#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j2q n ALA 11 N 0.00 0.00 -1.87 7.54 0.00 -1.26 -5.13 120.51 119.79 1j2q n ALA 11 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1j2q n ALA 11 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1j2q n ALA 11 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1j2q n ILE 12 N -0.73 0.00 -3.19 0.00 0.13 -1.26 -4.97 119.36 109.33 1j2q n ILE 12 Ca 0.00 0.00 -0.45 0.00 -1.10 0.00 0.00 62.75 61.20 1j2q n ILE 12 Cb 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 39.64 38.75 1j2q n ILE 12 CO 0.00 0.00 0.00 -0.89 2.80 0.00 0.00 176.55 178.46 1j2q s THR 13 N 0.87 4.98 0.29 9.51 2.01 -1.26 -4.85 115.64 127.20 1j2q s THR 13 Ca 0.00 -1.18 0.02 0.00 0.31 0.00 0.00 61.69 60.84 1j2q s THR 13 Cb 0.00 -4.42 -0.05 0.00 0.01 0.00 0.00 72.50 68.03 1j2q s THR 13 CO 0.00 -1.01 0.09 0.68 -0.69 0.00 0.00 174.62 173.68 1j2q s VAL 14 N 2.25 0.79 0.29 3.82 -7.23 -1.26 -4.80 120.40 114.25 1j2q s VAL 14 Ca 0.08 -2.00 -0.28 0.00 -1.81 0.00 0.00 61.98 57.97 1j2q s VAL 14 Cb -0.26 -2.68 -0.09 0.00 0.56 0.00 0.00 36.38 33.90 1j2q s VAL 14 CO 0.05 0.00 1.00 -0.36 -0.31 0.00 0.00 175.10 175.48 1j2q s PHE 15 N -3.55 3.74 0.51 2.82 0.08 -1.26 -4.27 117.98 116.05 1j2q s PHE 15 Ca 0.37 1.80 0.03 0.00 0.12 0.00 0.00 56.93 59.25 1j2q s PHE 15 Cb 0.08 -3.07 0.02 0.00 -0.57 0.00 0.00 43.02 39.49 1j2q s PHE 15 CO 0.15 0.02 0.71 -1.54 -0.10 0.00 0.00 175.22 174.45 1j2q s SER 16 N -1.23 5.42 0.55 1.36 1.04 0.35 -4.92 113.70 116.26 1j2q s SER 16 Ca 0.46 -0.11 0.37 0.00 0.48 0.00 0.00 55.95 57.14 1j2q s SER 16 Cb -0.26 -0.85 1.92 0.00 0.10 0.00 0.00 66.02 66.93 1j2q s SER 16 CO 0.32 -1.00 2.12 -0.65 0.98 0.00 0.00 173.24 175.01 1j2q h PRO 17 N 0.26 0.00 0.00 4.02 0.11 -1.97 0.13 132.00 134.55 1j2q h PRO 17 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1j2q h PRO 17 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1j2q h PRO 17 CO 0.50 0.00 -0.01 -0.25 -0.21 0.00 0.00 178.00 178.04 1j2q n ASP 18 N -2.84 0.30 0.00 -2.05 10.43 -1.26 -4.89 116.55 116.24 1j2q n ASP 18 Ca -0.02 0.52 0.00 0.00 2.57 0.00 0.00 54.79 57.86 1j2q n ASP 18 Cb 0.10 -0.60 0.00 0.00 1.84 0.00 0.00 41.12 42.47 1j2q n ASP 18 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1j2q n GLY 19 N 1.43 0.67 3.57 0.44 0.00 0.46 -5.07 105.19 106.68 1j2q n GLY 19 Ca 0.06 -0.67 -0.24 0.00 0.00 0.00 0.00 46.02 45.18 1j2q n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1j2q s ARG 20 N -1.50 1.98 -0.47 1.61 0.52 -1.26 -4.82 118.95 115.02 1j2q s ARG 20 Ca 0.00 -1.65 -0.12 0.00 -0.52 0.00 0.00 55.73 53.44 1j2q s ARG 20 Cb 0.00 -1.93 0.10 0.00 0.52 0.00 0.00 34.95 33.63 1j2q s ARG 20 CO 0.00 0.30 0.35 -0.51 0.02 0.00 0.00 175.30 175.46 1j2q s LEU 21 N -3.61 5.58 0.24 2.53 1.02 -1.26 -0.50 118.68 122.68 1j2q s LEU 21 Ca 0.32 -1.62 -0.06 0.00 0.02 0.00 0.00 54.13 52.78 1j2q s LEU 21 Cb -0.04 -2.08 0.28 0.00 0.02 0.00 0.00 46.19 44.37 1j2q s LEU 21 CO 0.18 -0.66 1.89 -0.26 0.02 0.00 0.00 176.35 177.51 1j2q h PHE 22 N 8.58 1.09 -0.67 0.29 0.04 -1.96 -1.71 116.94 122.59 1j2q h PHE 22 Ca -0.25 0.03 0.06 0.00 2.80 0.00 0.00 57.97 60.61 1j2q h PHE 22 Cb 1.09 -0.36 -0.06 0.00 2.20 0.00 0.00 35.95 38.82 1j2q h PHE 22 CO 0.64 0.63 0.36 1.96 -0.60 0.00 0.00 178.31 181.31 1j2q h GLN 23 N 1.13 0.65 -0.70 1.51 1.08 -1.89 0.59 115.11 117.47 1j2q h GLN 23 Ca 0.36 -0.04 -0.05 0.00 -1.45 0.00 0.00 58.65 57.47 1j2q h GLN 23 Cb -0.00 -0.15 -0.03 0.00 -0.05 0.00 0.00 27.48 27.25 1j2q h GLN 23 CO -0.12 0.43 0.24 0.28 -0.95 0.00 0.00 178.83 178.72 1j2q h VAL 24 N 0.67 1.25 -0.39 -0.54 2.07 -1.83 0.96 116.25 118.43 1j2q h VAL 24 Ca 0.31 -0.84 -0.14 0.00 0.82 0.00 0.00 66.70 66.84 1j2q h VAL 24 Cb 0.22 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1j2q h VAL 24 CO -0.20 0.33 -0.33 -0.33 0.02 0.00 0.00 177.57 177.07 1j2q h GLU 25 N 1.02 0.89 -0.39 1.57 5.08 -0.33 -1.40 114.58 121.01 1j2q h GLU 25 Ca 0.23 -0.43 -0.08 0.00 -1.00 0.00 0.00 59.36 58.08 1j2q h GLU 25 Cb 0.26 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1j2q h GLU 25 CO -0.01 1.08 -0.09 1.88 -1.00 0.00 0.00 179.01 180.87 1j2q h TYR 26 N 0.74 0.73 -0.87 4.33 0.05 0.45 -1.54 116.97 120.87 1j2q h TYR 26 Ca 0.08 -0.12 -0.00 0.00 0.05 0.00 0.00 58.73 58.74 1j2q h TYR 26 Cb 0.90 -0.19 -0.04 0.00 1.01 0.00 0.00 36.73 38.40 1j2q h TYR 26 CO 0.05 0.74 0.54 0.00 -1.05 0.00 0.00 178.16 178.44 1j2q h ALA 27 N 1.28 1.10 -0.52 3.88 0.00 -0.44 -0.79 119.26 123.78 1j2q h ALA 27 Ca 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1j2q h ALA 27 Cb 0.52 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1j2q h ALA 27 CO 0.03 0.55 0.33 0.00 0.00 0.00 0.00 179.25 180.16 1j2q h ARG 28 N 1.19 0.69 -0.26 0.00 3.08 -0.30 0.58 114.38 119.36 1j2q h ARG 28 Ca 0.31 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.33 1j2q h ARG 28 Cb -0.07 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.81 1j2q h ARG 28 CO -0.06 0.47 0.17 0.93 -1.07 0.00 0.00 179.97 180.41 1j2q h GLU 29 N 0.71 0.28 -0.37 0.04 4.39 -0.42 -1.66 114.58 117.55 1j2q h GLU 29 Ca 0.19 -0.02 -0.13 0.00 0.34 0.00 0.00 59.36 59.74 1j2q h GLU 29 Cb -0.06 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 1j2q h GLU 29 CO -0.04 0.19 -0.30 0.00 -1.16 0.00 0.00 179.01 177.69 1j2q h ALA 30 N 1.85 0.77 -0.29 3.43 0.00 -0.66 -3.01 119.26 121.34 1j2q h ALA 30 Ca 0.10 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.48 1j2q h ALA 30 Cb 0.05 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1j2q h ALA 30 CO -0.02 0.65 -0.32 -0.24 0.00 0.00 0.00 179.25 179.32 1j2q h VAL 31 N 0.67 1.28 -0.81 0.00 3.04 -1.08 -2.69 116.25 116.67 1j2q h VAL 31 Ca 0.08 -1.44 0.06 0.00 -1.01 0.00 0.00 66.70 64.38 1j2q h VAL 31 Cb 0.84 1.41 -0.05 0.00 -2.01 0.00 0.00 31.29 31.48 1j2q h VAL 31 CO 0.07 0.46 0.53 0.11 -1.01 0.00 0.00 177.57 177.74 1j2q h LYS 32 N 0.53 0.89 0.00 4.17 1.57 -1.28 0.26 116.57 122.71 1j2q h LYS 32 Ca 0.06 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1j2q h LYS 32 Cb 0.81 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1j2q h LYS 32 CO 0.07 0.59 0.00 -2.13 -0.57 0.00 0.00 179.45 177.41 1j2q n ARG 33 N -4.47 0.04 -1.49 3.15 0.63 -1.03 -1.70 116.66 111.79 1j2q n ARG 33 Ca 0.12 0.15 -0.33 0.00 -0.92 0.00 0.00 57.85 56.87 1j2q n ARG 33 Cb 0.18 -1.56 0.08 0.00 0.45 0.00 0.00 32.46 31.61 1j2q n ARG 33 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1j2q s GLY 34 N -3.11 2.06 0.52 5.14 0.00 0.92 -4.73 107.32 108.13 1j2q s GLY 34 Ca 0.10 0.57 -0.22 0.00 0.00 0.00 0.00 44.72 45.17 1j2q s GLY 34 CO 0.42 0.94 1.33 0.00 0.00 0.00 0.00 173.10 175.79 1j2q s ALA 35 N -2.39 2.87 0.34 3.20 0.00 -1.26 -1.25 121.76 123.27 1j2q s ALA 35 Ca 0.67 1.27 -0.25 0.00 0.00 0.00 0.00 51.96 53.65 1j2q s ALA 35 Cb -0.22 -3.53 -0.10 0.00 0.00 0.00 0.00 23.12 19.27 1j2q s ALA 35 CO 0.47 -1.23 0.95 -0.08 0.00 0.00 0.00 175.76 175.87 1j2q s THR 36 N -1.34 4.19 -0.00 0.00 -1.32 -1.26 -4.49 115.64 111.42 1j2q s THR 36 Ca 0.69 1.76 0.01 0.00 -1.21 0.00 0.00 61.69 62.94 1j2q s THR 36 Cb -0.38 -3.95 -0.00 0.00 -1.51 0.00 0.00 72.50 66.66 1j2q s THR 36 CO 0.46 0.09 -0.02 0.00 -2.21 0.00 0.00 174.62 172.93 1j2q s ALA 37 N -1.67 0.17 0.10 11.08 0.00 -0.49 -2.06 121.76 128.88 1j2q s ALA 37 Ca 0.52 -0.11 0.09 0.00 0.00 0.00 0.00 51.96 52.46 1j2q s ALA 37 Cb -0.18 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 1j2q s ALA 37 CO 0.23 0.03 -0.23 0.42 0.00 0.00 0.00 175.76 176.21 1j2q s ILE 38 N -0.11 1.87 -0.02 0.00 1.01 0.11 -1.44 121.20 122.62 1j2q s ILE 38 Ca 0.00 -1.53 0.01 0.00 0.00 0.00 0.00 60.65 59.12 1j2q s ILE 38 Cb -0.01 -1.67 0.02 0.00 0.01 0.00 0.00 42.46 40.81 1j2q s ILE 38 CO -0.00 0.05 -0.01 -0.83 0.00 0.00 0.00 174.94 174.14 1j2q s GLY 39 N -1.79 0.25 -0.03 6.18 0.00 -0.37 -0.34 107.32 111.22 1j2q s GLY 39 Ca 0.09 0.07 0.03 0.00 0.00 0.00 0.00 44.72 44.90 1j2q s GLY 39 CO 0.04 0.40 -0.11 -0.42 0.00 0.00 0.00 173.10 173.02 1j2q s ILE 40 N 0.74 0.93 -0.10 0.90 1.01 -0.22 -1.18 121.20 123.27 1j2q s ILE 40 Ca -0.08 -0.43 0.03 0.00 0.00 0.00 0.00 60.65 60.17 1j2q s ILE 40 Cb -0.11 -0.82 -0.01 0.00 0.01 0.00 0.00 42.46 41.53 1j2q s ILE 40 CO -0.01 0.29 -0.20 -0.75 0.00 0.00 0.00 174.94 174.26 1j2q s LYS 41 N 0.24 3.06 0.15 2.79 2.20 0.57 -0.50 119.74 128.24 1j2q s LYS 41 Ca -0.05 -0.81 0.01 0.00 -0.36 0.00 0.00 55.97 54.77 1j2q s LYS 41 Cb -0.10 -2.39 -0.01 0.00 -1.51 0.00 0.00 37.83 33.82 1j2q s LYS 41 CO 0.01 0.25 0.05 0.00 -0.36 0.00 0.00 175.35 175.30 1j2q h LYS 43 N 0.00 0.95 0.00 0.00 3.64 -1.81 -3.11 116.57 116.24 1j2q h LYS 43 Ca -0.11 -0.46 0.00 0.00 -1.27 0.00 0.00 60.65 58.80 1j2q h LYS 43 Cb 0.43 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1j2q h LYS 43 CO 0.18 1.13 0.00 0.39 -2.27 0.00 0.00 179.45 178.88 1j2q n GLU 44 N -4.08 0.37 -2.31 1.90 1.02 -1.26 -4.74 120.64 111.54 1j2q n GLU 44 Ca -0.01 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 1j2q n GLU 44 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1j2q n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j2q n GLY 45 N 0.75 -0.12 2.91 0.62 0.00 -1.18 -1.26 105.19 106.92 1j2q n GLY 45 Ca 0.12 -1.48 -0.19 0.00 0.00 0.00 0.00 46.02 44.47 1j2q n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j2q s VAL 46 N -2.79 0.50 0.07 1.61 0.11 -1.08 -0.83 120.40 117.99 1j2q s VAL 46 Ca 0.00 -0.15 0.05 0.00 -2.93 0.00 0.00 61.98 58.95 1j2q s VAL 46 Cb 0.00 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 34.31 1j2q s VAL 46 CO 0.00 0.19 -0.04 -0.63 -3.33 0.00 0.00 175.10 171.29 1j2q s ILE 47 N 0.59 3.78 -0.08 7.04 1.09 0.35 -2.17 121.20 131.81 1j2q s ILE 47 Ca -0.08 -0.98 -0.01 0.00 -1.10 0.00 0.00 60.65 58.49 1j2q s ILE 47 Cb -0.11 -2.75 0.03 0.00 -1.06 0.00 0.00 42.46 38.56 1j2q s ILE 47 CO -0.00 0.20 -0.03 -0.22 -0.10 0.00 0.00 174.94 174.78 1j2q s LEU 48 N -2.03 0.92 -0.04 2.97 2.96 0.40 -1.05 118.68 122.81 1j2q s LEU 48 Ca 0.22 -0.16 0.05 0.00 -0.22 0.00 0.00 54.13 54.02 1j2q s LEU 48 Cb -0.11 -0.56 -0.01 0.00 0.50 0.00 0.00 46.19 46.01 1j2q s LEU 48 CO 0.14 -0.14 -0.18 -0.51 -1.32 0.00 0.00 176.35 174.35 1j2q s ILE 49 N 1.66 1.44 0.05 6.68 2.07 0.54 -0.78 121.20 132.86 1j2q s ILE 49 Ca 0.01 -0.74 0.05 0.00 -1.41 0.00 0.00 60.65 58.56 1j2q s ILE 49 Cb -0.13 -1.23 -0.02 0.00 0.13 0.00 0.00 42.46 41.21 1j2q s ILE 49 CO -0.05 0.41 -0.14 0.00 -1.91 0.00 0.00 174.94 173.26 1j2q s ALA 50 N -0.09 1.16 -0.41 1.50 0.00 0.66 0.06 121.76 124.64 1j2q s ALA 50 Ca -0.01 -0.87 -0.28 0.00 0.00 0.00 0.00 51.96 50.80 1j2q s ALA 50 Cb -0.10 -0.16 -0.00 0.00 0.00 0.00 0.00 23.12 22.86 1j2q s ALA 50 CO 0.01 0.20 1.61 0.34 0.00 0.00 0.00 175.76 177.93 1j2q s ASP 51 N -1.30 6.03 0.00 0.00 3.68 -0.87 -0.94 116.67 123.26 1j2q s ASP 51 Ca 0.00 0.91 0.25 0.00 2.13 0.00 0.00 52.55 55.84 1j2q s ASP 51 Cb -0.08 -2.53 0.37 0.00 -1.45 0.00 0.00 42.92 39.22 1j2q s ASP 51 CO 0.01 -1.67 1.33 1.17 0.13 0.00 0.00 175.17 176.15 1j2q n LYS 52 N 8.40 1.39 -1.58 4.34 4.81 -0.75 -4.84 118.16 129.94 1j2q n LYS 52 Ca 0.19 -1.05 -0.49 0.00 -0.87 0.00 0.00 58.31 56.09 1j2q n LYS 52 Cb 0.48 -1.48 -0.04 0.00 0.02 0.00 0.00 35.03 34.01 1j2q n LYS 52 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1j2q n ARG 53 N 0.11 1.15 -4.24 1.64 1.74 -0.84 -4.83 116.66 111.39 1j2q n ARG 53 Ca 0.12 0.41 -0.23 0.00 -0.77 0.00 0.00 57.85 57.38 1j2q n ARG 53 Cb 0.45 -1.93 -0.07 0.00 -1.02 0.00 0.00 32.46 29.89 1j2q n ARG 53 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1j2q s VAL 54 N -0.08 3.17 -0.24 1.55 0.11 -1.26 -5.06 120.40 118.59 1j2q s VAL 54 Ca 0.75 -1.85 0.16 0.00 -2.93 0.00 0.00 61.98 58.11 1j2q s VAL 54 Cb -0.87 -2.88 0.64 0.00 -1.53 0.00 0.00 36.38 31.73 1j2q s VAL 54 CO 0.51 -0.28 1.54 0.61 -3.33 0.00 0.00 175.10 174.16 1j2q n GLY 55 N -0.99 3.62 3.63 6.54 0.00 -1.26 -4.97 105.19 111.76 1j2q n GLY 55 Ca -0.05 -0.99 -0.11 0.00 0.00 0.00 0.00 46.02 44.87 1j2q n GLY 55 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1j2q s SER 56 N -1.49 -0.61 0.00 1.61 0.15 -1.26 -5.01 113.70 107.09 1j2q s SER 56 Ca 0.47 1.17 0.16 0.00 0.70 0.00 0.00 55.95 58.45 1j2q s SER 56 Cb 0.36 1.19 0.79 0.00 -1.71 0.00 0.00 66.02 66.66 1j2q s SER 56 CO 0.12 -0.20 1.50 2.29 1.20 0.00 0.00 173.24 178.15 1j2q n LYS 57 N 2.57 0.16 0.12 5.44 2.85 -1.26 -2.61 118.16 125.43 1j2q n LYS 57 Ca -0.14 0.16 0.13 0.00 -1.05 0.00 0.00 58.31 57.41 1j2q n LYS 57 Cb 0.56 -1.50 0.29 0.00 -0.65 0.00 0.00 35.03 33.73 1j2q n LYS 57 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 1j2q h LEU 58 N 0.00 0.00 -9.70 -5.58 4.07 -2.02 -3.46 115.31 98.62 1j2q h LEU 58 Ca 0.00 -0.04 -0.54 0.00 0.08 0.00 0.00 57.88 57.38 1j2q h LEU 58 Cb 0.20 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.90 1j2q h LEU 58 CO 0.00 0.02 0.14 -0.76 -1.08 0.00 0.00 178.44 176.76 1j2q s LEU 59 N -4.85 4.57 -0.87 1.67 2.01 -1.07 -4.97 118.68 115.17 1j2q s LEU 59 Ca 0.09 1.56 -0.25 0.00 0.01 0.00 0.00 54.13 55.54 1j2q s LEU 59 Cb 0.11 -3.22 -0.03 0.00 0.01 0.00 0.00 46.19 43.06 1j2q s LEU 59 CO 0.64 0.20 1.84 -1.61 1.01 0.00 0.00 176.35 178.44 1j2q s GLU 60 N -1.04 2.74 0.16 1.70 0.41 -1.26 -4.81 118.70 116.60 1j2q s GLU 60 Ca 0.35 -0.26 -0.11 0.00 -0.41 0.00 0.00 54.97 54.53 1j2q s GLU 60 Cb -0.22 -4.97 0.04 0.00 -1.78 0.00 0.00 34.13 27.20 1j2q s GLU 60 CO 0.25 -3.06 1.62 0.00 -0.49 0.00 0.00 175.26 173.58 1j2q h ALA 61 N 11.63 0.73 0.00 5.21 0.00 -1.93 -2.71 119.26 132.18 1j2q h ALA 61 Ca 0.04 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1j2q h ALA 61 Cb 1.03 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1j2q h ALA 61 CO 1.25 0.53 0.13 0.38 0.00 0.00 0.00 179.25 181.54 1j2q h ASP 62 N 0.82 0.00 0.00 0.00 -0.00 -1.92 -3.12 116.42 112.19 1j2q h ASP 62 Ca 0.16 0.00 -0.01 0.00 -0.00 0.00 0.00 57.03 57.17 1j2q h ASP 62 Cb 0.51 0.00 -0.00 0.00 -0.00 0.00 0.00 39.33 39.84 1j2q h ASP 62 CO 0.02 0.00 -0.58 0.41 -0.00 0.00 0.00 179.24 179.09 1j2q n THR 63 N -3.00 1.43 -0.78 1.15 -1.04 -1.04 -4.96 114.28 106.04 1j2q n THR 63 Ca -0.03 0.20 -0.30 0.00 -2.04 0.00 0.00 64.05 61.88 1j2q n THR 63 Cb 0.19 -2.37 -0.04 0.00 -1.82 0.00 0.00 70.33 66.28 1j2q n THR 63 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1j2q n ILE 64 N -4.60 0.00 -4.81 12.58 3.06 -1.10 -4.92 119.36 119.58 1j2q n ILE 64 Ca -0.09 0.00 -0.33 0.00 -2.50 0.00 0.00 62.75 59.83 1j2q n ILE 64 Cb 0.30 -0.17 -0.15 0.00 0.54 0.00 0.00 39.64 40.16 1j2q n ILE 64 CO 0.00 0.00 0.00 -0.70 -2.50 0.00 0.00 176.55 173.35 1j2q s GLU 65 N 1.02 3.28 0.00 9.51 2.12 -1.26 -5.00 118.70 128.37 1j2q s GLU 65 Ca 0.47 -0.74 0.02 0.00 0.36 0.00 0.00 54.97 55.08 1j2q s GLU 65 Cb -0.66 -2.56 -0.01 0.00 0.26 0.00 0.00 34.13 31.15 1j2q s GLU 65 CO 0.35 0.16 0.15 1.63 -0.54 0.00 0.00 175.26 177.01 1j2q n LYS 66 N 3.65 5.36 -4.09 4.30 4.01 -1.26 -4.94 118.16 125.18 1j2q n LYS 66 Ca -0.18 -0.09 -0.32 0.00 -0.51 0.00 0.00 58.31 57.20 1j2q n LYS 66 Cb 0.53 -0.65 -0.16 0.00 -0.51 0.00 0.00 35.03 34.23 1j2q n LYS 66 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1j2q s ILE 67 N -1.02 1.93 0.01 -0.18 1.01 -1.26 -4.30 121.20 117.38 1j2q s ILE 67 Ca 0.01 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.77 1j2q s ILE 67 Cb 0.01 -1.77 -0.04 0.00 0.01 0.00 0.00 42.46 40.67 1j2q s ILE 67 CO 0.07 0.49 0.06 -0.31 0.00 0.00 0.00 174.94 175.24 1j2q s TYR 68 N 1.34 3.21 -0.18 3.97 1.51 0.51 -4.92 117.35 122.79 1j2q s TYR 68 Ca 0.04 0.15 -0.20 0.00 -1.01 0.00 0.00 57.07 56.05 1j2q s TYR 68 Cb -0.13 -1.70 -0.03 0.00 -0.11 0.00 0.00 41.96 39.99 1j2q s TYR 68 CO -0.12 0.52 0.60 0.21 -1.11 0.00 0.00 175.55 175.65 1j2q s LYS 69 N -1.76 4.23 -0.22 -0.62 2.20 -1.26 0.33 119.74 122.64 1j2q s LYS 69 Ca 0.23 0.58 -0.18 0.00 -0.36 0.00 0.00 55.97 56.24 1j2q s LYS 69 Cb -0.12 -3.55 -0.14 0.00 -1.51 0.00 0.00 37.83 32.50 1j2q s LYS 69 CO 0.14 -0.17 -0.03 -0.89 -0.36 0.00 0.00 175.35 174.04 1j2q n ILE 70 N 4.51 1.52 -3.96 5.43 2.08 0.58 -4.95 119.36 124.58 1j2q n ILE 70 Ca -0.03 -0.09 -0.02 0.00 0.56 0.00 0.00 62.75 63.17 1j2q n ILE 70 Cb 0.50 -2.05 -0.01 0.00 -0.75 0.00 0.00 39.64 37.33 1j2q n ILE 70 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1j2q n ASP 71 N -4.40 -0.11 0.03 4.38 4.64 -0.95 -4.70 116.55 115.44 1j2q n ASP 71 Ca -0.35 -1.27 0.02 0.00 -1.38 0.00 0.00 54.79 51.81 1j2q n ASP 71 Cb 0.68 0.23 0.36 0.00 -1.04 0.00 0.00 41.12 41.36 1j2q n ASP 71 CO 0.00 0.00 0.00 -0.33 -0.82 0.00 0.00 177.20 176.05 1j2q h GLU 72 N 0.00 0.45 -0.21 -0.67 4.39 -1.97 -3.04 114.58 113.54 1j2q h GLU 72 Ca -0.03 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1j2q h GLU 72 Cb 0.15 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1j2q h GLU 72 CO 0.04 0.44 0.00 -2.39 -1.16 0.00 0.00 179.01 175.95 1j2q n HIS 73 N -4.34 0.69 -3.80 4.33 1.44 -1.25 0.34 115.22 112.63 1j2q n HIS 73 Ca 0.01 -0.85 -0.13 0.00 -2.01 0.00 0.00 57.72 54.74 1j2q n HIS 73 Cb 0.19 -0.25 -0.13 0.00 0.12 0.00 0.00 29.99 29.93 1j2q n HIS 73 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1j2q s ILE 74 N -2.61 -0.01 0.21 0.61 1.01 -1.15 -2.52 121.20 116.73 1j2q s ILE 74 Ca 0.37 0.03 0.00 0.00 0.00 0.00 0.00 60.65 61.05 1j2q s ILE 74 Cb 0.30 -0.26 -0.04 0.00 0.01 0.00 0.00 42.46 42.47 1j2q s ILE 74 CO 0.08 0.01 0.09 0.00 0.00 0.00 0.00 174.94 175.13 1j2q s ALA 76 N -3.94 -1.27 0.16 0.00 0.00 0.15 -0.98 121.76 115.87 1j2q s ALA 76 Ca 0.35 0.79 0.09 0.00 0.00 0.00 0.00 51.96 53.19 1j2q s ALA 76 Cb 0.07 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1j2q s ALA 76 CO 0.10 -0.33 -0.13 0.00 0.00 0.00 0.00 175.76 175.41 1j2q s ALA 77 N -1.37 2.85 0.14 0.00 0.00 0.14 -0.36 121.76 123.17 1j2q s ALA 77 Ca -0.12 -1.43 0.04 0.00 0.00 0.00 0.00 51.96 50.46 1j2q s ALA 77 Cb -0.02 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 22.35 1j2q s ALA 77 CO 0.06 0.52 -0.10 -0.08 0.00 0.00 0.00 175.76 176.16 1j2q s THR 78 N -1.51 1.14 -0.22 0.00 -1.32 -1.26 0.07 115.64 112.55 1j2q s THR 78 Ca 0.22 -2.03 -0.18 0.00 -1.21 0.00 0.00 61.69 58.50 1j2q s THR 78 Cb -0.09 -1.81 0.06 0.00 -1.51 0.00 0.00 72.50 69.15 1j2q s THR 78 CO 0.13 -0.74 0.56 -0.55 -2.21 0.00 0.00 174.62 171.82 1j2q s SER 79 N -3.11 -0.63 0.00 8.08 0.15 -0.30 -4.86 113.70 113.03 1j2q s SER 79 Ca 0.16 1.16 0.00 0.00 0.70 0.00 0.00 55.95 57.97 1j2q s SER 79 Cb 0.02 1.14 0.00 0.00 -1.71 0.00 0.00 66.02 65.47 1j2q s SER 79 CO 0.00 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 174.85 1j2q n GLY 80 N 3.21 0.53 3.64 9.45 0.00 -1.26 0.52 105.19 121.27 1j2q n GLY 80 Ca -0.16 -2.06 -0.47 0.00 0.00 0.00 0.00 46.02 43.33 1j2q n GLY 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1j2q n LEU 81 N 0.00 3.35 -0.28 0.99 7.99 0.66 -4.84 117.00 124.88 1j2q n LEU 81 Ca 0.00 0.77 0.00 0.00 -0.01 0.00 0.00 56.01 56.77 1j2q n LEU 81 Cb 0.00 -1.41 0.13 0.00 -0.11 0.00 0.00 43.42 42.03 1j2q n LEU 81 CO 0.00 -0.20 1.14 1.62 -1.51 0.00 0.00 177.39 178.44 1j2q h VAL 82 N 5.97 0.99 -0.54 4.08 3.04 -1.95 -1.71 116.25 126.13 1j2q h VAL 82 Ca -0.45 -0.28 -0.10 0.00 -1.01 0.00 0.00 66.70 64.86 1j2q h VAL 82 Cb 1.27 0.09 -0.02 0.00 -2.01 0.00 0.00 31.29 30.62 1j2q h VAL 82 CO 0.96 0.15 -0.06 0.00 -1.01 0.00 0.00 177.57 177.61 1j2q h ALA 83 N 1.39 0.74 -0.66 3.17 0.00 -1.98 -2.66 119.26 119.27 1j2q h ALA 83 Ca 0.35 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1j2q h ALA 83 Cb 0.21 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1j2q h ALA 83 CO -0.19 0.62 0.20 -0.44 0.00 0.00 0.00 179.25 179.43 1j2q h ASP 84 N 0.88 0.97 -0.67 0.00 3.45 -1.88 -2.79 116.42 116.37 1j2q h ASP 84 Ca 0.15 -0.21 0.08 0.00 0.43 0.00 0.00 57.03 57.47 1j2q h ASP 84 Cb 0.62 -0.25 -0.06 0.00 -0.56 0.00 0.00 39.33 39.07 1j2q h ASP 84 CO 0.04 0.93 0.34 0.00 -1.57 0.00 0.00 179.24 178.98 1j2q h ALA 85 N 1.08 0.91 0.19 3.45 0.00 -1.09 -1.47 119.26 122.33 1j2q h ALA 85 Ca 0.21 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.17 1j2q h ALA 85 Cb 0.31 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1j2q h ALA 85 CO -0.00 -0.03 -0.39 0.00 0.00 0.00 0.00 179.25 178.83 1j2q h ARG 86 N 0.61 -0.65 -0.85 0.00 3.08 -1.20 0.12 114.38 115.49 1j2q h ARG 86 Ca 0.32 0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.47 1j2q h ARG 86 Cb 0.28 0.15 -0.05 0.00 0.08 0.00 0.00 29.97 30.43 1j2q h ARG 86 CO -0.23 -0.43 0.56 -0.39 -1.07 0.00 0.00 179.97 178.40 1j2q h VAL 87 N -0.67 1.07 -0.57 2.04 -1.51 -1.44 -1.52 116.25 113.64 1j2q h VAL 87 Ca 0.01 -0.33 -0.03 0.00 -1.23 0.00 0.00 66.70 65.12 1j2q h VAL 87 Cb 0.67 0.01 -0.03 0.00 -2.13 0.00 0.00 31.29 29.82 1j2q h VAL 87 CO -0.18 0.18 0.25 0.25 -1.23 0.00 0.00 177.57 176.83 1j2q h LEU 88 N 0.97 0.77 -0.57 4.19 5.85 -0.23 0.21 115.31 126.51 1j2q h LEU 88 Ca 0.36 -0.15 -0.16 0.00 0.84 0.00 0.00 57.88 58.77 1j2q h LEU 88 Cb 0.18 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1j2q h LEU 88 CO -0.13 0.71 -0.69 0.16 -0.34 0.00 0.00 178.44 178.15 1j2q h ILE 89 N 0.78 1.44 -0.52 4.05 3.07 -0.44 -1.20 117.51 124.70 1j2q h ILE 89 Ca 0.19 -2.24 -0.11 0.00 1.55 0.00 0.00 64.86 64.25 1j2q h ILE 89 Cb 0.16 2.19 -0.02 0.00 -0.27 0.00 0.00 36.82 38.89 1j2q h ILE 89 CO -0.02 0.65 -0.11 -0.78 -1.05 0.00 0.00 178.15 176.84 1j2q h ASP 90 N 0.10 1.00 -0.57 2.16 1.82 -1.07 0.57 116.42 120.43 1j2q h ASP 90 Ca -0.02 -0.35 0.05 0.00 -0.39 0.00 0.00 57.03 56.32 1j2q h ASP 90 Cb 1.23 -0.27 -0.05 0.00 0.68 0.00 0.00 39.33 40.92 1j2q h ASP 90 CO 0.10 1.12 0.30 -0.09 -1.61 0.00 0.00 179.24 179.06 1j2q h ARG 91 N 0.86 0.56 -0.46 0.28 9.65 -0.40 0.56 114.38 125.43 1j2q h ARG 91 Ca 0.13 -0.03 -0.05 0.00 -1.10 0.00 0.00 59.98 58.93 1j2q h ARG 91 Cb 0.67 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 29.11 1j2q h ARG 91 CO 0.05 0.37 0.07 0.00 2.80 0.00 0.00 179.97 183.26 1j2q h ALA 92 N 1.30 1.27 0.00 2.80 0.00 -0.68 -0.79 119.26 123.16 1j2q h ALA 92 Ca 0.25 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1j2q h ALA 92 Cb 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1j2q h ALA 92 CO -0.17 0.50 -0.00 0.00 0.00 0.00 0.00 179.25 179.58 1j2q h ARG 93 N 0.68 -0.00 -0.02 0.00 3.08 0.23 -0.97 114.38 117.38 1j2q h ARG 93 Ca 0.15 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.23 1j2q h ARG 93 Cb 0.32 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.33 1j2q h ARG 93 CO 0.00 0.27 -0.17 0.82 -1.07 0.00 0.00 179.97 179.82 1j2q h ILE 94 N -0.27 0.59 -0.80 2.04 2.04 -0.75 -1.81 117.51 118.56 1j2q h ILE 94 Ca -0.00 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.04 1j2q h ILE 94 Cb 0.27 0.59 -0.12 0.00 -0.74 0.00 0.00 36.82 36.81 1j2q h ILE 94 CO 0.00 0.00 0.23 -0.08 0.00 0.00 0.00 178.15 178.30 1j2q h GLU 95 N -0.27 0.28 -0.06 2.37 4.57 -1.02 0.22 114.58 120.67 1j2q h GLU 95 Ca 0.06 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1j2q h GLU 95 Cb 0.35 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.87 1j2q h GLU 95 CO -0.17 0.18 0.03 0.00 -1.18 0.00 0.00 179.01 177.87 1j2q h ALA 96 N 1.66 0.08 -0.83 2.92 0.00 -0.38 -2.43 119.26 120.29 1j2q h ALA 96 Ca 0.47 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.28 1j2q h ALA 96 Cb 0.84 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 1j2q h ALA 96 CO -0.54 -0.37 0.38 1.96 0.00 0.00 0.00 179.25 180.68 1j2q h GLN 97 N -0.02 1.20 -0.82 0.00 1.08 -0.50 -2.16 115.11 113.89 1j2q h GLN 97 Ca 0.02 -0.19 0.07 0.00 -1.45 0.00 0.00 58.65 57.11 1j2q h GLN 97 Cb 0.11 -0.21 -0.07 0.00 -0.05 0.00 0.00 27.48 27.27 1j2q h GLN 97 CO -0.00 0.94 0.49 0.82 -0.95 0.00 0.00 178.83 180.13 1j2q h ILE 98 N 1.18 0.98 -0.82 2.54 2.04 -0.43 0.16 117.51 123.18 1j2q h ILE 98 Ca 0.28 -0.30 0.05 0.00 1.00 0.00 0.00 64.86 65.89 1j2q h ILE 98 Cb 0.14 0.04 -0.05 0.00 -0.74 0.00 0.00 36.82 36.20 1j2q h ILE 98 CO -0.03 0.16 0.51 -1.13 0.00 0.00 0.00 178.15 177.65 1j2q h ASN 99 N 0.87 0.82 -0.43 1.72 -1.24 -0.90 -0.79 115.58 115.63 1j2q h ASN 99 Ca 0.38 0.01 -0.03 0.00 0.71 0.00 0.00 56.30 57.37 1j2q h ASN 99 Cb 0.25 -0.17 -0.02 0.00 0.73 0.00 0.00 38.32 39.11 1j2q h ASN 99 CO -0.20 0.54 0.16 0.03 -1.29 0.00 0.00 177.43 176.67 1j2q h ARG 100 N 0.96 0.64 -0.85 6.67 3.08 -0.75 -0.92 114.38 123.21 1j2q h ARG 100 Ca 0.34 -0.12 0.06 0.00 0.07 0.00 0.00 59.98 60.33 1j2q h ARG 100 Cb 0.10 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 29.99 1j2q h ARG 100 CO -0.15 0.61 0.56 1.25 -1.07 0.00 0.00 179.97 181.17 1j2q h LEU 101 N 0.54 0.84 0.00 3.04 6.46 0.36 0.32 115.31 126.88 1j2q h LEU 101 Ca 0.14 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.89 1j2q h LEU 101 Cb 0.21 -0.18 -0.00 0.00 -0.73 0.00 0.00 40.66 39.96 1j2q h LEU 101 CO -0.01 0.55 -1.62 1.07 -0.62 0.00 0.00 178.44 177.80 1j2q n THR 102 N -4.48 0.30 -0.14 1.05 5.66 -0.41 -4.54 114.28 111.72 1j2q n THR 102 Ca 0.13 -0.53 0.00 0.00 -3.05 0.00 0.00 64.05 60.59 1j2q n THR 102 Cb 0.20 -0.16 0.00 0.00 -1.55 0.00 0.00 70.33 68.82 1j2q n THR 102 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 1j2q n TYR 103 N -2.44 0.00 -3.60 1.09 4.01 -0.36 -5.00 117.16 110.85 1j2q n TYR 103 Ca -0.03 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.47 1j2q n TYR 103 Cb 0.58 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.69 1j2q n TYR 103 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1j2q n ASP 104 N -0.37 -6.36 -3.68 7.72 4.64 0.11 -4.99 116.55 113.63 1j2q n ASP 104 Ca 0.00 -0.54 -0.14 0.00 -1.38 0.00 0.00 54.79 52.73 1j2q n ASP 104 Cb 0.03 -5.03 -0.08 0.00 -1.04 0.00 0.00 41.12 35.00 1j2q n ASP 104 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 1j2q s GLU 105 N -6.31 0.73 0.53 -0.67 2.02 -1.25 -5.02 118.70 108.73 1j2q s GLU 105 Ca 0.58 0.27 -0.21 0.00 0.02 0.00 0.00 54.97 55.63 1j2q s GLU 105 Cb -0.26 0.34 -0.05 0.00 0.10 0.00 0.00 34.13 34.26 1j2q s GLU 105 CO 0.73 -0.17 1.27 -1.25 0.02 0.00 0.00 175.26 175.86 1j2q s PRO 106 N -0.67 3.28 0.40 0.39 0.04 -1.26 -3.30 135.00 133.88 1j2q s PRO 106 Ca -0.08 2.02 -0.23 0.00 0.04 0.00 0.00 61.00 62.76 1j2q s PRO 106 Cb -0.03 -2.23 -0.10 0.00 0.04 0.00 0.00 34.50 32.17 1j2q s PRO 106 CO 0.04 -1.01 0.98 -1.50 0.04 0.00 0.00 177.00 175.55 1j2q s ILE 107 N -1.43 4.11 0.54 0.56 2.07 -1.26 -4.96 121.20 120.84 1j2q s ILE 107 Ca 0.70 1.50 -0.17 0.00 -1.41 0.00 0.00 60.65 61.27 1j2q s ILE 107 Cb -0.35 -3.72 -0.06 0.00 0.13 0.00 0.00 42.46 38.46 1j2q s ILE 107 CO 0.41 -0.10 1.02 0.42 -1.91 0.00 0.00 174.94 174.78 1j2q s THR 108 N -1.88 4.11 0.29 4.00 -4.23 -1.26 -4.91 115.64 111.76 1j2q s THR 108 Ca 0.58 1.08 -0.01 0.00 -1.18 0.00 0.00 61.69 62.16 1j2q s THR 108 Cb -0.16 -3.53 0.27 0.00 1.34 0.00 0.00 72.50 70.42 1j2q s THR 108 CO 0.20 -0.51 1.94 0.58 -0.54 0.00 0.00 174.62 176.29 1j2q h VAL 109 N 0.91 1.15 -0.25 2.29 2.07 -1.93 -1.85 116.25 118.63 1j2q h VAL 109 Ca -0.47 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 1j2q h VAL 109 Cb 1.20 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1j2q h VAL 109 CO 0.59 0.20 0.13 0.50 0.02 0.00 0.00 177.57 179.01 1j2q h LYS 110 N 1.11 0.36 -0.23 1.57 3.64 -1.97 -2.15 116.57 118.90 1j2q h LYS 110 Ca 0.35 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.67 1j2q h LYS 110 Cb 0.02 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1j2q h LYS 110 CO -0.10 0.35 0.10 0.93 -2.27 0.00 0.00 179.45 178.45 1j2q h GLU 111 N 0.28 0.34 -0.39 1.90 4.39 -1.86 -1.88 114.58 117.36 1j2q h GLU 111 Ca 0.09 -0.06 0.07 0.00 0.34 0.00 0.00 59.36 59.80 1j2q h GLU 111 Cb 0.10 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 28.64 1j2q h GLU 111 CO -0.01 0.37 0.04 1.25 -1.16 0.00 0.00 179.01 179.50 1j2q h LEU 112 N 0.23 -0.08 -0.18 1.33 5.85 -1.29 -1.00 115.31 120.18 1j2q h LEU 112 Ca 0.08 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.91 1j2q h LEU 112 Cb 0.15 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1j2q h LEU 112 CO -0.01 -0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.09 1j2q h ALA 113 N 1.32 0.15 -1.00 1.25 0.00 -1.18 -1.83 119.26 117.96 1j2q h ALA 113 Ca 0.19 0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.23 1j2q h ALA 113 Cb 0.25 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.05 1j2q h ALA 113 CO -0.28 -0.44 0.65 0.87 0.00 0.00 0.00 179.25 180.04 1j2q h LYS 114 N 0.06 1.10 -0.05 0.00 1.57 -0.84 -1.07 116.57 117.34 1j2q h LYS 114 Ca 0.08 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1j2q h LYS 114 Cb 0.10 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.16 1j2q h LYS 114 CO -0.14 0.73 0.01 0.87 -0.57 0.00 0.00 179.45 180.35 1j2q h LYS 115 N 1.13 0.08 0.00 3.15 1.57 -0.41 -0.11 116.57 121.98 1j2q h LYS 115 Ca 0.45 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 59.15 1j2q h LYS 115 Cb 0.25 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1j2q h LYS 115 CO -0.19 0.31 -0.28 -0.84 -0.57 0.00 0.00 179.45 177.88 1j2q h ILE 116 N -0.16 0.87 -0.14 1.86 3.07 -1.19 -0.31 117.51 121.51 1j2q h ILE 116 Ca 0.02 -1.12 -0.13 0.00 1.55 0.00 0.00 64.86 65.18 1j2q h ILE 116 Cb 0.27 1.67 -0.01 0.00 -0.27 0.00 0.00 36.82 38.48 1j2q h ILE 116 CO 0.00 0.28 -0.47 0.00 -1.05 0.00 0.00 178.15 176.91 1j2q h ASP 118 N 0.28 0.65 0.39 0.00 3.32 -0.40 -0.49 116.42 120.17 1j2q h ASP 118 Ca 0.02 -0.35 -0.02 0.00 0.02 0.00 0.00 57.03 56.70 1j2q h ASP 118 Cb 0.94 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.30 1j2q h ASP 118 CO 0.08 1.08 -0.21 0.15 -1.72 0.00 0.00 179.24 178.62 1j2q h PHE 119 N 0.44 -0.54 -0.30 4.55 3.57 -0.52 -2.71 116.94 121.43 1j2q h PHE 119 Ca 0.00 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 1j2q h PHE 119 Cb 1.12 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 40.03 1j2q h PHE 119 CO 0.05 -0.33 0.13 0.87 -2.23 0.00 0.00 178.31 176.79 1j2q h LYS 120 N -0.56 0.41 -0.35 1.11 1.57 -0.72 -2.71 116.57 115.32 1j2q h LYS 120 Ca -0.05 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1j2q h LYS 120 Cb 0.44 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 1j2q h LYS 120 CO 0.07 0.34 0.17 0.37 -0.57 0.00 0.00 179.45 179.82 1j2q h GLN 121 N 0.41 0.47 -0.65 3.15 -0.00 -0.77 -2.63 115.11 115.10 1j2q h GLN 121 Ca 0.10 -0.05 -0.07 0.00 -0.00 0.00 0.00 58.65 58.64 1j2q h GLN 121 Cb 0.08 -0.10 -0.03 0.00 0.00 0.00 0.00 27.48 27.43 1j2q h GLN 121 CO -0.01 0.37 0.14 1.96 0.00 0.00 0.00 178.83 181.29 1j2q h GLN 122 N 0.48 1.05 0.00 1.69 4.20 -1.33 -1.59 115.11 119.61 1j2q h GLN 122 Ca 0.12 -0.26 0.00 0.00 0.06 0.00 0.00 58.65 58.57 1j2q h GLN 122 Cb 0.05 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.70 1j2q h GLN 122 CO -0.02 0.96 0.00 0.66 -0.67 0.00 0.00 178.83 179.76 1j2q n TYR 123 N -4.28 0.00 0.26 2.96 4.01 -0.99 -1.47 117.16 117.65 1j2q n TYR 123 Ca 0.04 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.85 1j2q n TYR 123 Cb 0.26 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.20 1j2q n TYR 123 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 1j2q n THR 124 N -0.59 0.00 -2.30 -0.72 -1.04 -0.60 -2.47 114.28 106.56 1j2q n THR 124 Ca 0.02 -0.26 0.02 0.00 -2.04 0.00 0.00 64.05 61.79 1j2q n THR 124 Cb 0.01 0.51 0.01 0.00 -1.82 0.00 0.00 70.33 69.04 1j2q n THR 124 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1j2q n GLN 125 N -1.73 0.00 -2.86 -2.82 10.64 -0.54 -4.82 117.38 115.26 1j2q n GLN 125 Ca -0.01 -1.59 -0.25 0.00 -1.83 0.00 0.00 57.00 53.33 1j2q n GLN 125 Cb 0.31 -0.18 -0.03 0.00 -0.86 0.00 0.00 30.24 29.49 1j2q n GLN 125 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1j2q n TYR 126 N 0.30 3.18 0.00 2.61 4.01 -1.12 -5.05 117.16 121.09 1j2q n TYR 126 Ca 0.03 -3.71 0.00 0.00 -0.16 0.00 0.00 57.90 54.06 1j2q n TYR 126 Cb 0.97 -0.38 0.00 0.00 -0.31 0.00 0.00 39.34 39.61 1j2q n TYR 126 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1j2q n GLY 127 N -0.21 0.00 1.24 2.72 0.00 -1.26 -3.54 105.19 104.14 1j2q n GLY 127 Ca 0.31 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.28 1j2q n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j2q n GLY 128 N 0.00 2.47 3.38 -0.02 0.00 -1.26 -4.70 105.19 105.06 1j2q n GLY 128 Ca 0.00 -0.20 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 1j2q n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j2q s VAL 129 N -0.59 0.06 0.28 1.61 0.11 -1.23 -5.17 120.40 115.47 1j2q s VAL 129 Ca 0.10 -0.95 0.11 0.00 -2.93 0.00 0.00 61.98 58.31 1j2q s VAL 129 Cb 0.08 -1.53 -0.05 0.00 -1.53 0.00 0.00 36.38 33.36 1j2q s VAL 129 CO 0.02 -0.28 -0.11 0.00 -3.33 0.00 0.00 175.10 171.41 1j2q s ARG 130 N -3.88 1.96 0.89 1.54 1.70 -1.26 -4.78 118.95 115.12 1j2q s ARG 130 Ca 0.09 -1.63 -0.11 0.00 -0.47 0.00 0.00 55.73 53.61 1j2q s ARG 130 Cb 0.02 -1.94 0.13 0.00 -0.57 0.00 0.00 34.95 32.58 1j2q s ARG 130 CO -0.05 0.33 1.09 -2.14 -1.08 0.00 0.00 175.30 173.45 1j2q s PRO 131 N -3.59 1.28 -0.21 3.89 0.02 -1.03 -4.81 135.00 130.54 1j2q s PRO 131 Ca 0.31 0.89 -0.27 0.00 0.02 0.00 0.00 61.00 61.95 1j2q s PRO 131 Cb -0.05 -1.81 -0.00 0.00 0.02 0.00 0.00 34.50 32.66 1j2q s PRO 131 CO 0.17 -2.25 0.92 -0.06 -0.33 0.00 0.00 177.00 175.46 1j2q s PHE 132 N -2.90 3.36 -0.87 6.54 0.40 -1.26 -4.93 117.98 118.33 1j2q s PHE 132 Ca 0.63 1.32 -0.07 0.00 -0.60 0.00 0.00 56.93 58.21 1j2q s PHE 132 Cb -0.18 -3.14 -0.14 0.00 0.51 0.00 0.00 43.02 40.07 1j2q s PHE 132 CO 0.57 -0.38 2.90 0.41 0.70 0.00 0.00 175.22 179.42 1j2q n GLY 133 N 3.48 3.45 3.30 4.36 0.00 -1.26 -4.57 105.19 113.95 1j2q n GLY 133 Ca 0.08 -1.20 -0.14 0.00 0.00 0.00 0.00 46.02 44.76 1j2q n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j2q s VAL 134 N 2.05 0.05 0.04 1.61 0.11 -1.26 0.24 120.40 123.24 1j2q s VAL 134 Ca 0.60 -0.40 0.08 0.00 -2.93 0.00 0.00 61.98 59.32 1j2q s VAL 134 Cb 0.20 -0.75 -0.03 0.00 -1.53 0.00 0.00 36.38 34.28 1j2q s VAL 134 CO -0.03 -0.22 -0.22 -0.55 -3.33 0.00 0.00 175.10 170.75 1j2q s SER 135 N -1.44 2.59 0.07 3.54 0.15 0.18 -3.61 113.70 115.19 1j2q s SER 135 Ca -0.12 -0.52 0.08 0.00 0.70 0.00 0.00 55.95 56.09 1j2q s SER 135 Cb -0.03 -0.22 -0.03 0.00 -1.71 0.00 0.00 66.02 64.02 1j2q s SER 135 CO 0.04 0.18 -0.22 -0.76 1.20 0.00 0.00 173.24 173.68 1j2q s LEU 136 N -1.14 2.21 -0.28 3.45 1.43 -1.16 -1.15 118.68 122.05 1j2q s LEU 136 Ca 0.08 -0.59 -0.04 0.00 -1.03 0.00 0.00 54.13 52.55 1j2q s LEU 136 Cb -0.09 -1.03 0.02 0.00 0.03 0.00 0.00 46.19 45.12 1j2q s LEU 136 CO 0.02 0.16 0.01 -0.76 0.23 0.00 0.00 176.35 176.00 1j2q s LEU 137 N -1.44 3.57 -0.27 1.79 1.43 0.11 0.47 118.68 124.34 1j2q s LEU 137 Ca 0.09 -0.87 -0.03 0.00 -1.03 0.00 0.00 54.13 52.28 1j2q s LEU 137 Cb -0.09 -1.76 0.02 0.00 0.03 0.00 0.00 46.19 44.39 1j2q s LEU 137 CO 0.03 -0.18 -0.01 -0.63 0.23 0.00 0.00 176.35 175.79 1j2q s ILE 138 N 1.38 3.23 0.01 -0.59 1.01 0.78 0.28 121.20 127.30 1j2q s ILE 138 Ca 0.00 -0.94 0.07 0.00 0.00 0.00 0.00 60.65 59.79 1j2q s ILE 138 Cb -0.17 -2.66 -0.02 0.00 0.01 0.00 0.00 42.46 39.61 1j2q s ILE 138 CO -0.01 0.14 -0.22 0.00 0.00 0.00 0.00 174.94 174.85 1j2q s ALA 139 N 1.38 1.87 0.02 9.38 0.00 -0.15 -0.98 121.76 133.28 1j2q s ALA 139 Ca 0.01 -1.03 -0.04 0.00 0.00 0.00 0.00 51.96 50.89 1j2q s ALA 139 Cb -0.17 -0.43 0.01 0.00 0.00 0.00 0.00 23.12 22.54 1j2q s ALA 139 CO -0.02 0.44 0.19 0.41 0.00 0.00 0.00 175.76 176.79 1j2q n GLY 140 N 2.20 0.98 2.75 0.00 0.00 -0.86 -0.35 105.19 109.92 1j2q n GLY 140 Ca -0.16 -0.93 -0.27 0.00 0.00 0.00 0.00 46.02 44.66 1j2q n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j2q s VAL 141 N -2.37 0.54 0.00 1.61 1.01 -1.05 -0.76 120.40 119.39 1j2q s VAL 141 Ca 0.04 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.55 1j2q s VAL 141 Cb -0.00 -0.98 0.00 0.00 0.00 0.00 0.00 36.38 35.40 1j2q s VAL 141 CO 0.01 -0.12 0.00 0.47 0.00 0.00 0.00 175.10 175.45 1j2q n ASP 142 N 5.05 0.00 0.00 3.32 8.00 -1.26 -4.80 116.55 126.86 1j2q n ASP 142 Ca -0.09 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.52 1j2q n ASP 142 Cb 0.48 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.54 1j2q n ASP 142 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1j2q n GLU 143 N 0.00 0.03 -3.84 -1.24 0.28 -1.26 -4.90 120.64 109.71 1j2q n GLU 143 Ca 0.00 -0.01 -0.11 0.00 -0.16 0.00 0.00 57.16 56.88 1j2q n GLU 143 Cb 0.00 -1.50 -0.09 0.00 1.43 0.00 0.00 31.44 31.28 1j2q n GLU 143 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1j2q s VAL 144 N -3.02 0.09 0.59 3.84 1.01 -1.26 -5.11 120.40 116.54 1j2q s VAL 144 Ca 0.08 -0.74 -0.20 0.00 0.00 0.00 0.00 61.98 61.12 1j2q s VAL 144 Cb 0.16 -0.68 -0.03 0.00 0.00 0.00 0.00 36.38 35.83 1j2q s VAL 144 CO 0.83 -0.41 1.31 -2.84 0.00 0.00 0.00 175.10 174.00 1j2q s PRO 146 N -1.90 2.91 -0.00 2.72 0.02 -1.26 -4.54 135.00 132.95 1j2q s PRO 146 Ca -0.10 2.12 -0.06 0.00 0.02 0.00 0.00 61.00 62.97 1j2q s PRO 146 Cb -0.04 -2.07 0.00 0.00 0.02 0.00 0.00 34.50 32.41 1j2q s PRO 146 CO -0.00 -1.33 0.12 0.15 -0.33 0.00 0.00 177.00 175.60 1j2q s LYS 147 N -3.13 0.42 -0.05 5.54 1.02 0.06 -4.89 119.74 118.72 1j2q s LYS 147 Ca 0.76 -0.34 -0.02 0.00 0.02 0.00 0.00 55.97 56.40 1j2q s LYS 147 Cb -0.38 0.18 0.03 0.00 -0.52 0.00 0.00 37.83 37.14 1j2q s LYS 147 CO 0.43 -0.10 0.09 -1.17 -0.92 0.00 0.00 175.35 173.68 1j2q s LEU 148 N -1.18 0.44 0.10 3.17 2.96 -1.26 -2.02 118.68 120.88 1j2q s LEU 148 Ca -0.13 0.15 0.07 0.00 -0.22 0.00 0.00 54.13 54.01 1j2q s LEU 148 Cb -0.07 0.04 -0.03 0.00 0.50 0.00 0.00 46.19 46.63 1j2q s LEU 148 CO 0.01 -0.20 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.35 1j2q s TYR 149 N 1.75 1.56 -0.01 5.38 2.02 -0.15 -1.35 117.35 126.55 1j2q s TYR 149 Ca -0.01 -0.45 0.03 0.00 -0.37 0.00 0.00 57.07 56.27 1j2q s TYR 149 Cb -0.12 -0.86 -0.01 0.00 -0.40 0.00 0.00 41.96 40.58 1j2q s TYR 149 CO -0.04 0.16 -0.11 -1.83 -1.57 0.00 0.00 175.55 172.15 1j2q s GLU 150 N -1.96 1.00 0.28 -0.62 4.04 -0.31 -0.15 118.70 120.97 1j2q s GLU 150 Ca 0.04 -0.40 0.09 0.00 0.04 0.00 0.00 54.97 54.74 1j2q s GLU 150 Cb -0.09 -0.95 -0.04 0.00 0.02 0.00 0.00 34.13 33.06 1j2q s GLU 150 CO 0.04 0.22 0.07 0.95 -1.84 0.00 0.00 175.26 174.69 1j2q s THR 151 N -0.15 3.57 0.17 1.83 -4.23 0.18 -2.27 115.64 114.73 1j2q s THR 151 Ca 0.02 -1.76 0.09 0.00 -1.18 0.00 0.00 61.69 58.86 1j2q s THR 151 Cb -0.06 -2.99 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 1j2q s THR 151 CO -0.00 -0.33 -0.21 -0.62 -0.54 0.00 0.00 174.62 172.92 1j2q s ASP 152 N -3.75 2.93 0.62 3.99 2.15 -0.84 -2.97 116.67 118.81 1j2q s ASP 152 Ca 0.33 -0.84 0.28 0.00 0.43 0.00 0.00 52.55 52.75 1j2q s ASP 152 Cb -0.06 -0.19 1.48 0.00 -0.30 0.00 0.00 42.92 43.85 1j2q s ASP 152 CO 0.22 0.03 1.87 -0.65 -0.17 0.00 0.00 175.17 176.47 1j2q h PRO 153 N 3.35 0.00 0.00 4.34 0.11 -1.80 0.20 132.00 138.20 1j2q h PRO 153 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1j2q h PRO 153 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1j2q h PRO 153 CO 0.48 0.00 -0.10 0.66 -0.21 0.00 0.00 178.00 178.83 1j2q h SER 154 N 0.00 0.00 0.00 -2.05 4.64 -1.89 -3.40 113.55 110.84 1j2q h SER 154 Ca 0.13 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1j2q h SER 154 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1j2q h SER 154 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1j2q n GLY 155 N 1.18 1.07 3.76 -0.77 0.00 0.72 -4.14 105.19 107.01 1j2q n GLY 155 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 1j2q n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j2q s ALA 156 N -2.00 3.32 0.06 4.61 0.00 -1.25 -4.66 121.76 121.83 1j2q s ALA 156 Ca 0.00 0.55 0.08 0.00 0.00 0.00 0.00 51.96 52.60 1j2q s ALA 156 Cb 0.00 -3.17 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 1j2q s ALA 156 CO 0.00 0.21 -0.21 -1.17 0.00 0.00 0.00 175.76 174.59 1j2q s LEU 157 N -1.44 2.47 -0.12 0.00 0.20 -1.26 -1.99 118.68 116.55 1j2q s LEU 157 Ca 0.43 -0.52 -0.09 0.00 0.69 0.00 0.00 54.13 54.64 1j2q s LEU 157 Cb -0.23 -1.43 0.04 0.00 -0.43 0.00 0.00 46.19 44.13 1j2q s LEU 157 CO 0.29 0.24 0.31 -0.76 -0.29 0.00 0.00 176.35 176.14 1j2q s LEU 158 N -1.54 0.59 -0.26 -0.68 1.43 -0.96 -5.01 118.68 112.25 1j2q s LEU 158 Ca 0.14 0.64 -0.11 0.00 -1.03 0.00 0.00 54.13 53.78 1j2q s LEU 158 Cb -0.10 1.03 -0.05 0.00 0.03 0.00 0.00 46.19 47.10 1j2q s LEU 158 CO 0.05 -0.13 0.17 -0.70 0.23 0.00 0.00 176.35 175.96 1j2q s GLU 159 N 0.60 4.00 0.26 1.70 2.12 -1.26 -1.17 118.70 124.95 1j2q s GLU 159 Ca -0.04 -0.30 0.09 0.00 0.36 0.00 0.00 54.97 55.09 1j2q s GLU 159 Cb -0.05 -3.58 -0.04 0.00 0.26 0.00 0.00 34.13 30.72 1j2q s GLU 159 CO -0.04 -0.05 -0.01 0.71 -0.54 0.00 0.00 175.26 175.34 1j2q s TYR 160 N 1.38 2.70 -0.09 5.30 1.51 -0.46 -5.01 117.35 122.68 1j2q s TYR 160 Ca 0.07 -0.22 0.02 0.00 -1.01 0.00 0.00 57.07 55.93 1j2q s TYR 160 Cb -0.15 -1.20 -0.25 0.00 -0.11 0.00 0.00 41.96 40.26 1j2q s TYR 160 CO 0.07 0.62 0.47 1.63 -1.11 0.00 0.00 175.55 177.22 1j2q n LYS 161 N -0.85 0.70 -3.58 -0.62 5.02 -1.26 -4.24 118.16 113.33 1j2q n LYS 161 Ca -0.07 0.27 -0.15 0.00 -2.02 0.00 0.00 58.31 56.34 1j2q n LYS 161 Cb 0.59 -1.73 -0.06 0.00 -0.02 0.00 0.00 35.03 33.80 1j2q n LYS 161 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j2q s ALA 162 N -2.57 -1.81 -0.01 7.82 0.00 -1.26 -0.32 121.76 123.61 1j2q s ALA 162 Ca -0.15 1.66 -0.12 0.00 0.00 0.00 0.00 51.96 53.35 1j2q s ALA 162 Cb 0.07 -0.65 0.04 0.00 0.00 0.00 0.00 23.12 22.58 1j2q s ALA 162 CO 0.79 -0.34 0.55 -2.37 0.00 0.00 0.00 175.76 174.39 1j2q n THR 163 N 1.66 0.00 -3.67 0.00 5.66 -0.33 -5.02 114.28 112.58 1j2q n THR 163 Ca -0.16 -0.07 -0.10 0.00 -3.05 0.00 0.00 64.05 60.67 1j2q n THR 163 Cb 0.56 0.25 -0.03 0.00 -1.55 0.00 0.00 70.33 69.56 1j2q n THR 163 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1j2q s ALA 164 N -1.43 -1.07 0.07 1.79 0.00 -1.26 -1.24 121.76 118.62 1j2q s ALA 164 Ca 0.13 -0.07 0.01 0.00 0.00 0.00 0.00 51.96 52.03 1j2q s ALA 164 Cb -0.00 0.83 -0.04 0.00 0.00 0.00 0.00 23.12 23.91 1j2q s ALA 164 CO -0.00 -0.78 -0.06 0.96 0.00 0.00 0.00 175.76 175.88 1j2q s ILE 165 N -3.84 0.52 0.00 0.00 -4.36 -0.52 -4.84 121.20 108.15 1j2q s ILE 165 Ca 0.07 -1.69 0.00 0.00 -0.26 0.00 0.00 60.65 58.76 1j2q s ILE 165 Cb -0.01 -1.37 0.00 0.00 1.25 0.00 0.00 42.46 42.33 1j2q s ILE 165 CO -0.06 -0.80 0.00 0.61 0.24 0.00 0.00 174.94 174.94 1j2q n GLY 166 N 0.36 -1.83 0.19 6.27 0.00 -1.26 -1.39 105.19 107.53 1j2q n GLY 166 Ca -0.15 -2.16 -0.09 0.00 0.00 0.00 0.00 46.02 43.62 1j2q n GLY 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j2q h MET 167 N 2.84 0.60 0.00 1.61 -0.00 -0.27 -2.09 114.93 117.62 1j2q h MET 167 Ca 0.00 -0.11 0.00 0.00 -0.00 0.00 0.00 59.70 59.59 1j2q h MET 167 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 31.60 31.50 1j2q h MET 167 CO 0.00 0.58 0.00 0.41 -0.00 0.00 0.00 176.91 177.90 1j2q n GLY 168 N -0.75 -0.48 0.00 -3.00 0.00 -1.26 -4.35 105.19 95.36 1j2q n GLY 168 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1j2q n GLY 168 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1j2q n ARG 169 N -0.74 0.00 -0.33 1.61 0.63 -0.79 -2.46 116.66 114.58 1j2q n ARG 169 Ca 0.06 0.53 0.21 0.00 -0.92 0.00 0.00 57.85 57.73 1j2q n ARG 169 Cb 0.03 -1.07 0.40 0.00 0.45 0.00 0.00 32.46 32.27 1j2q n ARG 169 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 1j2q h ASN 170 N 0.00 -0.11 0.26 6.15 -0.26 -1.84 -0.06 115.58 119.72 1j2q h ASN 170 Ca 0.00 0.26 -0.00 0.00 -0.56 0.00 0.00 56.30 56.00 1j2q h ASN 170 Cb 0.00 0.37 -0.02 0.00 -1.06 0.00 0.00 38.32 37.62 1j2q h ASN 170 CO 0.00 -0.36 -0.32 0.00 -1.06 0.00 0.00 177.43 175.69 1j2q h ALA 171 N 1.96 -0.96 0.00 -0.83 0.00 -1.79 -0.54 119.26 117.11 1j2q h ALA 171 Ca 0.69 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.47 1j2q h ALA 171 Cb 1.60 0.60 -0.00 0.00 0.00 0.00 0.00 17.79 19.99 1j2q h ALA 171 CO -0.83 -1.00 -0.10 -0.39 0.00 0.00 0.00 179.25 176.93 1j2q h VAL 172 N -0.60 0.50 -0.17 0.00 -1.51 -1.04 -1.89 116.25 111.54 1j2q h VAL 172 Ca -0.03 -0.48 -0.04 0.00 -1.23 0.00 0.00 66.70 64.91 1j2q h VAL 172 Cb 0.54 1.32 -0.00 0.00 -2.13 0.00 0.00 31.29 31.01 1j2q h VAL 172 CO -0.08 0.10 -0.07 0.74 -1.23 0.00 0.00 177.57 177.03 1j2q h THR 173 N 0.00 1.30 -0.68 7.19 2.02 -0.56 -0.70 112.91 121.48 1j2q h THR 173 Ca -0.00 -1.09 -0.06 0.00 0.77 0.00 0.00 66.41 66.03 1j2q h THR 173 Cb 0.31 1.67 -0.03 0.00 -1.74 0.00 0.00 68.15 68.36 1j2q h THR 173 CO 0.01 0.32 0.18 -0.33 0.37 0.00 0.00 175.52 176.08 1j2q h GLU 174 N 0.03 1.08 0.83 6.66 5.08 -0.72 -0.47 114.58 127.07 1j2q h GLU 174 Ca 0.04 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.11 1j2q h GLU 174 Cb 0.53 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.64 1j2q h GLU 174 CO 0.02 0.95 -0.40 0.35 -1.00 0.00 0.00 179.01 178.94 1j2q h PHE 175 N 1.01 -1.03 -0.73 4.33 3.04 -1.26 -2.68 116.94 119.62 1j2q h PHE 175 Ca 0.22 -0.02 0.13 0.00 3.98 0.00 0.00 57.97 62.27 1j2q h PHE 175 Cb 0.34 0.34 -0.05 0.00 2.56 0.00 0.00 35.95 39.15 1j2q h PHE 175 CO 0.03 -0.63 0.49 0.74 -2.02 0.00 0.00 178.31 176.91 1j2q h PHE 176 N -1.20 0.53 -0.28 0.41 0.04 -1.09 0.20 116.94 115.55 1j2q h PHE 176 Ca -0.11 0.01 0.08 0.00 2.80 0.00 0.00 57.97 60.75 1j2q h PHE 176 Cb 0.86 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 38.83 1j2q h PHE 176 CO -0.01 0.22 0.34 1.49 -0.60 0.00 0.00 178.31 179.76 1j2q h GLU 177 N 0.47 0.00 0.00 1.51 4.57 -0.73 -1.37 114.58 119.02 1j2q h GLU 177 Ca 0.35 0.00 -0.29 0.00 -1.18 0.00 0.00 59.36 58.25 1j2q h GLU 177 Cb 0.72 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.27 1j2q h GLU 177 CO -0.12 0.00 -1.97 1.63 -1.18 0.00 0.00 179.01 177.37 1j2q n LYS 178 N -3.62 0.38 0.12 1.92 5.02 0.55 -4.82 118.16 117.72 1j2q n LYS 178 Ca 0.04 0.15 -0.23 0.00 -2.02 0.00 0.00 58.31 56.25 1j2q n LYS 178 Cb 0.48 -1.17 -0.14 0.00 -0.02 0.00 0.00 35.03 34.18 1j2q n LYS 178 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1j2q h GLU 179 N -0.49 0.54 -6.61 1.97 4.39 -1.03 -3.47 114.58 109.88 1j2q h GLU 179 Ca -0.43 -0.84 -0.59 0.00 0.34 0.00 0.00 59.36 57.84 1j2q h GLU 179 Cb 1.43 0.30 0.13 0.00 -0.10 0.00 0.00 28.75 30.51 1j2q h GLU 179 CO -0.22 1.39 0.12 0.98 -1.16 0.00 0.00 179.01 180.12 1j2q n TYR 180 N -3.72 1.05 -3.79 4.33 9.36 -0.52 -5.01 117.16 118.85 1j2q n TYR 180 Ca -0.15 0.57 -0.13 0.00 3.32 0.00 0.00 57.90 61.52 1j2q n TYR 180 Cb 1.05 -2.21 -0.12 0.00 -0.63 0.00 0.00 39.34 37.43 1j2q n TYR 180 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 1j2q s ARG 181 N -1.95 0.21 0.64 2.98 0.52 -1.26 -4.98 118.95 115.11 1j2q s ARG 181 Ca 0.63 0.31 0.34 0.00 -0.52 0.00 0.00 55.73 56.49 1j2q s ARG 181 Cb -0.57 0.06 1.86 0.00 0.52 0.00 0.00 34.95 36.82 1j2q s ARG 181 CO 0.57 -0.05 2.09 -0.44 0.02 0.00 0.00 175.30 177.49 1j2q h ASP 182 N 6.12 0.00 -0.52 0.23 3.45 -1.95 -2.19 116.42 121.56 1j2q h ASP 182 Ca -0.29 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.17 1j2q h ASP 182 Cb 1.19 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.96 1j2q h ASP 182 CO 0.39 0.00 0.00 -0.90 -1.57 0.00 0.00 179.24 177.16 1j2q n ASP 183 N -3.23 4.02 -4.63 6.45 5.68 -1.26 -4.60 116.55 118.98 1j2q n ASP 183 Ca -0.01 -2.35 -0.39 0.00 -0.50 0.00 0.00 54.79 51.55 1j2q n ASP 183 Cb 0.29 -0.47 0.04 0.00 -1.14 0.00 0.00 41.12 39.85 1j2q n ASP 183 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1j2q n LEU 184 N 0.79 3.53 -4.91 -2.12 4.77 -0.83 -4.98 117.00 113.25 1j2q n LEU 184 Ca 0.21 0.90 -0.27 0.00 -0.03 0.00 0.00 56.01 56.82 1j2q n LEU 184 Cb 0.73 -1.40 0.05 0.00 -2.33 0.00 0.00 43.42 40.47 1j2q n LEU 184 CO 0.17 -1.59 0.63 -0.94 -1.33 0.00 0.00 177.39 174.33 1j2q s SER 185 N -1.03 5.23 0.12 -1.43 1.04 -1.26 -4.40 113.70 111.96 1j2q s SER 185 Ca 0.71 0.74 -0.25 0.00 0.48 0.00 0.00 55.95 57.62 1j2q s SER 185 Cb -0.46 -1.54 -0.06 0.00 0.10 0.00 0.00 66.02 64.06 1j2q s SER 185 CO 0.51 -1.36 1.65 0.15 0.98 0.00 0.00 173.24 175.17 1j2q h PHE 186 N -0.49 -0.56 -0.63 5.02 3.57 -1.96 0.55 116.94 122.45 1j2q h PHE 186 Ca -0.45 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.00 1j2q h PHE 186 Cb 1.28 0.25 -0.03 0.00 2.79 0.00 0.00 35.95 40.24 1j2q h PHE 186 CO 0.42 -0.30 0.13 -0.44 -2.23 0.00 0.00 178.31 175.89 1j2q h ASP 187 N -0.36 0.94 0.44 0.41 3.32 -1.99 0.32 116.42 119.51 1j2q h ASP 187 Ca 0.05 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 56.88 1j2q h ASP 187 Cb 0.42 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1j2q h ASP 187 CO -0.18 0.92 -0.21 0.44 -1.72 0.00 0.00 179.24 178.50 1j2q h ASP 188 N 0.95 -0.50 -0.69 6.45 3.45 -1.80 0.34 116.42 124.62 1j2q h ASP 188 Ca 0.20 -0.03 0.12 0.00 0.43 0.00 0.00 57.03 57.76 1j2q h ASP 188 Cb 0.36 0.13 -0.09 0.00 -0.56 0.00 0.00 39.33 39.18 1j2q h ASP 188 CO 0.00 -0.29 0.25 0.00 -1.57 0.00 0.00 179.24 177.63 1j2q h ALA 189 N -0.14 0.93 -0.19 3.45 0.00 0.32 0.64 119.26 124.27 1j2q h ALA 189 Ca -0.06 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1j2q h ALA 189 Cb 0.49 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1j2q h ALA 189 CO 0.10 -0.22 0.03 1.98 0.00 0.00 0.00 179.25 181.15 1j2q h MET 190 N 0.41 0.31 -0.90 0.00 1.85 -0.67 -2.52 114.93 113.42 1j2q h MET 190 Ca 0.37 -0.08 0.03 0.00 -0.61 0.00 0.00 59.70 59.41 1j2q h MET 190 Cb 0.53 -0.04 -0.05 0.00 0.43 0.00 0.00 31.60 32.47 1j2q h MET 190 CO -0.38 0.47 0.58 0.28 -0.40 0.00 0.00 176.91 177.47 1j2q h VAL 191 N 0.11 1.16 -0.20 -5.77 2.07 -0.17 0.10 116.25 113.55 1j2q h VAL 191 Ca 0.06 -0.39 0.06 0.00 0.82 0.00 0.00 66.70 67.24 1j2q h VAL 191 Cb 0.31 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 1j2q h VAL 191 CO 0.00 0.21 0.15 0.25 0.02 0.00 0.00 177.57 178.20 1j2q h LEU 192 N 1.14 0.00 0.05 2.57 5.85 -0.74 -0.51 115.31 123.68 1j2q h LEU 192 Ca 0.35 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.91 1j2q h LEU 192 Cb -0.02 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.03 1j2q h LEU 192 CO -0.11 0.00 -0.65 1.23 -0.34 0.00 0.00 178.44 178.57 1j2q h GLY 193 N 0.00 0.39 1.50 3.75 0.00 -0.41 -2.17 103.07 106.13 1j2q h GLY 193 Ca 0.09 -0.79 0.02 0.00 0.00 0.00 0.00 47.33 46.65 1j2q h GLY 193 CO -0.00 0.69 0.31 1.41 0.00 0.00 0.00 176.54 178.95 1j2q h LEU 194 N -0.25 0.49 0.14 3.11 -0.00 -0.34 -1.05 115.31 117.41 1j2q h LEU 194 Ca -0.10 -0.01 -0.01 0.00 -0.00 0.00 0.00 57.88 57.77 1j2q h LEU 194 Cb 1.42 -0.12 0.00 0.00 -0.00 0.00 0.00 40.66 41.96 1j2q h LEU 194 CO 0.13 0.35 -0.07 0.58 -0.00 0.00 0.00 178.44 179.43 1j2q h VAL 195 N 0.58 1.00 -0.97 1.22 2.07 -1.13 0.04 116.25 119.05 1j2q h VAL 195 Ca 0.18 -0.64 0.18 0.00 0.82 0.00 0.00 66.70 67.24 1j2q h VAL 195 Cb 0.00 1.40 -0.11 0.00 -1.52 0.00 0.00 31.29 31.06 1j2q h VAL 195 CO -0.04 0.15 0.57 0.00 0.02 0.00 0.00 177.57 178.27 1j2q h ALA 196 N 0.31 1.59 -0.08 1.67 0.00 -0.74 0.25 119.26 122.25 1j2q h ALA 196 Ca -0.02 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1j2q h ALA 196 Cb 0.39 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1j2q h ALA 196 CO 0.03 -0.06 0.04 0.52 0.00 0.00 0.00 179.25 179.78 1j2q h MET 197 N 0.73 0.12 -0.09 0.00 2.07 -0.93 -1.12 114.93 115.71 1j2q h MET 197 Ca 0.56 -0.02 0.04 0.00 -2.07 0.00 0.00 59.70 58.21 1j2q h MET 197 Cb 0.86 -0.02 -0.06 0.00 -1.87 0.00 0.00 31.60 30.51 1j2q h MET 197 CO -0.39 0.20 -0.27 0.78 1.07 0.00 0.00 176.91 178.30 1j2q h GLY 198 N 0.01 -0.36 0.62 8.32 0.00 0.14 -0.08 103.07 111.73 1j2q h GLY 198 Ca 0.03 0.33 0.08 0.00 0.00 0.00 0.00 47.33 47.77 1j2q h GLY 198 CO -0.00 -0.21 0.47 1.41 0.00 0.00 0.00 176.54 178.21 1j2q h LEU 199 N -0.37 0.70 0.06 3.11 3.38 -0.96 0.32 115.31 121.56 1j2q h LEU 199 Ca 0.09 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.12 1j2q h LEU 199 Cb 0.50 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 1j2q h LEU 199 CO -0.30 0.43 -0.42 -1.28 0.09 0.00 0.00 178.44 176.96 1j2q h SER 200 N 0.83 -1.25 0.00 -0.43 0.87 0.19 -0.03 113.55 113.73 1j2q h SER 200 Ca 0.37 0.14 0.00 0.00 -1.23 0.00 0.00 61.79 61.07 1j2q h SER 200 Cb 0.26 0.48 0.00 0.00 -0.44 0.00 0.00 62.40 62.70 1j2q h SER 200 CO -0.21 -0.47 0.00 2.30 -0.53 0.00 0.00 176.83 177.92 1j2q n ILE 201 N -5.46 0.00 -3.24 2.23 -5.35 -0.19 -4.89 119.36 102.46 1j2q n ILE 201 Ca -0.07 0.00 -0.16 0.00 -0.27 0.00 0.00 62.75 62.25 1j2q n ILE 201 Cb 0.37 -0.43 0.07 0.00 -1.74 0.00 0.00 39.64 37.91 1j2q n ILE 201 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1j2q n GLU 202 N -0.89 -5.72 -3.26 6.28 4.07 -0.03 -4.97 120.64 116.12 1j2q n GLU 202 Ca 0.18 0.65 0.00 0.00 -0.06 0.00 0.00 57.16 57.92 1j2q n GLU 202 Cb 0.08 -5.11 0.00 0.00 -0.06 0.00 0.00 31.44 26.35 1j2q n GLU 202 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1j2q n SER 203 N -2.28 0.00 -4.78 4.31 3.41 -0.28 -5.01 113.62 108.99 1j2q n SER 203 Ca -0.09 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.17 1j2q n SER 203 Cb 0.58 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.52 1j2q n SER 203 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1j2q s GLU 204 N -1.97 3.55 0.30 4.33 2.02 -1.26 -4.39 118.70 121.27 1j2q s GLU 204 Ca 0.00 1.56 -0.06 0.00 0.02 0.00 0.00 54.97 56.48 1j2q s GLU 204 Cb 0.00 -2.09 -0.06 0.00 0.10 0.00 0.00 34.13 32.09 1j2q s GLU 204 CO 0.00 -0.68 0.59 -0.51 0.02 0.00 0.00 175.26 174.68 1j2q s LEU 205 N -3.59 4.03 -0.25 1.80 1.43 -1.26 -5.02 118.68 115.82 1j2q s LEU 205 Ca 0.70 0.81 -0.02 0.00 -1.03 0.00 0.00 54.13 54.59 1j2q s LEU 205 Cb -0.22 -3.63 0.02 0.00 0.03 0.00 0.00 46.19 42.38 1j2q s LEU 205 CO 0.26 -0.22 -0.05 -0.69 0.23 0.00 0.00 176.35 175.88 1j2q s VAL 206 N -2.10 3.01 0.42 -1.59 1.01 -1.26 -4.95 120.40 114.93 1j2q s VAL 206 Ca 0.46 -0.91 0.22 0.00 0.00 0.00 0.00 61.98 61.75 1j2q s VAL 206 Cb -0.11 -2.50 0.42 0.00 0.00 0.00 0.00 36.38 34.20 1j2q s VAL 206 CO 0.29 0.24 1.74 1.55 0.00 0.00 0.00 175.10 178.92 1j2q h PRO 207 N 8.04 0.29 0.00 2.72 0.13 -1.96 0.87 132.00 142.09 1j2q h PRO 207 Ca -0.34 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1j2q h PRO 207 Cb 1.12 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1j2q h PRO 207 CO 0.58 0.19 0.00 0.39 -0.23 0.00 0.00 178.00 178.93 1j2q n GLU 208 N -4.62 0.03 -2.21 0.86 1.02 -1.26 -3.16 120.64 111.30 1j2q n GLU 208 Ca 0.28 0.34 -0.03 0.00 -0.02 0.00 0.00 57.16 57.73 1j2q n GLU 208 Cb 1.03 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 31.00 1j2q n GLU 208 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1j2q n ASN 209 N -1.44 2.10 -3.85 1.62 2.04 0.30 -4.95 115.26 111.08 1j2q n ASN 209 Ca 0.02 -2.50 -0.12 0.00 -0.44 0.00 0.00 54.58 51.54 1j2q n ASN 209 Cb 0.07 -0.42 -0.12 0.00 -2.53 0.00 0.00 39.78 36.79 1j2q n ASN 209 CO 0.00 0.00 0.00 0.27 -0.44 0.00 0.00 177.26 177.09 1j2q s ILE 210 N -3.09 0.04 -0.01 1.53 -4.36 -1.19 -1.80 121.20 112.31 1j2q s ILE 210 Ca 0.34 -0.31 0.05 0.00 -0.26 0.00 0.00 60.65 60.48 1j2q s ILE 210 Cb 0.36 -0.29 -0.03 0.00 1.25 0.00 0.00 42.46 43.75 1j2q s ILE 210 CO -0.06 -0.17 -0.17 -0.70 0.24 0.00 0.00 174.94 174.08 1j2q s GLU 211 N -0.54 2.30 -0.03 0.37 2.12 -0.12 -4.86 118.70 117.94 1j2q s GLU 211 Ca -0.06 -0.83 0.01 0.00 0.36 0.00 0.00 54.97 54.45 1j2q s GLU 211 Cb -0.04 -2.26 0.02 0.00 0.26 0.00 0.00 34.13 32.11 1j2q s GLU 211 CO 0.01 0.59 -0.02 0.08 -0.54 0.00 0.00 175.26 175.37 1j2q s VAL 212 N -0.78 0.29 0.07 3.70 1.01 -1.26 -0.24 120.40 123.19 1j2q s VAL 212 Ca 0.12 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.09 1j2q s VAL 212 Cb -0.10 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 1j2q s VAL 212 CO 0.02 0.15 -0.05 -0.83 0.00 0.00 0.00 175.10 174.39 1j2q s GLY 213 N 0.75 0.58 0.35 4.51 0.00 0.04 -1.01 107.32 112.53 1j2q s GLY 213 Ca -0.08 -1.15 -0.17 0.00 0.00 0.00 0.00 44.72 43.31 1j2q s GLY 213 CO -0.01 -1.25 0.75 -2.52 0.00 0.00 0.00 173.10 170.07 1j2q s TYR 214 N -3.24 0.05 -0.25 1.90 -0.85 -0.41 -0.46 117.35 114.09 1j2q s TYR 214 Ca 0.05 -0.65 -0.02 0.00 -0.52 0.00 0.00 57.07 55.93 1j2q s TYR 214 Cb 0.03 0.76 0.13 0.00 0.38 0.00 0.00 41.96 43.26 1j2q s TYR 214 CO -0.06 -1.45 0.31 0.08 -1.52 0.00 0.00 175.55 172.92 1j2q s VAL 215 N -2.86 -0.46 0.14 -3.49 1.01 -0.92 -1.67 120.40 112.14 1j2q s VAL 215 Ca 0.15 -0.24 -0.28 0.00 0.00 0.00 0.00 61.98 61.61 1j2q s VAL 215 Cb -0.05 -0.85 -0.07 0.00 0.00 0.00 0.00 36.38 35.41 1j2q s VAL 215 CO 0.10 -0.27 0.87 -0.54 0.00 0.00 0.00 175.10 175.26 1j2q s LYS 216 N 2.42 4.66 0.66 2.72 1.02 -1.26 -2.63 119.74 127.33 1j2q s LYS 216 Ca 0.10 1.31 0.35 0.00 0.02 0.00 0.00 55.97 57.74 1j2q s LYS 216 Cb -0.15 -3.33 1.92 0.00 -0.52 0.00 0.00 37.83 35.75 1j2q s LYS 216 CO -0.22 0.37 2.09 -0.24 -0.92 0.00 0.00 175.35 176.44 1j2q h VAL 217 N 3.71 0.04 0.39 3.17 3.04 -1.48 -2.41 116.25 122.71 1j2q h VAL 217 Ca -0.44 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.23 1j2q h VAL 217 Cb 1.21 0.79 0.00 0.00 -2.01 0.00 0.00 31.29 31.28 1j2q h VAL 217 CO 0.69 0.00 -0.19 -2.24 -1.01 0.00 0.00 177.57 174.83 1j2q h ASP 218 N 0.00 -0.45 -1.54 3.17 2.03 -1.93 -3.37 116.42 114.35 1j2q h ASP 218 Ca 0.01 -0.05 -0.63 0.00 -0.73 0.00 0.00 57.03 55.63 1j2q h ASP 218 Cb 0.43 0.12 -0.38 0.00 -0.83 0.00 0.00 39.33 38.67 1j2q h ASP 218 CO -0.00 -0.00 -0.24 -0.90 -1.03 0.00 0.00 179.24 177.07 1j2q n ASP 219 N -5.13 5.54 0.00 4.15 5.75 -1.13 -4.99 116.55 120.74 1j2q n ASP 219 Ca -0.08 -3.76 0.00 0.00 -0.01 0.00 0.00 54.79 50.95 1j2q n ASP 219 Cb 0.24 -0.62 0.00 0.00 -1.03 0.00 0.00 41.12 39.71 1j2q n ASP 219 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1j2q n ARG 220 N -0.54 0.00 -4.14 0.11 3.00 -0.92 -4.77 116.66 109.40 1j2q n ARG 220 Ca 0.44 0.00 -0.23 0.00 -0.01 0.00 0.00 57.85 58.05 1j2q n ARG 220 Cb 0.59 0.00 -0.17 0.00 0.00 0.00 0.00 32.46 32.88 1j2q n ARG 220 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1j2q s THR 220 N 0.00 0.74 0.06 0.55 -4.23 -1.26 -3.90 115.64 107.60 1j2q s THR 220 Ca 0.00 -0.19 -0.30 0.00 -1.18 0.00 0.00 61.69 60.01 1j2q s THR 220 Cb 0.00 -0.76 -0.09 0.00 1.34 0.00 0.00 72.50 72.99 1j2q s THR 220 CO 0.00 0.29 1.89 0.12 -0.54 0.00 0.00 174.62 176.38 1j2q s PHE 221 N 1.19 1.66 0.15 3.99 2.19 0.15 -4.51 117.98 122.80 1j2q s PHE 221 Ca -0.06 -0.24 0.07 0.00 0.33 0.00 0.00 56.93 57.03 1j2q s PHE 221 Cb -0.14 -4.19 -0.04 0.00 -1.31 0.00 0.00 43.02 37.34 1j2q s PHE 221 CO -0.02 -5.17 -0.16 0.21 1.83 0.00 0.00 175.22 171.92 1j2q s LYS 222 N 3.79 1.15 -0.15 10.12 2.20 -0.67 -4.99 119.74 131.18 1j2q s LYS 222 Ca 0.84 -1.34 0.01 0.00 -0.36 0.00 0.00 55.97 55.13 1j2q s LYS 222 Cb -0.43 -1.10 0.00 0.00 -1.51 0.00 0.00 37.83 34.79 1j2q s LYS 222 CO 0.39 0.21 -0.18 -2.00 -0.36 0.00 0.00 175.35 173.42 1j2q s GLU 223 N -2.80 3.14 -0.02 4.03 2.12 -1.26 -1.29 118.70 122.61 1j2q s GLU 223 Ca 0.13 -0.79 -0.34 0.00 0.36 0.00 0.00 54.97 54.33 1j2q s GLU 223 Cb -0.05 -2.57 -0.12 0.00 0.26 0.00 0.00 34.13 31.65 1j2q s GLU 223 CO 0.05 -0.02 1.80 0.28 -0.54 0.00 0.00 175.26 176.83 1j2q n VAL 224 N 4.13 0.43 -1.82 3.70 0.31 -0.18 -4.95 118.33 119.94 1j2q n VAL 224 Ca -0.19 -0.08 -0.33 0.00 -0.01 0.00 0.00 64.34 63.73 1j2q n VAL 224 Cb 0.51 -1.77 0.04 0.00 -0.91 0.00 0.00 33.84 31.71 1j2q n VAL 224 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1j2q s SER 225 N 3.23 5.25 0.42 4.52 1.04 -1.26 -4.65 113.70 122.26 1j2q s SER 225 Ca 0.89 1.97 0.14 0.00 0.48 0.00 0.00 55.95 59.43 1j2q s SER 225 Cb -0.69 -2.55 1.02 0.00 0.10 0.00 0.00 66.02 63.90 1j2q s SER 225 CO 0.48 -1.53 1.94 1.55 0.98 0.00 0.00 173.24 176.66 1j2q h PRO 226 N 0.14 0.43 -0.13 4.02 0.13 -1.95 -0.28 132.00 134.36 1j2q h PRO 226 Ca -0.47 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 64.56 1j2q h PRO 226 Cb 1.24 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 1j2q h PRO 226 CO 0.55 0.28 -0.21 0.93 -0.23 0.00 0.00 178.00 179.32 1j2q h GLU 227 N 0.44 0.37 0.00 0.86 3.07 -1.99 -2.54 114.58 114.79 1j2q h GLU 227 Ca 0.34 -0.22 0.00 0.00 -0.50 0.00 0.00 59.36 58.97 1j2q h GLU 227 Cb 0.70 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.64 1j2q h GLU 227 CO -0.11 0.81 0.00 0.93 -1.40 0.00 0.00 179.01 179.24 1j2q h GLU 228 N -0.04 0.00 0.05 2.33 5.08 -1.71 -2.80 114.58 117.48 1j2q h GLU 228 Ca 0.01 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.28 1j2q h GLU 228 Cb 0.78 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.04 1j2q h GLU 228 CO 0.05 0.00 -0.38 -0.07 -1.00 0.00 0.00 179.01 177.61 1j2q h LEU 229 N 0.00 0.25 -0.15 1.33 3.38 -0.68 -3.39 115.31 116.04 1j2q h LEU 229 Ca 0.00 -0.90 0.01 0.00 0.09 0.00 0.00 57.88 57.08 1j2q h LEU 229 Cb 0.22 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1j2q h LEU 229 CO 0.00 1.13 -0.09 0.29 0.09 0.00 0.00 178.44 179.86 1j2q n LYS 230 N -4.40 -0.07 -0.19 1.13 4.01 -1.00 -0.00 118.16 117.65 1j2q n LYS 230 Ca -0.11 0.48 0.00 0.00 -0.51 0.00 0.00 58.31 58.17 1j2q n LYS 230 Cb 0.61 -0.71 0.10 0.00 -0.51 0.00 0.00 35.03 34.53 1j2q n LYS 230 CO 0.00 0.00 0.00 -1.00 -1.11 0.00 0.00 177.40 175.29 1j2q h PRO 231 N 0.00 0.24 -0.33 1.97 0.13 -1.76 -0.25 132.00 132.00 1j2q h PRO 231 Ca 0.02 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.11 1j2q h PRO 231 Cb 0.06 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 1j2q h PRO 231 CO -0.14 0.16 0.10 1.88 -0.23 0.00 0.00 178.00 179.76 1j2q h TYR 232 N 0.25 0.55 -0.24 1.56 -1.99 -0.62 -0.37 116.97 116.10 1j2q h TYR 232 Ca 0.31 -0.06 -0.00 0.00 2.00 0.00 0.00 58.73 60.98 1j2q h TYR 232 Cb 0.45 -0.16 -0.01 0.00 2.00 0.00 0.00 36.73 39.02 1j2q h TYR 232 CO -0.25 0.55 0.15 0.28 -0.00 0.00 0.00 178.16 178.89 1j2q h VAL 233 N 0.38 1.09 0.21 -2.88 2.07 -0.82 -1.10 116.25 115.20 1j2q h VAL 233 Ca 0.11 -0.20 0.01 0.00 0.82 0.00 0.00 66.70 67.43 1j2q h VAL 233 Cb 0.27 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 1j2q h VAL 233 CO -0.00 0.09 -0.36 -0.08 0.02 0.00 0.00 177.57 177.23 1j2q h GLU 233 N 0.31 -0.62 0.00 1.57 4.81 -0.92 0.68 114.58 120.41 1j2q h GLU 233 Ca 0.09 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1j2q h GLU 233 Cb 0.01 0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.53 1j2q h GLU 233 CO -0.02 -0.42 0.00 -0.09 -0.73 0.00 0.00 179.01 177.76 1j2q h ARG 233 N -0.65 0.00 0.06 1.92 2.43 -0.96 -2.33 114.38 114.85 1j2q h ARG 233 Ca 0.01 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 58.92 1j2q h ARG 233 Cb 0.64 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.17 1j2q h ARG 233 CO -0.16 0.00 -1.37 0.00 -1.51 0.00 0.00 179.97 176.94 1j2q h ALA 233 N 2.01 0.26 -0.53 2.80 0.00 -0.05 -3.30 119.26 120.45 1j2q h ALA 233 Ca 0.00 -1.17 0.15 0.00 0.00 0.00 0.00 54.91 53.89 1j2q h ALA 233 Cb 0.15 0.62 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1j2q h ALA 233 CO 0.00 0.81 0.46 -0.91 0.00 0.00 0.00 179.25 179.62 1j2q h ASN 233 N -0.60 0.00 0.00 0.00 -0.26 0.65 -0.68 115.58 114.70 1j2q h ASN 233 Ca -0.33 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.41 1j2q h ASN 233 Cb 1.55 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.81 1j2q h ASN 233 CO -0.07 0.00 0.00 1.21 -1.06 0.00 0.00 177.43 177.51 1j2q n GLU 233 N -3.99 0.00 0.26 0.81 4.07 -0.91 -1.43 120.64 119.45 1j2q n GLU 233 Ca 0.10 0.26 0.13 0.00 -0.06 0.00 0.00 57.16 57.60 1j2q n GLU 233 Cb 0.68 -1.15 0.71 0.00 -0.06 0.00 0.00 31.44 31.62 1j2q n GLU 233 CO 0.00 0.00 0.00 -0.09 -0.06 0.00 0.00 177.13 176.98 1j2q h ARG 233 N 0.00 0.00 0.41 5.31 2.43 -1.54 -2.08 114.38 118.91 1j2q h ARG 233 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1j2q h ARG 233 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1j2q h ARG 233 CO 0.00 0.00 -0.20 0.82 -1.51 0.00 0.00 179.97 179.08 1j2q h ILE 233 N 0.00 0.00 -0.54 1.20 2.04 -0.79 -3.28 117.51 116.14 1j2q h ILE 233 Ca 0.00 -0.52 0.11 0.00 1.00 0.00 0.00 64.86 65.44 1j2q h ILE 233 Cb 0.44 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.42 1j2q h ILE 233 CO 0.00 0.00 -0.22 0.03 0.00 0.00 0.00 178.15 177.96 1j2q h ARG 233 N -1.08 -0.09 0.00 2.37 3.08 -0.56 0.52 114.38 118.63 1j2q h ARG 233 Ca -0.06 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1j2q h ARG 233 Cb 0.42 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.49 1j2q h ARG 233 CO 0.09 -0.06 0.00 -1.91 -1.07 0.00 0.00 179.97 177.03 1j2q n GLU 233 N -5.42 0.00 -0.91 0.04 2.13 -0.97 -5.02 120.64 110.49 1j2q n GLU 233 Ca 0.05 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.86 1j2q n GLU 233 Cb 0.32 -0.85 0.00 0.00 0.27 0.00 0.00 31.44 31.19 1j2q n GLU 233 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1j2q n LEU 233 N 0.14 -0.23 0.00 4.31 4.77 0.18 -5.09 117.00 121.07 1j2q n LEU 233 Ca 0.00 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1j2q n LEU 233 Cb 0.00 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1j2q n LEU 233 CO 0.00 -0.06 0.00 1.17 -1.33 0.00 0.00 177.39 177.17