#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nje h LEU 2 N 0.00 0.08 0.00 4.03 5.85 -1.99 -1.76 115.31 121.52 1nje h LEU 2 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1nje h LEU 2 Cb 0.00 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.07 1nje h LEU 2 CO 0.00 0.08 0.00 -1.84 -0.34 0.00 0.00 178.44 176.34 1nje n GLU 3 N -5.05 0.28 -0.38 1.25 0.28 -1.26 -4.06 120.64 111.70 1nje n GLU 3 Ca 0.00 0.04 0.30 0.00 -0.16 0.00 0.00 57.16 57.34 1nje n GLU 3 Cb 0.13 -1.50 0.58 0.00 1.43 0.00 0.00 31.44 32.08 1nje n GLU 3 CO 0.00 0.00 0.00 0.37 -0.16 0.00 0.00 177.13 177.34 1nje h GLN 4 N 0.00 0.23 -0.95 3.44 5.75 -1.75 0.50 115.11 122.33 1nje h GLN 4 Ca 0.00 -0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.53 1nje h GLN 4 Cb 0.31 -0.05 -0.06 0.00 1.07 0.00 0.00 27.48 28.75 1nje h GLN 4 CO 0.00 0.15 0.62 -1.35 -2.65 0.00 0.00 178.83 175.60 1nje h PRO 5 N 0.24 1.13 -0.04 -2.39 0.11 -1.79 0.31 132.00 129.56 1nje h PRO 5 Ca 0.69 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.73 1nje h PRO 5 Cb 2.02 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 32.87 1nje h PRO 5 CO -0.34 0.75 0.02 -0.92 -0.21 0.00 0.00 178.00 177.29 1nje h TYR 6 N 1.16 0.06 -0.21 0.65 3.20 -0.29 0.77 116.97 122.30 1nje h TYR 6 Ca 0.39 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.22 1nje h TYR 6 Cb 0.07 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 1nje h TYR 6 CO -0.00 0.19 -0.01 -0.07 -1.64 0.00 0.00 178.16 176.63 1nje h LEU 7 N -0.09 0.29 -0.84 2.82 3.38 -1.23 -1.25 115.31 118.39 1nje h LEU 7 Ca 0.01 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1nje h LEU 7 Cb 0.16 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1nje h LEU 7 CO -0.00 0.35 -0.34 0.44 0.09 0.00 0.00 178.44 178.98 1nje h ASP 8 N 0.31 0.00 0.21 -0.43 3.32 0.15 -0.43 116.42 119.55 1nje h ASP 8 Ca 0.07 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.85 1nje h ASP 8 Cb 0.22 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.81 1nje h ASP 8 CO 0.01 0.34 -1.20 0.25 -1.72 0.00 0.00 179.24 176.91 1nje h LEU 9 N 0.00 0.69 -0.65 1.55 7.12 -0.03 -2.72 115.31 121.27 1nje h LEU 9 Ca -0.00 -0.94 -0.03 0.00 0.13 0.00 0.00 57.88 57.04 1nje h LEU 9 Cb 0.92 -0.22 -0.03 0.00 -0.53 0.00 0.00 40.66 40.80 1nje h LEU 9 CO 0.04 1.58 0.29 0.00 -0.13 0.00 0.00 178.44 180.22 1nje h ALA 10 N 0.12 0.84 0.47 1.25 0.00 -1.16 -2.49 119.26 118.30 1nje h ALA 10 Ca -0.21 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 1nje h ALA 10 Cb 1.95 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 1nje h ALA 10 CO 0.22 0.43 -0.48 -0.22 0.00 0.00 0.00 179.25 179.20 1nje h LYS 11 N 0.91 -0.92 -0.91 0.00 3.64 -1.15 -3.02 116.57 115.12 1nje h LYS 11 Ca 0.22 0.06 0.16 0.00 -1.27 0.00 0.00 60.65 59.82 1nje h LYS 11 Cb 0.16 0.21 -0.10 0.00 -0.41 0.00 0.00 32.23 32.09 1nje h LYS 11 CO -0.02 -0.61 0.50 -0.22 -2.27 0.00 0.00 179.45 176.83 1nje h LYS 12 N -0.95 0.67 0.00 1.90 3.64 -1.24 0.75 116.57 121.33 1nje h LYS 12 Ca -0.06 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1nje h LYS 12 Cb 0.83 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1nje h LYS 12 CO -0.06 0.44 0.00 1.33 -2.27 0.00 0.00 179.45 178.89 1nje n VAL 13 N -4.82 0.63 0.02 2.00 0.24 -0.96 -0.19 118.33 115.25 1nje n VAL 13 Ca 0.19 0.16 -0.08 0.00 -2.04 0.00 0.00 64.34 62.57 1nje n VAL 13 Cb 0.48 -0.89 -0.13 0.00 -1.47 0.00 0.00 33.84 31.83 1nje n VAL 13 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1nje h LEU 14 N 0.00 0.01 0.03 1.34 3.38 -0.80 -2.13 115.31 117.14 1nje h LEU 14 Ca 0.00 -0.01 -0.25 0.00 0.09 0.00 0.00 57.88 57.71 1nje h LEU 14 Cb 0.19 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1nje h LEU 14 CO 0.00 1.01 -1.33 0.44 0.09 0.00 0.00 178.44 178.65 1nje h ASP 15 N 0.00 0.11 -0.06 -0.43 5.19 -0.94 -3.42 116.42 116.87 1nje h ASP 15 Ca -0.16 -0.65 0.00 0.00 -0.62 0.00 0.00 57.03 55.60 1nje h ASP 15 Cb 1.90 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 41.37 1nje h ASP 15 CO 0.10 1.54 0.00 -0.62 -3.12 0.00 0.00 179.24 177.14 1nje n GLU 16 N -4.23 0.75 -2.03 3.56 1.02 0.73 -4.96 120.64 115.49 1nje n GLU 16 Ca -0.30 -1.18 -0.42 0.00 -0.02 0.00 0.00 57.16 55.24 1nje n GLU 16 Cb 0.76 -1.16 -0.03 0.00 -0.02 0.00 0.00 31.44 30.99 1nje n GLU 16 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1nje s GLY 17 N -0.74 0.71 0.59 0.62 0.00 -0.80 -4.85 107.32 102.84 1nje s GLY 17 Ca 0.11 0.08 -0.15 0.00 0.00 0.00 0.00 44.72 44.76 1nje s GLY 17 CO 0.10 3.26 1.04 -2.38 0.00 0.00 0.00 173.10 175.12 1nje s HIS 18 N 7.19 3.18 -0.09 1.90 -3.43 -0.94 -4.43 115.29 118.67 1nje s HIS 18 Ca 0.77 1.47 -0.30 0.00 -0.80 0.00 0.00 55.06 56.20 1nje s HIS 18 Cb -0.20 -2.91 -0.03 0.00 -1.43 0.00 0.00 32.58 28.01 1nje s HIS 18 CO 0.31 -0.89 1.27 0.12 -2.00 0.00 0.00 174.74 173.56 1nje s PHE 19 N -2.62 2.97 -0.09 0.38 2.19 -1.26 -0.44 117.98 119.11 1nje s PHE 19 Ca 0.61 1.05 0.02 0.00 0.33 0.00 0.00 56.93 58.94 1nje s PHE 19 Cb -0.14 -3.50 0.01 0.00 -1.31 0.00 0.00 43.02 38.08 1nje s PHE 19 CO 0.39 -1.71 -0.17 0.21 1.83 0.00 0.00 175.22 175.77 1nje s LYS 20 N 2.77 2.26 0.72 10.12 2.20 0.33 -4.93 119.74 133.21 1nje s LYS 20 Ca 0.57 -0.59 -0.10 0.00 -0.36 0.00 0.00 55.97 55.48 1nje s LYS 20 Cb -0.25 -1.83 0.04 0.00 -1.51 0.00 0.00 37.83 34.28 1nje s LYS 20 CO 0.20 0.03 1.08 -1.25 -0.36 0.00 0.00 175.35 175.06 1nje s PRO 21 N 0.70 2.54 0.37 4.03 0.04 -1.26 -1.22 135.00 140.20 1nje s PRO 21 Ca -0.13 0.22 -0.16 0.00 0.04 0.00 0.00 61.00 60.97 1nje s PRO 21 Cb -0.16 -2.05 0.05 0.00 0.04 0.00 0.00 34.50 32.38 1nje s PRO 21 CO 0.03 -1.17 0.77 0.16 0.04 0.00 0.00 177.00 176.83 1nje s ASP 22 N -4.43 -0.03 0.18 6.66 -4.77 -1.26 -4.87 116.67 108.14 1nje s ASP 22 Ca 0.59 -1.06 -0.17 0.00 -3.30 0.00 0.00 52.55 48.60 1nje s ASP 22 Cb -0.11 0.83 0.12 0.00 -1.09 0.00 0.00 42.92 42.68 1nje s ASP 22 CO 0.49 -1.63 1.64 -0.09 0.70 0.00 0.00 175.17 176.28 1nje h ARG 23 N 2.00 -0.07 -0.96 2.11 2.43 -1.98 -1.88 114.38 116.03 1nje h ARG 23 Ca -0.30 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 1nje h ARG 23 Cb 1.25 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.82 1nje h ARG 23 CO 0.38 -0.05 0.00 0.25 -1.51 0.00 0.00 179.97 179.04 1nje n THR 24 N -5.37 0.32 -0.09 0.20 -2.24 -1.26 -4.84 114.28 100.99 1nje n THR 24 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1nje n THR 24 Cb 0.28 -0.60 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 1nje n THR 24 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nje n HIS 25 N 0.30 0.00 -3.72 4.78 1.44 -0.71 -4.16 115.22 113.14 1nje n HIS 25 Ca 0.00 0.00 -0.37 0.00 -2.01 0.00 0.00 57.72 55.34 1nje n HIS 25 Cb 0.28 -0.66 -0.11 0.00 0.12 0.00 0.00 29.99 29.62 1nje n HIS 25 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 1nje s THR 26 N -0.14 4.78 0.76 0.61 2.01 -1.26 -4.94 115.64 117.46 1nje s THR 26 Ca 0.00 -0.02 -0.15 0.00 0.31 0.00 0.00 61.69 61.83 1nje s THR 26 Cb 0.00 -3.24 -0.01 0.00 0.01 0.00 0.00 72.50 69.26 1nje s THR 26 CO 0.00 0.32 0.62 0.61 -0.69 0.00 0.00 174.62 175.48 1nje n GLY 27 N 4.76 -1.35 3.21 4.40 0.00 -1.26 -4.60 105.19 110.34 1nje n GLY 27 Ca -0.15 -0.44 -0.12 0.00 0.00 0.00 0.00 46.02 45.30 1nje n GLY 27 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nje s THR 28 N -1.99 0.83 -0.19 2.61 -4.23 -0.36 -0.94 115.64 111.36 1nje s THR 28 Ca 0.66 -1.98 -0.03 0.00 -1.18 0.00 0.00 61.69 59.15 1nje s THR 28 Cb -0.32 -1.81 -0.01 0.00 1.34 0.00 0.00 72.50 71.69 1nje s THR 28 CO 0.58 -0.77 -0.05 -0.31 -0.54 0.00 0.00 174.62 173.53 1nje s TYR 29 N -3.54 2.95 0.08 3.99 2.02 -0.19 -0.51 117.35 122.14 1nje s TYR 29 Ca 0.15 -0.75 0.05 0.00 -0.37 0.00 0.00 57.07 56.15 1nje s TYR 29 Cb 0.05 -2.04 -0.03 0.00 -0.40 0.00 0.00 41.96 39.54 1nje s TYR 29 CO -0.02 -0.39 -0.14 0.45 -1.57 0.00 0.00 175.55 173.88 1nje s SER 30 N 1.09 1.73 0.10 2.29 0.15 0.42 -1.28 113.70 118.19 1nje s SER 30 Ca 0.01 -0.65 0.03 0.00 0.70 0.00 0.00 55.95 56.04 1nje s SER 30 Cb -0.15 -0.05 -0.04 0.00 -1.71 0.00 0.00 66.02 64.07 1nje s SER 30 CO -0.00 -0.09 -0.09 0.27 1.20 0.00 0.00 173.24 174.53 1nje s ILE 31 N -1.42 0.89 -0.10 6.45 -4.36 -0.89 -2.22 121.20 119.55 1nje s ILE 31 Ca -0.00 -1.77 -0.00 0.00 -0.26 0.00 0.00 60.65 58.62 1nje s ILE 31 Cb -0.09 -1.50 0.02 0.00 1.25 0.00 0.00 42.46 42.14 1nje s ILE 31 CO 0.02 -0.67 -0.08 0.12 0.24 0.00 0.00 174.94 174.58 1nje s PHE 32 N -2.87 1.40 0.00 1.37 5.36 -1.26 -1.68 117.98 120.30 1nje s PHE 32 Ca 0.08 -0.65 0.00 0.00 -0.96 0.00 0.00 56.93 55.40 1nje s PHE 32 Cb -0.00 -1.16 0.00 0.00 -0.34 0.00 0.00 43.02 41.52 1nje s PHE 32 CO -0.01 -0.46 0.00 0.41 -1.46 0.00 0.00 175.22 173.70 1nje n GLY 33 N 4.76 -1.55 3.45 13.12 0.00 0.44 -5.00 105.19 120.41 1nje n GLY 33 Ca -0.14 -0.78 -0.11 0.00 0.00 0.00 0.00 46.02 44.99 1nje n GLY 33 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1nje s HIS 34 N 0.00 -0.49 -0.09 1.61 5.04 -0.92 -4.96 115.29 115.48 1nje s HIS 34 Ca 0.00 0.33 -0.12 0.00 -1.54 0.00 0.00 55.06 53.73 1nje s HIS 34 Cb 0.00 0.55 0.03 0.00 0.04 0.00 0.00 32.58 33.20 1nje s HIS 34 CO 0.00 -0.75 0.31 -1.14 -2.34 0.00 0.00 174.74 170.82 1nje s GLN 35 N -3.46 0.44 0.05 2.88 0.74 -1.26 -0.44 119.66 118.61 1nje s GLN 35 Ca 0.02 0.29 0.03 0.00 0.05 0.00 0.00 55.36 55.75 1nje s GLN 35 Cb -0.01 0.21 -0.02 0.00 1.10 0.00 0.00 33.01 34.28 1nje s GLN 35 CO -0.11 -0.08 -0.11 -1.64 -0.55 0.00 0.00 175.29 172.81 1nje s MET 36 N -0.19 0.68 -0.06 1.67 -1.94 0.68 -4.96 119.30 115.18 1nje s MET 36 Ca -0.03 -0.76 0.03 0.00 -1.71 0.00 0.00 55.69 53.22 1nje s MET 36 Cb -0.03 -0.58 0.01 0.00 2.01 0.00 0.00 34.83 36.23 1nje s MET 36 CO 0.01 0.13 -0.15 0.50 -0.01 0.00 0.00 175.02 175.50 1nje s ARG 37 N -1.40 1.89 -0.08 2.03 3.52 -1.26 0.01 118.95 123.66 1nje s ARG 37 Ca -0.04 -0.54 0.02 0.00 -0.13 0.00 0.00 55.73 55.04 1nje s ARG 37 Cb -0.09 -1.56 0.01 0.00 -1.56 0.00 0.00 34.95 31.75 1nje s ARG 37 CO 0.01 0.13 -0.15 -0.06 -0.81 0.00 0.00 175.30 174.42 1nje s PHE 38 N 0.39 1.79 -0.50 5.12 0.40 0.63 -4.93 117.98 120.88 1nje s PHE 38 Ca -0.11 -0.73 -0.22 0.00 -0.60 0.00 0.00 56.93 55.26 1nje s PHE 38 Cb -0.14 -1.28 0.04 0.00 0.51 0.00 0.00 43.02 42.15 1nje s PHE 38 CO 0.04 -0.36 0.78 0.34 0.70 0.00 0.00 175.22 176.72 1nje s ASP 39 N 0.72 6.32 0.00 1.36 -1.08 -1.26 -1.05 116.67 121.68 1nje s ASP 39 Ca -0.13 -0.44 0.15 0.00 -0.52 0.00 0.00 52.55 51.61 1nje s ASP 39 Cb -0.16 -2.37 0.86 0.00 -1.46 0.00 0.00 42.92 39.80 1nje s ASP 39 CO 0.03 -1.00 1.29 0.18 0.52 0.00 0.00 175.17 176.19 1nje n LEU 40 N 6.77 0.00 0.01 -1.34 4.77 -0.50 -1.66 117.00 125.05 1nje n LEU 40 Ca -0.01 0.01 0.11 0.00 -0.03 0.00 0.00 56.01 56.10 1nje n LEU 40 Cb 0.47 -0.01 0.09 0.00 -2.33 0.00 0.00 43.42 41.64 1nje n LEU 40 CO 0.59 -0.01 0.21 -1.54 -1.33 0.00 0.00 177.39 175.31 1nje n SER 41 N -1.01 0.68 0.02 -1.43 3.41 -1.26 -3.94 113.62 110.09 1nje n SER 41 Ca 0.11 -0.47 -0.08 0.00 -0.26 0.00 0.00 58.87 58.17 1nje n SER 41 Cb 0.05 0.59 -0.13 0.00 -0.26 0.00 0.00 64.21 64.46 1nje n SER 41 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1nje h LYS 42 N 0.00 0.00 0.00 4.33 1.79 -1.70 -3.50 116.57 117.50 1nje h LYS 42 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1nje h LYS 42 Cb 0.55 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.20 1nje h LYS 42 CO 0.00 0.75 0.00 0.41 -1.08 0.00 0.00 179.45 179.53 1nje n GLY 43 N 1.45 1.55 3.67 3.86 0.00 -1.25 -4.88 105.19 109.59 1nje n GLY 43 Ca -0.08 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.35 1nje n GLY 43 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1nje s PHE 44 N -1.99 3.40 0.00 1.61 5.36 -0.50 -4.57 117.98 121.29 1nje s PHE 44 Ca 0.00 1.39 -0.02 0.00 -0.96 0.00 0.00 56.93 57.35 1nje s PHE 44 Cb 0.00 -3.15 -0.09 0.00 -0.34 0.00 0.00 43.02 39.44 1nje s PHE 44 CO 0.00 -0.35 1.55 -0.35 -1.46 0.00 0.00 175.22 174.62 1nje n PRO 45 N 5.68 0.71 -3.15 10.12 -0.04 -1.26 -3.75 135.00 143.32 1nje n PRO 45 Ca 0.08 -0.32 -0.41 0.00 -0.04 0.00 0.00 63.50 62.81 1nje n PRO 45 Cb 0.48 -1.62 -0.07 0.00 -0.04 0.00 0.00 33.50 32.25 1nje n PRO 45 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1nje s LEU 46 N 0.00 4.20 0.09 1.53 2.96 -1.26 -4.52 118.68 121.67 1nje s LEU 46 Ca 0.21 0.29 -0.36 0.00 -0.22 0.00 0.00 54.13 54.05 1nje s LEU 46 Cb 0.10 -2.75 -0.17 0.00 0.50 0.00 0.00 46.19 43.87 1nje s LEU 46 CO 0.00 -0.49 1.19 0.18 -1.32 0.00 0.00 176.35 175.91 1nje n LEU 47 N 5.87 1.07 0.02 -0.68 4.77 -1.26 -4.70 117.00 122.09 1nje n LEU 47 Ca -0.02 1.14 0.11 0.00 -0.03 0.00 0.00 56.01 57.21 1nje n LEU 47 Cb 0.49 -1.12 -0.11 0.00 -2.33 0.00 0.00 43.42 40.35 1nje n LEU 47 CO 0.46 -1.42 -0.47 0.35 -1.33 0.00 0.00 177.39 174.99 1nje n THR 48 N 1.89 0.16 1.60 -5.08 -2.24 -1.26 -4.30 114.28 105.06 1nje n THR 48 Ca 0.18 -0.46 0.02 0.00 -2.27 0.00 0.00 64.05 61.53 1nje n THR 48 Cb 0.18 0.00 0.13 0.00 -2.10 0.00 0.00 70.33 68.55 1nje n THR 48 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1nje n THR 49 N -2.28 0.00 0.00 4.28 -2.24 -1.26 -0.88 114.28 111.90 1nje n THR 49 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1nje n THR 49 Cb 0.54 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 1nje n THR 49 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1nje n LYS 50 N -0.59 0.00 -1.68 -0.78 -0.00 -1.26 -4.75 118.16 109.11 1nje n LYS 50 Ca 0.03 0.00 -0.44 0.00 -0.00 0.00 0.00 58.31 57.90 1nje n LYS 50 Cb 0.02 0.00 -0.04 0.00 -0.00 0.00 0.00 35.03 35.01 1nje n LYS 50 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1nje n LYS 51 N 0.00 2.58 -5.23 -1.58 4.81 -1.03 -4.74 118.16 112.97 1nje n LYS 51 Ca 0.00 0.94 -0.31 0.00 -0.87 0.00 0.00 58.31 58.07 1nje n LYS 51 Cb 0.00 -2.83 -0.17 0.00 0.02 0.00 0.00 35.03 32.05 1nje n LYS 51 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1nje s VAL 52 N 3.50 2.02 -0.67 3.15 1.01 -1.26 -4.64 120.40 123.52 1nje s VAL 52 Ca 0.87 -1.03 -0.27 0.00 0.00 0.00 0.00 61.98 61.55 1nje s VAL 52 Cb -0.55 -1.72 -0.00 0.00 0.00 0.00 0.00 36.38 34.11 1nje s VAL 52 CO 0.43 0.56 1.63 -2.84 0.00 0.00 0.00 175.10 174.88 1nje s PRO 53 N 0.03 2.85 0.21 2.72 0.02 -1.26 -4.89 135.00 134.67 1nje s PRO 53 Ca -0.09 0.27 -0.10 0.00 0.02 0.00 0.00 61.00 61.09 1nje s PRO 53 Cb -0.15 -4.32 0.15 0.00 0.02 0.00 0.00 34.50 30.20 1nje s PRO 53 CO 0.05 -2.51 1.86 0.35 -0.33 0.00 0.00 177.00 176.42 1nje h PHE 54 N 13.01 0.96 -0.84 6.54 3.57 -2.00 -2.70 116.94 135.47 1nje h PHE 54 Ca -0.26 0.01 0.21 0.00 3.53 0.00 0.00 57.97 61.46 1nje h PHE 54 Cb 1.12 -0.32 -0.14 0.00 2.79 0.00 0.00 35.95 39.40 1nje h PHE 54 CO 1.08 0.63 0.13 0.78 -2.23 0.00 0.00 178.31 178.70 1nje h GLY 55 N 1.01 1.16 1.34 2.40 0.00 -1.99 0.39 103.07 107.37 1nje h GLY 55 Ca 0.27 0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.60 1nje h GLY 55 CO -0.05 -0.35 0.23 1.41 0.00 0.00 0.00 176.54 177.78 1nje h LEU 56 N 0.15 0.78 0.09 3.11 3.38 -1.87 -1.44 115.31 119.51 1nje h LEU 56 Ca 0.50 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.37 1nje h LEU 56 Cb 0.98 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1nje h LEU 56 CO -0.68 0.70 -0.04 0.40 0.09 0.00 0.00 178.44 178.90 1nje h ILE 57 N 0.84 1.16 0.19 1.22 2.04 -0.38 -2.32 117.51 120.26 1nje h ILE 57 Ca 0.20 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 65.01 1nje h ILE 57 Cb 0.17 1.82 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 1nje h ILE 57 CO -0.02 0.25 -0.18 0.50 0.00 0.00 0.00 178.15 178.70 1nje h LYS 58 N -0.61 -0.38 0.00 2.37 3.64 -0.64 0.69 116.57 121.64 1nje h LYS 58 Ca -0.01 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1nje h LYS 58 Cb 0.50 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 1nje h LYS 58 CO 0.02 -0.25 -0.05 0.66 -2.27 0.00 0.00 179.45 177.55 1nje h SER 59 N -0.40 -0.14 -0.58 4.20 4.64 -1.37 -2.26 113.55 117.64 1nje h SER 59 Ca 0.00 0.02 0.09 0.00 -0.47 0.00 0.00 61.79 61.43 1nje h SER 59 Cb 0.37 0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 62.45 1nje h SER 59 CO -0.04 -0.08 0.21 -0.08 -0.87 0.00 0.00 176.83 175.97 1nje h GLU 60 N -0.09 0.38 -0.32 4.77 4.81 -1.19 -0.17 114.58 122.77 1nje h GLU 60 Ca 0.02 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1nje h GLU 60 Cb 0.12 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 1nje h GLU 60 CO -0.05 0.25 0.16 1.25 -0.73 0.00 0.00 179.01 179.89 1nje h LEU 61 N 0.39 0.41 -0.64 1.64 5.85 -0.70 -1.39 115.31 120.86 1nje h LEU 61 Ca 0.29 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.92 1nje h LEU 61 Cb 0.35 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 1nje h LEU 61 CO -0.30 0.40 0.41 -0.07 -0.34 0.00 0.00 178.44 178.54 1nje h LEU 62 N 0.39 0.69 -0.70 2.25 3.38 -0.79 0.02 115.31 120.54 1nje h LEU 62 Ca 0.11 -0.01 0.12 0.00 0.09 0.00 0.00 57.88 58.19 1nje h LEU 62 Cb 0.09 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 40.60 1nje h LEU 62 CO -0.02 0.49 0.29 -0.25 0.09 0.00 0.00 178.44 179.05 1nje h TRP 63 N 0.82 0.51 0.66 1.13 7.01 -0.66 -0.65 115.95 124.77 1nje h TRP 63 Ca 0.25 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.25 1nje h TRP 63 Cb -0.03 -0.12 0.01 0.00 -2.10 0.00 0.00 29.16 26.92 1nje h TRP 63 CO -0.04 0.11 -0.32 0.74 -2.79 0.00 0.00 178.44 176.15 1nje h PHE 64 N 0.47 -0.82 -1.04 2.65 0.04 0.07 -2.93 116.94 115.38 1nje h PHE 64 Ca 0.37 -0.02 0.31 0.00 2.80 0.00 0.00 57.97 61.43 1nje h PHE 64 Cb 0.49 0.27 -0.14 0.00 2.20 0.00 0.00 35.95 38.78 1nje h PHE 64 CO -0.15 -0.51 0.62 -0.07 -0.60 0.00 0.00 178.31 177.60 1nje h LEU 65 N -0.90 0.50 -1.99 1.54 3.38 -0.81 0.55 115.31 117.57 1nje h LEU 65 Ca -0.09 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1nje h LEU 65 Cb 0.68 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1nje h LEU 65 CO 0.15 -0.07 0.00 0.45 0.09 0.00 0.00 178.44 179.06 1nje h HIS 66 N 0.35 0.00 0.00 1.13 3.86 -1.08 -3.46 115.15 115.95 1nje h HIS 66 Ca 0.71 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.92 1nje h HIS 66 Cb 1.68 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.15 1nje h HIS 66 CO -0.01 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.19 1nje n GLY 67 N -0.77 0.54 3.79 2.45 0.00 0.19 -5.02 105.19 106.37 1nje n GLY 67 Ca -0.01 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 1nje n GLY 67 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1nje s ASP 68 N -2.48 6.11 0.00 1.61 -1.08 -1.11 -4.43 116.67 115.28 1nje s ASP 68 Ca 0.00 2.03 0.00 0.00 -0.52 0.00 0.00 52.55 54.06 1nje s ASP 68 Cb 0.00 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 38.89 1nje s ASP 68 CO 0.00 -0.94 0.55 0.35 0.52 0.00 0.00 175.17 175.64 1nje n THR 69 N -1.08 0.19 -3.96 1.71 -2.24 -1.26 -4.16 114.28 103.48 1nje n THR 69 Ca 0.10 -0.21 -0.35 0.00 -2.27 0.00 0.00 64.05 61.32 1nje n THR 69 Cb 0.52 1.00 -0.12 0.00 -2.10 0.00 0.00 70.33 69.63 1nje n THR 69 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1nje s ASN 70 N -0.19 5.02 0.38 3.42 3.84 -1.26 -0.34 114.94 125.81 1nje s ASN 70 Ca 0.00 -0.17 0.15 0.00 0.21 0.00 0.00 52.86 53.05 1nje s ASN 70 Cb 0.00 -1.87 1.02 0.00 -0.55 0.00 0.00 41.25 39.85 1nje s ASN 70 CO 0.00 0.04 1.78 0.40 -2.79 0.00 0.00 177.10 176.53 1nje h ILE 71 N 5.38 0.58 -0.94 -5.21 1.08 -0.66 -3.00 117.51 114.74 1nje h ILE 71 Ca -0.37 -0.16 0.18 0.00 -0.39 0.00 0.00 64.86 64.11 1nje h ILE 71 Cb 1.18 0.06 -0.17 0.00 -3.07 0.00 0.00 36.82 34.82 1nje h ILE 71 CO 0.61 0.09 -0.28 -0.09 -0.69 0.00 0.00 178.15 177.78 1nje h ARG 72 N 0.48 -0.01 -0.42 2.37 2.43 -1.89 -0.68 114.38 116.66 1nje h ARG 72 Ca 0.58 0.00 0.08 0.00 -0.81 0.00 0.00 59.98 59.83 1nje h ARG 72 Cb 1.33 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.81 1nje h ARG 72 CO -0.31 -0.01 -0.01 0.35 -1.51 0.00 0.00 179.97 178.49 1nje h PHE 73 N -0.01 -0.03 0.24 2.20 3.04 -1.92 -0.94 116.94 119.51 1nje h PHE 73 Ca 0.41 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.38 1nje h PHE 73 Cb 0.66 0.08 0.00 0.00 2.56 0.00 0.00 35.95 39.25 1nje h PHE 73 CO -0.77 -0.09 -0.12 -0.07 -2.02 0.00 0.00 178.31 175.25 1nje h LEU 74 N 0.10 -0.27 -0.97 0.59 3.38 -1.33 -2.39 115.31 114.42 1nje h LEU 74 Ca 0.21 -0.01 0.12 0.00 0.09 0.00 0.00 57.88 58.29 1nje h LEU 74 Cb 0.30 0.07 -0.09 0.00 0.09 0.00 0.00 40.66 41.03 1nje h LEU 74 CO -0.35 -0.17 0.59 -0.07 0.09 0.00 0.00 178.44 178.54 1nje h LEU 75 N -0.35 0.86 -0.59 1.67 3.38 -1.21 0.45 115.31 119.52 1nje h LEU 75 Ca -0.03 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1nje h LEU 75 Cb 0.27 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1nje h LEU 75 CO 0.05 0.44 0.01 1.67 0.09 0.00 0.00 178.44 180.71 1nje n GLN 76 N -4.66 0.06 -0.39 1.13 7.27 -0.38 0.10 117.38 120.50 1nje n GLN 76 Ca 0.18 0.55 0.07 0.00 0.07 0.00 0.00 57.00 57.87 1nje n GLN 76 Cb 0.36 -1.70 0.12 0.00 2.41 0.00 0.00 30.24 31.44 1nje n GLN 76 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1nje n HIS 77 N -1.81 0.00 -1.79 3.69 8.25 0.13 -4.98 115.22 118.71 1nje n HIS 77 Ca -0.01 -0.90 -0.20 0.00 -0.26 0.00 0.00 57.72 56.35 1nje n HIS 77 Cb 0.02 -0.16 -0.07 0.00 1.12 0.00 0.00 29.99 30.91 1nje n HIS 77 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1nje n ARG 78 N -0.95 -1.47 -3.30 -0.41 1.74 0.11 -4.94 116.66 107.44 1nje n ARG 78 Ca 0.13 1.16 -0.43 0.00 -0.77 0.00 0.00 57.85 57.94 1nje n ARG 78 Cb 0.70 -5.59 -0.08 0.00 -1.02 0.00 0.00 32.46 26.47 1nje n ARG 78 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1nje s ASN 79 N -2.61 6.20 -0.03 0.55 3.84 0.61 -4.91 114.94 118.59 1nje s ASN 79 Ca 0.00 -0.71 0.16 0.00 0.21 0.00 0.00 52.86 52.52 1nje s ASN 79 Cb 0.00 -2.23 0.50 0.00 -0.55 0.00 0.00 41.25 38.97 1nje s ASN 79 CO 0.00 -0.61 1.42 1.41 -2.79 0.00 0.00 177.10 176.52 1nje n HIS 80 N 5.64 0.83 -0.14 0.43 8.25 -1.26 -3.14 115.22 125.84 1nje n HIS 80 Ca -0.07 -0.55 -0.04 0.00 -0.26 0.00 0.00 57.72 56.80 1nje n HIS 80 Cb 0.47 -0.08 0.02 0.00 1.12 0.00 0.00 29.99 31.53 1nje n HIS 80 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1nje h ILE 81 N 3.03 0.52 -0.00 1.59 2.04 -1.97 -2.87 117.51 119.84 1nje h ILE 81 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1nje h ILE 81 Cb 0.99 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1nje h ILE 81 CO 0.06 0.00 -0.10 0.79 0.00 0.00 0.00 178.15 178.90 1nje n TRP 82 N -5.35 0.00 -0.26 1.37 7.02 -1.26 -4.50 117.44 114.47 1nje n TRP 82 Ca 0.03 0.00 -0.04 0.00 -1.02 0.00 0.00 57.50 56.47 1nje n TRP 82 Cb 0.25 -0.18 0.01 0.00 -2.42 0.00 0.00 31.31 28.97 1nje n TRP 82 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1nje h ASP 83 N 0.53 -1.28 -1.42 -0.99 3.32 -1.83 -2.58 116.42 112.17 1nje h ASP 83 Ca 0.00 0.26 0.47 0.00 0.02 0.00 0.00 57.03 57.77 1nje h ASP 83 Cb 0.34 0.64 -0.13 0.00 0.22 0.00 0.00 39.33 40.41 1nje h ASP 83 CO 0.00 -0.30 0.93 -0.08 -1.72 0.00 0.00 179.24 178.07 1nje h GLU 84 N -0.12 0.04 0.24 3.56 4.22 -1.82 0.54 114.58 121.25 1nje h GLU 84 Ca 0.26 -0.00 -0.34 0.00 0.08 0.00 0.00 59.36 59.36 1nje h GLU 84 Cb 0.56 -0.01 0.03 0.00 0.50 0.00 0.00 28.75 29.84 1nje h GLU 84 CO -0.78 0.03 -1.50 -1.49 -2.18 0.00 0.00 179.01 173.09 1nje h TRP 85 N 0.04 0.92 0.00 0.92 4.06 -1.81 -1.82 115.95 118.25 1nje h TRP 85 Ca 0.86 -0.67 -0.10 0.00 2.06 0.00 0.00 58.89 61.03 1nje h TRP 85 Cb 2.81 -0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 30.92 1nje h TRP 85 CO -0.00 1.55 -0.49 0.00 -3.56 0.00 0.00 178.44 175.94 1nje h ALA 86 N 0.19 1.11 0.05 1.49 0.00 -1.05 -2.54 119.26 118.51 1nje h ALA 86 Ca -0.26 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.20 1nje h ALA 86 Cb 2.15 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.86 1nje h ALA 86 CO 0.26 0.61 -0.02 0.35 0.00 0.00 0.00 179.25 180.45 1nje h PHE 87 N 0.00 -0.06 -0.98 0.00 3.57 -1.14 -2.81 116.94 115.51 1nje h PHE 87 Ca -0.00 -0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.72 1nje h PHE 87 Cb 0.91 0.02 -0.12 0.00 2.79 0.00 0.00 35.95 39.55 1nje h PHE 87 CO 0.00 0.52 0.57 1.49 -2.23 0.00 0.00 178.31 178.65 1nje h GLU 88 N -0.71 0.58 0.14 1.11 4.81 -1.23 0.11 114.58 119.39 1nje h GLU 88 Ca -0.01 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1nje h GLU 88 Cb 0.61 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1nje h GLU 88 CO 0.01 0.38 -0.07 -0.22 -0.73 0.00 0.00 179.01 178.39 1nje h LYS 89 N 0.60 -0.18 -0.75 1.92 3.64 -1.47 -2.66 116.57 117.67 1nje h LYS 89 Ca 0.61 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.95 1nje h LYS 89 Cb 1.12 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.95 1nje h LYS 89 CO -0.46 0.11 0.24 2.35 -2.27 0.00 0.00 179.45 179.43 1nje h TRP 90 N -0.47 1.19 -0.02 1.91 7.01 -1.02 -2.14 115.95 122.41 1nje h TRP 90 Ca -0.02 -0.12 0.01 0.00 2.11 0.00 0.00 58.89 60.87 1nje h TRP 90 Cb 0.37 -0.35 -0.00 0.00 -2.10 0.00 0.00 29.16 27.08 1nje h TRP 90 CO 0.02 0.94 0.02 0.28 -2.79 0.00 0.00 178.44 176.90 1nje h VAL 91 N 1.11 0.86 0.00 2.65 2.07 -0.79 -0.04 116.25 122.11 1nje h VAL 91 Ca 0.24 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.64 1nje h VAL 91 Cb 0.29 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 1nje h VAL 91 CO -0.01 0.00 -0.88 0.11 0.02 0.00 0.00 177.57 176.81 1nje h LYS 92 N 0.00 0.00 -6.73 1.57 6.56 -1.10 -3.46 116.57 113.40 1nje h LYS 92 Ca 0.01 0.00 -0.54 0.00 -1.06 0.00 0.00 60.65 59.06 1nje h LYS 92 Cb 0.04 0.00 0.08 0.00 -0.57 0.00 0.00 32.23 31.78 1nje h LYS 92 CO -0.00 0.37 0.87 0.45 -2.06 0.00 0.00 179.45 179.09 1nje n SER 93 N -3.05 3.74 0.20 0.86 2.88 -0.03 -4.88 113.62 113.34 1nje n SER 93 Ca -0.03 1.13 0.16 0.00 -1.33 0.00 0.00 58.87 58.80 1nje n SER 93 Cb 0.76 -1.57 0.80 0.00 -0.75 0.00 0.00 64.21 63.45 1nje n SER 93 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 1nje h ASP 94 N 5.15 0.00 0.41 -3.46 3.04 -1.90 0.11 116.42 119.77 1nje h ASP 94 Ca -0.46 0.00 -0.03 0.00 -3.24 0.00 0.00 57.03 53.30 1nje h ASP 94 Cb 1.23 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.51 1nje h ASP 94 CO 0.82 0.00 -0.16 -0.33 -2.04 0.00 0.00 179.24 177.53 1nje h GLU 95 N 0.00 0.00 -6.53 4.15 5.08 -1.89 -3.42 114.58 111.97 1nje h GLU 95 Ca 0.08 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.91 1nje h GLU 95 Cb 0.42 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.69 1nje h GLU 95 CO -0.00 0.16 0.78 -0.47 -1.00 0.00 0.00 179.01 178.48 1nje s TYR 96 N -4.18 3.11 -0.38 4.33 5.04 0.39 -4.96 117.35 120.71 1nje s TYR 96 Ca -0.03 0.84 0.02 0.00 -2.44 0.00 0.00 57.07 55.47 1nje s TYR 96 Cb 0.13 -3.74 0.15 0.00 0.35 0.00 0.00 41.96 38.86 1nje s TYR 96 CO 0.61 -2.65 0.29 -1.01 -1.34 0.00 0.00 175.55 171.45 1nje s HIS 97 N 1.37 0.76 0.00 4.97 3.76 -1.26 -4.97 115.29 119.91 1nje s HIS 97 Ca 0.66 -1.85 0.00 0.00 -0.15 0.00 0.00 55.06 53.72 1nje s HIS 97 Cb -0.37 -0.85 0.00 0.00 1.11 0.00 0.00 32.58 32.47 1nje s HIS 97 CO 0.30 -0.85 0.00 0.41 -0.85 0.00 0.00 174.74 173.75 1nje n GLY 98 N 3.52 2.78 3.52 -2.22 0.00 -1.26 -5.17 105.19 106.36 1nje n GLY 98 Ca 0.20 -0.81 -0.38 0.00 0.00 0.00 0.00 46.02 45.03 1nje n GLY 98 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1nje n PRO 99 N 0.00 0.66 -0.26 1.61 -0.02 -1.26 -4.88 135.00 130.85 1nje n PRO 99 Ca 0.00 0.26 0.13 0.00 -2.02 0.00 0.00 63.50 61.87 1nje n PRO 99 Cb 0.00 -1.85 0.25 0.00 -0.02 0.00 0.00 33.50 31.88 1nje n PRO 99 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1nje n ASP 100 N 0.10 -0.04 0.00 2.55 -0.08 -1.26 -4.79 116.55 113.03 1nje n ASP 100 Ca 0.12 1.28 0.00 0.00 -1.51 0.00 0.00 54.79 54.69 1nje n ASP 100 Cb 0.47 -0.49 0.00 0.00 2.34 0.00 0.00 41.12 43.44 1nje n ASP 100 CO 0.00 0.00 0.00 0.23 0.12 0.00 0.00 177.20 177.55 1nje n MET 101 N -5.01 -0.04 -1.98 -0.67 2.81 -1.26 -4.92 117.12 106.05 1nje n MET 101 Ca 0.19 0.01 -0.40 0.00 -1.81 0.00 0.00 57.70 55.69 1nje n MET 101 Cb 0.64 -3.01 0.00 0.00 -0.71 0.00 0.00 33.22 30.14 1nje n MET 101 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1nje s THR 102 N -0.57 2.46 -0.92 2.03 -4.23 -1.26 -2.64 115.64 110.51 1nje s THR 102 Ca 0.00 0.42 0.00 0.00 -1.18 0.00 0.00 61.69 60.93 1nje s THR 102 Cb 0.00 -3.25 0.00 0.00 1.34 0.00 0.00 72.50 70.59 1nje s THR 102 CO 0.00 0.06 0.00 -0.67 -0.54 0.00 0.00 174.62 173.47 1nje n ASP 103 N 0.07 -3.14 -0.67 3.99 2.03 -1.26 -4.75 116.55 112.82 1nje n ASP 103 Ca 0.04 0.25 0.51 0.00 0.52 0.00 0.00 54.79 56.11 1nje n ASP 103 Cb 0.43 -2.79 0.81 0.00 -0.72 0.00 0.00 41.12 38.84 1nje n ASP 103 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 1nje h PHE 104 N 0.00 0.07 -0.17 -0.67 -0.00 -1.91 0.31 116.94 114.57 1nje h PHE 104 Ca -0.23 0.00 -0.04 0.00 -0.00 0.00 0.00 57.97 57.71 1nje h PHE 104 Cb 1.02 -0.02 -0.00 0.00 -0.00 0.00 0.00 35.95 36.95 1nje h PHE 104 CO 0.60 -0.04 -0.05 0.78 -0.00 0.00 0.00 178.31 179.61 1nje h GLY 105 N 0.00 0.35 0.44 6.09 0.00 -1.89 0.35 103.07 108.42 1nje h GLY 105 Ca 0.92 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.95 1nje h GLY 105 CO -0.07 0.27 -0.06 0.45 0.00 0.00 0.00 176.54 177.13 1nje h HIS 106 N 0.03 -0.15 -0.71 5.60 3.86 -0.71 -3.03 115.15 120.03 1nje h HIS 106 Ca 0.04 -0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.31 1nje h HIS 106 Cb 0.49 0.05 -0.04 0.00 1.06 0.00 0.00 27.41 28.96 1nje h HIS 106 CO 0.05 0.31 0.47 -0.09 0.86 0.00 0.00 177.93 179.54 1nje h ARG 107 N -0.72 0.72 -0.12 2.45 2.43 -1.19 -2.02 114.38 115.92 1nje h ARG 107 Ca -0.02 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 58.99 1nje h ARG 107 Cb 0.53 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1nje h ARG 107 CO 0.03 0.47 -0.38 0.66 -1.51 0.00 0.00 179.97 179.24 1nje h SER 108 N 0.74 0.54 -0.05 -3.80 4.64 -0.99 -2.48 113.55 112.15 1nje h SER 108 Ca 0.31 -0.61 0.01 0.00 -0.47 0.00 0.00 61.79 61.04 1nje h SER 108 Cb 0.26 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1nje h SER 108 CO -0.10 1.05 0.04 -0.61 -0.87 0.00 0.00 176.83 176.34 1nje h GLN 109 N 0.06 0.00 -0.37 4.77 4.15 -1.31 -1.80 115.11 120.60 1nje h GLN 109 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1nje h GLN 109 Cb 1.01 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.70 1nje h GLN 109 CO 0.08 0.00 0.00 1.63 -1.93 0.00 0.00 178.83 178.61 1nje n LYS 110 N -4.30 3.34 -3.19 1.69 4.76 -0.81 -4.89 118.16 114.77 1nje n LYS 110 Ca -0.02 -2.78 0.01 0.00 -2.87 0.00 0.00 58.31 52.65 1nje n LYS 110 Cb 0.14 -1.83 -0.02 0.00 -1.84 0.00 0.00 35.03 31.48 1nje n LYS 110 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1nje s ASP 111 N -1.48 -1.12 0.31 4.39 2.15 -0.68 -5.02 116.67 115.22 1nje s ASP 111 Ca 0.42 0.52 0.03 0.00 0.43 0.00 0.00 52.55 53.95 1nje s ASP 111 Cb 0.32 1.92 0.62 0.00 -0.30 0.00 0.00 42.92 45.48 1nje s ASP 111 CO 0.13 -0.28 1.86 1.55 -0.17 0.00 0.00 175.17 178.26 1nje h PRO 112 N 8.04 0.90 0.19 4.34 0.13 -1.88 0.00 132.00 143.72 1nje h PRO 112 Ca -0.16 -0.05 -0.31 0.00 -0.87 0.00 0.00 66.00 64.61 1nje h PRO 112 Cb 1.16 -0.20 0.02 0.00 0.13 0.00 0.00 31.00 32.11 1nje h PRO 112 CO 0.23 0.59 -1.42 1.49 -0.23 0.00 0.00 178.00 178.67 1nje h GLU 113 N 0.93 0.41 -0.54 0.86 4.57 -1.96 -3.14 114.58 115.70 1nje h GLU 113 Ca 0.46 -0.70 -0.04 0.00 -1.18 0.00 0.00 59.36 57.90 1nje h GLU 113 Cb 0.48 0.26 -0.02 0.00 -0.16 0.00 0.00 28.75 29.31 1nje h GLU 113 CO -0.22 1.33 0.20 0.35 -1.18 0.00 0.00 179.01 179.49 1nje h PHE 114 N 0.11 0.85 0.00 0.92 3.57 -1.78 -0.31 116.94 120.31 1nje h PHE 114 Ca -0.22 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.21 1nje h PHE 114 Cb 2.08 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 40.57 1nje h PHE 114 CO 0.10 0.70 0.04 0.00 -2.23 0.00 0.00 178.31 176.92 1nje h ALA 115 N 1.05 1.04 0.04 2.41 0.00 -1.09 0.05 119.26 122.77 1nje h ALA 115 Ca 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1nje h ALA 115 Cb 0.23 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.03 1nje h ALA 115 CO -0.01 -0.04 -0.31 0.00 0.00 0.00 0.00 179.25 178.90 1nje h ALA 116 N 1.91 -0.02 -0.74 0.00 0.00 -1.01 -2.57 119.26 116.83 1nje h ALA 116 Ca 0.00 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.36 1nje h ALA 116 Cb 0.08 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1nje h ALA 116 CO 0.00 0.13 0.45 0.28 0.00 0.00 0.00 179.25 180.11 1nje h VAL 117 N -0.68 1.21 0.57 0.00 2.07 -0.79 -2.44 116.25 116.19 1nje h VAL 117 Ca -0.05 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 1nje h VAL 117 Cb 1.18 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1nje h VAL 117 CO 0.06 0.22 -0.42 0.22 0.02 0.00 0.00 177.57 177.67 1nje h TYR 118 N 1.02 -1.12 0.00 1.57 3.20 -1.13 -1.13 116.97 119.38 1nje h TYR 118 Ca 0.27 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.12 1nje h TYR 118 Cb -0.04 0.41 -0.00 0.00 1.54 0.00 0.00 36.73 38.65 1nje h TYR 118 CO -0.01 -0.60 -0.08 0.45 -1.64 0.00 0.00 178.16 176.28 1nje h HIS 119 N -0.95 0.00 -0.09 -3.82 3.86 -1.36 0.35 115.15 113.14 1nje h HIS 119 Ca -0.07 0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 58.94 1nje h HIS 119 Cb 0.80 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.28 1nje h HIS 119 CO -0.15 0.08 -0.72 1.49 0.86 0.00 0.00 177.93 179.48 1nje h GLU 120 N 0.00 0.65 -0.26 2.45 4.57 -1.26 -2.27 114.58 118.45 1nje h GLU 120 Ca -0.00 -0.58 -0.07 0.00 -1.18 0.00 0.00 59.36 57.54 1nje h GLU 120 Cb 0.14 0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.85 1nje h GLU 120 CO 0.01 1.19 -0.12 1.49 -1.18 0.00 0.00 179.01 180.40 1nje h GLU 121 N 0.30 0.44 0.11 1.92 4.57 -0.54 -2.58 114.58 118.79 1nje h GLU 121 Ca -0.06 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 57.99 1nje h GLU 121 Cb 1.37 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.91 1nje h GLU 121 CO 0.15 0.56 -0.05 1.98 -1.18 0.00 0.00 179.01 180.47 1nje h MET 122 N 0.41 -0.14 -0.98 1.92 4.05 -0.94 -2.23 114.93 117.01 1nje h MET 122 Ca 0.08 0.01 0.16 0.00 -0.28 0.00 0.00 59.70 59.67 1nje h MET 122 Cb 0.46 0.03 -0.10 0.00 -0.80 0.00 0.00 31.60 31.20 1nje h MET 122 CO 0.03 0.30 0.59 0.00 0.23 0.00 0.00 176.91 178.06 1nje h ALA 123 N 0.16 1.56 0.37 0.39 0.00 -1.33 0.14 119.26 120.54 1nje h ALA 123 Ca -0.01 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1nje h ALA 123 Cb 0.50 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1nje h ALA 123 CO 0.02 0.02 -0.31 -0.22 0.00 0.00 0.00 179.25 178.77 1nje h LYS 124 N 0.81 -0.64 -0.53 0.00 1.63 -1.44 -2.07 116.57 114.33 1nje h LYS 124 Ca 0.54 0.04 0.11 0.00 -0.85 0.00 0.00 60.65 60.49 1nje h LYS 124 Cb 0.74 0.15 -0.10 0.00 -0.60 0.00 0.00 32.23 32.42 1nje h LYS 124 CO -0.35 -0.43 -0.15 0.35 -3.45 0.00 0.00 179.45 175.43 1nje h PHE 125 N -0.66 -0.32 -0.80 1.91 3.57 -0.61 0.02 116.94 120.03 1nje h PHE 125 Ca -0.05 0.05 0.06 0.00 3.53 0.00 0.00 57.97 61.56 1nje h PHE 125 Cb 0.56 0.23 -0.05 0.00 2.79 0.00 0.00 35.95 39.48 1nje h PHE 125 CO -0.13 -0.24 0.53 -0.44 -2.23 0.00 0.00 178.31 175.79 1nje h ASP 126 N -0.02 0.79 -0.26 0.41 3.32 -0.71 0.15 116.42 120.10 1nje h ASP 126 Ca 0.26 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.16 1nje h ASP 126 Cb 0.41 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 1nje h ASP 126 CO -0.56 0.51 -0.42 -0.78 -1.72 0.00 0.00 179.24 176.27 1nje h ASP 127 N 0.90 0.82 -0.16 6.45 3.58 -0.33 -1.87 116.42 125.82 1nje h ASP 127 Ca 0.34 -0.52 -0.02 0.00 0.42 0.00 0.00 57.03 57.24 1nje h ASP 127 Cb 0.20 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 1nje h ASP 127 CO -0.12 1.18 0.04 -0.09 -2.88 0.00 0.00 179.24 177.37 1nje h ARG 128 N 0.48 0.34 -0.29 0.28 1.12 -0.40 0.11 114.38 116.03 1nje h ARG 128 Ca 0.02 -0.05 -0.19 0.00 -1.11 0.00 0.00 59.98 58.65 1nje h ARG 128 Cb 1.02 -0.06 0.00 0.00 -0.01 0.00 0.00 29.97 30.92 1nje h ARG 128 CO 0.10 0.34 -0.56 0.28 -3.11 0.00 0.00 179.97 177.02 1nje h VAL 129 N 0.34 1.27 -0.03 0.20 2.07 -0.83 -0.09 116.25 119.18 1nje h VAL 129 Ca 0.08 -1.74 -0.12 0.00 0.82 0.00 0.00 66.70 65.74 1nje h VAL 129 Cb 0.17 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 1nje h VAL 129 CO -0.00 0.57 -0.55 -0.07 0.02 0.00 0.00 177.57 177.54 1nje h LEU 130 N 0.67 0.08 0.00 2.57 3.38 -0.43 -3.38 115.31 118.20 1nje h LEU 130 Ca 0.01 -0.04 -0.32 0.00 0.09 0.00 0.00 57.88 57.61 1nje h LEU 130 Cb 1.17 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.84 1nje h LEU 130 CO 0.12 0.62 -2.21 1.41 0.09 0.00 0.00 178.44 178.47 1nje n HIS 131 N -3.90 0.00 -2.82 1.13 8.25 0.30 -4.88 115.22 113.30 1nje n HIS 131 Ca -0.02 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.02 1nje n HIS 131 Cb 0.56 -0.81 -0.04 0.00 1.12 0.00 0.00 29.99 30.82 1nje n HIS 131 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1nje s ASP 132 N -6.14 6.24 0.26 0.41 -1.08 -0.05 -4.89 116.67 111.41 1nje s ASP 132 Ca -0.29 -0.68 -0.02 0.00 -0.52 0.00 0.00 52.55 51.04 1nje s ASP 132 Cb 0.08 -2.44 0.51 0.00 -1.46 0.00 0.00 42.92 39.61 1nje s ASP 132 CO 0.48 -1.39 1.74 0.44 0.52 0.00 0.00 175.17 176.96 1nje h ASP 133 N 9.50 0.36 -0.10 -0.34 5.19 -1.84 0.31 116.42 129.50 1nje h ASP 133 Ca -0.28 0.11 -0.17 0.00 -0.62 0.00 0.00 57.03 56.08 1nje h ASP 133 Cb 1.07 0.07 -0.00 0.00 0.18 0.00 0.00 39.33 40.64 1nje h ASP 133 CO 1.15 0.13 -0.52 0.00 -3.12 0.00 0.00 179.24 176.88 1nje h ALA 134 N 1.57 0.63 -0.23 3.45 0.00 -1.94 -2.00 119.26 120.74 1nje h ALA 134 Ca 0.44 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1nje h ALA 134 Cb 0.68 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1nje h ALA 134 CO -0.40 0.68 0.06 0.35 0.00 0.00 0.00 179.25 179.94 1nje h PHE 135 N 0.53 0.39 0.17 0.00 3.57 -1.33 -1.51 116.94 118.76 1nje h PHE 135 Ca 0.02 -0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 1nje h PHE 135 Cb 1.09 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.70 1nje h PHE 135 CO 0.05 0.46 -0.30 0.00 -2.23 0.00 0.00 178.31 176.30 1nje h ALA 136 N 0.88 -0.89 -1.22 2.41 0.00 -0.45 0.44 119.26 120.42 1nje h ALA 136 Ca 0.07 -0.09 0.35 0.00 0.00 0.00 0.00 54.91 55.25 1nje h ALA 136 Cb 0.27 0.63 -0.07 0.00 0.00 0.00 0.00 17.79 18.62 1nje h ALA 136 CO 0.00 -0.94 0.85 0.00 0.00 0.00 0.00 179.25 179.17 1nje h ALA 137 N -1.11 2.94 0.13 0.00 0.00 -1.30 1.27 119.26 121.19 1nje h ALA 137 Ca -0.02 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.54 1nje h ALA 137 Cb 0.47 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1nje h ALA 137 CO -0.11 -1.34 -1.82 -0.22 0.00 0.00 0.00 179.25 175.76 1nje h LYS 138 N 0.10 0.28 0.00 0.00 3.64 -0.05 -3.39 116.57 117.15 1nje h LYS 138 Ca 0.62 -0.47 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1nje h LYS 138 Cb 2.23 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 34.23 1nje h LYS 138 CO -0.11 1.16 -0.58 0.66 -2.27 0.00 0.00 179.45 178.32 1nje n TYR 139 N -3.47 0.00 1.58 1.91 4.01 0.14 -4.51 117.16 116.82 1nje n TYR 139 Ca -0.26 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.60 1nje n TYR 139 Cb 1.06 0.00 0.52 0.00 -0.31 0.00 0.00 39.34 40.61 1nje n TYR 139 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1nje n GLY 140 N 1.84 -0.27 3.26 2.72 0.00 0.43 -4.71 105.19 108.47 1nje n GLY 140 Ca 0.00 -0.32 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 1nje n GLY 140 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1nje s ASP 141 N -1.72 5.71 0.33 1.61 -1.08 -1.14 0.15 116.67 120.54 1nje s ASP 141 Ca 0.34 -1.61 0.08 0.00 -0.52 0.00 0.00 52.55 50.84 1nje s ASP 141 Cb 0.18 -2.02 0.58 0.00 -1.46 0.00 0.00 42.92 40.20 1nje s ASP 141 CO 0.28 -0.60 1.78 -0.07 0.52 0.00 0.00 175.17 177.08 1nje h LEU 142 N 8.46 0.23 0.00 -1.34 3.38 -0.96 -3.48 115.31 121.61 1nje h LEU 142 Ca -0.23 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1nje h LEU 142 Cb 1.08 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1nje h LEU 142 CO 0.80 0.54 0.00 0.61 0.09 0.00 0.00 178.44 180.49 1nje n GLY 143 N -0.44 2.29 3.33 0.83 0.00 -1.24 -4.72 105.19 105.24 1nje n GLY 143 Ca -0.01 -0.11 -0.47 0.00 0.00 0.00 0.00 46.02 45.43 1nje n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nje s LEU 144 N 0.00 6.75 0.11 0.99 1.43 -1.26 -4.62 118.68 122.07 1nje s LEU 144 Ca 0.00 -2.67 -0.07 0.00 -1.03 0.00 0.00 54.13 50.36 1nje s LEU 144 Cb 0.00 -2.21 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 1nje s LEU 144 CO 0.00 -0.58 0.17 0.54 0.23 0.00 0.00 176.35 176.71 1nje s VAL 145 N 0.20 0.13 0.24 -1.59 0.11 -1.26 -5.03 120.40 113.20 1nje s VAL 145 Ca 0.18 -1.39 -0.08 0.00 -2.93 0.00 0.00 61.98 57.76 1nje s VAL 145 Cb -0.10 -1.56 0.39 0.00 -1.53 0.00 0.00 36.38 33.58 1nje s VAL 145 CO -0.09 -0.59 1.37 -1.22 -3.33 0.00 0.00 175.10 171.24 1nje n TYR 146 N -0.08 0.30 -0.33 1.54 4.01 -1.26 -1.03 117.16 120.31 1nje n TYR 146 Ca -0.12 1.08 0.18 0.00 -0.16 0.00 0.00 57.90 58.87 1nje n TYR 146 Cb 0.62 -1.00 0.42 0.00 -0.31 0.00 0.00 39.34 39.07 1nje n TYR 146 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1nje h GLY 147 N 0.00 1.55 0.10 2.72 0.00 -1.78 0.57 103.07 106.23 1nje h GLY 147 Ca 0.42 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.46 1nje h GLY 147 CO -0.91 -0.13 -0.02 0.23 0.00 0.00 0.00 176.54 175.72 1nje h SER 148 N 0.56 -0.04 -1.00 0.19 0.87 -1.26 -2.78 113.55 110.09 1nje h SER 148 Ca 0.59 -0.58 0.20 0.00 -1.23 0.00 0.00 61.79 60.78 1nje h SER 148 Cb 1.21 0.01 -0.11 0.00 -0.44 0.00 0.00 62.40 63.08 1nje h SER 148 CO -0.36 0.71 0.61 1.56 -0.53 0.00 0.00 176.83 178.82 1nje h GLN 149 N -0.95 0.69 0.07 2.24 4.20 -0.70 0.70 115.11 121.36 1nje h GLN 149 Ca -0.01 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 1nje h GLN 149 Cb 0.61 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1nje h GLN 149 CO 0.01 0.46 -0.03 -1.49 -0.67 0.00 0.00 178.83 177.10 1nje h TRP 150 N 0.71 -0.08 -0.70 2.96 4.06 -0.01 -3.40 115.95 119.49 1nje h TRP 150 Ca 0.58 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.53 1nje h TRP 150 Cb 0.98 0.03 0.00 0.00 -1.00 0.00 0.00 29.16 29.16 1nje h TRP 150 CO -0.00 0.49 0.00 0.54 -3.56 0.00 0.00 178.44 175.90 1nje n ARG 151 N -4.79 2.71 -2.67 0.49 5.12 -1.05 -1.94 116.66 114.52 1nje n ARG 151 Ca -0.08 -2.63 -0.04 0.00 -1.93 0.00 0.00 57.85 53.17 1nje n ARG 151 Cb 0.30 -1.57 0.05 0.00 -1.16 0.00 0.00 32.46 30.09 1nje n ARG 151 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1nje n ALA 152 N 1.64 -3.51 -2.58 7.54 0.00 0.24 -4.20 120.51 119.64 1nje n ALA 152 Ca 0.24 -0.22 -0.43 0.00 0.00 0.00 0.00 53.44 53.04 1nje n ALA 152 Cb 0.62 -3.12 -0.05 0.00 0.00 0.00 0.00 19.45 16.91 1nje n ALA 152 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1nje s TRP 153 N 0.54 3.03 0.08 0.00 -0.11 -0.61 -4.37 118.94 117.50 1nje s TRP 153 Ca 0.25 0.48 -0.31 0.00 1.22 0.00 0.00 56.10 57.75 1nje s TRP 153 Cb 0.17 -3.67 -0.08 0.00 -1.50 0.00 0.00 33.47 28.39 1nje s TRP 153 CO -0.10 -0.90 1.49 -1.01 -4.62 0.00 0.00 176.95 171.81 1nje s HIS 154 N 3.40 2.90 0.78 5.86 3.76 -1.26 -1.41 115.29 129.32 1nje s HIS 154 Ca 0.34 0.70 -0.05 0.00 -0.15 0.00 0.00 55.06 55.89 1nje s HIS 154 Cb -0.12 -3.79 0.14 0.00 1.11 0.00 0.00 32.58 29.92 1nje s HIS 154 CO 0.21 -2.96 1.08 0.95 -0.85 0.00 0.00 174.74 173.17 1nje s THR 155 N 1.85 2.13 -0.07 1.30 -4.23 0.60 -4.98 115.64 112.22 1nje s THR 155 Ca 0.68 -0.40 0.22 0.00 -1.18 0.00 0.00 61.69 61.01 1nje s THR 155 Cb -0.37 -2.72 0.22 0.00 1.34 0.00 0.00 72.50 70.97 1nje s THR 155 CO 0.30 0.00 1.69 0.28 -0.54 0.00 0.00 174.62 176.35 1nje h SER 156 N -0.83 0.00 -0.74 3.99 0.02 -1.95 -3.00 113.55 111.03 1nje h SER 156 Ca -0.39 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.19 1nje h SER 156 Cb 1.26 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 63.59 1nje h SER 156 CO 0.42 0.23 0.46 0.29 -1.14 0.00 0.00 176.83 177.09 1nje n LYS 157 N -3.25 2.20 0.00 3.45 4.76 -1.26 -4.93 118.16 119.13 1nje n LYS 157 Ca 0.02 -2.36 0.00 0.00 -2.87 0.00 0.00 58.31 53.10 1nje n LYS 157 Cb 0.52 -1.94 0.00 0.00 -1.84 0.00 0.00 35.03 31.78 1nje n LYS 157 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nje n GLY 158 N -0.65 1.25 3.30 0.72 0.00 -1.14 -4.98 105.19 103.69 1nje n GLY 158 Ca 0.44 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.13 1nje n GLY 158 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nje n ASP 159 N 2.50 -2.58 -4.45 1.61 2.03 -1.26 -4.33 116.55 110.07 1nje n ASP 159 Ca 0.00 0.10 -0.30 0.00 0.52 0.00 0.00 54.79 55.12 1nje n ASP 159 Cb 0.00 -1.02 -0.12 0.00 -0.72 0.00 0.00 41.12 39.26 1nje n ASP 159 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1nje s THR 160 N -2.27 2.64 -0.15 5.18 -4.23 -1.26 -0.29 115.64 115.25 1nje s THR 160 Ca 0.54 -1.48 0.01 0.00 -1.18 0.00 0.00 61.69 59.58 1nje s THR 160 Cb -0.15 -2.17 0.02 0.00 1.34 0.00 0.00 72.50 71.54 1nje s THR 160 CO 0.68 0.17 -0.18 -0.63 -0.54 0.00 0.00 174.62 174.12 1nje s ILE 161 N -1.05 1.83 -1.26 2.99 1.01 -0.50 -4.85 121.20 119.37 1nje s ILE 161 Ca 0.16 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.87 1nje s ILE 161 Cb -0.10 -1.66 0.15 0.00 0.01 0.00 0.00 42.46 40.86 1nje s ILE 161 CO 0.07 0.50 1.67 -0.67 0.00 0.00 0.00 174.94 176.51 1nje n ASP 162 N 4.48 5.08 -0.18 3.58 2.03 -1.26 -1.57 116.55 128.71 1nje n ASP 162 Ca -0.19 -3.01 -0.06 0.00 0.52 0.00 0.00 54.79 52.04 1nje n ASP 162 Cb 0.51 -1.56 -0.05 0.00 -0.72 0.00 0.00 41.12 39.30 1nje n ASP 162 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 1nje h GLN 163 N 6.60 -0.06 -0.93 -0.67 4.20 -1.69 0.19 115.11 122.75 1nje h GLN 163 Ca 0.37 0.00 0.17 0.00 0.06 0.00 0.00 58.65 59.25 1nje h GLN 163 Cb 0.77 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.48 1nje h GLN 163 CO 1.44 -0.04 0.60 1.25 -0.67 0.00 0.00 178.83 181.40 1nje h LEU 164 N -0.06 0.66 -0.65 1.46 6.46 -1.80 0.32 115.31 121.70 1nje h LEU 164 Ca 0.07 0.05 -0.14 0.00 -0.12 0.00 0.00 57.88 57.75 1nje h LEU 164 Cb 0.24 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.08 1nje h LEU 164 CO -0.44 0.30 -0.65 1.23 -0.62 0.00 0.00 178.44 178.25 1nje h GLY 165 N 0.67 0.00 1.54 3.75 0.00 -1.46 -2.64 103.07 104.93 1nje h GLY 165 Ca 0.49 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.53 1nje h GLY 165 CO -0.25 0.00 -1.31 -0.55 0.00 0.00 0.00 176.54 174.43 1nje h ASP 166 N 0.00 0.46 -0.18 0.19 5.19 0.81 -3.05 116.42 119.83 1nje h ASP 166 Ca -0.01 -0.52 -0.06 0.00 -0.62 0.00 0.00 57.03 55.83 1nje h ASP 166 Cb 1.18 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 40.53 1nje h ASP 166 CO 0.08 1.41 -0.06 0.58 -3.12 0.00 0.00 179.24 178.14 1nje h VAL 167 N 0.08 1.21 -0.03 -1.35 2.07 -0.42 0.41 116.25 118.23 1nje h VAL 167 Ca -0.16 -0.88 -0.15 0.00 0.82 0.00 0.00 66.70 66.33 1nje h VAL 167 Cb 2.00 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 1nje h VAL 167 CO 0.21 0.29 -0.67 0.40 0.02 0.00 0.00 177.57 177.82 1nje h ILE 168 N 0.48 1.44 0.02 4.57 2.04 -1.50 -0.94 117.51 123.62 1nje h ILE 168 Ca 0.10 -2.20 -0.22 0.00 1.00 0.00 0.00 64.86 63.54 1nje h ILE 168 Cb 0.40 2.17 -0.01 0.00 -0.74 0.00 0.00 36.82 38.64 1nje h ILE 168 CO 0.02 0.64 -0.96 -0.08 0.00 0.00 0.00 178.15 177.76 1nje h GLU 169 N 0.08 0.25 -0.37 2.37 4.57 -1.34 -1.95 114.58 118.19 1nje h GLU 169 Ca -0.01 -0.30 -0.05 0.00 -1.18 0.00 0.00 59.36 57.82 1nje h GLU 169 Cb 1.19 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.85 1nje h GLU 169 CO 0.09 1.04 0.02 0.37 -1.18 0.00 0.00 179.01 179.36 1nje h GLN 170 N 0.13 0.57 -0.06 1.92 4.15 -0.59 -1.23 115.11 120.00 1nje h GLN 170 Ca -0.07 -0.12 -0.16 0.00 0.77 0.00 0.00 58.65 59.08 1nje h GLN 170 Cb 1.62 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 29.21 1nje h GLN 170 CO 0.15 0.58 -0.67 0.82 -1.93 0.00 0.00 178.83 177.78 1nje h ILE 171 N 0.55 1.41 -0.02 2.39 2.04 -1.08 0.78 117.51 123.57 1nje h ILE 171 Ca 0.12 -2.13 -0.10 0.00 1.00 0.00 0.00 64.86 63.74 1nje h ILE 171 Cb 0.32 2.11 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 1nje h ILE 171 CO 0.01 0.63 -0.47 0.11 0.00 0.00 0.00 178.15 178.43 1nje h LYS 172 N 0.17 0.04 0.00 2.37 1.57 -0.67 -3.13 116.57 116.93 1nje h LYS 172 Ca -0.02 -0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 58.55 1nje h LYS 172 Cb 1.21 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.48 1nje h LYS 172 CO 0.10 0.50 -2.04 0.25 -0.57 0.00 0.00 179.45 177.70 1nje n THR 173 N -3.98 0.72 -3.19 -0.16 -2.24 -0.53 -4.77 114.28 100.13 1nje n THR 173 Ca -0.02 -0.60 -0.20 0.00 -2.27 0.00 0.00 64.05 60.96 1nje n THR 173 Cb 0.50 -0.31 -0.04 0.00 -2.10 0.00 0.00 70.33 68.38 1nje n THR 173 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1nje n HIS 174 N -2.44 0.11 -0.25 4.78 8.25 0.27 -4.98 115.22 120.96 1nje n HIS 174 Ca -0.18 -3.75 0.02 0.00 -0.26 0.00 0.00 57.72 53.55 1nje n HIS 174 Cb 0.83 -0.40 0.10 0.00 1.12 0.00 0.00 29.99 31.64 1nje n HIS 174 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1nje h PRO 175 N 3.29 0.03 -0.68 -0.41 0.11 -1.69 -0.40 132.00 132.25 1nje h PRO 175 Ca 0.09 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1nje h PRO 175 Cb 0.93 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1nje h PRO 175 CO 0.50 0.02 0.00 0.66 -0.21 0.00 0.00 178.00 178.96 1nje n TYR 176 N -5.44 0.00 -2.97 0.65 4.01 -1.26 -4.10 117.16 108.04 1nje n TYR 176 Ca 0.11 -0.04 -0.40 0.00 -0.16 0.00 0.00 57.90 57.40 1nje n TYR 176 Cb 0.40 -0.07 -0.05 0.00 -0.31 0.00 0.00 39.34 39.31 1nje n TYR 176 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1nje s SER 177 N -0.23 7.15 -0.06 7.72 0.15 -0.16 -4.95 113.70 123.32 1nje s SER 177 Ca 0.00 1.38 0.08 0.00 0.70 0.00 0.00 55.95 58.11 1nje s SER 177 Cb 0.00 -2.46 0.36 0.00 -1.71 0.00 0.00 66.02 62.21 1nje s SER 177 CO 0.00 -0.07 1.17 0.54 1.20 0.00 0.00 173.24 176.08 1nje n ARG 178 N 3.31 2.41 -1.55 5.44 1.74 -1.26 -4.13 116.66 122.63 1nje n ARG 178 Ca -0.01 -1.40 -0.05 0.00 -0.77 0.00 0.00 57.85 55.62 1nje n ARG 178 Cb 0.51 -1.61 0.09 0.00 -1.02 0.00 0.00 32.46 30.43 1nje n ARG 178 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1nje n ARG 179 N 0.40 1.95 -1.72 5.56 1.74 -1.26 -4.86 116.66 118.47 1nje n ARG 179 Ca 0.13 -3.37 -0.33 0.00 -0.77 0.00 0.00 57.85 53.50 1nje n ARG 179 Cb 0.53 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.40 1nje n ARG 179 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1nje n LEU 180 N -0.62 7.27 -4.88 0.55 4.77 -1.26 -4.95 117.00 117.87 1nje n LEU 180 Ca 0.23 -4.45 -0.35 0.00 -0.03 0.00 0.00 56.01 51.40 1nje n LEU 180 Cb 0.88 -1.31 -0.05 0.00 -2.33 0.00 0.00 43.42 40.60 1nje n LEU 180 CO 0.11 1.90 -0.06 -0.63 -1.33 0.00 0.00 177.39 177.39 1nje s ILE 181 N -1.50 5.30 -0.09 -0.08 1.01 -1.26 -1.69 121.20 122.89 1nje s ILE 181 Ca 0.57 0.20 0.01 0.00 0.00 0.00 0.00 60.65 61.43 1nje s ILE 181 Cb 0.28 -3.56 0.02 0.00 0.01 0.00 0.00 42.46 39.20 1nje s ILE 181 CO -0.15 0.39 -0.09 -0.69 0.00 0.00 0.00 174.94 174.39 1nje s VAL 182 N -1.28 1.03 0.03 2.92 1.01 -0.51 -4.96 120.40 118.65 1nje s VAL 182 Ca 0.27 -0.36 0.07 0.00 0.00 0.00 0.00 61.98 61.96 1nje s VAL 182 Cb -0.13 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 1nje s VAL 182 CO 0.15 0.35 -0.17 -0.55 0.00 0.00 0.00 175.10 174.88 1nje s SER 183 N 1.18 3.87 0.00 3.32 0.15 -1.26 -2.13 113.70 118.83 1nje s SER 183 Ca -0.05 -0.39 0.06 0.00 0.70 0.00 0.00 55.95 56.27 1nje s SER 183 Cb -0.14 -0.66 0.18 0.00 -1.71 0.00 0.00 66.02 63.69 1nje s SER 183 CO -0.02 0.26 1.13 0.00 1.20 0.00 0.00 173.24 175.81 1nje n ALA 184 N 1.59 2.12 -3.45 5.45 0.00 -0.33 -4.70 120.51 121.20 1nje n ALA 184 Ca -0.16 -1.06 -0.43 0.00 0.00 0.00 0.00 53.44 51.78 1nje n ALA 184 Cb 0.52 -0.26 -0.05 0.00 0.00 0.00 0.00 19.45 19.66 1nje n ALA 184 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1nje s TRP 185 N -0.98 3.54 -0.43 0.00 -0.11 -1.21 -4.67 118.94 115.09 1nje s TRP 185 Ca 0.14 -2.00 -0.16 0.00 1.22 0.00 0.00 56.10 55.30 1nje s TRP 185 Cb 0.07 -3.63 0.03 0.00 -1.50 0.00 0.00 33.47 28.45 1nje s TRP 185 CO 0.09 -0.97 0.36 1.21 -4.62 0.00 0.00 176.95 173.03 1nje s ASN 186 N 2.21 6.14 0.56 5.86 3.84 -1.26 -4.94 114.94 127.36 1nje s ASN 186 Ca 0.13 -0.95 0.30 0.00 0.21 0.00 0.00 52.86 52.54 1nje s ASN 186 Cb -0.19 -2.18 1.46 0.00 -0.55 0.00 0.00 41.25 39.79 1nje s ASN 186 CO -0.04 -0.53 1.88 -0.65 -2.79 0.00 0.00 177.10 174.96 1nje h PRO 187 N 8.69 0.00 -0.07 0.43 0.11 -1.99 0.09 132.00 139.25 1nje h PRO 187 Ca -0.27 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.64 1nje h PRO 187 Cb 1.12 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1nje h PRO 187 CO 0.78 0.00 -0.77 1.49 -0.21 0.00 0.00 178.00 179.29 1nje h GLU 188 N 0.00 0.45 0.02 1.05 4.81 -2.04 -3.36 114.58 115.51 1nje h GLU 188 Ca 0.32 -0.39 -0.37 0.00 -0.13 0.00 0.00 59.36 58.80 1nje h GLU 188 Cb 1.48 0.09 -0.06 0.00 0.63 0.00 0.00 28.75 30.88 1nje h GLU 188 CO -0.00 1.03 -2.30 -0.25 -0.73 0.00 0.00 179.01 176.75 1nje n ASP 189 N -3.83 1.24 -0.23 1.04 8.00 -0.27 -4.68 116.55 117.82 1nje n ASP 189 Ca -0.05 0.01 0.13 0.00 0.71 0.00 0.00 54.79 55.59 1nje n ASP 189 Cb 0.73 0.02 0.25 0.00 -0.02 0.00 0.00 41.12 42.10 1nje n ASP 189 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1nje n VAL 190 N -3.10 -0.29 0.77 2.53 0.31 -0.14 -0.67 118.33 117.73 1nje n VAL 190 Ca -0.37 1.47 0.12 0.00 -0.01 0.00 0.00 64.34 65.55 1nje n VAL 190 Cb 1.06 -2.21 0.50 0.00 -0.91 0.00 0.00 33.84 32.28 1nje n VAL 190 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1nje n PRO 191 N -4.83 0.05 -0.10 5.55 -0.04 -1.26 -3.92 135.00 130.46 1nje n PRO 191 Ca 0.18 0.13 -0.12 0.00 -0.04 0.00 0.00 63.50 63.65 1nje n PRO 191 Cb 0.61 -1.57 -0.12 0.00 -0.04 0.00 0.00 33.50 32.38 1nje n PRO 191 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1nje n THR 192 N -1.67 1.24 -1.65 0.52 -2.24 0.15 -5.01 114.28 105.63 1nje n THR 192 Ca 0.05 -0.62 -0.35 0.00 -2.27 0.00 0.00 64.05 60.87 1nje n THR 192 Cb 0.30 -0.91 0.07 0.00 -2.10 0.00 0.00 70.33 67.69 1nje n THR 192 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nje s MET 193 N -2.44 2.46 0.01 -0.78 0.23 -1.02 -4.97 119.30 112.79 1nje s MET 193 Ca -0.19 1.78 -0.25 0.00 -1.03 0.00 0.00 55.69 56.00 1nje s MET 193 Cb 0.06 -1.87 -0.17 0.00 -1.53 0.00 0.00 34.83 31.33 1nje s MET 193 CO 0.62 -1.59 1.25 0.00 -2.03 0.00 0.00 175.02 173.26 1nje h ALA 194 N 0.14 -0.34 -3.52 3.16 0.00 -1.94 -3.41 119.26 113.36 1nje h ALA 194 Ca -0.49 -0.18 -0.65 0.00 0.00 0.00 0.00 54.91 53.59 1nje h ALA 194 Cb 1.30 0.13 -0.40 0.00 0.00 0.00 0.00 17.79 18.81 1nje h ALA 194 CO 0.52 -0.51 -0.68 -1.17 0.00 0.00 0.00 179.25 177.41 1nje s LEU 195 N -9.48 4.48 0.47 0.00 2.96 -1.26 -5.09 118.68 110.75 1nje s LEU 195 Ca -0.14 -2.58 -0.24 0.00 -0.22 0.00 0.00 54.13 50.95 1nje s LEU 195 Cb 0.02 -1.62 -0.08 0.00 0.50 0.00 0.00 46.19 45.01 1nje s LEU 195 CO 0.56 -0.31 1.21 -2.65 -1.32 0.00 0.00 176.35 173.85 1nje n PRO 196 N 3.69 1.68 -1.67 0.98 -0.02 -1.26 -4.83 135.00 133.57 1nje n PRO 196 Ca 0.04 0.61 -0.43 0.00 -2.02 0.00 0.00 63.50 61.70 1nje n PRO 196 Cb 0.37 -2.35 -0.01 0.00 -0.02 0.00 0.00 33.50 31.49 1nje n PRO 196 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1nje n PRO 197 N -0.27 1.95 -0.01 0.52 -0.04 -1.26 -4.92 135.00 130.96 1nje n PRO 197 Ca 0.09 0.69 -0.16 0.00 -0.04 0.00 0.00 63.50 64.07 1nje n PRO 197 Cb 0.41 -2.25 -0.11 0.00 -0.04 0.00 0.00 33.50 31.52 1nje n PRO 197 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1nje s HIS 199 N -3.26 3.40 0.16 0.00 3.76 -1.26 -2.15 115.29 115.94 1nje s HIS 199 Ca -0.14 -1.98 -0.19 0.00 -0.15 0.00 0.00 55.06 52.59 1nje s HIS 199 Cb 0.03 -4.33 0.07 0.00 1.11 0.00 0.00 32.58 29.45 1nje s HIS 199 CO 0.79 -1.43 1.65 1.15 -0.85 0.00 0.00 174.74 176.05 1nje h THR 200 N 4.91 0.51 -1.87 1.30 2.02 -1.52 -3.42 112.91 114.84 1nje h THR 200 Ca 0.29 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.47 1nje h THR 200 Cb 0.90 0.51 -0.23 0.00 -1.74 0.00 0.00 68.15 67.59 1nje h THR 200 CO 1.23 0.00 0.24 -0.22 0.37 0.00 0.00 175.52 177.14 1nje s LEU 201 N -10.57 -0.65 0.18 2.58 0.20 -1.20 -1.19 118.68 108.04 1nje s LEU 201 Ca -0.14 1.22 0.09 0.00 0.69 0.00 0.00 54.13 55.99 1nje s LEU 201 Cb 0.13 2.28 -0.04 0.00 -0.43 0.00 0.00 46.19 48.13 1nje s LEU 201 CO 0.70 -0.24 -0.19 -0.72 -0.29 0.00 0.00 176.35 175.61 1nje s TYR 202 N 0.24 1.90 0.00 5.38 1.13 -0.90 -0.60 117.35 124.50 1nje s TYR 202 Ca 0.00 -0.45 0.02 0.00 -1.41 0.00 0.00 57.07 55.23 1nje s TYR 202 Cb -0.05 -0.93 -0.01 0.00 -1.10 0.00 0.00 41.96 39.87 1nje s TYR 202 CO -0.01 0.37 -0.07 -1.14 -2.51 0.00 0.00 175.55 172.19 1nje s GLN 203 N -2.87 0.57 0.17 -3.49 0.74 0.95 -1.42 119.66 114.31 1nje s GLN 203 Ca 0.17 -0.32 0.01 0.00 0.05 0.00 0.00 55.36 55.28 1nje s GLN 203 Cb -0.06 -0.53 -0.04 0.00 1.10 0.00 0.00 33.01 33.49 1nje s GLN 203 CO 0.07 0.14 0.33 -0.06 -0.55 0.00 0.00 175.29 175.22 1nje s PHE 204 N -0.31 3.48 -0.19 1.67 0.08 -0.68 -0.04 117.98 121.99 1nje s PHE 204 Ca 0.01 0.21 -0.09 0.00 0.12 0.00 0.00 56.93 57.18 1nje s PHE 204 Cb -0.04 -1.74 0.08 0.00 -0.57 0.00 0.00 43.02 40.75 1nje s PHE 204 CO -0.00 0.46 0.44 -0.47 -0.10 0.00 0.00 175.22 175.55 1nje s TYR 205 N -1.80 -0.74 -0.12 0.36 6.14 -0.42 -4.58 117.35 116.18 1nje s TYR 205 Ca 0.36 1.48 0.01 0.00 0.64 0.00 0.00 57.07 59.56 1nje s TYR 205 Cb -0.11 0.32 -0.01 0.00 0.42 0.00 0.00 41.96 42.59 1nje s TYR 205 CO 0.29 -0.42 -0.18 0.08 0.64 0.00 0.00 175.55 175.96 1nje s VAL 206 N 1.99 2.60 -0.06 3.14 1.01 -1.26 -0.78 120.40 127.05 1nje s VAL 206 Ca -0.06 -0.82 -0.22 0.00 0.00 0.00 0.00 61.98 60.88 1nje s VAL 206 Cb -0.10 -2.06 0.05 0.00 0.00 0.00 0.00 36.38 34.27 1nje s VAL 206 CO -0.13 0.54 0.50 0.21 0.00 0.00 0.00 175.10 176.21 1nje s ASN 207 N 0.45 -0.45 -0.31 3.32 3.84 -0.78 -4.49 114.94 116.53 1nje s ASN 207 Ca -0.12 0.50 0.00 0.00 0.21 0.00 0.00 52.86 53.45 1nje s ASN 207 Cb -0.17 0.52 0.00 0.00 -0.55 0.00 0.00 41.25 41.06 1nje s ASN 207 CO 0.05 -0.48 0.00 0.47 -2.79 0.00 0.00 177.10 174.35 1nje n ASP 208 N 1.33 -4.55 0.00 -4.21 8.00 -1.26 -0.64 116.55 115.22 1nje n ASP 208 Ca -0.19 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.38 1nje n ASP 208 Cb 0.56 -3.00 0.00 0.00 -0.02 0.00 0.00 41.12 38.67 1nje n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nje n GLY 209 N 0.58 0.59 3.24 0.44 0.00 -1.26 -5.05 105.19 103.73 1nje n GLY 209 Ca -0.03 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 1nje n GLY 209 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nje s LYS 210 N -1.01 2.19 -0.18 1.61 1.02 0.18 -2.06 119.74 121.51 1nje s LYS 210 Ca 0.00 -0.83 -0.07 0.00 0.02 0.00 0.00 55.97 55.08 1nje s LYS 210 Cb 0.00 -1.94 -0.04 0.00 -0.52 0.00 0.00 37.83 35.32 1nje s LYS 210 CO 0.00 0.40 0.07 -1.17 -0.92 0.00 0.00 175.35 173.73 1nje s LEU 211 N -0.26 3.90 0.24 3.17 2.96 -0.84 -1.86 118.68 125.99 1nje s LEU 211 Ca 0.01 0.13 0.07 0.00 -0.22 0.00 0.00 54.13 54.12 1nje s LEU 211 Cb -0.12 -1.98 -0.05 0.00 0.50 0.00 0.00 46.19 44.54 1nje s LEU 211 CO 0.02 0.20 -0.10 -0.44 -1.32 0.00 0.00 176.35 174.71 1nje s SER 212 N 0.20 2.58 -0.00 3.68 0.01 0.04 0.15 113.70 120.36 1nje s SER 212 Ca 0.05 -1.10 0.00 0.00 1.31 0.00 0.00 55.95 56.21 1nje s SER 212 Cb -0.12 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 65.98 1nje s SER 212 CO 0.00 -0.27 -0.01 -0.22 0.41 0.00 0.00 173.24 173.15 1nje s LEU 213 N -3.36 1.87 -0.09 2.44 0.20 -0.88 -1.31 118.68 117.55 1nje s LEU 213 Ca 0.26 -0.02 0.01 0.00 0.69 0.00 0.00 54.13 55.07 1nje s LEU 213 Cb 0.02 -0.08 -0.02 0.00 -0.43 0.00 0.00 46.19 45.67 1nje s LEU 213 CO 0.09 -0.00 -0.12 -1.58 -0.29 0.00 0.00 176.35 174.45 1nje s GLN 214 N 0.13 2.91 -0.07 1.98 0.74 0.94 -1.49 119.66 124.80 1nje s GLN 214 Ca -0.01 -0.66 0.05 0.00 0.05 0.00 0.00 55.36 54.79 1nje s GLN 214 Cb -0.02 -2.53 -0.01 0.00 1.10 0.00 0.00 33.01 31.55 1nje s GLN 214 CO -0.00 0.47 -0.22 -1.17 -0.55 0.00 0.00 175.29 173.81 1nje s LEU 215 N -0.31 2.23 -0.30 3.68 1.98 -0.35 -0.03 118.68 125.57 1nje s LEU 215 Ca 0.03 -0.46 -0.08 0.00 -2.89 0.00 0.00 54.13 50.73 1nje s LEU 215 Cb -0.13 -1.43 -0.00 0.00 0.66 0.00 0.00 46.19 45.29 1nje s LEU 215 CO 0.03 0.23 0.11 -0.47 -1.89 0.00 0.00 176.35 174.36 1nje s TYR 216 N -0.09 3.16 -0.34 5.38 5.04 0.23 -1.56 117.35 129.18 1nje s TYR 216 Ca -0.05 -0.74 0.00 0.00 -2.44 0.00 0.00 57.07 53.84 1nje s TYR 216 Cb -0.14 -2.30 0.09 0.00 0.35 0.00 0.00 41.96 39.95 1nje s TYR 216 CO 0.04 -0.50 0.06 -1.14 -1.34 0.00 0.00 175.55 172.67 1nje s GLN 217 N 1.56 1.97 0.38 4.97 0.74 -0.36 -1.71 119.66 127.21 1nje s GLN 217 Ca 0.04 -1.64 0.07 0.00 0.05 0.00 0.00 55.36 53.87 1nje s GLN 217 Cb -0.17 -3.27 0.81 0.00 1.10 0.00 0.00 33.01 31.47 1nje s GLN 217 CO 0.04 -0.85 1.99 0.07 -0.55 0.00 0.00 175.29 175.99 1nje h ARG 218 N 7.86 0.64 -4.75 1.67 0.11 -1.73 0.05 114.38 118.23 1nje h ARG 218 Ca -0.13 -0.04 -0.33 0.00 0.10 0.00 0.00 59.98 59.58 1nje h ARG 218 Cb 1.04 -0.15 -0.23 0.00 1.11 0.00 0.00 29.97 31.74 1nje h ARG 218 CO 0.57 0.43 -0.75 0.45 0.10 0.00 0.00 179.97 180.76 1nje s SER 219 N -6.35 1.05 -0.20 0.08 0.15 -1.26 -0.23 113.70 106.94 1nje s SER 219 Ca -0.09 -0.45 -0.13 0.00 0.70 0.00 0.00 55.95 55.97 1nje s SER 219 Cb 0.19 -0.02 0.06 0.00 -1.71 0.00 0.00 66.02 64.54 1nje s SER 219 CO 0.76 -0.09 0.51 0.00 1.20 0.00 0.00 173.24 175.61 1nje s ALA 220 N -1.03 -1.32 -0.57 5.45 0.00 -0.55 -4.89 121.76 118.85 1nje s ALA 220 Ca -0.05 1.74 -0.19 0.00 0.00 0.00 0.00 51.96 53.46 1nje s ALA 220 Cb -0.08 -1.03 0.09 0.00 0.00 0.00 0.00 23.12 22.10 1nje s ALA 220 CO 0.01 -0.29 0.70 0.34 0.00 0.00 0.00 175.76 176.52 1nje s ASP 221 N 1.15 6.19 0.18 0.00 -1.08 -1.26 -0.80 116.67 121.05 1nje s ASP 221 Ca -0.07 -1.26 -0.14 0.00 -0.52 0.00 0.00 52.55 50.56 1nje s ASP 221 Cb -0.06 -2.31 0.15 0.00 -1.46 0.00 0.00 42.92 39.24 1nje s ASP 221 CO -0.11 -1.07 1.74 0.40 0.52 0.00 0.00 175.17 176.65 1nje h ILE 222 N 5.91 0.81 0.00 4.11 2.04 -1.12 0.14 117.51 129.41 1nje h ILE 222 Ca -0.29 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 1nje h ILE 222 Cb 1.09 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 1nje h ILE 222 CO 1.07 0.06 -0.00 0.15 0.00 0.00 0.00 178.15 179.42 1nje h PHE 223 N 0.30 -0.00 0.00 1.37 3.57 -1.93 -3.34 116.94 116.91 1nje h PHE 223 Ca 0.23 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 1nje h PHE 223 Cb 0.25 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 1nje h PHE 223 CO -0.18 0.95 -1.24 1.28 -2.23 0.00 0.00 178.31 176.89 1nje n LEU 224 N -4.62 0.71 -0.11 0.59 4.77 -1.24 -4.57 117.00 112.53 1nje n LEU 224 Ca -0.10 0.28 -0.23 0.00 -0.03 0.00 0.00 56.01 55.94 1nje n LEU 224 Cb 0.46 -0.02 -0.08 0.00 -2.33 0.00 0.00 43.42 41.45 1nje n LEU 224 CO 0.33 -0.10 -1.20 0.61 -1.33 0.00 0.00 177.39 175.70 1nje n GLY 225 N 1.24 -0.38 0.25 -0.72 0.00 0.29 -4.62 105.19 101.25 1nje n GLY 225 Ca -0.03 -0.13 0.03 0.00 0.00 0.00 0.00 46.02 45.89 1nje n GLY 225 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1nje h VAL 226 N -0.82 0.53 -0.95 1.61 2.07 -1.17 -0.35 116.25 117.17 1nje h VAL 226 Ca -0.51 -0.08 0.25 0.00 0.82 0.00 0.00 66.70 67.19 1nje h VAL 226 Cb 1.42 0.29 -0.13 0.00 -1.52 0.00 0.00 31.29 31.35 1nje h VAL 226 CO -0.31 0.04 0.47 -0.65 0.02 0.00 0.00 177.57 177.14 1nje h PRO 227 N 0.22 0.39 0.20 1.57 0.11 -1.81 -0.05 132.00 132.63 1nje h PRO 227 Ca 0.37 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.44 1nje h PRO 227 Cb 0.60 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.62 1nje h PRO 227 CO -0.50 0.26 -0.10 0.74 -0.21 0.00 0.00 178.00 178.20 1nje h PHE 228 N 0.41 -0.25 -0.73 0.65 -1.00 -1.61 -3.32 116.94 111.09 1nje h PHE 228 Ca 0.62 -0.01 0.28 0.00 2.81 0.00 0.00 57.97 61.68 1nje h PHE 228 Cb 1.25 0.08 -0.13 0.00 3.61 0.00 0.00 35.95 40.76 1nje h PHE 228 CO -0.09 -0.11 0.30 0.09 -1.61 0.00 0.00 178.31 176.89 1nje n ASN 229 N -4.95 0.17 0.13 2.17 5.03 -0.22 -0.85 115.26 116.74 1nje n ASN 229 Ca -0.04 1.22 -0.05 0.00 0.87 0.00 0.00 54.58 56.58 1nje n ASN 229 Cb 0.13 -0.56 -0.02 0.00 -1.02 0.00 0.00 39.78 38.31 1nje n ASN 229 CO 0.00 0.00 0.00 0.40 -1.83 0.00 0.00 177.26 175.83 1nje h ILE 230 N 0.00 0.00 -0.08 2.41 2.04 -1.18 -2.96 117.51 117.74 1nje h ILE 230 Ca 0.57 -0.04 0.02 0.00 1.00 0.00 0.00 64.86 66.42 1nje h ILE 230 Cb 1.45 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.53 1nje h ILE 230 CO -0.59 0.00 0.19 0.00 0.00 0.00 0.00 178.15 177.74 1nje h ALA 231 N -1.81 1.46 -0.19 1.87 0.00 -1.08 -0.39 119.26 119.11 1nje h ALA 231 Ca -0.03 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1nje h ALA 231 Cb 0.25 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1nje h ALA 231 CO 0.06 -0.23 -0.28 0.77 0.00 0.00 0.00 179.25 179.57 1nje h SER 232 N 0.00 0.58 1.56 0.00 0.02 -1.17 -2.23 113.55 112.32 1nje h SER 232 Ca 0.04 -0.52 -0.03 0.00 -0.84 0.00 0.00 61.79 60.44 1nje h SER 232 Cb 0.41 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 1nje h SER 232 CO -0.00 0.98 -0.45 1.88 -1.14 0.00 0.00 176.83 178.11 1nje h TYR 233 N 0.20 0.00 0.00 3.45 -1.99 -1.20 -2.23 116.97 115.20 1nje h TYR 233 Ca 0.02 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.57 1nje h TYR 233 Cb 0.86 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.56 1nje h TYR 233 CO 0.09 0.14 -0.85 0.00 -0.00 0.00 0.00 178.16 177.54 1nje h ALA 234 N 1.86 0.59 -0.10 3.88 0.00 -1.15 -1.89 119.26 122.45 1nje h ALA 234 Ca -0.01 -0.76 -0.13 0.00 0.00 0.00 0.00 54.91 54.01 1nje h ALA 234 Cb 1.12 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.79 1nje h ALA 234 CO 0.02 1.03 -0.43 1.25 0.00 0.00 0.00 179.25 181.12 1nje h LEU 235 N 0.01 0.55 -1.06 0.00 5.85 -1.40 -2.87 115.31 116.39 1nje h LEU 235 Ca -0.01 -0.64 0.08 0.00 0.84 0.00 0.00 57.88 58.15 1nje h LEU 235 Cb 1.50 -0.16 -0.07 0.00 0.37 0.00 0.00 40.66 42.30 1nje h LEU 235 CO 0.11 1.10 0.63 0.25 -0.34 0.00 0.00 178.44 180.18 1nje h LEU 236 N 0.04 0.95 -0.64 2.25 5.85 -1.34 -0.42 115.31 122.00 1nje h LEU 236 Ca -0.03 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1nje h LEU 236 Cb 1.08 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.90 1nje h LEU 236 CO 0.09 0.58 0.38 0.74 -0.34 0.00 0.00 178.44 179.89 1nje h THR 237 N 1.06 1.19 -0.09 1.05 2.02 -1.28 0.38 112.91 117.24 1nje h THR 237 Ca 0.44 -0.42 -0.03 0.00 0.77 0.00 0.00 66.41 67.16 1nje h THR 237 Cb 0.30 0.31 -0.00 0.00 -1.74 0.00 0.00 68.15 67.02 1nje h THR 237 CO -0.19 0.19 -0.08 0.45 0.37 0.00 0.00 175.52 176.26 1nje h HIS 238 N 0.87 0.26 -0.63 3.16 3.86 -1.16 -1.68 115.15 119.82 1nje h HIS 238 Ca 0.23 -0.07 0.13 0.00 -1.16 0.00 0.00 60.37 59.49 1nje h HIS 238 Cb -0.02 -0.06 -0.10 0.00 1.06 0.00 0.00 27.41 28.30 1nje h HIS 238 CO -0.02 0.62 0.09 -0.07 0.86 0.00 0.00 177.93 179.42 1nje h LEU 239 N -0.19 -0.09 -0.39 2.43 3.38 -0.67 0.48 115.31 120.26 1nje h LEU 239 Ca 0.02 0.13 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 1nje h LEU 239 Cb 0.57 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 1nje h LEU 239 CO 0.02 -0.04 -0.16 0.58 0.09 0.00 0.00 178.44 178.93 1nje h VAL 240 N 0.21 1.28 -0.82 1.22 2.07 -0.93 -2.16 116.25 117.12 1nje h VAL 240 Ca 0.34 -1.28 0.06 0.00 0.82 0.00 0.00 66.70 66.64 1nje h VAL 240 Cb 0.53 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.52 1nje h VAL 240 CO -0.46 0.43 0.50 0.00 0.02 0.00 0.00 177.57 178.05 1nje h ALA 241 N 0.82 1.13 0.15 1.67 0.00 0.07 0.33 119.26 123.43 1nje h ALA 241 Ca 0.09 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1nje h ALA 241 Cb 0.70 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1nje h ALA 241 CO 0.05 0.22 -0.07 1.25 0.00 0.00 0.00 179.25 180.71 1nje h HIS 242 N 0.91 -0.18 -0.31 0.00 6.17 -0.07 0.25 115.15 121.92 1nje h HIS 242 Ca 0.36 -0.00 0.07 0.00 0.71 0.00 0.00 60.37 61.51 1nje h HIS 242 Cb 0.19 0.06 -0.07 0.00 2.52 0.00 0.00 27.41 30.11 1nje h HIS 242 CO -0.04 0.05 -0.13 1.49 0.71 0.00 0.00 177.93 180.01 1nje h GLU 243 N -0.40 -0.07 -0.09 5.26 4.57 -0.85 -2.42 114.58 120.58 1nje h GLU 243 Ca -0.02 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1nje h GLU 243 Cb 0.32 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 1nje h GLU 243 CO 0.03 -0.05 0.00 0.00 -1.18 0.00 0.00 179.01 177.81 1nje n GLY 245 N 0.53 -0.51 3.84 0.00 0.00 -0.77 -4.95 105.19 103.33 1nje n GLY 245 Ca 0.01 0.06 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 1nje n GLY 245 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nje s LEU 246 N -6.27 3.42 0.00 0.99 1.43 0.81 -5.03 118.68 114.03 1nje s LEU 246 Ca 0.16 -0.70 -0.01 0.00 -1.03 0.00 0.00 54.13 52.55 1nje s LEU 246 Cb -0.07 -2.02 0.03 0.00 0.03 0.00 0.00 46.19 44.16 1nje s LEU 246 CO 0.20 -0.51 0.22 1.21 0.23 0.00 0.00 176.35 177.69 1nje n GLU 247 N -1.43 0.26 -4.46 1.70 4.07 -0.87 -4.48 120.64 115.44 1nje n GLU 247 Ca 0.01 -0.50 -0.27 0.00 -0.06 0.00 0.00 57.16 56.34 1nje n GLU 247 Cb 0.61 -0.17 -0.17 0.00 -0.06 0.00 0.00 31.44 31.65 1nje n GLU 247 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1nje s VAL 248 N -0.77 1.35 0.00 6.31 0.11 -1.26 -1.98 120.40 124.16 1nje s VAL 248 Ca 0.14 -0.56 0.00 0.00 -2.93 0.00 0.00 61.98 58.63 1nje s VAL 248 Cb -0.01 -1.24 0.00 0.00 -1.53 0.00 0.00 36.38 33.60 1nje s VAL 248 CO 0.09 0.41 0.00 0.61 -3.33 0.00 0.00 175.10 172.88 1nje n GLY 249 N 4.15 0.40 3.57 6.54 0.00 0.12 -4.51 105.19 115.46 1nje n GLY 249 Ca -0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.58 1nje n GLY 249 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nje s GLU 250 N 2.82 2.05 -0.29 1.61 2.02 -1.26 -1.41 118.70 124.23 1nje s GLU 250 Ca 0.00 -1.45 -0.06 0.00 0.02 0.00 0.00 54.97 53.48 1nje s GLU 250 Cb 0.00 -2.06 0.01 0.00 0.10 0.00 0.00 34.13 32.18 1nje s GLU 250 CO 0.00 0.38 0.07 0.12 0.02 0.00 0.00 175.26 175.85 1nje s PHE 251 N -2.13 3.15 -0.25 1.61 5.36 -0.22 -2.07 117.98 123.44 1nje s PHE 251 Ca 0.28 -1.05 -0.08 0.00 -0.96 0.00 0.00 56.93 55.12 1nje s PHE 251 Cb -0.07 -2.24 -0.03 0.00 -0.34 0.00 0.00 43.02 40.34 1nje s PHE 251 CO 0.17 -0.60 0.08 0.42 -1.46 0.00 0.00 175.22 173.83 1nje s ILE 252 N 1.48 4.42 -0.36 3.12 1.01 -0.55 -0.27 121.20 130.05 1nje s ILE 252 Ca 0.02 -0.13 -0.07 0.00 0.00 0.00 0.00 60.65 60.47 1nje s ILE 252 Cb -0.17 -3.07 0.06 0.00 0.01 0.00 0.00 42.46 39.28 1nje s ILE 252 CO 0.02 0.33 0.15 -2.28 0.00 0.00 0.00 174.94 173.16 1nje s HIS 253 N 1.62 3.31 -0.17 3.97 2.46 0.10 -1.21 115.29 125.37 1nje s HIS 253 Ca 0.06 -1.56 -0.06 0.00 0.47 0.00 0.00 55.06 53.97 1nje s HIS 253 Cb -0.15 -2.52 -0.04 0.00 -0.13 0.00 0.00 32.58 29.74 1nje s HIS 253 CO 0.04 -0.78 0.05 0.99 -2.47 0.00 0.00 174.74 172.57 1nje s THR 254 N 1.38 4.66 0.13 0.89 2.01 -0.60 -0.23 115.64 123.88 1nje s THR 254 Ca 0.00 -0.08 0.08 0.00 0.31 0.00 0.00 61.69 62.00 1nje s THR 254 Cb -0.21 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 69.18 1nje s THR 254 CO 0.02 0.49 -0.10 -0.36 -0.69 0.00 0.00 174.62 173.97 1nje s PHE 255 N 0.18 2.69 0.00 4.92 0.08 0.41 -1.23 117.98 125.04 1nje s PHE 255 Ca 0.04 -0.18 0.00 0.00 0.12 0.00 0.00 56.93 56.90 1nje s PHE 255 Cb -0.12 -1.39 0.00 0.00 -0.57 0.00 0.00 43.02 40.94 1nje s PHE 255 CO 0.01 0.45 0.00 0.41 -0.10 0.00 0.00 175.22 175.98 1nje n GLY 256 N 0.52 0.22 3.40 4.36 0.00 0.00 -2.16 105.19 111.53 1nje n GLY 256 Ca -0.13 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.44 1nje n GLY 256 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1nje s ASP 257 N -1.00 6.49 -0.05 1.61 -1.08 0.68 -0.42 116.67 122.90 1nje s ASP 257 Ca 0.00 -1.91 -0.21 0.00 -0.52 0.00 0.00 52.55 49.91 1nje s ASP 257 Cb 0.00 -2.33 -0.05 0.00 -1.46 0.00 0.00 42.92 39.08 1nje s ASP 257 CO 0.00 -1.01 0.61 0.00 0.52 0.00 0.00 175.17 175.29 1nje s ALA 258 N 2.29 3.43 0.06 3.66 0.00 -0.68 -1.48 121.76 129.04 1nje s ALA 258 Ca 0.23 0.03 -0.04 0.00 0.00 0.00 0.00 51.96 52.17 1nje s ALA 258 Cb -0.12 -2.80 -0.02 0.00 0.00 0.00 0.00 23.12 20.17 1nje s ALA 258 CO -0.03 0.03 0.06 -3.38 0.00 0.00 0.00 175.76 172.44 1nje s HIS 259 N 0.33 0.34 -0.20 0.00 -3.43 0.02 -2.09 115.29 110.26 1nje s HIS 259 Ca 0.32 -0.80 0.01 0.00 -0.80 0.00 0.00 55.06 53.79 1nje s HIS 259 Cb -0.17 -0.24 0.04 0.00 -1.43 0.00 0.00 32.58 30.78 1nje s HIS 259 CO 0.16 -0.42 -0.12 -1.17 -2.00 0.00 0.00 174.74 171.20 1nje s LEU 260 N -2.71 2.43 0.25 5.38 1.98 -0.41 -0.40 118.68 125.20 1nje s LEU 260 Ca 0.03 -0.93 -0.30 0.00 -2.89 0.00 0.00 54.13 50.05 1nje s LEU 260 Cb 0.05 -1.31 -0.10 0.00 0.66 0.00 0.00 46.19 45.49 1nje s LEU 260 CO -0.09 -0.13 1.42 -0.31 -1.89 0.00 0.00 176.35 175.35 1nje s TYR 261 N 1.34 3.03 0.48 5.38 2.02 -1.26 -1.02 117.35 127.31 1nje s TYR 261 Ca -0.01 1.07 0.24 0.00 -0.37 0.00 0.00 57.07 57.99 1nje s TYR 261 Cb -0.16 -3.80 1.27 0.00 -0.40 0.00 0.00 41.96 38.87 1nje s TYR 261 CO -0.08 -2.56 1.88 0.28 -1.57 0.00 0.00 175.55 173.49 1nje h VAL 262 N 3.51 0.62 0.00 0.71 2.07 -1.35 0.00 116.25 121.82 1nje h VAL 262 Ca -0.46 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 66.99 1nje h VAL 262 Cb 1.22 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1nje h VAL 262 CO 0.77 0.04 0.00 -0.46 0.02 0.00 0.00 177.57 177.93 1nje n ASN 263 N -4.41 0.67 0.00 0.57 6.94 -1.26 -2.84 115.26 114.93 1nje n ASN 263 Ca 0.18 -1.75 0.00 0.00 -0.02 0.00 0.00 54.58 53.00 1nje n ASN 263 Cb 0.81 -0.33 0.00 0.00 -2.36 0.00 0.00 39.78 37.89 1nje n ASN 263 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1nje n HIS 264 N -0.07 0.00 -0.20 -2.53 8.25 -0.01 -4.53 115.22 116.13 1nje n HIS 264 Ca 0.00 -0.13 -0.06 0.00 -0.26 0.00 0.00 57.72 57.27 1nje n HIS 264 Cb 0.17 -0.01 0.03 0.00 1.12 0.00 0.00 29.99 31.30 1nje n HIS 264 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1nje h LEU 265 N 0.00 0.64 -0.87 2.41 3.38 -1.62 -1.42 115.31 117.83 1nje h LEU 265 Ca 0.00 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1nje h LEU 265 Cb 0.62 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1nje h LEU 265 CO 0.00 0.46 -0.02 0.44 0.09 0.00 0.00 178.44 179.41 1nje h ASP 266 N 0.76 0.79 -0.09 -0.43 3.32 -1.90 -1.74 116.42 117.13 1nje h ASP 266 Ca 0.21 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1nje h ASP 266 Cb -0.08 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.26 1nje h ASP 266 CO -0.05 0.86 0.02 1.56 -1.72 0.00 0.00 179.24 179.92 1nje h GLN 267 N 0.75 0.14 -0.56 3.56 7.50 -1.84 -2.29 115.11 122.38 1nje h GLN 267 Ca 0.14 -0.03 -0.04 0.00 0.50 0.00 0.00 58.65 59.22 1nje h GLN 267 Cb 0.49 -0.02 -0.03 0.00 0.05 0.00 0.00 27.48 27.97 1nje h GLN 267 CO 0.02 0.32 0.18 0.97 -1.50 0.00 0.00 178.83 178.82 1nje h ILE 268 N -0.07 1.22 -0.66 2.54 6.09 -1.16 -2.13 117.51 123.33 1nje h ILE 268 Ca 0.03 -0.74 -0.06 0.00 -1.37 0.00 0.00 64.86 62.71 1nje h ILE 268 Cb 0.24 0.59 -0.03 0.00 0.47 0.00 0.00 36.82 38.10 1nje h ILE 268 CO 0.00 0.28 0.16 0.11 -3.07 0.00 0.00 178.15 175.63 1nje h LYS 269 N 0.82 1.04 -0.17 2.19 1.57 -1.19 0.12 116.57 120.95 1nje h LYS 269 Ca 0.19 -0.24 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 1nje h LYS 269 Cb 0.23 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 1nje h LYS 269 CO -0.01 0.92 -0.11 1.49 -0.57 0.00 0.00 179.45 181.18 1nje h GLU 270 N 0.99 0.37 -0.71 3.15 4.22 -1.02 -2.73 114.58 118.85 1nje h GLU 270 Ca 0.21 -0.17 0.02 0.00 0.08 0.00 0.00 59.36 59.49 1nje h GLU 270 Cb 0.35 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 1nje h GLU 270 CO 0.00 0.70 0.46 0.37 -2.18 0.00 0.00 179.01 178.37 1nje h GLN 271 N 0.04 0.91 -0.20 1.92 4.15 -1.20 -0.42 115.11 120.31 1nje h GLN 271 Ca 0.03 -0.05 0.06 0.00 0.77 0.00 0.00 58.65 59.46 1nje h GLN 271 Cb 0.60 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.08 1nje h GLN 271 CO 0.03 0.60 0.28 -0.07 -1.93 0.00 0.00 178.83 177.74 1nje h LEU 272 N 0.93 0.00 -0.99 -2.39 3.38 -0.47 0.29 115.31 116.06 1nje h LEU 272 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1nje h LEU 272 Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1nje h LEU 272 CO -0.08 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.91 1nje n SER 273 N -3.55 1.45 -4.92 -0.43 3.41 -0.17 -4.86 113.62 104.56 1nje n SER 273 Ca 0.02 -1.96 -0.27 0.00 -0.26 0.00 0.00 58.87 56.41 1nje n SER 273 Cb 0.40 -0.17 -0.02 0.00 -0.26 0.00 0.00 64.21 64.15 1nje n SER 273 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1nje s ARG 274 N -1.66 3.56 -0.23 4.33 0.52 0.10 -5.08 118.95 120.49 1nje s ARG 274 Ca 0.20 -0.15 -0.02 0.00 -0.52 0.00 0.00 55.73 55.24 1nje s ARG 274 Cb 0.10 -2.67 0.01 0.00 0.52 0.00 0.00 34.95 32.92 1nje s ARG 274 CO 0.14 0.21 -0.08 0.99 0.02 0.00 0.00 175.30 176.58 1nje s THR 275 N -2.15 2.91 1.02 0.02 2.01 -1.26 -5.07 115.64 113.12 1nje s THR 275 Ca 0.42 -0.85 -0.19 0.00 0.31 0.00 0.00 61.69 61.39 1nje s THR 275 Cb -0.10 -2.39 -0.03 0.00 0.01 0.00 0.00 72.50 69.98 1nje s THR 275 CO 0.32 0.32 -0.40 -2.65 -0.69 0.00 0.00 174.62 171.53 1nje n PRO 276 N 4.70 -0.58 -4.39 4.92 -0.02 -1.26 -4.93 135.00 133.44 1nje n PRO 276 Ca -0.18 -0.15 -0.20 0.00 -2.02 0.00 0.00 63.50 60.95 1nje n PRO 276 Cb 0.49 -1.45 -0.09 0.00 -0.02 0.00 0.00 33.50 32.43 1nje n PRO 276 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1nje s ARG 277 N -2.89 1.64 0.53 -0.52 0.52 -1.26 -5.04 118.95 111.93 1nje s ARG 277 Ca 0.49 -1.94 -0.22 0.00 -0.52 0.00 0.00 55.73 53.54 1nje s ARG 277 Cb -0.11 -0.36 -0.05 0.00 0.52 0.00 0.00 34.95 34.95 1nje s ARG 277 CO 0.70 -0.38 1.33 -2.14 0.02 0.00 0.00 175.30 174.82 1nje s PRO 278 N -3.85 3.25 0.52 3.54 0.02 -1.26 -4.87 135.00 132.34 1nje s PRO 278 Ca 0.34 2.16 -0.20 0.00 0.02 0.00 0.00 61.00 63.32 1nje s PRO 278 Cb 0.06 -2.29 -0.07 0.00 0.02 0.00 0.00 34.50 32.22 1nje s PRO 278 CO 0.16 -1.08 1.07 0.00 -0.33 0.00 0.00 177.00 176.82 1nje s ALA 279 N -1.34 2.80 0.59 -1.55 0.00 -1.26 -4.77 121.76 116.23 1nje s ALA 279 Ca 0.70 0.66 -0.16 0.00 0.00 0.00 0.00 51.96 53.15 1nje s ALA 279 Cb -0.38 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.42 1nje s ALA 279 CO 0.46 -0.51 1.08 -1.25 0.00 0.00 0.00 175.76 175.53 1nje s PRO 280 N -3.33 3.24 -0.24 0.00 0.04 -1.25 -4.77 135.00 128.70 1nje s PRO 280 Ca 0.69 1.31 -0.07 0.00 0.04 0.00 0.00 61.00 62.97 1nje s PRO 280 Cb -0.19 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.31 1nje s PRO 280 CO 0.24 -0.89 0.05 0.99 0.04 0.00 0.00 177.00 177.43 1nje s THR 281 N -2.30 4.16 0.10 1.26 2.01 0.55 -1.41 115.64 120.01 1nje s THR 281 Ca 0.66 -0.23 -0.30 0.00 0.31 0.00 0.00 61.69 62.13 1nje s THR 281 Cb -0.18 -2.93 -0.06 0.00 0.01 0.00 0.00 72.50 69.34 1nje s THR 281 CO 0.35 0.36 1.00 -0.22 -0.69 0.00 0.00 174.62 175.42 1nje s LEU 282 N 1.48 4.47 -0.26 4.42 2.96 -1.26 -0.99 118.68 129.50 1nje s LEU 282 Ca 0.06 1.83 0.00 0.00 -0.22 0.00 0.00 54.13 55.80 1nje s LEU 282 Cb -0.15 -3.59 0.07 0.00 0.50 0.00 0.00 46.19 43.03 1nje s LEU 282 CO 0.02 -0.14 0.01 -1.58 -1.32 0.00 0.00 176.35 173.34 1nje s GLN 283 N 0.14 1.27 0.14 1.98 0.74 0.23 -4.99 119.66 119.17 1nje s GLN 283 Ca 0.49 -1.04 -0.09 0.00 0.05 0.00 0.00 55.36 54.77 1nje s GLN 283 Cb -0.24 -2.47 -0.06 0.00 1.10 0.00 0.00 33.01 31.34 1nje s GLN 283 CO 0.30 -0.73 0.46 -0.51 -0.55 0.00 0.00 175.29 174.26 1nje s LEU 284 N 1.45 4.28 -0.04 3.68 1.02 -1.26 0.08 118.68 127.89 1nje s LEU 284 Ca 0.00 0.83 -0.30 0.00 0.02 0.00 0.00 54.13 54.68 1nje s LEU 284 Cb -0.18 -3.29 -0.08 0.00 0.02 0.00 0.00 46.19 42.65 1nje s LEU 284 CO -0.11 0.07 2.03 -3.20 0.02 0.00 0.00 176.35 175.16 1nje n ASN 285 N 0.44 3.87 -0.15 2.29 2.85 0.68 -4.91 115.26 120.32 1nje n ASN 285 Ca -0.04 0.74 -0.07 0.00 -0.11 0.00 0.00 54.58 55.10 1nje n ASN 285 Cb 0.52 -1.51 0.01 0.00 1.24 0.00 0.00 39.78 40.04 1nje n ASN 285 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1nje h PRO 286 N 11.52 0.57 0.80 1.20 0.13 -1.95 -3.30 132.00 140.96 1nje h PRO 286 Ca -0.47 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.58 1nje h PRO 286 Cb 1.25 -0.13 0.01 0.00 0.13 0.00 0.00 31.00 32.25 1nje h PRO 286 CO 0.95 0.38 -0.38 -0.44 -0.23 0.00 0.00 178.00 178.27 1nje h ASP 287 N 0.59 -0.91 -3.47 1.44 3.32 -2.01 -3.43 116.42 111.94 1nje h ASP 287 Ca 0.17 0.03 -0.53 0.00 0.02 0.00 0.00 57.03 56.72 1nje h ASP 287 Cb -0.05 0.24 0.08 0.00 0.22 0.00 0.00 39.33 39.82 1nje h ASP 287 CO -0.05 -0.57 0.84 -0.75 -1.72 0.00 0.00 179.24 176.99 1nje s LYS 288 N -5.08 4.15 0.00 3.56 2.20 -1.24 -4.94 119.74 118.39 1nje s LYS 288 Ca -0.16 2.52 0.00 0.00 -0.36 0.00 0.00 55.97 57.97 1nje s LYS 288 Cb 0.02 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 33.31 1nje s LYS 288 CO 0.47 -0.57 0.00 0.72 -0.36 0.00 0.00 175.35 175.62 1nje n HIS 289 N 1.85 0.00 -2.45 4.03 8.25 -1.26 -4.84 115.22 120.80 1nje n HIS 289 Ca 0.06 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.13 1nje n HIS 289 Cb 0.38 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.46 1nje n HIS 289 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 1nje s ASP 290 N -3.10 6.10 0.60 0.41 -4.77 -1.26 -4.16 116.67 110.49 1nje s ASP 290 Ca 0.00 -0.81 0.29 0.00 -3.30 0.00 0.00 52.55 48.73 1nje s ASP 290 Cb 0.00 -2.56 1.22 0.00 -1.09 0.00 0.00 42.92 40.49 1nje s ASP 290 CO 0.00 -1.85 1.58 0.16 0.70 0.00 0.00 175.17 175.76 1nje h ILE 291 N 6.56 0.16 0.00 2.11 3.07 -1.92 -1.77 117.51 125.72 1nje h ILE 291 Ca -0.04 0.00 -0.04 0.00 1.55 0.00 0.00 64.86 66.33 1nje h ILE 291 Cb 1.04 0.28 -0.01 0.00 -0.27 0.00 0.00 36.82 37.86 1nje h ILE 291 CO 1.33 0.00 -0.19 -0.26 -1.05 0.00 0.00 178.15 177.98 1nje h PHE 292 N 0.00 0.00 -0.52 0.16 0.04 -1.90 -2.26 116.94 112.46 1nje h PHE 292 Ca 0.39 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.16 1nje h PHE 292 Cb 2.20 0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.35 1nje h PHE 292 CO 0.00 0.19 0.00 -0.25 -0.60 0.00 0.00 178.31 177.65 1nje n ASP 293 N -3.59 4.35 -4.81 2.17 8.00 -0.66 -4.58 116.55 117.43 1nje n ASP 293 Ca -0.01 -2.50 -0.33 0.00 0.71 0.00 0.00 54.79 52.66 1nje n ASP 293 Cb 0.33 -0.57 0.01 0.00 -0.02 0.00 0.00 41.12 40.87 1nje n ASP 293 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1nje s PHE 294 N -2.02 3.05 0.05 1.24 0.40 -0.85 -5.08 117.98 114.77 1nje s PHE 294 Ca 0.44 1.50 0.01 0.00 -0.60 0.00 0.00 56.93 58.27 1nje s PHE 294 Cb 0.30 -2.98 -0.03 0.00 0.51 0.00 0.00 43.02 40.82 1nje s PHE 294 CO 0.18 -1.03 -0.05 0.34 0.70 0.00 0.00 175.22 175.36 1nje s ASP 295 N -2.86 0.68 0.12 1.36 2.15 -1.26 -5.04 116.67 111.83 1nje s ASP 295 Ca 0.63 -0.79 -0.05 0.00 0.43 0.00 0.00 52.55 52.78 1nje s ASP 295 Cb -0.15 0.11 0.19 0.00 -0.30 0.00 0.00 42.92 42.77 1nje s ASP 295 CO 0.37 -0.41 0.71 0.23 -0.17 0.00 0.00 175.17 175.90 1nje n MET 296 N 0.71 -0.06 0.31 4.34 2.81 -1.26 0.15 117.12 124.12 1nje n MET 296 Ca -0.18 0.71 0.20 0.00 -1.81 0.00 0.00 57.70 56.62 1nje n MET 296 Cb 0.58 -1.05 1.09 0.00 -0.71 0.00 0.00 33.22 33.13 1nje n MET 296 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 1nje h LYS 297 N 0.00 0.00 0.00 0.03 2.10 -2.03 -2.89 116.57 113.78 1nje h LYS 297 Ca 0.20 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.85 1nje h LYS 297 Cb 0.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.65 1nje h LYS 297 CO -0.46 0.00 -0.07 -0.25 -2.00 0.00 0.00 179.45 176.67 1nje n ASP 298 N -2.92 0.81 -4.21 7.07 8.00 0.12 -4.68 116.55 120.73 1nje n ASP 298 Ca -0.03 0.53 -0.34 0.00 0.71 0.00 0.00 54.79 55.66 1nje n ASP 298 Cb 0.09 -0.69 -0.15 0.00 -0.02 0.00 0.00 41.12 40.35 1nje n ASP 298 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1nje s ILE 299 N -3.11 2.84 -0.16 0.53 1.01 -1.09 -0.23 121.20 121.00 1nje s ILE 299 Ca 0.10 -0.85 -0.00 0.00 0.00 0.00 0.00 60.65 59.90 1nje s ILE 299 Cb 0.12 -2.35 -0.00 0.00 0.01 0.00 0.00 42.46 40.24 1nje s ILE 299 CO 0.61 0.34 -0.14 -0.75 0.00 0.00 0.00 174.94 175.00 1nje s LYS 300 N 1.36 3.24 0.08 2.79 2.47 0.11 -4.98 119.74 124.82 1nje s LYS 300 Ca 0.03 -0.74 -0.10 0.00 -1.56 0.00 0.00 55.97 53.60 1nje s LYS 300 Cb -0.15 -2.64 -0.06 0.00 -1.46 0.00 0.00 37.83 33.52 1nje s LYS 300 CO -0.06 0.03 0.40 -1.17 0.16 0.00 0.00 175.35 174.71 1nje s LEU 301 N 0.80 4.35 0.10 5.43 2.96 -1.26 0.74 118.68 131.80 1nje s LEU 301 Ca -0.05 0.80 0.03 0.00 -0.22 0.00 0.00 54.13 54.68 1nje s LEU 301 Cb -0.15 -2.97 -0.04 0.00 0.50 0.00 0.00 46.19 43.52 1nje s LEU 301 CO 0.00 0.18 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.37 1nje s LEU 302 N -1.89 2.46 -1.67 -0.68 1.43 -0.16 -4.90 118.68 113.27 1nje s LEU 302 Ca 0.33 -0.91 -0.17 0.00 -1.03 0.00 0.00 54.13 52.34 1nje s LEU 302 Cb -0.14 -0.19 0.14 0.00 0.03 0.00 0.00 46.19 46.03 1nje s LEU 302 CO 0.18 -0.36 0.81 0.59 0.23 0.00 0.00 176.35 177.79 1nje n ASN 303 N 0.23 -3.44 -4.47 2.29 5.03 -1.26 -0.33 115.26 113.30 1nje n ASN 303 Ca -0.14 -0.98 -0.43 0.00 0.87 0.00 0.00 54.58 53.90 1nje n ASN 303 Cb 0.59 -2.94 -0.06 0.00 -1.02 0.00 0.00 39.78 36.35 1nje n ASN 303 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1nje s TYR 304 N -3.31 3.02 -0.71 3.10 5.04 -1.26 -3.92 117.35 119.31 1nje s TYR 304 Ca 0.71 -0.37 0.05 0.00 -2.44 0.00 0.00 57.07 55.01 1nje s TYR 304 Cb -0.38 -3.54 0.21 0.00 0.35 0.00 0.00 41.96 38.59 1nje s TYR 304 CO 0.91 -1.03 0.64 -3.47 -1.34 0.00 0.00 175.55 171.26 1nje n ASP 305 N 6.33 3.50 -4.81 4.32 2.03 -1.26 -5.07 116.55 121.59 1nje n ASP 305 Ca -0.04 -3.30 -0.30 0.00 0.52 0.00 0.00 54.79 51.67 1nje n ASP 305 Cb 0.46 -0.77 0.08 0.00 -0.72 0.00 0.00 41.12 40.18 1nje n ASP 305 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1nje s PRO 306 N -1.87 2.19 0.83 -0.67 0.04 -1.26 -4.94 135.00 129.31 1nje s PRO 306 Ca 0.31 0.64 -0.12 0.00 0.04 0.00 0.00 61.00 61.86 1nje s PRO 306 Cb 0.03 -1.93 0.10 0.00 0.04 0.00 0.00 34.50 32.74 1nje s PRO 306 CO -0.10 -1.55 1.20 0.71 0.04 0.00 0.00 177.00 177.30 1nje s TYR 307 N -3.17 2.70 0.47 0.56 1.51 -0.06 -4.86 117.35 114.50 1nje s TYR 307 Ca 0.60 0.65 -0.23 0.00 -1.01 0.00 0.00 57.07 57.09 1nje s TYR 307 Cb -0.14 -3.59 -0.07 0.00 -0.11 0.00 0.00 41.96 38.05 1nje s TYR 307 CO 0.54 -1.92 1.21 -2.14 -1.11 0.00 0.00 175.55 172.13 1nje s PRO 308 N -5.62 3.66 0.89 -1.71 0.02 -1.26 -2.46 135.00 128.52 1nje s PRO 308 Ca 0.64 1.89 -0.11 0.00 0.02 0.00 0.00 61.00 63.44 1nje s PRO 308 Cb -0.10 -2.41 0.13 0.00 0.02 0.00 0.00 34.50 32.14 1nje s PRO 308 CO 0.49 -0.66 1.16 0.00 -0.33 0.00 0.00 177.00 177.66 1nje s ALA 309 N -1.48 1.57 -0.22 -1.55 0.00 -1.26 -4.13 121.76 114.69 1nje s ALA 309 Ca 0.64 0.66 0.01 0.00 0.00 0.00 0.00 51.96 53.28 1nje s ALA 309 Cb -0.31 -3.46 0.05 0.00 0.00 0.00 0.00 23.12 19.39 1nje s ALA 309 CO 0.38 -2.65 -0.11 0.42 0.00 0.00 0.00 175.76 173.81 1nje s ILE 310 N -2.52 1.82 0.41 0.00 1.01 -1.26 -4.91 121.20 115.74 1nje s ILE 310 Ca 0.68 -1.22 -0.22 0.00 0.00 0.00 0.00 60.65 59.89 1nje s ILE 310 Cb -0.24 -1.91 -0.10 0.00 0.01 0.00 0.00 42.46 40.21 1nje s ILE 310 CO 0.56 0.10 0.96 -1.59 0.00 0.00 0.00 174.94 174.97 1nje s LYS 311 N 1.30 4.27 0.02 2.79 -2.85 -1.26 -5.08 119.74 118.93 1nje s LYS 311 Ca -0.04 1.20 -0.28 0.00 -1.00 0.00 0.00 55.97 55.86 1nje s LYS 311 Cb -0.17 -2.32 0.08 0.00 -2.06 0.00 0.00 37.83 33.36 1nje s LYS 311 CO -0.07 -0.00 0.70 0.00 0.10 0.00 0.00 175.35 176.07 1nje s ALA 312 N -2.03 -1.72 0.56 0.59 0.00 -1.26 -4.98 121.76 112.92 1nje s ALA 312 Ca 0.60 1.00 -0.18 0.00 0.00 0.00 0.00 51.96 53.38 1nje s ALA 312 Cb -0.12 0.31 -0.05 0.00 0.00 0.00 0.00 23.12 23.26 1nje s ALA 312 CO 0.16 -0.55 1.08 -1.25 0.00 0.00 0.00 175.76 175.21 1nje s PRO 313 N -2.34 3.37 0.71 0.00 0.04 -1.26 -5.05 135.00 130.46 1nje s PRO 313 Ca -0.04 1.41 -0.01 0.00 0.04 0.00 0.00 61.00 62.40 1nje s PRO 313 Cb -0.01 -2.03 0.12 0.00 0.04 0.00 0.00 34.50 32.63 1nje s PRO 313 CO -0.01 -0.80 0.98 0.14 0.04 0.00 0.00 177.00 177.35 1nje s VAL 314 N -2.09 2.18 -0.19 -0.36 -7.23 -1.26 -4.92 120.40 106.53 1nje s VAL 314 Ca 0.68 -0.59 -0.03 0.00 -1.81 0.00 0.00 61.98 60.23 1nje s VAL 314 Cb -0.19 -2.59 -0.01 0.00 0.56 0.00 0.00 36.38 34.15 1nje s VAL 314 CO 0.30 0.00 -0.08 0.00 -0.31 0.00 0.00 175.10 175.01 1nje s ALA 315 N -3.11 2.73 0.00 1.32 0.00 -1.26 -5.08 121.76 116.36 1nje s ALA 315 Ca 0.65 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 51.52 1nje s ALA 315 Cb -0.06 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.53 1nje s ALA 315 CO 0.44 -0.25 0.00 1.33 0.00 0.00 0.00 175.76 177.28