#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aj9 n THR 2 N 0.00 4.42 -3.87 1.12 -2.24 -1.26 -5.03 114.28 107.43 2aj9 n THR 2 Ca 0.00 -0.50 -0.26 0.00 -2.27 0.00 0.00 64.05 61.02 2aj9 n THR 2 Cb 0.00 -1.40 -0.03 0.00 -2.10 0.00 0.00 70.33 66.80 2aj9 n THR 2 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2aj9 s GLU 3 N -3.11 3.46 -0.18 -0.78 2.02 -1.26 -5.06 118.70 113.79 2aj9 s GLU 3 Ca 0.79 -0.53 -0.29 0.00 0.02 0.00 0.00 54.97 54.96 2aj9 s GLU 3 Cb -0.40 -2.93 -0.01 0.00 0.10 0.00 0.00 34.13 30.90 2aj9 s GLU 3 CO 0.43 0.48 1.20 0.42 0.02 0.00 0.00 175.26 177.82 2aj9 s ILE 4 N -1.79 4.38 1.08 -1.63 1.01 -1.26 -5.01 121.20 117.99 2aj9 s ILE 4 Ca 0.36 1.67 -0.12 0.00 0.00 0.00 0.00 60.65 62.56 2aj9 s ILE 4 Cb -0.11 -4.08 0.24 0.00 0.01 0.00 0.00 42.46 38.52 2aj9 s ILE 4 CO 0.29 -0.15 1.06 0.00 0.00 0.00 0.00 174.94 176.13 2aj9 s ALA 5 N 3.43 0.17 0.31 9.38 0.00 -1.26 -5.07 121.76 128.73 2aj9 s ALA 5 Ca 0.52 -0.06 0.03 0.00 0.00 0.00 0.00 51.96 52.45 2aj9 s ALA 5 Cb -0.20 -3.25 -0.06 0.00 0.00 0.00 0.00 23.12 19.61 2aj9 s ALA 5 CO 0.12 -3.42 0.07 0.95 0.00 0.00 0.00 175.76 173.49 2aj9 s THR 6 N -2.61 0.97 0.40 0.00 -4.23 -1.26 -5.17 115.64 103.74 2aj9 s THR 6 Ca 0.67 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.22 2aj9 s THR 6 Cb -0.23 -2.72 -0.03 0.00 1.34 0.00 0.00 72.50 70.86 2aj9 s THR 6 CO 0.62 0.00 0.14 0.28 -0.54 0.00 0.00 174.62 175.12 2aj9 s THR 7 N -3.42 0.53 -0.07 3.99 -1.32 -1.26 -5.17 115.64 108.92 2aj9 s THR 7 Ca 0.36 -2.00 -0.31 0.00 -1.21 0.00 0.00 61.69 58.53 2aj9 s THR 7 Cb 0.08 -2.37 0.12 0.00 -1.51 0.00 0.00 72.50 68.82 2aj9 s THR 7 CO 0.15 0.00 1.10 -0.94 -2.21 0.00 0.00 174.62 172.72 2aj9 s SER 8 N -3.57 -0.20 0.00 8.08 1.04 -1.18 -4.65 113.70 113.22 2aj9 s SER 8 Ca 0.26 -0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.63 2aj9 s SER 8 Cb 0.03 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.40 2aj9 s SER 8 CO 0.16 -0.43 0.00 0.61 0.98 0.00 0.00 173.24 174.56 2aj9 n GLY 9 N -0.24 4.94 3.69 7.32 0.00 -0.79 -4.17 105.19 115.95 2aj9 n GLY 9 Ca -0.04 -1.42 -0.42 0.00 0.00 0.00 0.00 46.02 44.13 2aj9 n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aj9 s ALA 10 N -1.96 3.69 -0.57 4.61 0.00 -1.26 -4.80 121.76 121.47 2aj9 s ALA 10 Ca 0.00 1.23 0.26 0.00 0.00 0.00 0.00 51.96 53.45 2aj9 s ALA 10 Cb 0.00 -3.71 0.86 0.00 0.00 0.00 0.00 23.12 20.27 2aj9 s ALA 10 CO 0.00 -1.15 1.75 0.07 0.00 0.00 0.00 175.76 176.44 2aj9 h ARG 11 N 8.49 0.00 -4.62 0.00 0.11 -1.91 -3.35 114.38 113.10 2aj9 h ARG 11 Ca -0.43 0.00 -0.70 0.00 0.10 0.00 0.00 59.98 58.95 2aj9 h ARG 11 Cb 1.20 0.00 -0.22 0.00 1.11 0.00 0.00 29.97 32.06 2aj9 h ARG 11 CO 0.93 0.00 -0.49 0.45 0.10 0.00 0.00 179.97 180.96 2aj9 s SER 12 N -4.65 5.87 0.05 0.08 0.15 -1.26 -4.95 113.70 108.99 2aj9 s SER 12 Ca 0.08 -0.79 0.01 0.00 0.70 0.00 0.00 55.95 55.95 2aj9 s SER 12 Cb 0.10 -2.08 -0.03 0.00 -1.71 0.00 0.00 66.02 62.30 2aj9 s SER 12 CO 0.53 -0.35 -0.06 0.68 1.20 0.00 0.00 173.24 175.25 2aj9 s VAL 13 N 1.63 0.45 0.00 4.45 -7.23 -1.26 -2.09 120.40 116.34 2aj9 s VAL 13 Ca 0.04 -1.38 0.00 0.00 -1.81 0.00 0.00 61.98 58.83 2aj9 s VAL 13 Cb -0.18 -0.96 0.00 0.00 0.56 0.00 0.00 36.38 35.80 2aj9 s VAL 13 CO 0.08 -0.62 0.00 0.61 -0.31 0.00 0.00 175.10 174.86 2aj9 n GLY 14 N 0.90 2.42 3.62 2.32 0.00 -0.12 -0.26 105.19 114.07 2aj9 n GLY 14 Ca -0.19 -1.13 -0.40 0.00 0.00 0.00 0.00 46.02 44.30 2aj9 n GLY 14 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aj9 s LEU 15 N 0.00 4.07 0.20 0.99 1.43 -1.26 -2.37 118.68 121.74 2aj9 s LEU 15 Ca 0.00 0.63 0.19 0.00 -1.03 0.00 0.00 54.13 53.92 2aj9 s LEU 15 Cb 0.00 -2.80 0.01 0.00 0.03 0.00 0.00 46.19 43.43 2aj9 s LEU 15 CO 0.00 -0.36 1.12 -0.07 0.23 0.00 0.00 176.35 177.27 2aj9 h LEU 16 N 8.92 0.00 -7.75 1.79 3.38 -0.87 -3.39 115.31 117.39 2aj9 h LEU 16 Ca -0.27 0.00 0.32 0.00 0.09 0.00 0.00 57.88 58.01 2aj9 h LEU 16 Cb 1.13 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.80 2aj9 h LEU 16 CO 0.76 0.30 0.84 -0.94 0.09 0.00 0.00 178.44 179.49 2aj9 s SER 17 N -5.84 -0.01 -0.12 -0.43 1.04 -1.24 -4.00 113.70 103.09 2aj9 s SER 17 Ca 0.01 -0.24 -0.10 0.00 0.48 0.00 0.00 55.95 56.09 2aj9 s SER 17 Cb 0.08 0.20 0.03 0.00 0.10 0.00 0.00 66.02 66.43 2aj9 s SER 17 CO 0.77 -0.39 0.31 0.54 0.98 0.00 0.00 173.24 175.46 2aj9 s VAL 18 N -2.16 -0.00 -0.00 5.02 0.11 -1.26 -2.31 120.40 119.79 2aj9 s VAL 18 Ca 0.24 0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.34 2aj9 s VAL 18 Cb 0.01 -0.45 -0.01 0.00 -1.53 0.00 0.00 36.38 34.40 2aj9 s VAL 18 CO -0.01 0.01 -0.12 -0.83 -3.33 0.00 0.00 175.10 170.82 2aj9 s GLY 19 N 0.28 0.58 -0.02 6.54 0.00 0.35 -4.59 107.32 110.46 2aj9 s GLY 19 Ca -0.01 -0.54 0.04 0.00 0.00 0.00 0.00 44.72 44.21 2aj9 s GLY 19 CO -0.01 -0.46 -0.13 0.00 0.00 0.00 0.00 173.10 172.50 2aj9 s ALA 20 N -0.36 1.12 -0.20 3.20 0.00 -1.26 -0.03 121.76 124.23 2aj9 s ALA 20 Ca 0.04 -0.54 0.01 0.00 0.00 0.00 0.00 51.96 51.47 2aj9 s ALA 20 Cb -0.05 -0.33 0.04 0.00 0.00 0.00 0.00 23.12 22.78 2aj9 s ALA 20 CO -0.00 0.24 -0.13 -0.47 0.00 0.00 0.00 175.76 175.40 2aj9 s TYR 21 N -0.15 2.58 -0.23 0.00 5.04 0.79 -4.90 117.35 120.48 2aj9 s TYR 21 Ca 0.02 -1.67 -0.04 0.00 -2.44 0.00 0.00 57.07 52.94 2aj9 s TYR 21 Cb -0.07 -1.73 -0.00 0.00 0.35 0.00 0.00 41.96 40.51 2aj9 s TYR 21 CO 0.00 -0.77 -0.02 1.03 -1.34 0.00 0.00 175.55 174.45 2aj9 s ARG 22 N 1.34 3.29 0.78 4.97 0.52 -1.26 -2.40 118.95 126.20 2aj9 s ARG 22 Ca -0.00 -0.69 -0.16 0.00 -0.52 0.00 0.00 55.73 54.36 2aj9 s ARG 22 Cb -0.16 -3.07 -0.09 0.00 0.52 0.00 0.00 34.95 32.15 2aj9 s ARG 22 CO -0.09 -0.25 -0.03 -2.30 0.02 0.00 0.00 175.30 172.65 2aj9 n PRO 23 N 4.80 0.07 -0.02 3.54 -0.02 -1.26 -4.93 135.00 137.17 2aj9 n PRO 23 Ca -0.17 0.04 -0.16 0.00 -2.02 0.00 0.00 63.50 61.19 2aj9 n PRO 23 Cb 0.50 -1.40 -0.10 0.00 -0.02 0.00 0.00 33.50 32.48 2aj9 n PRO 23 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2aj9 h GLU 24 N -0.62 0.32 -6.50 -0.52 4.81 -1.99 -3.44 114.58 106.64 2aj9 h GLU 24 Ca -0.44 -0.29 -0.53 0.00 -0.13 0.00 0.00 59.36 57.97 2aj9 h GLU 24 Cb 1.35 0.07 0.04 0.00 0.63 0.00 0.00 28.75 30.84 2aj9 h GLU 24 CO 0.36 0.96 1.09 0.50 -0.73 0.00 0.00 179.01 181.18 2aj9 s ARG 25 N -3.42 4.15 -0.42 1.92 3.00 -1.24 -4.94 118.95 118.01 2aj9 s ARG 25 Ca -0.14 2.54 -0.10 0.00 -1.00 0.00 0.00 55.73 57.03 2aj9 s ARG 25 Cb 0.03 -3.59 0.07 0.00 0.00 0.00 0.00 34.95 31.46 2aj9 s ARG 25 CO 0.78 -0.82 0.26 0.08 0.00 0.00 0.00 175.30 175.60 2aj9 s VAL 26 N 2.69 4.35 -0.16 7.11 1.01 -1.26 -1.78 120.40 132.36 2aj9 s VAL 26 Ca 0.79 -1.30 -0.19 0.00 0.00 0.00 0.00 61.98 61.28 2aj9 s VAL 26 Cb -0.45 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 2aj9 s VAL 26 CO 0.35 -0.47 0.54 -0.69 0.00 0.00 0.00 175.10 174.83 2aj9 s VAL 27 N 1.46 5.11 0.60 2.92 1.01 -0.12 -4.94 120.40 126.44 2aj9 s VAL 27 Ca 0.03 1.05 -0.01 0.00 0.00 0.00 0.00 61.98 63.05 2aj9 s VAL 27 Cb -0.23 -3.87 0.05 0.00 0.00 0.00 0.00 36.38 32.33 2aj9 s VAL 27 CO 0.03 0.22 0.85 0.42 0.00 0.00 0.00 175.10 176.62 2aj9 s THR 28 N 1.27 2.52 0.20 3.92 -4.23 -1.26 -1.78 115.64 116.29 2aj9 s THR 28 Ca 0.27 -0.57 -0.05 0.00 -1.18 0.00 0.00 61.69 60.15 2aj9 s THR 28 Cb -0.16 -2.95 -0.00 0.00 1.34 0.00 0.00 72.50 70.73 2aj9 s THR 28 CO 0.11 0.00 1.57 0.78 -0.54 0.00 0.00 174.62 176.54 2aj9 h ASN 29 N -0.14 0.79 0.19 3.99 2.35 -1.87 -2.94 115.58 117.94 2aj9 h ASN 29 Ca -0.42 -0.33 -0.06 0.00 -0.55 0.00 0.00 56.30 54.94 2aj9 h ASN 29 Cb 1.30 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 39.44 2aj9 h ASN 29 CO 0.52 1.05 -0.24 0.44 -1.65 0.00 0.00 177.43 177.55 2aj9 h ASP 30 N 0.63 0.10 1.29 5.81 5.19 -1.95 0.68 116.42 128.18 2aj9 h ASP 30 Ca 0.07 -0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.44 2aj9 h ASP 30 Cb 0.87 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 40.35 2aj9 h ASP 30 CO 0.08 0.36 -0.04 -0.08 -3.12 0.00 0.00 179.24 176.43 2aj9 h GLU 31 N 0.10 0.00 0.01 3.56 4.81 -1.92 -2.94 114.58 118.20 2aj9 h GLU 31 Ca 0.02 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 58.95 2aj9 h GLU 31 Cb 0.49 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.82 2aj9 h GLU 31 CO 0.03 0.04 -1.73 -0.89 -0.73 0.00 0.00 179.01 175.74 2aj9 n ILE 32 N -3.14 1.62 1.40 2.32 5.41 -0.27 -3.88 119.36 122.82 2aj9 n ILE 32 Ca 0.01 -0.79 0.00 0.00 1.00 0.00 0.00 62.75 62.98 2aj9 n ILE 32 Cb 0.39 -1.08 0.00 0.00 -0.71 0.00 0.00 39.64 38.24 2aj9 n ILE 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2aj9 n GLN 34 N -0.32 0.10 0.00 0.00 6.02 -1.22 -3.64 117.38 118.32 2aj9 n GLN 34 Ca 0.00 0.13 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 2aj9 n GLN 34 Cb 0.06 -1.63 0.00 0.00 1.02 0.00 0.00 30.24 29.70 2aj9 n GLN 34 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2aj9 n HIS 35 N -1.80 0.00 -4.67 1.08 8.25 -1.06 -5.07 115.22 111.95 2aj9 n HIS 35 Ca 0.06 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.24 2aj9 n HIS 35 Cb 0.34 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.31 2aj9 n HIS 35 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 2aj9 s ILE 36 N -0.41 1.97 -1.31 1.59 1.10 -1.23 -4.72 121.20 118.18 2aj9 s ILE 36 Ca 0.00 -1.41 -0.12 0.00 -0.51 0.00 0.00 60.65 58.62 2aj9 s ILE 36 Cb 0.00 -1.71 0.13 0.00 0.15 0.00 0.00 42.46 41.03 2aj9 s ILE 36 CO 0.00 0.22 1.89 -0.67 -2.11 0.00 0.00 174.94 174.27 2aj9 n ASP 37 N 1.58 4.82 -1.44 4.50 4.64 -1.26 -4.65 116.55 124.74 2aj9 n ASP 37 Ca -0.17 -3.02 -0.04 0.00 -1.38 0.00 0.00 54.79 50.18 2aj9 n ASP 37 Cb 0.53 -1.55 -0.01 0.00 -1.04 0.00 0.00 41.12 39.04 2aj9 n ASP 37 CO 0.00 0.00 0.00 -0.24 -0.82 0.00 0.00 177.20 176.14 2aj9 n SER 38 N 4.91 -0.11 -4.05 1.67 2.88 -1.26 -5.17 113.62 112.48 2aj9 n SER 38 Ca 0.43 -1.42 -0.15 0.00 -1.33 0.00 0.00 58.87 56.40 2aj9 n SER 38 Cb 0.38 0.32 -0.10 0.00 -0.75 0.00 0.00 64.21 64.07 2aj9 n SER 38 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2aj9 s SER 39 N -1.45 0.81 0.10 -3.46 0.15 -1.26 -4.95 113.70 103.63 2aj9 s SER 39 Ca 0.08 -1.48 -0.20 0.00 0.70 0.00 0.00 55.95 55.05 2aj9 s SER 39 Cb 0.00 0.37 -0.09 0.00 -1.71 0.00 0.00 66.02 64.60 2aj9 s SER 39 CO 0.05 -0.86 1.67 -0.78 1.20 0.00 0.00 173.24 174.52 2aj9 h ASP 40 N 2.43 0.25 0.86 5.45 -0.00 -2.00 -1.96 116.42 121.45 2aj9 h ASP 40 Ca -0.34 -0.12 -0.18 0.00 -0.00 0.00 0.00 57.03 56.38 2aj9 h ASP 40 Cb 1.25 -0.06 -0.03 0.00 -0.00 0.00 0.00 39.33 40.49 2aj9 h ASP 40 CO 0.52 0.30 -0.87 -0.08 -0.00 0.00 0.00 179.24 179.11 2aj9 h GLU 41 N 0.18 0.01 -0.78 0.28 4.81 -1.97 -2.03 114.58 115.08 2aj9 h GLU 41 Ca 0.07 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2aj9 h GLU 41 Cb 0.12 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 2aj9 h GLU 41 CO -0.01 0.87 0.46 0.00 -0.73 0.00 0.00 179.01 179.61 2aj9 h ALA 42 N 1.13 0.99 -0.03 2.92 0.00 -1.88 -0.20 119.26 122.19 2aj9 h ALA 42 Ca -0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2aj9 h ALA 42 Cb 1.54 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2aj9 h ALA 42 CO 0.11 0.47 -0.08 0.82 0.00 0.00 0.00 179.25 180.58 2aj9 h ILE 43 N 1.07 1.47 -0.75 0.00 2.04 -1.29 -2.34 117.51 117.71 2aj9 h ILE 43 Ca 0.28 -1.49 0.03 0.00 1.00 0.00 0.00 64.86 64.68 2aj9 h ILE 43 Cb -0.03 2.39 -0.04 0.00 -0.74 0.00 0.00 36.82 38.40 2aj9 h ILE 43 CO -0.05 0.40 0.49 0.22 0.00 0.00 0.00 178.15 179.21 2aj9 h TYR 44 N -0.47 0.89 -0.08 1.37 5.03 -1.18 0.46 116.97 122.99 2aj9 h TYR 44 Ca -0.00 0.02 -0.20 0.00 2.58 0.00 0.00 58.73 61.13 2aj9 h TYR 44 Cb 0.69 -0.30 0.01 0.00 1.55 0.00 0.00 36.73 38.68 2aj9 h TYR 44 CO 0.13 0.53 -0.75 1.79 -1.32 0.00 0.00 178.16 178.54 2aj9 h THR 45 N 0.94 1.32 0.00 1.81 1.35 -1.11 0.22 112.91 117.44 2aj9 h THR 45 Ca 0.29 -2.02 -0.12 0.00 -0.55 0.00 0.00 66.41 64.01 2aj9 h THR 45 Cb 0.02 2.23 -0.02 0.00 -1.73 0.00 0.00 68.15 68.65 2aj9 h THR 45 CO -0.08 0.62 -0.59 -0.09 -0.25 0.00 0.00 175.52 175.13 2aj9 h ARG 46 N 0.30 0.00 0.00 4.72 2.43 -0.82 -3.40 114.38 117.61 2aj9 h ARG 46 Ca -0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2aj9 h ARG 46 Cb 1.40 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.95 2aj9 h ARG 46 CO 0.15 0.59 -0.99 0.25 -1.51 0.00 0.00 179.97 178.46 2aj9 n THR 47 N -3.36 0.00 -0.87 0.20 -2.24 0.16 -4.72 114.28 103.44 2aj9 n THR 47 Ca 0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 2aj9 n THR 47 Cb 0.72 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 2aj9 n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2aj9 n GLY 48 N 2.58 0.56 3.75 3.38 0.00 0.77 -1.96 105.19 114.28 2aj9 n GLY 48 Ca 0.00 -0.01 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2aj9 n GLY 48 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2aj9 s ILE 49 N -2.00 5.12 -0.13 -0.61 1.01 -1.26 -3.68 121.20 119.65 2aj9 s ILE 49 Ca 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 60.65 60.71 2aj9 s ILE 49 Cb 0.00 -3.27 -0.07 0.00 0.01 0.00 0.00 42.46 39.13 2aj9 s ILE 49 CO 0.00 0.53 -0.13 0.29 0.00 0.00 0.00 174.94 175.62 2aj9 n LYS 50 N 2.84 0.30 -4.02 2.79 4.76 0.49 -3.64 118.16 121.68 2aj9 n LYS 50 Ca -0.18 0.09 -0.10 0.00 -2.87 0.00 0.00 58.31 55.25 2aj9 n LYS 50 Cb 0.53 -1.16 -0.05 0.00 -1.84 0.00 0.00 35.03 32.51 2aj9 n LYS 50 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2aj9 s THR 51 N -2.25 0.00 0.13 -0.18 -4.23 -0.75 -2.58 115.64 105.78 2aj9 s THR 51 Ca -0.18 -1.47 -0.23 0.00 -1.18 0.00 0.00 61.69 58.63 2aj9 s THR 51 Cb 0.05 -2.32 0.07 0.00 1.34 0.00 0.00 72.50 71.64 2aj9 s THR 51 CO 0.27 0.00 0.59 0.00 -0.54 0.00 0.00 174.62 174.94 2aj9 s ARG 52 N -3.82 1.23 0.09 3.99 3.03 -0.73 -3.20 118.95 119.53 2aj9 s ARG 52 Ca 0.25 -0.38 -0.08 0.00 2.03 0.00 0.00 55.73 57.54 2aj9 s ARG 52 Cb -0.00 0.56 -0.06 0.00 -1.03 0.00 0.00 34.95 34.43 2aj9 s ARG 52 CO 0.11 -0.51 0.38 1.03 -1.13 0.00 0.00 175.30 175.17 2aj9 s ARG 53 N -3.37 3.70 -0.02 3.89 1.81 -1.26 -0.94 118.95 122.76 2aj9 s ARG 53 Ca -0.01 0.07 0.07 0.00 -1.72 0.00 0.00 55.73 54.14 2aj9 s ARG 53 Cb -0.01 -2.96 -0.02 0.00 -0.45 0.00 0.00 34.95 31.51 2aj9 s ARG 53 CO -0.10 0.55 -0.21 -0.06 -0.68 0.00 0.00 175.30 174.80 2aj9 s PHE 54 N -1.46 1.92 0.37 -0.53 0.40 -0.73 -1.61 117.98 116.34 2aj9 s PHE 54 Ca 0.34 -0.37 -0.15 0.00 -0.60 0.00 0.00 56.93 56.16 2aj9 s PHE 54 Cb -0.13 -1.24 -0.08 0.00 0.51 0.00 0.00 43.02 42.08 2aj9 s PHE 54 CO 0.19 -0.04 0.79 0.00 0.70 0.00 0.00 175.22 176.87 2aj9 s ALA 55 N -0.49 3.28 0.90 5.36 0.00 -1.26 -3.65 121.76 125.90 2aj9 s ALA 55 Ca 0.08 0.03 -0.10 0.00 0.00 0.00 0.00 51.96 51.97 2aj9 s ALA 55 Cb -0.08 -2.82 0.14 0.00 0.00 0.00 0.00 23.12 20.35 2aj9 s ALA 55 CO -0.01 0.18 1.12 0.00 0.00 0.00 0.00 175.76 177.05 2aj9 s ALA 56 N -2.15 1.48 0.49 0.00 0.00 -1.26 -4.90 121.76 115.43 2aj9 s ALA 56 Ca 0.55 0.40 0.17 0.00 0.00 0.00 0.00 51.96 53.08 2aj9 s ALA 56 Cb -0.10 -3.37 1.21 0.00 0.00 0.00 0.00 23.12 20.86 2aj9 s ALA 56 CO 0.21 -2.60 2.09 -0.44 0.00 0.00 0.00 175.76 175.03 2aj9 h ASP 57 N -1.74 0.00 0.65 0.00 3.32 -2.06 -2.01 116.42 114.58 2aj9 h ASP 57 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 2aj9 h ASP 57 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 2aj9 h ASP 57 CO 0.46 0.07 -0.31 -0.90 -1.72 0.00 0.00 179.24 176.83 2aj9 n ASP 58 N -4.38 0.35 -4.86 6.45 5.75 -1.26 -4.87 116.55 113.72 2aj9 n ASP 58 Ca -0.03 -0.04 -0.31 0.00 -0.01 0.00 0.00 54.79 54.39 2aj9 n ASP 58 Cb 0.15 -0.01 -0.05 0.00 -1.03 0.00 0.00 41.12 40.19 2aj9 n ASP 58 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2aj9 s GLU 59 N -2.96 3.89 0.34 0.11 2.02 -0.76 -5.04 118.70 116.30 2aj9 s GLU 59 Ca 0.13 0.54 0.07 0.00 0.02 0.00 0.00 54.97 55.74 2aj9 s GLU 59 Cb 0.18 -2.43 -0.03 0.00 0.10 0.00 0.00 34.13 31.95 2aj9 s GLU 59 CO 0.63 0.09 0.30 -1.54 0.02 0.00 0.00 175.26 174.76 2aj9 s SER 60 N -2.66 1.74 0.17 -0.19 1.04 -1.26 -4.80 113.70 107.72 2aj9 s SER 60 Ca 0.52 -1.77 -0.15 0.00 0.48 0.00 0.00 55.95 55.03 2aj9 s SER 60 Cb -0.10 0.57 0.07 0.00 0.10 0.00 0.00 66.02 66.66 2aj9 s SER 60 CO 0.24 -1.09 1.80 0.00 0.98 0.00 0.00 173.24 175.17 2aj9 h ALA 61 N 2.10 0.57 0.39 5.32 0.00 -1.89 -1.91 119.26 123.84 2aj9 h ALA 61 Ca -0.24 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2aj9 h ALA 61 Cb 1.23 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2aj9 h ALA 61 CO 0.35 -0.06 -0.19 0.00 0.00 0.00 0.00 179.25 179.36 2aj9 h ALA 62 N 1.20 -0.53 -0.79 0.00 0.00 -1.94 -1.07 119.26 116.13 2aj9 h ALA 62 Ca 0.18 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.03 2aj9 h ALA 62 Cb 0.02 0.20 -0.07 0.00 0.00 0.00 0.00 17.79 17.95 2aj9 h ALA 62 CO -0.09 -0.75 0.46 0.66 0.00 0.00 0.00 179.25 179.53 2aj9 h SER 63 N -0.62 0.66 0.55 0.00 4.64 -1.92 -0.81 113.55 116.05 2aj9 h SER 63 Ca -0.05 0.04 -0.11 0.00 -0.47 0.00 0.00 61.79 61.19 2aj9 h SER 63 Cb 0.46 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.44 2aj9 h SER 63 CO 0.09 0.40 -0.54 0.24 -0.87 0.00 0.00 176.83 176.14 2aj9 h MET 64 N 0.79 0.00 0.03 4.77 0.00 -1.28 -1.97 114.93 117.27 2aj9 h MET 64 Ca 0.37 0.00 -0.00 0.00 0.00 0.00 0.00 59.70 60.07 2aj9 h MET 64 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 31.60 31.90 2aj9 h MET 64 CO -0.23 0.54 -0.02 0.00 0.00 0.00 0.00 176.91 177.21 2aj9 h ALA 65 N 1.46 -0.05 -0.18 6.32 0.00 0.19 -0.64 119.26 126.35 2aj9 h ALA 65 Ca -0.01 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.90 2aj9 h ALA 65 Cb 0.96 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.71 2aj9 h ALA 65 CO 0.07 -0.48 -0.20 0.00 0.00 0.00 0.00 179.25 178.64 2aj9 h THR 66 N -0.14 0.48 -0.31 0.00 1.03 -1.35 0.13 112.91 112.75 2aj9 h THR 66 Ca -0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 66.41 66.38 2aj9 h THR 66 Cb 0.13 0.48 -0.02 0.00 -1.07 0.00 0.00 68.15 67.67 2aj9 h THR 66 CO 0.01 0.00 0.15 -0.08 -0.01 0.00 0.00 175.52 175.58 2aj9 h GLU 67 N -0.23 0.43 0.00 0.00 4.57 -0.90 -0.35 114.58 118.11 2aj9 h GLU 67 Ca 0.12 -0.04 -0.18 0.00 -1.18 0.00 0.00 59.36 58.07 2aj9 h GLU 67 Cb 0.40 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.88 2aj9 h GLU 67 CO -0.31 0.34 -0.86 0.00 -1.18 0.00 0.00 179.01 176.99 2aj9 h ALA 68 N 1.73 0.57 -0.38 2.92 0.00 -0.31 -3.16 119.26 120.62 2aj9 h ALA 68 Ca 0.11 -0.77 -0.16 0.00 0.00 0.00 0.00 54.91 54.10 2aj9 h ALA 68 Cb 0.06 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2aj9 h ALA 68 CO -0.02 1.03 -0.37 0.00 0.00 0.00 0.00 179.25 179.89 2aj9 h ARG 70 N 0.76 0.36 0.09 0.00 3.08 -1.09 0.36 114.38 117.93 2aj9 h ARG 70 Ca 0.06 -0.02 -0.26 0.00 0.07 0.00 0.00 59.98 59.83 2aj9 h ARG 70 Cb 0.96 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.93 2aj9 h ARG 70 CO 0.09 0.25 -1.18 0.00 -1.07 0.00 0.00 179.97 178.06 2aj9 h ARG 71 N 0.37 0.19 -0.37 0.04 3.08 -1.49 -2.39 114.38 113.80 2aj9 h ARG 71 Ca 0.10 -0.32 -0.10 0.00 0.07 0.00 0.00 59.98 59.73 2aj9 h ARG 71 Cb -0.02 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 2aj9 h ARG 71 CO -0.02 1.15 -0.17 0.00 -1.07 0.00 0.00 179.97 179.86 2aj9 h ALA 72 N 0.71 1.02 0.13 0.04 0.00 -0.48 0.37 119.26 121.05 2aj9 h ALA 72 Ca -0.10 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 2aj9 h ALA 72 Cb 1.91 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.55 2aj9 h ALA 72 CO 0.18 0.59 -0.06 -0.07 0.00 0.00 0.00 179.25 179.88 2aj9 h LEU 73 N 0.61 -0.15 -0.46 0.00 4.07 -0.98 -1.65 115.31 116.74 2aj9 h LEU 73 Ca 0.10 -0.27 0.03 0.00 0.08 0.00 0.00 57.88 57.82 2aj9 h LEU 73 Cb 0.62 0.04 -0.04 0.00 1.08 0.00 0.00 40.66 42.37 2aj9 h LEU 73 CO 0.04 0.20 0.25 -1.28 -1.08 0.00 0.00 178.44 176.58 2aj9 h SER 74 N -0.51 0.39 0.30 -0.43 0.87 -1.29 0.12 113.55 112.99 2aj9 h SER 74 Ca -0.02 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 2aj9 h SER 74 Cb 0.40 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.30 2aj9 h SER 74 CO 0.03 0.28 -0.10 0.78 -0.53 0.00 0.00 176.83 177.28 2aj9 h ASN 75 N 0.51 0.00 0.19 6.23 -0.26 -0.93 -0.66 115.58 120.66 2aj9 h ASN 75 Ca 0.19 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.93 2aj9 h ASN 75 Cb 0.06 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.32 2aj9 h ASN 75 CO -0.11 0.10 -0.35 0.00 -1.06 0.00 0.00 177.43 176.01 2aj9 n ALA 76 N -2.30 3.27 -3.58 -0.83 0.00 -0.36 -4.89 120.51 111.83 2aj9 n ALA 76 Ca -0.02 -0.46 -0.20 0.00 0.00 0.00 0.00 53.44 52.76 2aj9 n ALA 76 Cb 0.21 -1.04 0.06 0.00 0.00 0.00 0.00 19.45 18.68 2aj9 n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aj9 n GLY 77 N 1.37 -0.37 3.65 0.00 0.00 0.25 -5.01 105.19 105.09 2aj9 n GLY 77 Ca 0.11 0.14 -0.27 0.00 0.00 0.00 0.00 46.02 46.00 2aj9 n GLY 77 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aj9 s LEU 78 N -6.66 2.96 0.11 0.99 1.02 -0.31 -5.03 118.68 111.76 2aj9 s LEU 78 Ca 0.12 -1.23 0.09 0.00 0.02 0.00 0.00 54.13 53.13 2aj9 s LEU 78 Cb -0.06 -1.12 -0.04 0.00 0.02 0.00 0.00 46.19 45.00 2aj9 s LEU 78 CO 0.77 -0.45 -0.21 -0.55 0.02 0.00 0.00 176.35 175.93 2aj9 s SER 79 N -3.77 3.68 0.47 2.29 0.15 -1.26 -4.35 113.70 110.91 2aj9 s SER 79 Ca 0.37 -0.60 0.27 0.00 0.70 0.00 0.00 55.95 56.69 2aj9 s SER 79 Cb 0.07 -0.45 1.32 0.00 -1.71 0.00 0.00 66.02 65.25 2aj9 s SER 79 CO 0.19 0.19 1.79 0.00 1.20 0.00 0.00 173.24 176.62 2aj9 h ALA 80 N 3.92 2.65 0.00 5.45 0.00 -1.92 0.16 119.26 129.53 2aj9 h ALA 80 Ca -0.50 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 2aj9 h ALA 80 Cb 1.17 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 2aj9 h ALA 80 CO 0.44 -1.03 -0.09 0.00 0.00 0.00 0.00 179.25 178.57 2aj9 h ALA 81 N 1.53 1.78 0.00 0.00 0.00 -1.90 -2.05 119.26 118.62 2aj9 h ALA 81 Ca 0.58 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.41 2aj9 h ALA 81 Cb 1.86 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.64 2aj9 h ALA 81 CO -0.16 0.11 0.00 -0.25 0.00 0.00 0.00 179.25 178.95 2aj9 n ASP 82 N -4.33 0.00 -4.79 0.00 9.92 0.57 -4.76 116.55 113.16 2aj9 n ASP 82 Ca -0.03 0.07 -0.38 0.00 -0.53 0.00 0.00 54.79 53.93 2aj9 n ASP 82 Cb 0.17 -0.33 -0.06 0.00 -0.64 0.00 0.00 41.12 40.26 2aj9 n ASP 82 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2aj9 s ILE 83 N -2.66 5.12 -1.10 0.53 1.01 -0.77 -4.53 121.20 118.80 2aj9 s ILE 83 Ca 0.19 0.83 0.15 0.00 0.00 0.00 0.00 60.65 61.82 2aj9 s ILE 83 Cb 0.15 -3.73 -0.07 0.00 0.01 0.00 0.00 42.46 38.82 2aj9 s ILE 83 CO 0.36 0.48 0.74 0.47 0.00 0.00 0.00 174.94 176.99 2aj9 n ASP 84 N 2.61 1.19 -3.65 3.58 9.92 0.94 -5.00 116.55 126.14 2aj9 n ASP 84 Ca -0.12 -1.10 -0.01 0.00 -0.53 0.00 0.00 54.79 53.03 2aj9 n ASP 84 Cb 0.52 0.70 -0.04 0.00 -0.64 0.00 0.00 41.12 41.66 2aj9 n ASP 84 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2aj9 s GLY 85 N -2.07 0.10 -0.04 0.44 0.00 -1.22 -3.80 107.32 100.73 2aj9 s GLY 85 Ca 0.10 2.84 0.03 0.00 0.00 0.00 0.00 44.72 47.68 2aj9 s GLY 85 CO 0.48 1.08 -0.11 0.54 0.00 0.00 0.00 173.10 175.10 2aj9 s VAL 86 N -1.07 0.94 -0.22 1.40 0.11 -0.87 -0.49 120.40 120.20 2aj9 s VAL 86 Ca 0.10 -0.42 -0.04 0.00 -2.93 0.00 0.00 61.98 58.68 2aj9 s VAL 86 Cb -0.01 -0.85 -0.01 0.00 -1.53 0.00 0.00 36.38 33.98 2aj9 s VAL 86 CO -0.08 0.30 -0.03 -0.63 -3.33 0.00 0.00 175.10 171.33 2aj9 s ILE 87 N 0.34 3.50 -0.26 7.04 1.01 0.10 -2.96 121.20 129.98 2aj9 s ILE 87 Ca -0.07 -0.45 -0.09 0.00 0.00 0.00 0.00 60.65 60.04 2aj9 s ILE 87 Cb -0.11 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.72 2aj9 s ILE 87 CO 0.01 0.41 0.13 -0.69 0.00 0.00 0.00 174.94 174.81 2aj9 s VAL 88 N 1.50 4.86 -0.13 2.92 1.01 -0.57 -1.79 120.40 128.19 2aj9 s VAL 88 Ca 0.06 0.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.04 2aj9 s VAL 88 Cb -0.14 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.92 2aj9 s VAL 88 CO -0.02 0.30 -0.09 0.28 0.00 0.00 0.00 175.10 175.56 2aj9 s THR 89 N 1.62 3.41 -0.03 3.92 -1.32 -0.41 -0.45 115.64 122.37 2aj9 s THR 89 Ca 0.07 -0.54 -0.30 0.00 -1.21 0.00 0.00 61.69 59.70 2aj9 s THR 89 Cb -0.15 -2.45 0.11 0.00 -1.51 0.00 0.00 72.50 68.49 2aj9 s THR 89 CO 0.07 0.52 1.14 0.28 -2.21 0.00 0.00 174.62 174.42 2aj9 s THR 90 N 0.26 0.00 0.00 5.08 -1.32 -0.91 -2.20 115.64 116.55 2aj9 s THR 90 Ca -0.07 -0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.20 2aj9 s THR 90 Cb -0.15 -1.57 0.00 0.00 -1.51 0.00 0.00 72.50 69.27 2aj9 s THR 90 CO 0.04 0.00 0.61 0.59 -2.21 0.00 0.00 174.62 173.66 2aj9 n ASN 91 N -0.34 0.69 -0.50 8.08 3.02 -1.26 -4.42 115.26 120.53 2aj9 n ASN 91 Ca -0.06 -1.32 0.06 0.00 -0.03 0.00 0.00 54.58 53.24 2aj9 n ASN 91 Cb 0.61 0.00 0.19 0.00 -0.61 0.00 0.00 39.78 39.97 2aj9 n ASN 91 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2aj9 n THR 92 N -0.16 2.15 -2.90 3.41 -2.24 -1.26 -4.94 114.28 108.34 2aj9 n THR 92 Ca 0.00 -2.86 -0.43 0.00 -2.27 0.00 0.00 64.05 58.49 2aj9 n THR 92 Cb 0.37 -0.25 -0.05 0.00 -2.10 0.00 0.00 70.33 68.31 2aj9 n THR 92 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2aj9 s HIS 93 N -3.12 3.01 -0.60 4.78 5.04 -1.26 -4.55 115.29 118.59 2aj9 s HIS 93 Ca 0.37 0.40 -0.03 0.00 -1.54 0.00 0.00 55.06 54.25 2aj9 s HIS 93 Cb 0.35 -3.71 0.13 0.00 0.04 0.00 0.00 32.58 29.39 2aj9 s HIS 93 CO -0.03 -0.95 2.57 1.19 -2.34 0.00 0.00 174.74 175.18 2aj9 n PHE 94 N 6.81 1.97 -3.66 3.88 3.01 -1.26 -4.76 117.46 123.45 2aj9 n PHE 94 Ca 0.04 -2.08 -0.09 0.00 1.01 0.00 0.00 57.45 56.33 2aj9 n PHE 94 Cb 0.48 -1.36 -0.10 0.00 -0.01 0.00 0.00 39.48 38.49 2aj9 n PHE 94 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2aj9 s LEU 95 N -2.64 -0.55 0.57 4.37 1.43 -1.26 -5.02 118.68 115.58 2aj9 s LEU 95 Ca 0.57 0.93 0.25 0.00 -1.03 0.00 0.00 54.13 54.85 2aj9 s LEU 95 Cb 0.38 1.27 1.64 0.00 0.03 0.00 0.00 46.19 49.51 2aj9 s LEU 95 CO -0.26 -0.23 2.22 1.56 0.23 0.00 0.00 176.35 179.87 2aj9 h GLN 96 N 8.10 0.00 -1.37 1.70 1.08 -2.03 -3.44 115.11 119.14 2aj9 h GLN 96 Ca -0.17 0.00 0.15 0.00 -1.45 0.00 0.00 58.65 57.17 2aj9 h GLN 96 Cb 1.11 0.00 -0.25 0.00 -0.05 0.00 0.00 27.48 28.30 2aj9 h GLN 96 CO 0.14 0.00 0.71 -0.08 -0.95 0.00 0.00 178.83 178.64 2aj9 s THR 97 N -4.78 0.00 0.63 -0.54 -1.32 -1.26 -4.72 115.64 103.65 2aj9 s THR 97 Ca -0.05 0.00 -0.13 0.00 -1.21 0.00 0.00 61.69 60.30 2aj9 s THR 97 Cb 0.16 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 70.13 2aj9 s THR 97 CO 0.59 0.00 1.05 -2.16 -2.21 0.00 0.00 174.62 171.89 2aj9 s PRO 98 N -1.11 3.24 1.23 7.08 0.04 -1.26 -5.15 135.00 139.06 2aj9 s PRO 98 Ca 0.03 1.03 -0.15 0.00 0.04 0.00 0.00 61.00 61.95 2aj9 s PRO 98 Cb -0.01 -2.03 0.30 0.00 0.04 0.00 0.00 34.50 32.80 2aj9 s PRO 98 CO -0.02 -0.86 0.89 -0.35 0.04 0.00 0.00 177.00 176.70 2aj9 n PRO 99 N -2.52 -2.82 -0.02 0.56 -0.04 -1.26 -4.95 135.00 123.95 2aj9 n PRO 99 Ca 0.08 -0.80 0.02 0.00 -0.04 0.00 0.00 63.50 62.75 2aj9 n PRO 99 Cb 0.53 -2.08 -0.13 0.00 -0.04 0.00 0.00 33.50 31.78 2aj9 n PRO 99 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2aj9 n ALA 100 N -5.09 2.18 -0.19 0.55 0.00 -1.26 -4.58 120.51 112.12 2aj9 n ALA 100 Ca 0.03 -0.74 -0.13 0.00 0.00 0.00 0.00 53.44 52.60 2aj9 n ALA 100 Cb 0.55 -0.66 -0.10 0.00 0.00 0.00 0.00 19.45 19.24 2aj9 n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2aj9 h ALA 101 N 1.56 -0.72 -0.07 0.00 0.00 -1.90 -0.28 119.26 117.84 2aj9 h ALA 101 Ca -0.20 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.75 2aj9 h ALA 101 Cb 1.51 1.17 -0.00 0.00 0.00 0.00 0.00 17.79 20.47 2aj9 h ALA 101 CO 0.02 -1.01 0.06 -1.00 0.00 0.00 0.00 179.25 177.32 2aj9 h PRO 102 N -0.30 0.00 0.20 0.00 0.13 -1.84 -1.68 132.00 128.51 2aj9 h PRO 102 Ca 0.09 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.21 2aj9 h PRO 102 Cb 0.54 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.67 2aj9 h PRO 102 CO -0.65 0.00 -0.10 1.98 -0.23 0.00 0.00 178.00 179.01 2aj9 h MET 103 N 0.00 -0.26 -0.57 0.86 4.05 -1.32 -0.70 114.93 116.98 2aj9 h MET 103 Ca 0.04 0.02 0.12 0.00 -0.28 0.00 0.00 59.70 59.59 2aj9 h MET 103 Cb 0.15 0.06 -0.11 0.00 -0.80 0.00 0.00 31.60 30.90 2aj9 h MET 103 CO -0.00 -0.03 -0.10 -0.39 0.23 0.00 0.00 176.91 176.62 2aj9 h VAL 104 N -0.46 0.45 -0.46 -5.77 -1.51 -1.18 -1.28 116.25 106.05 2aj9 h VAL 104 Ca -0.03 -0.01 -0.03 0.00 -1.23 0.00 0.00 66.70 65.40 2aj9 h VAL 104 Cb 0.35 0.42 -0.02 0.00 -2.13 0.00 0.00 31.29 29.91 2aj9 h VAL 104 CO 0.05 0.01 0.17 0.00 -1.23 0.00 0.00 177.57 176.56 2aj9 h ALA 105 N 1.56 0.60 -0.48 5.19 0.00 -0.94 -1.10 119.26 124.10 2aj9 h ALA 105 Ca 0.28 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.08 2aj9 h ALA 105 Cb 0.44 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2aj9 h ALA 105 CO -0.56 0.23 0.22 0.00 0.00 0.00 0.00 179.25 179.14 2aj9 h ALA 106 N 1.01 0.60 0.00 0.00 0.00 -0.68 -0.92 119.26 119.27 2aj9 h ALA 106 Ca 0.15 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2aj9 h ALA 106 Cb 0.23 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2aj9 h ALA 106 CO -0.01 -0.14 -0.12 0.77 0.00 0.00 0.00 179.25 179.74 2aj9 h SER 107 N 0.43 0.00 1.16 0.00 0.02 -0.77 -1.39 113.55 113.01 2aj9 h SER 107 Ca 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2aj9 h SER 107 Cb 0.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.69 2aj9 h SER 107 CO -0.17 0.12 -0.27 0.18 -1.14 0.00 0.00 176.83 175.55 2aj9 n LEU 108 N -3.68 0.71 -0.56 5.07 4.77 -0.46 -4.95 117.00 117.90 2aj9 n LEU 108 Ca -0.02 0.41 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 2aj9 n LEU 108 Cb 0.24 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2aj9 n LEU 108 CO 0.30 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.87 2aj9 n GLY 109 N 1.34 0.56 1.99 -0.72 0.00 -0.51 -4.70 105.19 103.15 2aj9 n GLY 109 Ca 0.05 -0.32 -0.04 0.00 0.00 0.00 0.00 46.02 45.71 2aj9 n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aj9 n ALA 110 N -0.79 3.24 0.04 4.61 0.00 -0.47 -4.73 120.51 122.42 2aj9 n ALA 110 Ca 0.00 -0.92 0.13 0.00 0.00 0.00 0.00 53.44 52.65 2aj9 n ALA 110 Cb 0.31 -0.62 0.20 0.00 0.00 0.00 0.00 19.45 19.33 2aj9 n ALA 110 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2aj9 n LYS 111 N -0.90 0.02 0.05 0.00 2.85 -1.22 -0.55 118.16 118.41 2aj9 n LYS 111 Ca -0.21 0.86 0.12 0.00 -1.05 0.00 0.00 58.31 58.02 2aj9 n LYS 111 Cb 0.81 -2.22 0.05 0.00 -0.65 0.00 0.00 35.03 33.02 2aj9 n LYS 111 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2aj9 n GLY 112 N -1.49 -1.32 3.75 2.58 0.00 -1.26 -4.72 105.19 102.73 2aj9 n GLY 112 Ca 0.11 -0.32 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 2aj9 n GLY 112 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2aj9 s ILE 113 N -3.24 2.86 0.82 -0.61 -4.36 0.28 -5.00 121.20 111.96 2aj9 s ILE 113 Ca 0.03 0.41 -0.10 0.00 -0.26 0.00 0.00 60.65 60.73 2aj9 s ILE 113 Cb 0.13 -2.95 0.09 0.00 1.25 0.00 0.00 42.46 40.98 2aj9 s ILE 113 CO 0.78 -0.23 1.11 -1.48 0.24 0.00 0.00 174.94 175.35 2aj9 s LEU 114 N -4.94 2.92 0.00 0.37 0.05 -1.25 -4.89 118.68 110.94 2aj9 s LEU 114 Ca 0.70 1.91 0.00 0.00 0.05 0.00 0.00 54.13 56.79 2aj9 s LEU 114 Cb -0.24 -4.49 0.00 0.00 -2.05 0.00 0.00 46.19 39.41 2aj9 s LEU 114 CO 0.42 -2.40 0.00 0.61 -0.55 0.00 0.00 176.35 174.44 2aj9 n GLY 115 N -0.78 2.59 3.65 -3.48 0.00 -1.26 -2.04 105.19 103.86 2aj9 n GLY 115 Ca 0.10 -0.70 -0.09 0.00 0.00 0.00 0.00 46.02 45.32 2aj9 n GLY 115 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2aj9 s PHE 116 N -2.00 0.28 -0.06 1.61 -0.71 -1.15 -4.69 117.98 111.25 2aj9 s PHE 116 Ca 0.00 -0.67 -0.06 0.00 -1.04 0.00 0.00 56.93 55.16 2aj9 s PHE 116 Cb 0.00 0.32 -0.04 0.00 -1.21 0.00 0.00 43.02 42.08 2aj9 s PHE 116 CO 0.00 -1.08 0.19 -0.51 -1.34 0.00 0.00 175.22 172.48 2aj9 s ASP 117 N -3.01 6.43 -0.05 1.98 1.11 -1.26 -1.51 116.67 120.36 2aj9 s ASP 117 Ca 0.20 0.49 0.01 0.00 0.18 0.00 0.00 52.55 53.43 2aj9 s ASP 117 Cb -0.02 -2.07 0.02 0.00 1.07 0.00 0.00 42.92 41.92 2aj9 s ASP 117 CO 0.09 0.33 -0.06 -0.22 1.18 0.00 0.00 175.17 176.50 2aj9 s LEU 118 N -1.42 1.36 -0.09 1.23 0.20 0.40 -4.95 118.68 115.41 2aj9 s LEU 118 Ca 0.21 -0.16 0.02 0.00 0.69 0.00 0.00 54.13 54.90 2aj9 s LEU 118 Cb -0.13 -0.51 0.01 0.00 -0.43 0.00 0.00 46.19 45.13 2aj9 s LEU 118 CO 0.11 -0.04 -0.15 -0.44 -0.29 0.00 0.00 176.35 175.53 2aj9 s SER 119 N 0.91 2.27 0.00 3.68 0.01 -1.26 -2.13 113.70 117.17 2aj9 s SER 119 Ca -0.11 -0.39 0.03 0.00 1.31 0.00 0.00 55.95 56.78 2aj9 s SER 119 Cb -0.14 -1.03 0.04 0.00 0.21 0.00 0.00 66.02 65.10 2aj9 s SER 119 CO 0.00 0.04 1.02 0.00 0.41 0.00 0.00 173.24 174.71 2aj9 n ALA 120 N 3.94 3.62 -0.24 1.44 0.00 -1.26 -5.00 120.51 123.01 2aj9 n ALA 120 Ca -0.20 -0.86 0.00 0.00 0.00 0.00 0.00 53.44 52.38 2aj9 n ALA 120 Cb 0.52 -0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.60 2aj9 n ALA 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aj9 n GLY 121 N 0.05 -0.73 0.08 0.00 0.00 -1.26 -3.37 105.19 99.96 2aj9 n GLY 121 Ca -0.24 -1.15 0.05 0.00 0.00 0.00 0.00 46.02 44.67 2aj9 n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aj9 n ALA 123 N -1.57 3.17 0.21 0.00 0.00 -1.22 -4.15 120.51 116.96 2aj9 n ALA 123 Ca -0.01 -1.71 0.08 0.00 0.00 0.00 0.00 53.44 51.80 2aj9 n ALA 123 Cb 0.08 -0.97 0.47 0.00 0.00 0.00 0.00 19.45 19.04 2aj9 n ALA 123 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2aj9 h GLY 124 N 3.73 0.00 1.10 0.00 0.00 -1.04 -3.12 103.07 103.74 2aj9 h GLY 124 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 2aj9 h GLY 124 CO 0.27 0.00 0.12 -2.75 0.00 0.00 0.00 176.54 174.18 2aj9 h PHE 125 N 0.00 1.17 -0.49 5.60 3.57 -1.79 -1.29 116.94 123.71 2aj9 h PHE 125 Ca -0.00 -0.15 -0.08 0.00 3.53 0.00 0.00 57.97 61.27 2aj9 h PHE 125 Cb 0.66 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 2aj9 h PHE 125 CO 0.00 0.97 -0.00 0.78 -2.23 0.00 0.00 178.31 177.83 2aj9 h GLY 126 N 1.06 0.89 0.97 2.40 0.00 -1.84 -0.98 103.07 105.57 2aj9 h GLY 126 Ca 0.21 -0.60 -0.14 0.00 0.00 0.00 0.00 47.33 46.79 2aj9 h GLY 126 CO 0.01 0.56 -0.42 -0.97 0.00 0.00 0.00 176.54 175.72 2aj9 h TYR 127 N 0.77 0.84 -0.91 5.60 -1.99 -1.50 -2.41 116.97 117.37 2aj9 h TYR 127 Ca 0.15 -0.30 -0.02 0.00 2.00 0.00 0.00 58.73 60.56 2aj9 h TYR 127 Cb 0.47 -0.16 -0.04 0.00 2.00 0.00 0.00 36.73 39.00 2aj9 h TYR 127 CO 0.03 1.07 0.50 0.00 -0.00 0.00 0.00 178.16 179.75 2aj9 h ALA 128 N 0.62 1.16 0.28 3.88 0.00 -1.10 0.18 119.26 124.27 2aj9 h ALA 128 Ca 0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2aj9 h ALA 128 Cb 1.02 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2aj9 h ALA 128 CO 0.09 0.67 -0.13 1.25 0.00 0.00 0.00 179.25 181.13 2aj9 h LEU 129 N 1.27 -0.31 -1.17 0.00 5.85 -1.15 0.13 115.31 119.92 2aj9 h LEU 129 Ca 0.32 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 59.00 2aj9 h LEU 129 Cb 0.02 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 2aj9 h LEU 129 CO -0.05 -0.17 0.46 1.23 -0.34 0.00 0.00 178.44 179.57 2aj9 h GLY 130 N -0.44 1.09 0.94 3.75 0.00 -1.20 0.93 103.07 108.14 2aj9 h GLY 130 Ca -0.04 -0.45 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 2aj9 h GLY 130 CO 0.06 0.43 0.07 0.00 0.00 0.00 0.00 176.54 177.11 2aj9 h ALA 131 N 1.46 0.54 -0.66 3.60 0.00 -0.32 0.36 119.26 124.24 2aj9 h ALA 131 Ca 0.27 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 2aj9 h ALA 131 Cb -0.05 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2aj9 h ALA 131 CO -0.05 0.24 0.11 0.00 0.00 0.00 0.00 179.25 179.55 2aj9 h ALA 132 N 0.93 0.95 -0.53 0.00 0.00 -0.08 -0.84 119.26 119.69 2aj9 h ALA 132 Ca 0.12 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 2aj9 h ALA 132 Cb 0.36 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2aj9 h ALA 132 CO 0.01 0.66 0.07 0.00 0.00 0.00 0.00 179.25 179.98 2aj9 h ALA 133 N 1.10 0.71 -0.64 0.00 0.00 -0.63 -1.69 119.26 118.09 2aj9 h ALA 133 Ca 0.20 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 2aj9 h ALA 133 Cb 0.43 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2aj9 h ALA 133 CO 0.01 0.46 0.06 -0.44 0.00 0.00 0.00 179.25 179.34 2aj9 h ASP 134 N 0.77 1.07 -0.61 0.00 3.32 -0.62 -2.27 116.42 118.07 2aj9 h ASP 134 Ca 0.16 -0.28 -0.03 0.00 0.02 0.00 0.00 57.03 56.89 2aj9 h ASP 134 Cb 0.43 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.67 2aj9 h ASP 134 CO 0.01 1.08 0.25 -0.03 -1.72 0.00 0.00 179.24 178.84 2aj9 h MET 135 N 1.01 0.90 0.17 3.56 4.05 -1.04 -0.75 114.93 122.84 2aj9 h MET 135 Ca 0.19 -0.16 -0.01 0.00 -0.28 0.00 0.00 59.70 59.44 2aj9 h MET 135 Cb 0.50 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 31.15 2aj9 h MET 135 CO 0.02 0.76 -0.08 0.82 0.23 0.00 0.00 176.91 178.66 2aj9 h ILE 136 N 0.84 0.87 0.00 1.77 2.04 -1.25 0.15 117.51 121.93 2aj9 h ILE 136 Ca 0.20 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.87 2aj9 h ILE 136 Cb 0.19 0.98 -0.00 0.00 -0.74 0.00 0.00 36.82 37.24 2aj9 h ILE 136 CO -0.02 0.04 -0.09 0.03 0.00 0.00 0.00 178.15 178.11 2aj9 h ARG 137 N -0.32 0.00 -0.01 2.37 3.08 -1.43 -1.44 114.38 116.63 2aj9 h ARG 137 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2aj9 h ARG 137 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2aj9 h ARG 137 CO 0.04 0.09 -0.07 0.41 -1.07 0.00 0.00 179.97 179.38 2aj9 n GLY 138 N -0.70 -0.41 1.87 0.04 0.00 -0.29 -1.88 105.19 103.82 2aj9 n GLY 138 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.63 2aj9 n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aj9 n GLY 139 N 1.20 0.54 0.13 -0.02 0.00 -0.50 -3.09 105.19 103.46 2aj9 n GLY 139 Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.33 2aj9 n GLY 139 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2aj9 h GLY 140 N 0.00 0.00 -3.01 -0.02 0.00 -0.97 -3.44 103.07 95.63 2aj9 h GLY 140 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.37 2aj9 h GLY 140 CO 0.00 0.00 0.32 0.00 0.00 0.00 0.00 176.54 176.86 2aj9 s ALA 141 N -3.15 -1.65 -0.19 3.60 0.00 -1.22 -4.96 121.76 114.19 2aj9 s ALA 141 Ca 0.09 0.59 -0.01 0.00 0.00 0.00 0.00 51.96 52.63 2aj9 s ALA 141 Cb 0.11 0.71 -0.12 0.00 0.00 0.00 0.00 23.12 23.83 2aj9 s ALA 141 CO 0.59 -0.78 -0.19 0.00 0.00 0.00 0.00 175.76 175.39 2aj9 n ALA 142 N -0.34 1.61 -3.08 0.00 0.00 -1.26 -4.09 120.51 113.34 2aj9 n ALA 142 Ca -0.13 -0.81 -0.13 0.00 0.00 0.00 0.00 53.44 52.37 2aj9 n ALA 142 Cb 0.63 0.10 -0.15 0.00 0.00 0.00 0.00 19.45 20.04 2aj9 n ALA 142 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2aj9 s THR 143 N -2.38 0.04 0.11 0.00 2.01 -1.26 -4.08 115.64 110.09 2aj9 s THR 143 Ca -0.26 0.03 0.01 0.00 0.31 0.00 0.00 61.69 61.77 2aj9 s THR 143 Cb 0.07 -0.07 -0.04 0.00 0.01 0.00 0.00 72.50 72.47 2aj9 s THR 143 CO 0.42 0.04 -0.03 -0.04 -0.69 0.00 0.00 174.62 174.32 2aj9 s MET 144 N 0.26 0.86 -0.24 4.92 -1.94 0.62 -0.04 119.30 123.73 2aj9 s MET 144 Ca -0.02 -1.37 -0.05 0.00 -1.71 0.00 0.00 55.69 52.55 2aj9 s MET 144 Cb -0.04 -0.07 -0.00 0.00 2.01 0.00 0.00 34.83 36.73 2aj9 s MET 144 CO -0.01 -0.09 -0.01 -0.51 -0.01 0.00 0.00 175.02 174.39 2aj9 s LEU 145 N -3.04 3.16 -0.22 -0.03 1.43 0.36 -0.53 118.68 119.80 2aj9 s LEU 145 Ca 0.15 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 52.74 2aj9 s LEU 145 Cb 0.06 -1.78 -0.01 0.00 0.03 0.00 0.00 46.19 44.50 2aj9 s LEU 145 CO -0.03 -0.06 -0.04 -0.69 0.23 0.00 0.00 176.35 175.75 2aj9 s VAL 146 N 1.48 3.34 -0.08 -1.59 1.01 -0.65 0.01 120.40 123.93 2aj9 s VAL 146 Ca 0.05 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.51 2aj9 s VAL 146 Cb -0.15 -2.53 0.01 0.00 0.00 0.00 0.00 36.38 33.71 2aj9 s VAL 146 CO -0.02 0.40 -0.14 0.54 0.00 0.00 0.00 175.10 175.89 2aj9 s VAL 147 N 1.47 1.29 -0.22 2.92 0.11 -0.74 0.27 120.40 125.50 2aj9 s VAL 147 Ca 0.05 -0.56 -0.08 0.00 -2.93 0.00 0.00 61.98 58.47 2aj9 s VAL 147 Cb -0.14 -1.17 -0.04 0.00 -1.53 0.00 0.00 36.38 33.50 2aj9 s VAL 147 CO -0.03 0.39 0.08 -0.83 -3.33 0.00 0.00 175.10 171.38 2aj9 s GLY 148 N 0.70 1.85 -0.01 6.54 0.00 0.56 -1.29 107.32 115.67 2aj9 s GLY 148 Ca -0.13 -0.94 0.01 0.00 0.00 0.00 0.00 44.72 43.65 2aj9 s GLY 148 CO 0.03 0.33 -0.04 -1.08 0.00 0.00 0.00 173.10 172.34 2aj9 s THR 149 N 1.05 0.37 -0.01 0.90 -1.32 -0.93 -0.63 115.64 115.07 2aj9 s THR 149 Ca 0.05 -0.14 -0.04 0.00 -1.21 0.00 0.00 61.69 60.34 2aj9 s THR 149 Cb -0.14 -0.35 0.00 0.00 -1.51 0.00 0.00 72.50 70.50 2aj9 s THR 149 CO 0.03 0.13 0.09 -1.61 -2.21 0.00 0.00 174.62 171.06 2aj9 s GLU 150 N 0.26 0.30 -0.43 7.08 0.41 0.30 -4.40 118.70 122.23 2aj9 s GLU 150 Ca -0.03 -0.22 0.05 0.00 -0.41 0.00 0.00 54.97 54.37 2aj9 s GLU 150 Cb -0.06 0.13 0.20 0.00 -1.78 0.00 0.00 34.13 32.61 2aj9 s GLU 150 CO -0.00 -0.06 0.41 1.17 -0.49 0.00 0.00 175.26 176.29 2aj9 n LYS 151 N 2.12 0.50 0.06 1.61 4.81 -1.26 -1.55 118.16 124.45 2aj9 n LYS 151 Ca -0.19 -3.30 -0.06 0.00 -0.87 0.00 0.00 58.31 53.90 2aj9 n LYS 151 Cb 0.57 -1.58 -0.11 0.00 0.02 0.00 0.00 35.03 33.94 2aj9 n LYS 151 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 2aj9 h LEU 152 N 5.07 0.00 -0.98 3.14 3.38 -1.94 -3.38 115.31 120.60 2aj9 h LEU 152 Ca 0.20 0.00 0.31 0.00 0.09 0.00 0.00 57.88 58.48 2aj9 h LEU 152 Cb 0.89 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.46 2aj9 h LEU 152 CO 0.43 0.94 0.19 0.77 0.09 0.00 0.00 178.44 180.86 2aj9 h SER 153 N 0.00 -0.22 0.65 -0.43 4.64 -1.84 0.90 113.55 117.25 2aj9 h SER 153 Ca -0.05 0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2aj9 h SER 153 Cb 1.76 0.41 0.00 0.00 -0.31 0.00 0.00 62.40 64.26 2aj9 h SER 153 CO 0.12 -0.36 0.00 -0.65 -0.87 0.00 0.00 176.83 175.07 2aj9 h PRO 154 N 0.03 0.00 -0.01 4.77 0.11 -1.98 -2.10 132.00 132.82 2aj9 h PRO 154 Ca 0.66 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.77 2aj9 h PRO 154 Cb 1.50 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.61 2aj9 h PRO 154 CO -0.86 0.00 -0.58 -2.37 -0.21 0.00 0.00 178.00 173.99 2aj9 n THR 155 N -2.56 0.00 -2.57 -1.15 5.66 0.31 -4.95 114.28 109.02 2aj9 n THR 155 Ca 0.01 -0.09 -0.40 0.00 -3.05 0.00 0.00 64.05 60.52 2aj9 n THR 155 Cb 0.21 0.72 -0.05 0.00 -1.55 0.00 0.00 70.33 69.66 2aj9 n THR 155 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 2aj9 s ILE 156 N -2.76 3.69 -0.48 1.09 1.01 -0.79 -1.64 121.20 121.32 2aj9 s ILE 156 Ca 0.15 1.66 -0.19 0.00 0.00 0.00 0.00 60.65 62.27 2aj9 s ILE 156 Cb 0.18 -4.04 0.05 0.00 0.01 0.00 0.00 42.46 38.66 2aj9 s ILE 156 CO 0.68 0.36 0.58 -0.62 0.00 0.00 0.00 174.94 175.94 2aj9 s ASP 157 N -1.05 6.23 0.27 3.58 3.68 -1.26 -4.95 116.67 123.17 2aj9 s ASP 157 Ca 0.45 -0.81 -0.08 0.00 2.13 0.00 0.00 52.55 54.23 2aj9 s ASP 157 Cb -0.29 -2.28 0.43 0.00 -1.45 0.00 0.00 42.92 39.33 2aj9 s ASP 157 CO 0.37 -0.81 1.50 0.23 0.13 0.00 0.00 175.17 176.59 2aj9 n MET 158 N 6.03 -0.09 0.17 4.34 2.81 -1.26 -0.91 117.12 128.20 2aj9 n MET 158 Ca -0.06 1.50 0.05 0.00 -1.81 0.00 0.00 57.70 57.37 2aj9 n MET 158 Cb 0.46 -2.24 0.20 0.00 -0.71 0.00 0.00 33.22 30.93 2aj9 n MET 158 CO 0.00 0.00 0.00 1.88 1.51 0.00 0.00 175.97 179.36 2aj9 h TYR 159 N 0.00 0.00 -1.48 2.03 0.99 -1.93 -3.44 116.97 113.14 2aj9 h TYR 159 Ca 0.45 0.00 -0.48 0.00 2.00 0.00 0.00 58.73 60.71 2aj9 h TYR 159 Cb 0.69 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.42 2aj9 h TYR 159 CO -0.75 0.42 1.64 -3.47 -0.00 0.00 0.00 178.16 176.00 2aj9 n ASP 160 N -3.36 2.20 -0.05 3.88 4.64 -0.09 -4.76 116.55 119.01 2aj9 n ASP 160 Ca 0.01 -0.38 0.00 0.00 -1.38 0.00 0.00 54.79 53.03 2aj9 n ASP 160 Cb 0.61 -1.52 0.00 0.00 -1.04 0.00 0.00 41.12 39.17 2aj9 n ASP 160 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2aj9 n ALA 161 N 15.07 2.34 0.24 -1.67 0.00 -1.26 -2.31 120.51 132.92 2aj9 n ALA 161 Ca 0.39 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.86 2aj9 n ALA 161 Cb 0.49 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.92 2aj9 n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aj9 n GLY 162 N 0.32 0.19 0.00 0.00 0.00 -1.26 -4.87 105.19 99.57 2aj9 n GLY 162 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2aj9 n GLY 162 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2aj9 n ASN 163 N -0.79 0.00 0.28 1.61 0.23 -1.19 -4.87 115.26 110.54 2aj9 n ASN 163 Ca 0.02 -0.59 0.18 0.00 -0.53 0.00 0.00 54.58 53.65 2aj9 n ASN 163 Cb 0.09 0.00 0.96 0.00 -2.08 0.00 0.00 39.78 38.75 2aj9 n ASN 163 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2aj9 n PHE 165 N -2.77 0.47 -0.09 0.00 -1.74 -1.26 -4.63 117.46 107.43 2aj9 n PHE 165 Ca -0.02 -0.34 -0.14 0.00 -0.56 0.00 0.00 57.45 56.38 2aj9 n PHE 165 Cb 0.10 -0.01 -0.06 0.00 1.52 0.00 0.00 39.48 41.02 2aj9 n PHE 165 CO 0.00 0.00 0.00 -0.89 -0.56 0.00 0.00 176.76 175.31 2aj9 n ILE 166 N 0.99 1.48 -2.85 1.97 5.41 0.08 -4.91 119.36 121.53 2aj9 n ILE 166 Ca 0.15 0.05 -0.38 0.00 1.00 0.00 0.00 62.75 63.57 2aj9 n ILE 166 Cb 0.48 -2.20 -0.06 0.00 -0.71 0.00 0.00 39.64 37.15 2aj9 n ILE 166 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2aj9 s PHE 167 N -2.38 3.84 0.21 1.39 2.99 -1.23 -0.53 117.98 122.28 2aj9 s PHE 167 Ca -0.24 1.76 -0.00 0.00 0.00 0.00 0.00 56.93 58.44 2aj9 s PHE 167 Cb 0.05 -2.88 -0.04 0.00 0.00 0.00 0.00 43.02 40.16 2aj9 s PHE 167 CO 0.41 0.38 0.15 0.00 -0.00 0.00 0.00 175.22 176.16 2aj9 s ALA 168 N -1.35 1.22 0.34 5.36 0.00 -0.08 -4.70 121.76 122.55 2aj9 s ALA 168 Ca 0.43 -1.73 0.02 0.00 0.00 0.00 0.00 51.96 50.69 2aj9 s ALA 168 Cb -0.22 1.39 -0.02 0.00 0.00 0.00 0.00 23.12 24.27 2aj9 s ALA 168 CO 0.27 -0.60 0.52 -0.51 0.00 0.00 0.00 175.76 175.44 2aj9 s ASP 169 N -3.18 6.15 0.00 0.00 -0.00 -0.64 -4.16 116.67 114.85 2aj9 s ASP 169 Ca 0.39 0.24 0.00 0.00 -0.00 0.00 0.00 52.55 53.18 2aj9 s ASP 169 Cb 0.06 -1.77 0.00 0.00 -0.00 0.00 0.00 42.92 41.21 2aj9 s ASP 169 CO 0.13 -0.35 0.00 0.61 -0.00 0.00 0.00 175.17 175.56 2aj9 n GLY 170 N -1.75 0.39 3.62 0.21 0.00 -0.59 -4.67 105.19 102.40 2aj9 n GLY 170 Ca -0.04 -1.25 -0.08 0.00 0.00 0.00 0.00 46.02 44.65 2aj9 n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aj9 s ALA 171 N -1.98 -2.00 -0.11 4.61 0.00 -1.01 -0.54 121.76 120.73 2aj9 s ALA 171 Ca 0.00 1.76 -0.18 0.00 0.00 0.00 0.00 51.96 53.54 2aj9 s ALA 171 Cb 0.00 -1.26 0.04 0.00 0.00 0.00 0.00 23.12 21.90 2aj9 s ALA 171 CO 0.00 -0.24 0.45 0.00 0.00 0.00 0.00 175.76 175.97 2aj9 s ALA 172 N -0.28 -1.14 0.17 0.00 0.00 0.20 -0.15 121.76 120.57 2aj9 s ALA 172 Ca 0.02 1.04 0.06 0.00 0.00 0.00 0.00 51.96 53.08 2aj9 s ALA 172 Cb -0.03 -0.43 -0.05 0.00 0.00 0.00 0.00 23.12 22.61 2aj9 s ALA 172 CO -0.05 -0.25 -0.11 0.00 0.00 0.00 0.00 175.76 175.35 2aj9 s ALA 173 N -0.39 1.68 0.07 0.00 0.00 0.95 -0.32 121.76 123.75 2aj9 s ALA 173 Ca -0.05 -1.57 0.03 0.00 0.00 0.00 0.00 51.96 50.37 2aj9 s ALA 173 Cb -0.03 0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.08 2aj9 s ALA 173 CO 0.03 -0.05 -0.10 0.14 0.00 0.00 0.00 175.76 175.78 2aj9 s VAL 174 N -3.20 0.78 -0.18 0.00 -7.23 0.14 -0.50 120.40 110.22 2aj9 s VAL 174 Ca 0.20 -1.32 -0.08 0.00 -1.81 0.00 0.00 61.98 58.97 2aj9 s VAL 174 Cb 0.02 -0.96 -0.04 0.00 0.56 0.00 0.00 36.38 35.95 2aj9 s VAL 174 CO 0.03 -0.42 0.08 -0.69 -0.31 0.00 0.00 175.10 173.79 2aj9 s VAL 175 N -1.74 4.93 -0.12 1.32 1.01 -0.98 -1.64 120.40 123.18 2aj9 s VAL 175 Ca -0.03 0.01 0.01 0.00 0.00 0.00 0.00 61.98 61.97 2aj9 s VAL 175 Cb -0.07 -3.21 -0.01 0.00 0.00 0.00 0.00 36.38 33.08 2aj9 s VAL 175 CO 0.00 0.47 -0.15 -0.69 0.00 0.00 0.00 175.10 174.74 2aj9 s VAL 176 N 0.21 2.88 0.11 2.92 1.01 0.31 -0.11 120.40 127.73 2aj9 s VAL 176 Ca 0.05 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.27 2aj9 s VAL 176 Cb -0.12 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 34.09 2aj9 s VAL 176 CO 0.00 0.53 0.22 0.61 0.00 0.00 0.00 175.10 176.46 2aj9 n GLY 177 N 3.48 1.88 3.77 4.51 0.00 -1.00 -0.28 105.19 117.55 2aj9 n GLY 177 Ca -0.18 -1.14 -0.38 0.00 0.00 0.00 0.00 46.02 44.32 2aj9 n GLY 177 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2aj9 s GLU 178 N -2.06 4.08 0.02 1.61 2.12 -1.26 -0.94 118.70 122.27 2aj9 s GLU 178 Ca 0.05 1.81 0.01 0.00 0.36 0.00 0.00 54.97 57.21 2aj9 s GLU 178 Cb -0.01 -2.68 -0.02 0.00 0.26 0.00 0.00 34.13 31.68 2aj9 s GLU 178 CO 0.04 -0.29 -0.05 0.95 -0.54 0.00 0.00 175.26 175.37 2aj9 s THR 179 N -1.42 0.33 -0.46 -1.70 -4.23 -0.89 -4.75 115.64 102.52 2aj9 s THR 179 Ca 0.57 -0.81 0.10 0.00 -1.18 0.00 0.00 61.69 60.37 2aj9 s THR 179 Cb -0.30 -0.40 0.10 0.00 1.34 0.00 0.00 72.50 73.23 2aj9 s THR 179 CO 0.38 -0.32 1.24 -0.81 -0.54 0.00 0.00 174.62 174.57 2aj9 n PRO 180 N 1.86 0.06 -3.82 3.99 -0.04 -1.26 -4.56 135.00 131.23 2aj9 n PRO 180 Ca -0.21 0.52 -0.12 0.00 -0.04 0.00 0.00 63.50 63.66 2aj9 n PRO 180 Cb 0.56 -1.81 -0.09 0.00 -0.04 0.00 0.00 33.50 32.12 2aj9 n PRO 180 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2aj9 s PHE 181 N -3.18 -0.03 0.02 0.54 0.08 -1.26 -5.10 117.98 109.06 2aj9 s PHE 181 Ca -0.01 -0.06 -0.34 0.00 0.12 0.00 0.00 56.93 56.64 2aj9 s PHE 181 Cb 0.03 0.01 -0.13 0.00 -0.57 0.00 0.00 43.02 42.36 2aj9 s PHE 181 CO 0.09 -0.38 1.76 0.94 -0.10 0.00 0.00 175.22 177.53 2aj9 n GLN 182 N 1.09 2.19 -0.00 0.44 -0.06 -1.26 -4.49 117.38 115.28 2aj9 n GLN 182 Ca -0.21 0.80 0.03 0.00 -2.00 0.00 0.00 57.00 55.62 2aj9 n GLN 182 Cb 0.57 -2.61 -0.04 0.00 -4.06 0.00 0.00 30.24 24.09 2aj9 n GLN 182 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2aj9 n GLY 183 N 4.00 0.06 2.98 1.69 0.00 0.64 -4.89 105.19 109.68 2aj9 n GLY 183 Ca 0.20 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 2aj9 n GLY 183 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2aj9 s ILE 184 N -2.01 1.79 1.11 -0.61 1.01 -0.70 -1.68 121.20 120.11 2aj9 s ILE 184 Ca -0.00 -1.47 -0.13 0.00 0.00 0.00 0.00 60.65 59.05 2aj9 s ILE 184 Cb 0.04 -2.04 0.25 0.00 0.01 0.00 0.00 42.46 40.73 2aj9 s ILE 184 CO 0.26 -0.14 1.06 -0.83 0.00 0.00 0.00 174.94 175.29 2aj9 s GLY 185 N 1.26 1.54 0.45 6.18 0.00 0.95 -4.96 107.32 112.75 2aj9 s GLY 185 Ca -0.05 -0.36 -0.24 0.00 0.00 0.00 0.00 44.72 44.07 2aj9 s GLY 185 CO -0.07 0.35 1.27 2.56 0.00 0.00 0.00 173.10 177.21 2aj9 s PRO 186 N -4.79 3.72 0.23 2.90 0.04 -1.26 -4.73 135.00 131.10 2aj9 s PRO 186 Ca 0.67 2.04 -0.30 0.00 0.04 0.00 0.00 61.00 63.45 2aj9 s PRO 186 Cb -0.20 -2.53 -0.09 0.00 0.04 0.00 0.00 34.50 31.72 2aj9 s PRO 186 CO 0.61 -0.66 1.04 0.99 0.04 0.00 0.00 177.00 179.01 2aj9 s THR 187 N -1.37 3.84 -0.29 1.26 2.01 -1.26 -4.57 115.64 115.25 2aj9 s THR 187 Ca 0.62 1.74 0.01 0.00 0.31 0.00 0.00 61.69 64.38 2aj9 s THR 187 Cb -0.35 -4.11 0.08 0.00 0.01 0.00 0.00 72.50 68.13 2aj9 s THR 187 CO 0.44 0.37 0.02 -0.69 -0.69 0.00 0.00 174.62 174.07 2aj9 s VAL 188 N -0.82 1.62 0.36 3.82 1.01 0.19 -4.98 120.40 121.60 2aj9 s VAL 188 Ca 0.45 -1.66 0.04 0.00 0.00 0.00 0.00 61.98 60.81 2aj9 s VAL 188 Cb -0.29 -2.07 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 2aj9 s VAL 188 CO 0.36 -0.43 0.08 0.00 0.00 0.00 0.00 175.10 175.12 2aj9 s ALA 189 N 1.28 2.64 0.00 5.51 0.00 -1.26 -1.06 121.76 128.87 2aj9 s ALA 189 Ca 0.04 -1.65 0.00 0.00 0.00 0.00 0.00 51.96 50.35 2aj9 s ALA 189 Cb -0.18 0.68 0.00 0.00 0.00 0.00 0.00 23.12 23.62 2aj9 s ALA 189 CO -0.12 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 175.74 2aj9 n GLY 190 N -0.79 -1.00 3.73 0.00 0.00 -0.74 -5.00 105.19 101.40 2aj9 n GLY 190 Ca -0.04 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.18 2aj9 n GLY 190 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2aj9 s SER 191 N -4.00 -0.06 -0.33 1.61 1.04 -1.26 -2.18 113.70 108.51 2aj9 s SER 191 Ca 0.00 -0.25 -0.00 0.00 0.48 0.00 0.00 55.95 56.18 2aj9 s SER 191 Cb 0.00 0.25 0.13 0.00 0.10 0.00 0.00 66.02 66.50 2aj9 s SER 191 CO 0.00 -0.47 0.25 -0.62 0.98 0.00 0.00 173.24 173.38 2aj9 s ASP 192 N -3.17 2.44 0.41 7.02 3.68 0.14 -4.98 116.67 122.20 2aj9 s ASP 192 Ca 0.17 -1.62 0.22 0.00 2.13 0.00 0.00 52.55 53.45 2aj9 s ASP 192 Cb 0.02 -0.01 0.75 0.00 -1.45 0.00 0.00 42.92 42.24 2aj9 s ASP 192 CO -0.01 -0.34 1.76 1.23 0.13 0.00 0.00 175.17 177.94 2aj9 h GLY 193 N 7.51 0.00 1.99 2.66 0.00 -1.78 -3.00 103.07 110.45 2aj9 h GLY 193 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2aj9 h GLY 193 CO 0.29 0.00 0.00 1.18 0.00 0.00 0.00 176.54 178.01 2aj9 n GLU 194 N -3.39 0.00 -0.55 4.80 1.02 -1.26 -0.80 120.64 120.46 2aj9 n GLU 194 Ca 0.00 0.43 0.04 0.00 -0.02 0.00 0.00 57.16 57.62 2aj9 n GLU 194 Cb 0.48 -1.50 0.20 0.00 -0.02 0.00 0.00 31.44 30.60 2aj9 n GLU 194 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2aj9 n GLN 195 N -1.50 1.71 0.12 3.49 6.02 -1.13 -4.81 117.38 121.28 2aj9 n GLN 195 Ca 0.01 -3.10 0.15 0.00 -0.01 0.00 0.00 57.00 54.04 2aj9 n GLN 195 Cb 0.04 -1.67 0.68 0.00 1.02 0.00 0.00 30.24 30.31 2aj9 n GLN 195 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2aj9 h ALA 196 N 0.88 2.25 -0.12 -1.58 0.00 -1.08 -1.31 119.26 118.29 2aj9 h ALA 196 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2aj9 h ALA 196 Cb 1.23 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2aj9 h ALA 196 CO 0.13 -0.35 0.00 -0.25 0.00 0.00 0.00 179.25 178.78 2aj9 n ASP 197 N -4.41 0.68 -0.10 0.00 10.43 -1.26 -3.91 116.55 117.97 2aj9 n ASP 197 Ca 0.04 -2.00 -0.11 0.00 2.57 0.00 0.00 54.79 55.29 2aj9 n ASP 197 Cb 0.37 -0.09 -0.03 0.00 1.84 0.00 0.00 41.12 43.21 2aj9 n ASP 197 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2aj9 h ALA 198 N 3.21 0.39 -3.27 2.24 0.00 -1.59 -3.41 119.26 116.83 2aj9 h ALA 198 Ca 0.00 -0.20 -0.58 0.00 0.00 0.00 0.00 54.91 54.13 2aj9 h ALA 198 Cb 0.17 -0.11 -0.37 0.00 0.00 0.00 0.00 17.79 17.49 2aj9 h ALA 198 CO 0.00 0.09 -0.81 0.42 0.00 0.00 0.00 179.25 178.95 2aj9 s ILE 199 N -5.12 1.37 0.25 0.00 1.01 -1.25 -0.29 121.20 117.17 2aj9 s ILE 199 Ca -0.13 -0.67 -0.22 0.00 0.00 0.00 0.00 60.65 59.62 2aj9 s ILE 199 Cb 0.08 -1.41 0.03 0.00 0.01 0.00 0.00 42.46 41.17 2aj9 s ILE 199 CO 0.75 0.28 0.76 0.00 0.00 0.00 0.00 174.94 176.73 2aj9 s ARG 200 N 1.54 1.65 -0.44 2.79 1.70 -0.52 -4.06 118.95 121.62 2aj9 s ARG 200 Ca 0.02 -0.90 -0.14 0.00 -0.47 0.00 0.00 55.73 54.24 2aj9 s ARG 200 Cb -0.14 0.57 0.06 0.00 -0.57 0.00 0.00 34.95 34.87 2aj9 s ARG 200 CO -0.09 -0.76 0.33 -1.14 -1.08 0.00 0.00 175.30 172.57 2aj9 s GLN 201 N -3.79 2.89 0.28 3.89 0.74 -1.26 0.39 119.66 122.78 2aj9 s GLN 201 Ca 0.11 -1.28 0.06 0.00 0.05 0.00 0.00 55.36 54.30 2aj9 s GLN 201 Cb -0.05 -3.99 0.78 0.00 1.10 0.00 0.00 33.01 30.85 2aj9 s GLN 201 CO 0.05 -0.92 1.33 -0.40 -0.55 0.00 0.00 175.29 174.80 2aj9 n ASP 202 N 5.12 0.01 -4.08 6.67 5.75 -1.18 -4.49 116.55 124.34 2aj9 n ASP 202 Ca -0.12 1.44 -0.27 0.00 -0.01 0.00 0.00 54.79 55.83 2aj9 n ASP 202 Cb 0.44 -0.57 -0.17 0.00 -1.03 0.00 0.00 41.12 39.80 2aj9 n ASP 202 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2aj9 s ILE 203 N -5.67 1.41 0.64 2.12 1.01 -1.26 -5.05 121.20 114.40 2aj9 s ILE 203 Ca -0.10 -0.64 -0.15 0.00 0.00 0.00 0.00 60.65 59.76 2aj9 s ILE 203 Cb 0.26 -1.26 -0.01 0.00 0.01 0.00 0.00 42.46 41.46 2aj9 s ILE 203 CO 0.66 0.42 1.10 1.51 0.00 0.00 0.00 174.94 178.63 2aj9 s ASP 204 N 0.57 5.24 0.53 3.58 1.47 -1.26 -4.67 116.67 122.12 2aj9 s ASP 204 Ca -0.16 1.98 0.26 0.00 1.18 0.00 0.00 52.55 55.81 2aj9 s ASP 204 Cb -0.16 -2.55 1.49 0.00 -0.34 0.00 0.00 42.92 41.36 2aj9 s ASP 204 CO 0.05 -1.54 2.12 -0.50 0.68 0.00 0.00 175.17 175.98 2aj9 h TRP 205 N 0.14 0.00 0.14 2.11 4.06 -1.99 -2.52 115.95 117.89 2aj9 h TRP 205 Ca -0.47 0.00 -0.28 0.00 2.06 0.00 0.00 58.89 60.20 2aj9 h TRP 205 Cb 1.24 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.42 2aj9 h TRP 205 CO 0.55 0.09 -1.26 0.82 -3.56 0.00 0.00 178.44 175.08 2aj9 h ILE 206 N 0.00 1.43 -0.60 1.49 1.08 -1.98 -0.78 117.51 118.15 2aj9 h ILE 206 Ca -0.00 -2.89 -0.07 0.00 -0.39 0.00 0.00 64.86 61.51 2aj9 h ILE 206 Cb 0.22 2.90 -0.02 0.00 -3.07 0.00 0.00 36.82 36.85 2aj9 h ILE 206 CO 0.01 0.85 0.11 0.74 -0.69 0.00 0.00 178.15 179.17 2aj9 h THR 207 N 0.12 1.26 -0.25 -0.27 2.02 -1.90 -1.69 112.91 112.20 2aj9 h THR 207 Ca -0.16 -0.98 -0.06 0.00 0.77 0.00 0.00 66.41 65.99 2aj9 h THR 207 Cb 1.97 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 69.10 2aj9 h THR 207 CO 0.22 0.36 -0.07 0.15 0.37 0.00 0.00 175.52 176.55 2aj9 h PHE 208 N 0.89 0.55 -0.48 3.16 3.57 -1.49 -2.53 116.94 120.61 2aj9 h PHE 208 Ca 0.18 -0.12 0.11 0.00 3.53 0.00 0.00 57.97 61.67 2aj9 h PHE 208 Cb 0.41 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 2aj9 h PHE 208 CO 0.03 0.72 0.34 0.00 -2.23 0.00 0.00 178.31 177.16 2aj9 h ALA 209 N 0.75 2.22 -0.07 2.41 0.00 -0.91 -2.61 119.26 121.05 2aj9 h ALA 209 Ca 0.06 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2aj9 h ALA 209 Cb 0.55 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2aj9 h ALA 209 CO 0.03 -0.34 -0.20 1.96 0.00 0.00 0.00 179.25 180.70 2aj9 h GLN 210 N 0.18 0.25 -3.93 0.00 4.20 -1.10 -3.34 115.11 111.37 2aj9 h GLN 210 Ca 0.23 -0.18 -0.78 0.00 0.06 0.00 0.00 58.65 57.98 2aj9 h GLN 210 Cb 0.66 0.03 -0.25 0.00 0.30 0.00 0.00 27.48 28.22 2aj9 h GLN 210 CO -0.04 0.80 -0.03 1.21 -0.67 0.00 0.00 178.83 180.11 2aj9 s ASN 211 N -6.18 6.54 0.03 1.46 3.04 -0.97 -5.02 114.94 113.82 2aj9 s ASN 211 Ca -0.15 -2.36 -0.23 0.00 0.04 0.00 0.00 52.86 50.16 2aj9 s ASN 211 Cb 0.03 -2.21 -0.16 0.00 -1.54 0.00 0.00 41.25 37.38 2aj9 s ASN 211 CO 0.74 -0.68 1.40 -0.65 -3.04 0.00 0.00 177.10 174.88 2aj9 h PRO 212 N 8.18 0.16 0.00 0.43 0.11 -1.61 -1.39 132.00 137.89 2aj9 h PRO 212 Ca -0.04 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2aj9 h PRO 212 Cb 1.06 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2aj9 h PRO 212 CO 0.86 0.50 0.14 -1.13 -0.21 0.00 0.00 178.00 178.16 2aj9 n SER 213 N -4.78 0.04 -2.37 -2.05 3.41 -1.26 -4.69 113.62 101.91 2aj9 n SER 213 Ca -0.07 0.39 -0.04 0.00 -0.26 0.00 0.00 58.87 58.89 2aj9 n SER 213 Cb 0.24 -0.38 0.03 0.00 -0.26 0.00 0.00 64.21 63.83 2aj9 n SER 213 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2aj9 n GLY 214 N -1.36 -0.10 3.69 5.00 0.00 -0.52 -5.01 105.19 106.90 2aj9 n GLY 214 Ca -0.00 -1.84 -0.44 0.00 0.00 0.00 0.00 46.02 43.74 2aj9 n GLY 214 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2aj9 n PRO 215 N -1.37 2.19 -3.24 1.61 -0.02 -1.26 -4.99 135.00 127.91 2aj9 n PRO 215 Ca 0.03 0.78 -0.34 0.00 -2.02 0.00 0.00 63.50 61.94 2aj9 n PRO 215 Cb 0.10 -2.44 -0.06 0.00 -0.02 0.00 0.00 33.50 31.07 2aj9 n PRO 215 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2aj9 s ARG 216 N -0.75 4.04 0.67 -0.52 3.52 -1.26 -4.89 118.95 119.76 2aj9 s ARG 216 Ca 0.65 0.61 -0.16 0.00 -0.13 0.00 0.00 55.73 56.70 2aj9 s ARG 216 Cb -0.60 -2.77 0.00 0.00 -1.56 0.00 0.00 34.95 30.03 2aj9 s ARG 216 CO 0.52 0.36 1.15 -2.14 -0.81 0.00 0.00 175.30 174.38 2aj9 s PRO 217 N -2.31 2.64 -0.11 5.12 0.02 -1.26 -4.94 135.00 134.17 2aj9 s PRO 217 Ca 0.44 1.57 -0.29 0.00 0.02 0.00 0.00 61.00 62.74 2aj9 s PRO 217 Cb -0.14 -1.91 0.07 0.00 0.02 0.00 0.00 34.50 32.54 2aj9 s PRO 217 CO 0.20 -1.41 0.69 -0.06 -0.33 0.00 0.00 177.00 176.09 2aj9 s PHE 218 N -2.10 -0.69 0.11 6.54 2.99 -1.26 -5.01 117.98 118.55 2aj9 s PHE 218 Ca 0.71 1.34 -0.31 0.00 0.00 0.00 0.00 56.93 58.67 2aj9 s PHE 218 Cb -0.25 0.37 -0.08 0.00 0.00 0.00 0.00 43.02 43.07 2aj9 s PHE 218 CO 0.41 -0.55 1.40 0.54 -0.00 0.00 0.00 175.22 177.02 2aj9 s VAL 219 N -0.76 3.31 0.07 -0.44 0.11 -0.65 -3.12 120.40 118.91 2aj9 s VAL 219 Ca -0.08 0.92 0.08 0.00 -2.93 0.00 0.00 61.98 59.97 2aj9 s VAL 219 Cb -0.01 -3.59 -0.03 0.00 -1.53 0.00 0.00 36.38 31.21 2aj9 s VAL 219 CO 0.07 0.06 -0.18 -0.13 -3.33 0.00 0.00 175.10 171.60 2aj9 s ARG 220 N 1.24 1.97 -0.04 1.54 1.81 0.16 -4.70 118.95 120.92 2aj9 s ARG 220 Ca 0.65 -1.05 -0.02 0.00 -1.72 0.00 0.00 55.73 53.59 2aj9 s ARG 220 Cb -0.37 -2.16 0.03 0.00 -0.45 0.00 0.00 34.95 32.00 2aj9 s ARG 220 CO 0.30 0.52 0.04 -1.17 -0.68 0.00 0.00 175.30 174.31 2aj9 s LEU 221 N -1.69 0.38 -1.19 2.53 1.98 -1.26 -1.44 118.68 117.99 2aj9 s LEU 221 Ca 0.16 0.04 -0.09 0.00 -2.89 0.00 0.00 54.13 51.34 2aj9 s LEU 221 Cb -0.11 -0.20 0.22 0.00 0.66 0.00 0.00 46.19 46.76 2aj9 s LEU 221 CO 0.07 -0.22 1.55 -0.62 -1.89 0.00 0.00 176.35 175.24 2aj9 n GLU 222 N 5.09 3.76 -0.31 1.98 -0.58 0.61 -4.89 120.64 126.30 2aj9 n GLU 222 Ca -0.08 -4.01 0.04 0.00 -0.42 0.00 0.00 57.16 52.70 2aj9 n GLU 222 Cb 0.50 -2.79 0.11 0.00 -0.57 0.00 0.00 31.44 28.69 2aj9 n GLU 222 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2aj9 n GLY 223 N 2.74 -1.46 0.42 0.62 0.00 -1.26 -1.91 105.19 104.34 2aj9 n GLY 223 Ca 0.33 0.91 -0.15 0.00 0.00 0.00 0.00 46.02 47.11 2aj9 n GLY 223 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2aj9 h PRO 224 N 0.00 -0.65 -0.66 1.61 0.11 -1.98 0.25 132.00 130.68 2aj9 h PRO 224 Ca 0.39 0.04 0.12 0.00 0.11 0.00 0.00 66.00 66.67 2aj9 h PRO 224 Cb 0.60 0.15 -0.09 0.00 0.11 0.00 0.00 31.00 31.77 2aj9 h PRO 224 CO -0.86 -0.43 0.19 0.00 -0.21 0.00 0.00 178.00 176.69 2aj9 h ALA 225 N -0.23 0.84 -0.53 -0.75 0.00 -1.80 -0.31 119.26 116.48 2aj9 h ALA 225 Ca 0.02 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 2aj9 h ALA 225 Cb 0.70 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2aj9 h ALA 225 CO -0.25 -0.27 0.10 0.28 0.00 0.00 0.00 179.25 179.12 2aj9 h VAL 226 N 0.33 1.25 -0.23 0.00 2.07 -1.32 -1.57 116.25 116.77 2aj9 h VAL 226 Ca 0.35 -0.91 0.02 0.00 0.82 0.00 0.00 66.70 66.97 2aj9 h VAL 226 Cb 0.52 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 2aj9 h VAL 226 CO -0.40 0.33 0.10 0.15 0.02 0.00 0.00 177.57 177.77 2aj9 h PHE 227 N 0.75 0.19 -0.63 1.57 3.57 0.40 0.15 116.94 122.94 2aj9 h PHE 227 Ca 0.16 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 2aj9 h PHE 227 Cb 0.37 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 2aj9 h PHE 227 CO 0.03 0.10 0.21 0.00 -2.23 0.00 0.00 178.31 176.42 2aj9 h ARG 228 N 0.22 0.97 0.65 1.11 2.47 -0.96 -0.94 114.38 117.90 2aj9 h ARG 228 Ca 0.09 -0.20 -0.03 0.00 -1.26 0.00 0.00 59.98 58.58 2aj9 h ARG 228 Cb 0.03 -0.14 0.01 0.00 -1.65 0.00 0.00 29.97 28.22 2aj9 h ARG 228 CO -0.07 0.85 -0.31 2.35 0.56 0.00 0.00 179.97 183.34 2aj9 h TRP 229 N 0.90 -0.81 0.43 3.04 7.01 -0.92 -2.99 115.95 122.61 2aj9 h TRP 229 Ca 0.20 -0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.18 2aj9 h TRP 229 Cb 0.27 0.27 -0.03 0.00 -2.10 0.00 0.00 29.16 27.57 2aj9 h TRP 229 CO 0.02 -0.50 -0.49 0.00 -2.79 0.00 0.00 178.44 174.67 2aj9 h ALA 230 N -1.43 -1.08 -0.99 2.65 0.00 -0.70 -0.40 119.26 117.31 2aj9 h ALA 230 Ca -0.09 -0.17 0.18 0.00 0.00 0.00 0.00 54.91 54.83 2aj9 h ALA 230 Cb 0.67 0.73 -0.10 0.00 0.00 0.00 0.00 17.79 19.09 2aj9 h ALA 230 CO 0.15 -1.15 0.61 0.00 0.00 0.00 0.00 179.25 178.86 2aj9 h ALA 231 N -0.75 1.73 -0.35 0.00 0.00 -1.32 -1.64 119.26 116.93 2aj9 h ALA 231 Ca -0.05 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2aj9 h ALA 231 Cb 0.84 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2aj9 h ALA 231 CO -0.10 -0.07 0.00 1.19 0.00 0.00 0.00 179.25 180.27 2aj9 n PHE 232 N -4.72 0.68 0.00 0.00 3.72 -1.13 -4.64 117.46 111.38 2aj9 n PHE 232 Ca 0.22 -0.62 0.00 0.00 -0.05 0.00 0.00 57.45 57.00 2aj9 n PHE 232 Cb 0.57 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.98 2aj9 n PHE 232 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2aj9 n LYS 233 N 0.26 1.81 0.00 -1.08 4.76 -0.17 -4.76 118.16 118.98 2aj9 n LYS 233 Ca 0.16 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.66 2aj9 n LYS 233 Cb 0.60 -0.82 0.36 0.00 -1.84 0.00 0.00 35.03 33.33 2aj9 n LYS 233 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 2aj9 n MET 234 N -1.67 0.24 -0.03 1.97 2.81 -0.64 -2.67 117.12 117.13 2aj9 n MET 234 Ca 0.00 0.13 -0.15 0.00 -1.81 0.00 0.00 57.70 55.87 2aj9 n MET 234 Cb 0.32 -1.50 -0.10 0.00 -0.71 0.00 0.00 33.22 31.24 2aj9 n MET 234 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 2aj9 h GLY 235 N 2.26 0.29 1.55 3.03 0.00 -1.84 -1.65 103.07 106.71 2aj9 h GLY 235 Ca 0.00 -0.40 -0.10 0.00 0.00 0.00 0.00 47.33 46.83 2aj9 h GLY 235 CO 0.00 0.36 -0.23 -1.80 0.00 0.00 0.00 176.54 174.87 2aj9 h ASP 236 N -0.25 0.52 -0.20 0.19 1.82 -1.85 -1.85 116.42 114.80 2aj9 h ASP 236 Ca -0.01 -0.17 -0.01 0.00 -0.39 0.00 0.00 57.03 56.45 2aj9 h ASP 236 Cb 0.88 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 40.74 2aj9 h ASP 236 CO 0.05 0.75 0.10 0.58 -1.61 0.00 0.00 179.24 179.11 2aj9 h VAL 237 N 0.46 1.13 -0.55 2.25 2.07 -1.53 -0.16 116.25 119.92 2aj9 h VAL 237 Ca 0.07 -0.36 0.05 0.00 0.82 0.00 0.00 66.70 67.27 2aj9 h VAL 237 Cb 0.66 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.38 2aj9 h VAL 237 CO 0.05 0.12 0.29 1.23 0.02 0.00 0.00 177.57 179.28 2aj9 h GLY 238 N 0.20 0.78 2.00 2.17 0.00 -1.01 0.02 103.07 107.23 2aj9 h GLY 238 Ca 0.07 -0.20 -0.04 0.00 0.00 0.00 0.00 47.33 47.17 2aj9 h GLY 238 CO -0.01 0.13 -0.17 3.21 0.00 0.00 0.00 176.54 179.70 2aj9 h ARG 239 N 0.55 0.00 0.10 4.80 3.08 -1.03 -1.22 114.38 120.67 2aj9 h ARG 239 Ca 0.24 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 60.02 2aj9 h ARG 239 Cb 0.14 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.21 2aj9 h ARG 239 CO -0.16 0.17 -1.17 0.00 -1.07 0.00 0.00 179.97 177.73 2aj9 h ARG 240 N 0.00 0.44 -0.59 0.04 3.08 0.46 -1.67 114.38 116.14 2aj9 h ARG 240 Ca -0.00 -0.61 -0.10 0.00 0.07 0.00 0.00 59.98 59.34 2aj9 h ARG 240 Cb 0.42 0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.65 2aj9 h ARG 240 CO 0.02 1.25 -0.03 0.00 -1.07 0.00 0.00 179.97 180.14 2aj9 h ALA 241 N 0.51 0.79 -0.23 0.04 0.00 -0.53 -1.26 119.26 118.58 2aj9 h ALA 241 Ca -0.14 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.29 2aj9 h ALA 241 Cb 1.85 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 2aj9 h ALA 241 CO 0.21 0.66 -0.50 0.52 0.00 0.00 0.00 179.25 180.14 2aj9 h MET 242 N 0.95 0.64 -0.06 0.00 2.86 -1.29 -2.47 114.93 115.56 2aj9 h MET 242 Ca 0.16 -0.38 -0.00 0.00 -2.06 0.00 0.00 59.70 57.42 2aj9 h MET 242 Cb 0.59 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.28 2aj9 h MET 242 CO 0.04 0.99 0.03 0.22 1.06 0.00 0.00 176.91 179.24 2aj9 h ASP 243 N 0.50 0.08 0.71 1.22 1.82 -1.10 -1.20 116.42 118.46 2aj9 h ASP 243 Ca 0.02 -0.14 0.00 0.00 -0.39 0.00 0.00 57.03 56.52 2aj9 h ASP 243 Cb 1.05 -0.02 0.00 0.00 0.68 0.00 0.00 39.33 41.03 2aj9 h ASP 243 CO 0.10 0.21 0.00 0.00 -1.61 0.00 0.00 179.24 177.93 2aj9 h ALA 244 N 0.88 1.00 0.00 -0.78 0.00 -1.23 -1.33 119.26 117.80 2aj9 h ALA 244 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2aj9 h ALA 244 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2aj9 h ALA 244 CO -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 179.25 178.72 2aj9 n ALA 245 N -2.04 2.84 -2.10 0.00 0.00 -0.88 -4.59 120.51 113.75 2aj9 n ALA 245 Ca -0.00 -0.22 -0.07 0.00 0.00 0.00 0.00 53.44 53.15 2aj9 n ALA 245 Cb 0.23 -1.21 -0.00 0.00 0.00 0.00 0.00 19.45 18.46 2aj9 n ALA 245 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aj9 n GLY 246 N 1.34 0.12 3.37 0.00 0.00 -0.50 -5.04 105.19 104.48 2aj9 n GLY 246 Ca 0.04 -0.60 -0.29 0.00 0.00 0.00 0.00 46.02 45.17 2aj9 n GLY 246 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2aj9 s VAL 247 N -2.34 2.19 0.24 1.61 -7.23 -0.76 -5.05 120.40 109.06 2aj9 s VAL 247 Ca 0.00 -1.70 -0.12 0.00 -1.81 0.00 0.00 61.98 58.35 2aj9 s VAL 247 Cb 0.00 -1.94 -0.08 0.00 0.56 0.00 0.00 36.38 34.92 2aj9 s VAL 247 CO 0.00 0.11 0.61 -0.13 -0.31 0.00 0.00 175.10 175.37 2aj9 s ARG 248 N -1.96 3.91 0.31 4.82 0.52 -1.26 -4.38 118.95 120.91 2aj9 s ARG 248 Ca 0.13 0.45 0.06 0.00 -0.52 0.00 0.00 55.73 55.85 2aj9 s ARG 248 Cb -0.10 -2.65 0.73 0.00 0.52 0.00 0.00 34.95 33.45 2aj9 s ARG 248 CO 0.05 0.31 1.81 -1.35 0.02 0.00 0.00 175.30 176.14 2aj9 h PRO 249 N 2.69 0.77 0.00 3.54 0.11 -1.90 0.49 132.00 137.70 2aj9 h PRO 249 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2aj9 h PRO 249 Cb 1.18 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2aj9 h PRO 249 CO 0.67 0.51 0.00 -0.40 -0.21 0.00 0.00 178.00 178.57 2aj9 n ASP 250 N -4.67 0.00 -0.10 -2.05 5.68 -1.26 -2.55 116.55 111.59 2aj9 n ASP 250 Ca 0.21 -1.55 0.08 0.00 -0.50 0.00 0.00 54.79 53.03 2aj9 n ASP 250 Cb 0.51 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.42 2aj9 n ASP 250 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2aj9 n GLN 251 N -0.62 1.45 -3.08 0.11 6.02 0.17 -4.80 117.38 116.62 2aj9 n GLN 251 Ca 0.05 -0.22 -0.32 0.00 -0.01 0.00 0.00 57.00 56.50 2aj9 n GLN 251 Cb 0.02 -1.31 -0.06 0.00 1.02 0.00 0.00 30.24 29.92 2aj9 n GLN 251 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 2aj9 s ILE 252 N -2.46 4.63 -0.12 5.09 -4.36 -1.06 -4.77 121.20 118.15 2aj9 s ILE 252 Ca 0.09 1.03 0.07 0.00 -0.26 0.00 0.00 60.65 61.58 2aj9 s ILE 252 Cb 0.13 -3.61 -0.12 0.00 1.25 0.00 0.00 42.46 40.11 2aj9 s ILE 252 CO 0.63 -0.21 -0.01 0.47 0.24 0.00 0.00 174.94 176.05 2aj9 n ASP 253 N -0.43 2.44 -4.11 4.36 10.43 0.28 -4.72 116.55 124.80 2aj9 n ASP 253 Ca 0.04 -0.03 -0.26 0.00 2.57 0.00 0.00 54.79 57.12 2aj9 n ASP 253 Cb 0.53 0.45 -0.16 0.00 1.84 0.00 0.00 41.12 43.78 2aj9 n ASP 253 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2aj9 s VAL 254 N -2.28 1.38 -0.25 2.53 1.01 -0.68 -0.56 120.40 121.56 2aj9 s VAL 254 Ca -0.10 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.23 2aj9 s VAL 254 Cb 0.04 -1.20 0.06 0.00 0.00 0.00 0.00 36.38 35.27 2aj9 s VAL 254 CO 0.42 0.40 -0.09 0.12 0.00 0.00 0.00 175.10 175.96 2aj9 s PHE 255 N 0.23 2.88 -0.65 5.22 5.36 0.15 -0.06 117.98 131.11 2aj9 s PHE 255 Ca -0.08 -2.07 -0.02 0.00 -0.96 0.00 0.00 56.93 53.80 2aj9 s PHE 255 Cb -0.13 -1.77 0.17 0.00 -0.34 0.00 0.00 43.02 40.94 2aj9 s PHE 255 CO 0.03 -0.83 0.46 0.08 -1.46 0.00 0.00 175.22 173.50 2aj9 s VAL 256 N 1.23 3.70 0.41 3.12 1.01 -0.10 -2.08 120.40 127.69 2aj9 s VAL 256 Ca -0.07 -3.08 -0.05 0.00 0.00 0.00 0.00 61.98 58.77 2aj9 s VAL 256 Cb -0.19 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 2aj9 s VAL 256 CO -0.06 -0.89 0.69 -2.16 0.00 0.00 0.00 175.10 172.68 2aj9 s PRO 257 N -0.22 3.59 0.04 2.72 0.04 -1.26 -2.47 135.00 137.45 2aj9 s PRO 257 Ca 0.18 0.11 -0.33 0.00 0.04 0.00 0.00 61.00 61.00 2aj9 s PRO 257 Cb -0.19 -2.48 -0.12 0.00 0.04 0.00 0.00 34.50 31.74 2aj9 s PRO 257 CO -0.04 -0.03 1.78 1.58 0.04 0.00 0.00 177.00 180.34 2aj9 n HIS 258 N -1.74 2.38 -1.31 0.56 -0.00 0.39 -4.80 115.22 110.71 2aj9 n HIS 258 Ca -0.01 0.03 -0.41 0.00 -0.00 0.00 0.00 57.72 57.33 2aj9 n HIS 258 Cb 0.55 -2.65 -0.03 0.00 -0.00 0.00 0.00 29.99 27.86 2aj9 n HIS 258 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 2aj9 n GLN 259 N 5.48 2.08 -0.09 1.57 1.13 -1.26 -4.49 117.38 121.80 2aj9 n GLN 259 Ca 0.20 -2.07 -0.22 0.00 -1.94 0.00 0.00 57.00 52.97 2aj9 n GLN 259 Cb 0.31 -2.99 -0.12 0.00 0.11 0.00 0.00 30.24 27.56 2aj9 n GLN 259 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2aj9 h ALA 260 N 7.03 0.27 -2.58 -1.58 0.00 -1.89 -3.33 119.26 117.17 2aj9 h ALA 260 Ca 0.50 -1.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.10 2aj9 h ALA 260 Cb 0.60 0.71 -0.26 0.00 0.00 0.00 0.00 17.79 18.84 2aj9 h ALA 260 CO 1.89 0.74 -0.27 1.21 0.00 0.00 0.00 179.25 182.82 2aj9 s ASN 261 N -6.86 -0.55 0.39 0.00 3.84 -1.26 -4.83 114.94 105.66 2aj9 s ASN 261 Ca -0.28 0.95 0.14 0.00 0.21 0.00 0.00 52.86 53.89 2aj9 s ASN 261 Cb 0.06 0.84 0.79 0.00 -0.55 0.00 0.00 41.25 42.38 2aj9 s ASN 261 CO 0.62 -0.20 1.85 0.77 -2.79 0.00 0.00 177.10 177.34 2aj9 h SER 262 N 7.13 0.00 -0.16 -4.21 4.64 -1.71 -1.88 113.55 117.36 2aj9 h SER 262 Ca -0.36 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 60.76 2aj9 h SER 262 Cb 1.19 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.29 2aj9 h SER 262 CO 0.28 0.35 -0.70 0.03 -0.87 0.00 0.00 176.83 175.92 2aj9 h ARG 263 N 0.00 0.75 0.02 4.77 3.08 -1.85 -1.83 114.38 119.32 2aj9 h ARG 263 Ca -0.00 -0.60 0.02 0.00 0.07 0.00 0.00 59.98 59.47 2aj9 h ARG 263 Cb 0.64 0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.75 2aj9 h ARG 263 CO 0.04 1.21 -0.50 0.82 -1.07 0.00 0.00 179.97 180.47 2aj9 h ILE 264 N 0.46 0.04 -0.77 2.04 2.04 -1.84 -2.10 117.51 117.39 2aj9 h ILE 264 Ca -0.04 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.95 2aj9 h ILE 264 Cb 1.33 0.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 2aj9 h ILE 264 CO 0.15 0.00 0.51 0.78 0.00 0.00 0.00 178.15 179.58 2aj9 h ASN 265 N -0.66 0.48 0.39 1.72 -0.26 -1.26 -1.22 115.58 114.76 2aj9 h ASN 265 Ca 0.02 0.02 -0.14 0.00 -0.56 0.00 0.00 56.30 55.65 2aj9 h ASN 265 Cb 0.71 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.89 2aj9 h ASN 265 CO -0.34 0.26 -0.58 -0.33 -1.06 0.00 0.00 177.43 175.38 2aj9 h GLU 266 N 0.52 0.20 -0.72 0.81 4.39 -1.23 0.99 114.58 119.54 2aj9 h GLU 266 Ca 0.37 -0.13 -0.01 0.00 0.34 0.00 0.00 59.36 59.94 2aj9 h GLU 266 Cb 0.72 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.35 2aj9 h GLU 266 CO -0.13 0.72 0.43 -0.07 -1.16 0.00 0.00 179.01 178.80 2aj9 h LEU 267 N 0.15 0.87 -0.05 1.33 3.38 -0.55 -2.19 115.31 118.26 2aj9 h LEU 267 Ca -0.00 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2aj9 h LEU 267 Cb 1.07 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.59 2aj9 h LEU 267 CO 0.09 0.69 -0.02 -0.07 0.09 0.00 0.00 178.44 179.21 2aj9 h LEU 268 N 0.98 0.10 -0.61 1.67 3.38 -0.05 -1.33 115.31 119.46 2aj9 h LEU 268 Ca 0.26 -0.41 0.12 0.00 0.09 0.00 0.00 57.88 57.93 2aj9 h LEU 268 Cb -0.02 -0.03 -0.09 0.00 0.09 0.00 0.00 40.66 40.61 2aj9 h LEU 268 CO -0.05 0.49 0.10 0.58 0.09 0.00 0.00 178.44 179.65 2aj9 h VAL 269 N -0.30 0.60 -0.33 1.22 2.07 -0.91 0.39 116.25 119.00 2aj9 h VAL 269 Ca 0.01 -0.08 -0.03 0.00 0.82 0.00 0.00 66.70 67.43 2aj9 h VAL 269 Cb 0.45 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 2aj9 h VAL 269 CO 0.01 0.04 0.08 0.11 0.02 0.00 0.00 177.57 177.83 2aj9 h LYS 270 N 0.22 0.47 0.03 1.57 1.57 -1.10 -3.19 116.57 116.14 2aj9 h LYS 270 Ca 0.32 -0.07 -0.22 0.00 -1.87 0.00 0.00 60.65 58.81 2aj9 h LYS 270 Cb 0.50 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 2aj9 h LYS 270 CO -0.44 0.44 -0.97 -0.97 -0.57 0.00 0.00 179.45 176.94 2aj9 h ASN 271 N 0.47 0.27 1.12 0.86 -0.73 0.77 -3.31 115.58 115.02 2aj9 h ASN 271 Ca 0.11 -0.24 -0.01 0.00 1.87 0.00 0.00 56.30 58.03 2aj9 h ASN 271 Cb 0.18 -0.08 -0.00 0.00 0.27 0.00 0.00 38.32 38.68 2aj9 h ASN 271 CO -0.00 1.09 -0.05 -0.07 -0.37 0.00 0.00 177.43 178.03 2aj9 h LEU 272 N 0.09 0.00 -2.19 0.34 3.38 -0.55 -3.48 115.31 112.90 2aj9 h LEU 272 Ca -0.06 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.73 2aj9 h LEU 272 Cb 1.65 0.00 0.12 0.00 0.09 0.00 0.00 40.66 42.51 2aj9 h LEU 272 CO 0.15 0.05 -0.51 0.00 0.09 0.00 0.00 178.44 178.22 2aj9 n GLN 273 N -3.16 -2.89 -2.53 1.13 6.02 -1.24 -4.89 117.38 109.83 2aj9 n GLN 273 Ca 0.01 0.54 -0.24 0.00 -0.01 0.00 0.00 57.00 57.30 2aj9 n GLN 273 Cb 0.36 -4.45 0.10 0.00 1.02 0.00 0.00 30.24 27.28 2aj9 n GLN 273 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2aj9 s LEU 274 N -4.64 2.98 0.32 1.08 1.43 -1.26 -4.25 118.68 114.35 2aj9 s LEU 274 Ca 0.14 -0.25 -0.28 0.00 -1.03 0.00 0.00 54.13 52.71 2aj9 s LEU 274 Cb -0.02 -2.15 -0.10 0.00 0.03 0.00 0.00 46.19 43.95 2aj9 s LEU 274 CO 0.46 -1.83 1.21 -0.13 0.23 0.00 0.00 176.35 176.30 2aj9 s ARG 275 N -5.15 4.40 0.52 1.70 0.52 -1.26 -4.88 118.95 114.80 2aj9 s ARG 275 Ca 0.65 2.02 0.31 0.00 -0.52 0.00 0.00 55.73 58.19 2aj9 s ARG 275 Cb -0.06 -3.05 1.67 0.00 0.52 0.00 0.00 34.95 34.03 2aj9 s ARG 275 CO 0.44 -0.07 1.93 -1.35 0.02 0.00 0.00 175.30 176.27 2aj9 h PRO 276 N 3.41 0.00 -0.36 3.54 0.11 -2.00 -0.01 132.00 136.69 2aj9 h PRO 276 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2aj9 h PRO 276 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2aj9 h PRO 276 CO 0.65 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.04 2aj9 n ASP 277 N -2.66 3.79 -4.77 -2.05 5.75 -1.26 -5.01 116.55 110.33 2aj9 n ASP 277 Ca -0.02 -2.59 -0.40 0.00 -0.01 0.00 0.00 54.79 51.77 2aj9 n ASP 277 Cb 0.16 -0.45 -0.02 0.00 -1.03 0.00 0.00 41.12 39.78 2aj9 n ASP 277 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2aj9 s ALA 278 N -2.06 3.39 -0.27 2.12 0.00 -0.02 -4.96 121.76 119.97 2aj9 s ALA 278 Ca 0.38 1.19 -0.25 0.00 0.00 0.00 0.00 51.96 53.28 2aj9 s ALA 278 Cb 0.27 -3.45 -0.00 0.00 0.00 0.00 0.00 23.12 19.93 2aj9 s ALA 278 CO 0.14 -0.63 0.85 0.08 0.00 0.00 0.00 175.76 176.20 2aj9 s VAL 279 N -1.20 4.79 -0.12 0.00 1.01 0.28 -4.92 120.40 120.23 2aj9 s VAL 279 Ca 0.51 1.49 -0.04 0.00 0.00 0.00 0.00 61.98 63.95 2aj9 s VAL 279 Cb -0.38 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 31.81 2aj9 s VAL 279 CO 0.49 -0.16 0.02 -0.69 0.00 0.00 0.00 175.10 174.76 2aj9 s VAL 280 N 2.96 4.42 -0.13 2.92 1.01 -1.26 -0.68 120.40 129.64 2aj9 s VAL 280 Ca 0.35 -0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.85 2aj9 s VAL 280 Cb -0.15 -2.91 -0.02 0.00 0.00 0.00 0.00 36.38 33.31 2aj9 s VAL 280 CO 0.09 0.55 1.16 0.00 0.00 0.00 0.00 175.10 176.91 2aj9 s ALA 281 N -0.37 3.57 -0.27 5.51 0.00 -0.88 -4.87 121.76 124.44 2aj9 s ALA 281 Ca 0.08 0.46 0.15 0.00 0.00 0.00 0.00 51.96 52.64 2aj9 s ALA 281 Cb -0.12 -3.54 0.37 0.00 0.00 0.00 0.00 23.12 19.83 2aj9 s ALA 281 CO 0.02 -0.92 1.28 0.27 0.00 0.00 0.00 175.76 176.41 2aj9 n ASN 282 N 5.81 3.11 -0.18 0.00 0.23 -1.26 -4.79 115.26 118.17 2aj9 n ASN 282 Ca 0.12 -2.76 0.10 0.00 -0.53 0.00 0.00 54.58 51.51 2aj9 n ASN 282 Cb 0.46 -0.40 0.19 0.00 -2.08 0.00 0.00 39.78 37.95 2aj9 n ASN 282 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2aj9 n ASP 283 N -0.59 -0.01 -0.59 0.53 2.03 -1.26 -1.46 116.55 115.21 2aj9 n ASP 283 Ca 0.16 0.92 0.47 0.00 0.52 0.00 0.00 54.79 56.85 2aj9 n ASP 283 Cb 0.68 -0.36 0.75 0.00 -0.72 0.00 0.00 41.12 41.47 2aj9 n ASP 283 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 2aj9 h ILE 284 N 0.00 0.00 -0.88 5.18 2.10 -1.87 -1.32 117.51 120.73 2aj9 h ILE 284 Ca 0.36 -0.00 0.16 0.00 1.08 0.00 0.00 64.86 66.46 2aj9 h ILE 284 Cb 0.79 0.00 -0.07 0.00 -1.09 0.00 0.00 36.82 36.46 2aj9 h ILE 284 CO -0.49 0.00 0.57 -0.08 -1.08 0.00 0.00 178.15 177.07 2aj9 h GLU 285 N 0.00 0.57 0.00 2.19 4.81 -1.33 0.18 114.58 121.00 2aj9 h GLU 285 Ca 0.92 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 60.11 2aj9 h GLU 285 Cb 3.30 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 32.56 2aj9 h GLU 285 CO -0.26 0.38 0.00 -2.39 -0.73 0.00 0.00 179.01 176.01 2aj9 n HIS 286 N -4.55 0.00 0.00 0.92 1.44 -0.51 -0.38 115.22 112.14 2aj9 n HIS 286 Ca 0.18 -0.26 0.00 0.00 -2.01 0.00 0.00 57.72 55.62 2aj9 n HIS 286 Cb 0.54 -0.03 0.00 0.00 0.12 0.00 0.00 29.99 30.62 2aj9 n HIS 286 CO 0.00 0.00 0.00 2.41 -2.81 0.00 0.00 176.34 175.94 2aj9 n THR 287 N -0.26 0.00 -4.10 0.61 -1.04 -1.11 -3.97 114.28 104.41 2aj9 n THR 287 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2aj9 n THR 287 Cb 0.21 -0.87 0.00 0.00 -1.82 0.00 0.00 70.33 67.85 2aj9 n THR 287 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2aj9 n GLY 288 N 2.97 -0.97 3.44 3.41 0.00 0.60 -4.27 105.19 110.39 2aj9 n GLY 288 Ca 0.00 -1.20 -0.44 0.00 0.00 0.00 0.00 46.02 44.38 2aj9 n GLY 288 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2aj9 s ASN 289 N -4.00 6.16 -0.27 1.61 3.84 0.31 -4.49 114.94 118.11 2aj9 s ASN 289 Ca 0.00 -0.97 0.12 0.00 0.21 0.00 0.00 52.86 52.23 2aj9 s ASN 289 Cb 0.00 -2.20 0.72 0.00 -0.55 0.00 0.00 41.25 39.22 2aj9 s ASN 289 CO 0.00 -0.59 1.70 0.35 -2.79 0.00 0.00 177.10 175.76 2aj9 n THR 290 N 5.30 2.74 0.00 -5.21 -2.24 -1.26 -0.90 114.28 112.71 2aj9 n THR 290 Ca -0.10 -1.69 0.00 0.00 -2.27 0.00 0.00 64.05 59.99 2aj9 n THR 290 Cb 0.46 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 2aj9 n THR 290 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2aj9 n SER 291 N -0.05 0.00 0.22 3.42 2.88 -1.26 -1.10 113.62 117.73 2aj9 n SER 291 Ca 0.33 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.97 2aj9 n SER 291 Cb 1.22 0.00 0.42 0.00 -0.75 0.00 0.00 64.21 65.10 2aj9 n SER 291 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2aj9 h ALA 292 N -0.58 0.98 0.00 -1.46 0.00 -1.77 -2.15 119.26 114.29 2aj9 h ALA 292 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2aj9 h ALA 292 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2aj9 h ALA 292 CO 0.00 0.27 -0.28 0.00 0.00 0.00 0.00 179.25 179.23 2aj9 h ALA 293 N 1.79 0.82 -0.21 0.00 0.00 -1.30 -3.39 119.26 116.97 2aj9 h ALA 293 Ca -0.00 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2aj9 h ALA 293 Cb 0.80 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2aj9 h ALA 293 CO 0.03 0.00 -0.21 1.03 0.00 0.00 0.00 179.25 180.09 2aj9 h SER 294 N 0.00 -0.73 -0.25 0.00 0.87 -1.35 -1.02 113.55 111.07 2aj9 h SER 294 Ca 0.00 0.10 0.05 0.00 -1.23 0.00 0.00 61.79 60.71 2aj9 h SER 294 Cb 0.80 0.31 -0.05 0.00 -0.44 0.00 0.00 62.40 63.02 2aj9 h SER 294 CO 0.00 -0.14 -0.06 0.40 -0.53 0.00 0.00 176.83 176.50 2aj9 h ILE 295 N -0.12 0.75 -0.44 2.23 2.04 -1.80 -1.16 117.51 119.01 2aj9 h ILE 295 Ca 0.04 -0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.96 2aj9 h ILE 295 Cb 0.21 0.75 -0.06 0.00 -0.74 0.00 0.00 36.82 36.98 2aj9 h ILE 295 CO -0.26 0.00 0.11 -0.65 0.00 0.00 0.00 178.15 177.36 2aj9 h PRO 296 N 0.00 0.25 -0.57 2.37 0.11 -1.79 0.37 132.00 132.74 2aj9 h PRO 296 Ca 0.12 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.21 2aj9 h PRO 296 Cb 0.18 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.21 2aj9 h PRO 296 CO -0.25 0.16 0.34 -0.07 -0.21 0.00 0.00 178.00 177.97 2aj9 h LEU 297 N 0.26 0.69 -0.28 2.35 3.38 -0.89 -1.43 115.31 119.39 2aj9 h LEU 297 Ca 0.22 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.13 2aj9 h LEU 297 Cb 0.25 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2aj9 h LEU 297 CO -0.26 0.55 0.16 0.00 0.09 0.00 0.00 178.44 178.98 2aj9 h ALA 298 N 1.17 0.35 -0.56 1.53 0.00 -0.47 -1.77 119.26 119.49 2aj9 h ALA 298 Ca 0.20 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.15 2aj9 h ALA 298 Cb -0.01 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2aj9 h ALA 298 CO -0.04 -0.21 0.31 0.52 0.00 0.00 0.00 179.25 179.83 2aj9 h MET 299 N 0.34 0.58 -1.01 0.00 2.86 -0.66 -1.75 114.93 115.29 2aj9 h MET 299 Ca 0.11 -0.04 0.07 0.00 -2.06 0.00 0.00 59.70 57.79 2aj9 h MET 299 Cb -0.00 -0.13 -0.07 0.00 0.06 0.00 0.00 31.60 31.46 2aj9 h MET 299 CO -0.05 0.39 0.65 0.00 1.06 0.00 0.00 176.91 178.96 2aj9 h ALA 300 N 1.28 1.42 -0.05 6.32 0.00 -0.76 -1.80 119.26 125.66 2aj9 h ALA 300 Ca 0.24 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 2aj9 h ALA 300 Cb 0.11 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2aj9 h ALA 300 CO -0.14 0.42 -0.15 1.49 0.00 0.00 0.00 179.25 180.87 2aj9 h GLU 301 N 1.16 0.19 -0.57 0.00 4.81 -0.71 -1.40 114.58 118.06 2aj9 h GLU 301 Ca 0.44 -0.14 0.13 0.00 -0.13 0.00 0.00 59.36 59.66 2aj9 h GLU 301 Cb 0.21 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 2aj9 h GLU 301 CO -0.19 0.76 0.39 -0.07 -0.73 0.00 0.00 179.01 179.17 2aj9 h LEU 302 N -0.34 0.20 -0.01 1.64 4.07 -1.14 0.33 115.31 120.07 2aj9 h LEU 302 Ca -0.00 0.01 -0.00 0.00 0.08 0.00 0.00 57.88 57.96 2aj9 h LEU 302 Cb 0.77 -0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.47 2aj9 h LEU 302 CO 0.03 0.12 -0.01 -0.07 -1.08 0.00 0.00 178.44 177.43 2aj9 h LEU 303 N 0.22 0.02 -0.43 1.67 3.38 -1.22 -1.49 115.31 117.47 2aj9 h LEU 303 Ca 0.27 -0.55 0.07 0.00 0.09 0.00 0.00 57.88 57.77 2aj9 h LEU 303 Cb 0.77 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.45 2aj9 h LEU 303 CO -0.05 0.56 0.05 0.74 0.09 0.00 0.00 178.44 179.83 2aj9 h THR 304 N -0.53 0.73 -0.43 0.22 2.02 0.01 -2.00 112.91 112.94 2aj9 h THR 304 Ca 0.00 -0.06 -0.10 0.00 0.77 0.00 0.00 66.41 67.02 2aj9 h THR 304 Cb 0.56 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.50 2aj9 h THR 304 CO 0.00 0.03 -0.15 0.71 0.37 0.00 0.00 175.52 176.49 2aj9 h THR 305 N 0.17 1.26 0.00 3.16 1.35 -0.47 -3.46 112.91 114.92 2aj9 h THR 305 Ca 0.21 -1.23 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 2aj9 h THR 305 Cb 0.28 1.09 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 2aj9 h THR 305 CO -0.31 0.42 0.00 0.61 -0.25 0.00 0.00 175.52 175.99 2aj9 n GLY 306 N -0.36 1.10 0.07 5.82 0.00 -0.65 -4.93 105.19 106.23 2aj9 n GLY 306 Ca 0.01 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.59 2aj9 n GLY 306 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aj9 h ALA 307 N 0.00 0.04 -2.37 4.61 0.00 -1.57 -3.43 119.26 116.54 2aj9 h ALA 307 Ca 0.00 -0.27 -0.51 0.00 0.00 0.00 0.00 54.91 54.14 2aj9 h ALA 307 Cb 0.13 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2aj9 h ALA 307 CO 0.00 -0.18 0.02 0.00 0.00 0.00 0.00 179.25 179.09 2aj9 s ALA 308 N -4.21 3.44 0.04 0.00 0.00 -0.81 -4.96 121.76 115.26 2aj9 s ALA 308 Ca -0.16 -0.25 0.04 0.00 0.00 0.00 0.00 51.96 51.59 2aj9 s ALA 308 Cb 0.02 -2.58 -0.02 0.00 0.00 0.00 0.00 23.12 20.54 2aj9 s ALA 308 CO 0.69 0.19 -0.12 0.15 0.00 0.00 0.00 175.76 176.67 2aj9 s LYS 309 N -3.46 0.81 0.01 0.00 -0.14 -1.26 -4.40 119.74 111.30 2aj9 s LYS 309 Ca 0.49 -0.72 -0.35 0.00 -1.36 0.00 0.00 55.97 54.03 2aj9 s LYS 309 Cb -0.11 -0.78 -0.14 0.00 -1.68 0.00 0.00 37.83 35.13 2aj9 s LYS 309 CO 0.27 0.19 1.67 -2.30 -0.76 0.00 0.00 175.35 174.42 2aj9 n PRO 310 N 1.87 1.90 0.00 -1.68 -0.02 -1.26 -0.73 135.00 135.09 2aj9 n PRO 310 Ca -0.19 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2aj9 n PRO 310 Cb 0.55 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2aj9 n PRO 310 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2aj9 n GLY 311 N 3.74 0.41 3.76 -1.23 0.00 0.13 -4.96 105.19 107.03 2aj9 n GLY 311 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 2aj9 n GLY 311 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2aj9 s ASP 312 N -2.12 5.05 -0.42 1.61 1.01 0.09 -4.60 116.67 117.30 2aj9 s ASP 312 Ca 0.00 2.18 -0.23 0.00 0.71 0.00 0.00 52.55 55.21 2aj9 s ASP 312 Cb 0.00 -2.57 0.02 0.00 1.01 0.00 0.00 42.92 41.37 2aj9 s ASP 312 CO 0.00 -1.67 0.77 -0.22 0.21 0.00 0.00 175.17 174.26 2aj9 s LEU 313 N -4.56 4.21 0.12 1.23 2.96 -1.26 -0.86 118.68 120.52 2aj9 s LEU 313 Ca 0.72 0.06 0.08 0.00 -0.22 0.00 0.00 54.13 54.77 2aj9 s LEU 313 Cb -0.25 -2.97 -0.04 0.00 0.50 0.00 0.00 46.19 43.43 2aj9 s LEU 313 CO 0.38 -0.83 -0.13 0.00 -1.32 0.00 0.00 176.35 174.44 2aj9 s ALA 314 N 3.19 2.85 -0.26 5.97 0.00 0.01 0.99 121.76 134.51 2aj9 s ALA 314 Ca 0.30 -1.32 -0.05 0.00 0.00 0.00 0.00 51.96 50.89 2aj9 s ALA 314 Cb -0.13 -0.78 0.01 0.00 0.00 0.00 0.00 23.12 22.22 2aj9 s ALA 314 CO 0.20 0.60 0.02 -1.17 0.00 0.00 0.00 175.76 175.41 2aj9 s LEU 315 N -2.29 3.45 -0.21 0.00 0.20 0.91 -1.74 118.68 119.00 2aj9 s LEU 315 Ca 0.21 -0.64 -0.09 0.00 0.69 0.00 0.00 54.13 54.30 2aj9 s LEU 315 Cb -0.11 -1.80 -0.04 0.00 -0.43 0.00 0.00 46.19 43.81 2aj9 s LEU 315 CO 0.13 -0.13 0.10 -0.76 -0.29 0.00 0.00 176.35 175.40 2aj9 s LEU 316 N 1.46 3.91 -0.20 -0.68 1.43 -0.78 -0.93 118.68 122.88 2aj9 s LEU 316 Ca 0.03 0.08 -0.02 0.00 -1.03 0.00 0.00 54.13 53.19 2aj9 s LEU 316 Cb -0.16 -2.01 0.06 0.00 0.03 0.00 0.00 46.19 44.10 2aj9 s LEU 316 CO -0.00 0.13 0.01 -0.63 0.23 0.00 0.00 176.35 176.08 2aj9 s ILE 317 N 0.66 0.83 -0.16 -0.59 1.01 -1.03 -2.40 121.20 119.52 2aj9 s ILE 317 Ca 0.05 -0.73 -0.05 0.00 0.00 0.00 0.00 60.65 59.92 2aj9 s ILE 317 Cb -0.13 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 41.06 2aj9 s ILE 317 CO 0.01 -0.15 0.01 -0.83 0.00 0.00 0.00 174.94 173.98 2aj9 s GLY 318 N 1.72 1.82 0.03 6.18 0.00 0.03 -0.46 107.32 116.65 2aj9 s GLY 318 Ca -0.02 -0.78 -0.06 0.00 0.00 0.00 0.00 44.72 43.86 2aj9 s GLY 318 CO -0.07 -0.07 0.11 -2.52 0.00 0.00 0.00 173.10 170.54 2aj9 s TYR 319 N 0.21 0.17 -2.40 1.90 1.13 -1.26 -1.51 117.35 115.59 2aj9 s TYR 319 Ca 0.01 -0.45 0.00 0.00 -1.41 0.00 0.00 57.07 55.23 2aj9 s TYR 319 Cb -0.13 -0.12 0.00 0.00 -1.10 0.00 0.00 41.96 40.61 2aj9 s TYR 319 CO 0.02 -0.36 0.00 0.41 -2.51 0.00 0.00 175.55 173.11 2aj9 n GLY 320 N 0.85 -0.35 2.74 5.49 0.00 -1.09 -4.46 105.19 108.38 2aj9 n GLY 320 Ca -0.19 -0.71 -0.33 0.00 0.00 0.00 0.00 46.02 44.79 2aj9 n GLY 320 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aj9 n ALA 321 N -0.13 -2.80 -0.35 4.61 0.00 -1.26 -0.90 120.51 119.68 2aj9 n ALA 321 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2aj9 n ALA 321 Cb 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.25 2aj9 n ALA 321 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aj9 n GLY 322 N 2.08 0.00 2.92 0.00 0.00 -1.26 -2.29 105.19 106.65 2aj9 n GLY 322 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.06 2aj9 n GLY 322 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2aj9 n LEU 323 N 0.00 -7.09 -4.15 0.99 4.32 -0.08 -4.25 117.00 106.74 2aj9 n LEU 323 Ca 0.00 0.17 -0.14 0.00 -0.02 0.00 0.00 56.01 56.02 2aj9 n LEU 323 Cb 0.10 -3.27 -0.11 0.00 -1.62 0.00 0.00 43.42 38.52 2aj9 n LEU 323 CO 0.00 -1.58 -0.42 -0.94 -1.22 0.00 0.00 177.39 173.24 2aj9 s SER 324 N -2.79 1.33 -0.02 -1.43 1.04 -0.47 -0.69 113.70 110.67 2aj9 s SER 324 Ca 0.10 -0.73 -0.06 0.00 0.48 0.00 0.00 55.95 55.74 2aj9 s SER 324 Cb -0.03 0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.11 2aj9 s SER 324 CO 0.73 -0.23 0.12 -0.72 0.98 0.00 0.00 173.24 174.12 2aj9 s TYR 325 N -2.09 -0.02 -0.02 5.02 -0.85 -0.93 -2.69 117.35 115.78 2aj9 s TYR 325 Ca 0.01 0.03 0.00 0.00 -0.52 0.00 0.00 57.07 56.59 2aj9 s TYR 325 Cb -0.05 -0.02 0.03 0.00 0.38 0.00 0.00 41.96 42.29 2aj9 s TYR 325 CO 0.00 -0.20 0.02 0.00 -1.52 0.00 0.00 175.55 173.85 2aj9 s ALA 326 N -0.83 0.15 0.02 9.51 0.00 -0.57 -1.79 121.76 128.26 2aj9 s ALA 326 Ca -0.09 0.22 -0.04 0.00 0.00 0.00 0.00 51.96 52.05 2aj9 s ALA 326 Cb -0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.81 2aj9 s ALA 326 CO 0.01 -0.08 0.06 0.00 0.00 0.00 0.00 175.76 175.74 2aj9 s ALA 327 N 0.92 -0.03 -0.18 0.00 0.00 -0.23 -0.79 121.76 121.45 2aj9 s ALA 327 Ca -0.08 -0.50 -0.31 0.00 0.00 0.00 0.00 51.96 51.07 2aj9 s ALA 327 Cb -0.12 0.18 0.14 0.00 0.00 0.00 0.00 23.12 23.33 2aj9 s ALA 327 CO -0.02 -0.24 1.11 1.14 0.00 0.00 0.00 175.76 177.75 2aj9 s GLN 328 N -1.98 0.44 -0.04 0.00 0.00 -1.01 -0.64 119.66 116.42 2aj9 s GLN 328 Ca -0.11 0.02 -0.14 0.00 -0.00 0.00 0.00 55.36 55.13 2aj9 s GLN 328 Cb -0.05 0.20 -0.05 0.00 0.00 0.00 0.00 33.01 33.11 2aj9 s GLN 328 CO -0.02 -0.15 0.38 0.08 0.00 0.00 0.00 175.29 175.58 2aj9 s VAL 329 N -1.56 5.11 0.20 3.63 1.01 -1.26 -1.87 120.40 125.66 2aj9 s VAL 329 Ca 0.04 0.78 -0.03 0.00 0.00 0.00 0.00 61.98 62.76 2aj9 s VAL 329 Cb -0.01 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 2aj9 s VAL 329 CO -0.03 0.53 0.18 0.68 0.00 0.00 0.00 175.10 176.46 2aj9 s VAL 330 N -0.70 0.01 -0.24 2.92 -7.23 -0.71 -0.04 120.40 114.41 2aj9 s VAL 330 Ca 0.23 -1.87 -0.08 0.00 -1.81 0.00 0.00 61.98 58.44 2aj9 s VAL 330 Cb -0.16 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.37 2aj9 s VAL 330 CO 0.11 -0.06 0.09 -0.13 -0.31 0.00 0.00 175.10 174.80 2aj9 s ARG 331 N -4.12 3.75 0.06 4.82 0.52 -0.68 -0.81 118.95 122.50 2aj9 s ARG 331 Ca 0.34 -0.43 -0.36 0.00 -0.52 0.00 0.00 55.73 54.76 2aj9 s ARG 331 Cb 0.06 -3.36 -0.16 0.00 0.52 0.00 0.00 34.95 32.01 2aj9 s ARG 331 CO 0.10 -0.11 1.46 -1.33 0.02 0.00 0.00 175.30 175.44 2aj9 n MET 332 N 4.71 1.43 0.00 3.54 2.81 -0.04 -4.47 117.12 125.10 2aj9 n MET 332 Ca -0.16 0.52 0.00 0.00 -1.81 0.00 0.00 57.70 56.25 2aj9 n MET 332 Cb 0.52 -2.20 0.00 0.00 -0.71 0.00 0.00 33.22 30.82 2aj9 n MET 332 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2aj9 n PRO 333 N 3.20 3.02 0.00 0.03 -0.04 -1.26 0.21 135.00 140.15 2aj9 n PRO 333 Ca 0.19 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.71 2aj9 n PRO 333 Cb 0.21 0.00 0.05 0.00 -0.04 0.00 0.00 33.50 33.72 2aj9 n PRO 333 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09