#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 -1.80 7.54 0.00 -1.26 -5.13 120.51 119.87 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 -0.74 0.00 -3.21 0.00 0.13 -1.26 -4.98 119.36 109.30 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 0.80 5.00 0.29 9.51 2.01 -1.26 -4.83 115.64 127.16 1j2q s THR 13 Ca 0.00 -1.16 0.02 0.00 0.31 0.00 0.00 61.69 60.86 1j2q s THR 13 Cb 0.00 -4.40 -0.05 0.00 0.01 0.00 0.00 72.50 68.06 1j2q s THR 13 CO 0.00 -0.97 0.08 0.68 -0.69 0.00 0.00 174.62 173.72 1j2q s VAL 14 N 2.20 0.81 0.34 3.82 -7.23 -1.26 -4.82 120.40 114.26 1j2q s VAL 14 Ca 0.08 -2.00 -0.26 0.00 -1.81 0.00 0.00 61.98 57.99 1j2q s VAL 14 Cb -0.26 -2.69 -0.09 0.00 0.56 0.00 0.00 36.38 33.90 1j2q s VAL 14 CO 0.05 0.00 1.02 -0.36 -0.31 0.00 0.00 175.10 175.51 1j2q s PHE 15 N -3.55 3.49 0.37 2.82 0.08 -1.26 -4.24 117.98 115.69 1j2q s PHE 15 Ca 0.37 1.71 0.06 0.00 0.12 0.00 0.00 56.93 59.19 1j2q s PHE 15 Cb 0.08 -3.09 -0.00 0.00 -0.57 0.00 0.00 43.02 39.44 1j2q s PHE 15 CO 0.15 -0.30 0.51 -1.54 -0.10 0.00 0.00 175.22 173.94 1j2q s SER 16 N -1.42 5.87 0.65 1.36 1.04 0.06 -4.94 113.70 116.33 1j2q s SER 16 Ca 0.52 -0.21 0.37 0.00 0.48 0.00 0.00 55.95 57.11 1j2q s SER 16 Cb -0.23 -1.10 2.06 0.00 0.10 0.00 0.00 66.02 66.84 1j2q s SER 16 CO 0.29 -0.55 2.20 -0.65 0.98 0.00 0.00 173.24 175.52 1j2q h PRO 17 N 0.78 0.00 0.00 4.02 0.11 -1.97 0.35 132.00 135.29 1j2q h PRO 17 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1j2q h PRO 17 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1j2q h PRO 17 CO 0.51 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.05 1j2q n ASP 18 N -3.19 0.00 0.00 -2.05 10.43 -1.26 -4.89 116.55 115.58 1j2q n ASP 18 Ca -0.02 0.39 0.00 0.00 2.57 0.00 0.00 54.79 57.73 1j2q n ASP 18 Cb 0.20 -0.46 0.00 0.00 1.84 0.00 0.00 41.12 42.70 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 1.46 0.53 3.62 0.44 0.00 0.12 -5.06 105.19 106.30 1j2q n GLY 19 Ca 0.08 -0.84 -0.24 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.54 2.07 -0.47 1.61 0.52 -1.25 -4.82 118.95 115.05 1j2q s ARG 20 Ca 0.00 -1.71 -0.10 0.00 -0.52 0.00 0.00 55.73 53.40 1j2q s ARG 20 Cb 0.00 -1.94 0.11 0.00 0.52 0.00 0.00 34.95 33.64 1j2q s ARG 20 CO 0.00 0.18 0.36 -0.51 0.02 0.00 0.00 175.30 175.35 1j2q s LEU 21 N -3.69 5.70 0.27 2.53 1.02 -1.26 -0.76 118.68 122.49 1j2q s LEU 21 Ca 0.34 -1.84 -0.01 0.00 0.02 0.00 0.00 54.13 52.64 1j2q s LEU 21 Cb -0.01 -2.04 0.47 0.00 0.02 0.00 0.00 46.19 44.63 1j2q s LEU 21 CO 0.19 -0.70 1.83 -0.26 0.02 0.00 0.00 176.35 177.44 1j2q h PHE 22 N 8.51 1.06 -0.76 0.29 0.04 -1.96 -1.14 116.94 122.97 1j2q h PHE 22 Ca -0.23 0.03 0.05 0.00 2.80 0.00 0.00 57.97 60.63 1j2q h PHE 22 Cb 1.08 -0.33 -0.05 0.00 2.20 0.00 0.00 35.95 38.84 1j2q h PHE 22 CO 0.65 0.44 0.46 1.96 -0.60 0.00 0.00 178.31 181.22 1j2q h GLN 23 N 0.96 0.83 -0.59 1.51 1.08 -1.88 0.52 115.11 117.54 1j2q h GLN 23 Ca 0.45 -0.05 -0.09 0.00 -1.45 0.00 0.00 58.65 57.51 1j2q h GLN 23 Cb 0.39 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.61 1j2q h GLN 23 CO -0.24 0.55 0.01 0.28 -0.95 0.00 0.00 178.83 178.47 1j2q h VAL 24 N 0.86 1.26 -0.49 -0.54 2.07 -1.70 -0.01 116.25 117.70 1j2q h VAL 24 Ca 0.33 -1.13 -0.12 0.00 0.82 0.00 0.00 66.70 66.59 1j2q h VAL 24 Cb 0.13 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1j2q h VAL 24 CO -0.16 0.41 -0.18 -0.33 0.02 0.00 0.00 177.57 177.33 1j2q h GLU 25 N 0.92 0.98 -0.51 1.57 5.08 -0.33 -1.33 114.58 120.97 1j2q h GLU 25 Ca 0.17 -0.40 -0.08 0.00 -1.00 0.00 0.00 59.36 58.05 1j2q h GLU 25 Cb 0.54 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1j2q h GLU 25 CO 0.03 1.07 0.00 1.88 -1.00 0.00 0.00 179.01 181.00 1j2q h TYR 26 N 0.86 0.91 -0.93 4.33 0.05 0.22 -1.97 116.97 120.45 1j2q h TYR 26 Ca 0.12 -0.13 0.01 0.00 0.05 0.00 0.00 58.73 58.78 1j2q h TYR 26 Cb 0.75 -0.25 -0.05 0.00 1.01 0.00 0.00 36.73 38.20 1j2q h TYR 26 CO 0.05 0.83 0.61 0.00 -1.05 0.00 0.00 178.16 178.60 1j2q h ALA 27 N 1.21 1.18 -0.28 3.88 0.00 -0.60 0.11 119.26 124.76 1j2q h ALA 27 Ca 0.15 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1j2q h ALA 27 Cb 0.47 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1j2q h ALA 27 CO 0.02 0.56 0.15 0.00 0.00 0.00 0.00 179.25 179.98 1j2q h ARG 28 N 1.24 0.37 -0.01 0.00 3.08 -0.52 0.03 114.38 118.58 1j2q h ARG 28 Ca 0.34 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.34 1j2q h ARG 28 Cb -0.12 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 29.84 1j2q h ARG 28 CO -0.08 0.28 -0.12 0.93 -1.07 0.00 0.00 179.97 179.91 1j2q h GLU 29 N 0.38 0.02 -0.22 0.04 4.39 -0.42 -2.04 114.58 116.72 1j2q h GLU 29 Ca 0.10 -0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.63 1j2q h GLU 29 Cb 0.02 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1j2q h GLU 29 CO -0.02 0.14 -0.55 0.00 -1.16 0.00 0.00 179.01 177.42 1j2q h ALA 30 N 1.86 0.61 -0.20 3.43 0.00 -0.77 -3.02 119.26 121.16 1j2q h ALA 30 Ca 0.00 -0.51 -0.11 0.00 0.00 0.00 0.00 54.91 54.28 1j2q h ALA 30 Cb 0.23 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1j2q h ALA 30 CO 0.02 0.69 -0.37 -0.24 0.00 0.00 0.00 179.25 179.35 1j2q h VAL 31 N 0.52 1.30 -0.97 0.00 3.04 -1.14 -2.70 116.25 116.30 1j2q h VAL 31 Ca 0.01 -1.48 0.03 0.00 -1.01 0.00 0.00 66.70 64.25 1j2q h VAL 31 Cb 1.12 1.55 -0.05 0.00 -2.01 0.00 0.00 31.29 31.89 1j2q h VAL 31 CO 0.11 0.46 0.64 0.11 -1.01 0.00 0.00 177.57 177.88 1j2q h LYS 32 N 0.37 1.22 0.00 4.17 1.57 -1.30 0.11 116.57 122.71 1j2q h LYS 32 Ca 0.04 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1j2q h LYS 32 Cb 0.82 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1j2q h LYS 32 CO 0.07 0.81 0.00 -2.13 -0.57 0.00 0.00 179.45 177.62 1j2q n ARG 33 N -4.45 0.16 -1.19 3.15 0.63 -1.03 -1.37 116.66 112.56 1j2q n ARG 33 Ca 0.12 0.38 -0.32 0.00 -0.92 0.00 0.00 57.85 57.12 1j2q n ARG 33 Cb 0.07 -1.80 0.11 0.00 0.45 0.00 0.00 32.46 31.28 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 -3.45 1.90 0.44 5.14 0.00 0.37 -4.72 107.32 107.00 1j2q s GLY 34 Ca 0.05 0.55 -0.25 0.00 0.00 0.00 0.00 44.72 45.07 1j2q s GLY 34 CO 0.37 0.93 1.34 0.00 0.00 0.00 0.00 173.10 175.75 1j2q s ALA 35 N -2.54 3.18 0.34 3.20 0.00 -1.26 -1.26 121.76 123.42 1j2q s ALA 35 Ca 0.67 1.30 -0.26 0.00 0.00 0.00 0.00 51.96 53.67 1j2q s ALA 35 Cb -0.22 -3.52 -0.09 0.00 0.00 0.00 0.00 23.12 19.28 1j2q s ALA 35 CO 0.52 -1.01 1.00 -0.08 0.00 0.00 0.00 175.76 176.19 1j2q s THR 36 N -1.27 3.94 0.01 0.00 -1.32 -1.26 -4.46 115.64 111.28 1j2q s THR 36 Ca 0.61 1.63 0.01 0.00 -1.21 0.00 0.00 61.69 62.73 1j2q s THR 36 Cb -0.40 -3.91 -0.01 0.00 -1.51 0.00 0.00 72.50 66.67 1j2q s THR 36 CO 0.50 0.15 -0.05 0.00 -2.21 0.00 0.00 174.62 173.01 1j2q s ALA 37 N -1.54 0.40 0.05 11.08 0.00 -0.32 -2.20 121.76 129.23 1j2q s ALA 37 Ca 0.51 -0.34 0.06 0.00 0.00 0.00 0.00 51.96 52.20 1j2q s ALA 37 Cb -0.22 -0.05 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 1j2q s ALA 37 CO 0.28 0.05 -0.17 0.42 0.00 0.00 0.00 175.76 176.34 1j2q s ILE 38 N -0.45 1.39 -0.02 0.00 1.01 0.61 -1.47 121.20 122.27 1j2q s ILE 38 Ca -0.02 -1.15 0.01 0.00 0.00 0.00 0.00 60.65 59.49 1j2q s ILE 38 Cb -0.04 -1.24 0.01 0.00 0.01 0.00 0.00 42.46 41.20 1j2q s ILE 38 CO -0.00 0.06 -0.03 -0.83 0.00 0.00 0.00 174.94 174.14 1j2q s GLY 39 N -1.27 0.30 -0.04 6.18 0.00 -0.57 -0.29 107.32 111.64 1j2q s GLY 39 Ca 0.04 -0.02 0.03 0.00 0.00 0.00 0.00 44.72 44.76 1j2q s GLY 39 CO 0.02 0.28 -0.10 -0.42 0.00 0.00 0.00 173.10 172.87 1j2q s ILE 40 N 0.58 0.91 -0.10 0.90 1.01 -0.21 -1.33 121.20 122.96 1j2q s ILE 40 Ca -0.07 -0.41 0.02 0.00 0.00 0.00 0.00 60.65 60.20 1j2q s ILE 40 Cb -0.10 -0.81 -0.01 0.00 0.01 0.00 0.00 42.46 41.55 1j2q s ILE 40 CO -0.01 0.28 -0.17 -0.75 0.00 0.00 0.00 174.94 174.30 1j2q s LYS 41 N 0.30 3.03 0.08 2.79 2.20 0.05 -0.41 119.74 127.78 1j2q s LYS 41 Ca -0.06 -0.75 0.01 0.00 -0.36 0.00 0.00 55.97 54.81 1j2q s LYS 41 Cb -0.11 -2.46 -0.00 0.00 -1.51 0.00 0.00 37.83 33.75 1j2q s LYS 41 CO 0.01 0.32 0.03 0.00 -0.36 0.00 0.00 175.35 175.35 1j2q h LYS 43 N 0.00 0.76 0.00 0.00 3.64 -1.81 -3.14 116.57 116.01 1j2q h LYS 43 Ca -0.06 -0.54 0.00 0.00 -1.27 0.00 0.00 60.65 58.78 1j2q h LYS 43 Cb 0.24 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1j2q h LYS 43 CO 0.09 1.16 0.00 0.39 -2.27 0.00 0.00 179.45 178.82 1j2q n GLU 44 N -3.96 0.24 -2.95 1.90 1.02 -1.26 -4.74 120.64 110.90 1j2q n GLU 44 Ca -0.05 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1j2q n GLU 44 Cb 0.68 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 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 0.82 -0.31 2.89 0.62 0.00 -1.19 -1.09 105.19 106.93 1j2q n GLY 45 Ca 0.10 -1.35 -0.18 0.00 0.00 0.00 0.00 46.02 44.59 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 -2.92 0.39 0.09 1.61 0.11 -1.12 -0.37 120.40 118.20 1j2q s VAL 46 Ca 0.00 -0.09 0.06 0.00 -2.93 0.00 0.00 61.98 59.02 1j2q s VAL 46 Cb 0.00 -0.41 -0.04 0.00 -1.53 0.00 0.00 36.38 34.40 1j2q s VAL 46 CO 0.00 0.17 -0.05 -0.63 -3.33 0.00 0.00 175.10 171.25 1j2q s ILE 47 N 0.64 3.68 -0.08 7.04 1.09 0.45 -2.17 121.20 131.85 1j2q s ILE 47 Ca -0.07 -1.12 -0.00 0.00 -1.10 0.00 0.00 60.65 58.35 1j2q s ILE 47 Cb -0.11 -2.73 0.02 0.00 -1.06 0.00 0.00 42.46 38.58 1j2q s ILE 47 CO -0.00 0.12 -0.05 -0.22 -0.10 0.00 0.00 174.94 174.69 1j2q s LEU 48 N -2.23 1.07 -0.03 2.97 2.96 0.91 -1.04 118.68 123.29 1j2q s LEU 48 Ca 0.23 -0.19 0.04 0.00 -0.22 0.00 0.00 54.13 53.99 1j2q s LEU 48 Cb -0.11 -0.62 -0.00 0.00 0.50 0.00 0.00 46.19 45.95 1j2q s LEU 48 CO 0.16 -0.11 -0.16 -0.51 -1.32 0.00 0.00 176.35 174.41 1j2q s ILE 49 N 1.50 1.29 0.09 6.68 2.07 0.60 -0.40 121.20 133.02 1j2q s ILE 49 Ca -0.01 -0.65 0.06 0.00 -1.41 0.00 0.00 60.65 58.64 1j2q s ILE 49 Cb -0.13 -1.11 -0.03 0.00 0.13 0.00 0.00 42.46 41.32 1j2q s ILE 49 CO -0.04 0.37 -0.16 0.00 -1.91 0.00 0.00 174.94 173.20 1j2q s ALA 50 N -0.01 1.38 -0.46 1.50 0.00 0.41 -0.28 121.76 124.30 1j2q s ALA 50 Ca -0.02 -1.10 -0.29 0.00 0.00 0.00 0.00 51.96 50.56 1j2q s ALA 50 Cb -0.10 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.90 1j2q s ALA 50 CO 0.01 0.21 1.40 0.34 0.00 0.00 0.00 175.76 177.72 1j2q s ASP 51 N -1.87 6.29 0.00 0.00 3.68 -0.93 -1.12 116.67 122.71 1j2q s ASP 51 Ca 0.02 0.65 0.24 0.00 2.13 0.00 0.00 52.55 55.59 1j2q s ASP 51 Cb -0.09 -2.54 0.26 0.00 -1.45 0.00 0.00 42.92 39.10 1j2q s ASP 51 CO 0.03 -1.51 1.25 1.17 0.13 0.00 0.00 175.17 176.24 1j2q n LYS 52 N 8.23 0.71 -1.52 4.34 4.81 -0.74 -4.84 118.16 129.14 1j2q n LYS 52 Ca 0.15 -0.52 -0.49 0.00 -0.87 0.00 0.00 58.31 56.58 1j2q n LYS 52 Cb 0.48 -1.49 -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 -0.69 0.74 -4.37 1.64 1.74 -0.64 -4.83 116.66 110.25 1j2q n ARG 53 Ca 0.09 0.26 -0.24 0.00 -0.77 0.00 0.00 57.85 57.19 1j2q n ARG 53 Cb 0.39 -1.58 -0.09 0.00 -1.02 0.00 0.00 32.46 30.16 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 -0.62 2.86 -0.55 1.55 0.11 -1.26 -5.06 120.40 117.43 1j2q s VAL 54 Ca 0.69 -2.11 0.16 0.00 -2.93 0.00 0.00 61.98 57.79 1j2q s VAL 54 Cb -0.88 -2.64 0.67 0.00 -1.53 0.00 0.00 36.38 32.00 1j2q s VAL 54 CO 0.56 -0.33 1.59 0.61 -3.33 0.00 0.00 175.10 174.19 1j2q n GLY 55 N -0.82 3.20 3.64 6.54 0.00 -1.26 -4.96 105.19 111.54 1j2q n GLY 55 Ca -0.05 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.17 -0.64 0.00 1.61 0.15 -1.26 -5.00 113.70 107.39 1j2q s SER 56 Ca 0.48 1.19 0.11 0.00 0.70 0.00 0.00 55.95 58.42 1j2q s SER 56 Cb 0.35 1.22 0.48 0.00 -1.71 0.00 0.00 66.02 66.35 1j2q s SER 56 CO 0.17 -0.20 1.33 2.29 1.20 0.00 0.00 173.24 178.03 1j2q n LYS 57 N 2.78 0.02 0.08 5.44 2.85 -1.26 -2.35 118.16 125.72 1j2q n LYS 57 Ca -0.14 0.29 0.13 0.00 -1.05 0.00 0.00 58.31 57.54 1j2q n LYS 57 Cb 0.56 -1.50 0.43 0.00 -0.65 0.00 0.00 35.03 33.87 1j2q n LYS 57 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1j2q n LEU 58 N -1.47 0.66 -4.79 -5.58 4.32 -1.26 -4.81 117.00 104.06 1j2q n LEU 58 Ca 0.03 0.54 -0.39 0.00 -0.02 0.00 0.00 56.01 56.17 1j2q n LEU 58 Cb 0.12 -0.34 -0.06 0.00 -1.62 0.00 0.00 43.42 41.52 1j2q n LEU 58 CO 0.10 -0.14 0.35 -0.76 -1.22 0.00 0.00 177.39 175.72 1j2q s LEU 59 N -4.22 4.53 -0.80 2.23 2.01 -0.99 -4.98 118.68 116.46 1j2q s LEU 59 Ca 0.11 1.37 -0.25 0.00 0.01 0.00 0.00 54.13 55.37 1j2q s LEU 59 Cb 0.14 -3.03 -0.02 0.00 0.01 0.00 0.00 46.19 43.28 1j2q s LEU 59 CO 0.59 0.22 1.82 -1.61 1.01 0.00 0.00 176.35 178.39 1j2q s GLU 60 N -0.95 2.72 0.16 1.70 0.41 -1.26 -4.81 118.70 116.67 1j2q s GLU 60 Ca 0.32 -0.05 -0.10 0.00 -0.41 0.00 0.00 54.97 54.73 1j2q s GLU 60 Cb -0.20 -4.80 0.01 0.00 -1.78 0.00 0.00 34.13 27.36 1j2q s GLU 60 CO 0.21 -2.96 1.53 0.00 -0.49 0.00 0.00 175.26 173.55 1j2q h ALA 61 N 12.35 0.66 -0.04 5.21 0.00 -1.93 -2.88 119.26 132.64 1j2q h ALA 61 Ca -0.04 -0.42 0.01 0.00 0.00 0.00 0.00 54.91 54.46 1j2q h ALA 61 Cb 1.06 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1j2q h ALA 61 CO 1.24 0.67 0.11 0.38 0.00 0.00 0.00 179.25 181.65 1j2q h ASP 62 N 0.81 0.00 0.00 0.00 -0.00 -1.92 -3.13 116.42 112.17 1j2q h ASP 62 Ca 0.09 0.00 -0.07 0.00 -0.00 0.00 0.00 57.03 57.05 1j2q h ASP 62 Cb 0.86 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.18 1j2q h ASP 62 CO 0.08 0.00 -0.68 0.74 -0.00 0.00 0.00 179.24 179.38 1j2q h THR 63 N 0.00 0.31 -0.57 1.15 2.02 -1.91 -3.48 112.91 110.43 1j2q h THR 63 Ca 0.02 -1.38 -0.50 0.00 0.77 0.00 0.00 66.41 65.32 1j2q h THR 63 Cb 0.23 0.73 0.01 0.00 -1.74 0.00 0.00 68.15 67.38 1j2q h THR 63 CO -0.00 0.11 0.36 0.00 0.37 0.00 0.00 175.52 176.35 1j2q n ILE 64 N -4.57 0.00 -4.75 3.11 3.06 -1.12 -4.92 119.36 110.16 1j2q n ILE 64 Ca -0.14 0.00 -0.33 0.00 -2.50 0.00 0.00 62.75 59.78 1j2q n ILE 64 Cb 0.37 -0.26 -0.15 0.00 0.54 0.00 0.00 39.64 40.15 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 1.55 3.34 0.00 9.51 2.12 -1.26 -5.00 118.70 128.96 1j2q s GLU 65 Ca 0.59 -0.70 0.02 0.00 0.36 0.00 0.00 54.97 55.23 1j2q s GLU 65 Cb -0.84 -2.62 -0.02 0.00 0.26 0.00 0.00 34.13 30.91 1j2q s GLU 65 CO 0.45 0.18 0.08 1.63 -0.54 0.00 0.00 175.26 177.06 1j2q n LYS 66 N 3.62 6.30 -4.10 4.30 4.01 -1.26 -4.95 118.16 126.08 1j2q n LYS 66 Ca -0.18 -0.02 -0.33 0.00 -0.51 0.00 0.00 58.31 57.27 1j2q n LYS 66 Cb 0.53 -0.59 -0.16 0.00 -0.51 0.00 0.00 35.03 34.30 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 -1.12 2.16 0.00 -0.18 1.01 -1.26 -4.25 121.20 117.55 1j2q s ILE 67 Ca 0.01 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 59.74 1j2q s ILE 67 Cb 0.01 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.53 1j2q s ILE 67 CO 0.06 0.52 0.05 -0.31 0.00 0.00 0.00 174.94 175.26 1j2q s TYR 68 N 1.30 3.20 -0.19 3.97 1.51 0.50 -4.92 117.35 122.72 1j2q s TYR 68 Ca 0.05 0.15 -0.21 0.00 -1.01 0.00 0.00 57.07 56.05 1j2q s TYR 68 Cb -0.13 -1.71 -0.03 0.00 -0.11 0.00 0.00 41.96 39.99 1j2q s TYR 68 CO -0.12 0.52 0.64 0.21 -1.11 0.00 0.00 175.55 175.69 1j2q s LYS 69 N -1.70 4.23 -0.24 -0.62 2.20 -1.26 0.07 119.74 122.41 1j2q s LYS 69 Ca 0.22 0.64 -0.18 0.00 -0.36 0.00 0.00 55.97 56.29 1j2q s LYS 69 Cb -0.12 -3.57 -0.16 0.00 -1.51 0.00 0.00 37.83 32.47 1j2q s LYS 69 CO 0.13 -0.23 -0.06 -0.89 -0.36 0.00 0.00 175.35 173.94 1j2q n ILE 70 N 4.64 1.53 -3.80 5.43 2.08 0.14 -4.94 119.36 124.44 1j2q n ILE 70 Ca -0.01 -0.20 0.00 0.00 0.56 0.00 0.00 62.75 63.10 1j2q n ILE 70 Cb 0.50 -1.97 0.00 0.00 -0.75 0.00 0.00 39.64 37.42 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 -4.35 0.00 -0.02 4.38 4.64 -0.86 -4.69 116.55 115.65 1j2q n ASP 71 Ca -0.43 -0.95 -0.02 0.00 -1.38 0.00 0.00 54.79 52.00 1j2q n ASP 71 Cb 0.78 0.00 0.23 0.00 -1.04 0.00 0.00 41.12 41.09 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 0.57 -0.24 -0.67 4.39 -1.97 -3.09 114.58 113.58 1j2q h GLU 72 Ca 0.00 -0.16 -0.01 0.00 0.34 0.00 0.00 59.36 59.53 1j2q h GLU 72 Cb 0.00 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1j2q h GLU 72 CO 0.00 0.66 -0.00 -2.39 -1.16 0.00 0.00 179.01 176.12 1j2q n HIS 73 N -4.21 0.86 -3.77 4.33 1.44 -1.25 0.75 115.22 113.37 1j2q n HIS 73 Ca 0.01 -0.93 -0.13 0.00 -2.01 0.00 0.00 57.72 54.66 1j2q n HIS 73 Cb 0.31 -0.31 -0.13 0.00 0.12 0.00 0.00 29.99 29.99 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 -2.86 -0.02 0.29 0.61 1.01 -1.17 -2.39 121.20 116.67 1j2q s ILE 74 Ca 0.41 0.07 0.02 0.00 0.00 0.00 0.00 60.65 61.16 1j2q s ILE 74 Cb 0.34 -0.33 -0.05 0.00 0.01 0.00 0.00 42.46 42.43 1j2q s ILE 74 CO 0.08 0.03 0.11 0.00 0.00 0.00 0.00 174.94 175.15 1j2q s ALA 76 N -3.63 -1.35 0.20 0.00 0.00 0.11 -1.05 121.76 116.03 1j2q s ALA 76 Ca 0.36 0.80 0.11 0.00 0.00 0.00 0.00 51.96 53.23 1j2q s ALA 76 Cb 0.07 0.15 -0.04 0.00 0.00 0.00 0.00 23.12 23.30 1j2q s ALA 76 CO 0.15 -0.39 -0.19 0.00 0.00 0.00 0.00 175.76 175.33 1j2q s ALA 77 N -1.67 2.68 0.14 0.00 0.00 0.14 -0.37 121.76 122.67 1j2q s ALA 77 Ca -0.10 -1.61 0.04 0.00 0.00 0.00 0.00 51.96 50.30 1j2q s ALA 77 Cb -0.02 -0.45 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 1j2q s ALA 77 CO 0.04 0.43 -0.10 -0.08 0.00 0.00 0.00 175.76 176.06 1j2q s THR 78 N -1.74 1.09 -0.23 0.00 -1.32 -1.26 -0.52 115.64 111.66 1j2q s THR 78 Ca 0.23 -2.01 -0.19 0.00 -1.21 0.00 0.00 61.69 58.51 1j2q s THR 78 Cb -0.08 -1.78 0.06 0.00 -1.51 0.00 0.00 72.50 69.19 1j2q s THR 78 CO 0.12 -0.74 0.60 -0.55 -2.21 0.00 0.00 174.62 171.84 1j2q s SER 79 N -3.08 -0.67 0.00 8.08 0.15 -0.66 -4.85 113.70 112.66 1j2q s SER 79 Ca 0.15 1.24 0.00 0.00 0.70 0.00 0.00 55.95 58.04 1j2q s SER 79 Cb 0.02 1.23 0.00 0.00 -1.71 0.00 0.00 66.02 65.56 1j2q s SER 79 CO -0.00 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.83 1j2q n GLY 80 N 3.13 0.44 3.64 9.45 0.00 -1.26 0.30 105.19 120.88 1j2q n GLY 80 Ca -0.16 -2.03 -0.46 0.00 0.00 0.00 0.00 46.02 43.38 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 3.51 -0.28 0.99 7.99 0.40 -4.83 117.00 124.79 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 -1.44 0.20 0.00 -0.11 0.00 0.00 43.42 42.07 1j2q n LEU 81 CO 0.00 -0.15 1.26 1.62 -1.51 0.00 0.00 177.39 178.61 1j2q h VAL 82 N 5.96 1.20 -0.13 4.08 3.04 -1.95 -1.89 116.25 126.56 1j2q h VAL 82 Ca -0.46 -0.39 -0.03 0.00 -1.01 0.00 0.00 66.70 64.81 1j2q h VAL 82 Cb 1.26 -0.04 -0.00 0.00 -2.01 0.00 0.00 31.29 30.50 1j2q h VAL 82 CO 0.95 0.21 -0.03 0.00 -1.01 0.00 0.00 177.57 177.69 1j2q h ALA 83 N 1.47 0.18 -0.69 3.17 0.00 -1.98 -2.82 119.26 118.59 1j2q h ALA 83 Ca 0.32 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 55.07 1j2q h ALA 83 Cb -0.09 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 1j2q h ALA 83 CO -0.08 -0.08 0.39 -0.44 0.00 0.00 0.00 179.25 179.04 1j2q h ASP 84 N -0.05 0.57 -0.63 0.00 3.45 -1.90 -2.18 116.42 115.68 1j2q h ASP 84 Ca 0.03 0.03 0.10 0.00 0.43 0.00 0.00 57.03 57.62 1j2q h ASP 84 Cb 0.45 -0.08 -0.07 0.00 -0.56 0.00 0.00 39.33 39.06 1j2q h ASP 84 CO 0.01 0.36 0.25 0.00 -1.57 0.00 0.00 179.24 178.30 1j2q h ALA 85 N 1.36 0.83 -0.12 3.45 0.00 -1.25 -1.77 119.26 121.77 1j2q h ALA 85 Ca 0.31 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.35 1j2q h ALA 85 Cb 0.21 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 1j2q h ALA 85 CO -0.19 -0.17 -0.28 0.00 0.00 0.00 0.00 179.25 178.62 1j2q h ARG 86 N 0.45 -0.34 -0.21 0.00 3.08 -1.14 -0.09 114.38 116.12 1j2q h ARG 86 Ca 0.32 0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.36 1j2q h ARG 86 Cb 0.39 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 1j2q h ARG 86 CO -0.30 -0.23 -0.02 -0.39 -1.07 0.00 0.00 179.97 177.96 1j2q h VAL 87 N -0.35 1.15 -0.40 2.04 -1.51 -1.41 -2.14 116.25 113.63 1j2q h VAL 87 Ca 0.10 -0.59 -0.07 0.00 -1.23 0.00 0.00 66.70 64.91 1j2q h VAL 87 Cb 0.50 1.01 -0.01 0.00 -2.13 0.00 0.00 31.29 30.66 1j2q h VAL 87 CO -0.32 0.19 -0.02 0.25 -1.23 0.00 0.00 177.57 176.45 1j2q h LEU 88 N 0.31 0.70 -0.45 4.19 5.85 -0.35 0.65 115.31 126.21 1j2q h LEU 88 Ca 0.07 -0.32 -0.18 0.00 0.84 0.00 0.00 57.88 58.30 1j2q h LEU 88 Cb 0.24 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1j2q h LEU 88 CO 0.01 0.85 -0.67 0.16 -0.34 0.00 0.00 178.44 178.44 1j2q h ILE 89 N 0.53 1.36 -0.76 4.05 3.07 -0.78 -0.56 117.51 124.43 1j2q h ILE 89 Ca 0.11 -2.03 -0.06 0.00 1.55 0.00 0.00 64.86 64.43 1j2q h ILE 89 Cb 0.50 2.01 -0.03 0.00 -0.27 0.00 0.00 36.82 39.03 1j2q h ILE 89 CO 0.02 0.61 0.24 -0.78 -1.05 0.00 0.00 178.15 177.20 1j2q h ASP 90 N 0.31 1.10 -0.42 2.16 1.82 -1.32 0.21 116.42 120.28 1j2q h ASP 90 Ca -0.02 -0.21 0.03 0.00 -0.39 0.00 0.00 57.03 56.44 1j2q h ASP 90 Cb 1.23 -0.29 -0.03 0.00 0.68 0.00 0.00 39.33 40.92 1j2q h ASP 90 CO 0.12 1.01 0.22 -0.09 -1.61 0.00 0.00 179.24 178.89 1j2q h ARG 91 N 1.13 0.42 -0.71 0.28 9.65 -0.59 0.13 114.38 124.68 1j2q h ARG 91 Ca 0.24 -0.03 -0.04 0.00 -1.10 0.00 0.00 59.98 59.06 1j2q h ARG 91 Cb 0.31 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.76 1j2q h ARG 91 CO -0.01 0.28 0.30 0.00 2.80 0.00 0.00 179.97 183.34 1j2q h ALA 92 N 1.22 1.20 -0.09 2.80 0.00 -0.33 -0.71 119.26 123.35 1j2q h ALA 92 Ca 0.18 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1j2q h ALA 92 Cb 0.08 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1j2q h ALA 92 CO -0.12 0.59 0.04 0.00 0.00 0.00 0.00 179.25 179.76 1j2q h ARG 93 N 1.01 0.13 -0.09 0.00 3.08 0.43 -0.86 114.38 118.08 1j2q h ARG 93 Ca 0.24 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.30 1j2q h ARG 93 Cb 0.17 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 1j2q h ARG 93 CO -0.02 0.24 -0.10 0.82 -1.07 0.00 0.00 179.97 179.83 1j2q h ILE 94 N -0.01 0.71 -0.80 2.04 2.04 -0.54 -1.92 117.51 119.02 1j2q h ILE 94 Ca 0.03 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.05 1j2q h ILE 94 Cb 0.16 0.71 -0.11 0.00 -0.74 0.00 0.00 36.82 36.84 1j2q h ILE 94 CO -0.00 0.00 0.31 -0.08 0.00 0.00 0.00 178.15 178.37 1j2q h GLU 95 N -0.14 0.40 0.02 2.37 4.57 -0.85 0.93 114.58 121.87 1j2q h GLU 95 Ca 0.07 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.23 1j2q h GLU 95 Cb 0.24 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 1j2q h GLU 95 CO -0.17 0.26 -0.01 0.00 -1.18 0.00 0.00 179.01 177.91 1j2q h ALA 96 N 1.61 -0.02 -0.67 2.92 0.00 -0.43 -2.42 119.26 120.24 1j2q h ALA 96 Ca 0.46 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.28 1j2q h ALA 96 Cb 0.76 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1j2q h ALA 96 CO -0.46 -0.46 0.28 1.96 0.00 0.00 0.00 179.25 180.56 1j2q h GLN 97 N -0.12 0.99 -0.98 0.00 1.08 -0.60 -2.00 115.11 113.48 1j2q h GLN 97 Ca -0.00 -0.16 0.01 0.00 -1.45 0.00 0.00 58.65 57.05 1j2q h GLN 97 Cb 0.11 -0.17 -0.05 0.00 -0.05 0.00 0.00 27.48 27.32 1j2q h GLN 97 CO 0.00 0.80 0.65 0.82 -0.95 0.00 0.00 178.83 180.15 1j2q h ILE 98 N 0.97 1.24 -0.91 2.54 2.04 -0.70 0.63 117.51 123.31 1j2q h ILE 98 Ca 0.23 -0.45 0.02 0.00 1.00 0.00 0.00 64.86 65.66 1j2q h ILE 98 Cb 0.18 -0.19 -0.05 0.00 -0.74 0.00 0.00 36.82 36.02 1j2q h ILE 98 CO -0.02 0.24 0.60 -1.13 0.00 0.00 0.00 178.15 177.84 1j2q h ASN 99 N 1.31 1.03 -0.19 1.72 -1.24 -0.86 -1.38 115.58 115.97 1j2q h ASN 99 Ca 0.36 -0.02 -0.03 0.00 0.71 0.00 0.00 56.30 57.33 1j2q h ASN 99 Cb -0.13 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 38.67 1j2q h ASN 99 CO -0.08 0.73 0.02 0.03 -1.29 0.00 0.00 177.43 176.84 1j2q h ARG 100 N 1.21 0.33 -0.98 6.67 3.08 -1.08 -0.89 114.38 122.71 1j2q h ARG 100 Ca 0.34 -0.09 0.13 0.00 0.07 0.00 0.00 59.98 60.43 1j2q h ARG 100 Cb -0.09 -0.03 -0.08 0.00 0.08 0.00 0.00 29.97 29.84 1j2q h ARG 100 CO -0.09 0.50 0.62 1.25 -1.07 0.00 0.00 179.97 181.18 1j2q h LEU 101 N 0.10 0.86 0.00 3.04 6.46 -0.36 0.98 115.31 126.39 1j2q h LEU 101 Ca 0.06 0.05 -0.17 0.00 -0.12 0.00 0.00 57.88 57.69 1j2q h LEU 101 Cb 0.34 -0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 40.13 1j2q h LEU 101 CO 0.01 0.43 -1.66 1.07 -0.62 0.00 0.00 178.44 177.67 1j2q n THR 102 N -4.62 1.03 -0.04 1.05 5.66 -0.57 -4.50 114.28 112.29 1j2q n THR 102 Ca 0.19 -0.69 0.00 0.00 -3.05 0.00 0.00 64.05 60.50 1j2q n THR 102 Cb 0.40 -0.57 0.00 0.00 -1.55 0.00 0.00 70.33 68.62 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 -2.76 0.00 -3.03 1.09 4.01 -0.35 -4.99 117.16 111.13 1j2q n TYR 103 Ca -0.13 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.39 1j2q n TYR 103 Cb 0.85 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.91 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 -0.43 -6.07 -3.80 7.72 4.64 0.34 -4.97 116.55 113.98 1j2q n ASP 104 Ca 0.00 -0.29 -0.13 0.00 -1.38 0.00 0.00 54.79 53.00 1j2q n ASP 104 Cb 0.01 -4.91 -0.09 0.00 -1.04 0.00 0.00 41.12 35.09 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 -5.71 0.56 0.43 -0.67 2.02 -1.25 -5.00 118.70 109.07 1j2q s GLU 105 Ca 0.31 -0.15 -0.25 0.00 0.02 0.00 0.00 54.97 54.89 1j2q s GLU 105 Cb -0.14 0.24 -0.08 0.00 0.10 0.00 0.00 34.13 34.26 1j2q s GLU 105 CO 0.38 -0.14 1.26 -1.25 0.02 0.00 0.00 175.26 175.53 1j2q s PRO 106 N -1.09 3.87 0.34 0.39 0.04 -1.26 -3.21 135.00 134.09 1j2q s PRO 106 Ca -0.12 2.04 -0.26 0.00 0.04 0.00 0.00 61.00 62.70 1j2q s PRO 106 Cb -0.05 -2.64 -0.09 0.00 0.04 0.00 0.00 34.50 31.75 1j2q s PRO 106 CO 0.03 -0.53 1.02 -1.50 0.04 0.00 0.00 177.00 176.05 1j2q s ILE 107 N -1.34 3.87 0.60 0.56 2.07 -1.26 -4.97 121.20 120.73 1j2q s ILE 107 Ca 0.59 1.56 -0.16 0.00 -1.41 0.00 0.00 60.65 61.23 1j2q s ILE 107 Cb -0.35 -3.87 -0.03 0.00 0.13 0.00 0.00 42.46 38.34 1j2q s ILE 107 CO 0.44 0.14 1.08 0.42 -1.91 0.00 0.00 174.94 175.12 1j2q s THR 108 N -1.54 3.52 0.32 4.00 -4.23 -1.26 -4.89 115.64 111.56 1j2q s THR 108 Ca 0.52 0.76 0.02 0.00 -1.18 0.00 0.00 61.69 61.80 1j2q s THR 108 Cb -0.23 -3.27 0.21 0.00 1.34 0.00 0.00 72.50 70.55 1j2q s THR 108 CO 0.29 -0.39 1.92 0.58 -0.54 0.00 0.00 174.62 176.48 1j2q h VAL 109 N 0.47 1.19 -0.12 2.29 2.07 -1.93 -1.92 116.25 118.30 1j2q h VAL 109 Ca -0.47 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 1j2q h VAL 109 Cb 1.24 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1j2q h VAL 109 CO 0.56 0.23 0.02 0.50 0.02 0.00 0.00 177.57 178.90 1j2q h LYS 110 N 0.76 0.19 -0.49 1.57 3.64 -1.98 -2.33 116.57 117.94 1j2q h LYS 110 Ca 0.19 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 1j2q h LYS 110 Cb 0.12 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 1j2q h LYS 110 CO -0.02 0.38 0.28 0.93 -2.27 0.00 0.00 179.45 178.75 1j2q h GLU 111 N -0.02 0.68 -0.69 1.90 4.39 -1.88 -1.93 114.58 117.02 1j2q h GLU 111 Ca 0.04 -0.07 0.04 0.00 0.34 0.00 0.00 59.36 59.70 1j2q h GLU 111 Cb 0.28 -0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 28.74 1j2q h GLU 111 CO 0.00 0.52 0.42 1.25 -1.16 0.00 0.00 179.01 180.04 1j2q h LEU 112 N 0.66 0.67 -0.08 1.33 5.85 -1.35 -1.43 115.31 120.96 1j2q h LEU 112 Ca 0.18 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 1j2q h LEU 112 Cb 0.02 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 40.91 1j2q h LEU 112 CO -0.03 0.46 0.05 0.00 -0.34 0.00 0.00 178.44 178.58 1j2q h ALA 113 N 1.31 0.11 -0.90 1.25 0.00 -1.08 -2.21 119.26 117.74 1j2q h ALA 113 Ca 0.29 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.24 1j2q h ALA 113 Cb 0.07 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.76 1j2q h ALA 113 CO -0.13 -0.37 0.56 0.87 0.00 0.00 0.00 179.25 180.17 1j2q h LYS 114 N 0.07 0.94 -0.19 0.00 1.57 -0.98 -0.92 116.57 117.06 1j2q h LYS 114 Ca 0.03 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1j2q h LYS 114 Cb 0.04 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 1j2q h LYS 114 CO -0.01 0.62 0.05 0.87 -0.57 0.00 0.00 179.45 180.42 1j2q h LYS 115 N 0.97 0.30 0.00 3.15 1.57 -0.93 0.11 116.57 121.74 1j2q h LYS 115 Ca 0.41 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 59.05 1j2q h LYS 115 Cb 0.27 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1j2q h LYS 115 CO -0.21 0.42 -0.36 -0.84 -0.57 0.00 0.00 179.45 177.89 1j2q h ILE 116 N 0.12 0.94 -0.27 1.86 3.07 -1.20 -1.28 117.51 120.75 1j2q h ILE 116 Ca 0.06 -1.42 -0.13 0.00 1.55 0.00 0.00 64.86 64.91 1j2q h ILE 116 Cb 0.25 1.85 -0.01 0.00 -0.27 0.00 0.00 36.82 38.64 1j2q h ILE 116 CO -0.00 0.36 -0.39 0.00 -1.05 0.00 0.00 178.15 177.07 1j2q h ASP 118 N 0.51 0.86 0.66 0.00 3.32 -0.38 -1.03 116.42 120.36 1j2q h ASP 118 Ca 0.05 -0.37 -0.03 0.00 0.02 0.00 0.00 57.03 56.70 1j2q h ASP 118 Cb 0.90 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 1j2q h ASP 118 CO 0.08 1.12 -0.43 0.15 -1.72 0.00 0.00 179.24 178.44 1j2q h PHE 119 N 0.68 -1.14 -0.56 4.55 3.57 -0.92 -2.49 116.94 120.63 1j2q h PHE 119 Ca 0.07 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.67 1j2q h PHE 119 Cb 0.90 0.41 -0.03 0.00 2.79 0.00 0.00 35.95 40.02 1j2q h PHE 119 CO 0.05 -0.64 0.38 0.87 -2.23 0.00 0.00 178.31 176.74 1j2q h LYS 120 N -1.03 0.28 -0.30 1.11 1.57 -0.90 -1.99 116.57 115.31 1j2q h LYS 120 Ca -0.08 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.65 1j2q h LYS 120 Cb 0.84 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.07 1j2q h LYS 120 CO 0.07 0.19 0.04 0.37 -0.57 0.00 0.00 179.45 179.55 1j2q h GLN 121 N 0.29 0.45 -0.58 3.15 -0.00 -0.73 -2.72 115.11 114.97 1j2q h GLN 121 Ca 0.26 -0.07 -0.09 0.00 -0.00 0.00 0.00 58.65 58.75 1j2q h GLN 121 Cb 0.64 -0.08 -0.02 0.00 0.00 0.00 0.00 27.48 28.02 1j2q h GLN 121 CO -0.06 0.44 0.01 1.96 0.00 0.00 0.00 178.83 181.19 1j2q h GLN 122 N 0.44 1.00 -0.00 1.69 4.20 -1.17 -1.03 115.11 120.24 1j2q h GLN 122 Ca 0.10 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.51 1j2q h GLN 122 Cb 0.22 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1j2q h GLN 122 CO 0.00 0.98 0.00 0.66 -0.67 0.00 0.00 178.83 179.80 1j2q n TYR 123 N -4.19 0.00 0.14 2.96 4.01 -1.03 -1.52 117.16 117.54 1j2q n TYR 123 Ca 0.03 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.84 1j2q n TYR 123 Cb 0.33 -0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.26 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 -0.50 0.00 -2.27 -0.72 -1.04 -0.39 -2.59 114.28 106.77 1j2q n THR 124 Ca 0.00 -0.28 0.03 0.00 -2.04 0.00 0.00 64.05 61.76 1j2q n THR 124 Cb 0.00 0.39 0.02 0.00 -1.82 0.00 0.00 70.33 68.92 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 -1.81 0.06 -2.72 -2.82 10.64 -0.58 -4.82 117.38 115.34 1j2q n GLN 125 Ca -0.01 -1.67 -0.25 0.00 -1.83 0.00 0.00 57.00 53.24 1j2q n GLN 125 Cb 0.31 -0.25 -0.02 0.00 -0.86 0.00 0.00 30.24 29.43 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 0.24 3.31 0.00 2.61 4.01 -1.10 -5.05 117.16 121.19 1j2q n TYR 126 Ca 0.04 -3.48 0.00 0.00 -0.16 0.00 0.00 57.90 54.30 1j2q n TYR 126 Cb 0.96 -0.28 0.00 0.00 -0.31 0.00 0.00 39.34 39.71 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 -0.31 0.00 1.19 2.72 0.00 -1.26 -3.56 105.19 103.96 1j2q n GLY 127 Ca 0.33 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.31 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 2.42 3.37 -0.02 0.00 -1.26 -4.70 105.19 105.01 1j2q n GLY 128 Ca 0.00 -0.25 -0.09 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.95 0.06 0.29 1.61 0.11 -1.23 -5.17 120.40 115.11 1j2q s VAL 129 Ca 0.14 -1.21 0.10 0.00 -2.93 0.00 0.00 61.98 58.08 1j2q s VAL 129 Cb 0.11 -1.73 -0.05 0.00 -1.53 0.00 0.00 36.38 33.18 1j2q s VAL 129 CO 0.03 -0.28 -0.09 0.00 -3.33 0.00 0.00 175.10 171.44 1j2q s ARG 130 N -3.93 1.98 0.92 1.54 1.70 -1.26 -4.80 118.95 115.10 1j2q s ARG 130 Ca 0.14 -1.65 -0.12 0.00 -0.47 0.00 0.00 55.73 53.63 1j2q s ARG 130 Cb 0.02 -1.93 0.14 0.00 -0.57 0.00 0.00 34.95 32.61 1j2q s ARG 130 CO -0.02 0.30 1.09 -2.14 -1.08 0.00 0.00 175.30 173.45 1j2q s PRO 131 N -3.61 1.07 -0.27 3.89 0.02 -1.07 -4.81 135.00 130.22 1j2q s PRO 131 Ca 0.32 0.76 -0.24 0.00 0.02 0.00 0.00 61.00 61.86 1j2q s PRO 131 Cb -0.04 -1.79 -0.00 0.00 0.02 0.00 0.00 34.50 32.68 1j2q s PRO 131 CO 0.18 -2.35 0.80 -0.06 -0.33 0.00 0.00 177.00 175.23 1j2q s PHE 132 N -2.94 3.26 -0.47 6.54 0.40 -1.26 -4.92 117.98 118.59 1j2q s PHE 132 Ca 0.64 0.97 -0.06 0.00 -0.60 0.00 0.00 56.93 57.88 1j2q s PHE 132 Cb -0.18 -3.12 -0.15 0.00 0.51 0.00 0.00 43.02 40.08 1j2q s PHE 132 CO 0.57 -0.48 2.69 0.41 0.70 0.00 0.00 175.22 179.12 1j2q n GLY 133 N 3.98 2.92 3.21 4.36 0.00 -1.26 -4.56 105.19 113.84 1j2q n GLY 133 Ca 0.04 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.95 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 2.04 0.07 0.09 1.61 0.11 -1.26 0.15 120.40 123.21 1j2q s VAL 134 Ca 0.51 -0.54 0.10 0.00 -2.93 0.00 0.00 61.98 59.11 1j2q s VAL 134 Cb 0.20 -0.62 -0.03 0.00 -1.53 0.00 0.00 36.38 34.40 1j2q s VAL 134 CO -0.02 -0.30 -0.25 -0.55 -3.33 0.00 0.00 175.10 170.65 1j2q s SER 135 N -1.42 3.05 0.07 3.54 0.15 0.15 -3.57 113.70 115.66 1j2q s SER 135 Ca -0.13 -0.66 0.07 0.00 0.70 0.00 0.00 55.95 55.93 1j2q s SER 135 Cb -0.05 -0.23 -0.03 0.00 -1.71 0.00 0.00 66.02 64.00 1j2q s SER 135 CO 0.03 0.19 -0.20 -0.76 1.20 0.00 0.00 173.24 173.70 1j2q s LEU 136 N -1.65 2.23 -0.26 3.45 1.43 -1.07 -1.65 118.68 121.15 1j2q s LEU 136 Ca 0.11 -0.59 -0.02 0.00 -1.03 0.00 0.00 54.13 52.61 1j2q s LEU 136 Cb -0.10 -0.87 0.03 0.00 0.03 0.00 0.00 46.19 45.28 1j2q s LEU 136 CO 0.04 0.09 -0.04 -0.76 0.23 0.00 0.00 176.35 175.91 1j2q s LEU 137 N -1.51 3.41 -0.23 1.79 1.43 0.32 0.53 118.68 124.42 1j2q s LEU 137 Ca 0.06 -1.00 -0.04 0.00 -1.03 0.00 0.00 54.13 52.12 1j2q s LEU 137 Cb -0.09 -1.68 0.00 0.00 0.03 0.00 0.00 46.19 44.45 1j2q s LEU 137 CO 0.03 -0.17 -0.04 -0.63 0.23 0.00 0.00 176.35 175.77 1j2q s ILE 138 N 1.30 3.29 0.07 -0.59 1.01 0.95 0.23 121.20 127.46 1j2q s ILE 138 Ca -0.02 -0.63 0.07 0.00 0.00 0.00 0.00 60.65 60.07 1j2q s ILE 138 Cb -0.18 -2.55 -0.03 0.00 0.01 0.00 0.00 42.46 39.71 1j2q s ILE 138 CO -0.03 0.35 -0.20 0.00 0.00 0.00 0.00 174.94 175.05 1j2q s ALA 139 N 1.45 1.69 0.00 9.38 0.00 -0.22 -0.75 121.76 133.32 1j2q s ALA 139 Ca 0.04 -1.11 -0.08 0.00 0.00 0.00 0.00 51.96 50.82 1j2q s ALA 139 Cb -0.15 -0.28 0.03 0.00 0.00 0.00 0.00 23.12 22.72 1j2q s ALA 139 CO -0.03 0.35 0.37 0.41 0.00 0.00 0.00 175.76 176.86 1j2q n GLY 140 N 1.53 0.61 2.75 0.00 0.00 -0.89 -0.29 105.19 108.90 1j2q n GLY 140 Ca -0.18 -0.91 -0.27 0.00 0.00 0.00 0.00 46.02 44.65 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 -2.17 0.56 0.00 1.61 1.01 -1.00 -0.61 120.40 119.79 1j2q s VAL 141 Ca 0.09 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.52 1j2q s VAL 141 Cb -0.00 -1.04 0.00 0.00 0.00 0.00 0.00 36.38 35.34 1j2q s VAL 141 CO 0.00 -0.18 0.00 0.47 0.00 0.00 0.00 175.10 175.39 1j2q n ASP 142 N 5.04 0.00 0.01 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 0.47 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.59 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 0.12 -3.92 -1.24 0.28 -1.26 -4.90 120.64 109.73 1j2q n GLU 143 Ca 0.00 -0.01 -0.10 0.00 -0.16 0.00 0.00 57.16 56.89 1j2q n GLU 143 Cb 0.00 -1.53 -0.09 0.00 1.43 0.00 0.00 31.44 31.25 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 -3.09 0.13 0.56 3.84 1.01 -1.26 -5.11 120.40 116.48 1j2q s VAL 144 Ca 0.07 -1.04 -0.21 0.00 0.00 0.00 0.00 61.98 60.80 1j2q s VAL 144 Cb 0.16 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.65 1j2q s VAL 144 CO 0.81 -0.57 1.28 -2.84 0.00 0.00 0.00 175.10 173.78 1j2q s PRO 146 N -2.49 3.10 -0.01 2.72 0.02 -1.26 -4.53 135.00 132.55 1j2q s PRO 146 Ca -0.06 2.04 -0.06 0.00 0.02 0.00 0.00 61.00 62.94 1j2q s PRO 146 Cb -0.02 -2.13 0.00 0.00 0.02 0.00 0.00 34.50 32.37 1j2q s PRO 146 CO -0.04 -1.16 0.11 0.15 -0.33 0.00 0.00 177.00 175.74 1j2q s LYS 147 N -3.05 0.36 -0.03 5.54 1.02 0.22 -4.90 119.74 118.89 1j2q s LYS 147 Ca 0.74 -0.25 -0.01 0.00 0.02 0.00 0.00 55.97 56.47 1j2q s LYS 147 Cb -0.36 0.15 0.03 0.00 -0.52 0.00 0.00 37.83 37.13 1j2q s LYS 147 CO 0.41 -0.08 0.04 -1.17 -0.92 0.00 0.00 175.35 173.63 1j2q s LEU 148 N -0.95 0.63 0.11 3.17 2.96 -1.26 -2.09 118.68 121.24 1j2q s LEU 148 Ca -0.10 0.04 0.06 0.00 -0.22 0.00 0.00 54.13 53.91 1j2q s LEU 148 Cb -0.06 -0.15 -0.03 0.00 0.50 0.00 0.00 46.19 46.45 1j2q s LEU 148 CO 0.01 -0.18 -0.16 -0.31 -1.32 0.00 0.00 176.35 174.39 1j2q s TYR 149 N 1.62 1.46 -0.02 5.38 2.02 0.07 -1.36 117.35 126.52 1j2q s TYR 149 Ca -0.02 -0.49 0.03 0.00 -0.37 0.00 0.00 57.07 56.22 1j2q s TYR 149 Cb -0.13 -0.78 -0.00 0.00 -0.40 0.00 0.00 41.96 40.65 1j2q s TYR 149 CO -0.03 0.15 -0.11 -1.83 -1.57 0.00 0.00 175.55 172.16 1j2q s GLU 150 N -2.23 1.03 0.22 -0.62 4.04 -0.36 -0.03 118.70 120.74 1j2q s GLU 150 Ca 0.06 -0.37 0.08 0.00 0.04 0.00 0.00 54.97 54.78 1j2q s GLU 150 Cb -0.08 -0.96 -0.04 0.00 0.02 0.00 0.00 34.13 33.07 1j2q s GLU 150 CO 0.03 0.17 0.05 0.95 -1.84 0.00 0.00 175.26 174.62 1j2q s THR 151 N 0.03 3.85 0.20 1.83 -4.23 0.19 -2.47 115.64 115.04 1j2q s THR 151 Ca -0.01 -1.56 0.11 0.00 -1.18 0.00 0.00 61.69 59.06 1j2q s THR 151 Cb -0.07 -3.01 -0.04 0.00 1.34 0.00 0.00 72.50 70.71 1j2q s THR 151 CO 0.00 -0.25 -0.23 -0.62 -0.54 0.00 0.00 174.62 172.98 1j2q s ASP 152 N -3.41 3.47 0.57 3.99 2.15 -0.91 -2.60 116.67 119.93 1j2q s ASP 152 Ca 0.30 -0.87 0.29 0.00 0.43 0.00 0.00 52.55 52.70 1j2q s ASP 152 Cb -0.08 -0.27 1.47 0.00 -0.30 0.00 0.00 42.92 43.74 1j2q s ASP 152 CO 0.21 0.11 1.90 -0.65 -0.17 0.00 0.00 175.17 176.57 1j2q h PRO 153 N 3.13 0.00 0.00 4.34 0.11 -1.80 0.22 132.00 138.00 1j2q h PRO 153 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1j2q h PRO 153 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1j2q h PRO 153 CO 0.49 0.00 -0.07 0.66 -0.21 0.00 0.00 178.00 178.87 1j2q h SER 154 N 0.00 0.00 0.00 -2.05 4.64 -1.89 -3.40 113.55 110.85 1j2q h SER 154 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1j2q h SER 154 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1j2q h SER 154 CO -0.00 0.07 0.00 0.61 -0.87 0.00 0.00 176.83 176.63 1j2q n GLY 155 N 0.76 1.16 3.74 -0.77 0.00 0.76 -4.10 105.19 106.75 1j2q n GLY 155 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 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 3.31 -0.03 4.61 0.00 -1.25 -4.65 121.76 121.74 1j2q s ALA 156 Ca 0.00 0.60 0.03 0.00 0.00 0.00 0.00 51.96 52.60 1j2q s ALA 156 Cb 0.00 -3.23 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 1j2q s ALA 156 CO 0.00 0.13 -0.11 -1.17 0.00 0.00 0.00 175.76 174.60 1j2q s LEU 157 N -0.77 2.91 -0.08 0.00 0.20 -1.26 -2.15 118.68 117.53 1j2q s LEU 157 Ca 0.43 -0.17 -0.05 0.00 0.69 0.00 0.00 54.13 55.04 1j2q s LEU 157 Cb -0.25 -1.63 0.04 0.00 -0.43 0.00 0.00 46.19 43.91 1j2q s LEU 157 CO 0.31 0.33 0.19 -0.76 -0.29 0.00 0.00 176.35 176.13 1j2q s LEU 158 N -0.96 0.75 -0.29 -0.68 1.43 -1.03 -5.01 118.68 112.89 1j2q s LEU 158 Ca 0.13 0.40 -0.13 0.00 -1.03 0.00 0.00 54.13 53.50 1j2q s LEU 158 Cb -0.11 0.56 -0.04 0.00 0.03 0.00 0.00 46.19 46.63 1j2q s LEU 158 CO 0.03 -0.13 0.26 -0.70 0.23 0.00 0.00 176.35 176.03 1j2q s GLU 159 N 0.94 3.88 0.29 1.70 2.12 -1.26 -1.23 118.70 125.15 1j2q s GLU 159 Ca -0.07 -0.26 0.08 0.00 0.36 0.00 0.00 54.97 55.08 1j2q s GLU 159 Cb -0.09 -3.69 -0.04 0.00 0.26 0.00 0.00 34.13 30.58 1j2q s GLU 159 CO -0.05 -0.27 0.17 0.71 -0.54 0.00 0.00 175.26 175.28 1j2q s TYR 160 N 1.87 2.90 -0.10 5.30 1.51 -0.47 -5.00 117.35 123.36 1j2q s TYR 160 Ca 0.10 -0.23 0.05 0.00 -1.01 0.00 0.00 57.07 55.97 1j2q s TYR 160 Cb -0.16 -1.50 -0.24 0.00 -0.11 0.00 0.00 41.96 39.95 1j2q s TYR 160 CO 0.11 0.43 0.45 1.63 -1.11 0.00 0.00 175.55 177.05 1j2q n LYS 161 N -1.16 0.69 -3.60 -0.62 5.02 -1.26 -4.27 118.16 112.95 1j2q n LYS 161 Ca -0.05 0.25 -0.12 0.00 -2.02 0.00 0.00 58.31 56.37 1j2q n LYS 161 Cb 0.59 -1.72 -0.06 0.00 -0.02 0.00 0.00 35.03 33.81 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 -1.88 0.02 7.82 0.00 -1.26 -0.77 121.76 123.12 1j2q s ALA 162 Ca -0.14 1.77 -0.08 0.00 0.00 0.00 0.00 51.96 53.51 1j2q s ALA 162 Cb 0.07 -0.99 0.03 0.00 0.00 0.00 0.00 23.12 22.23 1j2q s ALA 162 CO 0.79 -0.30 0.39 -2.37 0.00 0.00 0.00 175.76 174.27 1j2q n THR 163 N 1.85 0.00 -3.59 0.00 5.66 -0.44 -5.02 114.28 112.74 1j2q n THR 163 Ca -0.14 -0.10 -0.11 0.00 -3.05 0.00 0.00 64.05 60.65 1j2q n THR 163 Cb 0.56 0.21 -0.03 0.00 -1.55 0.00 0.00 70.33 69.52 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 -1.33 -1.22 0.09 1.79 0.00 -1.26 -1.51 121.76 118.32 1j2q s ALA 164 Ca 0.09 0.10 0.01 0.00 0.00 0.00 0.00 51.96 52.16 1j2q s ALA 164 Cb -0.01 0.83 -0.04 0.00 0.00 0.00 0.00 23.12 23.90 1j2q s ALA 164 CO 0.01 -0.77 -0.06 0.96 0.00 0.00 0.00 175.76 175.90 1j2q s ILE 165 N -3.81 0.62 0.00 0.00 -4.36 -0.54 -4.83 121.20 108.28 1j2q s ILE 165 Ca 0.04 -1.88 0.00 0.00 -0.26 0.00 0.00 60.65 58.56 1j2q s ILE 165 Cb -0.01 -1.61 0.00 0.00 1.25 0.00 0.00 42.46 42.09 1j2q s ILE 165 CO -0.09 -0.87 0.00 0.61 0.24 0.00 0.00 174.94 174.84 1j2q n GLY 166 N 0.05 0.65 0.22 6.27 0.00 -1.26 -1.17 105.19 109.94 1j2q n GLY 166 Ca -0.13 -2.14 -0.04 0.00 0.00 0.00 0.00 46.02 43.71 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 0.00 0.52 0.00 1.61 -0.00 0.09 -0.74 114.93 116.41 1j2q h MET 167 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 59.70 59.67 1j2q h MET 167 Cb 0.00 -0.12 0.00 0.00 -0.00 0.00 0.00 31.60 31.48 1j2q h MET 167 CO 0.00 0.34 0.00 0.41 -0.00 0.00 0.00 176.91 177.66 1j2q n GLY 168 N -1.26 -0.45 0.00 -3.00 0.00 -1.26 -4.31 105.19 94.92 1j2q n GLY 168 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.66 0.00 -0.33 1.61 0.63 -0.29 -2.83 116.66 114.79 1j2q n ARG 169 Ca 0.03 0.57 0.12 0.00 -0.92 0.00 0.00 57.85 57.65 1j2q n ARG 169 Cb 0.02 -1.16 0.25 0.00 0.45 0.00 0.00 32.46 32.02 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 -0.50 0.04 6.15 -0.26 -1.84 0.09 115.58 119.26 1j2q h ASN 170 Ca 0.00 0.27 0.01 0.00 -0.56 0.00 0.00 56.30 56.01 1j2q h ASN 170 Cb 0.00 0.47 -0.02 0.00 -1.06 0.00 0.00 38.32 37.71 1j2q h ASN 170 CO 0.00 -0.32 -0.24 0.00 -1.06 0.00 0.00 177.43 175.81 1j2q h ALA 171 N 1.93 -0.74 0.00 -0.83 0.00 -1.83 0.10 119.26 117.90 1j2q h ALA 171 Ca 0.55 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.39 1j2q h ALA 171 Cb 1.08 0.67 -0.00 0.00 0.00 0.00 0.00 17.79 19.53 1j2q h ALA 171 CO -0.88 -0.80 -0.11 -0.39 0.00 0.00 0.00 179.25 177.06 1j2q h VAL 172 N -0.33 0.75 0.04 0.00 -1.51 -1.24 -1.37 116.25 112.60 1j2q h VAL 172 Ca -0.00 -0.44 -0.00 0.00 -1.23 0.00 0.00 66.70 65.03 1j2q h VAL 172 Cb 0.34 1.26 0.00 0.00 -2.13 0.00 0.00 31.29 30.76 1j2q h VAL 172 CO -0.14 0.11 -0.02 0.74 -1.23 0.00 0.00 177.57 177.03 1j2q h THR 173 N 0.00 1.17 -0.82 7.19 2.02 -0.33 0.78 112.91 122.92 1j2q h THR 173 Ca -0.00 -0.69 0.01 0.00 0.77 0.00 0.00 66.41 66.49 1j2q h THR 173 Cb 0.25 1.63 -0.04 0.00 -1.74 0.00 0.00 68.15 68.25 1j2q h THR 173 CO 0.01 0.17 0.53 -0.33 0.37 0.00 0.00 175.52 176.28 1j2q h GLU 174 N -0.36 1.09 0.73 6.66 5.08 -0.34 -0.07 114.58 127.37 1j2q h GLU 174 Ca -0.01 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 1j2q h GLU 174 Cb 0.33 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 29.35 1j2q h GLU 174 CO 0.01 0.73 -0.35 0.35 -1.00 0.00 0.00 179.01 178.75 1j2q h PHE 175 N 1.11 -0.91 -0.55 4.33 3.04 -1.12 -2.62 116.94 120.23 1j2q h PHE 175 Ca 0.30 -0.02 0.10 0.00 3.98 0.00 0.00 57.97 62.33 1j2q h PHE 175 Cb -0.11 0.30 -0.03 0.00 2.56 0.00 0.00 35.95 38.67 1j2q h PHE 175 CO -0.01 -0.55 0.37 0.74 -2.02 0.00 0.00 178.31 176.84 1j2q h PHE 176 N -1.04 0.33 -0.32 0.41 0.04 -0.68 0.14 116.94 115.83 1j2q h PHE 176 Ca -0.10 0.01 0.09 0.00 2.80 0.00 0.00 57.97 60.77 1j2q h PHE 176 Cb 0.76 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.79 1j2q h PHE 176 CO -0.01 0.16 0.31 1.49 -0.60 0.00 0.00 178.31 179.65 1j2q h GLU 177 N 0.31 0.00 0.00 1.51 4.57 -0.62 -1.16 114.58 119.19 1j2q h GLU 177 Ca 0.25 0.00 -0.34 0.00 -1.18 0.00 0.00 59.36 58.10 1j2q h GLU 177 Cb 0.59 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.12 1j2q h GLU 177 CO -0.06 0.00 -2.16 1.63 -1.18 0.00 0.00 179.01 177.24 1j2q n LYS 178 N -3.94 0.46 0.12 1.92 5.02 0.34 -4.80 118.16 117.28 1j2q n LYS 178 Ca 0.05 0.17 -0.22 0.00 -2.02 0.00 0.00 58.31 56.29 1j2q n LYS 178 Cb 0.47 -1.29 -0.15 0.00 -0.02 0.00 0.00 35.03 34.03 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 -0.54 0.45 -6.59 1.97 4.39 -1.08 -3.47 114.58 109.71 1j2q h GLU 179 Ca -0.51 -0.77 -0.59 0.00 0.34 0.00 0.00 59.36 57.84 1j2q h GLU 179 Cb 1.53 0.28 0.14 0.00 -0.10 0.00 0.00 28.75 30.60 1j2q h GLU 179 CO -0.25 1.36 0.04 0.98 -1.16 0.00 0.00 179.01 179.98 1j2q n TYR 180 N -3.64 0.81 -3.78 4.33 9.36 -0.44 -5.02 117.16 118.78 1j2q n TYR 180 Ca -0.17 0.56 -0.13 0.00 3.32 0.00 0.00 57.90 61.49 1j2q n TYR 180 Cb 1.08 -2.17 -0.12 0.00 -0.63 0.00 0.00 39.34 37.50 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 -1.98 0.25 0.64 2.98 0.52 -1.26 -4.98 118.95 115.12 1j2q s ARG 181 Ca 0.64 0.36 0.33 0.00 -0.52 0.00 0.00 55.73 56.54 1j2q s ARG 181 Cb -0.56 0.07 1.83 0.00 0.52 0.00 0.00 34.95 36.81 1j2q s ARG 181 CO 0.56 -0.06 2.09 -0.44 0.02 0.00 0.00 175.30 177.47 1j2q h ASP 182 N 6.10 0.00 -0.57 0.23 3.45 -1.95 -2.26 116.42 121.42 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 0.37 0.00 0.00 -0.90 -1.57 0.00 0.00 179.24 177.14 1j2q n ASP 183 N -3.29 3.68 -4.53 6.45 5.68 -1.26 -4.60 116.55 118.68 1j2q n ASP 183 Ca -0.00 -2.09 -0.38 0.00 -0.50 0.00 0.00 54.79 51.82 1j2q n ASP 183 Cb 0.31 -0.41 0.05 0.00 -1.14 0.00 0.00 41.12 39.93 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 1.10 2.11 -4.94 -2.12 4.77 -0.85 -4.98 117.00 112.10 1j2q n LEU 184 Ca 0.20 0.75 -0.25 0.00 -0.03 0.00 0.00 56.01 56.67 1j2q n LEU 184 Cb 0.59 -1.27 0.08 0.00 -2.33 0.00 0.00 43.42 40.49 1j2q n LEU 184 CO 0.14 -2.54 0.60 -0.94 -1.33 0.00 0.00 177.39 173.33 1j2q s SER 185 N -1.25 4.70 0.10 -1.43 1.04 -1.26 -4.44 113.70 111.17 1j2q s SER 185 Ca 0.72 0.33 -0.23 0.00 0.48 0.00 0.00 55.95 57.25 1j2q s SER 185 Cb -0.42 -0.94 -0.11 0.00 0.10 0.00 0.00 66.02 64.65 1j2q s SER 185 CO 0.51 -1.65 1.71 0.15 0.98 0.00 0.00 173.24 174.94 1j2q h PHE 186 N -0.60 -0.14 -0.48 5.02 3.57 -1.96 0.36 116.94 122.71 1j2q h PHE 186 Ca -0.43 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 60.97 1j2q h PHE 186 Cb 1.30 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 40.09 1j2q h PHE 186 CO 0.19 -0.09 -0.11 -0.44 -2.23 0.00 0.00 178.31 175.63 1j2q h ASP 187 N -0.11 0.88 0.18 0.41 3.32 -1.99 -0.41 116.42 118.71 1j2q h ASP 187 Ca 0.02 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 56.79 1j2q h ASP 187 Cb 0.13 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.45 1j2q h ASP 187 CO -0.05 1.00 -0.09 0.44 -1.72 0.00 0.00 179.24 178.82 1j2q h ASP 188 N 0.79 -0.21 -0.52 6.45 3.45 -1.87 0.39 116.42 124.90 1j2q h ASP 188 Ca 0.13 -0.10 0.09 0.00 0.43 0.00 0.00 57.03 57.58 1j2q h ASP 188 Cb 0.63 0.05 -0.07 0.00 -0.56 0.00 0.00 39.33 39.38 1j2q h ASP 188 CO 0.04 -0.03 0.12 0.00 -1.57 0.00 0.00 179.24 177.81 1j2q h ALA 189 N 0.41 0.61 -0.25 3.45 0.00 -0.15 0.15 119.26 123.47 1j2q h ALA 189 Ca -0.03 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1j2q h ALA 189 Cb 0.29 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1j2q h ALA 189 CO 0.04 -0.29 0.09 1.98 0.00 0.00 0.00 179.25 181.08 1j2q h MET 190 N 0.27 0.38 -0.87 0.00 1.85 -0.86 -2.33 114.93 113.36 1j2q h MET 190 Ca 0.26 -0.07 0.01 0.00 -0.61 0.00 0.00 59.70 59.29 1j2q h MET 190 Cb 0.35 -0.06 -0.04 0.00 0.43 0.00 0.00 31.60 32.28 1j2q h MET 190 CO -0.33 0.44 0.58 0.28 -0.40 0.00 0.00 176.91 177.48 1j2q h VAL 191 N 0.25 1.21 -0.43 -5.77 2.07 -0.26 0.46 116.25 113.78 1j2q h VAL 191 Ca 0.08 -0.40 0.07 0.00 0.82 0.00 0.00 66.70 67.27 1j2q h VAL 191 Cb 0.20 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 1j2q h VAL 191 CO -0.01 0.21 0.29 0.25 0.02 0.00 0.00 177.57 178.34 1j2q h LEU 192 N 1.17 0.25 -0.06 2.57 5.85 -0.51 -1.07 115.31 123.51 1j2q h LEU 192 Ca 0.33 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.99 1j2q h LEU 192 Cb -0.11 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 40.87 1j2q h LEU 192 CO -0.08 0.16 -0.20 1.23 -0.34 0.00 0.00 178.44 179.21 1j2q h GLY 193 N 0.29 0.26 1.48 3.75 0.00 -0.40 -2.04 103.07 106.39 1j2q h GLY 193 Ca 0.19 -0.34 0.02 0.00 0.00 0.00 0.00 47.33 47.20 1j2q h GLY 193 CO -0.04 0.30 0.32 1.41 0.00 0.00 0.00 176.54 178.53 1j2q h LEU 194 N -0.30 0.50 0.15 3.11 -0.00 -0.59 -0.90 115.31 117.27 1j2q h LEU 194 Ca -0.01 -0.01 -0.01 0.00 -0.00 0.00 0.00 57.88 57.85 1j2q h LEU 194 Cb 0.83 -0.12 0.00 0.00 -0.00 0.00 0.00 40.66 41.38 1j2q h LEU 194 CO 0.04 0.35 -0.07 0.58 -0.00 0.00 0.00 178.44 179.34 1j2q h VAL 195 N 0.59 0.99 -0.78 1.22 2.07 -1.20 0.14 116.25 119.27 1j2q h VAL 195 Ca 0.18 -0.63 0.16 0.00 0.82 0.00 0.00 66.70 67.24 1j2q h VAL 195 Cb 0.02 1.37 -0.10 0.00 -1.52 0.00 0.00 31.29 31.06 1j2q h VAL 195 CO -0.04 0.15 0.29 0.00 0.02 0.00 0.00 177.57 177.99 1j2q h ALA 196 N 0.29 1.12 0.05 1.67 0.00 -0.75 0.23 119.26 121.88 1j2q h ALA 196 Ca -0.02 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1j2q h ALA 196 Cb 0.39 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1j2q h ALA 196 CO 0.03 -0.26 -0.08 0.52 0.00 0.00 0.00 179.25 179.46 1j2q h MET 197 N 0.40 -0.16 -0.30 0.00 2.07 -0.93 -0.77 114.93 115.24 1j2q h MET 197 Ca 0.45 0.01 0.07 0.00 -2.07 0.00 0.00 59.70 58.16 1j2q h MET 197 Cb 0.73 0.04 -0.08 0.00 -1.87 0.00 0.00 31.60 30.42 1j2q h MET 197 CO -0.45 -0.11 -0.26 0.78 1.07 0.00 0.00 176.91 177.94 1j2q h GLY 198 N -0.17 -0.15 0.85 8.32 0.00 0.15 0.21 103.07 112.28 1j2q h GLY 198 Ca 0.01 0.32 0.04 0.00 0.00 0.00 0.00 47.33 47.70 1j2q h GLY 198 CO -0.05 -0.20 0.50 1.41 0.00 0.00 0.00 176.54 178.20 1j2q h LEU 199 N -0.24 0.82 -0.07 3.11 3.38 -0.84 0.13 115.31 121.59 1j2q h LEU 199 Ca 0.15 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.14 1j2q h LEU 199 Cb 0.48 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 1j2q h LEU 199 CO -0.43 0.56 -0.45 -1.28 0.09 0.00 0.00 178.44 176.93 1j2q h SER 200 N 0.96 -1.41 0.00 -0.43 0.87 0.50 0.64 113.55 114.69 1j2q h SER 200 Ca 0.32 0.16 0.00 0.00 -1.23 0.00 0.00 61.79 61.04 1j2q h SER 200 Cb 0.03 0.54 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 1j2q h SER 200 CO -0.12 -0.41 0.00 2.30 -0.53 0.00 0.00 176.83 178.07 1j2q n ILE 201 N -4.92 0.00 -3.27 2.23 -5.35 -0.21 -4.89 119.36 102.95 1j2q n ILE 201 Ca -0.05 0.00 -0.17 0.00 -0.27 0.00 0.00 62.75 62.26 1j2q n ILE 201 Cb 0.32 -0.49 0.07 0.00 -1.74 0.00 0.00 39.64 37.80 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 -5.89 -3.25 6.28 4.07 0.22 -4.97 120.64 116.21 1j2q n GLU 202 Ca 0.15 0.67 0.00 0.00 -0.06 0.00 0.00 57.16 57.92 1j2q n GLU 202 Cb 0.07 -5.20 0.00 0.00 -0.06 0.00 0.00 31.44 26.25 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 -2.38 0.00 -4.78 4.31 3.41 -0.16 -5.01 113.62 109.01 1j2q n SER 203 Ca -0.10 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.15 1j2q n SER 203 Cb 0.59 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.51 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 -1.64 3.96 0.37 4.33 2.02 -1.26 -4.37 118.70 122.10 1j2q s GLU 204 Ca 0.00 1.52 -0.08 0.00 0.02 0.00 0.00 54.97 56.42 1j2q s GLU 204 Cb 0.00 -2.37 -0.06 0.00 0.10 0.00 0.00 34.13 31.80 1j2q s GLU 204 CO 0.00 -0.32 0.70 -0.51 0.02 0.00 0.00 175.26 175.14 1j2q s LEU 205 N -3.00 3.90 -0.25 1.80 1.43 -1.26 -5.03 118.68 116.27 1j2q s LEU 205 Ca 0.62 0.97 -0.02 0.00 -1.03 0.00 0.00 54.13 54.68 1j2q s LEU 205 Cb -0.22 -3.84 0.03 0.00 0.03 0.00 0.00 46.19 42.19 1j2q s LEU 205 CO 0.26 -0.34 -0.05 -0.69 0.23 0.00 0.00 176.35 175.77 1j2q s VAL 206 N -2.29 2.94 0.44 -1.59 1.01 -1.26 -4.96 120.40 114.69 1j2q s VAL 206 Ca 0.48 -1.03 0.25 0.00 0.00 0.00 0.00 61.98 61.69 1j2q s VAL 206 Cb -0.10 -2.51 0.45 0.00 0.00 0.00 0.00 36.38 34.22 1j2q s VAL 206 CO 0.31 0.17 1.73 1.55 0.00 0.00 0.00 175.10 178.87 1j2q h PRO 207 N 8.02 0.23 0.00 2.72 0.13 -1.96 0.11 132.00 141.26 1j2q h PRO 207 Ca -0.32 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1j2q h PRO 207 Cb 1.11 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1j2q h PRO 207 CO 0.57 0.15 0.00 0.39 -0.23 0.00 0.00 178.00 178.88 1j2q n GLU 208 N -4.56 0.00 -2.16 0.86 1.02 -1.26 -3.24 120.64 111.30 1j2q n GLU 208 Ca 0.29 0.38 -0.04 0.00 -0.02 0.00 0.00 57.16 57.77 1j2q n GLU 208 Cb 1.12 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 31.09 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 -1.50 2.17 -3.86 1.62 2.04 0.40 -4.94 115.26 111.18 1j2q n ASN 209 Ca 0.02 -2.56 -0.12 0.00 -0.44 0.00 0.00 54.58 51.48 1j2q n ASN 209 Cb 0.08 -0.42 -0.12 0.00 -2.53 0.00 0.00 39.78 36.80 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 0.02 1.53 -4.36 -1.20 -1.61 121.20 112.53 1j2q s ILE 210 Ca 0.35 -0.34 0.07 0.00 -0.26 0.00 0.00 60.65 60.46 1j2q s ILE 210 Cb 0.36 -0.27 -0.03 0.00 1.25 0.00 0.00 42.46 43.77 1j2q s ILE 210 CO -0.05 -0.19 -0.19 -0.70 0.24 0.00 0.00 174.94 174.05 1j2q s GLU 211 N -0.60 2.13 -0.03 0.37 2.12 -0.28 -4.85 118.70 117.56 1j2q s GLU 211 Ca -0.07 -0.93 0.01 0.00 0.36 0.00 0.00 54.97 54.34 1j2q s GLU 211 Cb -0.04 -2.18 0.02 0.00 0.26 0.00 0.00 34.13 32.18 1j2q s GLU 211 CO 0.00 0.56 -0.03 0.08 -0.54 0.00 0.00 175.26 175.33 1j2q s VAL 212 N -0.83 0.38 0.08 3.70 1.01 -1.26 -0.44 120.40 123.03 1j2q s VAL 212 Ca 0.13 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.06 1j2q s VAL 212 Cb -0.10 -0.41 -0.03 0.00 0.00 0.00 0.00 36.38 35.84 1j2q s VAL 212 CO 0.03 0.17 -0.07 -0.83 0.00 0.00 0.00 175.10 174.40 1j2q s GLY 213 N 0.69 0.67 0.34 4.51 0.00 0.46 -1.10 107.32 112.89 1j2q s GLY 213 Ca -0.08 -1.12 -0.16 0.00 0.00 0.00 0.00 44.72 43.37 1j2q s GLY 213 CO -0.00 -1.20 0.72 -2.52 0.00 0.00 0.00 173.10 170.10 1j2q s TYR 214 N -2.69 0.13 -0.25 1.90 -0.85 -0.48 -0.06 117.35 115.04 1j2q s TYR 214 Ca 0.03 -0.68 -0.02 0.00 -0.52 0.00 0.00 57.07 55.88 1j2q s TYR 214 Cb -0.01 0.68 0.13 0.00 0.38 0.00 0.00 41.96 43.14 1j2q s TYR 214 CO -0.03 -1.40 0.33 0.08 -1.52 0.00 0.00 175.55 173.01 1j2q s VAL 215 N -2.95 -0.49 0.20 -3.49 1.01 -0.92 -1.81 120.40 111.94 1j2q s VAL 215 Ca 0.16 -0.22 -0.28 0.00 0.00 0.00 0.00 61.98 61.64 1j2q s VAL 215 Cb -0.05 -0.85 -0.08 0.00 0.00 0.00 0.00 36.38 35.40 1j2q s VAL 215 CO 0.11 -0.25 0.85 -0.54 0.00 0.00 0.00 175.10 175.27 1j2q s LYS 216 N 2.45 4.71 0.58 2.72 1.02 -1.26 -2.77 119.74 127.18 1j2q s LYS 216 Ca 0.10 1.32 0.36 0.00 0.02 0.00 0.00 55.97 57.77 1j2q s LYS 216 Cb -0.15 -3.27 1.97 0.00 -0.52 0.00 0.00 37.83 35.86 1j2q s LYS 216 CO -0.21 0.55 2.10 -0.24 -0.92 0.00 0.00 175.35 176.62 1j2q h VAL 217 N 3.24 0.00 0.25 3.17 3.04 -1.41 -2.52 116.25 122.03 1j2q h VAL 217 Ca -0.46 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.22 1j2q h VAL 217 Cb 1.20 0.80 0.00 0.00 -2.01 0.00 0.00 31.29 31.29 1j2q h VAL 217 CO 0.67 0.00 -0.12 -2.24 -1.01 0.00 0.00 177.57 174.87 1j2q h ASP 218 N 0.00 -0.28 -1.47 3.17 2.03 -1.93 -3.38 116.42 114.56 1j2q h ASP 218 Ca 0.00 -0.20 -0.62 0.00 -0.73 0.00 0.00 57.03 55.48 1j2q h ASP 218 Cb 0.12 0.07 -0.39 0.00 -0.83 0.00 0.00 39.33 38.30 1j2q h ASP 218 CO 0.00 0.22 -0.41 -0.90 -1.03 0.00 0.00 179.24 177.12 1j2q n ASP 219 N -5.00 5.28 0.00 4.15 5.75 -1.16 -5.00 116.55 120.57 1j2q n ASP 219 Ca -0.07 -3.75 0.00 0.00 -0.01 0.00 0.00 54.79 50.96 1j2q n ASP 219 Cb 0.24 -0.55 0.00 0.00 -1.03 0.00 0.00 41.12 39.77 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 -0.53 0.00 -4.04 0.11 3.00 -0.96 -4.77 116.66 109.47 1j2q n ARG 220 Ca 0.43 0.00 -0.21 0.00 -0.01 0.00 0.00 57.85 58.06 1j2q n ARG 220 Cb 0.64 0.00 -0.17 0.00 0.00 0.00 0.00 32.46 32.93 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 0.53 0.06 0.55 -4.23 -1.26 -3.83 115.64 107.47 1j2q s THR 220 Ca 0.00 -0.07 -0.30 0.00 -1.18 0.00 0.00 61.69 60.14 1j2q s THR 220 Cb 0.00 -0.59 -0.09 0.00 1.34 0.00 0.00 72.50 73.16 1j2q s THR 220 CO 0.00 0.25 1.91 0.12 -0.54 0.00 0.00 174.62 176.36 1j2q s PHE 221 N 1.25 1.57 0.16 3.99 2.19 0.23 -4.51 117.98 122.87 1j2q s PHE 221 Ca -0.06 -0.30 0.07 0.00 0.33 0.00 0.00 56.93 56.97 1j2q s PHE 221 Cb -0.14 -4.21 -0.04 0.00 -1.31 0.00 0.00 43.02 37.32 1j2q s PHE 221 CO -0.02 -5.29 -0.15 0.21 1.83 0.00 0.00 175.22 171.80 1j2q s LYS 222 N 3.91 1.19 -0.12 10.12 2.20 -0.75 -5.00 119.74 131.30 1j2q s LYS 222 Ca 0.86 -1.41 0.03 0.00 -0.36 0.00 0.00 55.97 55.08 1j2q s LYS 222 Cb -0.43 -1.08 0.00 0.00 -1.51 0.00 0.00 37.83 34.81 1j2q s LYS 222 CO 0.39 0.20 -0.22 -2.00 -0.36 0.00 0.00 175.35 173.36 1j2q s GLU 223 N -3.09 3.08 0.05 4.03 2.12 -1.26 -1.39 118.70 122.24 1j2q s GLU 223 Ca 0.16 -0.85 -0.31 0.00 0.36 0.00 0.00 54.97 54.33 1j2q s GLU 223 Cb -0.03 -2.39 -0.10 0.00 0.26 0.00 0.00 34.13 31.86 1j2q s GLU 223 CO 0.05 0.10 1.90 0.28 -0.54 0.00 0.00 175.26 177.06 1j2q n VAL 224 N 3.75 0.58 -2.01 3.70 0.31 -0.26 -4.95 118.33 119.44 1j2q n VAL 224 Ca -0.19 -0.10 -0.34 0.00 -0.01 0.00 0.00 64.34 63.69 1j2q n VAL 224 Cb 0.52 -2.16 0.02 0.00 -0.91 0.00 0.00 33.84 31.32 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 3.70 5.42 0.46 4.52 1.04 -1.26 -4.63 113.70 122.95 1j2q s SER 225 Ca 0.87 2.09 0.21 0.00 0.48 0.00 0.00 55.95 59.59 1j2q s SER 225 Cb -0.50 -2.57 1.19 0.00 0.10 0.00 0.00 66.02 64.25 1j2q s SER 225 CO 0.42 -1.42 1.90 1.55 0.98 0.00 0.00 173.24 176.67 1j2q h PRO 226 N 0.63 0.27 -0.10 4.02 0.13 -1.94 -0.25 132.00 134.75 1j2q h PRO 226 Ca -0.48 -0.02 -0.14 0.00 -0.87 0.00 0.00 66.00 64.49 1j2q h PRO 226 Cb 1.25 -0.06 0.01 0.00 0.13 0.00 0.00 31.00 32.33 1j2q h PRO 226 CO 0.56 0.18 -0.47 0.93 -0.23 0.00 0.00 178.00 178.97 1j2q h GLU 227 N 0.28 0.50 0.00 0.86 3.07 -1.99 -2.68 114.58 114.61 1j2q h GLU 227 Ca 0.41 -0.40 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1j2q h GLU 227 Cb 1.17 0.08 0.00 0.00 -0.84 0.00 0.00 28.75 29.16 1j2q h GLU 227 CO -0.11 1.03 0.00 0.93 -1.40 0.00 0.00 179.01 179.46 1j2q h GLU 228 N 0.09 0.00 0.03 2.33 5.08 -1.58 -2.87 114.58 117.67 1j2q h GLU 228 Ca -0.03 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.21 1j2q h GLU 228 Cb 1.11 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.37 1j2q h GLU 228 CO 0.10 0.00 -0.47 -0.07 -1.00 0.00 0.00 179.01 177.56 1j2q h LEU 229 N 0.00 0.36 -0.17 1.33 3.38 -0.84 -3.39 115.31 115.99 1j2q h LEU 229 Ca 0.00 -0.83 0.02 0.00 0.09 0.00 0.00 57.88 57.15 1j2q h LEU 229 Cb 0.30 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1j2q h LEU 229 CO 0.00 1.15 -0.10 0.29 0.09 0.00 0.00 178.44 179.87 1j2q n LYS 230 N -4.33 -0.07 -0.18 1.13 4.01 -1.03 -0.22 118.16 117.46 1j2q n LYS 230 Ca -0.11 0.50 -0.01 0.00 -0.51 0.00 0.00 58.31 58.18 1j2q n LYS 230 Cb 0.63 -0.74 0.08 0.00 -0.51 0.00 0.00 35.03 34.49 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 -0.05 1.97 0.13 -1.76 -0.18 132.00 132.35 1j2q h PRO 231 Ca 0.03 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1j2q h PRO 231 Cb 0.07 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.14 1j2q h PRO 231 CO -0.16 0.16 0.02 1.88 -0.23 0.00 0.00 178.00 179.67 1j2q h TYR 232 N 0.25 0.08 -0.61 1.56 -1.99 -0.79 0.12 116.97 115.59 1j2q h TYR 232 Ca 0.28 -0.00 0.04 0.00 2.00 0.00 0.00 58.73 61.04 1j2q h TYR 232 Cb 0.39 -0.02 -0.04 0.00 2.00 0.00 0.00 36.73 39.05 1j2q h TYR 232 CO -0.24 0.19 0.36 0.28 -0.00 0.00 0.00 178.16 178.75 1j2q h VAL 233 N -0.05 1.04 0.63 -2.88 2.07 -0.89 -0.23 116.25 115.93 1j2q h VAL 233 Ca 0.02 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 1j2q h VAL 233 Cb 0.14 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 1j2q h VAL 233 CO -0.00 0.13 -0.42 -0.08 0.02 0.00 0.00 177.57 177.22 1j2q h GLU 233 N 0.70 -0.96 -0.00 1.57 4.81 -0.82 0.43 114.58 120.30 1j2q h GLU 233 Ca 0.25 0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 1j2q h GLU 233 Cb 0.07 0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1j2q h GLU 233 CO -0.13 -0.64 0.00 -0.09 -0.73 0.00 0.00 179.01 177.42 1j2q h ARG 233 N -1.00 0.00 0.07 1.92 2.43 -0.74 -2.24 114.38 114.82 1j2q h ARG 233 Ca -0.08 0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 58.89 1j2q h ARG 233 Cb 0.82 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.36 1j2q h ARG 233 CO 0.06 0.00 -1.05 0.00 -1.51 0.00 0.00 179.97 177.47 1j2q h ALA 233 N 2.00 0.14 -0.36 2.80 0.00 -0.39 -3.29 119.26 120.16 1j2q h ALA 233 Ca 0.00 -0.97 0.10 0.00 0.00 0.00 0.00 54.91 54.04 1j2q h ALA 233 Cb 0.00 0.42 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1j2q h ALA 233 CO -0.00 0.60 0.38 -0.91 0.00 0.00 0.00 179.25 179.32 1j2q h ASN 233 N -0.61 0.00 0.00 0.00 -0.26 0.37 -0.85 115.58 114.23 1j2q h ASN 233 Ca -0.24 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.50 1j2q h ASN 233 Cb 1.49 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.75 1j2q h ASN 233 CO -0.01 0.00 0.00 1.21 -1.06 0.00 0.00 177.43 177.57 1j2q n GLU 233 N -3.78 0.00 0.32 0.81 4.07 -0.89 -1.58 120.64 119.59 1j2q n GLU 233 Ca 0.06 0.27 0.17 0.00 -0.06 0.00 0.00 57.16 57.60 1j2q n GLU 233 Cb 0.54 -1.18 0.91 0.00 -0.06 0.00 0.00 31.44 31.65 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 0.43 5.31 2.43 -1.55 -2.20 114.38 118.80 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 -0.21 0.82 -1.51 0.00 0.00 179.97 179.07 1j2q h ILE 233 N 0.00 0.26 -0.43 1.20 2.04 -0.92 -3.24 117.51 116.42 1j2q h ILE 233 Ca 0.01 -0.60 0.09 0.00 1.00 0.00 0.00 64.86 65.36 1j2q h ILE 233 Cb 0.53 0.40 -0.08 0.00 -0.74 0.00 0.00 36.82 36.93 1j2q h ILE 233 CO -0.00 0.05 -0.13 0.03 0.00 0.00 0.00 178.15 178.10 1j2q h ARG 233 N -1.06 -0.03 0.00 2.37 3.08 -0.69 0.50 114.38 118.55 1j2q h ARG 233 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1j2q h ARG 233 Cb 0.53 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1j2q h ARG 233 CO 0.10 -0.02 0.00 -1.91 -1.07 0.00 0.00 179.97 177.07 1j2q n GLU 233 N -5.34 0.00 -1.05 0.04 2.13 -0.97 -5.03 120.64 110.42 1j2q n GLU 233 Ca 0.03 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.83 1j2q n GLU 233 Cb 0.25 -0.86 0.00 0.00 0.27 0.00 0.00 31.44 31.10 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 0.34 -0.37 0.00 4.31 4.77 0.18 -5.09 117.00 121.14 1j2q n LEU 233 Ca 0.00 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1j2q n LEU 233 Cb 0.00 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 1j2q n LEU 233 CO 0.00 -0.09 0.00 1.17 -1.33 0.00 0.00 177.39 177.14