#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uqt n ARG 2 N 0.00 0.61 -4.75 4.33 0.63 -1.26 -4.76 116.66 111.45 1uqt n ARG 2 Ca 0.00 0.26 -0.33 0.00 -0.92 0.00 0.00 57.85 56.86 1uqt n ARG 2 Cb 0.00 -2.14 -0.16 0.00 0.45 0.00 0.00 32.46 30.61 1uqt n ARG 2 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 1uqt s LEU 3 N -2.27 2.27 -0.26 6.15 2.96 -0.81 -0.63 118.68 126.09 1uqt s LEU 3 Ca 0.73 -0.53 -0.00 0.00 -0.22 0.00 0.00 54.13 54.11 1uqt s LEU 3 Cb -0.37 -1.49 0.04 0.00 0.50 0.00 0.00 46.19 44.87 1uqt s LEU 3 CO 0.50 0.11 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.88 1uqt s VAL 4 N 0.67 2.69 -0.13 1.68 1.01 0.08 -1.93 120.40 124.48 1uqt s VAL 4 Ca -0.09 -1.30 -0.06 0.00 0.00 0.00 0.00 61.98 60.53 1uqt s VAL 4 Cb -0.16 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 1uqt s VAL 4 CO 0.02 0.06 0.10 -0.69 0.00 0.00 0.00 175.10 174.59 1uqt s VAL 5 N 1.24 5.18 -0.04 2.92 1.01 -0.64 -0.37 120.40 129.71 1uqt s VAL 5 Ca -0.04 0.09 0.04 0.00 0.00 0.00 0.00 61.98 62.07 1uqt s VAL 5 Cb -0.18 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 32.93 1uqt s VAL 5 CO -0.04 0.58 -0.14 0.54 0.00 0.00 0.00 175.10 176.04 1uqt s VAL 6 N -0.68 1.22 -0.07 2.92 0.11 -0.01 -1.06 120.40 122.83 1uqt s VAL 6 Ca 0.12 -0.59 -0.16 0.00 -2.93 0.00 0.00 61.98 58.43 1uqt s VAL 6 Cb -0.12 -1.06 0.03 0.00 -1.53 0.00 0.00 36.38 33.70 1uqt s VAL 6 CO 0.03 0.36 0.38 -0.94 -3.33 0.00 0.00 175.10 171.59 1uqt s SER 7 N 0.16 -0.32 0.16 3.54 1.04 -1.07 -0.90 113.70 116.31 1uqt s SER 7 Ca -0.05 0.42 -0.15 0.00 0.48 0.00 0.00 55.95 56.65 1uqt s SER 7 Cb -0.11 0.53 0.03 0.00 0.10 0.00 0.00 66.02 66.57 1uqt s SER 7 CO 0.02 -0.34 1.80 -1.13 0.98 0.00 0.00 173.24 174.57 1uqt h ASN 8 N 4.44 0.55 -3.28 7.02 -0.73 -1.88 -3.35 115.58 118.36 1uqt h ASN 8 Ca -0.28 -0.05 -0.64 0.00 1.87 0.00 0.00 56.30 57.19 1uqt h ASN 8 Cb 1.18 -0.14 -0.14 0.00 0.27 0.00 0.00 38.32 39.48 1uqt h ASN 8 CO 0.34 0.44 -0.72 -0.13 -0.37 0.00 0.00 177.43 176.99 1uqt s ARG 9 N -6.01 2.17 0.24 6.67 1.81 -1.26 -1.08 118.95 121.48 1uqt s ARG 9 Ca -0.13 -1.10 0.01 0.00 -1.72 0.00 0.00 55.73 52.79 1uqt s ARG 9 Cb 0.11 -2.28 -0.05 0.00 -0.45 0.00 0.00 34.95 32.28 1uqt s ARG 9 CO 0.74 0.48 0.08 0.96 -0.68 0.00 0.00 175.30 176.88 1uqt s ILE 10 N -1.44 0.57 -0.20 1.52 -4.36 -1.23 -4.87 121.20 111.19 1uqt s ILE 10 Ca 0.24 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.64 1uqt s ILE 10 Cb -0.10 -2.52 0.03 0.00 1.25 0.00 0.00 42.46 41.12 1uqt s ILE 10 CO 0.15 -0.11 -0.18 0.00 0.24 0.00 0.00 174.94 175.05 1uqt s ALA 11 N -3.74 2.38 1.06 2.27 0.00 -1.26 -4.99 121.76 117.48 1uqt s ALA 11 Ca 0.35 -1.35 -0.18 0.00 0.00 0.00 0.00 51.96 50.78 1uqt s ALA 11 Cb 0.07 -1.28 0.24 0.00 0.00 0.00 0.00 23.12 22.16 1uqt s ALA 11 CO 0.11 -0.56 1.27 -2.30 0.00 0.00 0.00 175.76 174.28 1uqt n PRO 12 N 4.58 -1.74 -1.52 0.00 -0.02 -1.26 -5.10 135.00 129.94 1uqt n PRO 12 Ca -0.19 -1.98 -0.32 0.00 -2.02 0.00 0.00 63.50 58.99 1uqt n PRO 12 Cb 0.48 -1.43 -0.13 0.00 -0.02 0.00 0.00 33.50 32.40 1uqt n PRO 12 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1uqt n PRO 13 N -4.06 0.31 -3.80 0.52 -0.02 -1.26 -5.22 135.00 121.47 1uqt n PRO 13 Ca 0.16 -0.11 -0.03 0.00 -2.02 0.00 0.00 63.50 61.50 1uqt n PRO 13 Cb 0.58 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 1uqt n PRO 13 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1uqt s ALA 20 N 8.45 -1.62 0.31 3.55 0.00 -1.26 -5.29 121.76 125.89 1uqt s ALA 20 Ca 1.21 -0.06 0.04 0.00 0.00 0.00 0.00 51.96 53.15 1uqt s ALA 20 Cb -0.77 0.67 -0.06 0.00 0.00 0.00 0.00 23.12 22.97 1uqt s ALA 20 CO 0.40 -1.05 0.05 0.20 0.00 0.00 0.00 175.76 175.36 1uqt s GLY 21 N -3.12 1.98 0.18 0.00 0.00 -1.26 -5.02 107.32 100.07 1uqt s GLY 21 Ca 0.16 -2.00 -0.24 0.00 0.00 0.00 0.00 44.72 42.64 1uqt s GLY 21 CO 0.03 -1.78 1.48 0.61 0.00 0.00 0.00 173.10 173.45 1uqt n GLY 22 N -0.63 -2.26 0.15 0.20 0.00 -1.26 -1.51 105.19 99.88 1uqt n GLY 22 Ca -0.03 1.11 -0.10 0.00 0.00 0.00 0.00 46.02 47.00 1uqt n GLY 22 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1uqt h LEU 23 N 0.00 0.42 -1.57 0.99 5.85 -1.98 -3.13 115.31 115.89 1uqt h LEU 23 Ca 0.24 -0.23 0.10 0.00 0.84 0.00 0.00 57.88 58.82 1uqt h LEU 23 Cb 0.48 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 1uqt h LEU 23 CO -0.93 0.54 0.43 0.00 -0.34 0.00 0.00 178.44 178.15 1uqt h ALA 24 N 0.89 1.96 -0.02 1.25 0.00 -1.69 -1.82 119.26 119.83 1uqt h ALA 24 Ca 0.09 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.82 1uqt h ALA 24 Cb 0.29 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1uqt h ALA 24 CO 0.00 -0.10 -0.73 -0.24 0.00 0.00 0.00 179.25 178.18 1uqt h VAL 25 N 0.49 1.47 -0.27 0.00 3.04 -1.45 -1.31 116.25 118.21 1uqt h VAL 25 Ca 0.30 -2.37 -0.10 0.00 -1.01 0.00 0.00 66.70 63.52 1uqt h VAL 25 Cb 0.52 2.28 -0.01 0.00 -2.01 0.00 0.00 31.29 32.08 1uqt h VAL 25 CO -0.09 0.69 -0.22 1.23 -1.01 0.00 0.00 177.57 178.16 1uqt h GLY 26 N 1.88 0.69 1.05 3.17 0.00 -1.33 -2.42 103.07 106.11 1uqt h GLY 26 Ca -0.02 -0.68 -0.05 0.00 0.00 0.00 0.00 47.33 46.58 1uqt h GLY 26 CO 0.10 0.61 0.24 -2.22 0.00 0.00 0.00 176.54 175.28 1uqt h ILE 27 N 0.36 1.26 -0.53 2.60 2.04 -1.37 -2.48 117.51 119.40 1uqt h ILE 27 Ca 0.05 -0.88 -0.08 0.00 1.00 0.00 0.00 64.86 64.95 1uqt h ILE 27 Cb 0.77 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 1uqt h ILE 27 CO 0.06 0.35 0.00 -0.07 0.00 0.00 0.00 178.15 178.48 1uqt h LEU 28 N 1.07 0.87 -0.51 1.44 -0.00 -1.25 -2.07 115.31 114.85 1uqt h LEU 28 Ca 0.24 -0.22 -0.12 0.00 -0.00 0.00 0.00 57.88 57.77 1uqt h LEU 28 Cb 0.29 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 40.70 1uqt h LEU 28 CO -0.01 0.93 -0.15 1.23 -0.00 0.00 0.00 178.44 180.44 1uqt h GLY 29 N 0.99 1.10 1.23 0.83 0.00 -1.32 -0.98 103.07 104.92 1uqt h GLY 29 Ca 0.16 -0.93 -0.09 0.00 0.00 0.00 0.00 47.33 46.48 1uqt h GLY 29 CO 0.02 0.84 -0.00 0.00 0.00 0.00 0.00 176.54 177.40 1uqt h ALA 30 N 0.90 0.97 -0.02 3.60 0.00 -1.29 -2.78 119.26 120.64 1uqt h ALA 30 Ca 0.13 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.61 1uqt h ALA 30 Cb 0.73 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1uqt h ALA 30 CO 0.06 0.62 -0.61 -0.07 0.00 0.00 0.00 179.25 179.25 1uqt h LEU 31 N 0.85 0.06 -0.56 0.00 3.38 -1.29 -2.92 115.31 114.84 1uqt h LEU 31 Ca 0.16 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 1uqt h LEU 31 Cb 0.51 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1uqt h LEU 31 CO 0.03 0.66 -0.49 0.50 0.09 0.00 0.00 178.44 179.22 1uqt h LYS 32 N 0.04 0.59 0.03 1.13 3.11 -0.93 0.14 116.57 120.68 1uqt h LYS 32 Ca -0.01 -0.34 -0.23 0.00 -2.81 0.00 0.00 60.65 57.26 1uqt h LYS 32 Cb 1.09 0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 32.35 1uqt h LYS 32 CO 0.08 0.95 -0.99 0.00 -2.81 0.00 0.00 179.45 176.68 1uqt h ALA 33 N 0.99 0.35 0.00 5.00 0.00 -1.51 -3.36 119.26 120.72 1uqt h ALA 33 Ca 0.02 -0.76 -0.25 0.00 0.00 0.00 0.00 54.91 53.92 1uqt h ALA 33 Cb 1.02 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 1uqt h ALA 33 CO 0.09 0.89 -2.16 0.00 0.00 0.00 0.00 179.25 178.08 1uqt n ALA 34 N -2.51 1.83 -0.32 0.00 0.00 -1.10 -5.04 120.51 113.37 1uqt n ALA 34 Ca -0.06 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.36 1uqt n ALA 34 Cb 0.87 -0.26 0.00 0.00 0.00 0.00 0.00 19.45 20.06 1uqt n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uqt n GLY 35 N 1.77 -3.27 0.00 0.00 0.00 0.48 -4.44 105.19 99.73 1uqt n GLY 35 Ca -0.23 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1uqt n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uqt n GLY 36 N -1.10 1.31 3.59 -0.02 0.00 -0.68 -1.92 105.19 106.37 1uqt n GLY 36 Ca 0.00 -0.15 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 1uqt n GLY 36 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1uqt s LEU 37 N 0.00 -0.71 -0.29 0.99 2.96 -0.81 -2.06 118.68 118.76 1uqt s LEU 37 Ca 0.00 1.40 0.01 0.00 -0.22 0.00 0.00 54.13 55.32 1uqt s LEU 37 Cb 0.00 2.30 0.07 0.00 0.50 0.00 0.00 46.19 49.06 1uqt s LEU 37 CO 0.00 -0.24 -0.03 0.86 -1.32 0.00 0.00 176.35 175.63 1uqt s TRP 38 N 0.91 3.36 -0.23 5.38 -0.00 -0.14 -1.61 118.94 126.61 1uqt s TRP 38 Ca -0.04 -2.27 -0.06 0.00 -0.00 0.00 0.00 56.10 53.72 1uqt s TRP 38 Cb -0.05 -2.22 -0.03 0.00 -0.00 0.00 0.00 33.47 31.18 1uqt s TRP 38 CO -0.08 -0.87 0.04 0.12 -0.00 0.00 0.00 176.95 176.16 1uqt s PHE 39 N 1.13 3.07 0.13 5.86 2.19 -0.23 -1.96 117.98 128.17 1uqt s PHE 39 Ca -0.04 -0.47 -0.25 0.00 0.33 0.00 0.00 56.93 56.50 1uqt s PHE 39 Cb -0.20 -2.18 0.08 0.00 -1.31 0.00 0.00 43.02 39.41 1uqt s PHE 39 CO -0.04 -0.33 1.06 0.20 1.83 0.00 0.00 175.22 177.94 1uqt s GLY 40 N 1.39 -0.16 0.62 13.12 0.00 -0.85 -2.60 107.32 118.85 1uqt s GLY 40 Ca 0.05 0.09 -0.16 0.00 0.00 0.00 0.00 44.72 44.69 1uqt s GLY 40 CO 0.02 0.93 1.12 0.86 0.00 0.00 0.00 173.10 176.04 1uqt s TRP 41 N -2.75 2.61 -0.45 1.90 -0.00 -0.24 -3.16 118.94 116.85 1uqt s TRP 41 Ca 0.16 1.55 0.02 0.00 -0.00 0.00 0.00 56.10 57.83 1uqt s TRP 41 Cb -0.01 -3.22 0.14 0.00 -0.00 0.00 0.00 33.47 30.38 1uqt s TRP 41 CO 0.02 -1.70 0.27 0.45 -0.00 0.00 0.00 176.95 175.99 1uqt s SER 42 N -2.30 3.47 -0.89 5.86 0.15 -1.00 -3.58 113.70 115.41 1uqt s SER 42 Ca 0.69 -2.72 -0.25 0.00 0.70 0.00 0.00 55.95 54.37 1uqt s SER 42 Cb -0.22 -0.96 0.03 0.00 -1.71 0.00 0.00 66.02 63.16 1uqt s SER 42 CO 0.37 -0.25 1.43 -0.83 1.20 0.00 0.00 173.24 175.17 1uqt s GLY 43 N 0.25 1.01 0.00 9.45 0.00 -1.26 -4.61 107.32 112.16 1uqt s GLY 43 Ca 0.20 -1.82 0.00 0.00 0.00 0.00 0.00 44.72 43.10 1uqt s GLY 43 CO -0.03 2.75 0.29 -1.84 0.00 0.00 0.00 173.10 174.27 1uqt n GLU 44 N 9.08 0.00 -0.10 2.90 0.28 -1.26 -5.15 120.64 126.39 1uqt n GLU 44 Ca 0.22 -0.29 0.01 0.00 -0.16 0.00 0.00 57.16 56.95 1uqt n GLU 44 Cb 0.50 -0.33 -0.00 0.00 1.43 0.00 0.00 31.44 33.03 1uqt n GLU 44 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1uqt n THR 45 N 0.00 0.00 0.00 3.84 -2.24 -1.26 -4.95 114.28 109.67 1uqt n THR 45 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1uqt n THR 45 Cb 0.46 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 1uqt n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uqt n GLY 46 N -0.36 2.28 2.66 3.38 0.00 -1.24 -4.88 105.19 107.03 1uqt n GLY 46 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1uqt n GLY 46 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1uqt n ASN 47 N 0.00 -2.30 -0.18 1.61 2.04 -1.26 -5.02 115.26 110.15 1uqt n ASN 47 Ca 0.00 -3.31 0.29 0.00 -0.44 0.00 0.00 54.58 51.12 1uqt n ASN 47 Cb 0.00 1.49 0.61 0.00 -2.53 0.00 0.00 39.78 39.34 1uqt n ASN 47 CO 0.00 0.00 0.00 1.05 -0.44 0.00 0.00 177.26 177.87 1uqt h GLU 48 N 3.76 0.00 -1.10 -3.83 4.11 -1.84 -3.28 114.58 112.40 1uqt h GLU 48 Ca -0.11 0.00 -0.40 0.00 0.07 0.00 0.00 59.36 58.93 1uqt h GLU 48 Cb 1.03 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.06 1uqt h GLU 48 CO 0.31 0.00 0.51 -3.47 0.07 0.00 0.00 179.01 176.43 1uqt n ASP 49 N -3.55 4.65 -4.75 3.06 2.03 -1.26 -4.75 116.55 111.98 1uqt n ASP 49 Ca 0.21 -3.20 -0.24 0.00 0.52 0.00 0.00 54.79 52.08 1uqt n ASP 49 Cb 1.27 -0.83 -0.07 0.00 -0.72 0.00 0.00 41.12 40.77 1uqt n ASP 49 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1uqt s GLN 50 N -2.42 2.29 1.21 -0.67 -0.21 -1.24 -5.14 119.66 113.49 1uqt s GLN 50 Ca 0.41 -1.73 -0.13 0.00 0.02 0.00 0.00 55.36 53.94 1uqt s GLN 50 Cb 0.34 -2.07 0.31 0.00 1.00 0.00 0.00 33.01 32.59 1uqt s GLN 50 CO 0.05 -0.05 1.01 -2.30 -2.12 0.00 0.00 175.29 171.87 1uqt n PRO 51 N -1.24 -2.73 -2.42 2.91 -0.02 -1.26 -4.97 135.00 125.27 1uqt n PRO 51 Ca -0.01 -0.77 -0.41 0.00 -2.02 0.00 0.00 63.50 60.28 1uqt n PRO 51 Cb 0.63 -2.15 -0.03 0.00 -0.02 0.00 0.00 33.50 31.93 1uqt n PRO 51 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1uqt s LEU 52 N -7.37 4.44 -0.62 2.45 2.01 -1.26 -4.95 118.68 113.39 1uqt s LEU 52 Ca 0.69 2.15 -0.28 0.00 0.01 0.00 0.00 54.13 56.70 1uqt s LEU 52 Cb -0.26 -3.60 0.02 0.00 0.01 0.00 0.00 46.19 42.36 1uqt s LEU 52 CO 0.66 -0.36 1.37 -0.54 1.01 0.00 0.00 176.35 178.49 1uqt s LYS 53 N 0.03 3.26 -0.11 1.70 -0.14 -0.50 -4.86 119.74 119.12 1uqt s LYS 53 Ca 0.53 0.24 -0.04 0.00 -1.36 0.00 0.00 55.97 55.34 1uqt s LYS 53 Cb -0.31 -4.14 -0.04 0.00 -1.68 0.00 0.00 37.83 31.67 1uqt s LYS 53 CO 0.34 -2.01 0.05 0.15 -0.76 0.00 0.00 175.35 173.12 1uqt s LYS 54 N 5.58 3.31 0.06 1.68 1.02 -1.26 -1.78 119.74 128.34 1uqt s LYS 54 Ca 0.47 -0.33 0.01 0.00 0.02 0.00 0.00 55.97 56.14 1uqt s LYS 54 Cb -0.10 -2.97 -0.03 0.00 -0.52 0.00 0.00 37.83 34.21 1uqt s LYS 54 CO 0.22 0.62 -0.05 0.14 -0.92 0.00 0.00 175.35 175.36 1uqt s VAL 55 N -0.64 0.45 -0.03 3.17 -7.23 -0.95 -5.03 120.40 110.14 1uqt s VAL 55 Ca 0.11 -1.51 0.01 0.00 -1.81 0.00 0.00 61.98 58.78 1uqt s VAL 55 Cb -0.12 -1.13 0.02 0.00 0.56 0.00 0.00 36.38 35.71 1uqt s VAL 55 CO 0.02 -0.71 -0.04 -0.75 -0.31 0.00 0.00 175.10 173.31 1uqt s LYS 56 N -2.88 0.60 0.00 4.82 2.36 -1.26 -1.91 119.74 121.47 1uqt s LYS 56 Ca 0.00 -0.08 0.00 0.00 -2.55 0.00 0.00 55.97 53.35 1uqt s LYS 56 Cb -0.01 -0.65 0.00 0.00 -1.05 0.00 0.00 37.83 36.13 1uqt s LYS 56 CO -0.04 -0.05 0.00 1.17 1.55 0.00 0.00 175.35 177.98 1uqt n LYS 57 N 3.81 0.00 0.09 4.03 4.81 -0.95 -5.05 118.16 124.89 1uqt n LYS 57 Ca -0.23 0.04 0.00 0.00 -0.87 0.00 0.00 58.31 57.24 1uqt n LYS 57 Cb 0.52 -0.29 0.00 0.00 0.02 0.00 0.00 35.03 35.28 1uqt n LYS 57 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1uqt n GLY 58 N 2.35 -1.83 0.19 3.14 0.00 -1.26 -4.92 105.19 102.86 1uqt n GLY 58 Ca 0.00 0.44 -0.08 0.00 0.00 0.00 0.00 46.02 46.39 1uqt n GLY 58 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1uqt h ASN 59 N 0.00 0.45 -4.23 1.61 -0.00 -1.94 -3.47 115.58 107.99 1uqt h ASN 59 Ca 0.00 -0.25 -0.54 0.00 -0.00 0.00 0.00 56.30 55.51 1uqt h ASN 59 Cb 0.00 -0.13 -0.22 0.00 -0.00 0.00 0.00 38.32 37.97 1uqt h ASN 59 CO 0.00 0.95 -0.82 0.27 -0.00 0.00 0.00 177.43 177.83 1uqt s ILE 60 N -3.82 1.62 -0.08 2.57 -4.36 -1.26 -1.68 121.20 114.18 1uqt s ILE 60 Ca -0.06 -1.50 0.02 0.00 -0.26 0.00 0.00 60.65 58.86 1uqt s ILE 60 Cb 0.11 -1.48 0.01 0.00 1.25 0.00 0.00 42.46 42.36 1uqt s ILE 60 CO 0.82 -0.08 -0.15 0.28 0.24 0.00 0.00 174.94 176.05 1uqt s THR 61 N -1.17 1.41 0.40 8.37 -1.32 -0.87 -2.24 115.64 120.22 1uqt s THR 61 Ca 0.05 -0.63 -0.20 0.00 -1.21 0.00 0.00 61.69 59.71 1uqt s THR 61 Cb -0.10 -1.27 -0.10 0.00 -1.51 0.00 0.00 72.50 69.51 1uqt s THR 61 CO 0.04 0.42 0.89 0.26 -2.21 0.00 0.00 174.62 174.02 1uqt s TRP 62 N 0.69 3.34 -0.18 9.09 0.51 -0.80 -0.97 118.94 130.62 1uqt s TRP 62 Ca -0.13 1.51 -0.08 0.00 -2.12 0.00 0.00 56.10 55.28 1uqt s TRP 62 Cb -0.16 -2.77 0.08 0.00 -0.81 0.00 0.00 33.47 29.81 1uqt s TRP 62 CO 0.03 -0.04 0.40 0.00 -0.51 0.00 0.00 176.95 176.83 1uqt s ALA 63 N -2.11 -1.06 0.16 0.98 0.00 -0.83 -2.24 121.76 116.66 1uqt s ALA 63 Ca 0.59 1.46 0.04 0.00 0.00 0.00 0.00 51.96 54.06 1uqt s ALA 63 Cb -0.10 -1.14 -0.05 0.00 0.00 0.00 0.00 23.12 21.84 1uqt s ALA 63 CO 0.15 -0.55 -0.09 -1.54 0.00 0.00 0.00 175.76 173.73 1uqt s SER 64 N 2.11 1.76 0.07 0.00 1.04 -0.74 -2.01 113.70 115.93 1uqt s SER 64 Ca -0.05 -1.04 -0.05 0.00 0.48 0.00 0.00 55.95 55.30 1uqt s SER 64 Cb -0.11 -0.00 -0.02 0.00 0.10 0.00 0.00 66.02 65.99 1uqt s SER 64 CO -0.12 -0.36 0.07 0.72 0.98 0.00 0.00 173.24 174.53 1uqt s PHE 65 N -3.36 0.34 0.34 5.02 -0.12 -1.19 -1.41 117.98 117.62 1uqt s PHE 65 Ca 0.18 -0.83 0.07 0.00 -0.05 0.00 0.00 56.93 56.31 1uqt s PHE 65 Cb 0.03 -0.23 -0.02 0.00 -0.63 0.00 0.00 43.02 42.17 1uqt s PHE 65 CO 0.01 -0.45 0.36 -0.80 -0.05 0.00 0.00 175.22 174.29 1uqt s ASN 66 N -2.84 5.48 0.09 1.98 0.02 -1.26 -2.37 114.94 116.04 1uqt s ASN 66 Ca 0.05 -0.42 0.09 0.00 -1.02 0.00 0.00 52.86 51.56 1uqt s ASN 66 Cb 0.06 -1.01 -0.03 0.00 0.02 0.00 0.00 41.25 40.29 1uqt s ASN 66 CO -0.10 -0.41 -0.23 -0.76 0.02 0.00 0.00 177.10 175.61 1uqt s LEU 67 N -4.07 2.27 0.78 0.60 1.43 -1.26 -4.66 118.68 113.76 1uqt s LEU 67 Ca 0.43 -0.66 -0.11 0.00 -1.03 0.00 0.00 54.13 52.76 1uqt s LEU 67 Cb -0.07 -1.05 0.06 0.00 0.03 0.00 0.00 46.19 45.16 1uqt s LEU 67 CO 0.28 0.14 1.10 -0.94 0.23 0.00 0.00 176.35 177.16 1uqt s SER 68 N -1.74 4.36 0.48 2.29 1.04 -1.26 -3.61 113.70 115.25 1uqt s SER 68 Ca 0.10 1.89 0.22 0.00 0.48 0.00 0.00 55.95 58.64 1uqt s SER 68 Cb -0.10 -2.53 1.20 0.00 0.10 0.00 0.00 66.02 64.69 1uqt s SER 68 CO 0.04 -2.13 2.00 -0.33 0.98 0.00 0.00 173.24 173.80 1uqt h GLU 69 N -1.10 0.00 -0.14 4.02 5.08 -1.98 -0.89 114.58 119.57 1uqt h GLU 69 Ca -0.44 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.81 1uqt h GLU 69 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1uqt h GLU 69 CO 0.50 0.18 -0.33 0.37 -1.00 0.00 0.00 179.01 178.73 1uqt h GLN 70 N 0.00 0.48 -0.50 2.33 4.15 -1.99 -1.85 115.11 117.73 1uqt h GLN 70 Ca -0.00 -0.32 -0.05 0.00 0.77 0.00 0.00 58.65 59.05 1uqt h GLN 70 Cb 0.40 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.11 1uqt h GLN 70 CO 0.02 0.93 0.11 -0.44 -1.93 0.00 0.00 178.83 177.53 1uqt h ASP 71 N 0.09 0.71 -0.06 -0.69 3.45 -1.80 -2.07 116.42 116.05 1uqt h ASP 71 Ca -0.00 -0.12 -0.03 0.00 0.43 0.00 0.00 57.03 57.31 1uqt h ASP 71 Cb 0.93 -0.19 -0.00 0.00 -0.56 0.00 0.00 39.33 39.52 1uqt h ASP 71 CO 0.07 0.71 -0.07 0.25 -1.57 0.00 0.00 179.24 178.63 1uqt h LEU 72 N 0.74 0.16 -0.61 1.55 6.46 -1.21 -0.41 115.31 121.98 1uqt h LEU 72 Ca 0.16 -0.51 0.04 0.00 -0.12 0.00 0.00 57.88 57.45 1uqt h LEU 72 Cb 0.28 -0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 40.13 1uqt h LEU 72 CO -0.00 0.64 0.36 -0.78 -0.62 0.00 0.00 178.44 178.04 1uqt h ASP 73 N -0.32 0.57 0.27 1.25 -0.00 -1.21 -1.16 116.42 115.83 1uqt h ASP 73 Ca 0.01 0.01 -0.34 0.00 -0.00 0.00 0.00 57.03 56.71 1uqt h ASP 73 Cb 0.60 -0.11 0.02 0.00 -0.00 0.00 0.00 39.33 39.84 1uqt h ASP 73 CO 0.02 0.39 -1.61 -0.33 -0.00 0.00 0.00 179.24 177.71 1uqt h GLU 74 N 0.70 0.42 0.30 0.28 5.08 -1.42 0.48 114.58 120.42 1uqt h GLU 74 Ca 0.25 -0.72 -0.01 0.00 -1.00 0.00 0.00 59.36 57.88 1uqt h GLU 74 Cb 0.07 0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1uqt h GLU 74 CO -0.12 1.33 -0.14 -0.92 -1.00 0.00 0.00 179.01 178.16 1uqt h TYR 75 N 0.12 -0.37 0.00 4.33 -0.00 -1.12 -1.72 116.97 118.21 1uqt h TYR 75 Ca -0.29 -0.01 -0.37 0.00 -0.00 0.00 0.00 58.73 58.05 1uqt h TYR 75 Cb 2.11 0.12 -0.06 0.00 -0.00 0.00 0.00 36.73 38.91 1uqt h TYR 75 CO 0.10 -0.15 -2.21 0.98 -0.00 0.00 0.00 178.16 176.88 1uqt n TYR 76 N -5.04 0.05 -0.08 -3.82 9.36 -0.73 -1.70 117.16 115.21 1uqt n TYR 76 Ca -0.06 0.02 -0.11 0.00 3.32 0.00 0.00 57.90 61.08 1uqt n TYR 76 Cb 0.19 -0.91 0.03 0.00 -0.63 0.00 0.00 39.34 38.02 1uqt n TYR 76 CO 0.00 0.00 0.00 -0.91 0.22 0.00 0.00 176.86 176.17 1uqt h ASN 77 N -1.00 0.84 0.00 2.98 -0.26 -1.24 -2.00 115.58 114.90 1uqt h ASN 77 Ca -0.56 -0.38 0.00 0.00 -0.56 0.00 0.00 56.30 54.80 1uqt h ASN 77 Cb 1.49 -0.24 0.00 0.00 -1.06 0.00 0.00 38.32 38.51 1uqt h ASN 77 CO -0.34 1.13 0.00 0.00 -1.06 0.00 0.00 177.43 177.16 1uqt n GLN 78 N -4.05 0.00 -0.14 0.81 6.02 0.17 -3.69 117.38 116.50 1uqt n GLN 78 Ca -0.02 0.13 -0.12 0.00 -0.01 0.00 0.00 57.00 56.98 1uqt n GLN 78 Cb 0.53 -0.53 -0.01 0.00 1.02 0.00 0.00 30.24 31.25 1uqt n GLN 78 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 1uqt h PHE 79 N 0.00 1.11 0.00 1.08 3.57 -1.38 -0.50 116.94 120.82 1uqt h PHE 79 Ca 0.00 -0.30 -0.00 0.00 3.53 0.00 0.00 57.97 61.20 1uqt h PHE 79 Cb 0.00 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.49 1uqt h PHE 79 CO 0.00 1.12 -0.00 0.77 -2.23 0.00 0.00 178.31 177.97 1uqt h SER 80 N 0.78 -0.00 0.45 0.41 0.02 -1.42 -1.01 113.55 112.78 1uqt h SER 80 Ca 0.08 -0.68 0.00 0.00 -0.84 0.00 0.00 61.79 60.35 1uqt h SER 80 Cb 0.87 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1uqt h SER 80 CO 0.08 0.68 -1.06 0.59 -1.14 0.00 0.00 176.83 175.98 1uqt n ASN 81 N -4.76 0.60 0.00 3.07 4.13 -0.75 -1.12 115.26 116.42 1uqt n ASN 81 Ca -0.09 -0.17 0.00 0.00 1.68 0.00 0.00 54.58 56.00 1uqt n ASN 81 Cb 0.34 0.82 0.00 0.00 -1.54 0.00 0.00 39.78 39.39 1uqt n ASN 81 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1uqt n ALA 82 N -1.86 1.83 0.03 5.41 0.00 -0.22 -4.43 120.51 121.27 1uqt n ALA 82 Ca 0.02 -0.39 -0.01 0.00 0.00 0.00 0.00 53.44 53.06 1uqt n ALA 82 Cb 0.45 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.89 1uqt n ALA 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1uqt n VAL 83 N -0.02 1.20 -0.05 0.00 0.31 -1.08 -1.18 118.33 117.51 1uqt n VAL 83 Ca 0.00 0.37 -0.13 0.00 -0.01 0.00 0.00 64.34 64.57 1uqt n VAL 83 Cb 0.08 -1.64 -0.07 0.00 -0.91 0.00 0.00 33.84 31.30 1uqt n VAL 83 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1uqt h LEU 84 N -0.10 0.33 0.28 7.52 3.38 -1.22 -1.42 115.31 124.09 1uqt h LEU 84 Ca 0.00 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.54 1uqt h LEU 84 Cb 0.10 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1uqt h LEU 84 CO 0.00 0.68 -0.13 -0.25 0.09 0.00 0.00 178.44 178.82 1uqt h TRP 85 N -0.01 -0.35 -0.40 1.13 2.91 -1.36 0.07 115.95 117.94 1uqt h TRP 85 Ca 0.03 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.03 1uqt h TRP 85 Cb 0.56 0.11 -0.02 0.00 -0.51 0.00 0.00 29.16 29.30 1uqt h TRP 85 CO 0.07 -0.17 0.19 -1.00 -1.03 0.00 0.00 178.44 176.50 1uqt h PRO 86 N -0.44 0.57 -0.80 2.65 0.13 -1.77 -2.37 132.00 129.97 1uqt h PRO 86 Ca -0.04 -0.08 -0.00 0.00 -0.87 0.00 0.00 66.00 65.01 1uqt h PRO 86 Cb 0.33 -0.10 -0.04 0.00 0.13 0.00 0.00 31.00 31.32 1uqt h PRO 86 CO 0.06 0.50 0.50 0.00 -0.23 0.00 0.00 178.00 178.83 1uqt h ALA 87 N 1.04 1.02 0.00 -0.56 0.00 -1.14 0.24 119.26 119.86 1uqt h ALA 87 Ca 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1uqt h ALA 87 Cb 0.11 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1uqt h ALA 87 CO -0.02 0.47 -0.07 0.74 0.00 0.00 0.00 179.25 180.37 1uqt h PHE 88 N 1.09 0.00 -0.91 0.00 0.05 -0.92 -2.01 116.94 114.25 1uqt h PHE 88 Ca 0.29 0.00 -0.43 0.00 3.82 0.00 0.00 57.97 61.65 1uqt h PHE 88 Cb -0.07 0.00 -0.26 0.00 2.00 0.00 0.00 35.95 37.63 1uqt h PHE 88 CO -0.01 0.07 0.53 0.72 -0.18 0.00 0.00 178.31 179.44 1uqt n HIS 89 N -3.14 2.84 -2.87 -0.55 8.25 -0.85 -4.42 115.22 114.48 1uqt n HIS 89 Ca 0.02 -1.67 -0.16 0.00 -0.26 0.00 0.00 57.72 55.65 1uqt n HIS 89 Cb 0.44 -0.87 0.03 0.00 1.12 0.00 0.00 29.99 30.72 1uqt n HIS 89 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1uqt n TYR 90 N -0.89 -1.50 -3.29 4.41 4.01 -0.75 -4.86 117.16 114.29 1uqt n TYR 90 Ca 0.54 0.43 -0.25 0.00 -0.16 0.00 0.00 57.90 58.45 1uqt n TYR 90 Cb 1.58 -3.55 -0.07 0.00 -0.31 0.00 0.00 39.34 36.99 1uqt n TYR 90 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1uqt n ARG 91 N -3.17 1.62 0.19 -0.72 5.12 0.01 -4.89 116.66 114.82 1uqt n ARG 91 Ca -0.07 -3.93 0.07 0.00 -1.93 0.00 0.00 57.85 51.99 1uqt n ARG 91 Cb 0.58 -1.73 0.57 0.00 -1.16 0.00 0.00 32.46 30.72 1uqt n ARG 91 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 1uqt h LEU 92 N 4.03 0.12 -2.48 0.55 4.07 -1.88 -1.89 115.31 117.83 1uqt h LEU 92 Ca 0.13 -0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.09 1uqt h LEU 92 Cb 0.77 -0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.48 1uqt h LEU 92 CO 0.64 0.11 -0.01 -2.24 -1.08 0.00 0.00 178.44 175.86 1uqt h ASP 93 N 0.14 0.00 0.10 -0.43 2.03 -1.95 -2.20 116.42 114.10 1uqt h ASP 93 Ca 0.04 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.34 1uqt h ASP 93 Cb 0.02 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.52 1uqt h ASP 93 CO -0.00 0.01 -0.95 0.18 -1.03 0.00 0.00 179.24 177.44 1uqt n LEU 94 N -3.13 0.87 -4.77 0.15 4.32 -0.72 -4.97 117.00 108.75 1uqt n LEU 94 Ca -0.02 -0.38 -0.39 0.00 -0.02 0.00 0.00 56.01 55.20 1uqt n LEU 94 Cb 0.15 -0.04 -0.02 0.00 -1.62 0.00 0.00 43.42 41.88 1uqt n LEU 94 CO 0.23 0.21 0.86 0.68 -1.22 0.00 0.00 177.39 178.15 1uqt s VAL 95 N -3.02 3.11 -0.51 4.08 -7.23 -0.83 -4.86 120.40 111.13 1uqt s VAL 95 Ca 0.08 0.97 0.06 0.00 -1.81 0.00 0.00 61.98 61.28 1uqt s VAL 95 Cb 0.16 -3.56 0.23 0.00 0.56 0.00 0.00 36.38 33.77 1uqt s VAL 95 CO 0.84 0.12 0.57 1.67 -0.31 0.00 0.00 175.10 177.99 1uqt n GLN 96 N 0.25 1.36 -2.85 4.82 -0.06 -0.33 -5.01 117.38 115.56 1uqt n GLN 96 Ca 0.03 -3.84 -0.41 0.00 -2.00 0.00 0.00 57.00 50.79 1uqt n GLN 96 Cb 0.46 -1.74 -0.04 0.00 -4.06 0.00 0.00 30.24 24.86 1uqt n GLN 96 CO 0.00 0.00 0.00 0.12 -0.20 0.00 0.00 177.06 176.98 1uqt s PHE 97 N -1.46 3.61 -0.05 3.69 2.19 -1.26 -4.71 117.98 119.99 1uqt s PHE 97 Ca 0.35 1.49 -0.04 0.00 0.33 0.00 0.00 56.93 59.07 1uqt s PHE 97 Cb 0.12 -2.99 0.02 0.00 -1.31 0.00 0.00 43.02 38.86 1uqt s PHE 97 CO -0.10 0.01 0.12 -0.65 1.83 0.00 0.00 175.22 176.43 1uqt s GLN 98 N 1.02 0.12 0.19 10.12 -0.21 -1.26 -5.09 119.66 124.55 1uqt s GLN 98 Ca 0.45 0.20 -0.13 0.00 0.02 0.00 0.00 55.36 55.91 1uqt s GLN 98 Cb -0.19 0.00 0.10 0.00 1.00 0.00 0.00 33.01 33.92 1uqt s GLN 98 CO 0.23 -0.05 1.85 0.00 -2.12 0.00 0.00 175.29 175.20 1uqt h ARG 99 N 6.29 0.79 -0.49 2.91 3.08 -2.00 -1.86 114.38 123.09 1uqt h ARG 99 Ca -0.29 -0.05 0.14 0.00 0.07 0.00 0.00 59.98 59.85 1uqt h ARG 99 Cb 1.19 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 31.04 1uqt h ARG 99 CO 0.44 0.52 0.47 -1.35 -1.07 0.00 0.00 179.97 178.98 1uqt h PRO 100 N 0.81 0.00 0.11 0.04 0.11 -1.99 -0.69 132.00 130.39 1uqt h PRO 100 Ca 0.22 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 66.06 1uqt h PRO 100 Cb -0.09 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.03 1uqt h PRO 100 CO -0.05 0.00 -1.20 0.00 -0.21 0.00 0.00 178.00 176.54 1uqt h ALA 101 N 1.53 0.13 -0.61 -0.75 0.00 -1.63 -2.37 119.26 115.56 1uqt h ALA 101 Ca 0.23 -0.86 -0.10 0.00 0.00 0.00 0.00 54.91 54.19 1uqt h ALA 101 Cb 1.17 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1uqt h ALA 101 CO -0.00 0.94 0.00 2.35 0.00 0.00 0.00 179.25 182.54 1uqt h TRP 102 N 0.10 1.17 -0.06 0.00 2.91 -1.06 -1.90 115.95 117.10 1uqt h TRP 102 Ca -0.13 -0.20 -0.00 0.00 1.13 0.00 0.00 58.89 59.69 1uqt h TRP 102 Cb 1.92 -0.31 -0.00 0.00 -0.51 0.00 0.00 29.16 30.26 1uqt h TRP 102 CO 0.06 1.03 0.03 -0.44 -1.03 0.00 0.00 178.44 178.10 1uqt h ASP 103 N 0.98 0.08 -0.54 2.65 3.32 -1.25 -2.12 116.42 119.53 1uqt h ASP 103 Ca 0.17 -0.09 0.06 0.00 0.02 0.00 0.00 57.03 57.19 1uqt h ASP 103 Cb 0.56 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.06 1uqt h ASP 103 CO 0.03 0.14 0.36 1.23 -1.72 0.00 0.00 179.24 179.28 1uqt h GLY 104 N 0.01 0.61 0.97 2.75 0.00 -1.33 0.23 103.07 106.31 1uqt h GLY 104 Ca 0.02 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 1uqt h GLY 104 CO -0.00 0.15 0.20 -1.82 0.00 0.00 0.00 176.54 175.07 1uqt h TYR 105 N 0.49 0.46 -0.25 5.60 3.20 -0.94 -0.92 116.97 124.62 1uqt h TYR 105 Ca 0.23 -0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.94 1uqt h TYR 105 Cb 0.29 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 1uqt h TYR 105 CO -0.00 0.34 -0.50 -0.07 -1.64 0.00 0.00 178.16 176.29 1uqt h LEU 106 N 0.44 0.75 -0.65 2.82 3.38 -0.51 -2.07 115.31 119.47 1uqt h LEU 106 Ca 0.12 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.64 1uqt h LEU 106 Cb 0.02 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 1uqt h LEU 106 CO -0.02 1.12 0.11 -0.09 0.09 0.00 0.00 178.44 179.65 1uqt h ARG 107 N 0.53 1.07 -0.09 1.13 2.43 -0.43 -1.00 114.38 118.03 1uqt h ARG 107 Ca 0.02 -0.28 -0.24 0.00 -0.81 0.00 0.00 59.98 58.67 1uqt h ARG 107 Cb 1.06 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 30.50 1uqt h ARG 107 CO 0.10 0.99 -0.89 -0.24 -1.51 0.00 0.00 179.97 178.42 1uqt h VAL 108 N 0.99 1.28 -0.56 0.20 3.04 -1.14 0.96 116.25 121.02 1uqt h VAL 108 Ca 0.20 -2.08 0.05 0.00 -1.01 0.00 0.00 66.70 63.86 1uqt h VAL 108 Cb 0.43 2.14 -0.03 0.00 -2.01 0.00 0.00 31.29 31.82 1uqt h VAL 108 CO 0.01 0.65 0.37 0.78 -1.01 0.00 0.00 177.57 178.38 1uqt h ASN 109 N 0.48 0.49 -0.09 3.17 2.35 -1.22 -0.35 115.58 120.42 1uqt h ASN 109 Ca -0.08 -0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.44 1uqt h ASN 109 Cb 1.53 -0.11 0.01 0.00 0.05 0.00 0.00 38.32 39.80 1uqt h ASN 109 CO 0.18 0.33 -0.81 0.00 -1.65 0.00 0.00 177.43 175.48 1uqt h ALA 110 N 1.69 0.32 0.22 -0.83 0.00 -0.75 -1.93 119.26 117.98 1uqt h ALA 110 Ca 0.24 -0.61 0.01 0.00 0.00 0.00 0.00 54.91 54.54 1uqt h ALA 110 Cb 0.22 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1uqt h ALA 110 CO -0.07 0.69 -0.27 -0.07 0.00 0.00 0.00 179.25 179.54 1uqt h LEU 111 N 0.50 -0.74 -1.23 0.00 3.38 -0.39 -1.70 115.31 115.13 1uqt h LEU 111 Ca -0.06 0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.05 1uqt h LEU 111 Cb 1.44 0.26 -0.05 0.00 0.09 0.00 0.00 40.66 42.39 1uqt h LEU 111 CO 0.16 -0.38 0.55 -0.07 0.09 0.00 0.00 178.44 178.79 1uqt h LEU 112 N -0.55 0.82 -0.59 1.67 4.07 -1.07 -1.83 115.31 117.83 1uqt h LEU 112 Ca 0.00 0.01 -0.15 0.00 0.08 0.00 0.00 57.88 57.82 1uqt h LEU 112 Cb 0.52 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 1uqt h LEU 112 CO -0.09 0.52 -0.48 0.00 -1.08 0.00 0.00 178.44 177.31 1uqt h ALA 113 N 1.55 0.77 -0.79 1.53 0.00 -1.25 -1.98 119.26 119.08 1uqt h ALA 113 Ca 0.37 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1uqt h ALA 113 Cb 0.24 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1uqt h ALA 113 CO -0.13 0.67 0.36 -0.44 0.00 0.00 0.00 179.25 179.70 1uqt h ASP 114 N 0.44 1.06 1.63 0.00 3.45 -0.57 -1.77 116.42 120.67 1uqt h ASP 114 Ca 0.02 -0.15 0.00 0.00 0.43 0.00 0.00 57.03 57.33 1uqt h ASP 114 Cb 1.00 -0.27 0.00 0.00 -0.56 0.00 0.00 39.33 39.50 1uqt h ASP 114 CO 0.09 0.92 -0.06 0.11 -1.57 0.00 0.00 179.24 178.73 1uqt h LYS 115 N 1.13 0.00 0.00 3.56 1.57 -1.25 -3.29 116.57 118.30 1uqt h LYS 115 Ca 0.27 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.78 1uqt h LYS 115 Cb 0.16 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.42 1uqt h LYS 115 CO -0.03 0.00 -1.87 -0.11 -0.57 0.00 0.00 179.45 176.87 1uqt n LEU 116 N -2.59 0.53 -0.10 2.94 0.00 -0.76 -4.46 117.00 112.56 1uqt n LEU 116 Ca 0.05 0.24 -0.10 0.00 0.00 0.00 0.00 56.01 56.20 1uqt n LEU 116 Cb 0.47 0.24 -0.04 0.00 0.00 0.00 0.00 43.42 44.09 1uqt n LEU 116 CO 0.32 0.33 0.59 0.25 0.00 0.00 0.00 177.39 178.89 1uqt h LEU 117 N 0.00 -1.35 -1.46 -1.96 7.12 -1.39 -2.53 115.31 113.74 1uqt h LEU 117 Ca -0.32 0.20 -0.04 0.00 0.13 0.00 0.00 57.88 57.85 1uqt h LEU 117 Cb 1.91 0.59 -0.01 0.00 -0.53 0.00 0.00 40.66 42.62 1uqt h LEU 117 CO 0.05 -0.37 -0.11 -0.65 -0.13 0.00 0.00 178.44 177.22 1uqt h PRO 118 N -0.35 0.21 0.00 5.25 0.11 -1.78 -2.19 132.00 133.24 1uqt h PRO 118 Ca 0.13 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.16 1uqt h PRO 118 Cb 0.58 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 1uqt h PRO 118 CO -0.53 0.33 -0.19 -0.07 -0.21 0.00 0.00 178.00 177.33 1uqt h LEU 119 N 0.20 0.00-10.11 2.35 -0.00 -1.70 -3.45 115.31 102.60 1uqt h LEU 119 Ca 0.04 0.00 -0.48 0.00 -0.00 0.00 0.00 57.88 57.44 1uqt h LEU 119 Cb 0.33 0.00 0.04 0.00 -0.00 0.00 0.00 40.66 41.03 1uqt h LEU 119 CO 0.02 0.19 0.39 -0.76 -0.00 0.00 0.00 178.44 178.28 1uqt s LEU 120 N -6.89 3.73 0.24 1.67 1.43 -0.83 -5.08 118.68 112.95 1uqt s LEU 120 Ca -0.00 1.91 0.06 0.00 -1.03 0.00 0.00 54.13 55.07 1uqt s LEU 120 Cb 0.11 -4.55 -0.05 0.00 0.03 0.00 0.00 46.19 41.72 1uqt s LEU 120 CO 0.62 -0.93 -0.08 -1.10 0.23 0.00 0.00 176.35 175.09 1uqt s GLN 121 N -3.49 1.41 0.06 1.70 -0.21 -1.26 -5.05 119.66 112.82 1uqt s GLN 121 Ca 0.67 -1.68 -0.27 0.00 0.02 0.00 0.00 55.36 54.09 1uqt s GLN 121 Cb -0.17 -1.01 -0.17 0.00 1.00 0.00 0.00 33.01 32.66 1uqt s GLN 121 CO 0.25 0.06 1.54 -0.44 -2.12 0.00 0.00 175.29 174.58 1uqt h ASP 122 N 2.43 -0.37 -0.18 5.90 3.32 -2.00 -3.05 116.42 122.46 1uqt h ASP 122 Ca -0.39 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1uqt h ASP 122 Cb 1.22 0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1uqt h ASP 122 CO 0.65 -0.17 0.00 -0.67 -1.72 0.00 0.00 179.24 177.33 1uqt n ASP 123 N -5.23 1.32 -4.30 6.45 2.03 -1.26 -4.84 116.55 110.72 1uqt n ASP 123 Ca -0.10 -1.77 -0.35 0.00 0.52 0.00 0.00 54.79 53.09 1uqt n ASP 123 Cb 0.22 -0.12 0.08 0.00 -0.72 0.00 0.00 41.12 40.59 1uqt n ASP 123 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1uqt n ASP 124 N 0.13 -3.11 -4.36 1.67 9.92 -1.16 -4.37 116.55 115.28 1uqt n ASP 124 Ca 0.13 0.36 -0.31 0.00 -0.53 0.00 0.00 54.79 54.44 1uqt n ASP 124 Cb 0.25 -1.06 -0.15 0.00 -0.64 0.00 0.00 41.12 39.52 1uqt n ASP 124 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1uqt s ILE 125 N -2.16 2.31 -0.06 0.53 1.09 0.20 -4.32 121.20 118.79 1uqt s ILE 125 Ca 0.54 -1.07 0.04 0.00 -1.10 0.00 0.00 60.65 59.06 1uqt s ILE 125 Cb -0.25 -1.84 0.00 0.00 -1.06 0.00 0.00 42.46 39.31 1uqt s ILE 125 CO 0.70 0.54 -0.16 -0.63 -0.10 0.00 0.00 174.94 175.29 1uqt s ILE 126 N -0.67 1.42 -0.22 2.92 1.01 -0.26 -0.74 121.20 124.65 1uqt s ILE 126 Ca 0.11 -0.68 -0.01 0.00 0.00 0.00 0.00 60.65 60.07 1uqt s ILE 126 Cb -0.10 -1.24 0.06 0.00 0.01 0.00 0.00 42.46 41.19 1uqt s ILE 126 CO -0.00 0.41 -0.01 0.86 0.00 0.00 0.00 174.94 176.20 1uqt s TRP 127 N 0.29 1.87 -0.11 3.97 -0.00 0.50 -1.05 118.94 124.43 1uqt s TRP 127 Ca -0.10 -1.44 -0.06 0.00 -0.00 0.00 0.00 56.10 54.51 1uqt s TRP 127 Cb -0.14 -1.40 -0.04 0.00 -0.00 0.00 0.00 33.47 31.89 1uqt s TRP 127 CO 0.04 -0.72 0.12 0.42 -0.00 0.00 0.00 176.95 176.81 1uqt s ILE 128 N 1.57 5.31 -0.20 5.86 -1.09 -0.07 -0.83 121.20 131.76 1uqt s ILE 128 Ca -0.03 0.10 -0.01 0.00 -2.23 0.00 0.00 60.65 58.49 1uqt s ILE 128 Cb -0.18 -3.31 0.01 0.00 -1.58 0.00 0.00 42.46 37.40 1uqt s ILE 128 CO -0.08 0.59 -0.14 -1.00 -1.23 0.00 0.00 174.94 173.08 1uqt s HIS 129 N -1.03 2.85 0.00 3.97 3.76 -0.08 -1.69 115.29 123.08 1uqt s HIS 129 Ca 0.16 -1.43 0.00 0.00 -0.15 0.00 0.00 55.06 53.64 1uqt s HIS 129 Cb -0.12 -1.98 0.00 0.00 1.11 0.00 0.00 32.58 31.59 1uqt s HIS 129 CO 0.05 -0.73 0.00 -3.47 -0.85 0.00 0.00 174.74 169.74 1uqt n ASP 130 N 4.68 0.00 0.32 1.40 -0.08 -0.08 -4.49 116.55 118.29 1uqt n ASP 130 Ca -0.20 0.00 0.17 0.00 -1.51 0.00 0.00 54.79 53.25 1uqt n ASP 130 Cb 0.50 0.00 0.89 0.00 2.34 0.00 0.00 41.12 44.85 1uqt n ASP 130 CO 0.00 0.00 0.00 0.10 0.12 0.00 0.00 177.20 177.42 1uqt h TYR 131 N 0.00 0.00 0.00 -0.67 -0.00 -1.98 -1.38 116.97 112.94 1uqt h TYR 131 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1uqt h TYR 131 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 1uqt h TYR 131 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 178.16 178.61 1uqt h HIS 132 N 0.00 0.00 -0.03 0.10 3.86 -1.95 -3.25 115.15 113.87 1uqt h HIS 132 Ca 0.00 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.12 1uqt h HIS 132 Cb 0.45 0.00 -0.17 0.00 1.06 0.00 0.00 27.41 28.76 1uqt h HIS 132 CO 0.00 0.00 -0.73 1.28 0.86 0.00 0.00 177.93 179.34 1uqt n LEU 133 N -2.87 2.11 -0.27 2.43 4.77 -0.52 -4.82 117.00 117.84 1uqt n LEU 133 Ca -0.01 -3.20 0.08 0.00 -0.03 0.00 0.00 56.01 52.85 1uqt n LEU 133 Cb 0.19 -0.30 0.21 0.00 -2.33 0.00 0.00 43.42 41.18 1uqt n LEU 133 CO 0.22 1.08 0.90 -0.07 -1.33 0.00 0.00 177.39 178.19 1uqt h LEU 134 N 1.07 -0.12 -0.30 2.23 3.38 -1.68 -2.03 115.31 117.86 1uqt h LEU 134 Ca -0.08 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1uqt h LEU 134 Cb 1.36 0.27 0.00 0.00 0.09 0.00 0.00 40.66 42.38 1uqt h LEU 134 CO 0.06 -0.12 0.00 -2.65 0.09 0.00 0.00 178.44 175.82 1uqt n PRO 135 N -5.25 1.19 -0.03 1.13 -0.02 -1.26 -4.38 135.00 126.38 1uqt n PRO 135 Ca 0.16 -0.29 -0.14 0.00 -2.02 0.00 0.00 63.50 61.21 1uqt n PRO 135 Cb 0.53 -1.30 -0.02 0.00 -0.02 0.00 0.00 33.50 32.70 1uqt n PRO 135 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1uqt h PHE 136 N 0.58 0.95 -0.55 6.00 3.57 -1.70 -2.56 116.94 123.23 1uqt h PHE 136 Ca 0.00 -0.37 -0.09 0.00 3.53 0.00 0.00 57.97 61.05 1uqt h PHE 136 Cb 0.13 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 1uqt h PHE 136 CO 0.03 1.17 0.01 0.00 -2.23 0.00 0.00 178.31 177.29 1uqt h ALA 137 N 0.74 0.74 -0.72 2.41 0.00 -1.79 -1.81 119.26 118.83 1uqt h ALA 137 Ca -0.01 -0.29 0.13 0.00 0.00 0.00 0.00 54.91 54.74 1uqt h ALA 137 Cb 1.23 -0.20 -0.09 0.00 0.00 0.00 0.00 17.79 18.72 1uqt h ALA 137 CO 0.13 0.56 0.25 1.25 0.00 0.00 0.00 179.25 181.44 1uqt h HIS 138 N 0.84 0.43 -0.07 0.00 -0.00 -1.66 0.29 115.15 114.98 1uqt h HIS 138 Ca 0.16 0.04 -0.13 0.00 -0.00 0.00 0.00 60.37 60.44 1uqt h HIS 138 Cb 0.52 -0.08 -0.01 0.00 -0.00 0.00 0.00 27.41 27.84 1uqt h HIS 138 CO 0.04 0.03 -0.53 0.93 -0.00 0.00 0.00 177.93 178.40 1uqt h GLU 139 N 0.39 0.20 -0.15 5.26 4.39 -1.06 -2.16 114.58 121.46 1uqt h GLU 139 Ca 0.39 -0.12 -0.07 0.00 0.34 0.00 0.00 59.36 59.90 1uqt h GLU 139 Cb 0.59 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1uqt h GLU 139 CO -0.41 0.68 -0.17 -0.07 -1.16 0.00 0.00 179.01 177.89 1uqt h LEU 140 N 0.16 0.41 -1.65 1.33 3.38 -0.66 -3.10 115.31 115.17 1uqt h LEU 140 Ca 0.00 -0.49 0.02 0.00 0.09 0.00 0.00 57.88 57.50 1uqt h LEU 140 Cb 0.99 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 1uqt h LEU 140 CO 0.08 0.82 0.27 0.03 0.09 0.00 0.00 178.44 179.73 1uqt h ARG 141 N 0.00 0.45 0.00 1.13 2.47 -0.76 -1.60 114.38 116.07 1uqt h ARG 141 Ca 0.02 -0.03 -0.05 0.00 -1.26 0.00 0.00 59.98 58.66 1uqt h ARG 141 Cb 0.71 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.92 1uqt h ARG 141 CO 0.04 0.30 -0.24 0.87 0.56 0.00 0.00 179.97 181.50 1uqt h LYS 142 N 0.47 0.00 -0.34 0.04 1.57 -1.38 -2.28 116.57 114.64 1uqt h LYS 142 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1uqt h LYS 142 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1uqt h LYS 142 CO -0.04 0.24 0.00 0.54 -0.57 0.00 0.00 179.45 179.62 1uqt n ARG 143 N -3.72 2.09 -0.49 3.15 1.74 -0.65 -4.95 116.66 113.83 1uqt n ARG 143 Ca -0.01 -1.66 0.00 0.00 -0.77 0.00 0.00 57.85 55.41 1uqt n ARG 143 Cb 0.35 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 1uqt n ARG 143 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uqt n GLY 144 N 1.29 0.75 3.63 -0.13 0.00 -0.86 -5.04 105.19 104.84 1uqt n GLY 144 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1uqt n GLY 144 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1uqt s VAL 145 N -2.13 4.58 -2.04 1.61 -7.23 -0.93 -4.89 120.40 109.36 1uqt s VAL 145 Ca 0.00 1.53 0.28 0.00 -1.81 0.00 0.00 61.98 61.98 1uqt s VAL 145 Cb 0.00 -4.34 0.47 0.00 0.56 0.00 0.00 36.38 33.07 1uqt s VAL 145 CO 0.00 -0.44 1.75 0.59 -0.31 0.00 0.00 175.10 176.69 1uqt n ASN 146 N 6.71 1.00 -4.64 4.85 3.02 -1.26 -4.16 115.26 120.78 1uqt n ASN 146 Ca 0.09 -1.07 -0.32 0.00 -0.03 0.00 0.00 54.58 53.26 1uqt n ASN 146 Cb 0.47 0.03 0.15 0.00 -0.61 0.00 0.00 39.78 39.82 1uqt n ASN 146 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1uqt n ASN 147 N -0.43 0.19 -4.62 6.41 5.03 -1.26 -3.86 115.26 116.72 1uqt n ASN 147 Ca 0.16 0.46 -0.43 0.00 0.87 0.00 0.00 54.58 55.64 1uqt n ASN 147 Cb 0.32 -1.45 -0.03 0.00 -1.02 0.00 0.00 39.78 37.60 1uqt n ASN 147 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1uqt s ARG 148 N -4.34 3.47 -0.12 3.52 0.52 -1.26 -4.90 118.95 115.83 1uqt s ARG 148 Ca 0.67 2.01 0.03 0.00 -0.52 0.00 0.00 55.73 57.92 1uqt s ARG 148 Cb -0.25 -4.25 0.00 0.00 0.52 0.00 0.00 34.95 30.97 1uqt s ARG 148 CO 0.57 -1.71 -0.22 0.42 0.02 0.00 0.00 175.30 174.39 1uqt s ILE 149 N 6.83 2.19 0.25 1.52 1.01 -1.26 -1.11 121.20 130.63 1uqt s ILE 149 Ca 0.91 -0.96 0.10 0.00 0.00 0.00 0.00 60.65 60.70 1uqt s ILE 149 Cb -0.32 -1.86 -0.04 0.00 0.01 0.00 0.00 42.46 40.24 1uqt s ILE 149 CO 0.35 0.55 -0.04 -0.83 0.00 0.00 0.00 174.94 174.97 1uqt s GLY 150 N 0.55 1.69 -0.01 6.18 0.00 -0.21 -0.92 107.32 114.60 1uqt s GLY 150 Ca -0.13 -1.62 0.04 0.00 0.00 0.00 0.00 44.72 43.01 1uqt s GLY 150 CO 0.04 -1.68 -0.13 -0.12 0.00 0.00 0.00 173.10 171.21 1uqt s PHE 151 N -2.19 1.17 -0.08 1.90 5.36 0.11 -0.89 117.98 123.36 1uqt s PHE 151 Ca 0.30 -0.23 0.03 0.00 -0.96 0.00 0.00 56.93 56.07 1uqt s PHE 151 Cb -0.07 -0.76 0.01 0.00 -0.34 0.00 0.00 43.02 41.86 1uqt s PHE 151 CO 0.18 -0.03 -0.19 0.12 -1.46 0.00 0.00 175.22 173.85 1uqt s PHE 152 N -0.28 2.05 -0.28 10.12 2.19 -0.68 0.44 117.98 131.54 1uqt s PHE 152 Ca 0.05 -0.80 -0.10 0.00 0.33 0.00 0.00 56.93 56.40 1uqt s PHE 152 Cb -0.05 -1.41 -0.04 0.00 -1.31 0.00 0.00 43.02 40.21 1uqt s PHE 152 CO -0.00 -0.35 0.17 -1.17 1.83 0.00 0.00 175.22 175.70 1uqt s LEU 153 N 0.47 3.94 0.31 6.12 0.20 -0.64 -0.90 118.68 128.18 1uqt s LEU 153 Ca -0.16 -0.10 0.23 0.00 0.69 0.00 0.00 54.13 54.79 1uqt s LEU 153 Cb -0.17 -2.08 0.33 0.00 -0.43 0.00 0.00 46.19 43.84 1uqt s LEU 153 CO 0.06 -0.06 1.47 0.45 -0.29 0.00 0.00 176.35 177.98 1uqt h HIS 154 N 8.35 0.00 -1.12 5.38 3.86 -1.95 -3.33 115.15 126.35 1uqt h HIS 154 Ca -0.35 0.00 -0.53 0.00 -1.16 0.00 0.00 60.37 58.33 1uqt h HIS 154 Cb 1.18 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.62 1uqt h HIS 154 CO 0.73 0.00 -0.34 0.96 0.86 0.00 0.00 177.93 180.14 1uqt s ILE 155 N -3.23 2.22 0.66 2.45 -4.36 -1.26 -4.37 121.20 113.31 1uqt s ILE 155 Ca 0.06 -1.40 -0.17 0.00 -0.26 0.00 0.00 60.65 58.88 1uqt s ILE 155 Cb 0.08 -2.62 -0.00 0.00 1.25 0.00 0.00 42.46 41.17 1uqt s ILE 155 CO 0.69 0.00 1.21 -2.84 0.24 0.00 0.00 174.94 174.25 1uqt s PRO 156 N -4.21 2.59 -0.22 0.37 0.02 -1.26 -4.77 135.00 127.52 1uqt s PRO 156 Ca 0.44 1.81 -0.09 0.00 0.02 0.00 0.00 61.00 63.18 1uqt s PRO 156 Cb -0.02 -1.88 -0.04 0.00 0.02 0.00 0.00 34.50 32.57 1uqt s PRO 156 CO 0.26 -1.50 0.11 0.12 -0.33 0.00 0.00 177.00 175.66 1uqt s PHE 157 N -1.75 3.24 0.46 6.54 5.36 -1.26 -4.80 117.98 125.78 1uqt s PHE 157 Ca 0.76 0.04 -0.20 0.00 -0.96 0.00 0.00 56.93 56.57 1uqt s PHE 157 Cb -0.30 -2.20 -0.09 0.00 -0.34 0.00 0.00 43.02 40.09 1uqt s PHE 157 CO 0.39 0.01 1.00 -1.25 -1.46 0.00 0.00 175.22 173.91 1uqt s PRO 158 N 0.93 3.99 0.88 10.12 0.04 -1.26 -4.68 135.00 145.01 1uqt s PRO 158 Ca 0.05 1.23 -0.10 0.00 0.04 0.00 0.00 61.00 62.23 1uqt s PRO 158 Cb -0.13 -2.13 0.12 0.00 0.04 0.00 0.00 34.50 32.39 1uqt s PRO 158 CO 0.03 -0.25 1.13 0.95 0.04 0.00 0.00 177.00 178.89 1uqt s THR 159 N -2.11 2.44 0.27 1.26 -4.23 -1.26 -4.49 115.64 107.52 1uqt s THR 159 Ca 0.64 0.14 -0.01 0.00 -1.18 0.00 0.00 61.69 61.29 1uqt s THR 159 Cb -0.13 -2.31 0.27 0.00 1.34 0.00 0.00 72.50 71.68 1uqt s THR 159 CO 0.18 -0.19 1.68 -0.65 -0.54 0.00 0.00 174.62 175.10 1uqt h PRO 160 N -1.67 0.28 0.00 3.99 0.11 -1.91 -0.29 132.00 132.51 1uqt h PRO 160 Ca -0.44 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 1uqt h PRO 160 Cb 1.26 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1uqt h PRO 160 CO 0.45 0.18 -0.02 0.93 -0.21 0.00 0.00 178.00 179.33 1uqt h GLU 161 N 0.29 0.00 0.00 1.05 4.39 -1.99 0.48 114.58 118.80 1uqt h GLU 161 Ca 0.50 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.96 1uqt h GLU 161 Cb 0.92 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.54 1uqt h GLU 161 CO -0.56 0.02 -1.38 -0.89 -1.16 0.00 0.00 179.01 175.04 1uqt n ILE 162 N -3.94 1.52 -0.17 3.13 -0.00 -0.42 -4.40 119.36 115.08 1uqt n ILE 162 Ca -0.03 -0.05 -0.00 0.00 -0.00 0.00 0.00 62.75 62.67 1uqt n ILE 162 Cb 0.11 -2.07 0.25 0.00 -0.00 0.00 0.00 39.64 37.93 1uqt n ILE 162 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.55 176.70 1uqt h PHE 163 N -1.00 0.87 0.00 1.39 3.57 -0.90 -2.47 116.94 118.41 1uqt h PHE 163 Ca -0.36 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.13 1uqt h PHE 163 Cb 1.25 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.71 1uqt h PHE 163 CO 0.02 0.60 0.00 0.09 -2.23 0.00 0.00 178.31 176.79 1uqt n ASN 164 N -4.38 0.31 0.21 0.41 3.02 0.14 -2.11 115.26 112.85 1uqt n ASN 164 Ca 0.06 0.56 0.06 0.00 -0.03 0.00 0.00 54.58 55.23 1uqt n ASN 164 Cb 0.09 -0.63 0.47 0.00 -0.61 0.00 0.00 39.78 39.10 1uqt n ASN 164 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1uqt h ALA 165 N 2.55 1.40 -2.46 5.41 0.00 -1.64 -3.44 119.26 121.07 1uqt h ALA 165 Ca 0.00 -0.25 -0.54 0.00 0.00 0.00 0.00 54.91 54.12 1uqt h ALA 165 Cb 0.41 -0.04 0.04 0.00 0.00 0.00 0.00 17.79 18.20 1uqt h ALA 165 CO 0.00 0.35 1.10 1.28 0.00 0.00 0.00 179.25 181.98 1uqt n LEU 166 N -4.00 3.99 0.30 0.00 4.32 -0.90 -4.87 117.00 115.85 1uqt n LEU 166 Ca -0.02 0.99 0.18 0.00 -0.02 0.00 0.00 56.01 57.14 1uqt n LEU 166 Cb 0.34 -1.53 0.97 0.00 -1.62 0.00 0.00 43.42 41.58 1uqt n LEU 166 CO 0.36 0.15 1.10 -0.65 -1.22 0.00 0.00 177.39 177.13 1uqt h PRO 167 N 8.50 0.00 0.00 3.23 0.11 -1.90 -2.52 132.00 139.42 1uqt h PRO 167 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1uqt h PRO 167 Cb 1.23 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 1uqt h PRO 167 CO 0.95 0.00 -0.42 -2.37 -0.21 0.00 0.00 178.00 175.94 1uqt n THR 168 N -2.85 1.96 -0.17 -1.15 5.66 -1.26 -4.82 114.28 111.65 1uqt n THR 168 Ca -0.02 -2.83 0.03 0.00 -3.05 0.00 0.00 64.05 58.17 1uqt n THR 168 Cb 0.18 -0.15 0.30 0.00 -1.55 0.00 0.00 70.33 69.11 1uqt n THR 168 CO 0.00 0.00 0.00 0.10 -3.05 0.00 0.00 175.07 172.12 1uqt h TYR 169 N 0.76 0.83 -0.35 1.09 -0.00 -1.74 -2.27 116.97 115.29 1uqt h TYR 169 Ca -0.01 0.02 -0.11 0.00 0.00 0.00 0.00 58.73 58.63 1uqt h TYR 169 Cb 1.06 -0.28 -0.01 0.00 0.00 0.00 0.00 36.73 37.50 1uqt h TYR 169 CO 0.55 0.50 -0.23 0.38 -0.00 0.00 0.00 178.16 179.35 1uqt h ASP 170 N 0.87 0.69 -0.27 0.10 2.03 -1.87 -1.51 116.42 116.47 1uqt h ASP 170 Ca 0.27 -0.25 -0.12 0.00 -0.73 0.00 0.00 57.03 56.21 1uqt h ASP 170 Cb -0.00 -0.19 -0.00 0.00 -0.83 0.00 0.00 39.33 38.30 1uqt h ASP 170 CO -0.07 0.91 -0.28 0.74 -1.03 0.00 0.00 179.24 179.51 1uqt h THR 171 N 0.60 1.31 -0.97 1.15 2.02 -1.82 -1.88 112.91 113.31 1uqt h THR 171 Ca 0.08 -1.46 0.04 0.00 0.77 0.00 0.00 66.41 65.85 1uqt h THR 171 Cb 0.71 1.64 -0.06 0.00 -1.74 0.00 0.00 68.15 68.70 1uqt h THR 171 CO 0.05 0.46 0.64 -0.07 0.37 0.00 0.00 175.52 176.97 1uqt h LEU 172 N 0.39 1.05 -0.24 2.58 4.07 -1.34 -1.37 115.31 120.45 1uqt h LEU 172 Ca 0.04 -0.01 -0.09 0.00 0.08 0.00 0.00 57.88 57.91 1uqt h LEU 172 Cb 0.85 -0.23 -0.00 0.00 1.08 0.00 0.00 40.66 42.35 1uqt h LEU 172 CO 0.07 0.70 -0.20 -0.07 -1.08 0.00 0.00 178.44 177.87 1uqt h LEU 173 N 1.20 0.58 -0.73 1.67 4.07 -1.19 -2.20 115.31 118.72 1uqt h LEU 173 Ca 0.40 -0.46 0.03 0.00 0.08 0.00 0.00 57.88 57.93 1uqt h LEU 173 Cb 0.05 -0.16 -0.05 0.00 1.08 0.00 0.00 40.66 41.58 1uqt h LEU 173 CO -0.13 0.92 0.46 -0.33 -1.08 0.00 0.00 178.44 178.28 1uqt h GLU 174 N 0.25 0.87 0.00 1.13 5.08 -0.89 -2.79 114.58 118.24 1uqt h GLU 174 Ca 0.04 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.23 1uqt h GLU 174 Cb 0.74 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 1uqt h GLU 174 CO 0.05 0.58 -0.58 1.96 -1.00 0.00 0.00 179.01 180.02 1uqt h GLN 175 N 0.90 0.00 0.00 2.33 4.20 -1.23 -3.04 115.11 118.26 1uqt h GLN 175 Ca 0.30 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.89 1uqt h GLN 175 Cb 0.02 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 1uqt h GLN 175 CO -0.11 0.58 -0.56 -0.07 -0.67 0.00 0.00 178.83 178.00 1uqt h LEU 176 N 0.00 0.00 0.00 1.46 3.38 -1.13 -2.60 115.31 116.42 1uqt h LEU 176 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1uqt h LEU 176 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1uqt h LEU 176 CO 0.08 0.56 0.00 0.00 0.09 0.00 0.00 178.44 179.16 1uqt h ASP 178 N 0.00 0.00 -4.05 0.00 5.19 -1.57 -3.43 116.42 112.55 1uqt h ASP 178 Ca 0.00 0.00 -0.52 0.00 -0.62 0.00 0.00 57.03 55.89 1uqt h ASP 178 Cb 0.05 0.00 0.10 0.00 0.18 0.00 0.00 39.33 39.65 1uqt h ASP 178 CO 0.00 0.00 0.51 -0.31 -3.12 0.00 0.00 179.24 176.32 1uqt s TYR 179 N -3.23 2.54 0.08 4.55 2.02 -1.08 -4.84 117.35 117.40 1uqt s TYR 179 Ca 0.07 1.49 0.04 0.00 -0.37 0.00 0.00 57.07 58.30 1uqt s TYR 179 Cb 0.05 -3.51 -0.23 0.00 -0.40 0.00 0.00 41.96 37.87 1uqt s TYR 179 CO 0.66 -2.10 1.15 -0.44 -1.57 0.00 0.00 175.55 173.26 1uqt h ASP 180 N 1.43 0.13 -3.48 2.29 5.19 -1.30 -3.42 116.42 117.26 1uqt h ASP 180 Ca -0.50 -0.15 -0.36 0.00 -0.62 0.00 0.00 57.03 55.40 1uqt h ASP 180 Cb 1.28 -0.04 -0.34 0.00 0.18 0.00 0.00 39.33 40.41 1uqt h ASP 180 CO 0.57 1.12 -0.75 -0.22 -3.12 0.00 0.00 179.24 176.84 1uqt s LEU 181 N -6.77 1.19 -0.18 1.55 2.96 -1.09 -0.70 118.68 115.63 1uqt s LEU 181 Ca -0.02 -0.05 0.00 0.00 -0.22 0.00 0.00 54.13 53.85 1uqt s LEU 181 Cb 0.09 -0.27 0.01 0.00 0.50 0.00 0.00 46.19 46.52 1uqt s LEU 181 CO 0.84 -0.09 -0.18 -0.76 -1.32 0.00 0.00 176.35 174.84 1uqt s LEU 182 N 1.02 2.25 -0.08 -0.68 2.01 -0.12 0.07 118.68 123.14 1uqt s LEU 182 Ca -0.10 -0.61 -0.01 0.00 0.01 0.00 0.00 54.13 53.43 1uqt s LEU 182 Cb -0.14 -1.52 -0.03 0.00 0.01 0.00 0.00 46.19 44.51 1uqt s LEU 182 CO -0.01 0.00 -0.03 -0.83 1.01 0.00 0.00 176.35 176.48 1uqt s GLY 183 N 1.29 1.77 0.17 -3.19 0.00 0.17 -2.27 107.32 105.26 1uqt s GLY 183 Ca 0.04 -0.85 0.04 0.00 0.00 0.00 0.00 44.72 43.96 1uqt s GLY 183 CO -0.11 -0.60 -0.08 -1.36 0.00 0.00 0.00 173.10 170.94 1uqt s PHE 184 N -0.81 1.35 0.17 1.90 0.08 -0.75 -1.62 117.98 118.29 1uqt s PHE 184 Ca 0.12 -0.78 -0.05 0.00 0.12 0.00 0.00 56.93 56.34 1uqt s PHE 184 Cb -0.11 -0.70 0.03 0.00 -0.57 0.00 0.00 43.02 41.67 1uqt s PHE 184 CO 0.02 0.07 1.44 1.96 -0.10 0.00 0.00 175.22 178.62 1uqt h GLN 185 N 2.71 0.59 -4.62 0.44 1.08 -1.79 -0.21 115.11 113.31 1uqt h GLN 185 Ca -0.37 -0.42 -0.22 0.00 -1.45 0.00 0.00 58.65 56.19 1uqt h GLN 185 Cb 1.20 0.07 -0.15 0.00 -0.05 0.00 0.00 27.48 28.55 1uqt h GLN 185 CO 0.64 1.04 -0.69 0.95 -0.95 0.00 0.00 178.83 179.82 1uqt s THR 186 N -3.87 0.59 0.21 -0.54 -4.23 -1.26 -3.70 115.64 102.84 1uqt s THR 186 Ca -0.08 -1.93 -0.09 0.00 -1.18 0.00 0.00 61.69 58.41 1uqt s THR 186 Cb 0.10 -1.77 0.16 0.00 1.34 0.00 0.00 72.50 72.34 1uqt s THR 186 CO 0.86 -0.79 1.87 -0.08 -0.54 0.00 0.00 174.62 175.94 1uqt h GLU 187 N 2.93 0.96 0.00 3.99 4.57 -1.97 -2.23 114.58 122.83 1uqt h GLU 187 Ca -0.35 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 57.76 1uqt h GLU 187 Cb 1.17 -0.22 -0.00 0.00 -0.16 0.00 0.00 28.75 29.54 1uqt h GLU 187 CO 0.64 0.64 -0.05 -0.91 -1.18 0.00 0.00 179.01 178.15 1uqt h ASN 188 N 0.99 0.00 -0.11 1.04 2.35 -1.98 0.66 115.58 118.54 1uqt h ASN 188 Ca 0.29 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.95 1uqt h ASN 188 Cb -0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.32 1uqt h ASN 188 CO -0.09 0.05 -0.28 0.44 -1.65 0.00 0.00 177.43 175.90 1uqt h ASP 189 N 0.00 0.43 -0.35 5.81 3.32 -1.72 -0.49 116.42 123.42 1uqt h ASP 189 Ca -0.00 -0.59 0.03 0.00 0.02 0.00 0.00 57.03 56.49 1uqt h ASP 189 Cb 0.09 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 1uqt h ASP 189 CO 0.01 0.94 0.17 -0.09 -1.72 0.00 0.00 179.24 178.55 1uqt h ARG 190 N -0.06 0.34 -0.85 3.56 2.43 -0.79 -1.70 114.38 117.31 1uqt h ARG 190 Ca -0.01 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1uqt h ARG 190 Cb 0.89 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 30.33 1uqt h ARG 190 CO 0.06 0.22 0.48 -0.07 -1.51 0.00 0.00 179.97 179.15 1uqt h LEU 191 N 0.35 1.04 -0.51 3.80 4.07 -0.90 -2.31 115.31 120.85 1uqt h LEU 191 Ca 0.15 -0.09 -0.03 0.00 0.08 0.00 0.00 57.88 57.99 1uqt h LEU 191 Cb 0.07 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 41.53 1uqt h LEU 191 CO -0.11 0.83 0.20 0.00 -1.08 0.00 0.00 178.44 178.28 1uqt h ALA 192 N 1.26 0.66 -0.30 1.53 0.00 -0.78 -1.29 119.26 120.33 1uqt h ALA 192 Ca 0.30 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1uqt h ALA 192 Cb 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1uqt h ALA 192 CO -0.05 0.27 0.18 0.35 0.00 0.00 0.00 179.25 180.00 1uqt h PHE 193 N 0.68 0.34 -0.48 0.00 3.57 -1.07 -1.03 116.94 118.95 1uqt h PHE 193 Ca 0.17 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 1uqt h PHE 193 Cb 0.20 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 1uqt h PHE 193 CO 0.01 0.21 0.21 -0.07 -2.23 0.00 0.00 178.31 176.44 1uqt h LEU 194 N 0.37 0.60 -0.24 0.59 4.07 -1.28 -1.35 115.31 118.07 1uqt h LEU 194 Ca 0.12 -0.06 -0.13 0.00 0.08 0.00 0.00 57.88 57.89 1uqt h LEU 194 Cb -0.01 -0.15 -0.00 0.00 1.08 0.00 0.00 40.66 41.57 1uqt h LEU 194 CO -0.05 0.52 -0.37 -0.78 -1.08 0.00 0.00 178.44 176.69 1uqt h ASP 195 N 0.67 0.74 -0.54 -0.43 -0.00 -1.00 0.20 116.42 116.06 1uqt h ASP 195 Ca 0.17 -0.52 0.03 0.00 -0.00 0.00 0.00 57.03 56.71 1uqt h ASP 195 Cb 0.09 -0.21 -0.04 0.00 -0.00 0.00 0.00 39.33 39.17 1uqt h ASP 195 CO -0.02 1.12 0.31 0.00 -0.00 0.00 0.00 179.24 180.65 1uqt h LEU 197 N 0.62 0.92 -1.80 0.00 5.85 -1.14 -2.78 115.31 116.97 1uqt h LEU 197 Ca 0.22 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 1uqt h LEU 197 Cb 0.06 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 40.84 1uqt h LEU 197 CO -0.11 0.90 -0.12 0.28 -0.34 0.00 0.00 178.44 179.05 1uqt h SER 198 N 0.88 0.00 0.73 1.25 0.02 -0.69 -1.56 113.55 114.19 1uqt h SER 198 Ca 0.19 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.93 1uqt h SER 198 Cb 0.34 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1uqt h SER 198 CO 0.00 0.12 -0.97 0.78 -1.14 0.00 0.00 176.83 175.62 1uqt h ASN 199 N 0.00 0.19 0.19 3.07 2.35 -1.13 -3.35 115.58 116.90 1uqt h ASN 199 Ca -0.00 -0.17 -0.31 0.00 -0.55 0.00 0.00 56.30 55.26 1uqt h ASN 199 Cb 0.40 -0.06 0.02 0.00 0.05 0.00 0.00 38.32 38.73 1uqt h ASN 199 CO 0.02 1.05 -1.49 0.25 -1.65 0.00 0.00 177.43 175.60 1uqt h LEU 200 N 0.06 0.64 -7.52 1.61 6.46 -1.30 -3.49 115.31 111.77 1uqt h LEU 200 Ca -0.05 -0.92 -0.02 0.00 -0.12 0.00 0.00 57.88 56.77 1uqt h LEU 200 Cb 1.65 -0.21 -0.11 0.00 -0.73 0.00 0.00 40.66 41.27 1uqt h LEU 200 CO 0.14 1.69 0.04 0.28 -0.62 0.00 0.00 178.44 179.97 1uqt s THR 201 N -2.55 0.03 0.08 1.05 -1.32 -0.62 -5.13 115.64 107.18 1uqt s THR 201 Ca -0.14 -0.62 -0.30 0.00 -1.21 0.00 0.00 61.69 59.42 1uqt s THR 201 Cb 0.04 -1.41 -0.06 0.00 -1.51 0.00 0.00 72.50 69.56 1uqt s THR 201 CO 0.87 -0.14 1.17 -0.60 -2.21 0.00 0.00 174.62 173.71 1uqt s ARG 202 N -3.84 4.46 -0.07 7.08 3.52 -1.26 -3.97 118.95 124.88 1uqt s ARG 202 Ca 0.07 1.74 0.04 0.00 -0.13 0.00 0.00 55.73 57.45 1uqt s ARG 202 Cb -0.01 -3.34 -0.00 0.00 -1.56 0.00 0.00 34.95 30.04 1uqt s ARG 202 CO -0.06 -0.19 -0.20 0.14 -0.81 0.00 0.00 175.30 174.17 1uqt s VAL 203 N 0.82 1.73 -0.22 7.11 -7.23 -1.26 -4.42 120.40 116.93 1uqt s VAL 203 Ca 0.57 -0.86 -0.09 0.00 -1.81 0.00 0.00 61.98 59.78 1uqt s VAL 203 Cb -0.29 -1.49 -0.05 0.00 0.56 0.00 0.00 36.38 35.11 1uqt s VAL 203 CO 0.30 0.49 0.13 -0.89 -0.31 0.00 0.00 175.10 174.82 1uqt s THR 204 N 0.15 5.13 0.04 5.32 2.01 -0.78 -4.93 115.64 122.59 1uqt s THR 204 Ca -0.09 0.10 0.07 0.00 0.31 0.00 0.00 61.69 62.08 1uqt s THR 204 Cb -0.14 -3.37 -0.03 0.00 0.01 0.00 0.00 72.50 68.96 1uqt s THR 204 CO 0.05 0.38 -0.19 -0.89 -0.69 0.00 0.00 174.62 173.28 1uqt s THR 205 N 0.88 2.71 0.00 -0.82 2.01 -1.26 -1.98 115.64 117.18 1uqt s THR 205 Ca 0.06 -1.22 0.00 0.00 0.31 0.00 0.00 61.69 60.84 1uqt s THR 205 Cb -0.13 -2.13 0.00 0.00 0.01 0.00 0.00 72.50 70.25 1uqt s THR 205 CO 0.03 0.33 0.00 0.54 -0.69 0.00 0.00 174.62 174.83 1uqt n ARG 206 N 1.56 0.10 -2.71 4.92 1.74 -1.06 -4.98 116.66 116.23 1uqt n ARG 206 Ca -0.16 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 56.86 1uqt n ARG 206 Cb 0.52 -0.01 0.07 0.00 -1.02 0.00 0.00 32.46 32.02 1uqt n ARG 206 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1uqt n SER 207 N 0.00 0.36 0.00 0.55 7.64 -1.26 -4.96 113.62 115.95 1uqt n SER 207 Ca 0.00 -2.44 0.00 0.00 1.01 0.00 0.00 58.87 57.44 1uqt n SER 207 Cb 0.00 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 1uqt n SER 207 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1uqt n ALA 208 N -0.48 0.00 -2.31 -0.43 0.00 -1.26 -4.20 120.51 111.82 1uqt n ALA 208 Ca 0.03 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.50 1uqt n ALA 208 Cb 0.83 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.30 1uqt n ALA 208 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1uqt n LYS 209 N 0.00 0.08 -4.46 0.00 5.02 -1.26 -5.03 118.16 112.50 1uqt n LYS 209 Ca 0.00 -1.79 -0.30 0.00 -2.02 0.00 0.00 58.31 54.20 1uqt n LYS 209 Cb 0.00 -0.21 -0.17 0.00 -0.02 0.00 0.00 35.03 34.63 1uqt n LYS 209 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1uqt s SER 210 N -1.79 2.65 0.18 4.39 0.15 -1.26 -2.21 113.70 115.81 1uqt s SER 210 Ca 0.25 -0.48 0.04 0.00 0.70 0.00 0.00 55.95 56.45 1uqt s SER 210 Cb 0.28 -1.20 -0.05 0.00 -1.71 0.00 0.00 66.02 63.35 1uqt s SER 210 CO -0.12 0.02 -0.05 -1.00 1.20 0.00 0.00 173.24 173.29 1uqt s HIS 211 N 1.00 1.35 0.03 3.44 3.76 -0.37 -2.55 115.29 121.96 1uqt s HIS 211 Ca -0.05 -0.85 0.02 0.00 -0.15 0.00 0.00 55.06 54.02 1uqt s HIS 211 Cb -0.15 -0.74 -0.02 0.00 1.11 0.00 0.00 32.58 32.78 1uqt s HIS 211 CO -0.03 -0.00 -0.07 0.99 -0.85 0.00 0.00 174.74 174.78 1uqt s THR 212 N -3.41 0.51 -0.29 1.30 2.01 -0.84 -2.25 115.64 112.68 1uqt s THR 212 Ca 0.22 -0.86 -0.15 0.00 0.31 0.00 0.00 61.69 61.21 1uqt s THR 212 Cb 0.04 -0.54 0.10 0.00 0.01 0.00 0.00 72.50 72.11 1uqt s THR 212 CO 0.04 -0.25 0.72 0.00 -0.69 0.00 0.00 174.62 174.43 1uqt s ALA 213 N -1.06 -1.98 -1.31 7.40 0.00 -0.97 -1.86 121.76 121.98 1uqt s ALA 213 Ca -0.07 2.38 -0.08 0.00 0.00 0.00 0.00 51.96 54.19 1uqt s ALA 213 Cb -0.08 -1.55 0.05 0.00 0.00 0.00 0.00 23.12 21.54 1uqt s ALA 213 CO 0.00 -0.51 0.47 0.91 0.00 0.00 0.00 175.76 176.64 1uqt n TRP 214 N 4.52 -1.80 -0.60 0.00 8.01 -1.26 -1.20 117.44 125.11 1uqt n TRP 214 Ca -0.18 0.44 0.00 0.00 -1.31 0.00 0.00 57.50 56.46 1uqt n TRP 214 Cb 0.57 -3.22 0.00 0.00 -2.01 0.00 0.00 31.31 26.64 1uqt n TRP 214 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1uqt n GLY 215 N -1.21 0.99 3.68 6.99 0.00 -1.26 -4.99 105.19 109.40 1uqt n GLY 215 Ca -0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 1uqt n GLY 215 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uqt s LYS 216 N -0.26 4.30 0.04 1.61 1.02 -0.34 -5.06 119.74 121.05 1uqt s LYS 216 Ca 0.00 0.74 -0.16 0.00 0.02 0.00 0.00 55.97 56.57 1uqt s LYS 216 Cb 0.00 -3.53 -0.06 0.00 -0.52 0.00 0.00 37.83 33.72 1uqt s LYS 216 CO 0.00 -0.13 0.47 0.00 -0.92 0.00 0.00 175.35 174.77 1uqt s ALA 217 N 1.51 3.66 0.22 5.17 0.00 -1.26 -2.30 121.76 128.75 1uqt s ALA 217 Ca 0.32 -0.14 -0.22 0.00 0.00 0.00 0.00 51.96 51.92 1uqt s ALA 217 Cb -0.16 -2.47 0.04 0.00 0.00 0.00 0.00 23.12 20.53 1uqt s ALA 217 CO 0.13 0.46 0.72 -0.59 0.00 0.00 0.00 175.76 176.48 1uqt s PHE 218 N -1.14 -0.29 0.06 0.00 -0.12 -0.95 -4.66 117.98 110.88 1uqt s PHE 218 Ca 0.27 -0.06 0.06 0.00 -0.05 0.00 0.00 56.93 57.15 1uqt s PHE 218 Cb -0.17 0.65 -0.03 0.00 -0.63 0.00 0.00 43.02 42.84 1uqt s PHE 218 CO 0.16 -1.05 -0.18 1.03 -0.05 0.00 0.00 175.22 175.13 1uqt s ARG 219 N -3.76 1.08 0.22 1.99 0.52 0.12 -1.24 118.95 117.88 1uqt s ARG 219 Ca 0.08 -0.96 0.11 0.00 -0.52 0.00 0.00 55.73 54.44 1uqt s ARG 219 Cb -0.04 -1.19 -0.05 0.00 0.52 0.00 0.00 34.95 34.20 1uqt s ARG 219 CO -0.00 0.29 -0.20 0.95 0.02 0.00 0.00 175.30 176.35 1uqt s THR 220 N -1.01 2.24 -0.02 0.02 -4.23 -0.94 -0.95 115.64 110.75 1uqt s THR 220 Ca 0.04 -2.17 -0.30 0.00 -1.18 0.00 0.00 61.69 58.08 1uqt s THR 220 Cb -0.09 -2.13 0.11 0.00 1.34 0.00 0.00 72.50 71.72 1uqt s THR 220 CO 0.02 -0.31 0.99 -0.70 -0.54 0.00 0.00 174.62 174.08 1uqt s GLU 221 N -3.12 0.74 -0.19 3.99 2.56 -0.96 -4.76 118.70 116.97 1uqt s GLU 221 Ca 0.24 -0.30 -0.04 0.00 0.00 0.00 0.00 54.97 54.86 1uqt s GLU 221 Cb -0.06 0.32 -0.02 0.00 2.00 0.00 0.00 34.13 36.37 1uqt s GLU 221 CO 0.11 -0.33 -0.04 0.08 -0.56 0.00 0.00 175.26 174.52 1uqt s VAL 222 N -2.96 3.65 -0.43 3.70 1.01 -1.26 -1.82 120.40 122.29 1uqt s VAL 222 Ca 0.07 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.65 1uqt s VAL 222 Cb -0.01 -2.63 0.14 0.00 0.00 0.00 0.00 36.38 33.89 1uqt s VAL 222 CO -0.06 0.45 0.26 -0.31 0.00 0.00 0.00 175.10 175.44 1uqt s TYR 223 N 0.90 1.68 -0.26 5.22 2.02 -0.09 -4.91 117.35 121.92 1uqt s TYR 223 Ca -0.00 -2.28 -0.29 0.00 -0.37 0.00 0.00 57.07 54.12 1uqt s TYR 223 Cb -0.15 -1.60 -0.02 0.00 -0.40 0.00 0.00 41.96 39.80 1uqt s TYR 223 CO 0.01 -0.78 1.53 -1.25 -1.57 0.00 0.00 175.55 173.49 1uqt s PRO 224 N 0.37 3.80 0.62 -1.71 0.05 -1.24 -4.51 135.00 132.37 1uqt s PRO 224 Ca 0.20 1.50 -0.19 0.00 0.05 0.00 0.00 61.00 62.56 1uqt s PRO 224 Cb -0.19 -4.00 -0.03 0.00 0.05 0.00 0.00 34.50 30.33 1uqt s PRO 224 CO -0.03 -1.28 1.23 1.51 0.05 0.00 0.00 177.00 178.48 1uqt n ILE 225 N 6.43 4.50 -3.36 0.56 3.06 -1.26 -4.90 119.36 124.39 1uqt n ILE 225 Ca 0.18 -0.50 0.00 0.00 -2.50 0.00 0.00 62.75 59.93 1uqt n ILE 225 Cb 0.46 -1.45 0.00 0.00 0.54 0.00 0.00 39.64 39.19 1uqt n ILE 225 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1uqt n GLY 226 N 0.98 5.39 3.51 4.50 0.00 -1.26 -5.01 105.19 113.29 1uqt n GLY 226 Ca 0.15 -1.71 -0.24 0.00 0.00 0.00 0.00 46.02 44.22 1uqt n GLY 226 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1uqt s ILE 227 N -0.79 1.64 -0.81 -0.61 1.10 -1.26 -4.48 121.20 115.98 1uqt s ILE 227 Ca 0.00 -2.04 -0.11 0.00 -0.51 0.00 0.00 60.65 57.99 1uqt s ILE 227 Cb 0.00 -2.79 0.21 0.00 0.15 0.00 0.00 42.46 40.03 1uqt s ILE 227 CO 0.00 -0.07 0.73 -0.70 -2.11 0.00 0.00 174.94 172.79 1uqt s GLU 228 N -3.78 3.45 0.25 3.50 2.12 -1.26 -1.09 118.70 121.88 1uqt s GLU 228 Ca 0.34 -2.56 -0.03 0.00 0.36 0.00 0.00 54.97 53.08 1uqt s GLU 228 Cb 0.08 -4.29 0.29 0.00 0.26 0.00 0.00 34.13 30.46 1uqt s GLU 228 CO 0.16 -1.26 1.74 -1.35 -0.54 0.00 0.00 175.26 174.01 1uqt h PRO 229 N 7.49 0.85 -0.52 4.30 0.11 -1.96 -1.97 132.00 140.30 1uqt h PRO 229 Ca 0.09 -0.23 -0.01 0.00 0.11 0.00 0.00 66.00 65.96 1uqt h PRO 229 Cb 1.00 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.99 1uqt h PRO 229 CO 0.76 0.85 0.27 0.87 -0.21 0.00 0.00 178.00 180.54 1uqt h LYS 230 N 0.80 0.74 -0.37 1.05 1.57 -1.95 -0.84 116.57 117.56 1uqt h LYS 230 Ca 0.15 -0.10 -0.12 0.00 -1.87 0.00 0.00 60.65 58.72 1uqt h LYS 230 Cb 0.46 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 1uqt h LYS 230 CO 0.02 0.59 -0.27 1.49 -0.57 0.00 0.00 179.45 180.71 1uqt h GLU 231 N 0.70 0.77 -0.01 3.15 4.57 -1.89 -1.47 114.58 120.39 1uqt h GLU 231 Ca 0.18 -0.33 -0.00 0.00 -1.18 0.00 0.00 59.36 58.03 1uqt h GLU 231 Cb 0.08 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.64 1uqt h GLU 231 CO -0.03 0.95 0.01 0.82 -1.18 0.00 0.00 179.01 179.58 1uqt h ILE 232 N 0.66 1.07 -0.99 2.32 1.08 -1.22 -1.85 117.51 118.58 1uqt h ILE 232 Ca 0.08 -0.20 0.07 0.00 -0.39 0.00 0.00 64.86 64.42 1uqt h ILE 232 Cb 0.79 1.19 -0.07 0.00 -3.07 0.00 0.00 36.82 35.66 1uqt h ILE 232 CO 0.07 0.05 0.64 0.00 -0.69 0.00 0.00 178.15 178.22 1uqt h ALA 233 N 0.92 1.42 -0.35 1.87 0.00 -1.04 -0.12 119.26 121.97 1uqt h ALA 233 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1uqt h ALA 233 Cb 0.08 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1uqt h ALA 233 CO -0.00 0.43 0.14 -0.22 0.00 0.00 0.00 179.25 179.60 1uqt h LYS 234 N 1.16 0.52 -0.23 0.00 3.64 -1.07 -2.53 116.57 118.05 1uqt h LYS 234 Ca 0.43 -0.09 -0.10 0.00 -1.27 0.00 0.00 60.65 59.61 1uqt h LYS 234 Cb 0.18 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1uqt h LYS 234 CO -0.17 0.51 -0.24 1.96 -2.27 0.00 0.00 179.45 179.24 1uqt h GLN 235 N 0.41 0.57 -0.92 1.90 4.20 -0.76 -3.09 115.11 117.42 1uqt h GLN 235 Ca 0.12 -0.30 0.04 0.00 0.06 0.00 0.00 58.65 58.56 1uqt h GLN 235 Cb 0.19 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.93 1uqt h GLN 235 CO -0.01 0.90 0.60 0.00 -0.67 0.00 0.00 178.83 179.65 1uqt h ALA 236 N 0.66 1.43 0.00 3.87 0.00 -1.04 -2.97 119.26 121.21 1uqt h ALA 236 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1uqt h ALA 236 Cb 0.80 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1uqt h ALA 236 CO 0.06 0.48 -0.24 0.00 0.00 0.00 0.00 179.25 179.54 1uqt n ALA 237 N -2.39 2.62 -1.04 0.00 0.00 -0.96 -4.19 120.51 114.55 1uqt n ALA 237 Ca 0.12 -0.14 -0.30 0.00 0.00 0.00 0.00 53.44 53.12 1uqt n ALA 237 Cb 0.12 -1.34 0.13 0.00 0.00 0.00 0.00 19.45 18.36 1uqt n ALA 237 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1uqt s GLY 238 N -3.44 1.66 0.17 0.00 0.00 -1.12 -4.92 107.32 99.67 1uqt s GLY 238 Ca 0.10 0.25 -0.33 0.00 0.00 0.00 0.00 44.72 44.74 1uqt s GLY 238 CO 0.63 0.68 1.67 -1.05 0.00 0.00 0.00 173.10 175.03 1uqt n PRO 239 N -3.91 2.47 -1.86 2.90 -0.02 -1.26 -4.96 135.00 128.36 1uqt n PRO 239 Ca 0.09 0.89 -0.39 0.00 -2.02 0.00 0.00 63.50 62.07 1uqt n PRO 239 Cb 0.53 -2.71 0.02 0.00 -0.02 0.00 0.00 33.50 31.33 1uqt n PRO 239 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1uqt s LEU 240 N 1.22 4.04 0.51 2.45 1.43 -1.26 -4.99 118.68 122.08 1uqt s LEU 240 Ca 0.78 2.80 -0.21 0.00 -1.03 0.00 0.00 54.13 56.46 1uqt s LEU 240 Cb -0.59 -4.05 -0.06 0.00 0.03 0.00 0.00 46.19 41.52 1uqt s LEU 240 CO 0.36 -1.23 1.17 -2.84 0.23 0.00 0.00 176.35 174.04 1uqt s PRO 241 N -2.57 3.49 0.31 1.29 0.02 -1.26 -4.72 135.00 131.57 1uqt s PRO 241 Ca 0.64 1.76 0.04 0.00 0.02 0.00 0.00 61.00 63.46 1uqt s PRO 241 Cb -0.41 -2.21 0.82 0.00 0.02 0.00 0.00 34.50 32.72 1uqt s PRO 241 CO 0.51 -0.77 1.55 -2.30 -0.33 0.00 0.00 177.00 175.66 1uqt n PRO 242 N -0.92 -0.08 0.24 5.54 -0.02 -1.26 -0.83 135.00 137.67 1uqt n PRO 242 Ca 0.10 1.47 0.15 0.00 -2.02 0.00 0.00 63.50 63.20 1uqt n PRO 242 Cb 0.49 -2.36 0.53 0.00 -0.02 0.00 0.00 33.50 32.14 1uqt n PRO 242 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1uqt h LYS 243 N 0.00 0.00 0.06 -0.52 1.79 -1.99 -1.71 116.57 114.19 1uqt h LYS 243 Ca 0.63 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 58.80 1uqt h LYS 243 Cb 1.34 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.96 1uqt h LYS 243 CO -0.91 0.00 -1.59 -0.07 -1.08 0.00 0.00 179.45 175.80 1uqt h LEU 244 N 0.00 0.19 -0.87 2.94 -0.00 -1.34 -2.50 115.31 113.72 1uqt h LEU 244 Ca 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 57.88 57.57 1uqt h LEU 244 Cb 0.62 -0.06 -0.04 0.00 -0.00 0.00 0.00 40.66 41.18 1uqt h LEU 244 CO 0.00 1.27 0.56 0.00 -0.00 0.00 0.00 178.44 180.27 1uqt h ALA 245 N 0.70 1.11 -0.01 1.53 0.00 -1.33 -1.84 119.26 119.42 1uqt h ALA 245 Ca -0.25 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1uqt h ALA 245 Cb 1.98 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 19.42 1uqt h ALA 245 CO 0.12 0.53 0.01 0.37 0.00 0.00 0.00 179.25 180.27 1uqt h GLN 246 N 1.19 0.01 -0.49 0.00 4.15 -1.35 -2.88 115.11 115.74 1uqt h GLN 246 Ca 0.32 -0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.69 1uqt h GLN 246 Cb -0.11 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.55 1uqt h GLN 246 CO -0.07 0.02 0.11 1.25 -1.93 0.00 0.00 178.83 178.21 1uqt h LEU 247 N 0.01 0.69 -0.42 -2.39 5.85 -1.34 -2.18 115.31 115.54 1uqt h LEU 247 Ca 0.00 -0.12 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 1uqt h LEU 247 Cb 0.01 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 1uqt h LEU 247 CO -0.00 0.69 -0.06 0.50 -0.34 0.00 0.00 178.44 179.23 1uqt h LYS 248 N 0.72 0.78 0.00 1.25 3.64 -1.25 -1.28 116.57 120.43 1uqt h LYS 248 Ca 0.16 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1uqt h LYS 248 Cb 0.28 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1uqt h LYS 248 CO -0.00 0.88 0.00 0.00 -2.27 0.00 0.00 179.45 178.06 1uqt n ALA 249 N -2.44 1.87 0.00 5.00 0.00 -1.10 -2.87 120.51 120.98 1uqt n ALA 249 Ca -0.01 0.04 -0.07 0.00 0.00 0.00 0.00 53.44 53.40 1uqt n ALA 249 Cb 0.34 -1.41 -0.13 0.00 0.00 0.00 0.00 19.45 18.25 1uqt n ALA 249 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1uqt h GLU 250 N 0.00 0.00 -0.96 0.00 5.08 -0.97 -3.37 114.58 114.37 1uqt h GLU 250 Ca 0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 1uqt h GLU 250 Cb 0.48 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 29.42 1uqt h GLU 250 CO 0.00 0.59 0.63 1.28 -1.00 0.00 0.00 179.01 180.52 1uqt n LEU 251 N -3.11 7.23 -0.18 1.33 4.77 -0.52 -4.72 117.00 121.79 1uqt n LEU 251 Ca -0.12 -4.29 -0.01 0.00 -0.03 0.00 0.00 56.01 51.56 1uqt n LEU 251 Cb 1.00 -0.88 0.09 0.00 -2.33 0.00 0.00 43.42 41.30 1uqt n LEU 251 CO 0.45 1.51 0.97 0.11 -1.33 0.00 0.00 177.39 179.11 1uqt h LYS 252 N 1.93 0.37 -0.35 3.23 1.57 -1.72 -2.65 116.57 118.95 1uqt h LYS 252 Ca 0.57 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.33 1uqt h LYS 252 Cb 1.07 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.30 1uqt h LYS 252 CO 1.43 0.24 0.00 0.09 -0.57 0.00 0.00 179.45 180.65 1uqt n ASN 253 N -5.00 3.36 -4.39 0.86 3.02 -1.26 -4.85 115.26 107.00 1uqt n ASN 253 Ca 0.07 -1.99 -0.36 0.00 -0.03 0.00 0.00 54.58 52.27 1uqt n ASN 253 Cb 0.24 -0.22 -0.13 0.00 -0.61 0.00 0.00 39.78 39.06 1uqt n ASN 253 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1uqt s VAL 254 N -1.56 3.96 0.32 2.41 1.01 -1.00 -4.80 120.40 120.73 1uqt s VAL 254 Ca 0.38 -0.35 -0.22 0.00 0.00 0.00 0.00 61.98 61.78 1uqt s VAL 254 Cb 0.22 -2.87 -0.10 0.00 0.00 0.00 0.00 36.38 33.64 1uqt s VAL 254 CO 0.32 0.33 0.87 -1.10 0.00 0.00 0.00 175.10 175.51 1uqt s GLN 255 N 1.56 4.36 -0.18 2.72 -0.21 -0.20 -4.87 119.66 122.85 1uqt s GLN 255 Ca 0.06 1.10 -0.02 0.00 0.02 0.00 0.00 55.36 56.51 1uqt s GLN 255 Cb -0.15 -2.66 -0.01 0.00 1.00 0.00 0.00 33.01 31.19 1uqt s GLN 255 CO 0.01 0.23 -0.08 -0.80 -2.12 0.00 0.00 175.29 172.53 1uqt s ASN 256 N -1.81 4.20 -0.18 5.90 0.01 -1.26 -0.88 114.94 120.91 1uqt s ASN 256 Ca 0.51 -0.35 -0.08 0.00 -0.71 0.00 0.00 52.86 52.24 1uqt s ASN 256 Cb -0.15 -1.68 -0.04 0.00 0.41 0.00 0.00 41.25 39.78 1uqt s ASN 256 CO 0.20 0.07 0.07 -0.63 -1.51 0.00 0.00 177.10 175.30 1uqt s ILE 257 N 0.91 4.82 -0.01 0.60 1.01 0.50 -0.78 121.20 128.25 1uqt s ILE 257 Ca -0.02 -0.02 0.03 0.00 0.00 0.00 0.00 60.65 60.64 1uqt s ILE 257 Cb -0.15 -3.17 -0.01 0.00 0.01 0.00 0.00 42.46 39.14 1uqt s ILE 257 CO 0.00 0.46 -0.10 0.12 0.00 0.00 0.00 174.94 175.42 1uqt s PHE 258 N 0.35 0.95 0.01 3.97 5.36 0.07 -0.97 117.98 127.72 1uqt s PHE 258 Ca 0.03 -0.19 0.00 0.00 -0.96 0.00 0.00 56.93 55.82 1uqt s PHE 258 Cb -0.12 -0.62 -0.01 0.00 -0.34 0.00 0.00 43.02 41.93 1uqt s PHE 258 CO -0.00 -0.02 -0.01 -1.12 -1.46 0.00 0.00 175.22 172.60 1uqt s SER 259 N -0.21 0.12 0.00 6.13 0.01 -0.57 -0.83 113.70 118.35 1uqt s SER 259 Ca 0.03 -0.18 0.00 0.00 1.31 0.00 0.00 55.95 57.12 1uqt s SER 259 Cb -0.04 0.03 -0.00 0.00 0.21 0.00 0.00 66.02 66.21 1uqt s SER 259 CO -0.00 -0.10 -0.01 0.54 0.41 0.00 0.00 173.24 174.08 1uqt s VAL 260 N -0.50 0.07 -0.13 3.43 0.11 -1.26 -1.27 120.40 120.85 1uqt s VAL 260 Ca -0.05 -0.16 -0.33 0.00 -2.93 0.00 0.00 61.98 58.50 1uqt s VAL 260 Cb -0.04 -0.09 0.13 0.00 -1.53 0.00 0.00 36.38 34.85 1uqt s VAL 260 CO -0.00 -0.06 1.15 -1.83 -3.33 0.00 0.00 175.10 171.03 1uqt s GLU 261 N -0.23 0.43 0.32 1.54 1.03 -0.76 -4.98 118.70 116.05 1uqt s GLU 261 Ca -0.02 -0.17 -0.27 0.00 0.03 0.00 0.00 54.97 54.53 1uqt s GLU 261 Cb -0.02 0.19 -0.13 0.00 -0.80 0.00 0.00 34.13 33.37 1uqt s GLU 261 CO -0.00 -0.19 1.03 0.54 -1.33 0.00 0.00 175.26 175.31 1uqt n ARG 262 N -0.17 1.43 -2.60 -4.83 1.74 -1.26 -3.83 116.66 107.12 1uqt n ARG 262 Ca -0.02 0.50 -0.41 0.00 -0.77 0.00 0.00 57.85 57.15 1uqt n ARG 262 Cb 0.59 -1.92 -0.03 0.00 -1.02 0.00 0.00 32.46 30.08 1uqt n ARG 262 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1uqt s LEU 263 N 0.16 3.49 0.00 0.55 0.20 -0.92 -4.90 118.68 117.26 1uqt s LEU 263 Ca 0.59 -0.90 -0.01 0.00 0.69 0.00 0.00 54.13 54.50 1uqt s LEU 263 Cb -0.66 -2.54 -0.01 0.00 -0.43 0.00 0.00 46.19 42.55 1uqt s LEU 263 CO 0.60 -1.66 0.01 -0.62 -0.29 0.00 0.00 176.35 174.39 1uqt s ASP 264 N 4.11 0.08 0.50 3.68 -1.08 -1.26 -4.13 116.67 118.57 1uqt s ASP 264 Ca 0.37 -0.17 0.24 0.00 -0.52 0.00 0.00 52.55 52.46 1uqt s ASP 264 Cb -0.06 0.08 1.30 0.00 -1.46 0.00 0.00 42.92 42.78 1uqt s ASP 264 CO 0.06 -0.14 2.04 0.10 0.52 0.00 0.00 175.17 177.74 1uqt h TYR 265 N 5.45 0.00 -0.04 -5.34 -0.00 -1.92 -1.68 116.97 113.43 1uqt h TYR 265 Ca -0.28 0.00 0.01 0.00 -0.00 0.00 0.00 58.73 58.47 1uqt h TYR 265 Cb 1.21 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.94 1uqt h TYR 265 CO 0.52 0.15 0.09 0.66 -0.00 0.00 0.00 178.16 179.57 1uqt h SER 266 N 0.00 0.00 1.04 0.10 4.64 -1.94 -3.13 113.55 114.25 1uqt h SER 266 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1uqt h SER 266 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1uqt h SER 266 CO 0.02 0.00 -0.36 0.29 -0.87 0.00 0.00 176.83 175.91 1uqt n LYS 267 N -3.42 0.23 -3.10 4.77 4.76 -0.63 -0.35 118.16 120.43 1uqt n LYS 267 Ca -0.02 0.11 -0.17 0.00 -2.87 0.00 0.00 58.31 55.37 1uqt n LYS 267 Cb 0.17 -1.69 0.05 0.00 -1.84 0.00 0.00 35.03 31.71 1uqt n LYS 267 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1uqt n GLY 268 N 1.36 -0.15 0.17 0.72 0.00 -1.19 -3.61 105.19 102.49 1uqt n GLY 268 Ca 0.04 -0.05 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1uqt n GLY 268 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1uqt h LEU 269 N -1.58 0.53 -0.95 0.99 4.07 -1.86 -0.77 115.31 115.74 1uqt h LEU 269 Ca -0.40 -0.40 0.06 0.00 0.08 0.00 0.00 57.88 57.22 1uqt h LEU 269 Cb 1.27 -0.15 -0.06 0.00 1.08 0.00 0.00 40.66 42.80 1uqt h LEU 269 CO 0.41 0.81 0.60 -0.65 -1.08 0.00 0.00 178.44 178.53 1uqt h PRO 270 N 0.25 1.08 -0.25 1.13 0.11 -1.93 -1.47 132.00 130.92 1uqt h PRO 270 Ca 0.06 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 66.04 1uqt h PRO 270 Cb 0.60 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 1uqt h PRO 270 CO 0.03 0.71 -0.12 0.93 -0.21 0.00 0.00 178.00 179.35 1uqt h GLU 271 N 1.11 0.41 -0.35 1.05 3.07 -1.90 -1.38 114.58 116.60 1uqt h GLU 271 Ca 0.40 -0.11 -0.06 0.00 -0.50 0.00 0.00 59.36 59.10 1uqt h GLU 271 Cb 0.14 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 1uqt h GLU 271 CO -0.16 0.53 -0.02 -0.09 -1.40 0.00 0.00 179.01 177.87 1uqt h ARG 272 N 0.38 0.62 -0.77 2.33 2.43 -0.24 -0.77 114.38 118.36 1uqt h ARG 272 Ca 0.07 -0.21 0.01 0.00 -0.81 0.00 0.00 59.98 59.05 1uqt h ARG 272 Cb 0.45 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.90 1uqt h ARG 272 CO 0.03 0.75 0.51 0.74 -1.51 0.00 0.00 179.97 180.49 1uqt h PHE 273 N 0.43 0.96 -0.45 2.20 -1.00 -0.92 -1.60 116.94 116.56 1uqt h PHE 273 Ca 0.10 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.87 1uqt h PHE 273 Cb 0.48 -0.32 -0.02 0.00 3.61 0.00 0.00 35.95 39.69 1uqt h PHE 273 CO 0.04 0.60 0.18 -0.07 -1.61 0.00 0.00 178.31 177.44 1uqt h LEU 274 N 1.03 0.58 -0.50 1.54 4.07 -1.03 -0.55 115.31 120.45 1uqt h LEU 274 Ca 0.29 -0.06 -0.08 0.00 0.08 0.00 0.00 57.88 58.10 1uqt h LEU 274 Cb -0.09 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 41.48 1uqt h LEU 274 CO -0.07 0.53 -0.01 0.00 -1.08 0.00 0.00 178.44 177.81 1uqt h ALA 275 N 1.56 0.68 -0.52 1.53 0.00 -0.45 -1.41 119.26 120.66 1uqt h ALA 275 Ca 0.16 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1uqt h ALA 275 Cb 0.14 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1uqt h ALA 275 CO -0.02 0.50 0.14 -0.92 0.00 0.00 0.00 179.25 178.95 1uqt h TYR 276 N 0.76 0.86 -0.89 0.00 3.20 -0.75 -1.01 116.97 119.14 1uqt h TYR 276 Ca 0.14 -0.10 0.11 0.00 3.14 0.00 0.00 58.73 62.02 1uqt h TYR 276 Cb 0.53 -0.24 -0.08 0.00 1.54 0.00 0.00 36.73 38.48 1uqt h TYR 276 CO 0.04 0.75 0.53 1.49 -1.64 0.00 0.00 178.16 179.33 1uqt h GLU 277 N 0.72 0.82 -0.11 1.82 4.81 -0.93 -1.24 114.58 120.46 1uqt h GLU 277 Ca 0.16 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.22 1uqt h GLU 277 Cb 0.32 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1uqt h GLU 277 CO -0.00 0.54 -0.49 0.00 -0.73 0.00 0.00 179.01 178.33 1uqt h ALA 278 N 1.50 0.95 -0.25 2.92 0.00 -0.58 0.54 119.26 124.33 1uqt h ALA 278 Ca 0.44 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1uqt h ALA 278 Cb 0.44 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1uqt h ALA 278 CO -0.27 0.65 0.16 1.25 0.00 0.00 0.00 179.25 181.04 1uqt h LEU 279 N 0.24 0.30 -0.89 0.00 5.85 -0.42 -1.32 115.31 119.06 1uqt h LEU 279 Ca 0.01 -0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 1uqt h LEU 279 Cb 0.95 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.89 1uqt h LEU 279 CO 0.08 0.26 -0.10 -0.07 -0.34 0.00 0.00 178.44 178.26 1uqt h LEU 280 N 0.32 0.69 -0.17 2.25 4.07 -0.80 0.73 115.31 122.40 1uqt h LEU 280 Ca 0.09 -0.20 -0.11 0.00 0.08 0.00 0.00 57.88 57.74 1uqt h LEU 280 Cb 0.01 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.56 1uqt h LEU 280 CO -0.02 0.83 -0.33 -0.08 -1.08 0.00 0.00 178.44 177.76 1uqt h GLU 281 N 0.65 0.53 0.00 1.13 4.57 -0.73 -3.35 114.58 117.38 1uqt h GLU 281 Ca 0.11 -0.34 0.00 0.00 -1.18 0.00 0.00 59.36 57.96 1uqt h GLU 281 Cb 0.55 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 1uqt h GLU 281 CO 0.03 0.94 -1.35 1.63 -1.18 0.00 0.00 179.01 179.08 1uqt n LYS 282 N -4.34 0.52 -3.25 1.92 5.02 -0.51 -4.57 118.16 112.96 1uqt n LYS 282 Ca -0.06 -0.08 -0.26 0.00 -2.02 0.00 0.00 58.31 55.89 1uqt n LYS 282 Cb 0.49 -1.46 -0.06 0.00 -0.02 0.00 0.00 35.03 33.98 1uqt n LYS 282 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1uqt n TYR 283 N -1.78 2.75 0.32 2.13 4.01 0.24 -4.94 117.16 119.89 1uqt n TYR 283 Ca 0.01 -3.99 0.22 0.00 -0.16 0.00 0.00 57.90 53.97 1uqt n TYR 283 Cb 0.40 -0.49 1.11 0.00 -0.31 0.00 0.00 39.34 40.05 1uqt n TYR 283 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1uqt h PRO 284 N 3.77 0.00 -1.24 -0.72 0.13 -1.77 -1.70 132.00 130.47 1uqt h PRO 284 Ca 0.15 0.00 0.36 0.00 -0.87 0.00 0.00 66.00 65.64 1uqt h PRO 284 Cb 0.69 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.76 1uqt h PRO 284 CO 0.74 0.00 0.88 1.96 -0.23 0.00 0.00 178.00 181.35 1uqt h GLN 285 N 0.00 0.05 -0.00 0.86 7.50 -1.93 -1.74 115.11 119.85 1uqt h GLN 285 Ca 0.00 -0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1uqt h GLN 285 Cb 0.09 -0.01 0.00 0.00 0.05 0.00 0.00 27.48 27.61 1uqt h GLN 285 CO 0.00 0.03 -0.20 0.72 -1.50 0.00 0.00 178.83 177.88 1uqt n HIS 286 N -4.23 0.00 -1.75 2.96 8.25 -0.64 -4.87 115.22 114.95 1uqt n HIS 286 Ca 0.27 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.32 1uqt n HIS 286 Cb 1.27 -0.20 -0.02 0.00 1.12 0.00 0.00 29.99 32.16 1uqt n HIS 286 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1uqt s HIS 287 N -2.59 2.84 0.00 4.41 3.76 -0.66 -1.40 115.29 121.66 1uqt s HIS 287 Ca 0.24 0.52 0.00 0.00 -0.15 0.00 0.00 55.06 55.67 1uqt s HIS 287 Cb 0.19 -4.11 0.00 0.00 1.11 0.00 0.00 32.58 29.77 1uqt s HIS 287 CO 0.52 -4.03 0.00 0.41 -0.85 0.00 0.00 174.74 170.79 1uqt n GLY 288 N 3.24 1.79 0.00 -2.22 0.00 -1.26 -4.81 105.19 101.93 1uqt n GLY 288 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1uqt n GLY 288 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1uqt n LYS 289 N -2.00 -0.64 -4.28 1.61 5.02 -0.49 -4.88 118.16 112.50 1uqt n LYS 289 Ca 0.00 -0.41 -0.15 0.00 -2.02 0.00 0.00 58.31 55.73 1uqt n LYS 289 Cb 0.00 -0.87 -0.10 0.00 -0.02 0.00 0.00 35.03 34.03 1uqt n LYS 289 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1uqt s ILE 290 N -0.03 0.47 -0.18 -0.18 -4.36 -1.15 -1.03 121.20 114.74 1uqt s ILE 290 Ca 0.00 -2.00 -0.22 0.00 -0.26 0.00 0.00 60.65 58.17 1uqt s ILE 290 Cb 0.00 -2.53 0.06 0.00 1.25 0.00 0.00 42.46 41.24 1uqt s ILE 290 CO 0.00 -0.08 0.60 -0.60 0.24 0.00 0.00 174.94 175.10 1uqt s ARG 291 N -4.04 0.76 -0.19 0.37 3.52 -0.06 -4.84 118.95 114.48 1uqt s ARG 291 Ca 0.36 0.67 -0.04 0.00 -0.13 0.00 0.00 55.73 56.59 1uqt s ARG 291 Cb 0.07 0.37 -0.02 0.00 -1.56 0.00 0.00 34.95 33.81 1uqt s ARG 291 CO 0.12 -0.13 -0.04 -0.47 -0.81 0.00 0.00 175.30 173.96 1uqt s TYR 292 N -0.06 2.97 -0.18 5.12 5.04 -0.47 -0.37 117.35 129.40 1uqt s TYR 292 Ca -0.03 -0.62 -0.01 0.00 -2.44 0.00 0.00 57.07 53.97 1uqt s TYR 292 Cb -0.04 -2.03 0.00 0.00 0.35 0.00 0.00 41.96 40.25 1uqt s TYR 292 CO 0.03 -0.30 -0.14 0.99 -1.34 0.00 0.00 175.55 174.78 1uqt s THR 293 N 0.94 2.62 -0.22 4.34 2.01 -0.15 -0.69 115.64 124.50 1uqt s THR 293 Ca -0.00 -0.76 -0.04 0.00 0.31 0.00 0.00 61.69 61.20 1uqt s THR 293 Cb -0.15 -2.13 -0.01 0.00 0.01 0.00 0.00 72.50 70.23 1uqt s THR 293 CO 0.01 0.50 -0.04 -1.58 -0.69 0.00 0.00 174.62 172.82 1uqt s GLN 294 N 1.15 3.37 -0.19 4.92 2.00 0.08 -1.51 119.66 129.48 1uqt s GLN 294 Ca 0.01 -0.63 -0.08 0.00 -2.00 0.00 0.00 55.36 52.67 1uqt s GLN 294 Cb -0.14 -3.01 -0.04 0.00 0.80 0.00 0.00 33.01 30.62 1uqt s GLN 294 CO -0.05 -0.20 0.07 0.42 -0.50 0.00 0.00 175.29 175.02 1uqt s ILE 295 N 1.48 4.81 -0.50 -2.34 1.01 -0.40 -1.16 121.20 124.10 1uqt s ILE 295 Ca 0.06 -0.02 0.07 0.00 0.00 0.00 0.00 60.65 60.75 1uqt s ILE 295 Cb -0.14 -3.18 0.19 0.00 0.01 0.00 0.00 42.46 39.34 1uqt s ILE 295 CO -0.03 0.45 0.68 0.00 0.00 0.00 0.00 174.94 176.04 1uqt n ALA 296 N 3.61 -1.16 -1.77 9.38 0.00 -0.42 -1.83 120.51 128.32 1uqt n ALA 296 Ca -0.16 -1.35 -0.38 0.00 0.00 0.00 0.00 53.44 51.54 1uqt n ALA 296 Cb 0.52 -1.38 -0.01 0.00 0.00 0.00 0.00 19.45 18.59 1uqt n ALA 296 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1uqt s PRO 297 N 0.73 3.81 0.05 0.00 0.04 -1.25 -4.24 135.00 134.15 1uqt s PRO 297 Ca 0.31 1.91 -0.30 0.00 0.04 0.00 0.00 61.00 62.95 1uqt s PRO 297 Cb 0.02 -2.53 -0.09 0.00 0.04 0.00 0.00 34.50 31.94 1uqt s PRO 297 CO -0.08 -0.54 1.89 0.99 0.04 0.00 0.00 177.00 179.30 1uqt s THR 298 N -1.43 2.96 -0.09 1.26 2.01 -1.26 -2.17 115.64 116.91 1uqt s THR 298 Ca 0.61 0.12 0.02 0.00 0.31 0.00 0.00 61.69 62.75 1uqt s THR 298 Cb -0.32 -3.08 -0.02 0.00 0.01 0.00 0.00 72.50 69.10 1uqt s THR 298 CO 0.40 -0.01 -0.15 -0.55 -0.69 0.00 0.00 174.62 173.62 1uqt s SER 299 N 3.84 3.94 -1.47 3.53 0.15 -1.26 -4.79 113.70 117.63 1uqt s SER 299 Ca 0.85 -0.29 -0.01 0.00 0.70 0.00 0.00 55.95 57.20 1uqt s SER 299 Cb -0.42 -1.25 0.00 0.00 -1.71 0.00 0.00 66.02 62.64 1uqt s SER 299 CO 0.39 0.24 0.21 0.54 1.20 0.00 0.00 173.24 175.82 1uqt n ARG 300 N 2.99 -2.05 0.00 5.44 1.74 -1.26 -4.79 116.66 118.73 1uqt n ARG 300 Ca -0.18 0.24 0.11 0.00 -0.77 0.00 0.00 57.85 57.25 1uqt n ARG 300 Cb 0.52 -4.02 0.58 0.00 -1.02 0.00 0.00 32.46 28.52 1uqt n ARG 300 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uqt n GLY 301 N -2.29 -0.89 0.08 -0.13 0.00 -1.26 -2.41 105.19 98.28 1uqt n GLY 301 Ca -0.32 -0.11 0.10 0.00 0.00 0.00 0.00 46.02 45.69 1uqt n GLY 301 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1uqt n ASP 302 N -1.19 0.42 -4.44 1.61 10.43 -1.26 -4.61 116.55 117.52 1uqt n ASP 302 Ca 0.12 0.60 -0.32 0.00 2.57 0.00 0.00 54.79 57.76 1uqt n ASP 302 Cb 0.14 -0.69 -0.14 0.00 1.84 0.00 0.00 41.12 42.27 1uqt n ASP 302 CO 0.00 0.00 0.00 0.68 -1.07 0.00 0.00 177.20 176.81 1uqt s VAL 303 N -3.18 2.81 0.19 2.53 -7.23 -1.01 -5.05 120.40 109.46 1uqt s VAL 303 Ca 0.06 -0.83 -0.12 0.00 -1.81 0.00 0.00 61.98 59.28 1uqt s VAL 303 Cb 0.10 -2.08 0.11 0.00 0.56 0.00 0.00 36.38 35.07 1uqt s VAL 303 CO 0.37 0.58 1.73 -0.61 -0.31 0.00 0.00 175.10 176.86 1uqt h GLN 304 N 5.36 0.30 -0.82 4.82 5.75 -1.89 -1.51 115.11 127.12 1uqt h GLN 304 Ca -0.46 -0.02 0.07 0.00 -0.15 0.00 0.00 58.65 58.10 1uqt h GLN 304 Cb 1.14 -0.07 -0.05 0.00 1.07 0.00 0.00 27.48 29.57 1uqt h GLN 304 CO 0.49 0.20 0.53 0.00 -2.65 0.00 0.00 178.83 177.41 1uqt h ALA 305 N 1.37 1.64 0.01 3.38 0.00 -1.96 -0.87 119.26 122.84 1uqt h ALA 305 Ca 0.26 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.89 1uqt h ALA 305 Cb 0.32 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.91 1uqt h ALA 305 CO -0.29 0.22 -1.03 1.88 0.00 0.00 0.00 179.25 180.02 1uqt h TYR 306 N 0.86 0.87 -0.24 0.00 -1.99 -1.59 -3.02 116.97 111.86 1uqt h TYR 306 Ca 0.36 -0.49 -0.07 0.00 2.00 0.00 0.00 58.73 60.53 1uqt h TYR 306 Cb 0.29 -0.09 -0.01 0.00 2.00 0.00 0.00 36.73 38.91 1uqt h TYR 306 CO -0.00 1.32 -0.16 1.96 -0.00 0.00 0.00 178.16 181.28 1uqt h GLN 307 N 0.32 0.42 -0.67 4.88 4.20 -1.07 -2.47 115.11 120.71 1uqt h GLN 307 Ca -0.12 -0.12 -0.07 0.00 0.06 0.00 0.00 58.65 58.40 1uqt h GLN 307 Cb 1.68 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 29.39 1uqt h GLN 307 CO 0.19 0.57 0.13 -0.44 -0.67 0.00 0.00 178.83 178.62 1uqt h ASP 308 N 0.38 1.05 -0.03 1.46 3.32 -1.19 -2.42 116.42 119.00 1uqt h ASP 308 Ca 0.07 -0.24 -0.23 0.00 0.02 0.00 0.00 57.03 56.65 1uqt h ASP 308 Cb 0.51 -0.28 0.01 0.00 0.22 0.00 0.00 39.33 39.80 1uqt h ASP 308 CO 0.03 1.02 -0.86 -0.29 -1.72 0.00 0.00 179.24 177.42 1uqt h ILE 309 N 1.03 1.30 -0.38 0.35 6.09 -1.36 -2.47 117.51 122.06 1uqt h ILE 309 Ca 0.21 -2.10 0.07 0.00 -1.37 0.00 0.00 64.86 61.67 1uqt h ILE 309 Cb 0.41 2.14 -0.07 0.00 0.47 0.00 0.00 36.82 39.77 1uqt h ILE 309 CO 0.01 0.66 -0.06 -0.09 -3.07 0.00 0.00 178.15 175.60 1uqt h ARG 310 N 0.45 0.04 -0.26 2.19 2.43 -1.34 -0.90 114.38 116.99 1uqt h ARG 310 Ca -0.08 -0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.03 1uqt h ARG 310 Cb 1.50 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 31.02 1uqt h ARG 310 CO 0.17 0.02 -0.12 0.45 -1.51 0.00 0.00 179.97 178.98 1uqt h HIS 311 N 0.04 0.46 -0.26 2.20 3.86 -1.44 -1.47 115.15 118.53 1uqt h HIS 311 Ca 0.18 -0.06 -0.10 0.00 -1.16 0.00 0.00 60.37 59.23 1uqt h HIS 311 Cb 0.27 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 1uqt h HIS 311 CO -0.31 0.54 -0.27 1.96 0.86 0.00 0.00 177.93 180.71 1uqt h GLN 312 N 0.40 0.51 -0.15 2.45 1.08 -0.91 -1.87 115.11 116.61 1uqt h GLN 312 Ca 0.08 -0.20 -0.21 0.00 -1.45 0.00 0.00 58.65 56.87 1uqt h GLN 312 Cb 0.46 -0.03 0.01 0.00 -0.05 0.00 0.00 27.48 27.87 1uqt h GLN 312 CO 0.03 0.74 -0.71 -0.07 -0.95 0.00 0.00 178.83 177.87 1uqt h LEU 313 N 0.45 0.89 -0.08 1.46 4.07 -0.62 -0.42 115.31 121.05 1uqt h LEU 313 Ca 0.06 -0.62 0.02 0.00 0.08 0.00 0.00 57.88 57.42 1uqt h LEU 313 Cb 0.71 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 42.16 1uqt h LEU 313 CO 0.05 1.37 -0.06 -0.33 -1.08 0.00 0.00 178.44 178.39 1uqt h GLU 314 N 0.46 -0.06 -0.40 1.13 5.08 -1.20 0.09 114.58 119.68 1uqt h GLU 314 Ca -0.04 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1uqt h GLU 314 Cb 1.34 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.57 1uqt h GLU 314 CO 0.15 -0.04 0.23 -0.97 -1.00 0.00 0.00 179.01 177.37 1uqt h ASN 315 N -0.06 0.36 0.16 1.42 -0.73 -1.27 -2.22 115.58 113.23 1uqt h ASN 315 Ca 0.05 0.01 -0.14 0.00 1.87 0.00 0.00 56.30 58.09 1uqt h ASN 315 Cb 0.14 -0.07 -0.01 0.00 0.27 0.00 0.00 38.32 38.65 1uqt h ASN 315 CO -0.12 0.26 -0.49 -0.33 -0.37 0.00 0.00 177.43 176.38 1uqt h GLU 316 N 0.46 0.38 -0.43 6.67 4.39 -0.84 0.28 114.58 125.50 1uqt h GLU 316 Ca 0.16 -0.22 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 1uqt h GLU 316 Cb 0.02 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 1uqt h GLU 316 CO -0.08 0.79 0.17 0.00 -1.16 0.00 0.00 179.01 178.73 1uqt h ALA 317 N 1.17 0.56 -0.36 3.43 0.00 -0.81 -0.68 119.26 122.56 1uqt h ALA 317 Ca 0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1uqt h ALA 317 Cb 0.98 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1uqt h ALA 317 CO 0.08 0.16 0.10 0.78 0.00 0.00 0.00 179.25 180.38 1uqt h GLY 318 N 0.55 0.62 0.81 0.00 0.00 -1.13 -1.33 103.07 102.59 1uqt h GLY 318 Ca 0.14 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.09 1uqt h GLY 318 CO -0.01 0.35 -0.04 -0.09 0.00 0.00 0.00 176.54 176.75 1uqt h ARG 319 N 0.44 -0.10 -0.25 4.80 2.43 -0.80 0.68 114.38 121.58 1uqt h ARG 319 Ca 0.12 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 1uqt h ARG 319 Cb 0.28 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 1uqt h ARG 319 CO -0.00 0.11 0.08 0.82 -1.51 0.00 0.00 179.97 179.47 1uqt h ILE 320 N -0.30 1.19 -0.68 1.20 2.04 -1.13 -1.39 117.51 118.45 1uqt h ILE 320 Ca -0.01 -0.60 -0.04 0.00 1.00 0.00 0.00 64.86 65.20 1uqt h ILE 320 Cb 0.25 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 1uqt h ILE 320 CO 0.02 0.20 0.26 0.78 0.00 0.00 0.00 178.15 179.40 1uqt h ASN 321 N 0.24 0.94 -0.04 1.72 2.35 -1.27 -1.00 115.58 118.51 1uqt h ASN 321 Ca 0.08 -0.14 -0.04 0.00 -0.55 0.00 0.00 56.30 55.65 1uqt h ASN 321 Cb 0.23 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1uqt h ASN 321 CO -0.00 0.85 -0.08 1.23 -1.65 0.00 0.00 177.43 177.78 1uqt h GLY 322 N 1.07 0.30 0.36 2.83 0.00 -0.60 0.11 103.07 107.14 1uqt h GLY 322 Ca 0.23 -0.17 -0.19 0.00 0.00 0.00 0.00 47.33 47.20 1uqt h GLY 322 CO -0.02 0.16 -0.94 1.70 0.00 0.00 0.00 176.54 177.45 1uqt h LYS 323 N 0.27 0.16 0.00 4.80 3.64 -1.02 -3.41 116.57 121.01 1uqt h LYS 323 Ca 0.06 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1uqt h LYS 323 Cb 0.31 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1uqt h LYS 323 CO 0.01 1.13 -0.84 0.66 -2.27 0.00 0.00 179.45 178.14 1uqt n TYR 324 N -4.21 0.00 -1.38 1.91 4.01 -0.40 -5.01 117.16 112.08 1uqt n TYR 324 Ca -0.20 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.23 1uqt n TYR 324 Cb 0.75 -0.02 0.10 0.00 -0.31 0.00 0.00 39.34 39.86 1uqt n TYR 324 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1uqt s GLY 325 N -2.66 1.64 0.27 2.72 0.00 0.37 -4.85 107.32 104.81 1uqt s GLY 325 Ca 0.06 -0.03 0.02 0.00 0.00 0.00 0.00 44.72 44.77 1uqt s GLY 325 CO 0.69 0.39 0.09 1.20 0.00 0.00 0.00 173.10 175.48 1uqt s GLN 326 N -5.02 1.45 0.48 2.90 -0.21 -0.04 -4.98 119.66 114.25 1uqt s GLN 326 Ca 0.61 -1.79 0.15 0.00 0.02 0.00 0.00 55.36 54.35 1uqt s GLN 326 Cb -0.16 -0.35 1.16 0.00 1.00 0.00 0.00 33.01 34.66 1uqt s GLN 326 CO 0.56 -0.28 2.08 -0.07 -2.12 0.00 0.00 175.29 175.45 1uqt h LEU 327 N 2.34 0.17 -3.05 2.90 3.38 -2.01 -2.70 115.31 116.34 1uqt h LEU 327 Ca -0.38 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1uqt h LEU 327 Cb 1.25 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1uqt h LEU 327 CO 0.62 0.12 0.00 0.61 0.09 0.00 0.00 178.44 179.87 1uqt n GLY 328 N -1.54 4.04 3.20 0.83 0.00 -1.26 -4.97 105.19 105.50 1uqt n GLY 328 Ca 0.03 -0.78 -0.08 0.00 0.00 0.00 0.00 46.02 45.18 1uqt n GLY 328 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1uqt s TRP 329 N -2.25 -0.82 -0.33 1.61 -0.00 -1.02 -5.12 118.94 111.01 1uqt s TRP 329 Ca 0.26 1.41 -0.10 0.00 -0.00 0.00 0.00 56.10 57.68 1uqt s TRP 329 Cb 0.22 0.26 0.01 0.00 -0.00 0.00 0.00 33.47 33.95 1uqt s TRP 329 CO 0.05 -0.54 0.16 0.99 -0.00 0.00 0.00 176.95 177.61 1uqt s THR 330 N 2.61 4.50 0.35 5.86 2.01 -1.26 -0.86 115.64 128.85 1uqt s THR 330 Ca 0.01 -0.60 0.09 0.00 0.31 0.00 0.00 61.69 61.50 1uqt s THR 330 Cb -0.13 -3.37 0.12 0.00 0.01 0.00 0.00 72.50 69.13 1uqt s THR 330 CO -0.14 -0.03 1.84 -0.65 -0.69 0.00 0.00 174.62 174.96 1uqt h PRO 331 N 8.36 0.23 -4.49 4.92 0.11 -1.88 -3.44 132.00 135.81 1uqt h PRO 331 Ca -0.30 -0.07 -0.57 0.00 0.11 0.00 0.00 66.00 65.17 1uqt h PRO 331 Cb 1.13 -0.02 -0.36 0.00 0.11 0.00 0.00 31.00 31.86 1uqt h PRO 331 CO 0.63 0.46 -0.82 -1.17 -0.21 0.00 0.00 178.00 176.89 1uqt s LEU 332 N -8.57 1.48 -0.30 2.35 0.20 -1.26 -1.37 118.68 111.21 1uqt s LEU 332 Ca -0.05 -0.40 -0.09 0.00 0.69 0.00 0.00 54.13 54.28 1uqt s LEU 332 Cb 0.15 -1.03 -0.01 0.00 -0.43 0.00 0.00 46.19 44.87 1uqt s LEU 332 CO 0.75 -0.07 0.13 -0.31 -0.29 0.00 0.00 176.35 176.55 1uqt s TYR 333 N 1.52 3.16 -0.18 5.38 1.51 0.13 -4.96 117.35 123.92 1uqt s TYR 333 Ca 0.04 -0.61 -0.02 0.00 -1.01 0.00 0.00 57.07 55.46 1uqt s TYR 333 Cb -0.13 -2.32 -0.01 0.00 -0.11 0.00 0.00 41.96 39.40 1uqt s TYR 333 CO -0.09 -0.46 -0.10 -0.47 -1.11 0.00 0.00 175.55 173.32 1uqt s TYR 334 N 1.59 2.88 -0.17 2.71 5.04 -1.26 -0.75 117.35 127.40 1uqt s TYR 334 Ca 0.05 -0.97 0.00 0.00 -2.44 0.00 0.00 57.07 53.71 1uqt s TYR 334 Cb -0.17 -1.99 0.03 0.00 0.35 0.00 0.00 41.96 40.19 1uqt s TYR 334 CO 0.05 -0.49 -0.10 -0.51 -1.34 0.00 0.00 175.55 173.16 1uqt s LEU 335 N 1.09 1.87 -1.08 6.97 1.43 -0.31 -4.99 118.68 123.67 1uqt s LEU 335 Ca 0.00 -0.67 -0.04 0.00 -1.03 0.00 0.00 54.13 52.39 1uqt s LEU 335 Cb -0.15 -1.12 0.31 0.00 0.03 0.00 0.00 46.19 45.26 1uqt s LEU 335 CO -0.02 -0.12 1.45 -3.20 0.23 0.00 0.00 176.35 174.69 1uqt n ASN 336 N 4.77 6.34 -3.72 2.29 4.05 -1.26 -1.30 115.26 126.42 1uqt n ASN 336 Ca -0.15 -3.39 -0.14 0.00 0.45 0.00 0.00 54.58 51.35 1uqt n ASN 336 Cb 0.48 -1.27 -0.09 0.00 1.23 0.00 0.00 39.78 40.14 1uqt n ASN 336 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 1uqt s GLN 337 N -2.71 0.65 -0.02 1.20 -0.21 -1.26 -4.79 119.66 112.52 1uqt s GLN 337 Ca 0.31 0.14 -0.20 0.00 0.02 0.00 0.00 55.36 55.64 1uqt s GLN 337 Cb 0.04 0.30 -0.05 0.00 1.00 0.00 0.00 33.01 34.30 1uqt s GLN 337 CO 0.09 -0.15 0.57 -1.58 -2.12 0.00 0.00 175.29 172.10 1uqt s HIS 338 N -0.75 3.67 0.07 0.91 5.65 -1.26 -3.79 115.29 119.79 1uqt s HIS 338 Ca -0.08 1.15 0.08 0.00 0.25 0.00 0.00 55.06 56.45 1uqt s HIS 338 Cb -0.04 -2.58 -0.04 0.00 -1.18 0.00 0.00 32.58 28.75 1uqt s HIS 338 CO 0.04 0.36 -0.17 -0.06 -0.65 0.00 0.00 174.74 174.25 1uqt s PHE 339 N -0.17 2.58 0.38 3.88 0.40 -1.26 -5.11 117.98 118.68 1uqt s PHE 339 Ca 0.30 -0.24 -0.27 0.00 -0.60 0.00 0.00 56.93 56.11 1uqt s PHE 339 Cb -0.18 -1.43 -0.10 0.00 0.51 0.00 0.00 43.02 41.83 1uqt s PHE 339 CO 0.16 0.31 1.37 0.34 0.70 0.00 0.00 175.22 178.10 1uqt s ASP 340 N -1.73 6.41 0.32 1.36 -1.08 -1.26 -4.87 116.67 115.83 1uqt s ASP 340 Ca 0.16 2.80 0.07 0.00 -0.52 0.00 0.00 52.55 55.06 1uqt s ASP 340 Cb -0.11 -2.65 0.75 0.00 -1.46 0.00 0.00 42.92 39.46 1uqt s ASP 340 CO 0.08 -0.79 1.82 -0.09 0.52 0.00 0.00 175.17 176.70 1uqt h ARG 341 N 2.94 0.74 -0.28 4.34 2.43 -1.99 -1.36 114.38 121.20 1uqt h ARG 341 Ca -0.50 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 58.58 1uqt h ARG 341 Cb 1.24 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 1uqt h ARG 341 CO 0.64 0.49 0.01 0.87 -1.51 0.00 0.00 179.97 180.47 1uqt h LYS 342 N 0.76 0.49 -0.56 0.20 1.57 -1.96 -1.63 116.57 115.44 1uqt h LYS 342 Ca 0.52 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 59.09 1uqt h LYS 342 Cb 0.80 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.04 1uqt h LYS 342 CO -0.29 0.64 0.11 1.25 -0.57 0.00 0.00 179.45 180.59 1uqt h LEU 343 N 0.29 0.83 -1.00 2.94 5.85 -1.76 -2.84 115.31 119.62 1uqt h LEU 343 Ca 0.08 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 1uqt h LEU 343 Cb 0.41 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 1uqt h LEU 343 CO 0.01 0.83 0.23 -0.07 -0.34 0.00 0.00 178.44 179.10 1uqt h LEU 344 N 0.84 0.88 -0.88 2.25 3.38 -0.92 -0.62 115.31 120.24 1uqt h LEU 344 Ca 0.18 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1uqt h LEU 344 Cb 0.34 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 1uqt h LEU 344 CO 0.00 0.80 0.53 0.24 0.09 0.00 0.00 178.44 180.11 1uqt h MET 345 N 0.93 1.19 -0.54 1.13 2.86 -1.07 -0.00 114.93 119.42 1uqt h MET 345 Ca 0.21 -0.11 -0.05 0.00 -2.06 0.00 0.00 59.70 57.70 1uqt h MET 345 Cb 0.22 -0.25 -0.03 0.00 0.06 0.00 0.00 31.60 31.61 1uqt h MET 345 CO -0.01 0.83 0.14 0.87 1.06 0.00 0.00 176.91 179.80 1uqt h LYS 346 N 1.21 0.83 -0.36 1.72 1.57 -1.11 -2.52 116.57 117.90 1uqt h LYS 346 Ca 0.31 -0.16 -0.09 0.00 -1.87 0.00 0.00 60.65 58.84 1uqt h LYS 346 Cb -0.05 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 1uqt h LYS 346 CO -0.06 0.74 -0.11 0.82 -0.57 0.00 0.00 179.45 180.27 1uqt h ILE 347 N 0.80 1.28 -0.62 1.86 2.04 -0.05 -2.11 117.51 120.72 1uqt h ILE 347 Ca 0.18 -1.20 0.12 0.00 1.00 0.00 0.00 64.86 64.96 1uqt h ILE 347 Cb 0.28 1.30 -0.09 0.00 -0.74 0.00 0.00 36.82 37.57 1uqt h ILE 347 CO -0.00 0.39 0.12 -0.26 0.00 0.00 0.00 178.15 178.40 1uqt h PHE 348 N 0.51 0.19 -0.49 1.37 0.04 -0.95 -0.26 116.94 117.34 1uqt h PHE 348 Ca 0.09 0.04 -0.06 0.00 2.80 0.00 0.00 57.97 60.84 1uqt h PHE 348 Cb 0.63 0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.77 1uqt h PHE 348 CO 0.05 -0.05 0.09 -0.09 -0.60 0.00 0.00 178.31 177.72 1uqt h ARG 349 N 0.25 0.81 0.00 1.51 2.43 -1.03 -2.96 114.38 115.38 1uqt h ARG 349 Ca 0.33 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 1uqt h ARG 349 Cb 0.50 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1uqt h ARG 349 CO -0.42 0.80 -0.06 0.10 -1.51 0.00 0.00 179.97 178.87 1uqt h TYR 350 N 0.68 0.00 -4.20 2.20 -0.00 -1.11 -3.43 116.97 111.10 1uqt h TYR 350 Ca 0.15 0.00 -0.51 0.00 0.00 0.00 0.00 58.73 58.37 1uqt h TYR 350 Cb 0.37 0.00 0.12 0.00 0.00 0.00 0.00 36.73 37.22 1uqt h TYR 350 CO 0.03 0.06 0.37 -1.54 -0.00 0.00 0.00 178.16 177.08 1uqt s SER 351 N -6.24 4.82 -0.07 0.10 1.04 -0.13 -4.89 113.70 108.33 1uqt s SER 351 Ca 0.07 2.06 0.20 0.00 0.48 0.00 0.00 55.95 58.76 1uqt s SER 351 Cb 0.05 -2.56 -0.27 0.00 0.10 0.00 0.00 66.02 63.34 1uqt s SER 351 CO 0.68 -1.83 0.39 0.47 0.98 0.00 0.00 173.24 173.93 1uqt n ASP 352 N -2.60 0.13 -3.78 7.02 8.00 0.04 -4.45 116.55 120.90 1uqt n ASP 352 Ca 0.11 0.05 -0.13 0.00 0.71 0.00 0.00 54.79 55.54 1uqt n ASP 352 Cb 0.52 1.37 -0.13 0.00 -0.02 0.00 0.00 41.12 42.86 1uqt n ASP 352 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1uqt s VAL 353 N -3.07 -0.02 -0.23 2.53 1.01 -0.80 -1.79 120.40 118.03 1uqt s VAL 353 Ca -0.08 0.07 -0.06 0.00 0.00 0.00 0.00 61.98 61.91 1uqt s VAL 353 Cb 0.10 -0.26 -0.02 0.00 0.00 0.00 0.00 36.38 36.20 1uqt s VAL 353 CO 0.87 0.03 0.02 -0.83 0.00 0.00 0.00 175.10 175.19 1uqt s GLY 354 N 0.55 1.71 -0.42 4.51 0.00 0.86 -0.75 107.32 113.77 1uqt s GLY 354 Ca -0.04 -1.12 -0.07 0.00 0.00 0.00 0.00 44.72 43.49 1uqt s GLY 354 CO -0.03 0.45 0.26 -2.27 0.00 0.00 0.00 173.10 171.51 1uqt s LEU 355 N 1.47 5.26 -0.52 0.66 0.20 -0.01 -0.90 118.68 124.84 1uqt s LEU 355 Ca 0.05 -1.72 0.04 0.00 0.69 0.00 0.00 54.13 53.19 1uqt s LEU 355 Cb -0.15 -1.95 0.14 0.00 -0.43 0.00 0.00 46.19 43.81 1uqt s LEU 355 CO 0.01 -0.57 0.29 -0.69 -0.29 0.00 0.00 176.35 175.10 1uqt s VAL 356 N 1.34 2.20 -0.50 1.68 1.01 -0.26 -4.48 120.40 121.38 1uqt s VAL 356 Ca 0.04 -3.21 0.08 0.00 0.00 0.00 0.00 61.98 58.89 1uqt s VAL 356 Cb -0.24 -2.52 0.34 0.00 0.00 0.00 0.00 36.38 33.96 1uqt s VAL 356 CO -0.00 -0.87 0.85 0.35 0.00 0.00 0.00 175.10 175.42 1uqt n THR 357 N 3.06 1.76 -1.25 3.92 -2.24 -1.26 -1.42 114.28 116.84 1uqt n THR 357 Ca 0.09 -5.16 -0.33 0.00 -2.27 0.00 0.00 64.05 56.38 1uqt n THR 357 Cb 0.34 -1.03 0.11 0.00 -2.10 0.00 0.00 70.33 67.64 1uqt n THR 357 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1uqt s PRO 358 N -2.98 1.91 0.14 -0.78 0.04 -1.24 -4.60 135.00 127.49 1uqt s PRO 358 Ca 0.45 1.62 0.06 0.00 0.04 0.00 0.00 61.00 63.17 1uqt s PRO 358 Cb 0.30 -1.82 -0.11 0.00 0.04 0.00 0.00 34.50 32.91 1uqt s PRO 358 CO -0.11 -1.98 1.33 -0.07 0.04 0.00 0.00 177.00 176.21 1uqt h LEU 359 N -0.76 0.06 -7.00 -3.56 4.07 -0.86 -3.42 115.31 103.84 1uqt h LEU 359 Ca -0.46 -0.06 0.01 0.00 0.08 0.00 0.00 57.88 57.46 1uqt h LEU 359 Cb 1.28 -0.02 -0.21 0.00 1.08 0.00 0.00 40.66 42.79 1uqt h LEU 359 CO 0.48 0.97 0.02 -0.60 -1.08 0.00 0.00 178.44 178.23 1uqt s ARG 360 N -2.89 0.71 -0.17 1.13 6.06 -1.06 -4.77 118.95 117.96 1uqt s ARG 360 Ca -0.00 1.20 -0.08 0.00 -2.50 0.00 0.00 55.73 54.35 1uqt s ARG 360 Cb 0.10 0.16 0.06 0.00 0.06 0.00 0.00 34.95 35.34 1uqt s ARG 360 CO 0.82 -0.15 0.39 0.34 -2.50 0.00 0.00 175.30 174.21 1uqt s ASP 361 N 1.53 -0.40 0.25 -2.12 -1.08 -0.97 -4.67 116.67 109.21 1uqt s ASP 361 Ca -0.09 0.88 -0.09 0.00 -0.52 0.00 0.00 52.55 52.72 1uqt s ASP 361 Cb -0.05 0.86 0.39 0.00 -1.46 0.00 0.00 42.92 42.66 1uqt s ASP 361 CO -0.18 -0.20 1.60 1.23 0.52 0.00 0.00 175.17 178.14 1uqt h GLY 362 N 7.40 0.67 0.00 2.66 0.00 -1.87 -0.57 103.07 111.36 1uqt h GLY 362 Ca -0.32 0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.24 1uqt h GLY 362 CO 0.26 -0.32 0.00 -0.13 0.00 0.00 0.00 176.54 176.35 1uqt n MET 363 N -5.49 0.00 -1.57 4.80 0.00 -1.26 -3.70 117.12 109.89 1uqt n MET 363 Ca 0.13 0.00 -0.00 0.00 -0.00 0.00 0.00 57.70 57.83 1uqt n MET 363 Cb 0.44 0.00 -0.00 0.00 0.00 0.00 0.00 33.22 33.66 1uqt n MET 363 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 1uqt n ASN 364 N -3.37 -2.21 0.18 6.12 2.85 -1.26 -1.20 115.26 116.37 1uqt n ASN 364 Ca 0.00 0.09 0.03 0.00 -0.11 0.00 0.00 54.58 54.59 1uqt n ASN 364 Cb 0.00 -1.27 0.34 0.00 1.24 0.00 0.00 39.78 40.09 1uqt n ASN 364 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1uqt h LEU 365 N 0.22 0.00 -0.95 1.20 3.38 -1.98 -3.13 115.31 114.05 1uqt h LEU 365 Ca -0.01 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.05 1uqt h LEU 365 Cb 0.03 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.71 1uqt h LEU 365 CO 0.00 0.41 0.59 0.58 0.09 0.00 0.00 178.44 180.12 1uqt h VAL 366 N 0.00 0.99 -0.72 1.22 2.07 -1.94 0.31 116.25 118.18 1uqt h VAL 366 Ca -0.00 -0.35 0.05 0.00 0.82 0.00 0.00 66.70 67.22 1uqt h VAL 366 Cb 0.78 -0.11 -0.05 0.00 -1.52 0.00 0.00 31.29 30.39 1uqt h VAL 366 CO 0.05 0.18 0.43 0.00 0.02 0.00 0.00 177.57 178.25 1uqt h ALA 367 N 1.48 0.96 -0.08 1.67 0.00 -1.91 0.30 119.26 121.67 1uqt h ALA 367 Ca 0.44 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 55.12 1uqt h ALA 367 Cb 0.32 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.94 1uqt h ALA 367 CO -0.22 0.15 -0.85 0.87 0.00 0.00 0.00 179.25 179.20 1uqt h LYS 368 N 0.80 0.64 -0.67 0.00 1.57 -1.31 -3.00 116.57 114.61 1uqt h LYS 368 Ca 0.31 -0.58 -0.03 0.00 -1.87 0.00 0.00 60.65 58.49 1uqt h LYS 368 Cb 0.13 0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 1uqt h LYS 368 CO -0.16 1.19 0.32 0.93 -0.57 0.00 0.00 179.45 181.16 1uqt h GLU 369 N 0.41 0.96 -0.32 3.15 5.08 0.08 -1.33 114.58 122.62 1uqt h GLU 369 Ca -0.07 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.16 1uqt h GLU 369 Cb 1.48 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.53 1uqt h GLU 369 CO 0.16 0.77 0.19 -0.92 -1.00 0.00 0.00 179.01 178.21 1uqt h TYR 370 N 0.93 0.37 -0.27 4.33 5.03 -0.42 -1.32 116.97 125.62 1uqt h TYR 370 Ca 0.23 0.01 -0.14 0.00 2.58 0.00 0.00 58.73 61.41 1uqt h TYR 370 Cb 0.12 -0.12 -0.01 0.00 1.55 0.00 0.00 36.73 38.27 1uqt h TYR 370 CO 0.00 0.22 -0.42 -0.39 -1.32 0.00 0.00 178.16 176.26 1uqt h VAL 371 N 0.40 1.29 -0.24 1.81 -1.51 -1.33 -2.95 116.25 113.72 1uqt h VAL 371 Ca 0.12 -1.59 -0.03 0.00 -1.23 0.00 0.00 66.70 63.97 1uqt h VAL 371 Cb -0.02 1.53 -0.01 0.00 -2.13 0.00 0.00 31.29 30.66 1uqt h VAL 371 CO -0.04 0.51 0.02 0.00 -1.23 0.00 0.00 177.57 176.82 1uqt h ALA 372 N 1.00 1.58 0.00 5.19 0.00 -0.81 -2.76 119.26 123.46 1uqt h ALA 372 Ca 0.04 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1uqt h ALA 372 Cb 0.95 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1uqt h ALA 372 CO 0.09 0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.65 1uqt h ALA 373 N 1.68 1.00 -2.80 0.00 0.00 -1.08 -3.36 119.26 114.70 1uqt h ALA 373 Ca 0.08 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.47 1uqt h ALA 373 Cb 0.21 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.07 1uqt h ALA 373 CO 0.00 0.00 0.54 -0.65 0.00 0.00 0.00 179.25 179.15 1uqt s GLN 374 N -3.12 3.80 -0.19 0.00 -1.52 -1.04 -4.28 119.66 113.30 1uqt s GLN 374 Ca 0.10 1.96 -0.29 0.00 -1.95 0.00 0.00 55.36 55.19 1uqt s GLN 374 Cb 0.11 -2.55 -0.05 0.00 -0.22 0.00 0.00 33.01 30.31 1uqt s GLN 374 CO 0.61 -0.57 1.96 0.34 -0.25 0.00 0.00 175.29 177.37 1uqt s ASP 375 N -1.07 5.93 0.60 5.90 -1.08 -1.26 -4.89 116.67 120.80 1uqt s ASP 375 Ca 0.61 1.88 0.39 0.00 -0.52 0.00 0.00 52.55 54.91 1uqt s ASP 375 Cb -0.33 -2.52 1.88 0.00 -1.46 0.00 0.00 42.92 40.48 1uqt s ASP 375 CO 0.41 -1.58 2.17 1.55 0.52 0.00 0.00 175.17 178.25 1uqt h PRO 376 N 12.83 0.00 0.00 4.34 0.13 -1.94 -0.88 132.00 146.48 1uqt h PRO 376 Ca -0.40 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.73 1uqt h PRO 376 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1uqt h PRO 376 CO 0.98 0.01 -0.04 0.00 -0.23 0.00 0.00 178.00 178.72 1uqt h ALA 377 N 1.99 0.98 -0.99 -0.56 0.00 -2.00 -3.40 119.26 115.29 1uqt h ALA 377 Ca -0.00 -0.03 -0.38 0.00 0.00 0.00 0.00 54.91 54.50 1uqt h ALA 377 Cb 0.26 -0.01 -0.27 0.00 0.00 0.00 0.00 17.79 17.78 1uqt h ALA 377 CO 0.00 0.05 -0.80 -1.71 0.00 0.00 0.00 179.25 176.78 1uqt n ASN 378 N -3.12 -1.17 -4.85 0.00 5.15 -0.47 -5.03 115.26 105.79 1uqt n ASN 378 Ca 0.03 -3.14 -0.33 0.00 -0.60 0.00 0.00 54.58 50.54 1uqt n ASN 378 Cb 0.47 0.64 -0.06 0.00 -0.53 0.00 0.00 39.78 40.30 1uqt n ASN 378 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1uqt s PRO 379 N -0.54 4.03 1.04 1.20 0.04 -0.46 -4.52 135.00 135.79 1uqt s PRO 379 Ca 0.33 0.70 -0.16 0.00 0.04 0.00 0.00 61.00 61.90 1uqt s PRO 379 Cb 0.24 -2.45 0.22 0.00 0.04 0.00 0.00 34.50 32.55 1uqt s PRO 379 CO -0.14 0.16 1.17 0.20 0.04 0.00 0.00 177.00 178.44 1uqt s GLY 380 N -2.23 1.63 -0.09 0.56 0.00 -1.26 -4.82 107.32 101.11 1uqt s GLY 380 Ca 0.54 -0.86 0.02 0.00 0.00 0.00 0.00 44.72 44.41 1uqt s GLY 380 CO 0.17 -0.12 -0.13 0.14 0.00 0.00 0.00 173.10 173.17 1uqt s VAL 381 N -3.32 3.12 -0.27 1.40 1.01 -0.74 -4.86 120.40 116.74 1uqt s VAL 381 Ca 0.69 -0.67 -0.16 0.00 0.00 0.00 0.00 61.98 61.84 1uqt s VAL 381 Cb -0.10 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 1uqt s VAL 381 CO 0.54 0.56 0.42 -0.22 0.00 0.00 0.00 175.10 176.41 1uqt s LEU 382 N -0.26 4.05 -0.30 3.92 2.96 -1.26 -0.10 118.68 127.69 1uqt s LEU 382 Ca 0.02 0.35 -0.13 0.00 -0.22 0.00 0.00 54.13 54.15 1uqt s LEU 382 Cb -0.13 -2.50 -0.04 0.00 0.50 0.00 0.00 46.19 44.02 1uqt s LEU 382 CO 0.03 -0.23 0.25 -0.69 -1.32 0.00 0.00 176.35 174.40 1uqt s VAL 383 N 2.15 5.26 -0.01 1.68 1.01 -0.08 -0.80 120.40 129.62 1uqt s VAL 383 Ca 0.17 0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.32 1uqt s VAL 383 Cb -0.16 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 1uqt s VAL 383 CO 0.10 0.13 -0.12 -0.22 0.00 0.00 0.00 175.10 174.98 1uqt s LEU 384 N 1.84 2.03 0.28 3.92 2.96 -0.05 -1.10 118.68 128.55 1uqt s LEU 384 Ca 0.09 -0.23 -0.29 0.00 -0.22 0.00 0.00 54.13 53.47 1uqt s LEU 384 Cb -0.16 -0.63 -0.09 0.00 0.50 0.00 0.00 46.19 45.80 1uqt s LEU 384 CO 0.11 0.15 1.06 -0.55 -1.32 0.00 0.00 176.35 175.80 1uqt s SER 385 N -0.32 7.31 0.31 3.68 0.15 -0.51 -0.85 113.70 123.46 1uqt s SER 385 Ca 0.05 2.19 0.24 0.00 0.70 0.00 0.00 55.95 59.13 1uqt s SER 385 Cb -0.05 -2.62 1.09 0.00 -1.71 0.00 0.00 66.02 62.73 1uqt s SER 385 CO -0.00 -0.11 1.74 0.06 1.20 0.00 0.00 173.24 176.13 1uqt h GLN 386 N 3.79 0.00 -0.11 5.44 3.07 -1.62 -2.18 115.11 123.50 1uqt h GLN 386 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.28 1uqt h GLN 386 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.77 1uqt h GLN 386 CO 0.67 0.00 0.00 1.19 0.09 0.00 0.00 178.83 180.78 1uqt n PHE 387 N -2.33 0.13 -3.09 0.06 3.72 -1.26 -4.83 117.46 109.86 1uqt n PHE 387 Ca 0.01 -0.07 -0.39 0.00 -0.05 0.00 0.00 57.45 56.95 1uqt n PHE 387 Cb 0.19 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.68 1uqt n PHE 387 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1uqt s ALA 388 N -1.87 3.45 0.59 4.37 0.00 -0.82 -2.28 121.76 125.19 1uqt s ALA 388 Ca 0.35 0.18 0.33 0.00 0.00 0.00 0.00 51.96 52.82 1uqt s ALA 388 Cb 0.19 -2.86 1.94 0.00 0.00 0.00 0.00 23.12 22.38 1uqt s ALA 388 CO 0.29 0.17 2.27 0.78 0.00 0.00 0.00 175.76 179.28 1uqt h GLY 389 N 5.30 0.00 2.00 0.00 0.00 -1.03 -0.72 103.07 108.63 1uqt h GLY 389 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1uqt h GLY 389 CO 0.69 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.23 1uqt h ALA 390 N 1.99 1.00 0.00 3.60 0.00 -1.41 -2.85 119.26 121.59 1uqt h ALA 390 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1uqt h ALA 390 Cb 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1uqt h ALA 390 CO 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 179.25 179.21 1uqt h ALA 391 N 2.00 1.07 0.00 0.00 0.00 -1.37 0.27 119.26 121.23 1uqt h ALA 391 Ca 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1uqt h ALA 391 Cb 0.32 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1uqt h ALA 391 CO 0.00 0.05 -0.33 -0.91 0.00 0.00 0.00 179.25 178.06 1uqt h ASN 392 N 0.00 0.00 0.00 0.00 2.35 -1.69 -3.29 115.58 112.95 1uqt h ASN 392 Ca -0.00 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.48 1uqt h ASN 392 Cb 0.33 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.65 1uqt h ASN 392 CO 0.01 0.33 -2.05 -1.84 -1.65 0.00 0.00 177.43 172.23 1uqt n GLU 393 N -4.01 1.42 -2.43 0.81 0.28 -0.81 -4.72 120.64 111.18 1uqt n GLU 393 Ca -0.02 -0.01 -0.42 0.00 -0.16 0.00 0.00 57.16 56.55 1uqt n GLU 393 Cb 0.39 -1.40 0.01 0.00 1.43 0.00 0.00 31.44 31.86 1uqt n GLU 393 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1uqt n LEU 394 N -2.55 7.07 0.18 -1.84 4.77 0.02 -4.66 117.00 119.99 1uqt n LEU 394 Ca -0.24 -4.93 0.06 0.00 -0.03 0.00 0.00 56.01 50.87 1uqt n LEU 394 Cb 0.98 -1.36 0.27 0.00 -2.33 0.00 0.00 43.42 40.98 1uqt n LEU 394 CO 0.33 1.71 0.66 0.74 -1.33 0.00 0.00 177.39 179.50 1uqt h THR 395 N 3.18 0.74 -0.17 -5.08 2.02 -1.85 -2.66 112.91 109.09 1uqt h THR 395 Ca 0.45 -1.60 0.00 0.00 0.77 0.00 0.00 66.41 66.03 1uqt h THR 395 Cb 0.50 2.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.94 1uqt h THR 395 CO 1.47 0.35 0.00 -1.20 0.37 0.00 0.00 175.52 176.51 1uqt n SER 396 N -3.37 1.48 -4.76 4.18 7.64 -1.26 -4.85 113.62 112.67 1uqt n SER 396 Ca 0.01 -1.72 -0.30 0.00 1.01 0.00 0.00 58.87 57.86 1uqt n SER 396 Cb 0.55 -0.11 0.10 0.00 -1.01 0.00 0.00 64.21 63.75 1uqt n SER 396 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1uqt s ALA 397 N -1.78 2.08 -0.66 -0.43 0.00 -1.01 -4.82 121.76 115.14 1uqt s ALA 397 Ca 0.30 0.08 -0.27 0.00 0.00 0.00 0.00 51.96 52.07 1uqt s ALA 397 Cb 0.16 -3.21 0.03 0.00 0.00 0.00 0.00 23.12 20.10 1uqt s ALA 397 CO 0.24 -1.88 1.20 -0.51 0.00 0.00 0.00 175.76 174.81 1uqt s LEU 398 N -5.95 3.43 0.00 0.00 1.02 0.02 -4.92 118.68 112.28 1uqt s LEU 398 Ca 0.61 -0.29 -0.25 0.00 0.02 0.00 0.00 54.13 54.22 1uqt s LEU 398 Cb -0.17 -2.78 -0.05 0.00 0.02 0.00 0.00 46.19 43.22 1uqt s LEU 398 CO 0.56 -1.64 0.77 -0.63 0.02 0.00 0.00 176.35 175.43 1uqt s ILE 399 N 5.19 4.86 0.07 -0.59 -1.09 -1.26 -0.87 121.20 127.51 1uqt s ILE 399 Ca 0.36 1.61 0.00 0.00 -2.23 0.00 0.00 60.65 60.40 1uqt s ILE 399 Cb -0.09 -4.11 -0.04 0.00 -1.58 0.00 0.00 42.46 36.64 1uqt s ILE 399 CO 0.19 0.30 -0.05 0.68 -1.23 0.00 0.00 174.94 174.83 1uqt s VAL 400 N 0.36 0.43 -0.41 2.92 -7.23 -0.03 -4.93 120.40 111.51 1uqt s VAL 400 Ca 0.40 -1.81 -0.15 0.00 -1.81 0.00 0.00 61.98 58.60 1uqt s VAL 400 Cb -0.20 -1.52 0.02 0.00 0.56 0.00 0.00 36.38 35.25 1uqt s VAL 400 CO 0.22 -0.91 0.31 0.21 -0.31 0.00 0.00 175.10 174.62 1uqt s ASN 401 N -2.88 6.12 0.42 4.85 3.04 -1.26 -1.57 114.94 123.65 1uqt s ASN 401 Ca 0.08 -0.91 0.29 0.00 0.04 0.00 0.00 52.86 52.36 1uqt s ASN 401 Cb 0.06 -2.17 1.42 0.00 -1.54 0.00 0.00 41.25 39.02 1uqt s ASN 401 CO -0.07 -0.47 1.88 1.55 -3.04 0.00 0.00 177.10 176.95 1uqt h PRO 402 N 8.64 0.00 0.00 0.43 0.13 -1.90 -0.02 132.00 139.28 1uqt h PRO 402 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1uqt h PRO 402 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1uqt h PRO 402 CO 0.74 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.17 1uqt n TYR 403 N -2.57 0.00 -3.78 1.56 4.02 -1.26 -4.14 117.16 110.99 1uqt n TYR 403 Ca -0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.55 1uqt n TYR 403 Cb 0.15 -0.46 -0.10 0.00 -0.02 0.00 0.00 39.34 38.90 1uqt n TYR 403 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1uqt s ASP 404 N -2.93 5.17 0.43 7.72 3.68 -0.02 -4.97 116.67 125.76 1uqt s ASP 404 Ca 0.09 -3.30 0.10 0.00 2.13 0.00 0.00 52.55 51.57 1uqt s ASP 404 Cb 0.10 -1.79 0.96 0.00 -1.45 0.00 0.00 42.92 40.75 1uqt s ASP 404 CO 0.28 -0.24 2.04 0.08 0.13 0.00 0.00 175.17 177.46 1uqt h ARG 405 N 6.35 0.43 -0.12 4.34 0.11 -1.79 -1.21 114.38 122.49 1uqt h ARG 405 Ca 0.05 -0.03 -0.12 0.00 0.10 0.00 0.00 59.98 59.99 1uqt h ARG 405 Cb 0.87 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 31.84 1uqt h ARG 405 CO 0.74 0.29 -0.44 -0.44 0.10 0.00 0.00 179.97 180.22 1uqt h ASP 406 N 0.45 0.29 -0.42 0.08 3.45 -1.93 0.01 116.42 118.34 1uqt h ASP 406 Ca 0.18 -0.13 -0.12 0.00 0.43 0.00 0.00 57.03 57.39 1uqt h ASP 406 Cb 0.17 -0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 38.84 1uqt h ASP 406 CO -0.04 0.70 -0.21 -0.08 -1.57 0.00 0.00 179.24 178.03 1uqt h GLU 407 N 0.23 0.89 -0.57 3.56 4.81 -1.58 -0.38 114.58 121.53 1uqt h GLU 407 Ca 0.02 -0.39 -0.01 0.00 -0.13 0.00 0.00 59.36 58.85 1uqt h GLU 407 Cb 0.87 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.20 1uqt h GLU 407 CO 0.07 1.04 0.30 0.28 -0.73 0.00 0.00 179.01 179.97 1uqt h VAL 408 N 0.71 1.19 -0.79 0.32 2.07 -1.07 -1.36 116.25 117.33 1uqt h VAL 408 Ca 0.09 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 1uqt h VAL 408 Cb 0.77 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 1uqt h VAL 408 CO 0.06 0.21 0.47 0.00 0.02 0.00 0.00 177.57 178.33 1uqt h ALA 409 N 1.13 1.00 -0.24 1.67 0.00 -0.78 -1.19 119.26 120.85 1uqt h ALA 409 Ca 0.20 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 1uqt h ALA 409 Cb 0.06 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1uqt h ALA 409 CO -0.03 0.48 -0.15 0.00 0.00 0.00 0.00 179.25 179.55 1uqt h ALA 410 N 1.25 1.30 -0.54 0.00 0.00 -0.61 -0.40 119.26 120.26 1uqt h ALA 410 Ca 0.28 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1uqt h ALA 410 Cb -0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1uqt h ALA 410 CO -0.05 0.47 -0.01 0.00 0.00 0.00 0.00 179.25 179.65 1uqt h ALA 411 N 1.47 0.73 -0.45 0.00 0.00 -0.66 -1.34 119.26 119.01 1uqt h ALA 411 Ca 0.07 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 1uqt h ALA 411 Cb 0.49 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1uqt h ALA 411 CO 0.03 0.56 0.12 -0.07 0.00 0.00 0.00 179.25 179.89 1uqt h LEU 412 N 0.84 0.67 -0.48 0.00 3.38 -0.56 0.31 115.31 119.47 1uqt h LEU 412 Ca 0.15 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.92 1uqt h LEU 412 Cb 0.55 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1uqt h LEU 412 CO 0.03 0.72 0.29 -0.78 0.09 0.00 0.00 178.44 178.79 1uqt h ASP 413 N 0.60 0.47 -0.58 -0.43 3.58 -0.98 -0.87 116.42 118.21 1uqt h ASP 413 Ca 0.14 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.58 1uqt h ASP 413 Cb 0.30 -0.10 -0.03 0.00 1.72 0.00 0.00 39.33 41.22 1uqt h ASP 413 CO -0.00 0.34 0.32 -0.09 -2.88 0.00 0.00 179.24 176.92 1uqt h ARG 414 N 0.58 0.81 -0.50 0.28 2.43 -0.95 -2.66 114.38 114.37 1uqt h ARG 414 Ca 0.19 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1uqt h ARG 414 Cb 0.01 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 1uqt h ARG 414 CO -0.08 0.62 0.31 0.00 -1.51 0.00 0.00 179.97 179.31 1uqt h ALA 415 N 1.14 0.64 0.00 2.80 0.00 -0.62 -2.14 119.26 121.09 1uqt h ALA 415 Ca 0.20 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1uqt h ALA 415 Cb 0.05 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1uqt h ALA 415 CO -0.03 0.11 0.00 -0.07 0.00 0.00 0.00 179.25 179.26 1uqt h LEU 416 N 0.67 0.00 -2.93 0.00 3.38 -0.88 -2.94 115.31 112.62 1uqt h LEU 416 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1uqt h LEU 416 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1uqt h LEU 416 CO -0.04 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.84 1uqt n THR 417 N -2.68 0.97 -2.50 0.22 -2.24 -1.03 -5.04 114.28 101.98 1uqt n THR 417 Ca -0.01 -0.98 -0.42 0.00 -2.27 0.00 0.00 64.05 60.37 1uqt n THR 417 Cb 0.12 0.52 -0.03 0.00 -2.10 0.00 0.00 70.33 68.84 1uqt n THR 417 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1uqt s MET 418 N -0.97 4.47 0.63 -0.78 0.00 -0.83 -4.99 119.30 116.84 1uqt s MET 418 Ca 0.01 1.68 -0.18 0.00 0.00 0.00 0.00 55.69 57.20 1uqt s MET 418 Cb 0.01 -3.37 -0.03 0.00 0.00 0.00 0.00 34.83 31.44 1uqt s MET 418 CO 0.01 -0.18 1.14 -1.13 0.00 0.00 0.00 175.02 174.86 1uqt n SER 419 N 3.83 1.48 -0.18 1.11 3.41 -1.26 -4.80 113.62 117.20 1uqt n SER 419 Ca 0.08 0.82 -0.02 0.00 -0.26 0.00 0.00 58.87 59.49 1uqt n SER 419 Cb 0.48 -1.48 0.05 0.00 -0.26 0.00 0.00 64.21 62.99 1uqt n SER 419 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1uqt h LEU 420 N 0.51 -0.52 -0.41 1.04 5.85 -1.98 -1.75 115.31 118.06 1uqt h LEU 420 Ca -0.50 0.17 0.09 0.00 0.84 0.00 0.00 57.88 58.48 1uqt h LEU 420 Cb 1.35 0.35 -0.09 0.00 0.37 0.00 0.00 40.66 42.64 1uqt h LEU 420 CO 0.52 -0.19 -0.22 0.00 -0.34 0.00 0.00 178.44 178.21 1uqt h ALA 421 N 1.56 0.05 -0.63 1.25 0.00 -1.99 -0.70 119.26 118.80 1uqt h ALA 421 Ca 0.27 0.14 -0.08 0.00 0.00 0.00 0.00 54.91 55.24 1uqt h ALA 421 Cb 0.41 0.53 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1uqt h ALA 421 CO -0.58 -0.59 0.10 1.49 0.00 0.00 0.00 179.25 179.67 1uqt h GLU 422 N -0.15 1.05 -0.91 0.00 4.81 -1.85 -1.83 114.58 115.69 1uqt h GLU 422 Ca 0.20 -0.28 0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1uqt h GLU 422 Cb 0.46 -0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.66 1uqt h GLU 422 CO -0.50 0.98 0.60 0.00 -0.73 0.00 0.00 179.01 179.36 1uqt h ARG 423 N 0.96 1.09 0.03 1.92 3.08 -0.87 -1.34 114.38 119.25 1uqt h ARG 423 Ca 0.19 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 1uqt h ARG 423 Cb 0.44 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1uqt h ARG 423 CO 0.01 0.72 -0.01 0.82 -1.07 0.00 0.00 179.97 180.44 1uqt h ILE 424 N 1.12 1.22 -0.46 2.04 1.08 -0.93 -1.44 117.51 120.13 1uqt h ILE 424 Ca 0.37 -0.79 0.07 0.00 -0.39 0.00 0.00 64.86 64.13 1uqt h ILE 424 Cb 0.06 1.74 -0.06 0.00 -3.07 0.00 0.00 36.82 35.49 1uqt h ILE 424 CO -0.12 0.20 0.10 -1.28 -0.69 0.00 0.00 178.15 176.36 1uqt h SER 425 N -0.38 0.02 -0.08 1.72 0.87 -1.13 0.78 113.55 115.35 1uqt h SER 425 Ca -0.00 0.08 -0.04 0.00 -1.23 0.00 0.00 61.79 60.59 1uqt h SER 425 Cb 0.36 0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.42 1uqt h SER 425 CO 0.01 0.05 -0.10 0.03 -0.53 0.00 0.00 176.83 176.28 1uqt h ARG 426 N 0.24 0.21 -0.11 2.24 3.08 -1.27 -2.44 114.38 116.33 1uqt h ARG 426 Ca 0.23 -0.12 0.02 0.00 0.07 0.00 0.00 59.98 60.17 1uqt h ARG 426 Cb 0.28 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1uqt h ARG 426 CO -0.29 0.67 0.01 1.25 -1.07 0.00 0.00 179.97 180.55 1uqt h HIS 427 N -0.23 0.02 -0.22 3.04 2.76 -1.12 -2.39 115.15 117.02 1uqt h HIS 427 Ca 0.01 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.16 1uqt h HIS 427 Cb 0.64 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.59 1uqt h HIS 427 CO 0.10 0.01 -0.00 0.00 -1.30 0.00 0.00 177.93 176.73 1uqt h ALA 428 N 1.09 1.60 -0.15 5.26 0.00 -0.87 0.43 119.26 126.61 1uqt h ALA 428 Ca 0.05 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1uqt h ALA 428 Cb 0.05 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1uqt h ALA 428 CO -0.07 0.30 -0.03 1.49 0.00 0.00 0.00 179.25 180.93 1uqt h GLU 429 N 0.31 0.30 -0.42 0.00 4.81 -1.19 -2.00 114.58 116.39 1uqt h GLU 429 Ca 0.07 -0.11 -0.09 0.00 -0.13 0.00 0.00 59.36 59.10 1uqt h GLU 429 Cb 0.22 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 1uqt h GLU 429 CO 0.00 0.57 -0.10 0.52 -0.73 0.00 0.00 179.01 179.27 1uqt h MET 430 N -0.00 0.74 -0.57 1.92 2.86 -1.09 -2.86 114.93 115.93 1uqt h MET 430 Ca 0.04 -0.24 -0.09 0.00 -2.06 0.00 0.00 59.70 57.35 1uqt h MET 430 Cb 0.46 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.03 1uqt h MET 430 CO 0.01 0.82 0.01 1.25 1.06 0.00 0.00 176.91 180.06 1uqt h LEU 431 N 0.67 0.98 -0.74 1.22 5.85 -0.88 -1.11 115.31 121.29 1uqt h LEU 431 Ca 0.12 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 1uqt h LEU 431 Cb 0.57 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 1uqt h LEU 431 CO 0.04 1.05 0.42 -0.78 -0.34 0.00 0.00 178.44 178.82 1uqt h ASP 432 N 0.89 0.92 -0.60 1.25 -0.00 -1.32 -0.68 116.42 116.88 1uqt h ASP 432 Ca 0.16 -0.09 -0.07 0.00 -0.00 0.00 0.00 57.03 57.03 1uqt h ASP 432 Cb 0.54 -0.23 -0.02 0.00 -0.00 0.00 0.00 39.33 39.61 1uqt h ASP 432 CO 0.03 0.74 0.10 0.58 -0.00 0.00 0.00 179.24 180.68 1uqt h VAL 433 N 1.02 1.26 0.00 2.25 2.07 -1.19 -1.97 116.25 119.69 1uqt h VAL 433 Ca 0.26 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.77 1uqt h VAL 433 Cb 0.01 0.74 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1uqt h VAL 433 CO -0.04 0.37 -0.08 0.16 0.02 0.00 0.00 177.57 178.00 1uqt h ILE 434 N 0.90 0.15 -0.03 4.57 3.07 -0.98 -2.29 117.51 122.90 1uqt h ILE 434 Ca 0.18 -1.06 -0.26 0.00 1.55 0.00 0.00 64.86 65.27 1uqt h ILE 434 Cb 0.43 1.94 0.02 0.00 -0.27 0.00 0.00 36.82 38.94 1uqt h ILE 434 CO 0.01 0.08 -0.99 0.58 -1.05 0.00 0.00 178.15 176.78 1uqt h VAL 435 N 0.00 1.28 0.03 0.16 2.07 -1.00 -3.09 116.25 115.70 1uqt h VAL 435 Ca -0.00 -2.19 -0.22 0.00 0.82 0.00 0.00 66.70 65.11 1uqt h VAL 435 Cb 0.93 2.31 -0.01 0.00 -1.52 0.00 0.00 31.29 33.00 1uqt h VAL 435 CO 0.01 0.68 -0.97 0.11 0.02 0.00 0.00 177.57 177.43 1uqt h LYS 436 N 0.42 0.24 -2.43 1.57 1.57 -1.29 -3.28 116.57 113.37 1uqt h LYS 436 Ca -0.12 -0.29 -0.69 0.00 -1.87 0.00 0.00 60.65 57.69 1uqt h LYS 436 Cb 1.64 0.09 -0.36 0.00 0.08 0.00 0.00 32.23 33.68 1uqt h LYS 436 CO 0.20 1.04 0.00 -1.71 -0.57 0.00 0.00 179.45 178.40 1uqt n ASN 437 N -3.63 5.10 -4.84 0.86 5.15 -0.87 -4.91 115.26 112.13 1uqt n ASN 437 Ca -0.05 -3.51 -0.25 0.00 -0.60 0.00 0.00 54.58 50.18 1uqt n ASN 437 Cb 0.86 -0.89 0.08 0.00 -0.53 0.00 0.00 39.78 39.30 1uqt n ASN 437 CO 0.00 0.00 0.00 1.51 1.40 0.00 0.00 177.26 180.17 1uqt s ASP 438 N -2.32 4.71 0.39 1.20 3.84 -1.17 -4.52 116.67 118.80 1uqt s ASP 438 Ca 0.39 0.23 0.08 0.00 -0.00 0.00 0.00 52.55 53.25 1uqt s ASP 438 Cb 0.15 -0.84 0.80 0.00 -1.38 0.00 0.00 42.92 41.64 1uqt s ASP 438 CO -0.01 -1.63 1.96 -0.29 -0.00 0.00 0.00 175.17 175.20 1uqt h ILE 439 N -0.54 1.15 -0.10 2.11 6.09 -1.33 0.74 117.51 125.63 1uqt h ILE 439 Ca -0.43 -0.55 -0.00 0.00 -1.37 0.00 0.00 64.86 62.51 1uqt h ILE 439 Cb 1.30 0.94 -0.00 0.00 0.47 0.00 0.00 36.82 39.52 1uqt h ILE 439 CO 0.54 0.19 0.06 -1.13 -3.07 0.00 0.00 178.15 174.74 1uqt h ASN 440 N 0.36 0.12 -0.67 2.19 -1.24 -1.92 -2.44 115.58 111.99 1uqt h ASN 440 Ca 0.09 -0.05 0.08 0.00 0.71 0.00 0.00 56.30 57.12 1uqt h ASN 440 Cb 0.21 -0.03 -0.07 0.00 0.73 0.00 0.00 38.32 39.17 1uqt h ASN 440 CO 0.00 0.14 0.32 -0.74 -1.29 0.00 0.00 177.43 175.87 1uqt h HIS 441 N 0.09 0.58 0.33 0.67 2.76 -1.62 -2.10 115.15 115.87 1uqt h HIS 441 Ca 0.04 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.23 1uqt h HIS 441 Cb 0.04 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 28.82 1uqt h HIS 441 CO -0.05 0.22 -0.30 2.35 -1.30 0.00 0.00 177.93 178.85 1uqt h TRP 442 N 0.57 -0.79 -0.46 5.26 7.01 -0.70 -1.57 115.95 125.27 1uqt h TRP 442 Ca 0.32 0.00 -0.14 0.00 2.11 0.00 0.00 58.89 61.19 1uqt h TRP 442 Cb 0.32 0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 27.67 1uqt h TRP 442 CO -0.11 -0.43 -0.25 -0.56 -2.79 0.00 0.00 178.44 174.29 1uqt h GLN 443 N -0.65 0.97 -0.41 2.65 -0.00 -1.42 -2.67 115.11 113.58 1uqt h GLN 443 Ca -0.02 -0.43 -0.03 0.00 -0.00 0.00 0.00 58.65 58.17 1uqt h GLN 443 Cb 0.58 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.48 28.01 1uqt h GLN 443 CO -0.04 1.10 0.12 0.93 -0.00 0.00 0.00 178.83 180.94 1uqt h GLU 444 N 0.83 0.59 -0.41 0.06 5.08 -1.27 -1.54 114.58 117.93 1uqt h GLU 444 Ca 0.10 -0.09 -0.15 0.00 -1.00 0.00 0.00 59.36 58.22 1uqt h GLU 444 Cb 0.83 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1uqt h GLU 444 CO 0.07 0.53 -0.32 0.00 -1.00 0.00 0.00 179.01 178.29 1uqt h PHE 446 N 0.77 0.96 -0.31 0.00 3.57 -1.21 -1.78 116.94 118.93 1uqt h PHE 446 Ca 0.08 -0.36 -0.11 0.00 3.53 0.00 0.00 57.97 61.10 1uqt h PHE 446 Cb 0.91 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 1uqt h PHE 446 CO 0.06 1.16 -0.26 0.82 -2.23 0.00 0.00 178.31 177.86 1uqt h ILE 447 N 0.48 1.30 -0.64 1.41 1.08 -1.29 -1.00 117.51 118.85 1uqt h ILE 447 Ca -0.00 -1.41 -0.04 0.00 -0.39 0.00 0.00 64.86 63.02 1uqt h ILE 447 Cb 1.13 1.52 -0.03 0.00 -3.07 0.00 0.00 36.82 36.37 1uqt h ILE 447 CO 0.11 0.46 0.25 -1.28 -0.69 0.00 0.00 178.15 177.00 1uqt h SER 448 N 0.47 0.86 -0.50 1.72 0.87 -1.33 0.15 113.55 115.78 1uqt h SER 448 Ca 0.05 -0.12 -0.11 0.00 -1.23 0.00 0.00 61.79 60.39 1uqt h SER 448 Cb 0.82 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.54 1uqt h SER 448 CO 0.07 0.78 -0.10 0.44 -0.53 0.00 0.00 176.83 177.48 1uqt h ASP 449 N 0.93 0.98 0.30 6.23 3.32 -1.24 -2.74 116.42 124.19 1uqt h ASP 449 Ca 0.22 -0.31 -0.15 0.00 0.02 0.00 0.00 57.03 56.80 1uqt h ASP 449 Cb 0.18 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 1uqt h ASP 449 CO -0.02 1.09 -0.61 0.25 -1.72 0.00 0.00 179.24 178.23 1uqt h LEU 450 N 0.88 0.35 -0.70 1.55 5.85 -0.57 -2.79 115.31 119.88 1uqt h LEU 450 Ca 0.14 -0.20 -0.14 0.00 0.84 0.00 0.00 57.88 58.52 1uqt h LEU 450 Cb 0.65 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 1uqt h LEU 450 CO 0.05 0.87 -0.53 0.11 -0.34 0.00 0.00 178.44 178.60 1uqt h LYS 451 N 0.23 0.33 0.00 1.25 1.57 -0.97 -3.12 116.57 115.86 1uqt h LYS 451 Ca -0.01 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.56 1uqt h LYS 451 Cb 1.12 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.45 1uqt h LYS 451 CO 0.10 0.78 -0.07 1.96 -0.57 0.00 0.00 179.45 181.64 1uqt h GLN 452 N 0.26 0.00 -6.39 3.15 4.20 -1.20 -3.43 115.11 111.70 1uqt h GLN 452 Ca 0.01 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.17 1uqt h GLN 452 Cb 1.01 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.79 1uqt h GLN 452 CO 0.09 0.07 0.74 0.42 -0.67 0.00 0.00 178.83 179.48 1uqt s ILE 453 N -4.52 3.89 0.02 2.54 1.01 -1.18 -4.98 121.20 117.98 1uqt s ILE 453 Ca -0.04 1.28 -0.30 0.00 0.00 0.00 0.00 60.65 61.59 1uqt s ILE 453 Cb 0.15 -3.82 -0.07 0.00 0.01 0.00 0.00 42.46 38.73 1uqt s ILE 453 CO 0.60 0.02 1.55 0.68 0.00 0.00 0.00 174.94 177.79 1uqt s VAL 454 N 2.04 3.38 0.51 2.92 -7.23 -1.26 -4.96 120.40 115.81 1uqt s VAL 454 Ca 0.61 0.76 -0.19 0.00 -1.81 0.00 0.00 61.98 61.35 1uqt s VAL 454 Cb -0.29 -3.49 -0.07 0.00 0.56 0.00 0.00 36.38 33.08 1uqt s VAL 454 CO 0.26 -0.01 1.04 -2.16 -0.31 0.00 0.00 175.10 173.91 1uqt s PRO 455 N 2.74 3.69 0.00 4.82 0.04 -1.26 -5.04 135.00 140.00 1uqt s PRO 455 Ca 0.70 1.30 0.03 0.00 0.04 0.00 0.00 61.00 63.07 1uqt s PRO 455 Cb -0.35 -2.08 0.20 0.00 0.04 0.00 0.00 34.50 32.31 1uqt s PRO 455 CO 0.29 -0.51 0.69 2.89 0.04 0.00 0.00 177.00 180.40