#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3is6 s ARG 47 N 0.00 3.75 0.45 3.49 1.70 -1.26 -5.03 118.95 122.05 3is6 s ARG 47 Ca 0.00 1.94 -0.22 0.00 -0.47 0.00 0.00 55.73 56.98 3is6 s ARG 47 Cb 0.00 -2.49 -0.09 0.00 -0.57 0.00 0.00 34.95 31.80 3is6 s ARG 47 CO 0.00 -0.61 1.04 -0.51 -1.08 0.00 0.00 175.30 174.14 3is6 s ASP 48 N -1.13 6.52 0.76 -2.89 1.01 -1.26 -4.92 116.67 114.75 3is6 s ASP 48 Ca 0.62 1.95 -0.12 0.00 0.71 0.00 0.00 52.55 55.72 3is6 s ASP 48 Cb -0.33 -2.57 0.05 0.00 1.01 0.00 0.00 42.92 41.08 3is6 s ASP 48 CO 0.40 -0.66 1.10 -0.36 0.21 0.00 0.00 175.17 175.87 3is6 s PHE 49 N -1.88 2.50 0.26 4.23 0.08 -1.26 -4.96 117.98 116.95 3is6 s PHE 49 Ca 0.64 1.57 -0.30 0.00 0.12 0.00 0.00 56.93 58.96 3is6 s PHE 49 Cb -0.18 -3.11 -0.11 0.00 -0.57 0.00 0.00 43.02 39.05 3is6 s PHE 49 CO 0.22 -1.87 1.52 -2.14 -0.10 0.00 0.00 175.22 172.85 3is6 s PRO 50 N -4.66 4.20 -1.50 0.24 0.02 -1.26 -3.10 135.00 128.94 3is6 s PRO 50 Ca 0.63 2.43 -0.12 0.00 0.02 0.00 0.00 61.00 63.96 3is6 s PRO 50 Cb -0.19 -3.08 0.07 0.00 0.02 0.00 0.00 34.50 31.33 3is6 s PRO 50 CO 0.52 -0.53 0.92 0.72 -0.33 0.00 0.00 177.00 178.31 3is6 n HIS 51 N 2.41 -2.28 0.26 6.54 8.25 -1.26 -4.80 115.22 124.33 3is6 n HIS 51 Ca 0.08 0.84 0.12 0.00 -0.26 0.00 0.00 57.72 58.50 3is6 n HIS 51 Cb 0.39 -4.01 0.71 0.00 1.12 0.00 0.00 29.99 28.20 3is6 n HIS 51 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 3is6 h HIS 52 N -1.98 0.00 0.00 4.41 2.07 -1.93 0.12 115.15 117.85 3is6 h HIS 52 Ca -0.56 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 56.95 3is6 h HIS 52 Cb 1.37 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.34 3is6 h HIS 52 CO 0.57 0.12 -0.04 0.38 -3.07 0.00 0.00 177.93 175.89 3is6 h ASP 53 N 0.00 0.00 -0.39 3.10 2.03 -1.89 -2.96 116.42 116.31 3is6 h ASP 53 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3is6 h ASP 53 Cb 0.31 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.81 3is6 h ASP 53 CO 0.02 0.04 0.00 0.54 -1.03 0.00 0.00 179.24 178.81 3is6 n ARG 54 N -3.25 2.40 -3.41 4.15 1.74 0.43 -4.97 116.66 113.74 3is6 n ARG 54 Ca -0.01 -2.13 -0.38 0.00 -0.77 0.00 0.00 57.85 54.56 3is6 n ARG 54 Cb 0.22 -1.40 -0.06 0.00 -1.02 0.00 0.00 32.46 30.20 3is6 n ARG 54 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3is6 s ILE 55 N -1.14 5.17 0.27 0.55 1.01 -1.12 -2.10 121.20 123.84 3is6 s ILE 55 Ca 0.32 0.83 0.08 0.00 0.00 0.00 0.00 60.65 61.89 3is6 s ILE 55 Cb 0.18 -3.75 -0.05 0.00 0.01 0.00 0.00 42.46 38.85 3is6 s ILE 55 CO 0.24 0.41 -0.11 0.00 0.00 0.00 0.00 174.94 175.48 3is6 s ILE 57 N -2.84 2.76 -0.27 0.00 -4.36 -0.31 -0.95 121.20 115.24 3is6 s ILE 57 Ca 0.28 -2.21 -0.13 0.00 -0.26 0.00 0.00 60.65 58.33 3is6 s ILE 57 Cb 0.01 -2.53 -0.04 0.00 1.25 0.00 0.00 42.46 41.15 3is6 s ILE 57 CO 0.12 -0.36 0.28 -0.69 0.24 0.00 0.00 174.94 174.53 3is6 s VAL 58 N -2.46 5.24 0.25 8.37 1.01 -0.89 -1.69 120.40 130.22 3is6 s VAL 58 Ca 0.31 0.39 0.07 0.00 0.00 0.00 0.00 61.98 62.75 3is6 s VAL 58 Cb -0.04 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 3is6 s VAL 58 CO 0.17 0.21 0.15 -0.54 0.00 0.00 0.00 175.10 175.09 3is6 s LYS 59 N 1.84 2.79 -0.05 2.72 -0.14 -0.48 -4.41 119.74 122.02 3is6 s LYS 59 Ca 0.11 -1.12 0.03 0.00 -1.36 0.00 0.00 55.97 53.63 3is6 s LYS 59 Cb -0.16 -2.48 0.00 0.00 -1.68 0.00 0.00 37.83 33.51 3is6 s LYS 59 CO 0.10 0.40 -0.14 0.99 -0.76 0.00 0.00 175.35 175.94 3is6 s THR 60 N -2.15 1.22 0.08 2.17 2.01 -0.89 -1.12 115.64 116.96 3is6 s THR 60 Ca 0.32 -0.57 0.05 0.00 0.31 0.00 0.00 61.69 61.80 3is6 s THR 60 Cb -0.08 -1.08 -0.03 0.00 0.01 0.00 0.00 72.50 71.32 3is6 s THR 60 CO 0.24 0.37 -0.13 -1.00 -0.69 0.00 0.00 174.62 173.40 3is6 s HIS 61 N 0.34 1.19 -2.93 4.92 3.76 -0.34 -1.26 115.29 120.97 3is6 s HIS 61 Ca -0.09 -0.49 0.00 0.00 -0.15 0.00 0.00 55.06 54.33 3is6 s HIS 61 Cb -0.13 -0.66 0.00 0.00 1.11 0.00 0.00 32.58 32.90 3is6 s HIS 61 CO 0.03 0.05 0.00 0.41 -0.85 0.00 0.00 174.74 174.38 3is6 n GLY 62 N 1.13 -0.55 3.19 -2.22 0.00 -0.88 -1.01 105.19 104.85 3is6 n GLY 62 Ca -0.20 -0.81 -0.12 0.00 0.00 0.00 0.00 46.02 44.89 3is6 n GLY 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3is6 s THR 63 N -3.27 0.08 0.39 2.61 -4.23 -0.52 -0.18 115.64 110.52 3is6 s THR 63 Ca 0.00 -0.68 0.04 0.00 -1.18 0.00 0.00 61.69 59.87 3is6 s THR 63 Cb 0.00 -0.68 -0.03 0.00 1.34 0.00 0.00 72.50 73.13 3is6 s THR 63 CO 0.00 -0.37 0.12 -0.60 -0.54 0.00 0.00 174.62 173.23 3is6 s ARG 64 N -1.82 1.88 0.00 3.99 3.52 -0.51 -2.04 118.95 123.97 3is6 s ARG 64 Ca -0.11 -2.13 0.00 0.00 -0.13 0.00 0.00 55.73 53.36 3is6 s ARG 64 Cb -0.04 -0.63 0.00 0.00 -1.56 0.00 0.00 34.95 32.72 3is6 s ARG 64 CO 0.00 -0.44 0.00 1.04 -0.81 0.00 0.00 175.30 175.10 3is6 n GLN 65 N -0.87 0.00 -2.00 5.12 6.02 -1.22 -2.66 117.38 121.77 3is6 n GLN 65 Ca -0.05 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.92 3is6 n GLN 65 Cb 0.65 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.92 3is6 n GLN 65 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 3is6 n GLU 68 N 0.00 -0.49 0.00 -1.09 0.00 -1.26 -4.67 120.64 113.13 3is6 n GLU 68 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 57.16 57.24 3is6 n GLU 68 Cb 0.00 -2.55 0.00 0.00 0.00 0.00 0.00 31.44 28.89 3is6 n GLU 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3is6 n GLY 69 N -1.14 2.88 3.85 -1.84 0.00 -1.26 -5.03 105.19 102.65 3is6 n GLY 69 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 3is6 n GLY 69 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3is6 s ASP 70 N -1.31 6.05 0.87 1.61 3.84 -1.26 -5.09 116.67 121.38 3is6 s ASP 70 Ca 0.00 0.26 -0.11 0.00 -0.00 0.00 0.00 52.55 52.69 3is6 s ASP 70 Cb 0.00 -1.83 0.11 0.00 -1.38 0.00 0.00 42.92 39.82 3is6 s ASP 70 CO 0.00 0.27 1.09 -0.75 -0.00 0.00 0.00 175.17 175.78 3is6 s LYS 71 N -1.82 1.45 0.38 2.11 2.36 -1.26 -4.97 119.74 117.99 3is6 s LYS 71 Ca 0.25 0.89 -0.26 0.00 -2.55 0.00 0.00 55.97 54.30 3is6 s LYS 71 Cb -0.12 -1.83 -0.09 0.00 -1.05 0.00 0.00 37.83 34.74 3is6 s LYS 71 CO 0.16 -2.13 1.18 -2.14 1.55 0.00 0.00 175.35 173.97 3is6 s PRO 72 N -4.93 4.17 -0.07 4.03 0.02 -1.26 -4.82 135.00 132.14 3is6 s PRO 72 Ca 0.63 1.89 0.03 0.00 0.02 0.00 0.00 61.00 63.57 3is6 s PRO 72 Cb -0.18 -2.79 -0.02 0.00 0.02 0.00 0.00 34.50 31.53 3is6 s PRO 72 CO 0.57 -0.24 -0.16 -1.21 -0.33 0.00 0.00 177.00 175.63 3is6 s GLU 73 N -2.13 2.70 0.06 5.54 2.02 -1.09 -4.96 118.70 120.85 3is6 s GLU 73 Ca 0.54 -0.74 -0.24 0.00 0.02 0.00 0.00 54.97 54.55 3is6 s GLU 73 Cb -0.32 -2.39 -0.06 0.00 0.10 0.00 0.00 34.13 31.46 3is6 s GLU 73 CO 0.41 0.49 0.75 -1.83 0.02 0.00 0.00 175.26 175.09 3is6 s GLU 74 N -0.38 4.48 -0.15 1.61 4.04 -1.26 -1.42 118.70 125.62 3is6 s GLU 74 Ca 0.04 1.04 -0.05 0.00 0.04 0.00 0.00 54.97 56.04 3is6 s GLU 74 Cb -0.12 -3.34 -0.03 0.00 0.02 0.00 0.00 34.13 30.65 3is6 s GLU 74 CO 0.02 0.35 0.01 -0.51 -1.84 0.00 0.00 175.26 173.29 3is6 s LEU 75 N -0.29 3.52 -0.20 1.83 1.43 0.74 -4.94 118.68 120.77 3is6 s LEU 75 Ca 0.37 0.00 -0.04 0.00 -1.03 0.00 0.00 54.13 53.43 3is6 s LEU 75 Cb -0.21 -1.86 0.09 0.00 0.03 0.00 0.00 46.19 44.25 3is6 s LEU 75 CO 0.23 0.21 0.20 -0.62 0.23 0.00 0.00 176.35 176.60 3is6 s ASP 76 N 0.13 1.62 0.08 2.29 -1.08 -1.26 -2.07 116.67 116.37 3is6 s ASP 76 Ca 0.02 -0.34 0.10 0.00 -0.52 0.00 0.00 52.55 51.80 3is6 s ASP 76 Cb -0.13 0.26 -0.03 0.00 -1.46 0.00 0.00 42.92 41.55 3is6 s ASP 76 CO 0.02 -0.34 -0.25 -0.36 0.52 0.00 0.00 175.17 174.76 3is6 s PHE 77 N 2.29 2.36 -1.47 -5.34 0.08 -0.39 -4.99 117.98 110.52 3is6 s PHE 77 Ca 0.06 -0.37 0.13 0.00 0.12 0.00 0.00 56.93 56.87 3is6 s PHE 77 Cb -0.16 -1.35 0.16 0.00 -0.57 0.00 0.00 43.02 41.10 3is6 s PHE 77 CO -0.13 0.24 0.99 0.43 -0.10 0.00 0.00 175.22 176.64 3is6 n SER 78 N 1.36 2.28 -4.29 1.36 7.64 -1.26 -2.09 113.62 118.62 3is6 n SER 78 Ca -0.17 -1.63 -0.17 0.00 1.01 0.00 0.00 58.87 57.91 3is6 n SER 78 Cb 0.52 -0.06 -0.10 0.00 -1.01 0.00 0.00 64.21 63.56 3is6 n SER 78 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 3is6 s GLN 79 N -1.05 1.16 0.26 1.43 -0.21 -1.26 -4.79 119.66 115.20 3is6 s GLN 79 Ca 0.17 -1.46 0.01 0.00 0.02 0.00 0.00 55.36 54.11 3is6 s GLN 79 Cb 0.11 -0.89 -0.05 0.00 1.00 0.00 0.00 33.01 33.18 3is6 s GLN 79 CO 0.16 0.14 0.09 0.14 -2.12 0.00 0.00 175.29 173.71 3is6 s VAL 80 N -2.92 0.57 0.75 1.09 -7.23 0.73 -4.78 120.40 108.62 3is6 s VAL 80 Ca 0.17 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.24 3is6 s VAL 80 Cb -0.00 -2.63 0.04 0.00 0.56 0.00 0.00 36.38 34.35 3is6 s VAL 80 CO 0.04 -0.01 1.09 -0.44 -0.31 0.00 0.00 175.10 175.46 3is6 s SER 81 N -3.31 4.70 0.34 4.85 0.01 -1.26 -1.35 113.70 117.68 3is6 s SER 81 Ca 0.37 1.80 0.02 0.00 1.31 0.00 0.00 55.95 59.45 3is6 s SER 81 Cb 0.08 -2.52 0.60 0.00 0.21 0.00 0.00 66.02 64.39 3is6 s SER 81 CO 0.13 -1.91 1.99 1.23 0.41 0.00 0.00 173.24 175.10 3is6 h GLY 82 N -0.99 0.91 2.00 3.44 0.00 -1.57 -3.10 103.07 103.76 3is6 h GLY 82 Ca -0.44 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 46.50 3is6 h GLY 82 CO 0.52 0.35 -0.16 -1.33 0.00 0.00 0.00 176.54 175.93 3is6 h GLY 83 N 0.89 0.00 0.81 4.60 0.00 -0.53 -3.36 103.07 105.47 3is6 h GLY 83 Ca 0.23 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.56 3is6 h GLY 83 CO -0.05 0.00 0.01 -2.08 0.00 0.00 0.00 176.54 174.43 3is6 h VAL 84 N 0.00 1.18 -0.27 4.60 2.07 -1.75 -3.20 116.25 118.87 3is6 h VAL 84 Ca -0.00 -0.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.99 3is6 h VAL 84 Cb 0.43 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 3is6 h VAL 84 CO 0.02 0.14 0.16 0.00 0.02 0.00 0.00 177.57 177.91 3is6 h ALA 85 N 0.81 0.34 -0.72 1.67 0.00 -1.82 -2.02 119.26 117.52 3is6 h ALA 85 Ca 0.02 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3is6 h ALA 85 Cb 0.22 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3is6 h ALA 85 CO -0.00 -0.15 0.33 -1.35 0.00 0.00 0.00 179.25 178.09 3is6 h PRO 86 N 0.33 1.04 -0.60 0.00 0.10 -1.83 -2.31 132.00 128.73 3is6 h PRO 86 Ca 0.10 -0.15 -0.05 0.00 0.10 0.00 0.00 66.00 66.00 3is6 h PRO 86 Cb 0.03 -0.19 -0.03 0.00 0.10 0.00 0.00 31.00 30.91 3is6 h PRO 86 CO -0.02 0.81 0.19 0.00 0.10 0.00 0.00 178.00 179.08 3is6 h ALA 87 N 1.34 1.21 -0.47 -0.75 0.00 -1.48 -2.60 119.26 116.51 3is6 h ALA 87 Ca 0.25 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3is6 h ALA 87 Cb 0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3is6 h ALA 87 CO -0.03 0.56 0.15 0.82 0.00 0.00 0.00 179.25 180.75 3is6 h ILE 88 N 0.88 1.22 -0.59 0.00 2.04 -0.81 -0.00 117.51 120.25 3is6 h ILE 88 Ca 0.20 -0.75 -0.02 0.00 1.00 0.00 0.00 64.86 65.29 3is6 h ILE 88 Cb 0.25 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 3is6 h ILE 88 CO -0.01 0.27 0.28 -0.61 0.00 0.00 0.00 178.15 178.08 3is6 h GLN 89 N 0.63 0.85 -0.48 2.37 4.15 -1.28 -1.05 115.11 120.30 3is6 h GLN 89 Ca 0.15 -0.13 -0.11 0.00 0.77 0.00 0.00 58.65 59.34 3is6 h GLN 89 Cb 0.27 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.79 3is6 h GLN 89 CO -0.00 0.70 -0.12 0.93 -1.93 0.00 0.00 178.83 178.41 3is6 h GLU 90 N 0.81 0.92 0.00 1.69 5.08 -1.33 -3.39 114.58 118.36 3is6 h GLU 90 Ca 0.20 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 3is6 h GLU 90 Cb 0.13 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.33 3is6 h GLU 90 CO -0.02 1.01 -1.43 0.39 -1.00 0.00 0.00 179.01 177.96 3is6 n GLU 91 N -4.22 0.91 -3.99 2.33 1.02 -0.03 -4.98 120.64 111.69 3is6 n GLU 91 Ca 0.00 -0.10 -0.35 0.00 -0.02 0.00 0.00 57.16 56.69 3is6 n GLU 91 Cb 0.39 -1.32 -0.12 0.00 -0.02 0.00 0.00 31.44 30.38 3is6 n GLU 91 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3is6 s ILE 92 N -2.88 4.28 0.36 -3.67 -1.09 -0.41 -5.04 121.20 112.75 3is6 s ILE 92 Ca -0.03 -0.20 -0.27 0.00 -2.23 0.00 0.00 60.65 57.92 3is6 s ILE 92 Cb 0.10 -2.95 -0.09 0.00 -1.58 0.00 0.00 42.46 37.94 3is6 s ILE 92 CO 0.63 0.41 1.27 -2.16 -1.23 0.00 0.00 174.94 173.86 3is6 s PRO 93 N 0.99 4.19 0.00 2.79 0.04 -1.26 -3.08 135.00 138.67 3is6 s PRO 93 Ca 0.03 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.18 3is6 s PRO 93 Cb -0.14 -2.91 0.00 0.00 0.04 0.00 0.00 34.50 31.49 3is6 s PRO 93 CO 0.02 -0.29 0.00 0.41 0.04 0.00 0.00 177.00 177.18 3is6 n GLY 94 N 0.75 0.71 3.56 0.56 0.00 -1.26 -5.02 105.19 104.50 3is6 n GLY 94 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3is6 n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3is6 s VAL 95 N -2.60 5.13 0.02 1.61 1.01 -1.18 -1.72 120.40 122.67 3is6 s VAL 95 Ca 0.00 0.22 -0.23 0.00 0.00 0.00 0.00 61.98 61.97 3is6 s VAL 95 Cb 0.00 -3.84 -0.16 0.00 0.00 0.00 0.00 36.38 32.38 3is6 s VAL 95 CO 0.00 -0.09 1.35 -0.08 0.00 0.00 0.00 175.10 176.29 3is6 h GLU 96 N 8.41 0.20 -2.63 2.72 4.81 -0.75 -3.46 114.58 123.89 3is6 h GLU 96 Ca -0.30 -0.10 -0.10 0.00 -0.13 0.00 0.00 59.36 58.74 3is6 h GLU 96 Cb 1.14 -0.00 -0.22 0.00 0.63 0.00 0.00 28.75 30.30 3is6 h GLU 96 CO 0.71 0.59 -0.15 -1.17 -0.73 0.00 0.00 179.01 178.26 3is6 s LEU 97 N -9.25 0.25 0.02 1.64 2.96 -0.99 -4.99 118.68 108.33 3is6 s LEU 97 Ca -0.15 0.70 0.03 0.00 -0.22 0.00 0.00 54.13 54.50 3is6 s LEU 97 Cb 0.04 1.65 -0.02 0.00 0.50 0.00 0.00 46.19 48.36 3is6 s LEU 97 CO 0.72 -0.29 -0.09 0.00 -1.32 0.00 0.00 176.35 175.36 3is6 s ALA 98 N -0.33 0.76 0.13 5.97 0.00 -1.26 -0.16 121.76 126.87 3is6 s ALA 98 Ca -0.05 -0.61 -0.11 0.00 0.00 0.00 0.00 51.96 51.19 3is6 s ALA 98 Cb -0.03 -0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.00 3is6 s ALA 98 CO 0.03 0.12 0.29 -0.08 0.00 0.00 0.00 175.76 176.11 3is6 s THR 99 N -0.76 0.09 0.03 0.00 -1.32 -0.46 -4.86 115.64 108.37 3is6 s THR 99 Ca -0.02 -1.08 0.05 0.00 -1.21 0.00 0.00 61.69 59.43 3is6 s THR 99 Cb -0.07 -1.47 -0.02 0.00 -1.51 0.00 0.00 72.50 69.43 3is6 s THR 99 CO 0.00 -0.43 -0.15 0.00 -2.21 0.00 0.00 174.62 171.83 3is6 s ARG 100 N -3.88 1.01 0.12 7.08 1.70 -1.26 -1.23 118.95 122.49 3is6 s ARG 100 Ca 0.09 -0.75 0.04 0.00 -0.47 0.00 0.00 55.73 54.64 3is6 s ARG 100 Cb 0.03 -1.03 -0.04 0.00 -0.57 0.00 0.00 34.95 33.34 3is6 s ARG 100 CO -0.07 0.26 -0.11 0.95 -1.08 0.00 0.00 175.30 175.25 3is6 s THR 101 N -0.78 1.06 -0.02 4.99 -4.23 -0.76 -3.99 115.64 111.91 3is6 s THR 101 Ca 0.03 -1.79 0.00 0.00 -1.18 0.00 0.00 61.69 58.75 3is6 s THR 101 Cb -0.08 -1.55 0.02 0.00 1.34 0.00 0.00 72.50 72.24 3is6 s THR 101 CO 0.01 -0.61 0.01 0.28 -0.54 0.00 0.00 174.62 173.77 3is6 s THR 102 N -2.72 0.09 -0.20 3.99 -1.32 -0.84 -0.99 115.64 113.65 3is6 s THR 102 Ca 0.10 0.09 -0.26 0.00 -1.21 0.00 0.00 61.69 60.40 3is6 s THR 102 Cb -0.01 -0.17 -0.01 0.00 -1.51 0.00 0.00 72.50 70.80 3is6 s THR 102 CO 0.00 0.10 0.90 -0.22 -2.21 0.00 0.00 174.62 173.19 3is6 s LEU 103 N 0.78 4.14 0.01 9.08 2.96 -1.26 -1.36 118.68 133.02 3is6 s LEU 103 Ca -0.07 1.22 -0.22 0.00 -0.22 0.00 0.00 54.13 54.84 3is6 s LEU 103 Cb -0.10 -3.33 -0.18 0.00 0.50 0.00 0.00 46.19 43.08 3is6 s LEU 103 CO -0.02 -0.50 1.22 0.22 -1.32 0.00 0.00 176.35 175.96 3is6 h TYR 104 N 7.43 0.38 0.00 5.38 3.20 -1.54 -3.48 116.97 128.34 3is6 h TYR 104 Ca -0.25 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 61.47 3is6 h TYR 104 Cb 1.11 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.31 3is6 h TYR 104 CO 0.73 0.83 0.00 0.41 -1.64 0.00 0.00 178.16 178.50 3is6 n GLY 105 N 0.53 -0.28 3.71 1.82 0.00 -1.10 -4.96 105.19 104.92 3is6 n GLY 105 Ca -0.08 -2.21 -0.35 0.00 0.00 0.00 0.00 46.02 43.38 3is6 n GLY 105 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3is6 s THR 106 N 0.00 5.39 0.26 2.61 2.01 -1.26 -1.30 115.64 123.36 3is6 s THR 106 Ca 0.00 0.19 -0.07 0.00 0.31 0.00 0.00 61.69 62.12 3is6 s THR 106 Cb 0.00 -3.47 -0.01 0.00 0.01 0.00 0.00 72.50 69.03 3is6 s THR 106 CO 0.00 0.42 0.39 -0.94 -0.69 0.00 0.00 174.62 173.80 3is6 s SER 107 N 0.50 0.28 0.55 3.53 1.04 -0.68 -4.95 113.70 113.98 3is6 s SER 107 Ca 0.08 -1.21 0.09 0.00 0.48 0.00 0.00 55.95 55.39 3is6 s SER 107 Cb -0.12 0.56 0.07 0.00 0.10 0.00 0.00 66.02 66.63 3is6 s SER 107 CO -0.01 -1.11 0.70 -0.54 0.98 0.00 0.00 173.24 173.26 3is6 s LYS 108 N -3.77 2.34 -0.16 4.02 1.02 -1.26 -1.06 119.74 120.88 3is6 s LYS 108 Ca 0.29 -1.67 -0.09 0.00 0.02 0.00 0.00 55.97 54.51 3is6 s LYS 108 Cb 0.01 -2.55 0.05 0.00 -0.52 0.00 0.00 37.83 34.82 3is6 s LYS 108 CO 0.13 -0.76 0.39 -1.50 -0.92 0.00 0.00 175.35 172.70 3is6 s ILE 110 N -2.66 -0.02 -0.27 2.17 2.07 0.04 -1.32 121.20 121.21 3is6 s ILE 110 Ca 0.56 0.09 -0.12 0.00 -1.41 0.00 0.00 60.65 59.77 3is6 s ILE 110 Cb -0.05 -0.58 -0.05 0.00 0.13 0.00 0.00 42.46 41.91 3is6 s ILE 110 CO 0.35 0.04 0.23 -0.22 -1.91 0.00 0.00 174.94 173.43 3is6 s LEU 111 N 1.23 4.04 -1.54 8.50 2.96 -0.21 -2.07 118.68 131.59 3is6 s LEU 111 Ca -0.08 0.09 -0.14 0.00 -0.22 0.00 0.00 54.13 53.78 3is6 s LEU 111 Cb -0.08 -2.20 0.09 0.00 0.50 0.00 0.00 46.19 44.51 3is6 s LEU 111 CO -0.11 -0.06 0.91 -0.62 -1.32 0.00 0.00 176.35 175.15 3is6 n GLU 112 N 4.99 -5.07 -1.33 1.98 -0.58 -0.16 -1.70 120.64 118.78 3is6 n GLU 112 Ca -0.13 0.57 -0.11 0.00 -0.42 0.00 0.00 57.16 57.07 3is6 n GLU 112 Cb 0.52 -5.43 -0.05 0.00 -0.57 0.00 0.00 31.44 25.90 3is6 n GLU 112 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3is6 n ASP 113 N -2.75 -4.90 0.00 1.62 8.00 -1.26 -4.82 116.55 112.44 3is6 n ASP 113 Ca 0.04 0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.82 3is6 n ASP 113 Cb 0.52 -3.39 0.00 0.00 -0.02 0.00 0.00 41.12 38.24 3is6 n ASP 113 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3is6 n ASN 114 N -0.50 0.00 -4.81 -2.24 5.15 -0.69 -5.10 115.26 107.07 3is6 n ASN 114 Ca -0.11 0.00 -0.36 0.00 -0.60 0.00 0.00 54.58 53.51 3is6 n ASN 114 Cb 0.46 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.65 3is6 n ASN 114 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3is6 s LYS 115 N 0.00 4.33 -0.12 1.20 1.02 -1.24 -4.82 119.74 120.11 3is6 s LYS 115 Ca 0.00 1.00 -0.03 0.00 0.02 0.00 0.00 55.97 56.96 3is6 s LYS 115 Cb 0.00 -2.77 -0.03 0.00 -0.52 0.00 0.00 37.83 34.51 3is6 s LYS 115 CO 0.00 0.31 0.01 0.99 -0.92 0.00 0.00 175.35 175.74 3is6 s THR 116 N -1.63 4.35 -0.03 2.17 2.01 -1.26 -1.05 115.64 120.19 3is6 s THR 116 Ca 0.47 -0.22 0.02 0.00 0.31 0.00 0.00 61.69 62.28 3is6 s THR 116 Cb -0.16 -2.87 0.01 0.00 0.01 0.00 0.00 72.50 69.48 3is6 s THR 116 CO 0.21 0.56 -0.09 -0.31 -0.69 0.00 0.00 174.62 174.29 3is6 s TYR 117 N -0.39 1.01 -0.10 4.92 2.02 -1.26 -4.99 117.35 118.56 3is6 s TYR 117 Ca 0.08 -0.27 -0.29 0.00 -0.37 0.00 0.00 57.07 56.22 3is6 s TYR 117 Cb -0.12 -0.73 -0.01 0.00 -0.40 0.00 0.00 41.96 40.69 3is6 s TYR 117 CO 0.02 -0.13 0.98 -2.00 -1.57 0.00 0.00 175.55 172.85 3is6 s GLU 118 N 0.29 4.42 -0.01 -0.62 2.12 -1.26 -4.39 118.70 119.25 3is6 s GLU 118 Ca -0.05 1.34 0.03 0.00 0.36 0.00 0.00 54.97 56.65 3is6 s GLU 118 Cb -0.10 -3.54 -0.01 0.00 0.26 0.00 0.00 34.13 30.75 3is6 s GLU 118 CO 0.01 -0.29 -0.10 0.95 -0.54 0.00 0.00 175.26 175.29 3is6 s THR 119 N 1.92 0.76 -0.30 -1.70 -4.23 -0.22 -4.96 115.64 106.91 3is6 s THR 119 Ca 0.47 -0.43 -0.13 0.00 -1.18 0.00 0.00 61.69 60.42 3is6 s THR 119 Cb -0.18 -0.64 -0.03 0.00 1.34 0.00 0.00 72.50 72.98 3is6 s THR 119 CO 0.18 0.20 0.29 -0.75 -0.54 0.00 0.00 174.62 174.00 3is6 s LYS 120 N -0.26 3.82 -0.16 3.99 2.20 -1.26 -1.68 119.74 126.39 3is6 s LYS 120 Ca 0.03 -0.27 -0.03 0.00 -0.36 0.00 0.00 55.97 55.34 3is6 s LYS 120 Cb -0.04 -3.71 -0.02 0.00 -1.51 0.00 0.00 37.83 32.55 3is6 s LYS 120 CO -0.00 -0.32 -0.06 0.99 -0.36 0.00 0.00 175.35 175.59 3is6 s THR 121 N 1.91 3.62 -0.05 3.43 2.01 -0.42 -0.92 115.64 125.23 3is6 s THR 121 Ca 0.10 -0.45 0.06 0.00 0.31 0.00 0.00 61.69 61.71 3is6 s THR 121 Cb -0.16 -2.58 -0.01 0.00 0.01 0.00 0.00 72.50 69.76 3is6 s THR 121 CO 0.11 0.49 -0.22 -0.22 -0.69 0.00 0.00 174.62 174.08 3is6 s LEU 122 N 0.53 2.02 -0.21 4.42 2.96 -1.26 -1.25 118.68 125.89 3is6 s LEU 122 Ca -0.04 -0.45 -0.13 0.00 -0.22 0.00 0.00 54.13 53.29 3is6 s LEU 122 Cb -0.15 -1.23 -0.05 0.00 0.50 0.00 0.00 46.19 45.27 3is6 s LEU 122 CO 0.03 0.23 0.25 -0.76 -1.32 0.00 0.00 176.35 174.78 3is6 s LEU 123 N -0.18 4.15 0.13 -0.68 1.02 -0.47 -1.80 118.68 120.85 3is6 s LEU 123 Ca -0.01 0.30 -0.05 0.00 0.02 0.00 0.00 54.13 54.39 3is6 s LEU 123 Cb -0.12 -2.27 -0.02 0.00 0.02 0.00 0.00 46.19 43.80 3is6 s LEU 123 CO 0.02 0.03 0.16 0.00 0.02 0.00 0.00 176.35 176.58 3is6 s ALA 124 N 1.01 0.34 0.40 4.21 0.00 -0.23 -1.99 121.76 125.51 3is6 s ALA 124 Ca 0.12 -1.10 0.02 0.00 0.00 0.00 0.00 51.96 51.00 3is6 s ALA 124 Cb -0.14 0.76 -0.01 0.00 0.00 0.00 0.00 23.12 23.73 3is6 s ALA 124 CO 0.05 -0.54 0.60 -1.21 0.00 0.00 0.00 175.76 174.66 3is6 s GLU 125 N -3.98 3.17 0.55 0.00 2.02 -1.26 -1.62 118.70 117.58 3is6 s GLU 125 Ca 0.17 -0.56 0.22 0.00 0.02 0.00 0.00 54.97 54.82 3is6 s GLU 125 Cb 0.05 -2.64 1.48 0.00 0.10 0.00 0.00 34.13 33.13 3is6 s GLU 125 CO -0.02 -0.11 2.18 -1.35 0.02 0.00 0.00 175.26 175.98 3is6 h PRO 126 N 0.58 0.00 0.00 0.39 0.11 -1.82 -0.91 132.00 130.35 3is6 h PRO 126 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3is6 h PRO 126 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3is6 h PRO 126 CO 0.57 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.36 3is6 h ALA 127 N 1.98 1.00 -0.91 -0.75 0.00 -1.94 -2.38 119.26 116.25 3is6 h ALA 127 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.96 3is6 h ALA 127 Cb 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 3is6 h ALA 127 CO -0.00 0.00 0.60 0.35 0.00 0.00 0.00 179.25 180.20 3is6 h PHE 128 N 0.00 1.12 -0.68 0.00 3.57 -1.54 -1.73 116.94 117.67 3is6 h PHE 128 Ca 0.00 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 3is6 h PHE 128 Cb 0.29 -0.37 -0.03 0.00 2.79 0.00 0.00 35.95 38.62 3is6 h PHE 128 CO 0.00 0.66 0.27 -0.07 -2.23 0.00 0.00 178.31 176.94 3is6 h LEU 129 N 1.16 0.95 -1.50 0.59 4.07 -1.60 -1.91 115.31 117.07 3is6 h LEU 129 Ca 0.36 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 58.14 3is6 h LEU 129 Cb -0.01 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.48 3is6 h LEU 129 CO -0.10 0.86 0.00 0.47 -1.08 0.00 0.00 178.44 178.59 3is6 n ASP 130 N -4.38 0.84 0.00 -0.43 8.00 -0.65 -1.40 116.55 118.53 3is6 n ASP 130 Ca 0.05 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.71 3is6 n ASP 130 Cb 0.18 -0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.07 3is6 n ASP 130 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3is6 n PHE 132 N 0.54 0.00 -3.75 1.24 3.72 -0.72 -4.78 117.46 113.71 3is6 n PHE 132 Ca 0.00 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.16 3is6 n PHE 132 Cb 0.16 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.73 3is6 n PHE 132 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3is6 n GLY 133 N 0.00 -0.36 3.69 1.37 0.00 -0.86 -4.66 105.19 104.37 3is6 n GLY 133 Ca 0.00 0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 3is6 n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3is6 s VAL 134 N -3.54 5.03 -0.05 1.61 1.01 -0.49 -5.00 120.40 118.97 3is6 s VAL 134 Ca 0.22 1.34 0.00 0.00 0.00 0.00 0.00 61.98 63.53 3is6 s VAL 134 Cb -0.11 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 3is6 s VAL 134 CO 0.81 0.17 -0.01 -1.61 0.00 0.00 0.00 175.10 174.46 3is6 s GLU 135 N 1.39 2.85 -0.10 2.72 0.41 -1.26 -4.82 118.70 119.89 3is6 s GLU 135 Ca 0.33 -0.52 -0.22 0.00 -0.41 0.00 0.00 54.97 54.15 3is6 s GLU 135 Cb -0.17 -2.70 -0.03 0.00 -1.78 0.00 0.00 34.13 29.45 3is6 s GLU 135 CO 0.14 0.66 0.65 -0.51 -0.49 0.00 0.00 175.26 175.70 3is6 s LEU 136 N -1.15 4.27 0.18 1.80 1.43 -1.26 -1.96 118.68 121.99 3is6 s LEU 136 Ca 0.16 1.05 -0.05 0.00 -1.03 0.00 0.00 54.13 54.25 3is6 s LEU 136 Cb -0.11 -2.97 0.07 0.00 0.03 0.00 0.00 46.19 43.20 3is6 s LEU 136 CO 0.05 -0.13 1.48 0.40 0.23 0.00 0.00 176.35 178.39 3is6 h ILE 137 N 4.84 1.31 -4.00 -0.59 2.04 -0.89 -3.47 117.51 116.75 3is6 h ILE 137 Ca -0.39 -1.78 -0.16 0.00 1.00 0.00 0.00 64.86 63.54 3is6 h ILE 137 Cb 1.18 1.73 -0.20 0.00 -0.74 0.00 0.00 36.82 38.80 3is6 h ILE 137 CO 0.76 0.56 -0.68 0.00 0.00 0.00 0.00 178.15 178.79 3is6 s ALA 138 N -4.03 0.17 0.00 1.87 0.00 -1.14 -4.97 121.76 113.66 3is6 s ALA 138 Ca -0.08 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.19 3is6 s ALA 138 Cb 0.11 0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.41 3is6 s ALA 138 CO 0.85 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.81 3is6 n GLY 139 N 1.27 -0.48 3.58 0.00 0.00 -1.26 -1.55 105.19 106.76 3is6 n GLY 139 Ca -0.22 -1.76 -0.40 0.00 0.00 0.00 0.00 46.02 43.64 3is6 n GLY 139 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3is6 s VAL 140 N -1.57 5.15 0.22 1.61 1.01 -1.26 -4.96 120.40 120.62 3is6 s VAL 140 Ca 0.00 0.42 -0.08 0.00 0.00 0.00 0.00 61.98 62.31 3is6 s VAL 140 Cb 0.00 -3.76 0.19 0.00 0.00 0.00 0.00 36.38 32.81 3is6 s VAL 140 CO 0.00 0.05 1.87 -0.09 0.00 0.00 0.00 175.10 176.92 3is6 h ARG 141 N 8.28 1.17 -0.03 2.72 2.43 -1.94 -2.62 114.38 124.38 3is6 h ARG 141 Ca -0.31 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 58.74 3is6 h ARG 141 Cb 1.15 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 30.46 3is6 h ARG 141 CO 0.67 0.82 -0.07 -0.44 -1.51 0.00 0.00 179.97 179.45 3is6 h ASP 142 N 1.18 0.04 0.85 -3.80 5.19 -2.02 -1.78 116.42 116.08 3is6 h ASP 142 Ca 0.31 -0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 56.59 3is6 h ASP 142 Cb -0.04 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.44 3is6 h ASP 142 CO -0.06 0.12 -0.59 0.28 -3.12 0.00 0.00 179.24 175.87 3is6 h SER 143 N 0.05 0.00 -2.86 6.45 0.02 -1.90 -3.47 113.55 111.84 3is6 h SER 143 Ca 0.01 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.42 3is6 h SER 143 Cb 0.15 0.00 0.07 0.00 0.14 0.00 0.00 62.40 62.77 3is6 h SER 143 CO 0.01 0.59 0.92 0.00 -1.14 0.00 0.00 176.83 177.21 3is6 n ALA 144 N -2.35 2.49 -1.52 3.77 0.00 -0.67 -3.08 120.51 119.15 3is6 n ALA 144 Ca -0.00 0.40 -0.14 0.00 0.00 0.00 0.00 53.44 53.69 3is6 n ALA 144 Cb 0.65 -2.47 -0.05 0.00 0.00 0.00 0.00 19.45 17.58 3is6 n ALA 144 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3is6 n LEU 145 N 3.12 -1.11 -0.06 0.00 4.77 -1.26 -4.63 117.00 117.83 3is6 n LEU 145 Ca 0.13 0.30 -0.02 0.00 -0.03 0.00 0.00 56.01 56.39 3is6 n LEU 145 Cb 0.35 -2.10 -0.16 0.00 -2.33 0.00 0.00 43.42 39.18 3is6 n LEU 145 CO 0.64 -0.66 -0.97 0.54 -1.33 0.00 0.00 177.39 175.61 3is6 n ARG 146 N -2.56 0.68 -4.03 3.23 1.74 -1.18 -4.49 116.66 110.06 3is6 n ARG 146 Ca -0.14 -0.06 -0.35 0.00 -0.77 0.00 0.00 57.85 56.53 3is6 n ARG 146 Cb 0.48 -1.54 -0.11 0.00 -1.02 0.00 0.00 32.46 30.27 3is6 n ARG 146 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3is6 s ASP 147 N -5.18 5.21 0.00 0.55 -1.08 -1.26 -5.08 116.67 109.82 3is6 s ASP 147 Ca -0.09 -0.09 -0.00 0.00 -0.52 0.00 0.00 52.55 51.85 3is6 s ASP 147 Cb 0.09 -1.90 -0.02 0.00 -1.46 0.00 0.00 42.92 39.63 3is6 s ASP 147 CO 0.86 0.10 0.60 0.59 0.52 0.00 0.00 175.17 177.83 3is6 n ASN 148 N 4.05 0.63 -0.35 -0.34 3.02 -1.26 -4.75 115.26 116.25 3is6 n ASN 148 Ca -0.17 -1.42 0.00 0.00 -0.03 0.00 0.00 54.58 52.96 3is6 n ASN 148 Cb 0.52 -0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.54 3is6 n ASN 148 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3is6 n THR 150 N 2.51 0.00 -4.23 3.41 -2.24 -1.26 -4.88 114.28 107.59 3is6 n THR 150 Ca 0.03 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.68 3is6 n THR 150 Cb 0.09 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.22 3is6 n THR 150 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3is6 s LEU 152 N -3.15 3.05 0.02 0.00 1.43 -0.78 -1.05 118.68 118.20 3is6 s LEU 152 Ca 0.23 -0.23 0.07 0.00 -1.03 0.00 0.00 54.13 53.17 3is6 s LEU 152 Cb 0.06 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.49 3is6 s LEU 152 CO 0.03 0.26 -0.20 -0.63 0.23 0.00 0.00 176.35 176.05 3is6 s ILE 153 N -1.01 1.59 0.73 -0.59 -1.09 -0.89 -0.81 121.20 119.12 3is6 s ILE 153 Ca 0.17 -1.07 -0.11 0.00 -2.23 0.00 0.00 60.65 57.41 3is6 s ILE 153 Cb -0.11 -1.37 0.03 0.00 -1.58 0.00 0.00 42.46 39.43 3is6 s ILE 153 CO 0.08 0.27 1.08 -0.94 -1.23 0.00 0.00 174.94 174.20 3is6 s SER 154 N -0.94 4.93 0.23 3.58 1.04 -0.43 -1.12 113.70 120.98 3is6 s SER 154 Ca 0.07 1.76 -0.08 0.00 0.48 0.00 0.00 55.95 58.18 3is6 s SER 154 Cb -0.08 -2.51 0.20 0.00 0.10 0.00 0.00 66.02 63.72 3is6 s SER 154 CO 0.01 -1.75 1.89 -0.08 0.98 0.00 0.00 173.24 174.29 3is6 h GLU 155 N -0.82 1.14 -0.59 4.02 4.81 -1.31 -1.27 114.58 120.55 3is6 h GLU 155 Ca -0.44 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 58.66 3is6 h GLU 155 Cb 1.22 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 30.33 3is6 h GLU 155 CO 0.54 0.77 0.17 0.77 -0.73 0.00 0.00 179.01 180.52 3is6 h SER 156 N 1.17 0.88 -0.61 1.04 0.02 -1.92 -2.22 113.55 111.90 3is6 h SER 156 Ca 0.31 -0.22 -0.07 0.00 -0.84 0.00 0.00 61.79 60.97 3is6 h SER 156 Cb -0.11 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.17 3is6 h SER 156 CO -0.07 0.87 0.10 0.25 -1.14 0.00 0.00 176.83 176.84 3is6 h LEU 157 N 0.85 0.97 -0.80 5.07 5.85 -1.82 -1.27 115.31 124.16 3is6 h LEU 157 Ca 0.19 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.65 3is6 h LEU 157 Cb 0.32 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 3is6 h LEU 157 CO -0.00 0.98 0.50 0.00 -0.34 0.00 0.00 178.44 179.58 3is6 h ALA 158 N 1.02 1.02 -0.55 1.25 0.00 -1.11 -2.40 119.26 118.48 3is6 h ALA 158 Ca 0.19 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3is6 h ALA 158 Cb 0.43 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3is6 h ALA 158 CO 0.01 0.46 0.22 -0.09 0.00 0.00 0.00 179.25 179.86 3is6 h ARG 159 N 1.09 0.83 -1.96 0.00 2.43 -1.13 -0.70 114.38 114.95 3is6 h ARG 159 Ca 0.29 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3is6 h ARG 159 Cb -0.08 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.34 3is6 h ARG 159 CO -0.06 0.72 0.00 1.63 -1.51 0.00 0.00 179.97 180.75 3is6 n LYS 160 N -4.51 0.13 0.00 0.20 5.02 -0.50 -4.08 118.16 114.42 3is6 n LYS 160 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 3is6 n LYS 160 Cb 0.16 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 3is6 n LYS 160 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3is6 n GLY 162 N 1.63 -0.35 0.00 0.72 0.00 -1.04 -5.09 105.19 101.06 3is6 n GLY 162 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3is6 n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3is6 n GLY 163 N -0.06 -1.41 3.76 -0.02 0.00 -0.29 -4.94 105.19 102.22 3is6 n GLY 163 Ca 0.00 -1.58 -0.25 0.00 0.00 0.00 0.00 46.02 44.19 3is6 n GLY 163 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3is6 n ASP 164 N -2.02 -3.17 -0.04 1.61 4.64 -1.26 -4.88 116.55 111.42 3is6 n ASP 164 Ca 0.00 -0.77 0.12 0.00 -1.38 0.00 0.00 54.79 52.77 3is6 n ASP 164 Cb 0.00 -4.14 0.28 0.00 -1.04 0.00 0.00 41.12 36.22 3is6 n ASP 164 CO 0.00 0.00 0.00 1.33 -0.82 0.00 0.00 177.20 177.71 3is6 n VAL 165 N -4.50 0.00 -1.72 5.18 0.24 -1.26 -4.88 118.33 111.39 3is6 n VAL 165 Ca -0.13 -0.02 -0.42 0.00 -2.04 0.00 0.00 64.34 61.72 3is6 n VAL 165 Cb 0.61 0.26 -0.03 0.00 -1.47 0.00 0.00 33.84 33.21 3is6 n VAL 165 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 3is6 n LEU 166 N -1.35 4.01 0.00 1.34 7.94 -1.26 -0.93 117.00 126.75 3is6 n LEU 166 Ca 0.07 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 56.02 3is6 n LEU 166 Cb 0.34 -1.57 0.00 0.00 0.53 0.00 0.00 43.42 42.71 3is6 n LEU 166 CO 0.33 0.19 0.00 0.61 -1.11 0.00 0.00 177.39 177.41 3is6 n GLY 167 N 3.99 1.95 3.77 -3.96 0.00 -0.40 -4.99 105.19 105.56 3is6 n GLY 167 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 3is6 n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3is6 s LYS 168 N -0.28 2.00 -0.08 1.61 1.02 -0.10 -4.58 119.74 119.32 3is6 s LYS 168 Ca 0.00 0.84 0.03 0.00 0.02 0.00 0.00 55.97 56.85 3is6 s LYS 168 Cb 0.00 -1.89 -0.02 0.00 -0.52 0.00 0.00 37.83 35.40 3is6 s LYS 168 CO 0.00 -1.73 -0.16 1.03 -0.92 0.00 0.00 175.35 173.57 3is6 s ARG 169 N -5.03 2.84 0.03 1.68 0.52 -1.26 -1.15 118.95 116.57 3is6 s ARG 169 Ca 0.61 -0.73 0.09 0.00 -0.52 0.00 0.00 55.73 55.18 3is6 s ARG 169 Cb -0.16 -2.43 -0.03 0.00 0.52 0.00 0.00 34.95 32.86 3is6 s ARG 169 CO 0.55 0.43 -0.26 -0.51 0.02 0.00 0.00 175.30 175.53 3is6 s LEU 170 N -0.22 2.16 0.08 2.53 1.43 0.54 -0.99 118.68 124.21 3is6 s LEU 170 Ca 0.00 -0.54 -0.07 0.00 -1.03 0.00 0.00 54.13 52.49 3is6 s LEU 170 Cb -0.13 -1.32 -0.01 0.00 0.03 0.00 0.00 46.19 44.76 3is6 s LEU 170 CO 0.03 0.28 0.15 0.00 0.23 0.00 0.00 176.35 177.04 3is6 s ARG 171 N -1.06 0.80 0.50 1.70 1.70 -0.88 -0.45 118.95 121.25 3is6 s ARG 171 Ca 0.11 -1.00 -0.23 0.00 -0.47 0.00 0.00 55.73 54.14 3is6 s ARG 171 Cb -0.10 0.32 -0.06 0.00 -0.57 0.00 0.00 34.95 34.53 3is6 s ARG 171 CO 0.01 -0.24 1.34 -2.14 -1.08 0.00 0.00 175.30 173.20 3is6 s PRO 172 N -3.86 3.43 0.43 3.89 0.02 -1.26 -0.78 135.00 136.87 3is6 s PRO 172 Ca 0.05 2.20 0.09 0.00 0.02 0.00 0.00 61.00 63.37 3is6 s PRO 172 Cb 0.05 -2.41 0.94 0.00 0.02 0.00 0.00 34.50 33.10 3is6 s PRO 172 CO -0.11 -0.95 2.06 0.00 -0.33 0.00 0.00 177.00 177.68 3is6 h ALA 173 N 1.85 1.79 -0.10 -1.55 0.00 -1.58 -2.44 119.26 117.22 3is6 h ALA 173 Ca -0.51 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3is6 h ALA 173 Cb 1.28 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3is6 h ALA 173 CO 0.59 0.18 0.00 -0.85 0.00 0.00 0.00 179.25 179.17 3is6 n GLU 174 N -4.48 2.15 -1.92 0.00 -0.00 -1.26 -4.94 120.64 110.19 3is6 n GLU 174 Ca 0.03 -1.69 -0.41 0.00 -0.00 0.00 0.00 57.16 55.09 3is6 n GLU 174 Cb 0.10 -1.47 -0.01 0.00 -0.00 0.00 0.00 31.44 30.06 3is6 n GLU 174 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3is6 s SER 175 N -1.87 6.52 -0.18 -1.84 0.15 -0.92 -4.93 113.70 110.63 3is6 s SER 175 Ca 0.33 2.85 0.16 0.00 0.70 0.00 0.00 55.95 59.98 3is6 s SER 175 Cb 0.21 -2.64 0.66 0.00 -1.71 0.00 0.00 66.02 62.53 3is6 s SER 175 CO 0.31 -0.77 1.57 0.29 1.20 0.00 0.00 173.24 175.84 3is6 n LYS 176 N 1.46 3.81 -4.33 5.44 4.76 -1.26 -4.99 118.16 123.05 3is6 n LYS 176 Ca 0.04 -2.94 -0.26 0.00 -2.87 0.00 0.00 58.31 52.28 3is6 n LYS 176 Cb 0.40 -1.99 -0.09 0.00 -1.84 0.00 0.00 35.03 31.50 3is6 n LYS 176 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3is6 s SER 177 N -1.31 4.09 0.00 4.39 0.15 -1.26 -5.02 113.70 114.74 3is6 s SER 177 Ca 0.47 -0.68 0.25 0.00 0.70 0.00 0.00 55.95 56.69 3is6 s SER 177 Cb 0.36 -0.62 1.00 0.00 -1.71 0.00 0.00 66.02 65.05 3is6 s SER 177 CO 0.14 0.09 1.70 -0.90 1.20 0.00 0.00 173.24 175.46 3is6 n ASP 178 N -0.11 1.35 -4.76 5.45 5.68 -1.26 -4.86 116.55 118.03 3is6 n ASP 178 Ca -0.10 -1.54 -0.41 0.00 -0.50 0.00 0.00 54.79 52.24 3is6 n ASP 178 Cb 0.56 -0.04 -0.01 0.00 -1.14 0.00 0.00 41.12 40.49 3is6 n ASP 178 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 3is6 s ARG 179 N -1.91 4.22 0.09 0.11 3.52 -1.26 -5.00 118.95 118.71 3is6 s ARG 179 Ca 0.36 2.41 -0.06 0.00 -0.13 0.00 0.00 55.73 58.30 3is6 s ARG 179 Cb 0.19 -3.04 -0.01 0.00 -1.56 0.00 0.00 34.95 30.53 3is6 s ARG 179 CO 0.30 -0.42 0.14 0.00 -0.81 0.00 0.00 175.30 174.50 3is6 s ALA 180 N -0.71 0.04 -0.14 6.12 0.00 -1.26 -4.84 121.76 120.97 3is6 s ALA 180 Ca 0.55 -0.84 -0.10 0.00 0.00 0.00 0.00 51.96 51.56 3is6 s ALA 180 Cb -0.44 0.49 -0.05 0.00 0.00 0.00 0.00 23.12 23.13 3is6 s ALA 180 CO 0.54 -0.49 0.21 0.42 0.00 0.00 0.00 175.76 176.43 3is6 s ILE 181 N -3.90 5.37 -0.07 0.00 1.01 0.40 -4.89 121.20 119.13 3is6 s ILE 181 Ca 0.08 0.36 -0.13 0.00 0.00 0.00 0.00 60.65 60.96 3is6 s ILE 181 Cb 0.06 -3.51 -0.05 0.00 0.01 0.00 0.00 42.46 38.96 3is6 s ILE 181 CO -0.09 0.51 0.33 -0.89 0.00 0.00 0.00 174.94 174.79 3is6 s THR 182 N -0.27 5.21 -0.52 2.92 2.01 -1.26 -0.34 115.64 123.39 3is6 s THR 182 Ca 0.14 0.64 -0.27 0.00 0.31 0.00 0.00 61.69 62.51 3is6 s THR 182 Cb -0.13 -3.63 0.03 0.00 0.01 0.00 0.00 72.50 68.79 3is6 s THR 182 CO 0.03 0.53 1.08 -0.63 -0.69 0.00 0.00 174.62 174.94 3is6 s ILE 183 N -0.60 4.23 -0.91 1.82 1.01 -0.30 -1.59 121.20 124.85 3is6 s ILE 183 Ca 0.20 0.87 0.24 0.00 0.00 0.00 0.00 60.65 61.96 3is6 s ILE 183 Cb -0.15 -4.60 -0.05 0.00 0.01 0.00 0.00 42.46 37.68 3is6 s ILE 183 CO 0.09 -1.10 1.27 0.61 0.00 0.00 0.00 174.94 175.81 3is6 n GLY 184 N 4.98 -1.22 3.57 6.18 0.00 -0.21 -1.27 105.19 117.22 3is6 n GLY 184 Ca 0.08 -0.39 -0.08 0.00 0.00 0.00 0.00 46.02 45.64 3is6 n GLY 184 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3is6 s GLY 185 N -3.16 -0.41 -0.10 -0.02 0.00 -1.21 -4.03 107.32 98.39 3is6 s GLY 185 Ca 0.09 0.65 0.02 0.00 0.00 0.00 0.00 44.72 45.47 3is6 s GLY 185 CO 0.74 0.20 -0.14 0.14 0.00 0.00 0.00 173.10 174.04 3is6 s VAL 186 N -3.29 1.40 0.05 1.40 1.01 -0.59 -2.10 120.40 118.29 3is6 s VAL 186 Ca 0.07 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.49 3is6 s VAL 186 Cb -0.01 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 3is6 s VAL 186 CO -0.06 0.42 0.01 0.72 0.00 0.00 0.00 175.10 176.19 3is6 s PHE 187 N 0.97 3.05 0.32 5.22 -0.12 -0.28 -0.18 117.98 126.95 3is6 s PHE 187 Ca -0.07 0.03 -0.29 0.00 -0.05 0.00 0.00 56.93 56.54 3is6 s PHE 187 Cb -0.15 -1.60 -0.11 0.00 -0.63 0.00 0.00 43.02 40.53 3is6 s PHE 187 CO -0.01 0.48 1.56 -2.00 -0.05 0.00 0.00 175.22 175.20 3is6 s GLU 188 N -2.03 4.12 0.36 1.99 2.12 -0.83 -0.87 118.70 123.57 3is6 s GLU 188 Ca 0.24 2.57 -0.28 0.00 0.36 0.00 0.00 54.97 57.86 3is6 s GLU 188 Cb -0.12 -3.01 -0.12 0.00 0.26 0.00 0.00 34.13 31.15 3is6 s GLU 188 CO 0.16 -0.59 1.33 -0.25 -0.54 0.00 0.00 175.26 175.36 3is6 n ASP 189 N 1.68 2.96 -4.76 -1.70 8.00 -1.26 -4.79 116.55 116.68 3is6 n ASP 189 Ca 0.06 1.20 -0.33 0.00 0.71 0.00 0.00 54.79 56.43 3is6 n ASP 189 Cb 0.38 -1.51 0.06 0.00 -0.02 0.00 0.00 41.12 40.03 3is6 n ASP 189 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3is6 s LEU 190 N -1.32 3.33 0.43 0.64 1.43 -1.26 -4.94 118.68 117.00 3is6 s LEU 190 Ca 0.56 2.03 -0.26 0.00 -1.03 0.00 0.00 54.13 55.42 3is6 s LEU 190 Cb -0.54 -4.55 -0.09 0.00 0.03 0.00 0.00 46.19 41.03 3is6 s LEU 190 CO 0.62 -1.79 1.44 -2.65 0.23 0.00 0.00 176.35 174.21 3is6 n PRO 191 N -2.61 2.37 -1.46 1.29 -0.02 -1.26 -4.99 135.00 128.31 3is6 n PRO 191 Ca 0.11 0.84 -0.29 0.00 -2.02 0.00 0.00 63.50 62.13 3is6 n PRO 191 Cb 0.52 -2.63 0.12 0.00 -0.02 0.00 0.00 33.50 31.48 3is6 n PRO 191 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3is6 s HIS 192 N -1.17 2.60 -1.51 6.00 -3.43 -1.26 -4.11 115.29 112.41 3is6 s HIS 192 Ca 0.59 1.08 -0.13 0.00 -0.80 0.00 0.00 55.06 55.79 3is6 s HIS 192 Cb -0.46 -3.21 0.08 0.00 -1.43 0.00 0.00 32.58 27.56 3is6 s HIS 192 CO 0.59 -2.12 0.99 0.09 -2.00 0.00 0.00 174.74 172.29 3is6 n ASN 193 N -3.65 -4.80 -4.13 7.38 5.03 -1.26 -4.95 115.26 108.88 3is6 n ASN 193 Ca 0.07 -0.76 -0.17 0.00 0.87 0.00 0.00 54.58 54.58 3is6 n ASN 193 Cb 0.57 -3.97 -0.12 0.00 -1.02 0.00 0.00 39.78 35.23 3is6 n ASN 193 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 3is6 s SER 194 N -3.35 1.42 0.58 6.41 0.15 -1.17 -2.10 113.70 115.65 3is6 s SER 194 Ca 0.64 -0.53 0.35 0.00 0.70 0.00 0.00 55.95 57.11 3is6 s SER 194 Cb -0.32 -0.04 1.78 0.00 -1.71 0.00 0.00 66.02 65.73 3is6 s SER 194 CO 0.82 -0.07 2.16 0.77 1.20 0.00 0.00 173.24 178.12 3is6 h SER 195 N 4.60 0.00 -3.28 5.45 4.64 -1.09 -3.40 113.55 120.47 3is6 h SER 195 Ca -0.38 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.26 3is6 h SER 195 Cb 1.19 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.11 3is6 h SER 195 CO 0.42 0.04 0.08 -0.63 -0.87 0.00 0.00 176.83 175.87 3is6 s ILE 196 N -4.06 4.85 -0.08 0.95 1.01 -1.26 -5.01 121.20 117.60 3is6 s ILE 196 Ca -0.03 -0.40 0.01 0.00 0.00 0.00 0.00 60.65 60.24 3is6 s ILE 196 Cb 0.12 -4.30 0.02 0.00 0.01 0.00 0.00 42.46 38.31 3is6 s ILE 196 CO 0.51 -0.80 -0.10 -1.10 0.00 0.00 0.00 174.94 173.46 3is6 s GLN 197 N 2.70 1.57 -0.25 2.79 -0.21 -1.26 -4.81 119.66 120.20 3is6 s GLN 197 Ca 0.16 -0.33 -0.12 0.00 0.02 0.00 0.00 55.36 55.09 3is6 s GLN 197 Cb -0.18 -1.42 0.08 0.00 1.00 0.00 0.00 33.01 32.49 3is6 s GLN 197 CO 0.13 -0.08 0.58 0.00 -2.12 0.00 0.00 175.29 173.80 3is6 s ALA 198 N 1.03 -1.61 -1.93 6.09 0.00 -1.26 -4.79 121.76 119.29 3is6 s ALA 198 Ca -0.08 2.08 0.22 0.00 0.00 0.00 0.00 51.96 54.18 3is6 s ALA 198 Cb -0.15 -1.35 1.29 0.00 0.00 0.00 0.00 23.12 22.92 3is6 s ALA 198 CO -0.01 -0.49 1.69 -0.25 0.00 0.00 0.00 175.76 176.71 3is6 n ASP 199 N 4.62 0.00 -3.64 0.00 8.00 -0.10 -4.79 116.55 120.65 3is6 n ASP 199 Ca -0.18 -0.61 -0.08 0.00 0.71 0.00 0.00 54.79 54.62 3is6 n ASP 199 Cb 0.55 -0.03 -0.07 0.00 -0.02 0.00 0.00 41.12 41.55 3is6 n ASP 199 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3is6 s LEU 201 N -2.07 -0.82 0.15 0.64 1.43 0.01 -1.31 118.68 116.71 3is6 s LEU 201 Ca 0.32 1.38 0.08 0.00 -1.03 0.00 0.00 54.13 54.88 3is6 s LEU 201 Cb 0.15 2.31 -0.04 0.00 0.03 0.00 0.00 46.19 48.64 3is6 s LEU 201 CO 0.26 -0.22 -0.18 -0.76 0.23 0.00 0.00 176.35 175.68 3is6 s LEU 202 N 1.20 2.41 0.41 1.79 1.43 -0.74 -1.86 118.68 123.32 3is6 s LEU 202 Ca -0.07 -0.83 -0.25 0.00 -1.03 0.00 0.00 54.13 51.95 3is6 s LEU 202 Cb -0.05 -0.81 -0.08 0.00 0.03 0.00 0.00 46.19 45.28 3is6 s LEU 202 CO -0.13 -0.03 1.27 -2.84 0.23 0.00 0.00 176.35 174.84 3is6 s PRO 203 N -2.65 3.94 0.61 1.29 0.02 -1.26 -1.06 135.00 135.89 3is6 s PRO 203 Ca 0.14 2.06 0.39 0.00 0.02 0.00 0.00 61.00 63.61 3is6 s PRO 203 Cb -0.06 -2.70 1.98 0.00 0.02 0.00 0.00 34.50 33.75 3is6 s PRO 203 CO 0.06 -0.49 2.22 0.97 -0.33 0.00 0.00 177.00 179.43 3is6 h ILE 204 N 2.35 0.09 0.00 2.83 2.10 -1.58 -2.08 117.51 121.22 3is6 h ILE 204 Ca -0.49 -0.22 0.00 0.00 1.08 0.00 0.00 64.86 65.23 3is6 h ILE 204 Cb 1.25 1.19 0.00 0.00 -1.09 0.00 0.00 36.82 38.17 3is6 h ILE 204 CO 0.62 0.01 0.00 0.35 -1.08 0.00 0.00 178.15 178.06 3is6 n THR 205 N -3.18 0.63 -0.11 2.19 -2.24 -1.26 -4.84 114.28 105.47 3is6 n THR 205 Ca -0.02 0.16 -0.01 0.00 -2.27 0.00 0.00 64.05 61.91 3is6 n THR 205 Cb 0.16 -0.92 -0.02 0.00 -2.10 0.00 0.00 70.33 67.45 3is6 n THR 205 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 3is6 n TRP 206 N -1.30 0.00 -4.09 4.78 7.02 -0.78 -4.95 117.44 118.13 3is6 n TRP 206 Ca 0.06 -0.17 -0.31 0.00 -1.02 0.00 0.00 57.50 56.06 3is6 n TRP 206 Cb 0.12 -0.47 -0.07 0.00 -2.42 0.00 0.00 31.31 28.47 3is6 n TRP 206 CO 0.00 0.00 0.00 -2.14 -2.02 0.00 0.00 177.69 173.53 3is6 s PRO 208 N 2.43 2.93 0.45 -0.99 0.02 -1.26 -5.17 135.00 133.40 3is6 s PRO 208 Ca 0.06 -0.62 0.11 0.00 0.02 0.00 0.00 61.00 60.57 3is6 s PRO 208 Cb 0.03 -2.76 1.00 0.00 0.02 0.00 0.00 34.50 32.78 3is6 s PRO 208 CO 0.00 0.60 2.07 0.00 -0.33 0.00 0.00 177.00 179.33 3is6 h ALA 209 N 3.63 1.78 -0.79 -1.55 0.00 -1.99 -0.68 119.26 119.66 3is6 h ALA 209 Ca -0.48 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.35 3is6 h ALA 209 Cb 1.17 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 3is6 h ALA 209 CO 0.64 0.19 0.38 1.05 0.00 0.00 0.00 179.25 181.51 3is6 h GLU 210 N 0.29 1.14 -0.33 0.00 -0.00 -2.03 -2.22 114.58 111.42 3is6 h GLU 210 Ca 0.08 -0.17 -0.05 0.00 -0.00 0.00 0.00 59.36 59.21 3is6 h GLU 210 Cb 0.04 -0.20 -0.01 0.00 -0.00 0.00 0.00 28.75 28.57 3is6 h GLU 210 CO -0.01 0.88 0.01 1.03 -0.00 0.00 0.00 179.01 180.92 3is6 h SER 211 N 1.12 0.57 0.12 3.06 0.87 -1.56 -2.36 113.55 115.39 3is6 h SER 211 Ca 0.27 -0.30 -0.02 0.00 -1.23 0.00 0.00 61.79 60.51 3is6 h SER 211 Cb 0.12 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 61.92 3is6 h SER 211 CO -0.03 0.74 -0.11 -0.07 -0.53 0.00 0.00 176.83 176.83 3is6 h LEU 212 N 0.40 0.00 -1.86 2.23 3.38 -1.25 -2.62 115.31 115.58 3is6 h LEU 212 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3is6 h LEU 212 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3is6 h LEU 212 CO 0.02 0.11 0.00 0.59 0.09 0.00 0.00 178.44 179.24 3is6 n ASN 213 N -4.30 2.79 -4.77 -0.43 5.03 -0.85 -2.18 115.26 110.55 3is6 n ASN 213 Ca -0.03 -1.87 -0.38 0.00 0.87 0.00 0.00 54.58 53.17 3is6 n ASN 213 Cb 0.18 -0.03 -0.03 0.00 -1.02 0.00 0.00 39.78 38.89 3is6 n ASN 213 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 3is6 s ASN 214 N -1.69 6.63 0.00 6.41 2.47 -0.89 -4.49 114.94 123.38 3is6 s ASN 214 Ca 0.25 2.22 0.00 0.00 0.42 0.00 0.00 52.86 55.75 3is6 s ASN 214 Cb 0.18 -2.60 0.00 0.00 -1.45 0.00 0.00 41.25 37.37 3is6 s ASN 214 CO 0.26 -0.59 0.16 0.79 -3.72 0.00 0.00 177.10 174.00 3is6 n TRP 215 N 0.05 0.00 -4.02 0.43 7.02 -1.26 -0.94 117.44 118.72 3is6 n TRP 215 Ca 0.04 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.20 3is6 n TRP 215 Cb 0.48 0.00 -0.15 0.00 -2.42 0.00 0.00 31.31 29.22 3is6 n TRP 215 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 3is6 s ILE 216 N -0.66 2.38 0.00 -0.99 1.01 -1.26 -4.88 121.20 116.80 3is6 s ILE 216 Ca 0.00 -1.67 0.00 0.00 0.00 0.00 0.00 60.65 58.98 3is6 s ILE 216 Cb 0.00 -2.44 0.00 0.00 0.01 0.00 0.00 42.46 40.03 3is6 s ILE 216 CO 0.00 -0.12 0.00 0.61 0.00 0.00 0.00 174.94 175.43 3is6 n GLY 217 N 4.46 -1.25 3.81 6.18 0.00 -1.26 -4.93 105.19 112.19 3is6 n GLY 217 Ca -0.12 -1.23 -0.25 0.00 0.00 0.00 0.00 46.02 44.43 3is6 n GLY 217 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3is6 n ASN 218 N -0.58 -1.47 -3.55 1.61 5.15 -1.26 -4.45 115.26 110.71 3is6 n ASN 218 Ca 0.00 -0.94 -0.41 0.00 -0.60 0.00 0.00 54.58 52.64 3is6 n ASN 218 Cb 0.00 -3.50 -0.01 0.00 -0.53 0.00 0.00 39.78 35.74 3is6 n ASN 218 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3is6 n ASP 219 N -2.97 6.31 -0.86 1.20 8.00 -1.26 -4.38 116.55 122.60 3is6 n ASP 219 Ca -0.27 -2.78 0.09 0.00 0.71 0.00 0.00 54.79 52.54 3is6 n ASP 219 Cb 0.67 -1.58 0.14 0.00 -0.02 0.00 0.00 41.12 40.33 3is6 n ASP 219 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3is6 n ARG 220 N 4.50 1.99 -4.20 -1.24 1.85 -1.11 -4.17 116.66 114.28 3is6 n ARG 220 Ca 0.63 -1.88 -0.32 0.00 -1.00 0.00 0.00 57.85 55.27 3is6 n ARG 220 Cb 0.31 -1.39 -0.08 0.00 -1.05 0.00 0.00 32.46 30.25 3is6 n ARG 220 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 3is6 s TYR 221 N -1.38 3.14 -0.18 2.89 2.02 -0.45 -4.48 117.35 118.90 3is6 s TYR 221 Ca 0.27 0.11 -0.07 0.00 -0.37 0.00 0.00 57.07 57.02 3is6 s TYR 221 Cb 0.17 -1.68 -0.04 0.00 -0.40 0.00 0.00 41.96 40.01 3is6 s TYR 221 CO 0.24 0.50 0.05 0.42 -1.57 0.00 0.00 175.55 175.19 3is6 s ILE 222 N -1.15 4.69 -0.22 2.71 1.01 -0.16 -0.19 121.20 127.88 3is6 s ILE 222 Ca 0.22 -0.07 -0.04 0.00 0.00 0.00 0.00 60.65 60.75 3is6 s ILE 222 Cb -0.12 -3.11 -0.01 0.00 0.01 0.00 0.00 42.46 39.24 3is6 s ILE 222 CO 0.13 0.46 -0.04 0.00 0.00 0.00 0.00 174.94 175.49 3is6 s ALA 223 N 0.37 2.83 -0.15 9.38 0.00 -1.26 -1.83 121.76 131.10 3is6 s ALA 223 Ca 0.02 -1.16 -0.05 0.00 0.00 0.00 0.00 51.96 50.77 3is6 s ALA 223 Cb -0.13 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.24 3is6 s ALA 223 CO 0.00 -0.42 0.03 0.71 0.00 0.00 0.00 175.76 176.08 3is6 s TYR 224 N 1.47 3.21 -0.09 0.00 2.02 -0.37 -2.10 117.35 121.49 3is6 s TYR 224 Ca 0.06 0.07 0.01 0.00 -0.37 0.00 0.00 57.07 56.84 3is6 s TYR 224 Cb -0.14 -1.97 0.02 0.00 -0.40 0.00 0.00 41.96 39.47 3is6 s TYR 224 CO -0.03 0.25 -0.11 0.08 -1.57 0.00 0.00 175.55 174.16 3is6 s VAL 225 N -0.07 1.18 -0.28 0.71 1.01 -0.12 -1.36 120.40 121.47 3is6 s VAL 225 Ca 0.05 -0.45 -0.09 0.00 0.00 0.00 0.00 61.98 61.49 3is6 s VAL 225 Cb -0.12 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 3is6 s VAL 225 CO 0.01 0.38 0.14 -0.60 0.00 0.00 0.00 175.10 175.03 3is6 s ARG 226 N 1.07 3.64 0.42 2.72 3.52 0.77 -0.90 118.95 130.19 3is6 s ARG 226 Ca -0.07 -0.51 -0.14 0.00 -0.13 0.00 0.00 55.73 54.88 3is6 s ARG 226 Cb -0.15 -3.52 -0.08 0.00 -1.56 0.00 0.00 34.95 29.65 3is6 s ARG 226 CO -0.01 -0.27 0.84 -0.51 -0.81 0.00 0.00 175.30 174.54 3is6 s LEU 227 N 1.66 3.84 0.71 -0.88 1.43 -0.89 -0.07 118.68 124.48 3is6 s LEU 227 Ca 0.06 1.35 -0.13 0.00 -1.03 0.00 0.00 54.13 54.39 3is6 s LEU 227 Cb -0.16 -4.23 0.02 0.00 0.03 0.00 0.00 46.19 41.85 3is6 s LEU 227 CO 0.07 -0.40 1.09 -0.13 0.23 0.00 0.00 176.35 177.21 3is6 s ARG 228 N -3.64 2.60 0.32 1.70 0.52 -0.70 -4.66 118.95 115.10 3is6 s ARG 228 Ca 0.55 1.24 -0.29 0.00 -0.52 0.00 0.00 55.73 56.71 3is6 s ARG 228 Cb -0.10 -1.94 -0.12 0.00 0.52 0.00 0.00 34.95 33.32 3is6 s ARG 228 CO 0.26 -1.38 1.47 -2.30 0.02 0.00 0.00 175.30 173.37 3is6 n PRO 229 N -2.96 2.46 -0.46 3.54 -0.02 -1.26 -2.33 135.00 133.98 3is6 n PRO 229 Ca 0.09 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 3is6 n PRO 229 Cb 0.53 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 3is6 n PRO 229 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3is6 n GLY 230 N 1.39 1.37 3.63 -1.23 0.00 -1.26 -5.02 105.19 104.08 3is6 n GLY 230 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3is6 n GLY 230 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3is6 s VAL 231 N -3.19 5.08 0.20 1.61 1.01 -0.98 -5.05 120.40 119.08 3is6 s VAL 231 Ca 0.00 0.91 -0.23 0.00 0.00 0.00 0.00 61.98 62.66 3is6 s VAL 231 Cb 0.00 -3.83 -0.08 0.00 0.00 0.00 0.00 36.38 32.46 3is6 s VAL 231 CO 0.00 0.12 0.76 -0.94 0.00 0.00 0.00 175.10 175.04 3is6 s SER 232 N 1.39 7.22 0.28 3.32 1.04 -1.26 -4.90 113.70 120.79 3is6 s SER 232 Ca 0.22 1.54 -0.03 0.00 0.48 0.00 0.00 55.95 58.17 3is6 s SER 232 Cb -0.16 -2.46 0.38 0.00 0.10 0.00 0.00 66.02 63.88 3is6 s SER 232 CO 0.09 0.11 1.89 -0.65 0.98 0.00 0.00 173.24 175.66 3is6 h PRO 233 N 3.83 1.03 0.00 4.02 0.10 -1.97 -2.53 132.00 136.48 3is6 h PRO 233 Ca -0.48 -0.12 -0.03 0.00 0.10 0.00 0.00 66.00 65.47 3is6 h PRO 233 Cb 1.20 -0.20 -0.00 0.00 0.10 0.00 0.00 31.00 32.10 3is6 h PRO 233 CO 0.65 0.77 -0.13 0.93 0.10 0.00 0.00 178.00 180.32 3is6 h GLU 234 N 1.03 0.00 0.00 1.05 3.07 -1.92 -2.07 114.58 115.73 3is6 h GLU 234 Ca 0.26 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.11 3is6 h GLU 234 Cb 0.06 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.97 3is6 h GLU 234 CO -0.04 0.13 -0.02 0.66 -1.40 0.00 0.00 179.01 178.34 3is6 h SER 235 N 0.00 0.00 -0.23 1.42 4.64 -1.85 -2.99 113.55 114.54 3is6 h SER 235 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3is6 h SER 235 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 3is6 h SER 235 CO 0.02 0.02 0.00 0.18 -0.87 0.00 0.00 176.83 176.18 3is6 n LEU 236 N -3.16 2.03 -0.18 5.97 4.77 -0.78 -4.32 117.00 121.33 3is6 n LEU 236 Ca -0.01 -0.87 -0.07 0.00 -0.03 0.00 0.00 56.01 55.03 3is6 n LEU 236 Cb 0.24 -0.15 0.02 0.00 -2.33 0.00 0.00 43.42 41.21 3is6 n LEU 236 CO 0.26 0.44 1.06 0.44 -1.33 0.00 0.00 177.39 178.26 3is6 h ASP 237 N 2.61 0.64 -0.50 -1.43 3.32 -1.68 -1.78 116.42 117.61 3is6 h ASP 237 Ca 0.00 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 56.95 3is6 h ASP 237 Cb 0.58 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 3is6 h ASP 237 CO 0.00 0.52 0.15 -0.33 -1.72 0.00 0.00 179.24 177.86 3is6 h GLU 238 N 0.72 0.78 -0.62 3.56 5.08 -1.85 -2.00 114.58 120.24 3is6 h GLU 238 Ca 0.19 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.34 3is6 h GLU 238 Cb -0.01 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 3is6 h GLU 238 CO -0.04 0.73 0.23 0.00 -1.00 0.00 0.00 179.01 178.94 3is6 h ALA 239 N 1.01 1.24 -0.82 3.43 0.00 -1.82 -1.60 119.26 120.71 3is6 h ALA 239 Ca 0.16 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3is6 h ALA 239 Cb 0.28 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3is6 h ALA 239 CO -0.00 0.55 0.37 -0.07 0.00 0.00 0.00 179.25 180.10 3is6 h LEU 240 N 0.90 1.09 -0.81 0.00 3.38 -0.88 -2.26 115.31 116.73 3is6 h LEU 240 Ca 0.21 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 3is6 h LEU 240 Cb 0.20 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 3is6 h LEU 240 CO -0.02 0.94 0.35 0.25 0.09 0.00 0.00 178.44 180.05 3is6 h LEU 241 N 1.17 1.09 -1.39 1.67 6.46 -0.78 -0.07 115.31 123.47 3is6 h LEU 241 Ca 0.28 -0.16 0.00 0.00 -0.12 0.00 0.00 57.88 57.88 3is6 h LEU 241 Cb 0.15 -0.28 0.00 0.00 -0.73 0.00 0.00 40.66 39.80 3is6 h LEU 241 CO -0.03 0.95 0.00 -0.62 -0.62 0.00 0.00 178.44 178.12 3is6 n GLU 242 N -4.30 0.15 0.00 1.25 1.02 -0.66 -1.70 120.64 116.40 3is6 n GLU 242 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 3is6 n GLU 242 Cb 0.17 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 3is6 n GLU 242 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 3is6 n GLN 244 N 0.62 0.00 -0.13 3.49 7.27 -0.04 -2.22 117.38 126.37 3is6 n GLN 244 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 57.00 57.05 3is6 n GLN 244 Cb 0.05 0.00 0.21 0.00 2.41 0.00 0.00 30.24 32.91 3is6 n GLN 244 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 3is6 h LYS 245 N 0.00 0.83 -0.64 3.69 1.57 -1.59 -1.33 116.57 119.09 3is6 h LYS 245 Ca 0.00 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 3is6 h LYS 245 Cb 0.00 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 3is6 h LYS 245 CO 0.00 0.72 0.20 0.00 -0.57 0.00 0.00 179.45 179.80 3is6 h ARG 246 N 0.81 0.97 0.00 3.15 3.08 -1.72 -3.35 114.38 117.31 3is6 h ARG 246 Ca 0.18 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3is6 h ARG 246 Cb 0.24 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3is6 h ARG 246 CO -0.01 0.83 -1.34 0.72 -1.07 0.00 0.00 179.97 179.11 3is6 n HIS 247 N -4.28 0.00 -4.58 3.04 8.25 -1.08 -4.99 115.22 111.58 3is6 n HIS 247 Ca 0.05 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.18 3is6 n HIS 247 Cb 0.21 -0.22 -0.14 0.00 1.12 0.00 0.00 29.99 30.96 3is6 n HIS 247 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 3is6 s GLN 248 N -2.77 3.43 0.62 -0.41 0.74 -0.52 -4.88 119.66 115.87 3is6 s GLN 248 Ca -0.02 -0.65 -0.11 0.00 0.05 0.00 0.00 55.36 54.64 3is6 s GLN 248 Cb 0.10 -2.73 0.15 0.00 1.10 0.00 0.00 33.01 31.62 3is6 s GLN 248 CO 0.59 0.16 0.69 -0.40 -0.55 0.00 0.00 175.29 175.77 3is6 n ASP 249 N 3.71 -0.77 0.00 6.67 3.85 -1.26 -4.79 116.55 123.96 3is6 n ASP 249 Ca -0.18 -1.08 0.00 0.00 -0.71 0.00 0.00 54.79 52.82 3is6 n ASP 249 Cb 0.52 -0.57 0.00 0.00 -1.35 0.00 0.00 41.12 39.72 3is6 n ASP 249 CO 0.00 0.00 0.00 -1.84 -1.01 0.00 0.00 177.20 174.35 3is6 n GLU 251 N -2.99 0.00 -0.34 0.11 -0.00 -1.26 -4.54 120.64 111.62 3is6 n GLU 251 Ca 0.09 0.00 -0.04 0.00 -0.00 0.00 0.00 57.16 57.21 3is6 n GLU 251 Cb 0.33 -0.41 0.09 0.00 -0.00 0.00 0.00 31.44 31.45 3is6 n GLU 251 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 3is6 h VAL 252 N 0.00 1.26 -0.15 3.84 2.07 -1.99 -1.91 116.25 119.37 3is6 h VAL 252 Ca 0.00 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 3is6 h VAL 252 Cb 0.00 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.78 3is6 h VAL 252 CO 0.00 0.29 0.01 -0.26 0.02 0.00 0.00 177.57 177.62 3is6 h PHE 253 N 1.27 0.29 -0.51 1.57 0.04 -1.85 -3.04 116.94 114.71 3is6 h PHE 253 Ca 0.32 -0.05 0.01 0.00 2.80 0.00 0.00 57.97 61.05 3is6 h PHE 253 Cb 0.01 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.05 3is6 h PHE 253 CO 0.01 0.47 0.34 0.00 -0.60 0.00 0.00 178.31 178.53 3is6 h ARG 254 N 0.02 0.66 -0.47 1.51 -0.00 -1.61 0.35 114.38 114.84 3is6 h ARG 254 Ca 0.04 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.98 59.47 3is6 h ARG 254 Cb 0.35 -0.15 -0.02 0.00 0.00 0.00 0.00 29.97 30.15 3is6 h ARG 254 CO 0.01 0.44 0.25 1.57 0.00 0.00 0.00 179.97 182.23 3is6 h LYS 255 N 0.68 0.64 -0.49 0.04 5.09 -1.25 0.20 116.57 121.48 3is6 h LYS 255 Ca 0.19 -0.06 0.00 0.00 0.09 0.00 0.00 60.65 60.87 3is6 h LYS 255 Cb -0.05 -0.13 0.00 0.00 0.10 0.00 0.00 32.23 32.14 3is6 h LYS 255 CO -0.04 0.49 0.00 0.00 -2.09 0.00 0.00 179.45 177.80 3is6 n ALA 256 N -2.46 2.43 -3.44 0.07 0.00 0.10 -4.93 120.51 112.27 3is6 n ALA 256 Ca 0.04 -0.92 -0.21 0.00 0.00 0.00 0.00 53.44 52.34 3is6 n ALA 256 Cb 0.11 -0.96 0.07 0.00 0.00 0.00 0.00 19.45 18.66 3is6 n ALA 256 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3is6 n GLY 257 N 1.37 -0.40 3.40 0.00 0.00 0.06 -4.32 105.19 105.30 3is6 n GLY 257 Ca 0.18 0.15 -0.33 0.00 0.00 0.00 0.00 46.02 46.03 3is6 n GLY 257 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3is6 s VAL 258 N -3.27 3.13 -0.07 1.61 1.01 0.05 -3.38 120.40 119.47 3is6 s VAL 258 Ca 0.51 -0.64 0.05 0.00 0.00 0.00 0.00 61.98 61.90 3is6 s VAL 258 Cb -0.22 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.84 3is6 s VAL 258 CO 0.63 0.53 -0.24 -1.83 0.00 0.00 0.00 175.10 174.19 3is6 s GLU 259 N 0.19 2.64 0.13 2.72 1.03 -0.87 -4.06 118.70 120.48 3is6 s GLU 259 Ca -0.07 -0.86 -0.11 0.00 0.03 0.00 0.00 54.97 53.96 3is6 s GLU 259 Cb -0.15 -2.14 0.00 0.00 -0.80 0.00 0.00 34.13 31.05 3is6 s GLU 259 CO 0.05 0.29 0.28 -0.48 -1.33 0.00 0.00 175.26 174.07 3is6 s LEU 260 N 0.06 0.99 0.11 1.83 0.05 -1.26 -1.44 118.68 119.01 3is6 s LEU 260 Ca -0.09 -0.66 -0.11 0.00 0.05 0.00 0.00 54.13 53.31 3is6 s LEU 260 Cb -0.15 1.31 0.01 0.00 -2.05 0.00 0.00 46.19 45.31 3is6 s LEU 260 CO 0.05 -0.83 0.28 -1.38 -0.55 0.00 0.00 176.35 173.92 3is6 s HIS 261 N -3.89 0.06 -0.04 3.48 -3.43 -0.18 -4.97 115.29 106.32 3is6 s HIS 261 Ca 0.09 -0.45 -0.04 0.00 -0.80 0.00 0.00 55.06 53.86 3is6 s HIS 261 Cb 0.03 0.05 -0.04 0.00 -1.43 0.00 0.00 32.58 31.20 3is6 s HIS 261 CO -0.07 -0.62 0.17 0.71 -2.00 0.00 0.00 174.74 172.93 3is6 s TYR 262 N -3.86 3.56 -0.04 0.38 2.02 -1.26 -1.19 117.35 116.96 3is6 s TYR 262 Ca 0.06 0.41 -0.14 0.00 -0.37 0.00 0.00 57.07 57.03 3is6 s TYR 262 Cb 0.04 -1.86 0.03 0.00 -0.40 0.00 0.00 41.96 39.76 3is6 s TYR 262 CO -0.10 0.67 0.32 -1.54 -1.57 0.00 0.00 175.55 173.34 3is6 s SER 263 N -1.69 -0.24 0.13 2.29 1.04 -0.27 -4.84 113.70 110.12 3is6 s SER 263 Ca 0.24 0.25 -0.30 0.00 0.48 0.00 0.00 55.95 56.62 3is6 s SER 263 Cb -0.12 0.41 -0.06 0.00 0.10 0.00 0.00 66.02 66.35 3is6 s SER 263 CO 0.15 -0.36 0.95 -0.76 0.98 0.00 0.00 173.24 174.19 3is6 s LEU 264 N -0.94 4.53 0.00 2.42 1.43 -1.26 -1.38 118.68 123.48 3is6 s LEU 264 Ca -0.10 1.81 0.04 0.00 -1.03 0.00 0.00 54.13 54.85 3is6 s LEU 264 Cb -0.04 -3.58 -0.01 0.00 0.03 0.00 0.00 46.19 42.58 3is6 s LEU 264 CO 0.03 -0.02 -0.12 0.28 0.23 0.00 0.00 176.35 176.75 3is6 s THR 265 N -0.22 0.98 0.46 5.49 -1.32 -0.68 -4.66 115.64 115.68 3is6 s THR 265 Ca 0.46 -0.65 -0.25 0.00 -1.21 0.00 0.00 61.69 60.04 3is6 s THR 265 Cb -0.24 -0.84 -0.08 0.00 -1.51 0.00 0.00 72.50 69.83 3is6 s THR 265 CO 0.30 0.19 1.42 -2.84 -2.21 0.00 0.00 174.62 171.48 3is6 s PRO 266 N -0.52 3.63 -0.28 7.08 0.02 -1.26 -1.16 135.00 142.51 3is6 s PRO 266 Ca 0.04 2.40 -0.18 0.00 0.02 0.00 0.00 61.00 63.27 3is6 s PRO 266 Cb -0.06 -2.62 -0.02 0.00 0.02 0.00 0.00 34.50 31.83 3is6 s PRO 266 CO -0.00 -0.85 0.53 0.12 -0.33 0.00 0.00 177.00 176.47 3is6 s PHE 267 N -1.21 3.25 -0.33 6.54 5.36 0.03 -4.68 117.98 126.94 3is6 s PHE 267 Ca 0.62 0.57 -0.07 0.00 -0.96 0.00 0.00 56.93 57.09 3is6 s PHE 267 Cb -0.43 -2.78 0.03 0.00 -0.34 0.00 0.00 43.02 39.50 3is6 s PHE 267 CO 0.55 -0.34 0.10 1.21 -1.46 0.00 0.00 175.22 175.29 3is6 s ASN 268 N 1.59 5.27 0.33 6.13 3.84 -1.26 -4.92 114.94 125.92 3is6 s ASN 268 Ca 0.21 -0.98 0.26 0.00 0.21 0.00 0.00 52.86 52.56 3is6 s ASN 268 Cb -0.15 -1.88 1.01 0.00 -0.55 0.00 0.00 41.25 39.67 3is6 s ASN 268 CO 0.10 -0.28 1.78 0.08 -2.79 0.00 0.00 177.10 175.99 3is6 h ARG 269 N 8.24 0.00 -6.45 0.43 0.11 -1.95 -3.47 114.38 111.29 3is6 h ARG 269 Ca -0.26 0.00 -0.53 0.00 0.10 0.00 0.00 59.98 59.29 3is6 h ARG 269 Cb 1.10 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.20 3is6 h ARG 269 CO 0.61 0.00 1.06 -1.17 0.10 0.00 0.00 179.97 180.57 3is6 s LEU 270 N -5.00 4.38 -0.30 0.08 2.96 -1.26 -0.57 118.68 118.96 3is6 s LEU 270 Ca 0.05 2.57 -0.00 0.00 -0.22 0.00 0.00 54.13 56.53 3is6 s LEU 270 Cb 0.09 -3.56 0.14 0.00 0.50 0.00 0.00 46.19 43.36 3is6 s LEU 270 CO 0.48 -0.94 0.30 -0.60 -1.32 0.00 0.00 176.35 174.27 3is6 s ARG 271 N 2.92 0.37 0.30 1.98 3.52 -0.89 -4.69 118.95 122.46 3is6 s ARG 271 Ca 0.77 -0.29 -0.29 0.00 -0.13 0.00 0.00 55.73 55.79 3is6 s ARG 271 Cb -0.42 -0.70 -0.10 0.00 -1.56 0.00 0.00 34.95 32.17 3is6 s ARG 271 CO 0.34 -1.06 1.26 -0.51 -0.81 0.00 0.00 175.30 174.53 3is6 s LEU 272 N 2.18 4.45 0.37 -0.88 1.43 -1.26 -3.03 118.68 121.94 3is6 s LEU 272 Ca 0.11 2.57 -0.28 0.00 -1.03 0.00 0.00 54.13 55.50 3is6 s LEU 272 Cb -0.14 -3.64 -0.10 0.00 0.03 0.00 0.00 46.19 42.34 3is6 s LEU 272 CO -0.28 -0.45 1.35 -0.70 0.23 0.00 0.00 176.35 176.50 3is6 s GLU 273 N -1.51 4.17 -0.07 1.70 2.12 -1.26 -4.82 118.70 119.03 3is6 s GLU 273 Ca 0.49 2.29 -0.33 0.00 0.36 0.00 0.00 54.97 57.77 3is6 s GLU 273 Cb -0.38 -2.94 -0.11 0.00 0.26 0.00 0.00 34.13 30.96 3is6 s GLU 273 CO 0.49 -0.37 1.90 -3.47 -0.54 0.00 0.00 175.26 173.26 3is6 n ASP 274 N 0.49 3.59 -3.53 -1.70 2.03 -1.26 -4.79 116.55 111.38 3is6 n ASP 274 Ca 0.01 0.96 -0.40 0.00 0.52 0.00 0.00 54.79 55.88 3is6 n ASP 274 Cb 0.42 -1.40 -0.01 0.00 -0.72 0.00 0.00 41.12 39.41 3is6 n ASP 274 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 3is6 n PRO 275 N 6.82 4.15 -1.81 -0.67 -0.04 -1.26 -4.76 135.00 137.42 3is6 n PRO 275 Ca 0.22 -3.18 -0.31 0.00 -0.04 0.00 0.00 63.50 60.19 3is6 n PRO 275 Cb 0.32 -2.75 0.02 0.00 -0.04 0.00 0.00 33.50 31.04 3is6 n PRO 275 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3is6 s THR 276 N 0.01 4.37 0.23 0.52 -4.23 -1.26 -4.96 115.64 110.32 3is6 s THR 276 Ca 0.54 0.82 -0.08 0.00 -1.18 0.00 0.00 61.69 61.79 3is6 s THR 276 Cb 0.16 -3.64 0.20 0.00 1.34 0.00 0.00 72.50 70.57 3is6 s THR 276 CO -0.07 -0.96 1.88 -0.07 -0.54 0.00 0.00 174.62 174.86 3is6 h LEU 277 N -0.33 1.05 -0.29 4.79 4.07 -2.04 -2.23 115.31 120.33 3is6 h LEU 277 Ca -0.44 -0.06 -0.00 0.00 0.08 0.00 0.00 57.88 57.45 3is6 h LEU 277 Cb 1.20 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.66 3is6 h LEU 277 CO 0.60 0.80 0.17 0.58 -1.08 0.00 0.00 178.44 179.51 3is6 h VAL 278 N 1.21 1.12 0.00 1.22 2.07 -1.97 -0.27 116.25 119.62 3is6 h VAL 278 Ca 0.32 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.55 3is6 h VAL 278 Cb -0.06 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 3is6 h VAL 278 CO -0.06 0.11 0.00 0.59 0.02 0.00 0.00 177.57 178.23 3is6 n ASN 279 N -4.83 0.25 0.00 0.57 3.02 -0.84 -3.44 115.26 109.98 3is6 n ASN 279 Ca -0.02 -0.32 0.00 0.00 -0.03 0.00 0.00 54.58 54.21 3is6 n ASN 279 Cb 0.06 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.15 3is6 n ASN 279 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3is6 n LEU 281 N 0.55 0.00 0.25 3.41 7.94 -0.11 -3.88 117.00 125.15 3is6 n LEU 281 Ca 0.00 0.00 0.11 0.00 -1.11 0.00 0.00 56.01 55.01 3is6 n LEU 281 Cb 0.05 0.00 0.63 0.00 0.53 0.00 0.00 43.42 44.63 3is6 n LEU 281 CO 0.00 0.00 0.91 -0.09 -1.11 0.00 0.00 177.39 177.10 3is6 h ARG 282 N 0.00 0.00 -0.22 1.96 2.43 -1.81 -3.03 114.38 113.71 3is6 h ARG 282 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3is6 h ARG 282 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3is6 h ARG 282 CO 0.00 0.17 0.00 0.44 -1.51 0.00 0.00 179.97 179.07 3is6 n ILE 283 N -3.66 1.83 1.68 1.20 -5.35 -1.25 -5.26 119.36 108.56 3is6 n ILE 283 Ca -0.01 -1.67 0.15 0.00 -0.27 0.00 0.00 62.75 60.95 3is6 n ILE 283 Cb 0.29 -0.02 0.68 0.00 -1.74 0.00 0.00 39.64 38.85 3is6 n ILE 283 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79