#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t6n n GLY 46 N 0.00 -1.59 0.00 5.00 0.00 -1.26 -4.86 105.19 102.48 1t6n n GLY 46 Ca 0.00 0.55 0.10 0.00 0.00 0.00 0.00 46.02 46.66 1t6n n GLY 46 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1t6n n PHE 47 N 0.00 0.00 0.30 1.61 3.01 -1.26 -4.29 117.46 116.83 1t6n n PHE 47 Ca 0.00 0.00 0.19 0.00 1.01 0.00 0.00 57.45 58.65 1t6n n PHE 47 Cb 0.00 -0.04 0.96 0.00 -0.01 0.00 0.00 39.48 40.39 1t6n n PHE 47 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1t6n h ARG 48 N 0.00 0.00 -0.63 -1.08 3.08 -1.95 -1.74 114.38 112.05 1t6n h ARG 48 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1t6n h ARG 48 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1t6n h ARG 48 CO 0.00 0.00 0.00 -0.40 -1.07 0.00 0.00 179.97 178.50 1t6n n ASP 49 N -2.88 3.57 -0.37 7.04 5.68 -1.26 -4.36 116.55 123.96 1t6n n ASP 49 Ca -0.02 -1.99 0.13 0.00 -0.50 0.00 0.00 54.79 52.41 1t6n n ASP 49 Cb 0.12 -0.42 0.56 0.00 -1.14 0.00 0.00 41.12 40.24 1t6n n ASP 49 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1t6n n PHE 50 N 1.46 0.06 -3.51 2.11 0.99 -0.66 -4.95 117.46 112.96 1t6n n PHE 50 Ca 0.22 -0.03 -0.19 0.00 -0.00 0.00 0.00 57.45 57.45 1t6n n PHE 50 Cb 0.57 0.00 0.06 0.00 -1.00 0.00 0.00 39.48 39.11 1t6n n PHE 50 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.76 176.65 1t6n n LEU 51 N -0.09 -3.96 -4.86 4.37 7.94 -1.26 -4.88 117.00 114.26 1t6n n LEU 51 Ca 0.19 -0.74 -0.26 0.00 -1.11 0.00 0.00 56.01 54.08 1t6n n LEU 51 Cb 0.28 -2.92 -0.04 0.00 0.53 0.00 0.00 43.42 41.26 1t6n n LEU 51 CO 0.15 0.34 -0.17 -0.76 -1.11 0.00 0.00 177.39 175.84 1t6n s LEU 52 N -6.27 4.03 0.72 -1.96 1.43 -1.26 -5.09 118.68 110.28 1t6n s LEU 52 Ca 0.14 0.00 -0.15 0.00 -1.03 0.00 0.00 54.13 53.09 1t6n s LEU 52 Cb -0.03 -2.63 0.03 0.00 0.03 0.00 0.00 46.19 43.60 1t6n s LEU 52 CO 0.77 0.06 1.18 -1.59 0.23 0.00 0.00 176.35 177.00 1t6n s LYS 53 N -3.14 2.29 0.16 1.70 -2.85 -1.26 -4.67 119.74 111.97 1t6n s LYS 53 Ca 0.32 1.65 -0.28 0.00 -1.00 0.00 0.00 55.97 56.66 1t6n s LYS 53 Cb -0.11 -1.86 -0.01 0.00 -2.06 0.00 0.00 37.83 33.79 1t6n s LYS 53 CO 0.26 -1.69 1.56 -1.35 0.10 0.00 0.00 175.35 174.22 1t6n h PRO 54 N -0.25 -0.22 -0.54 1.78 0.11 -1.99 -0.67 132.00 130.22 1t6n h PRO 54 Ca -0.47 0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.76 1t6n h PRO 54 Cb 1.28 0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.41 1t6n h PRO 54 CO 0.51 -0.15 0.37 0.93 -0.21 0.00 0.00 178.00 179.44 1t6n h GLU 55 N -0.23 0.27 0.06 1.05 4.39 -1.91 -0.88 114.58 117.33 1t6n h GLU 55 Ca 0.15 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.74 1t6n h GLU 55 Cb 0.55 -0.06 0.01 0.00 -0.10 0.00 0.00 28.75 29.15 1t6n h GLU 55 CO -0.72 0.18 -0.40 1.25 -1.16 0.00 0.00 179.01 178.16 1t6n h LEU 56 N 0.28 0.25 -1.16 1.33 5.85 -1.59 -3.05 115.31 117.21 1t6n h LEU 56 Ca 0.25 -0.94 0.01 0.00 0.84 0.00 0.00 57.88 58.04 1t6n h LEU 56 Cb 0.62 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 1t6n h LEU 56 CO -0.05 1.17 0.57 0.25 -0.34 0.00 0.00 178.44 180.03 1t6n h LEU 57 N -0.63 0.98 -0.64 2.25 5.85 -0.86 -1.80 115.31 120.46 1t6n h LEU 57 Ca -0.07 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1t6n h LEU 57 Cb 1.29 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 1t6n h LEU 57 CO 0.08 0.71 0.36 0.03 -0.34 0.00 0.00 178.44 179.28 1t6n h ARG 58 N 1.16 0.88 -0.66 1.25 3.08 -1.26 -1.41 114.38 117.42 1t6n h ARG 58 Ca 0.31 -0.09 -0.05 0.00 0.07 0.00 0.00 59.98 60.23 1t6n h ARG 58 Cb -0.13 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 29.71 1t6n h ARG 58 CO -0.07 0.65 0.23 0.00 -1.07 0.00 0.00 179.97 179.71 1t6n h ALA 59 N 1.18 0.86 0.32 0.04 0.00 -1.28 0.18 119.26 120.56 1t6n h ALA 59 Ca 0.23 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1t6n h ALA 59 Cb 0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1t6n h ALA 59 CO -0.04 0.51 -0.23 0.82 0.00 0.00 0.00 179.25 180.31 1t6n h ILE 60 N 0.94 0.52 -0.62 0.00 1.08 -0.96 -0.66 117.51 117.82 1t6n h ILE 60 Ca 0.22 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.63 1t6n h ILE 60 Cb 0.25 0.52 -0.03 0.00 -3.07 0.00 0.00 36.82 34.50 1t6n h ILE 60 CO -0.01 0.00 0.16 0.58 -0.69 0.00 0.00 178.15 178.19 1t6n h VAL 61 N -0.55 1.25 0.00 1.67 2.07 -1.14 -2.39 116.25 117.17 1t6n h VAL 61 Ca -0.03 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.58 1t6n h VAL 61 Cb 0.47 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1t6n h VAL 61 CO 0.01 0.34 -0.02 0.44 0.02 0.00 0.00 177.57 178.37 1t6n h ASP 62 N 0.91 0.00 0.21 0.57 5.19 -0.48 -1.85 116.42 120.96 1t6n h ASP 62 Ca 0.20 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.61 1t6n h ASP 62 Cb 0.35 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.86 1t6n h ASP 62 CO 0.00 0.02 -0.12 0.00 -3.12 0.00 0.00 179.24 176.02 1t6n n GLY 64 N 1.25 0.79 3.54 0.00 0.00 -0.69 -5.05 105.19 105.03 1t6n n GLY 64 Ca 0.16 -0.60 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 1t6n n GLY 64 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1t6n s PHE 65 N -2.00 3.21 0.00 1.61 0.40 -0.93 -4.86 117.98 115.41 1t6n s PHE 65 Ca 0.00 -0.04 0.00 0.00 -0.60 0.00 0.00 56.93 56.29 1t6n s PHE 65 Cb 0.00 -2.66 0.00 0.00 0.51 0.00 0.00 43.02 40.87 1t6n s PHE 65 CO 0.00 -0.43 0.39 0.39 0.70 0.00 0.00 175.22 176.26 1t6n n GLU 66 N 5.37 0.22 -3.74 0.44 -0.58 -1.26 -4.44 120.64 116.64 1t6n n GLU 66 Ca -0.09 -0.46 -0.28 0.00 -0.42 0.00 0.00 57.16 55.91 1t6n n GLU 66 Cb 0.49 -0.69 -0.12 0.00 -0.57 0.00 0.00 31.44 30.56 1t6n n GLU 66 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 1t6n s HIS 67 N -0.15 2.70 0.28 -0.32 3.76 -1.26 -4.57 115.29 115.74 1t6n s HIS 67 Ca 0.00 -2.96 -0.29 0.00 -0.15 0.00 0.00 55.06 51.65 1t6n s HIS 67 Cb 0.00 -2.12 -0.10 0.00 1.11 0.00 0.00 32.58 31.47 1t6n s HIS 67 CO 0.00 -0.65 1.42 -2.14 -0.85 0.00 0.00 174.74 172.52 1t6n s PRO 68 N -0.83 4.26 0.97 8.40 0.02 -1.26 -4.99 135.00 141.57 1t6n s PRO 68 Ca 0.26 2.32 -0.13 0.00 0.02 0.00 0.00 61.00 63.47 1t6n s PRO 68 Cb -0.04 -3.08 0.17 0.00 0.02 0.00 0.00 34.50 31.57 1t6n s PRO 68 CO -0.16 -0.39 1.14 -1.54 -0.33 0.00 0.00 177.00 175.72 1t6n s SER 69 N 0.11 2.99 0.25 2.53 1.04 -1.26 -4.81 113.70 114.55 1t6n s SER 69 Ca 0.56 0.92 -0.04 0.00 0.48 0.00 0.00 55.95 57.88 1t6n s SER 69 Cb -0.42 -1.45 0.29 0.00 0.10 0.00 0.00 66.02 64.54 1t6n s SER 69 CO 0.48 -2.87 1.78 -0.33 0.98 0.00 0.00 173.24 173.28 1t6n h GLU 70 N -1.72 0.94 -0.42 4.02 5.08 -1.94 -1.34 114.58 119.21 1t6n h GLU 70 Ca -0.51 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 57.62 1t6n h GLU 70 Cb 1.32 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 1t6n h GLU 70 CO 0.57 0.84 0.16 0.28 -1.00 0.00 0.00 179.01 179.86 1t6n h VAL 71 N 0.90 1.20 -0.21 3.13 2.07 -1.92 -1.97 116.25 119.46 1t6n h VAL 71 Ca 0.19 -0.64 -0.08 0.00 0.82 0.00 0.00 66.70 67.00 1t6n h VAL 71 Cb 0.33 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1t6n h VAL 71 CO 0.00 0.23 -0.22 1.56 0.02 0.00 0.00 177.57 179.16 1t6n h GLN 72 N 0.53 0.37 -0.20 1.57 4.20 -1.72 0.36 115.11 120.23 1t6n h GLN 72 Ca 0.14 -0.12 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 1t6n h GLN 72 Cb 0.21 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1t6n h GLN 72 CO -0.01 0.58 -0.29 1.25 -0.67 0.00 0.00 178.83 179.69 1t6n h HIS 73 N 0.34 0.45 0.08 2.96 2.76 -0.90 -2.51 115.15 118.33 1t6n h HIS 73 Ca 0.06 -0.10 -0.30 0.00 -2.20 0.00 0.00 60.37 57.82 1t6n h HIS 73 Cb 0.58 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 29.41 1t6n h HIS 73 CO 0.01 0.65 -1.60 0.93 -1.30 0.00 0.00 177.93 176.63 1t6n h GLU 74 N 0.35 0.17 0.07 5.26 4.39 -0.91 -3.42 114.58 120.50 1t6n h GLU 74 Ca 0.05 -0.29 -0.22 0.00 0.34 0.00 0.00 59.36 59.24 1t6n h GLU 74 Cb 0.69 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.44 1t6n h GLU 74 CO 0.05 0.97 -1.12 0.00 -1.16 0.00 0.00 179.01 177.75 1t6n h ILE 76 N -0.56 0.47 -0.85 0.00 2.04 -1.67 0.13 117.51 117.07 1t6n h ILE 76 Ca -0.26 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.73 1t6n h ILE 76 Cb 1.54 0.47 -0.06 0.00 -0.74 0.00 0.00 36.82 38.03 1t6n h ILE 76 CO -0.00 0.00 0.55 -0.65 0.00 0.00 0.00 178.15 178.05 1t6n h PRO 77 N -0.06 0.68 0.19 2.37 0.11 -1.80 0.38 132.00 133.86 1t6n h PRO 77 Ca 0.21 -0.04 -0.34 0.00 0.11 0.00 0.00 66.00 65.95 1t6n h PRO 77 Cb 0.39 -0.15 0.01 0.00 0.11 0.00 0.00 31.00 31.36 1t6n h PRO 77 CO -0.49 0.45 -1.63 1.96 -0.21 0.00 0.00 178.00 178.08 1t6n h GLN 78 N 0.70 0.41 -0.66 1.05 4.20 -1.68 -3.32 115.11 115.81 1t6n h GLN 78 Ca 0.42 -0.70 -0.02 0.00 0.06 0.00 0.00 58.65 58.41 1t6n h GLN 78 Cb 0.63 0.26 -0.03 0.00 0.30 0.00 0.00 27.48 28.64 1t6n h GLN 78 CO -0.18 1.32 0.33 0.00 -0.67 0.00 0.00 178.83 179.63 1t6n h ALA 79 N 0.21 1.34 0.00 3.87 0.00 -0.54 -1.38 119.26 122.75 1t6n h ALA 79 Ca -0.30 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1t6n h ALA 79 Cb 2.10 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.62 1t6n h ALA 79 CO 0.20 0.52 -0.07 0.97 0.00 0.00 0.00 179.25 180.88 1t6n h ILE 80 N 0.93 0.32 -0.11 0.00 2.10 -1.05 -1.22 117.51 118.49 1t6n h ILE 80 Ca 0.23 -0.43 0.00 0.00 1.08 0.00 0.00 64.86 65.75 1t6n h ILE 80 Cb 0.08 1.32 0.00 0.00 -1.09 0.00 0.00 36.82 37.12 1t6n h ILE 80 CO -0.03 0.07 0.00 0.18 -1.08 0.00 0.00 178.15 177.29 1t6n n LEU 81 N -3.40 1.43 0.00 2.19 4.77 -0.55 -4.83 117.00 116.61 1t6n n LEU 81 Ca -0.01 -0.57 0.00 0.00 -0.03 0.00 0.00 56.01 55.40 1t6n n LEU 81 Cb 0.22 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1t6n n LEU 81 CO 0.27 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 1t6n n GLY 82 N 1.11 0.75 3.76 -0.72 0.00 -0.46 -5.06 105.19 104.57 1t6n n GLY 82 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1t6n n GLY 82 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1t6n s MET 83 N -0.61 3.63 0.49 1.61 -1.94 -1.06 -4.62 119.30 116.81 1t6n s MET 83 Ca 0.00 1.97 -0.19 0.00 -1.71 0.00 0.00 55.69 55.76 1t6n s MET 83 Cb 0.00 -2.44 -0.08 0.00 2.01 0.00 0.00 34.83 34.32 1t6n s MET 83 CO 0.00 -0.71 1.02 -0.51 -0.01 0.00 0.00 175.02 174.80 1t6n s ASP 84 N -1.13 6.41 -0.00 3.03 1.01 -1.26 -4.59 116.67 120.15 1t6n s ASP 84 Ca 0.64 1.82 0.00 0.00 0.71 0.00 0.00 52.55 55.73 1t6n s ASP 84 Cb -0.34 -2.55 -0.00 0.00 1.01 0.00 0.00 42.92 41.05 1t6n s ASP 84 CO 0.41 -0.73 -0.00 -0.69 0.21 0.00 0.00 175.17 174.36 1t6n s VAL 85 N -2.16 0.03 -0.20 -1.27 1.01 -0.58 -1.19 120.40 116.04 1t6n s VAL 85 Ca 0.65 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.61 1t6n s VAL 85 Cb -0.14 -0.04 0.05 0.00 0.00 0.00 0.00 36.38 36.25 1t6n s VAL 85 CO 0.22 0.01 -0.07 -0.22 0.00 0.00 0.00 175.10 175.04 1t6n s LEU 86 N -0.00 2.13 -0.04 3.92 2.96 -0.49 -0.56 118.68 126.59 1t6n s LEU 86 Ca 0.00 -0.89 0.02 0.00 -0.22 0.00 0.00 54.13 53.04 1t6n s LEU 86 Cb -0.00 -1.12 0.01 0.00 0.50 0.00 0.00 46.19 45.58 1t6n s LEU 86 CO -0.00 -0.18 -0.08 0.00 -1.32 0.00 0.00 176.35 174.77 1t6n s GLN 88 N 0.59 3.10 -0.12 0.00 0.74 0.15 -1.75 119.66 122.37 1t6n s GLN 88 Ca -0.10 -0.77 -0.11 0.00 0.05 0.00 0.00 55.36 54.43 1t6n s GLN 88 Cb -0.13 -2.68 0.03 0.00 1.10 0.00 0.00 33.01 31.33 1t6n s GLN 88 CO 0.01 -0.19 0.32 0.00 -0.55 0.00 0.00 175.29 174.88 1t6n s ALA 89 N 1.30 -0.78 0.93 1.58 0.00 -0.77 -0.60 121.76 123.42 1t6n s ALA 89 Ca 0.04 0.89 -0.11 0.00 0.00 0.00 0.00 51.96 52.79 1t6n s ALA 89 Cb -0.14 -0.52 0.15 0.00 0.00 0.00 0.00 23.12 22.62 1t6n s ALA 89 CO -0.09 -0.15 1.11 0.15 0.00 0.00 0.00 175.76 176.78 1t6n s LYS 90 N 0.18 0.89 0.32 0.00 1.02 -1.26 -3.93 119.74 116.97 1t6n s LYS 90 Ca -0.00 1.32 -0.29 0.00 0.02 0.00 0.00 55.97 57.01 1t6n s LYS 90 Cb -0.02 -1.73 -0.12 0.00 -0.52 0.00 0.00 37.83 35.44 1t6n s LYS 90 CO 0.00 -2.64 1.46 0.45 -0.92 0.00 0.00 175.35 173.70 1t6n n SER 91 N -4.22 3.42 0.00 2.83 2.88 -1.26 -2.23 113.62 115.03 1t6n n SER 91 Ca 0.10 1.19 0.00 0.00 -1.33 0.00 0.00 58.87 58.82 1t6n n SER 91 Cb 0.53 -1.55 0.00 0.00 -0.75 0.00 0.00 64.21 62.44 1t6n n SER 91 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1t6n n GLY 92 N 1.31 0.83 0.00 0.46 0.00 -1.26 -4.94 105.19 101.60 1t6n n GLY 92 Ca 0.06 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.22 1t6n n GLY 92 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1t6n n MET 93 N -2.00 0.16 -2.07 1.61 2.81 -0.95 -4.93 117.12 111.75 1t6n n MET 93 Ca 0.00 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 1t6n n MET 93 Cb 0.00 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.01 1t6n n MET 93 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1t6n n GLY 94 N 1.36 0.89 0.08 3.03 0.00 -1.26 -4.51 105.19 104.77 1t6n n GLY 94 Ca 0.10 -0.55 -0.13 0.00 0.00 0.00 0.00 46.02 45.44 1t6n n GLY 94 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1t6n h LYS 95 N 0.00 -0.09 -0.55 1.61 1.57 -1.91 -2.39 116.57 114.80 1t6n h LYS 95 Ca 0.00 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1t6n h LYS 95 Cb 0.85 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.14 1t6n h LYS 95 CO 0.00 -0.06 0.31 1.15 -0.57 0.00 0.00 179.45 180.27 1t6n h THR 96 N -0.10 0.99 -0.42 -0.16 2.02 -2.00 -1.19 112.91 112.06 1t6n h THR 96 Ca -0.01 -0.20 0.04 0.00 0.77 0.00 0.00 66.41 67.01 1t6n h THR 96 Cb 0.08 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 66.82 1t6n h THR 96 CO 0.01 0.11 0.28 0.00 0.37 0.00 0.00 175.52 176.29 1t6n h ALA 97 N 1.28 1.90 0.42 6.16 0.00 -1.92 0.30 119.26 127.40 1t6n h ALA 97 Ca 0.24 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1t6n h ALA 97 Cb 0.10 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1t6n h ALA 97 CO -0.14 0.04 -0.25 0.28 0.00 0.00 0.00 179.25 179.18 1t6n h VAL 98 N 0.39 0.48 0.00 0.00 2.07 -0.69 -1.05 116.25 117.45 1t6n h VAL 98 Ca 0.18 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.63 1t6n h VAL 98 Cb 0.21 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1t6n h VAL 98 CO -0.04 0.00 -0.33 2.19 0.02 0.00 0.00 177.57 179.41 1t6n h PHE 99 N -0.64 0.00 -0.04 1.57 -5.15 -1.36 -1.48 116.94 109.84 1t6n h PHE 99 Ca -0.05 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.71 1t6n h PHE 99 Cb 0.52 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.69 1t6n h PHE 99 CO -0.08 0.30 -0.03 0.28 -2.00 0.00 0.00 178.31 176.78 1t6n h VAL 100 N 0.00 1.36 -0.37 0.88 2.07 -0.91 -0.89 116.25 118.39 1t6n h VAL 100 Ca -0.01 -1.12 -0.06 0.00 0.82 0.00 0.00 66.70 66.33 1t6n h VAL 100 Cb 1.24 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 33.03 1t6n h VAL 100 CO 0.04 0.30 -0.00 -0.07 0.02 0.00 0.00 177.57 177.86 1t6n h LEU 101 N -0.35 0.65 -0.52 2.57 3.38 -1.23 -1.29 115.31 118.52 1t6n h LEU 101 Ca 0.01 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 1t6n h LEU 101 Cb 0.50 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1t6n h LEU 101 CO 0.01 0.80 0.32 0.00 0.09 0.00 0.00 178.44 179.66 1t6n h ALA 102 N 0.87 0.66 -0.01 1.53 0.00 -1.28 -1.56 119.26 119.47 1t6n h ALA 102 Ca 0.11 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 1t6n h ALA 102 Cb 0.47 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1t6n h ALA 102 CO 0.02 0.14 -0.68 1.79 0.00 0.00 0.00 179.25 180.52 1t6n h THR 103 N 0.69 1.47 -0.19 0.00 1.35 -1.07 -2.30 112.91 112.87 1t6n h THR 103 Ca 0.19 -2.29 -0.15 0.00 -0.55 0.00 0.00 66.41 63.60 1t6n h THR 103 Cb -0.02 2.23 -0.01 0.00 -1.73 0.00 0.00 68.15 68.62 1t6n h THR 103 CO -0.04 0.66 -0.53 -0.07 -0.25 0.00 0.00 175.52 175.29 1t6n h LEU 104 N 0.03 0.59 -0.67 3.87 3.38 -1.07 0.24 115.31 121.68 1t6n h LEU 104 Ca -0.01 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.59 1t6n h LEU 104 Cb 1.20 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 1t6n h LEU 104 CO 0.09 1.00 0.17 -0.61 0.09 0.00 0.00 178.44 179.18 1t6n h GLN 105 N 0.41 1.06 0.00 1.13 5.75 -1.12 -3.09 115.11 119.26 1t6n h GLN 105 Ca 0.01 -0.25 0.00 0.00 -0.15 0.00 0.00 58.65 58.26 1t6n h GLN 105 Cb 1.06 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.47 1t6n h GLN 105 CO 0.10 0.95 -0.55 1.04 -2.65 0.00 0.00 178.83 177.72 1t6n n GLN 106 N -4.29 0.25 -1.63 1.69 6.02 -0.88 -4.93 117.38 113.60 1t6n n GLN 106 Ca 0.04 0.08 -0.50 0.00 -0.01 0.00 0.00 57.00 56.61 1t6n n GLN 106 Cb 0.25 -1.67 -0.05 0.00 1.02 0.00 0.00 30.24 29.79 1t6n n GLN 106 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1t6n n LEU 107 N -2.03 2.32 -3.64 1.08 7.94 0.06 -4.93 117.00 117.81 1t6n n LEU 107 Ca 0.04 1.09 -0.27 0.00 -1.11 0.00 0.00 56.01 55.76 1t6n n LEU 107 Cb 0.42 -1.28 -0.10 0.00 0.53 0.00 0.00 43.42 42.99 1t6n n LEU 107 CO 0.35 -0.67 -0.08 -0.62 -1.11 0.00 0.00 177.39 175.26 1t6n n GLU 108 N 3.36 1.58 -1.59 1.96 1.02 -1.26 -5.04 120.64 120.66 1t6n n GLU 108 Ca 0.19 -4.17 -0.54 0.00 -0.02 0.00 0.00 57.16 52.62 1t6n n GLU 108 Cb 0.22 -2.07 -0.06 0.00 -0.02 0.00 0.00 31.44 29.51 1t6n n GLU 108 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1t6n n PRO 109 N 1.83 0.99 -3.90 3.49 -0.02 -1.26 -5.01 135.00 131.12 1t6n n PRO 109 Ca 0.24 0.36 -0.23 0.00 -2.02 0.00 0.00 63.50 61.85 1t6n n PRO 109 Cb 0.40 -1.99 -0.17 0.00 -0.02 0.00 0.00 33.50 31.73 1t6n n PRO 109 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1t6n s VAL 110 N 0.80 0.60 0.23 -1.45 1.01 -1.26 -5.11 120.40 115.21 1t6n s VAL 110 Ca 0.87 -0.04 -0.31 0.00 0.00 0.00 0.00 61.98 62.49 1t6n s VAL 110 Cb -1.01 -0.69 -0.14 0.00 0.00 0.00 0.00 36.38 34.54 1t6n s VAL 110 CO 0.51 0.29 1.38 0.41 0.00 0.00 0.00 175.10 177.68 1t6n n THR 111 N 4.87 0.95 0.00 3.92 -1.04 -1.26 -2.22 114.28 119.50 1t6n n THR 111 Ca -0.12 -0.24 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 1t6n n THR 111 Cb 0.50 -1.41 0.00 0.00 -1.82 0.00 0.00 70.33 67.60 1t6n n THR 111 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1t6n n GLY 112 N 2.13 2.39 3.31 3.41 0.00 -1.26 -5.03 105.19 110.14 1t6n n GLY 112 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 1t6n n GLY 112 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1t6n s GLN 113 N -0.25 1.40 -0.18 1.61 -2.07 -0.94 -4.91 119.66 114.32 1t6n s GLN 113 Ca 0.00 -1.13 -0.18 0.00 -1.82 0.00 0.00 55.36 52.23 1t6n s GLN 113 Cb 0.00 -1.66 -0.04 0.00 -1.09 0.00 0.00 33.01 30.22 1t6n s GLN 113 CO 0.00 0.41 0.48 0.08 -1.32 0.00 0.00 175.29 174.94 1t6n s VAL 114 N -0.96 5.15 -0.30 3.63 1.01 -1.25 -4.38 120.40 123.30 1t6n s VAL 114 Ca 0.10 0.90 0.04 0.00 0.00 0.00 0.00 61.98 63.01 1t6n s VAL 114 Cb -0.10 -3.81 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 1t6n s VAL 114 CO 0.04 0.23 0.33 -1.54 0.00 0.00 0.00 175.10 174.16 1t6n n SER 115 N 4.41 0.62 -3.89 3.32 3.41 -0.69 -3.55 113.62 117.25 1t6n n SER 115 Ca -0.06 -0.81 -0.23 0.00 -0.26 0.00 0.00 58.87 57.52 1t6n n SER 115 Cb 0.51 0.62 -0.17 0.00 -0.26 0.00 0.00 64.21 64.91 1t6n n SER 115 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1t6n s VAL 116 N -0.96 0.70 -0.13 -3.33 1.01 -1.02 -0.37 120.40 116.30 1t6n s VAL 116 Ca 0.03 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.85 1t6n s VAL 116 Cb 0.03 -0.73 0.02 0.00 0.00 0.00 0.00 36.38 35.70 1t6n s VAL 116 CO 0.11 0.28 -0.15 -0.22 0.00 0.00 0.00 175.10 175.12 1t6n s LEU 117 N 1.21 1.74 -0.07 3.92 2.96 -0.25 -1.29 118.68 126.90 1t6n s LEU 117 Ca -0.06 -0.48 0.04 0.00 -0.22 0.00 0.00 54.13 53.41 1t6n s LEU 117 Cb -0.14 -1.17 0.00 0.00 0.50 0.00 0.00 46.19 45.38 1t6n s LEU 117 CO -0.02 -0.02 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.11 1t6n s VAL 118 N 1.25 1.66 0.02 1.68 1.01 -0.13 0.06 120.40 125.95 1t6n s VAL 118 Ca -0.00 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.20 1t6n s VAL 118 Cb -0.14 -1.44 -0.02 0.00 0.00 0.00 0.00 36.38 34.78 1t6n s VAL 118 CO -0.07 0.47 -0.10 -0.04 0.00 0.00 0.00 175.10 175.37 1t6n s MET 119 N 0.31 0.68 0.28 2.72 -1.94 0.47 -1.55 119.30 120.27 1t6n s MET 119 Ca -0.13 -0.58 0.03 0.00 -1.71 0.00 0.00 55.69 53.30 1t6n s MET 119 Cb -0.16 -0.61 -0.01 0.00 2.01 0.00 0.00 34.83 36.06 1t6n s MET 119 CO 0.05 0.15 0.31 0.00 -0.01 0.00 0.00 175.02 175.53 1t6n h HIS 121 N 1.87 0.00 -3.64 0.00 2.76 -1.80 -3.42 115.15 110.92 1t6n h HIS 121 Ca -0.21 0.00 -0.51 0.00 -2.20 0.00 0.00 60.37 57.45 1t6n h HIS 121 Cb 0.99 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.93 1t6n h HIS 121 CO 0.00 0.00 0.31 0.95 -1.30 0.00 0.00 177.93 177.89 1t6n s THR 122 N -2.09 4.28 0.26 6.26 -4.23 -1.26 -4.98 115.64 113.89 1t6n s THR 122 Ca -0.12 1.99 -0.05 0.00 -1.18 0.00 0.00 61.69 62.34 1t6n s THR 122 Cb 0.02 -4.28 0.26 0.00 1.34 0.00 0.00 72.50 69.83 1t6n s THR 122 CO 0.18 0.44 1.94 -0.09 -0.54 0.00 0.00 174.62 176.55 1t6n h ARG 123 N 4.68 1.25 -0.71 3.99 2.43 -1.96 -2.75 114.38 121.31 1t6n h ARG 123 Ca -0.45 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 58.59 1t6n h ARG 123 Cb 1.20 -0.28 -0.03 0.00 -0.42 0.00 0.00 29.97 30.44 1t6n h ARG 123 CO 0.69 0.83 0.22 0.93 -1.51 0.00 0.00 179.97 181.13 1t6n h GLU 124 N 1.29 1.11 -0.60 0.20 3.07 -2.00 -2.68 114.58 114.96 1t6n h GLU 124 Ca 0.36 -0.24 -0.07 0.00 -0.50 0.00 0.00 59.36 58.90 1t6n h GLU 124 Cb -0.13 -0.16 -0.03 0.00 -0.84 0.00 0.00 28.75 27.60 1t6n h GLU 124 CO -0.08 0.95 0.09 1.25 -1.40 0.00 0.00 179.01 179.82 1t6n h LEU 125 N 1.05 0.93 -0.66 1.33 5.85 -1.91 -1.96 115.31 119.94 1t6n h LEU 125 Ca 0.23 -0.21 0.06 0.00 0.84 0.00 0.00 57.88 58.80 1t6n h LEU 125 Cb 0.31 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 1t6n h LEU 125 CO -0.01 0.94 0.36 0.00 -0.34 0.00 0.00 178.44 179.39 1t6n h ALA 126 N 1.17 0.88 -0.03 1.25 0.00 -1.21 -0.30 119.26 121.03 1t6n h ALA 126 Ca 0.18 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 1t6n h ALA 126 Cb 0.42 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1t6n h ALA 126 CO 0.01 0.03 -0.55 0.74 0.00 0.00 0.00 179.25 179.48 1t6n h PHE 127 N 0.66 0.09 -0.01 0.00 -1.00 -1.24 -2.68 116.94 112.76 1t6n h PHE 127 Ca 0.30 -0.03 -0.16 0.00 2.81 0.00 0.00 57.97 60.89 1t6n h PHE 127 Cb 0.20 -0.02 -0.02 0.00 3.61 0.00 0.00 35.95 39.72 1t6n h PHE 127 CO -0.08 0.60 -0.73 1.96 -1.61 0.00 0.00 178.31 178.45 1t6n h GLN 128 N 0.06 0.07 -0.68 1.51 1.08 -0.68 -2.47 115.11 114.00 1t6n h GLN 128 Ca -0.00 -0.07 -0.07 0.00 -1.45 0.00 0.00 58.65 57.06 1t6n h GLN 128 Cb 0.98 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 28.40 1t6n h GLN 128 CO 0.08 0.77 0.15 0.82 -0.95 0.00 0.00 178.83 179.70 1t6n h ILE 129 N 0.05 1.26 -0.81 2.54 2.04 -0.94 -1.23 117.51 120.41 1t6n h ILE 129 Ca -0.01 -0.97 -0.02 0.00 1.00 0.00 0.00 64.86 64.86 1t6n h ILE 129 Cb 1.29 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 37.91 1t6n h ILE 129 CO 0.10 0.37 0.45 -1.28 0.00 0.00 0.00 178.15 177.79 1t6n h SER 130 N 1.03 1.01 -0.74 1.72 0.87 -1.27 -1.28 113.55 114.89 1t6n h SER 130 Ca 0.21 -0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.65 1t6n h SER 130 Cb 0.38 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 62.05 1t6n h SER 130 CO 0.00 0.82 0.35 0.11 -0.53 0.00 0.00 176.83 177.59 1t6n h LYS 131 N 1.13 1.07 -0.19 2.24 1.79 -0.94 -1.00 116.57 120.67 1t6n h LYS 131 Ca 0.29 -0.16 0.01 0.00 -2.18 0.00 0.00 60.65 58.60 1t6n h LYS 131 Cb 0.03 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.48 1t6n h LYS 131 CO -0.05 0.84 0.11 0.93 -1.08 0.00 0.00 179.45 180.21 1t6n h GLU 132 N 1.04 0.23 -0.05 3.15 4.39 -0.66 0.81 114.58 123.49 1t6n h GLU 132 Ca 0.25 -0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.95 1t6n h GLU 132 Cb 0.12 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 1t6n h GLU 132 CO -0.03 0.15 0.00 1.88 -1.16 0.00 0.00 179.01 179.85 1t6n h TYR 133 N 0.24 0.00 -0.48 4.33 -1.99 -0.87 -1.73 116.97 116.46 1t6n h TYR 133 Ca 0.07 0.00 0.06 0.00 2.00 0.00 0.00 58.73 60.87 1t6n h TYR 133 Cb -0.01 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 38.67 1t6n h TYR 133 CO -0.08 -0.00 0.18 0.93 -0.00 0.00 0.00 178.16 179.19 1t6n h GLU 134 N 0.02 0.34 -0.06 4.88 5.08 -0.93 -1.06 114.58 122.85 1t6n h GLU 134 Ca 0.02 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1t6n h GLU 134 Cb 0.02 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.16 1t6n h GLU 134 CO -0.03 0.23 -0.13 -0.09 -1.00 0.00 0.00 179.01 177.98 1t6n h ARG 135 N 0.35 -0.19 -0.00 2.33 2.43 -0.54 -2.88 114.38 115.89 1t6n h ARG 135 Ca 0.23 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 1t6n h ARG 135 Cb 0.23 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1t6n h ARG 135 CO -0.23 -0.13 -0.12 1.19 -1.51 0.00 0.00 179.97 179.18 1t6n n PHE 136 N -5.27 0.00 -0.62 2.20 0.99 -0.68 -3.06 117.46 111.02 1t6n n PHE 136 Ca -0.04 0.00 0.09 0.00 -0.00 0.00 0.00 57.45 57.50 1t6n n PHE 136 Cb 0.19 -0.24 0.33 0.00 -1.00 0.00 0.00 39.48 38.76 1t6n n PHE 136 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1t6n n SER 137 N -1.10 4.49 -0.33 4.37 3.41 -0.42 -4.62 113.62 119.41 1t6n n SER 137 Ca 0.13 -2.46 0.24 0.00 -0.26 0.00 0.00 58.87 56.51 1t6n n SER 137 Cb 0.28 -0.54 0.47 0.00 -0.26 0.00 0.00 64.21 64.16 1t6n n SER 137 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1t6n h LYS 138 N 3.62 0.22 -0.53 4.33 3.64 -1.44 0.28 116.57 126.68 1t6n h LYS 138 Ca 0.00 -0.01 -0.17 0.00 -1.27 0.00 0.00 60.65 59.20 1t6n h LYS 138 Cb 1.38 -0.05 -0.10 0.00 -0.41 0.00 0.00 32.23 33.05 1t6n h LYS 138 CO 0.21 0.14 0.14 0.66 -2.27 0.00 0.00 179.45 178.33 1t6n n TYR 139 N -5.14 1.75 -3.19 1.91 0.53 -1.26 -4.52 117.16 107.24 1t6n n TYR 139 Ca 0.31 -1.25 -0.23 0.00 -1.02 0.00 0.00 57.90 55.71 1t6n n TYR 139 Cb 1.00 -0.56 -0.05 0.00 -1.03 0.00 0.00 39.34 38.70 1t6n n TYR 139 CO 0.00 0.00 0.00 -1.33 -1.02 0.00 0.00 176.86 174.51 1t6n n MET 140 N -0.55 1.68 -0.41 -0.72 2.81 0.98 -4.91 117.12 115.99 1t6n n MET 140 Ca 0.35 -3.90 0.36 0.00 -1.81 0.00 0.00 57.70 52.70 1t6n n MET 140 Cb 1.19 -1.78 0.70 0.00 -0.71 0.00 0.00 33.22 32.62 1t6n n MET 140 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1t6n h PRO 141 N 3.53 0.08 0.00 0.03 0.11 -1.80 -1.93 132.00 132.03 1t6n h PRO 141 Ca 0.12 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1t6n h PRO 141 Cb 0.78 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.88 1t6n h PRO 141 CO 0.62 0.06 0.00 -0.91 -0.21 0.00 0.00 178.00 177.56 1t6n h ASN 142 N 0.09 0.00 -3.10 -2.05 2.35 -1.94 -3.45 115.58 107.48 1t6n h ASN 142 Ca 0.68 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.88 1t6n h ASN 142 Cb 2.44 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 40.79 1t6n h ASN 142 CO -0.13 0.00 0.67 -0.69 -1.65 0.00 0.00 177.43 175.64 1t6n s VAL 143 N -3.21 4.20 -0.00 2.81 1.01 -0.73 -4.98 120.40 119.50 1t6n s VAL 143 Ca 0.08 1.54 0.08 0.00 0.00 0.00 0.00 61.98 63.68 1t6n s VAL 143 Cb 0.09 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.46 1t6n s VAL 143 CO 0.60 0.02 -0.25 -0.54 0.00 0.00 0.00 175.10 174.94 1t6n s LYS 144 N 1.98 2.04 0.04 2.72 -0.14 -1.26 -5.00 119.74 120.12 1t6n s LYS 144 Ca 0.57 -0.97 0.06 0.00 -1.36 0.00 0.00 55.97 54.27 1t6n s LYS 144 Cb -0.26 -2.05 -0.02 0.00 -1.68 0.00 0.00 37.83 33.82 1t6n s LYS 144 CO 0.24 0.55 -0.18 0.08 -0.76 0.00 0.00 175.35 175.28 1t6n s VAL 145 N -0.68 1.42 0.04 3.17 1.01 -1.26 -0.63 120.40 123.47 1t6n s VAL 145 Ca 0.11 -1.10 0.03 0.00 0.00 0.00 0.00 61.98 61.02 1t6n s VAL 145 Cb -0.10 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 35.01 1t6n s VAL 145 CO 0.00 0.12 -0.09 0.00 0.00 0.00 0.00 175.10 175.13 1t6n s ALA 146 N -0.81 0.73 -0.14 5.51 0.00 -0.19 -4.98 121.76 121.88 1t6n s ALA 146 Ca 0.05 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.23 1t6n s ALA 146 Cb -0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.02 1t6n s ALA 146 CO 0.01 0.05 -0.15 0.08 0.00 0.00 0.00 175.76 175.75 1t6n s VAL 147 N -1.23 2.77 -0.51 0.00 1.01 -1.26 -0.60 120.40 120.58 1t6n s VAL 147 Ca -0.07 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.20 1t6n s VAL 147 Cb -0.09 -2.16 0.15 0.00 0.00 0.00 0.00 36.38 34.28 1t6n s VAL 147 CO 0.01 0.52 0.33 -0.36 0.00 0.00 0.00 175.10 175.60 1t6n s PHE 148 N 0.60 2.25 -0.61 5.22 2.99 0.12 -4.94 117.98 123.60 1t6n s PHE 148 Ca -0.09 -2.68 0.16 0.00 0.00 0.00 0.00 56.93 54.33 1t6n s PHE 148 Cb -0.16 -1.91 0.65 0.00 0.00 0.00 0.00 43.02 41.60 1t6n s PHE 148 CO 0.03 -0.73 1.56 0.34 -0.00 0.00 0.00 175.22 176.43 1t6n n PHE 149 N 2.93 1.38 -4.30 0.36 7.35 -1.26 -2.41 117.46 121.50 1t6n n PHE 149 Ca 0.17 -0.71 0.00 0.00 -0.76 0.00 0.00 57.45 56.15 1t6n n PHE 149 Cb 0.38 -0.31 0.00 0.00 0.35 0.00 0.00 39.48 39.90 1t6n n PHE 149 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1t6n n GLY 150 N 0.47 -1.44 0.27 7.13 0.00 -1.26 -4.78 105.19 105.58 1t6n n GLY 150 Ca 0.24 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 45.00 1t6n n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t6n n GLY 151 N 0.00 2.97 3.69 -0.02 0.00 -1.26 -5.01 105.19 105.56 1t6n n GLY 151 Ca 0.00 -0.33 -0.30 0.00 0.00 0.00 0.00 46.02 45.39 1t6n n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t6n s LEU 152 N 0.00 2.59 0.13 0.99 1.43 -1.26 -5.09 118.68 117.48 1t6n s LEU 152 Ca 0.00 -1.51 -0.34 0.00 -1.03 0.00 0.00 54.13 51.25 1t6n s LEU 152 Cb 0.00 -0.82 -0.14 0.00 0.03 0.00 0.00 46.19 45.26 1t6n s LEU 152 CO 0.00 -0.65 1.57 -0.24 0.23 0.00 0.00 176.35 177.27 1t6n n SER 153 N -1.11 2.95 0.29 2.29 2.88 -1.26 -4.84 113.62 114.82 1t6n n SER 153 Ca -0.12 1.08 0.16 0.00 -1.33 0.00 0.00 58.87 58.66 1t6n n SER 153 Cb 0.67 -1.39 0.89 0.00 -0.75 0.00 0.00 64.21 63.63 1t6n n SER 153 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 1t6n h ILE 154 N 3.73 0.40 -0.76 2.46 2.10 -2.01 -2.03 117.51 121.41 1t6n h ILE 154 Ca -0.45 -0.24 0.07 0.00 1.08 0.00 0.00 64.86 65.31 1t6n h ILE 154 Cb 1.26 1.17 -0.05 0.00 -1.09 0.00 0.00 36.82 38.11 1t6n h ILE 154 CO 0.88 0.05 0.50 0.11 -1.08 0.00 0.00 178.15 178.60 1t6n h LYS 155 N 0.00 0.77 -0.69 2.19 1.79 -1.99 0.13 116.57 118.77 1t6n h LYS 155 Ca -0.00 -0.05 -0.07 0.00 -2.18 0.00 0.00 60.65 58.35 1t6n h LYS 155 Cb 0.16 -0.17 -0.03 0.00 -1.58 0.00 0.00 32.23 30.61 1t6n h LYS 155 CO 0.01 0.51 0.16 0.87 -1.08 0.00 0.00 179.45 179.91 1t6n h LYS 156 N 0.79 1.10 -0.24 3.15 1.57 -1.73 0.98 116.57 122.19 1t6n h LYS 156 Ca 0.33 -0.27 -0.12 0.00 -1.87 0.00 0.00 60.65 58.73 1t6n h LYS 156 Cb 0.27 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1t6n h LYS 156 CO -0.11 0.98 -0.35 -0.44 -0.57 0.00 0.00 179.45 178.96 1t6n h ASP 157 N 1.05 0.54 -0.36 0.86 3.32 -1.27 -2.41 116.42 118.14 1t6n h ASP 157 Ca 0.22 -0.22 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 1t6n h ASP 157 Cb 0.38 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1t6n h ASP 157 CO 0.00 0.85 0.00 -0.33 -1.72 0.00 0.00 179.24 178.04 1t6n h GLU 158 N 0.44 0.73 -0.97 3.56 5.08 -0.32 -2.57 114.58 120.52 1t6n h GLU 158 Ca 0.05 -0.19 0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1t6n h GLU 158 Cb 0.82 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.92 1t6n h GLU 158 CO 0.07 0.74 0.64 1.49 -1.00 0.00 0.00 179.01 180.95 1t6n h GLU 159 N 0.69 1.22 0.10 2.33 4.81 -0.32 -1.74 114.58 121.66 1t6n h GLU 159 Ca 0.14 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1t6n h GLU 159 Cb 0.42 -0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.53 1t6n h GLU 159 CO 0.02 0.80 -0.05 0.28 -0.73 0.00 0.00 179.01 179.33 1t6n h VAL 160 N 1.25 1.03 0.00 0.32 2.07 -1.27 -2.77 116.25 116.88 1t6n h VAL 160 Ca 0.38 -0.47 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 1t6n h VAL 160 Cb -0.03 1.33 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1t6n h VAL 160 CO -0.11 0.12 -0.07 -0.07 0.02 0.00 0.00 177.57 177.46 1t6n h LEU 161 N -0.35 0.00 -0.14 2.57 4.07 -1.30 0.57 115.31 120.72 1t6n h LEU 161 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1t6n h LEU 161 Cb 0.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.03 1t6n h LEU 161 CO 0.02 0.07 -0.44 1.17 -1.08 0.00 0.00 178.44 178.18 1t6n n LYS 162 N -3.56 0.24 0.00 1.13 4.81 -0.68 -4.13 118.16 115.97 1t6n n LYS 162 Ca -0.02 -0.14 0.00 0.00 -0.87 0.00 0.00 58.31 57.28 1t6n n LYS 162 Cb 0.19 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.74 1t6n n LYS 162 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1t6n n LYS 163 N -1.26 0.21 -2.94 1.64 5.02 -0.91 -4.93 118.16 115.01 1t6n n LYS 163 Ca 0.07 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.15 1t6n n LYS 163 Cb 0.34 -0.74 -0.02 0.00 -0.02 0.00 0.00 35.03 34.59 1t6n n LYS 163 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1t6n n ASN 164 N -1.90 2.65 -4.62 4.39 3.02 0.19 -5.08 115.26 113.91 1t6n n ASN 164 Ca 0.00 -3.29 -0.52 0.00 -0.03 0.00 0.00 54.58 50.74 1t6n n ASN 164 Cb 0.24 -0.57 -0.06 0.00 -0.61 0.00 0.00 39.78 38.78 1t6n n ASN 164 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1t6n s PRO 166 N 4.60 2.84 0.08 0.00 0.04 -1.26 -4.50 135.00 136.80 1t6n s PRO 166 Ca 1.00 0.67 0.18 0.00 0.04 0.00 0.00 61.00 62.89 1t6n s PRO 166 Cb -0.86 -2.00 -0.12 0.00 0.04 0.00 0.00 34.50 31.57 1t6n s PRO 166 CO 0.55 -1.09 0.84 0.72 0.04 0.00 0.00 177.00 178.06 1t6n n HIS 167 N -3.08 0.92 -4.38 0.56 8.25 0.20 -3.82 115.22 113.86 1t6n n HIS 167 Ca 0.07 0.30 -0.26 0.00 -0.26 0.00 0.00 57.72 57.56 1t6n n HIS 167 Cb 0.56 -1.03 -0.17 0.00 1.12 0.00 0.00 29.99 30.46 1t6n n HIS 167 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1t6n s ILE 168 N -3.04 1.18 -0.07 1.59 1.01 -0.56 -1.70 121.20 119.61 1t6n s ILE 168 Ca -0.03 -0.46 0.04 0.00 0.00 0.00 0.00 60.65 60.20 1t6n s ILE 168 Cb 0.09 -1.10 -0.02 0.00 0.01 0.00 0.00 42.46 41.44 1t6n s ILE 168 CO 0.81 0.37 -0.19 -0.69 0.00 0.00 0.00 174.94 175.24 1t6n s VAL 169 N 1.00 2.55 -0.08 2.92 1.01 -0.41 -1.02 120.40 126.38 1t6n s VAL 169 Ca -0.08 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.05 1t6n s VAL 169 Cb -0.15 -1.99 0.01 0.00 0.00 0.00 0.00 36.38 34.25 1t6n s VAL 169 CO -0.00 0.56 -0.16 -0.69 0.00 0.00 0.00 175.10 174.81 1t6n s VAL 170 N -0.17 1.43 0.00 2.92 1.01 0.23 -0.95 120.40 124.87 1t6n s VAL 170 Ca -0.02 -0.65 -0.05 0.00 0.00 0.00 0.00 61.98 61.26 1t6n s VAL 170 Cb -0.14 -1.27 0.02 0.00 0.00 0.00 0.00 36.38 34.99 1t6n s VAL 170 CO 0.04 0.42 0.23 0.61 0.00 0.00 0.00 175.10 176.39 1t6n n GLY 171 N 3.72 0.67 3.88 4.51 0.00 -0.60 0.12 105.19 117.49 1t6n n GLY 171 Ca -0.22 -0.89 -0.33 0.00 0.00 0.00 0.00 46.02 44.58 1t6n n GLY 171 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t6n s THR 172 N -2.19 5.12 0.18 2.61 2.01 -1.01 -2.75 115.64 119.60 1t6n s THR 172 Ca 0.05 0.28 -0.19 0.00 0.31 0.00 0.00 61.69 62.15 1t6n s THR 172 Cb -0.00 -3.63 0.12 0.00 0.01 0.00 0.00 72.50 68.99 1t6n s THR 172 CO 0.00 0.18 1.62 -0.65 -0.69 0.00 0.00 174.62 175.08 1t6n h PRO 173 N 3.32 -0.12 -0.38 4.92 0.11 -1.92 -1.38 132.00 136.55 1t6n h PRO 173 Ca -0.48 0.01 0.08 0.00 0.11 0.00 0.00 66.00 65.72 1t6n h PRO 173 Cb 1.18 0.03 -0.09 0.00 0.11 0.00 0.00 31.00 32.23 1t6n h PRO 173 CO 0.69 -0.08 -0.25 0.78 -0.21 0.00 0.00 178.00 178.93 1t6n h GLY 174 N -0.13 -0.05 1.11 -0.55 0.00 -1.95 0.10 103.07 101.61 1t6n h GLY 174 Ca 0.21 0.31 -0.17 0.00 0.00 0.00 0.00 47.33 47.69 1t6n h GLY 174 CO -0.53 -0.20 -0.44 -0.09 0.00 0.00 0.00 176.54 175.28 1t6n h ARG 175 N -0.19 0.88 -0.37 4.80 9.65 -1.81 -2.04 114.38 125.30 1t6n h ARG 175 Ca 0.18 -0.51 -0.00 0.00 -1.10 0.00 0.00 59.98 58.55 1t6n h ARG 175 Cb 0.48 0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.08 1t6n h ARG 175 CO -0.49 1.15 0.22 0.82 2.80 0.00 0.00 179.97 184.47 1t6n h ILE 176 N 0.68 1.12 -0.82 1.20 1.08 -0.91 -0.96 117.51 118.90 1t6n h ILE 176 Ca 0.04 -0.29 -0.03 0.00 -0.39 0.00 0.00 64.86 64.19 1t6n h ILE 176 Cb 1.04 0.65 -0.04 0.00 -3.07 0.00 0.00 36.82 35.40 1t6n h ILE 176 CO 0.10 0.12 0.39 0.25 -0.69 0.00 0.00 178.15 178.33 1t6n h LEU 177 N 0.48 1.07 -0.26 1.44 5.85 -0.78 0.29 115.31 123.40 1t6n h LEU 177 Ca 0.13 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1t6n h LEU 177 Cb 0.01 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 1t6n h LEU 177 CO -0.02 0.90 0.11 0.00 -0.34 0.00 0.00 178.44 179.09 1t6n h ALA 178 N 1.21 0.34 -0.13 1.25 0.00 -1.02 0.41 119.26 121.32 1t6n h ALA 178 Ca 0.28 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1t6n h ALA 178 Cb 0.12 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1t6n h ALA 178 CO -0.04 -0.08 -0.16 -0.07 0.00 0.00 0.00 179.25 178.91 1t6n h LEU 179 N 0.27 0.19 -0.07 0.00 3.38 -0.89 -1.88 115.31 116.32 1t6n h LEU 179 Ca 0.09 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.88 1t6n h LEU 179 Cb 0.17 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.87 1t6n h LEU 179 CO -0.01 0.38 -0.49 0.00 0.09 0.00 0.00 178.44 178.41 1t6n h ALA 180 N 1.65 0.15 -0.79 1.53 0.00 -0.48 -0.47 119.26 120.85 1t6n h ALA 180 Ca 0.04 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1t6n h ALA 180 Cb 0.41 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1t6n h ALA 180 CO 0.03 0.33 0.42 0.00 0.00 0.00 0.00 179.25 180.03 1t6n h ARG 181 N -0.01 1.10 -0.09 0.00 3.08 0.12 -1.61 114.38 116.98 1t6n h ARG 181 Ca -0.04 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1t6n h ARG 181 Cb 1.15 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.99 1t6n h ARG 181 CO 0.10 0.82 0.00 0.27 -1.07 0.00 0.00 179.97 180.08 1t6n n ASN 182 N -4.34 0.62 0.00 7.04 0.23 -0.73 -4.89 115.26 113.19 1t6n n ASN 182 Ca 0.08 -1.72 0.00 0.00 -0.53 0.00 0.00 54.58 52.41 1t6n n ASN 182 Cb 0.11 -0.06 0.00 0.00 -2.08 0.00 0.00 39.78 37.75 1t6n n ASN 182 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1t6n n LYS 183 N -0.29 0.00 -0.21 -3.83 4.76 -0.61 -4.88 118.16 113.11 1t6n n LYS 183 Ca 0.10 0.00 -0.02 0.00 -2.87 0.00 0.00 58.31 55.53 1t6n n LYS 183 Cb 0.14 -2.08 0.09 0.00 -1.84 0.00 0.00 35.03 31.34 1t6n n LYS 183 CO 0.00 0.00 0.00 0.77 -1.37 0.00 0.00 177.40 176.80 1t6n h SER 184 N 0.00 0.41 -3.52 4.39 0.02 -1.50 -3.38 113.55 109.98 1t6n h SER 184 Ca 0.00 0.04 -0.72 0.00 -0.84 0.00 0.00 61.79 60.28 1t6n h SER 184 Cb 0.00 -0.03 -0.21 0.00 0.14 0.00 0.00 62.40 62.30 1t6n h SER 184 CO 0.00 0.26 -0.44 -0.22 -1.14 0.00 0.00 176.83 175.30 1t6n s LEU 185 N -10.30 5.06 -0.36 5.07 2.96 -0.29 -4.88 118.68 115.93 1t6n s LEU 185 Ca -0.13 -0.87 -0.23 0.00 -0.22 0.00 0.00 54.13 52.68 1t6n s LEU 185 Cb 0.16 -2.15 0.01 0.00 0.50 0.00 0.00 46.19 44.70 1t6n s LEU 185 CO 0.75 -0.43 0.78 0.21 -1.32 0.00 0.00 176.35 176.34 1t6n s ASN 186 N 1.68 6.56 -0.04 3.68 2.47 -1.26 -4.39 114.94 123.64 1t6n s ASN 186 Ca 0.05 0.38 0.20 0.00 0.42 0.00 0.00 52.86 53.90 1t6n s ASN 186 Cb -0.19 -2.40 0.63 0.00 -1.45 0.00 0.00 41.25 37.84 1t6n s ASN 186 CO 0.10 -0.72 1.53 0.18 -3.72 0.00 0.00 177.10 174.47 1t6n n LEU 187 N 6.40 4.08 0.00 3.21 4.77 -1.26 -4.49 117.00 129.72 1t6n n LEU 187 Ca 0.03 -2.16 0.00 0.00 -0.03 0.00 0.00 56.01 53.85 1t6n n LEU 187 Cb 0.48 -0.49 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1t6n n LEU 187 CO 0.53 0.90 0.47 0.29 -1.33 0.00 0.00 177.39 178.25 1t6n n LYS 188 N 1.30 0.91 0.00 3.23 5.02 -1.26 -3.09 118.16 124.27 1t6n n LYS 188 Ca 0.23 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.52 1t6n n LYS 188 Cb 0.69 -1.01 0.00 0.00 -0.02 0.00 0.00 35.03 34.69 1t6n n LYS 188 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1t6n n HIS 189 N -0.51 0.00 -2.05 2.13 8.25 -1.26 -4.67 115.22 117.11 1t6n n HIS 189 Ca 0.00 -0.26 -0.42 0.00 -0.26 0.00 0.00 57.72 56.78 1t6n n HIS 189 Cb 0.00 -0.03 -0.03 0.00 1.12 0.00 0.00 29.99 31.06 1t6n n HIS 189 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1t6n s ILE 190 N -0.52 3.28 -0.52 1.59 -1.09 -1.18 -4.26 121.20 118.51 1t6n s ILE 190 Ca 0.00 0.72 0.07 0.00 -2.23 0.00 0.00 60.65 59.21 1t6n s ILE 190 Cb 0.00 -3.47 -0.02 0.00 -1.58 0.00 0.00 42.46 37.39 1t6n s ILE 190 CO 0.00 0.00 0.44 0.29 -1.23 0.00 0.00 174.94 174.44 1t6n n LYS 191 N 5.39 3.11 -3.64 2.79 4.76 0.50 -4.32 118.16 126.76 1t6n n LYS 191 Ca 0.15 -0.34 -0.15 0.00 -2.87 0.00 0.00 58.31 55.09 1t6n n LYS 191 Cb 0.42 -0.92 -0.14 0.00 -1.84 0.00 0.00 35.03 32.54 1t6n n LYS 191 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 1t6n s HIS 192 N -1.23 -0.31 -0.29 2.13 3.76 -1.03 -0.82 115.29 117.49 1t6n s HIS 192 Ca 0.05 0.72 -0.03 0.00 -0.15 0.00 0.00 55.06 55.64 1t6n s HIS 192 Cb 0.05 -0.17 0.03 0.00 1.11 0.00 0.00 32.58 33.60 1t6n s HIS 192 CO 0.20 -0.36 0.02 0.12 -0.85 0.00 0.00 174.74 173.86 1t6n s PHE 193 N 2.36 3.19 -0.03 1.40 5.36 0.75 -1.09 117.98 129.92 1t6n s PHE 193 Ca 0.03 -1.55 0.05 0.00 -0.96 0.00 0.00 56.93 54.50 1t6n s PHE 193 Cb -0.13 -2.15 -0.01 0.00 -0.34 0.00 0.00 43.02 40.39 1t6n s PHE 193 CO -0.08 -0.73 -0.19 0.42 -1.46 0.00 0.00 175.22 173.18 1t6n s ILE 194 N 1.34 1.52 -0.09 3.12 1.01 0.11 -1.58 121.20 126.64 1t6n s ILE 194 Ca -0.02 -0.80 0.02 0.00 0.00 0.00 0.00 60.65 59.86 1t6n s ILE 194 Cb -0.18 -1.28 0.01 0.00 0.01 0.00 0.00 42.46 41.01 1t6n s ILE 194 CO -0.01 0.43 -0.16 -0.76 0.00 0.00 0.00 174.94 174.45 1t6n s LEU 195 N -0.26 1.77 0.05 2.97 1.43 -0.71 -0.40 118.68 123.53 1t6n s LEU 195 Ca 0.03 -0.39 0.07 0.00 -1.03 0.00 0.00 54.13 52.80 1t6n s LEU 195 Cb -0.09 -1.03 -0.03 0.00 0.03 0.00 0.00 46.19 45.06 1t6n s LEU 195 CO 0.01 0.06 -0.15 -0.62 0.23 0.00 0.00 176.35 175.87 1t6n s ASP 196 N 0.68 4.02 -1.41 2.29 -1.08 -0.20 -0.69 116.67 120.28 1t6n s ASP 196 Ca -0.13 -0.39 -0.06 0.00 -0.52 0.00 0.00 52.55 51.45 1t6n s ASP 196 Cb -0.16 -0.71 0.01 0.00 -1.46 0.00 0.00 42.92 40.59 1t6n s ASP 196 CO 0.03 0.24 0.83 -0.62 0.52 0.00 0.00 175.17 176.18 1t6n n GLU 197 N 1.38 -6.00 -0.10 4.34 1.02 0.76 -3.71 120.64 118.33 1t6n n GLU 197 Ca -0.16 0.84 0.11 0.00 -0.02 0.00 0.00 57.16 57.94 1t6n n GLU 197 Cb 0.52 -5.69 0.48 0.00 -0.02 0.00 0.00 31.44 26.73 1t6n n GLU 197 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1t6n h ASP 199 N 0.47 0.75 0.28 0.00 2.03 -1.83 -0.21 116.42 117.90 1t6n h ASP 199 Ca 0.29 -0.27 -0.09 0.00 -0.73 0.00 0.00 57.03 56.23 1t6n h ASP 199 Cb 0.51 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.79 1t6n h ASP 199 CO -0.08 0.95 -0.37 0.11 -1.03 0.00 0.00 179.24 178.82 1t6n h LYS 200 N 0.65 0.14 0.09 4.15 1.79 -1.79 -1.64 116.57 119.94 1t6n h LYS 200 Ca 0.09 -0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1t6n h LYS 200 Cb 0.73 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.37 1t6n h LYS 200 CO 0.06 0.50 -0.04 0.52 -1.08 0.00 0.00 179.45 179.40 1t6n h MET 201 N 0.12 -0.11 0.00 3.15 2.86 -1.30 -3.33 114.93 116.32 1t6n h MET 201 Ca 0.01 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1t6n h MET 201 Cb 0.72 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.40 1t6n h MET 201 CO 0.05 0.42 0.00 -0.07 1.06 0.00 0.00 176.91 178.37 1t6n h LEU 202 N -0.88 0.00 -0.75 1.22 3.38 -1.08 -3.14 115.31 114.07 1t6n h LEU 202 Ca -0.01 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1t6n h LEU 202 Cb 0.58 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 1t6n h LEU 202 CO 0.02 0.00 0.10 -0.08 0.09 0.00 0.00 178.44 178.56 1t6n h GLU 203 N 0.00 1.05 -5.84 1.13 4.81 -1.40 -3.41 114.58 110.92 1t6n h GLU 203 Ca 0.00 -0.28 -0.60 0.00 -0.13 0.00 0.00 59.36 58.36 1t6n h GLU 203 Cb 0.54 -0.13 -0.09 0.00 0.63 0.00 0.00 28.75 29.70 1t6n h GLU 203 CO 0.00 0.97 0.48 -0.65 -0.73 0.00 0.00 179.01 179.08 1t6n s GLN 204 N -5.17 4.08 0.23 1.92 -0.21 -1.19 -4.96 119.66 114.37 1t6n s GLN 204 Ca -0.11 0.82 -0.07 0.00 0.02 0.00 0.00 55.36 56.01 1t6n s GLN 204 Cb 0.15 -3.69 0.40 0.00 1.00 0.00 0.00 33.01 30.87 1t6n s GLN 204 CO 0.84 -0.62 1.68 1.25 -2.12 0.00 0.00 175.29 176.32 1t6n h LEU 205 N 9.38 -0.08 -0.57 2.90 7.12 -1.87 0.27 115.31 132.46 1t6n h LEU 205 Ca -0.23 0.15 -0.10 0.00 0.13 0.00 0.00 57.88 57.82 1t6n h LEU 205 Cb 1.09 0.22 -0.02 0.00 -0.53 0.00 0.00 40.66 41.42 1t6n h LEU 205 CO 0.89 -0.06 -0.04 -2.24 -0.13 0.00 0.00 178.44 176.86 1t6n h ASP 206 N 0.22 1.03 -0.18 1.25 2.03 -1.93 -1.37 116.42 117.47 1t6n h ASP 206 Ca 0.38 -0.33 -0.13 0.00 -0.73 0.00 0.00 57.03 56.23 1t6n h ASP 206 Cb 0.64 -0.28 -0.01 0.00 -0.83 0.00 0.00 39.33 38.85 1t6n h ASP 206 CO -0.51 1.11 -0.33 -0.03 -1.03 0.00 0.00 179.24 178.45 1t6n h MET 207 N 0.92 0.68 -0.23 4.15 4.05 -1.51 -2.54 114.93 120.45 1t6n h MET 207 Ca 0.16 -0.32 -0.00 0.00 -0.28 0.00 0.00 59.70 59.26 1t6n h MET 207 Cb 0.61 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.39 1t6n h MET 207 CO 0.04 0.92 0.13 -0.09 0.23 0.00 0.00 176.91 178.13 1t6n h ARG 208 N 0.58 0.32 -0.93 0.39 2.43 -0.26 -1.49 114.38 115.42 1t6n h ARG 208 Ca 0.06 -0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1t6n h ARG 208 Cb 0.84 -0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 30.27 1t6n h ARG 208 CO 0.07 0.28 0.61 0.00 -1.51 0.00 0.00 179.97 179.42 1t6n h ARG 209 N 0.27 1.08 -0.34 0.20 2.47 -1.11 0.30 114.38 117.25 1t6n h ARG 209 Ca 0.08 -0.07 -0.03 0.00 -1.26 0.00 0.00 59.98 58.70 1t6n h ARG 209 Cb 0.06 -0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 28.12 1t6n h ARG 209 CO -0.01 0.72 0.09 -0.44 0.56 0.00 0.00 179.97 180.89 1t6n h ASP 210 N 1.12 0.51 -0.86 7.04 3.32 -1.09 -0.83 116.42 125.62 1t6n h ASP 210 Ca 0.38 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1t6n h ASP 210 Cb 0.10 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.48 1t6n h ASP 210 CO -0.13 0.60 0.50 0.58 -1.72 0.00 0.00 179.24 179.07 1t6n h VAL 211 N 0.40 1.24 -0.47 -1.35 2.07 -0.52 -1.11 116.25 116.51 1t6n h VAL 211 Ca 0.11 -0.56 -0.07 0.00 0.82 0.00 0.00 66.70 67.00 1t6n h VAL 211 Cb 0.28 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 1t6n h VAL 211 CO -0.00 0.26 -0.00 1.56 0.02 0.00 0.00 177.57 179.41 1t6n h GLN 212 N 1.19 0.78 -0.39 1.57 4.20 -0.67 -0.43 115.11 121.35 1t6n h GLN 212 Ca 0.31 -0.21 -0.16 0.00 0.06 0.00 0.00 58.65 58.65 1t6n h GLN 212 Cb -0.02 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1t6n h GLN 212 CO -0.05 0.79 -0.38 1.49 -0.67 0.00 0.00 178.83 180.00 1t6n h GLU 213 N 0.73 0.94 -0.10 1.46 4.81 -0.66 -2.01 114.58 119.74 1t6n h GLU 213 Ca 0.14 -0.49 -0.01 0.00 -0.13 0.00 0.00 59.36 58.87 1t6n h GLU 213 Cb 0.44 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.83 1t6n h GLU 213 CO 0.02 1.14 0.03 0.82 -0.73 0.00 0.00 179.01 180.29 1t6n h ILE 214 N 0.77 1.19 -0.63 2.32 2.04 -1.03 -3.06 117.51 119.11 1t6n h ILE 214 Ca 0.06 -0.59 0.12 0.00 1.00 0.00 0.00 64.86 65.45 1t6n h ILE 214 Cb 0.97 1.39 -0.09 0.00 -0.74 0.00 0.00 36.82 38.35 1t6n h ILE 214 CO 0.09 0.17 0.17 0.15 0.00 0.00 0.00 178.15 178.73 1t6n h PHE 215 N -0.03 0.27 -0.11 1.37 3.57 -1.02 -0.33 116.94 120.66 1t6n h PHE 215 Ca 0.03 0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.60 1t6n h PHE 215 Cb 0.24 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.95 1t6n h PHE 215 CO 0.00 -0.00 0.19 -0.09 -2.23 0.00 0.00 178.31 176.18 1t6n h ARG 216 N 0.30 0.00 -0.00 1.11 2.43 -1.26 -1.04 114.38 115.93 1t6n h ARG 216 Ca 0.33 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.50 1t6n h ARG 216 Cb 0.49 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1t6n h ARG 216 CO -0.39 0.00 -0.31 -1.33 -1.51 0.00 0.00 179.97 176.43 1t6n n MET 217 N -3.46 0.10 -3.21 0.20 2.81 -0.13 -4.91 117.12 108.52 1t6n n MET 217 Ca -0.00 -0.04 -0.23 0.00 -1.81 0.00 0.00 57.70 55.62 1t6n n MET 217 Cb 0.29 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.30 1t6n n MET 217 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1t6n s THR 218 N -2.93 4.39 0.57 2.03 -4.23 -0.40 -4.08 115.64 110.99 1t6n s THR 218 Ca 0.14 -0.57 -0.20 0.00 -1.18 0.00 0.00 61.69 59.88 1t6n s THR 218 Cb 0.18 -3.60 -0.04 0.00 1.34 0.00 0.00 72.50 70.38 1t6n s THR 218 CO 0.62 -0.38 1.22 -2.84 -0.54 0.00 0.00 174.62 172.71 1t6n s PRO 219 N -4.41 3.08 0.14 3.99 0.02 -1.26 -4.95 135.00 131.62 1t6n s PRO 219 Ca 0.45 1.87 -0.13 0.00 0.02 0.00 0.00 61.00 63.21 1t6n s PRO 219 Cb -0.10 -2.02 0.01 0.00 0.02 0.00 0.00 34.50 32.41 1t6n s PRO 219 CO 0.36 -1.13 1.60 0.45 -0.33 0.00 0.00 177.00 177.95 1t6n h HIS 220 N 1.09 0.90 -1.25 6.54 3.86 -1.95 -3.37 115.15 120.96 1t6n h HIS 220 Ca -0.50 -0.15 -0.55 0.00 -1.16 0.00 0.00 60.37 58.00 1t6n h HIS 220 Cb 1.29 -0.24 -0.09 0.00 1.06 0.00 0.00 27.41 29.44 1t6n h HIS 220 CO 0.47 0.86 1.34 -2.00 0.86 0.00 0.00 177.93 179.46 1t6n s GLU 221 N -5.03 3.38 0.22 2.45 2.56 -1.26 -4.88 118.70 116.13 1t6n s GLU 221 Ca -0.13 -0.85 -0.20 0.00 0.00 0.00 0.00 54.97 53.80 1t6n s GLU 221 Cb 0.11 -5.14 0.03 0.00 2.00 0.00 0.00 34.13 31.14 1t6n s GLU 221 CO 0.81 -2.37 0.61 -1.59 -0.56 0.00 0.00 175.26 172.16 1t6n s LYS 222 N 5.40 1.51 -0.14 4.30 -2.85 -1.26 -4.80 119.74 121.90 1t6n s LYS 222 Ca 0.48 -0.83 -0.10 0.00 -1.00 0.00 0.00 55.97 54.51 1t6n s LYS 222 Cb -0.02 0.57 -0.05 0.00 -2.06 0.00 0.00 37.83 36.27 1t6n s LYS 222 CO -0.05 -0.66 0.21 -1.14 0.10 0.00 0.00 175.35 173.81 1t6n s GLN 223 N -3.87 3.91 -0.09 1.78 0.74 -0.00 -4.96 119.66 117.17 1t6n s GLN 223 Ca 0.09 -0.04 0.04 0.00 0.05 0.00 0.00 55.36 55.50 1t6n s GLN 223 Cb -0.03 -3.32 0.00 0.00 1.10 0.00 0.00 33.01 30.77 1t6n s GLN 223 CO -0.01 0.50 -0.20 0.08 -0.55 0.00 0.00 175.29 175.10 1t6n s VAL 224 N -0.27 1.78 -0.01 1.34 1.01 -1.26 -0.18 120.40 122.81 1t6n s VAL 224 Ca 0.14 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.27 1t6n s VAL 224 Cb -0.12 -1.55 0.01 0.00 0.00 0.00 0.00 36.38 34.72 1t6n s VAL 224 CO 0.03 0.50 0.01 -0.04 0.00 0.00 0.00 175.10 175.60 1t6n s MET 225 N 0.39 0.00 -0.02 2.72 -1.94 -0.62 -1.53 119.30 118.31 1t6n s MET 225 Ca -0.16 0.05 0.03 0.00 -1.71 0.00 0.00 55.69 53.90 1t6n s MET 225 Cb -0.17 -0.09 -0.01 0.00 2.01 0.00 0.00 34.83 36.58 1t6n s MET 225 CO 0.07 -0.05 -0.12 -1.64 -0.01 0.00 0.00 175.02 173.27 1t6n s MET 226 N 0.32 1.05 0.09 2.03 -1.94 0.27 -1.74 119.30 119.38 1t6n s MET 226 Ca -0.03 -0.41 0.05 0.00 -1.71 0.00 0.00 55.69 53.59 1t6n s MET 226 Cb -0.04 -0.99 -0.03 0.00 2.01 0.00 0.00 34.83 35.77 1t6n s MET 226 CO -0.01 0.22 -0.13 -0.06 -0.01 0.00 0.00 175.02 175.03 1t6n s PHE 227 N -0.12 1.19 -0.15 -0.03 0.40 0.13 -0.84 117.98 118.57 1t6n s PHE 227 Ca 0.02 -0.53 -0.31 0.00 -0.60 0.00 0.00 56.93 55.51 1t6n s PHE 227 Cb -0.06 -0.66 0.13 0.00 0.51 0.00 0.00 43.02 42.94 1t6n s PHE 227 CO 0.00 0.06 1.08 0.45 0.70 0.00 0.00 175.22 177.51 1t6n s SER 228 N -2.05 -0.26 0.47 1.36 0.15 -0.72 -0.17 113.70 112.48 1t6n s SER 228 Ca 0.02 0.13 0.26 0.00 0.70 0.00 0.00 55.95 57.06 1t6n s SER 228 Cb -0.07 0.24 0.61 0.00 -1.71 0.00 0.00 66.02 65.09 1t6n s SER 228 CO 0.02 -0.34 1.71 0.00 1.20 0.00 0.00 173.24 175.82 1t6n h ALA 229 N 2.18 0.99 -2.93 5.45 0.00 -1.87 -2.06 119.26 121.03 1t6n h ALA 229 Ca -0.15 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.49 1t6n h ALA 229 Cb 1.19 -0.00 -0.34 0.00 0.00 0.00 0.00 17.79 18.63 1t6n h ALA 229 CO 0.27 0.02 -0.58 0.95 0.00 0.00 0.00 179.25 179.91 1t6n s THR 230 N -3.33 -0.35 -0.31 0.00 -4.23 -1.26 -4.46 115.64 101.71 1t6n s THR 230 Ca 0.05 0.28 0.03 0.00 -1.18 0.00 0.00 61.69 60.87 1t6n s THR 230 Cb 0.06 -0.40 0.09 0.00 1.34 0.00 0.00 72.50 73.59 1t6n s THR 230 CO 0.64 0.11 0.01 -0.76 -0.54 0.00 0.00 174.62 174.07 1t6n s LEU 231 N 2.36 3.88 0.97 4.79 1.43 -1.26 -4.66 118.68 126.20 1t6n s LEU 231 Ca 0.02 -1.80 -0.12 0.00 -1.03 0.00 0.00 54.13 51.21 1t6n s LEU 231 Cb -0.12 -1.46 0.18 0.00 0.03 0.00 0.00 46.19 44.82 1t6n s LEU 231 CO -0.08 -0.32 1.09 -0.94 0.23 0.00 0.00 176.35 176.33 1t6n s SER 232 N 1.10 2.65 0.37 2.29 1.04 -1.26 -4.85 113.70 115.04 1t6n s SER 232 Ca 0.04 1.66 0.15 0.00 0.48 0.00 0.00 55.95 58.28 1t6n s SER 232 Cb -0.19 -2.30 0.73 0.00 0.10 0.00 0.00 66.02 64.36 1t6n s SER 232 CO -0.09 -3.18 1.80 0.11 0.98 0.00 0.00 173.24 172.85 1t6n h LYS 233 N -1.92 0.00 0.00 4.02 1.79 -2.01 -2.78 116.57 115.67 1t6n h LYS 233 Ca -0.51 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 57.80 1t6n h LYS 233 Cb 1.29 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.92 1t6n h LYS 233 CO 0.50 0.39 -0.74 1.49 -1.08 0.00 0.00 179.45 180.01 1t6n h GLU 234 N 0.00 0.00 0.00 3.15 4.81 -2.05 -3.28 114.58 117.22 1t6n h GLU 234 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1t6n h GLU 234 Cb 0.75 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.13 1t6n h GLU 234 CO 0.05 0.74 -0.96 1.51 -0.73 0.00 0.00 179.01 179.61 1t6n n ILE 235 N -3.62 0.19 -0.12 2.32 3.06 -1.15 -4.30 119.36 115.74 1t6n n ILE 235 Ca -0.01 -0.24 -0.08 0.00 -2.50 0.00 0.00 62.75 59.92 1t6n n ILE 235 Cb 0.73 0.16 0.00 0.00 0.54 0.00 0.00 39.64 41.07 1t6n n ILE 235 CO 0.00 0.00 0.00 0.03 -2.50 0.00 0.00 176.55 174.08 1t6n h ARG 236 N 0.00 0.48 -0.18 9.51 3.08 -1.55 -1.80 114.38 123.92 1t6n h ARG 236 Ca 0.00 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1t6n h ARG 236 Cb 0.73 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 1t6n h ARG 236 CO 0.00 0.32 0.01 -1.35 -1.07 0.00 0.00 179.97 177.88 1t6n h PRO 237 N 0.50 0.26 -0.20 0.04 0.11 -1.75 -1.60 132.00 129.36 1t6n h PRO 237 Ca 0.14 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.12 1t6n h PRO 237 Cb -0.04 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.01 1t6n h PRO 237 CO -0.04 0.28 -0.30 0.28 -0.21 0.00 0.00 178.00 178.01 1t6n h VAL 238 N 0.26 1.27 -0.29 3.15 2.07 -1.60 -2.85 116.25 118.27 1t6n h VAL 238 Ca 0.06 -1.33 -0.14 0.00 0.82 0.00 0.00 66.70 66.12 1t6n h VAL 238 Cb 0.17 1.45 -0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1t6n h VAL 238 CO 0.00 0.41 -0.36 0.00 0.02 0.00 0.00 177.57 177.65 1t6n h ARG 240 N 0.50 0.00 0.00 0.00 3.08 -1.21 -2.87 114.38 113.88 1t6n h ARG 240 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1t6n h ARG 240 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.99 1t6n h ARG 240 CO 0.09 0.00 0.00 0.87 -1.07 0.00 0.00 179.97 179.86 1t6n h LYS 241 N 0.00 0.00 -0.02 0.04 1.57 -1.47 -1.53 116.57 115.16 1t6n h LYS 241 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1t6n h LYS 241 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1t6n h LYS 241 CO 0.00 0.00 -0.12 1.19 -0.57 0.00 0.00 179.45 179.95 1t6n n PHE 242 N -2.71 0.00 -4.24 -1.35 3.01 -1.08 -4.98 117.46 106.10 1t6n n PHE 242 Ca 0.00 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.21 1t6n n PHE 242 Cb 0.21 -0.02 -0.08 0.00 -0.01 0.00 0.00 39.48 39.58 1t6n n PHE 242 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 1t6n s MET 243 N -2.16 2.16 -0.23 -1.08 -1.94 -0.58 -4.88 119.30 110.60 1t6n s MET 243 Ca 0.28 -1.88 0.01 0.00 -1.71 0.00 0.00 55.69 52.40 1t6n s MET 243 Cb 0.20 -1.91 0.05 0.00 2.01 0.00 0.00 34.83 35.18 1t6n s MET 243 CO 0.39 -0.07 -0.08 -0.65 -0.01 0.00 0.00 175.02 174.60 1t6n s GLN 244 N -3.85 1.90 -0.62 2.03 -0.21 -1.26 -4.87 119.66 112.79 1t6n s GLN 244 Ca 0.39 -1.04 -0.14 0.00 0.02 0.00 0.00 55.36 54.59 1t6n s GLN 244 Cb 0.05 -2.62 0.02 0.00 1.00 0.00 0.00 33.01 31.46 1t6n s GLN 244 CO 0.21 -0.54 0.37 -3.47 -2.12 0.00 0.00 175.29 169.74 1t6n n ASP 245 N 4.61 -2.40 -4.84 5.90 2.03 -1.26 -4.62 116.55 115.97 1t6n n ASP 245 Ca -0.13 -0.68 -0.31 0.00 0.52 0.00 0.00 54.79 54.18 1t6n n ASP 245 Cb 0.44 -0.88 0.02 0.00 -0.72 0.00 0.00 41.12 39.98 1t6n n ASP 245 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1t6n s PRO 246 N -5.58 3.36 0.13 -0.67 0.04 -1.26 -4.78 135.00 126.24 1t6n s PRO 246 Ca 0.19 0.87 -0.28 0.00 0.04 0.00 0.00 61.00 61.83 1t6n s PRO 246 Cb -0.11 -2.05 -0.07 0.00 0.04 0.00 0.00 34.50 32.32 1t6n s PRO 246 CO 0.53 -0.76 0.88 1.41 0.04 0.00 0.00 177.00 179.10 1t6n s MET 247 N -4.97 4.66 -0.03 4.56 -2.45 -0.33 -4.91 119.30 115.83 1t6n s MET 247 Ca 0.57 1.31 0.07 0.00 -1.25 0.00 0.00 55.69 56.39 1t6n s MET 247 Cb -0.12 -3.34 -0.02 0.00 1.25 0.00 0.00 34.83 32.61 1t6n s MET 247 CO 0.51 0.35 -0.23 -1.21 1.05 0.00 0.00 175.02 175.49 1t6n s GLU 248 N -0.44 1.99 -0.07 4.11 2.02 -1.26 -1.40 118.70 123.65 1t6n s GLU 248 Ca 0.42 -0.83 -0.03 0.00 0.02 0.00 0.00 54.97 54.55 1t6n s GLU 248 Cb -0.23 -1.86 0.04 0.00 0.10 0.00 0.00 34.13 32.18 1t6n s GLU 248 CO 0.28 0.46 0.14 -1.50 0.02 0.00 0.00 175.26 174.66 1t6n s ILE 249 N -0.44 -0.16 -0.30 -1.63 2.07 -0.48 -4.99 121.20 115.27 1t6n s ILE 249 Ca 0.06 0.29 0.01 0.00 -1.41 0.00 0.00 60.65 59.60 1t6n s ILE 249 Cb -0.10 -0.25 0.09 0.00 0.13 0.00 0.00 42.46 42.34 1t6n s ILE 249 CO 0.00 0.12 0.06 -0.36 -1.91 0.00 0.00 174.94 172.85 1t6n s PHE 250 N 1.79 2.46 0.00 3.50 0.40 -1.26 -0.68 117.98 124.19 1t6n s PHE 250 Ca -0.02 -2.12 0.00 0.00 -0.60 0.00 0.00 56.93 54.19 1t6n s PHE 250 Cb -0.12 -2.06 0.00 0.00 0.51 0.00 0.00 43.02 41.35 1t6n s PHE 250 CO -0.05 -0.88 0.08 1.33 0.70 0.00 0.00 175.22 176.40