.64 118.09 2ca6 n GLU 285 Ca 0.03 1.09 -0.41 0.00 -0.02 0.00 0.00 57.16 57.84 2ca6 n GLU 285 Cb 0.53 -5.59 -0.03 0.00 -0.02 0.00 0.00 31.44 26.33 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 -2.89 3.55 0.27 -3.67 1.01 -1.26 -3.30 121.20 114.91 2ca6 s ILE 286 Ca 0.00 1.32 0.08 0.00 0.00 0.00 0.00 60.65 62.05 2ca6 s ILE 286 Cb 0.00 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 2ca6 s ILE 286 CO 0.00 0.22 0.12 -1.61 0.00 0.00 0.00 174.94 173.67 2ca6 s GLU 287 N -0.35 2.63 0.20 2.79 2.02 -1.26 0.12 118.70 124.85 2ca6 s GLU 287 Ca 0.52 -1.24 -0.09 0.00 0.02 0.00 0.00 54.97 54.18 2ca6 s GLU 287 Cb -0.33 -2.38 0.28 0.00 0.10 0.00 0.00 34.13 31.81 2ca6 s GLU 287 CO 0.37 0.35 1.20 -0.11 0.02 0.00 0.00 175.26 177.10 2ca6 n LEU 288 N -1.08 -0.38 -0.27 1.80 7.94 -1.26 -2.12 117.00 121.64 2ca6 n LEU 288 Ca -0.07 1.34 0.05 0.00 -1.11 0.00 0.00 56.01 56.22 2ca6 n LEU 288 Cb 0.59 -0.36 0.19 0.00 0.53 0.00 0.00 43.42 44.36 2ca6 n LEU 288 CO 0.42 -1.25 1.05 0.44 -1.11 0.00 0.00 177.39 176.94 2ca6 h ASP 289 N 0.00 0.39 0.42 1.96 5.19 -1.96 -0.56 116.42 121.86 2ca6 h ASP 289 Ca 0.33 0.09 -0.13 0.00 -0.62 0.00 0.00 57.03 56.70 2ca6 h ASP 289 Cb 0.52 0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.06 2ca6 h ASP 289 CO -0.78 0.17 -0.56 0.00 -3.12 0.00 0.00 179.24 174.94 2ca6 h ALA 290 N 1.53 0.96 -0.11 3.45 0.00 -1.81 -2.31 119.26 120.98 2ca6 h ALA 290 Ca 0.42 -0.52 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 2ca6 h ALA 290 Cb 0.58 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2ca6 h ALA 290 CO -0.36 0.70 -0.34 0.28 0.00 0.00 0.00 179.25 179.53 2ca6 h VAL 291 N 0.11 1.28 -0.28 0.00 2.07 -1.18 0.69 116.25 118.93 2ca6 h VAL 291 Ca -0.00 -1.33 -0.16 0.00 0.82 0.00 0.00 66.70 66.03 2ca6 h VAL 291 Cb 1.03 1.58 -0.00 0.00 -1.52 0.00 0.00 31.29 32.37 2ca6 h VAL 291 CO 0.08 0.40 -0.44 0.03 0.02 0.00 0.00 177.57 177.66 2ca6 h ARG 292 N 0.19 0.80 -0.44 1.57 3.08 -0.88 0.15 114.38 118.85 2ca6 h ARG 292 Ca 0.02 -0.48 -0.08 0.00 0.07 0.00 0.00 59.98 59.51 2ca6 h ARG 292 Cb 0.70 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 2ca6 h ARG 292 CO 0.05 1.11 -0.05 1.15 -1.07 0.00 0.00 179.97 181.17 2ca6 h THR 293 N 0.56 1.27 -0.17 2.04 2.02 -0.92 -2.74 112.91 114.96 2ca6 h THR 293 Ca 0.02 -1.12 0.00 0.00 0.77 0.00 0.00 66.41 66.08 2ca6 h THR 293 Cb 1.04 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 68.56 2ca6 h THR 293 CO 0.10 0.38 0.11 0.25 0.37 0.00 0.00 175.52 176.73 2ca6 h LEU 294 N 0.64 0.20 -0.81 2.58 5.85 0.47 -1.12 115.31 123.12 2ca6 h LEU 294 Ca 0.12 -0.03 0.11 0.00 0.84 0.00 0.00 57.88 58.92 2ca6 h LEU 294 Cb 0.56 -0.05 -0.13 0.00 0.37 0.00 0.00 40.66 41.41 2ca6 h LEU 294 CO 0.03 0.17 -0.44 0.50 -0.34 0.00 0.00 178.44 178.36 2ca6 h LYS 295 N 0.22 -0.09 -0.07 1.25 3.11 -0.47 0.40 116.57 120.92 2ca6 h LYS 295 Ca 0.06 0.01 -0.00 0.00 -2.81 0.00 0.00 60.65 57.91 2ca6 h LYS 295 Cb 0.00 0.02 -0.00 0.00 -1.00 0.00 0.00 32.23 31.25 2ca6 h LYS 295 CO -0.01 -0.06 0.04 1.15 -2.81 0.00 0.00 179.45 177.76 2ca6 h THR 296 N -0.10 1.06 -0.68 1.00 2.02 -1.20 -1.90 112.91 113.11 2ca6 h THR 296 Ca 0.24 -0.16 0.10 0.00 0.77 0.00 0.00 66.41 67.36 2ca6 h THR 296 Cb 0.55 1.04 -0.07 0.00 -1.74 0.00 0.00 68.15 67.92 2ca6 h THR 296 CO -0.85 0.05 0.31 0.58 0.37 0.00 0.00 175.52 175.98 2ca6 h VAL 297 N 0.05 0.80 -0.25 3.16 2.07 0.35 0.19 116.25 122.62 2ca6 h VAL 297 Ca 0.02 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 2ca6 h VAL 297 Cb 0.05 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 2ca6 h VAL 297 CO -0.00 0.09 0.08 0.40 0.02 0.00 0.00 177.57 178.16 2ca6 h ILE 298 N 0.52 1.19 -0.24 4.57 2.04 -0.14 1.10 117.51 126.56 2ca6 h ILE 298 Ca 0.35 -0.62 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 2ca6 h ILE 298 Cb 0.41 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 2ca6 h ILE 298 CO -0.30 0.20 0.15 -0.78 0.00 0.00 0.00 178.15 177.42 2ca6 h ASP 299 N 0.23 0.29 0.21 1.72 3.58 -0.63 -2.81 116.42 119.02 2ca6 h ASP 299 Ca 0.08 -0.04 -0.35 0.00 0.42 0.00 0.00 57.03 57.14 2ca6 h ASP 299 Cb 0.24 -0.07 -0.04 0.00 1.72 0.00 0.00 39.33 41.17 2ca6 h ASP 299 CO -0.00 0.25 -2.01 -0.62 -2.88 0.00 0.00 179.24 173.97 2ca6 n GLU 300 N -4.89 0.69 -0.08 0.28 1.02 0.61 -4.66 120.64 113.62 2ca6 n GLU 300 Ca -0.03 0.23 0.05 0.00 -0.02 0.00 0.00 57.16 57.39 2ca6 n GLU 300 Cb 0.05 -1.69 0.09 0.00 -0.02 0.00 0.00 31.44 29.87 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 -3.22 1.59 -3.28 3.49 4.76 0.38 -4.81 118.16 117.07 2ca6 n LYS 301 Ca -0.29 -1.54 -0.25 0.00 -2.87 0.00 0.00 58.31 53.36 2ca6 n LYS 301 Cb 1.05 -1.22 -0.08 0.00 -1.84 0.00 0.00 35.03 32.94 2ca6 n LYS 301 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 2ca6 n MET 302 N 0.51 0.71 0.11 1.97 2.81 -1.06 -3.96 117.12 118.22 2ca6 n MET 302 Ca 0.08 -3.33 0.10 0.00 -1.81 0.00 0.00 57.70 52.74 2ca6 n MET 302 Cb 0.33 -1.43 0.46 0.00 -0.71 0.00 0.00 33.22 31.87 2ca6 n MET 302 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2ca6 n PRO 303 N 1.77 0.14 -0.06 0.03 -0.04 -1.26 -3.00 135.00 132.58 2ca6 n PRO 303 Ca 0.24 0.46 0.07 0.00 -0.04 0.00 0.00 63.50 64.23 2ca6 n PRO 303 Cb 0.50 -1.82 0.10 0.00 -0.04 0.00 0.00 33.50 32.24 2ca6 n PRO 303 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ca6 n ASP 304 N -2.10 2.49 -4.70 3.54 8.00 -1.26 -5.01 116.55 117.50 2ca6 n ASP 304 Ca 0.01 -1.71 -0.42 0.00 0.71 0.00 0.00 54.79 53.38 2ca6 n ASP 304 Cb 0.16 -0.08 -0.00 0.00 -0.02 0.00 0.00 41.12 41.18 2ca6 n ASP 304 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2ca6 n LEU 305 N 0.83 3.78 0.00 0.64 7.94 -0.91 -4.30 117.00 124.99 2ca6 n LEU 305 Ca 0.10 1.18 0.00 0.00 -1.11 0.00 0.00 56.01 56.18 2ca6 n LEU 305 Cb 0.40 -1.50 0.00 0.00 0.53 0.00 0.00 43.42 42.85 2ca6 n LEU 305 CO 0.10 -0.50 -0.23 0.18 -1.11 0.00 0.00 177.39 175.83 2ca6 n LEU 306 N 0.56 0.00 -3.88 -1.96 4.77 0.43 -4.26 117.00 112.67 2ca6 n LEU 306 Ca 0.05 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.83 2ca6 n LEU 306 Cb 0.37 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.30 2ca6 n LEU 306 CO 0.61 0.00 -0.40 -0.36 -1.33 0.00 0.00 177.39 175.91 2ca6 s PHE 307 N -1.39 0.67 -0.05 -1.77 0.08 -0.35 -0.87 117.98 114.30 2ca6 s PHE 307 Ca 0.00 -0.17 0.01 0.00 0.12 0.00 0.00 56.93 56.89 2ca6 s PHE 307 Cb 0.00 -0.62 0.02 0.00 -0.57 0.00 0.00 43.02 41.85 2ca6 s PHE 307 CO 0.00 -0.18 -0.05 -1.17 -0.10 0.00 0.00 175.22 173.71 2ca6 s LEU 308 N 0.97 1.30 -0.24 -0.37 2.96 -0.74 -1.28 118.68 121.27 2ca6 s LEU 308 Ca -0.10 -0.15 0.01 0.00 -0.22 0.00 0.00 54.13 53.67 2ca6 s LEU 308 Cb -0.14 -0.51 0.04 0.00 0.50 0.00 0.00 46.19 46.08 2ca6 s LEU 308 CO -0.00 -0.06 -0.11 -1.61 -1.32 0.00 0.00 176.35 173.24 2ca6 s GLU 309 N 1.01 2.54 0.00 1.98 2.02 -0.70 -1.48 118.70 124.07 2ca6 s GLU 309 Ca -0.09 -1.16 0.00 0.00 0.02 0.00 0.00 54.97 53.74 2ca6 s GLU 309 Cb -0.14 -2.85 0.00 0.00 0.10 0.00 0.00 34.13 31.23 2ca6 s GLU 309 CO -0.00 -0.46 0.58 1.28 0.02 0.00 0.00 175.26 176.68 2ca6 n LEU 310 N 4.53 1.06 -4.76 1.80 4.77 -1.26 -0.92 117.00 122.22 2ca6 n LEU 310 Ca -0.16 -1.06 -0.39 0.00 -0.03 0.00 0.00 56.01 54.38 2ca6 n LEU 310 Cb 0.45 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.57 2ca6 n LEU 310 CO 0.24 0.26 0.98 0.21 -1.33 0.00 0.00 177.39 177.75 2ca6 s ASN 311 N -0.32 5.54 0.00 -1.43 2.47 -1.26 -3.09 114.94 116.85 2ca6 s ASN 311 Ca 0.00 2.74 0.00 0.00 0.42 0.00 0.00 52.86 56.02 2ca6 s ASN 311 Cb 0.00 -2.64 0.00 0.00 -1.45 0.00 0.00 41.25 37.16 2ca6 s ASN 311 CO 0.00 -1.38 0.00 0.61 -3.72 0.00 0.00 177.10 172.61 2ca6 n GLY 312 N 0.66 0.79 3.98 1.21 0.00 -1.15 -1.72 105.19 108.96 2ca6 n GLY 312 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 2ca6 n GLY 312 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ca6 s ASN 313 N -2.99 3.80 -0.43 1.61 0.01 -1.18 -4.20 114.94 111.57 2ca6 s ASN 313 Ca 0.00 -0.26 -0.02 0.00 -0.71 0.00 0.00 52.86 51.87 2ca6 s ASN 313 Cb 0.00 0.06 0.17 0.00 0.41 0.00 0.00 41.25 41.89 2ca6 s ASN 313 CO 0.00 -2.25 2.37 0.54 -1.51 0.00 0.00 177.10 176.25 2ca6 n ARG 314 N -3.19 2.18 -4.04 -0.60 1.74 0.12 -0.17 116.66 112.71 2ca6 n ARG 314 Ca 0.16 -2.13 -0.10 0.00 -0.77 0.00 0.00 57.85 55.02 2ca6 n ARG 314 Cb 0.60 -1.93 -0.08 0.00 -1.02 0.00 0.00 32.46 30.03 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 -2.00 0.58 0.06 -1.55 -0.12 -1.25 -4.16 117.98 109.54 2ca6 s PHE 315 Ca 0.47 -0.95 0.02 0.00 -0.05 0.00 0.00 56.93 56.42 2ca6 s PHE 315 Cb 0.34 -0.23 -0.04 0.00 -0.63 0.00 0.00 43.02 42.46 2ca6 s PHE 315 CO -0.12 -0.63 0.09 -1.54 -0.05 0.00 0.00 175.22 172.97 2ca6 s SER 316 N -3.00 5.65 0.56 1.98 1.04 -1.26 -4.34 113.70 114.34 2ca6 s SER 316 Ca 0.20 0.05 0.26 0.00 0.48 0.00 0.00 55.95 56.94 2ca6 s SER 316 Cb 0.05 -1.56 1.52 0.00 0.10 0.00 0.00 66.02 66.13 2ca6 s SER 316 CO 0.01 0.19 2.05 -0.08 0.98 0.00 0.00 173.24 176.38 2ca6 h GLU 317 N 3.39 0.00 0.00 4.02 4.22 -1.99 0.41 114.58 124.63 2ca6 h GLU 317 Ca -0.47 0.00 0.00 0.00 0.08 0.00 0.00 59.36 58.97 2ca6 h GLU 317 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 2ca6 h GLU 317 CO 0.67 0.00 0.00 0.39 -2.18 0.00 0.00 179.01 177.89 2ca6 n GLU 318 N -4.04 0.80 -2.35 1.92 1.02 -1.26 -4.71 120.64 112.03 2ca6 n GLU 318 Ca 0.04 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.81 2ca6 n GLU 318 Cb 0.42 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.32 2ca6 n GLU 318 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2ca6 s ASP 319 N -2.14 6.54 0.62 1.62 1.01 0.13 -4.91 116.67 119.54 2ca6 s ASP 319 Ca 0.40 2.27 0.33 0.00 0.71 0.00 0.00 52.55 56.27 2ca6 s ASP 319 Cb 0.20 -2.61 1.93 0.00 1.01 0.00 0.00 42.92 43.46 2ca6 s ASP 319 CO 0.37 -0.66 2.23 0.44 0.21 0.00 0.00 175.17 177.76 2ca6 h ASP 320 N 2.54 0.00 -0.58 0.27 3.32 -1.89 -2.00 116.42 118.08 2ca6 h ASP 320 Ca -0.49 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.53 2ca6 h ASP 320 Cb 1.23 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.75 2ca6 h ASP 320 CO 0.62 0.00 0.23 1.62 -1.72 0.00 0.00 179.24 179.99 2ca6 h VAL 321 N 0.00 1.22 -0.24 -1.35 3.04 -1.94 -2.64 116.25 114.34 2ca6 h VAL 321 Ca 0.02 -0.71 0.05 0.00 -1.01 0.00 0.00 66.70 65.05 2ca6 h VAL 321 Cb 0.16 0.50 -0.05 0.00 -2.01 0.00 0.00 31.29 29.89 2ca6 h VAL 321 CO -0.00 0.28 -0.11 0.58 -1.01 0.00 0.00 177.57 177.32 2ca6 h VAL 322 N 0.89 0.65 0.00 1.51 2.07 -1.64 0.11 116.25 119.85 2ca6 h VAL 322 Ca 0.21 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.69 2ca6 h VAL 322 Cb 0.20 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 2ca6 h VAL 322 CO -0.02 0.00 -0.19 0.44 0.02 0.00 0.00 177.57 177.82 2ca6 h ASP 323 N -0.07 0.00 0.05 0.57 5.19 -1.67 -1.24 116.42 119.25 2ca6 h ASP 323 Ca 0.13 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.54 2ca6 h ASP 323 Cb 0.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.77 2ca6 h ASP 323 CO -0.29 0.19 -0.02 -0.33 -3.12 0.00 0.00 179.24 175.67 2ca6 h GLU 324 N 0.00 -0.06 0.03 3.56 5.08 -0.75 -1.72 114.58 120.71 2ca6 h GLU 324 Ca -0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2ca6 h GLU 324 Cb 0.60 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 2ca6 h GLU 324 CO 0.02 0.32 -0.16 0.82 -1.00 0.00 0.00 179.01 179.01 2ca6 h ILE 325 N -0.45 0.61 -0.95 3.13 2.04 -0.58 -1.54 117.51 119.77 2ca6 h ILE 325 Ca -0.01 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.08 2ca6 h ILE 325 Cb 0.41 0.61 -0.07 0.00 -0.74 0.00 0.00 36.82 37.02 2ca6 h ILE 325 CO 0.01 0.00 0.63 0.03 0.00 0.00 0.00 178.15 178.82 2ca6 h ARG 326 N -0.28 0.36 0.00 2.37 3.08 -1.19 0.13 114.38 118.85 2ca6 h ARG 326 Ca 0.04 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 59.96 2ca6 h ARG 326 Cb 0.34 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 2ca6 h ARG 326 CO -0.14 0.24 -0.54 1.49 -1.07 0.00 0.00 179.97 179.95 2ca6 h GLU 327 N 0.37 0.00 -0.33 0.04 4.81 -0.35 -1.44 114.58 117.68 2ca6 h GLU 327 Ca 0.51 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.69 2ca6 h GLU 327 Cb 1.33 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 2ca6 h GLU 327 CO -0.20 0.54 0.02 0.28 -0.73 0.00 0.00 179.01 178.93 2ca6 h VAL 328 N 0.00 1.25 -0.05 0.32 2.07 -0.04 -0.42 116.25 119.38 2ca6 h VAL 328 Ca -0.01 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.60 2ca6 h VAL 328 Cb 1.16 1.19 -0.00 0.00 -1.52 0.00 0.00 31.29 32.12 2ca6 h VAL 328 CO 0.07 0.30 0.02 -0.26 0.02 0.00 0.00 177.57 177.72 2ca6 h PHE 329 N 0.39 0.08 0.09 1.57 0.04 -1.36 -1.83 116.94 115.93 2ca6 h PHE 329 Ca 0.10 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.88 2ca6 h PHE 329 Cb 0.41 -0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.50 2ca6 h PHE 329 CO 0.03 0.24 -0.25 0.77 -0.60 0.00 0.00 178.31 178.50 2ca6 h SER 330 N -0.10 -0.72 -0.53 2.17 0.02 -1.13 0.91 113.55 114.18 2ca6 h SER 330 Ca 0.02 0.09 0.07 0.00 -0.84 0.00 0.00 61.79 61.12 2ca6 h SER 330 Cb 0.20 0.28 -0.06 0.00 0.14 0.00 0.00 62.40 62.96 2ca6 h SER 330 CO -0.00 -0.34 0.21 0.74 -1.14 0.00 0.00 176.83 176.30 2ca6 h THR 331 N -0.44 0.85 0.00 -2.27 2.02 -1.08 -1.53 112.91 110.46 2ca6 h THR 331 Ca 0.04 -0.14 -0.10 0.00 0.77 0.00 0.00 66.41 66.97 2ca6 h THR 331 Cb 0.48 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 2ca6 h THR 331 CO -0.16 0.07 -0.48 0.03 0.37 0.00 0.00 175.52 175.35 2ca6 h ARG 332 N 0.41 0.00 -0.02 6.66 3.08 -0.85 -3.47 114.38 120.19 2ca6 h ARG 332 Ca 0.25 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.30 2ca6 h ARG 332 Cb 0.26 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 2ca6 h ARG 332 CO -0.24 0.48 -0.01 0.41 -1.07 0.00 0.00 179.97 179.55 2ca6 n GLY 333 N -0.05 0.47 3.13 0.04 0.00 0.31 -5.01 105.19 104.09 2ca6 n GLY 333 Ca -0.01 -0.27 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 2ca6 n GLY 333 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ca6 s ARG 334 N -0.65 0.29 0.00 1.61 3.52 -1.02 -5.01 118.95 117.69 2ca6 s ARG 334 Ca 0.00 0.35 0.00 0.00 -0.13 0.00 0.00 55.73 55.95 2ca6 s ARG 334 Cb 0.00 0.13 0.00 0.00 -1.56 0.00 0.00 34.95 33.52 2ca6 s ARG 334 CO 0.00 -0.04 0.00 0.41 -0.81 0.00 0.00 175.30 174.86 2ca6 n GLY 335 N 2.99 2.43 3.28 8.12 0.00 -1.26 -4.47 105.19 116.28 2ca6 n GLY 335 Ca -0.13 -1.76 -0.14 0.00 0.00 0.00 0.00 46.02 43.99 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 -3.90 0.71 0.09 1.61 -1.05 -0.04 -4.82 118.70 111.30 2ca6 s GLU 336 Ca 0.00 -0.06 0.01 0.00 -0.15 0.00 0.00 54.97 54.77 2ca6 s GLU 336 Cb 0.00 0.32 -0.04 0.00 -0.44 0.00 0.00 34.13 33.97 2ca6 s GLU 336 CO 0.00 -0.19 0.22 -1.17 0.95 0.00 0.00 175.26 175.06 2ca6 s LEU 337 N -1.17 4.28 0.80 1.83 2.96 -1.26 -1.79 118.68 124.32 2ca6 s LEU 337 Ca -0.12 0.20 -0.11 0.00 -0.22 0.00 0.00 54.13 53.88 2ca6 s LEU 337 Cb -0.04 -2.88 0.09 0.00 0.50 0.00 0.00 46.19 43.86 2ca6 s LEU 337 CO 0.05 0.13 1.15 1.51 -1.32 0.00 0.00 176.35 177.86 2ca6 s ASP 338 N -2.74 4.42 -0.19 3.68 -4.77 -0.55 -4.93 116.67 111.58 2ca6 s ASP 338 Ca 0.34 0.60 -0.29 0.00 -3.30 0.00 0.00 52.55 49.90 2ca6 s ASP 338 Cb -0.12 -1.08 0.00 0.00 -1.09 0.00 0.00 42.92 40.63 2ca6 s ASP 338 CO 0.27 -1.92 1.09 -0.70 0.70 0.00 0.00 175.17 174.61 2ca6 s GLU 339 N -5.51 4.28 -1.28 2.11 2.56 -1.26 -4.88 118.70 114.71 2ca6 s GLU 339 Ca 0.63 1.44 -0.06 0.00 0.00 0.00 0.00 54.97 56.98 2ca6 s GLU 339 Cb -0.10 -3.65 0.16 0.00 2.00 0.00 0.00 34.13 32.54 2ca6 s GLU 339 CO 0.48 -0.60 2.16 1.28 -0.56 0.00 0.00 175.26 178.02 2ca6 n LEU 340 N 6.18 7.52 -0.10 2.70 4.77 -1.26 -4.66 117.00 132.15 2ca6 n LEU 340 Ca 0.12 -4.87 0.12 0.00 -0.03 0.00 0.00 56.01 51.36 2ca6 n LEU 340 Cb 0.46 -1.38 0.26 0.00 -2.33 0.00 0.00 43.42 40.43 2ca6 n LEU 340 CO 0.53 1.84 0.48 -0.90 -1.33 0.00 0.00 177.39 178.01 2ca6 n ASP 341 N 2.23 0.76 -2.86 -1.43 5.68 -1.26 -4.47 116.55 115.19 2ca6 n ASP 341 Ca 0.53 -0.56 -0.20 0.00 -0.50 0.00 0.00 54.79 54.06 2ca6 n ASP 341 Cb 0.29 0.28 -0.01 0.00 -1.14 0.00 0.00 41.12 40.53 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 -1.17 2.71 -4.86 -1.12 2.03 -1.26 -5.06 116.55 107.83 2ca6 n ASP 342 Ca 0.08 -3.26 -0.29 0.00 0.52 0.00 0.00 54.79 51.83 2ca6 n ASP 342 Cb 0.34 -0.55 0.08 0.00 -0.72 0.00 0.00 41.12 40.28 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 -3.09 2.12 -0.17 -0.67 -1.94 -1.26 -2.95 119.30 111.35 2ca6 s MET 343 Ca 0.41 0.36 0.13 0.00 -1.71 0.00 0.00 55.69 54.88 2ca6 s MET 343 Cb 0.37 -1.95 -0.20 0.00 2.01 0.00 0.00 34.83 35.06 2ca6 s MET 343 CO -0.09 -1.53 0.04 -1.91 -0.01 0.00 0.00 175.02 171.51 2ca6 n GLU 344 N -3.32 1.27 0.00 2.03 2.13 0.76 -4.92 120.64 118.59 2ca6 n GLU 344 Ca 0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.89 2ca6 n GLU 344 Cb 0.59 -1.42 0.00 0.00 0.27 0.00 0.00 31.44 30.88 2ca6 n GLU 344 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81