#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t6n s GLY 46 N 0.00 -0.49 0.49 0.23 0.00 -1.26 -3.87 107.32 102.42 1t6n s GLY 46 Ca 0.00 -0.92 0.28 0.00 0.00 0.00 0.00 44.72 44.07 1t6n s GLY 46 CO 0.00 4.00 1.79 0.74 0.00 0.00 0.00 173.10 179.63 1t6n h PHE 47 N 12.92 0.00 0.00 1.90 -1.00 -1.95 0.40 116.94 129.21 1t6n h PHE 47 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1t6n h PHE 47 Cb 1.03 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.59 1t6n h PHE 47 CO 1.16 0.02 -0.05 -2.13 -1.61 0.00 0.00 178.31 175.69 1t6n n ARG 48 N -3.11 0.24 0.00 1.51 0.63 -1.26 -2.73 116.66 111.94 1t6n n ARG 48 Ca 0.02 0.18 0.15 0.00 -0.92 0.00 0.00 57.85 57.28 1t6n n ARG 48 Cb 0.43 -1.77 0.84 0.00 0.45 0.00 0.00 32.46 32.41 1t6n n ARG 48 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1t6n n ASP 49 N -2.18 0.00 -4.84 6.15 8.00 0.14 -4.73 116.55 119.09 1t6n n ASP 49 Ca 0.06 -0.74 -0.26 0.00 0.71 0.00 0.00 54.79 54.55 1t6n n ASP 49 Cb 0.42 -0.06 -0.05 0.00 -0.02 0.00 0.00 41.12 41.41 1t6n n ASP 49 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1t6n s PHE 50 N -2.13 3.25 -1.26 1.24 2.99 -1.11 -5.02 117.98 115.94 1t6n s PHE 50 Ca 0.40 0.02 -0.15 0.00 0.00 0.00 0.00 56.93 57.20 1t6n s PHE 50 Cb 0.20 -1.56 0.13 0.00 0.00 0.00 0.00 43.02 41.79 1t6n s PHE 50 CO 0.36 0.52 1.60 -0.11 -0.00 0.00 0.00 175.22 177.59 1t6n n LEU 51 N -0.42 5.18 -4.68 -0.37 7.94 -1.26 -4.96 117.00 118.43 1t6n n LEU 51 Ca -0.08 -4.23 -0.28 0.00 -1.11 0.00 0.00 56.01 50.31 1t6n n LEU 51 Cb 0.55 -1.67 -0.08 0.00 0.53 0.00 0.00 43.42 42.75 1t6n n LEU 51 CO 0.45 0.51 -0.33 -0.76 -1.11 0.00 0.00 177.39 176.15 1t6n s LEU 52 N 2.65 3.39 0.59 -1.96 1.43 -1.26 -5.10 118.68 118.42 1t6n s LEU 52 Ca 0.48 -0.28 -0.19 0.00 -1.03 0.00 0.00 54.13 53.10 1t6n s LEU 52 Cb 0.01 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 1t6n s LEU 52 CO 0.03 0.13 1.26 -0.54 0.23 0.00 0.00 176.35 177.46 1t6n s LYS 53 N -2.63 2.96 0.16 1.70 1.02 -1.26 -4.79 119.74 116.90 1t6n s LYS 53 Ca 0.26 1.96 -0.19 0.00 0.02 0.00 0.00 55.97 58.03 1t6n s LYS 53 Cb -0.10 -2.01 0.08 0.00 -0.52 0.00 0.00 37.83 35.28 1t6n s LYS 53 CO 0.18 -1.25 1.64 -1.35 -0.92 0.00 0.00 175.35 173.66 1t6n h PRO 54 N 1.01 -0.11 -0.60 -1.68 0.11 -1.99 -1.47 132.00 127.27 1t6n h PRO 54 Ca -0.51 0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.70 1t6n h PRO 54 Cb 1.30 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.40 1t6n h PRO 54 CO 0.55 -0.07 0.40 0.93 -0.21 0.00 0.00 178.00 179.60 1t6n h GLU 55 N -0.11 0.45 -0.10 1.05 3.07 -1.91 -0.57 114.58 116.46 1t6n h GLU 55 Ca 0.18 -0.03 -0.13 0.00 -0.50 0.00 0.00 59.36 58.89 1t6n h GLU 55 Cb 0.39 -0.10 0.01 0.00 -0.84 0.00 0.00 28.75 28.21 1t6n h GLU 55 CO -0.44 0.30 -0.44 1.25 -1.40 0.00 0.00 179.01 178.28 1t6n h LEU 56 N 0.46 0.55 -0.87 1.33 5.85 -1.60 -2.75 115.31 118.29 1t6n h LEU 56 Ca 0.27 -0.64 -0.03 0.00 0.84 0.00 0.00 57.88 58.32 1t6n h LEU 56 Cb 0.46 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 1t6n h LEU 56 CO -0.08 1.10 0.43 0.25 -0.34 0.00 0.00 178.44 179.80 1t6n h LEU 57 N 0.04 1.12 -0.88 2.25 5.85 -0.71 -2.04 115.31 120.95 1t6n h LEU 57 Ca -0.03 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1t6n h LEU 57 Cb 1.08 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 1t6n h LEU 57 CO 0.09 0.94 0.48 -0.09 -0.34 0.00 0.00 178.44 179.52 1t6n h ARG 58 N 1.23 1.23 -0.54 1.25 2.43 -1.14 -1.52 114.38 117.32 1t6n h ARG 58 Ca 0.30 -0.14 -0.11 0.00 -0.81 0.00 0.00 59.98 59.22 1t6n h ARG 58 Cb 0.10 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.39 1t6n h ARG 58 CO -0.04 0.90 -0.09 0.00 -1.51 0.00 0.00 179.97 179.23 1t6n h ALA 59 N 1.26 0.82 -0.58 2.80 0.00 -1.14 -1.93 119.26 120.50 1t6n h ALA 59 Ca 0.31 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1t6n h ALA 59 Cb 0.03 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1t6n h ALA 59 CO -0.05 0.66 0.27 0.82 0.00 0.00 0.00 179.25 180.95 1t6n h ILE 60 N 0.89 1.21 -0.67 0.00 2.04 -0.96 -1.57 117.51 118.45 1t6n h ILE 60 Ca 0.14 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 1t6n h ILE 60 Cb 0.64 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 1t6n h ILE 60 CO 0.04 0.25 0.38 0.58 0.00 0.00 0.00 178.15 179.40 1t6n h VAL 61 N 0.79 1.20 0.00 1.67 2.07 -1.11 -1.86 116.25 119.01 1t6n h VAL 61 Ca 0.20 -0.49 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 1t6n h VAL 61 Cb 0.14 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1t6n h VAL 61 CO -0.02 0.22 -0.10 0.44 0.02 0.00 0.00 177.57 178.13 1t6n h ASP 62 N 0.92 0.00 0.51 0.57 5.19 -0.86 -0.68 116.42 122.07 1t6n h ASP 62 Ca 0.24 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.65 1t6n h ASP 62 Cb 0.01 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.52 1t6n h ASP 62 CO -0.04 0.10 -0.16 0.00 -3.12 0.00 0.00 179.24 176.02 1t6n n GLY 64 N 1.37 -1.09 0.25 0.00 0.00 -0.26 -5.02 105.19 100.43 1t6n n GLY 64 Ca 0.11 0.39 -0.05 0.00 0.00 0.00 0.00 46.02 46.47 1t6n n GLY 64 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1t6n n PHE 65 N -1.80 0.00 0.00 1.61 3.01 -1.23 -4.98 117.46 114.07 1t6n n PHE 65 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1t6n n PHE 65 Cb 0.51 -0.27 0.00 0.00 -0.01 0.00 0.00 39.48 39.71 1t6n n PHE 65 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1t6n n GLU 66 N -3.69 0.00 -3.48 -1.08 2.13 -1.26 -4.84 120.64 108.41 1t6n n GLU 66 Ca -0.08 0.00 -0.23 0.00 0.66 0.00 0.00 57.16 57.51 1t6n n GLU 66 Cb 0.28 -3.46 -0.13 0.00 0.27 0.00 0.00 31.44 28.40 1t6n n GLU 66 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 1t6n s HIS 67 N -0.76 -0.05 0.47 4.31 3.76 -1.25 -1.15 115.29 120.62 1t6n s HIS 67 Ca 0.00 -0.47 -0.22 0.00 -0.15 0.00 0.00 55.06 54.22 1t6n s HIS 67 Cb 0.00 -0.67 -0.07 0.00 1.11 0.00 0.00 32.58 32.95 1t6n s HIS 67 CO 0.00 -0.83 1.13 -2.14 -0.85 0.00 0.00 174.74 172.06 1t6n s PRO 68 N 2.23 3.74 0.86 8.40 0.01 -1.26 -5.00 135.00 143.97 1t6n s PRO 68 Ca 0.09 1.68 -0.12 0.00 0.01 0.00 0.00 61.00 62.65 1t6n s PRO 68 Cb -0.15 -2.32 0.11 0.00 0.01 0.00 0.00 34.50 32.14 1t6n s PRO 68 CO -0.31 -0.55 1.13 -1.54 0.01 0.00 0.00 177.00 175.73 1t6n s SER 69 N -1.51 3.99 0.27 2.53 1.04 -1.26 -4.74 113.70 114.02 1t6n s SER 69 Ca 0.65 1.06 -0.00 0.00 0.48 0.00 0.00 55.95 58.14 1t6n s SER 69 Cb -0.26 -1.69 0.53 0.00 0.10 0.00 0.00 66.02 64.69 1t6n s SER 69 CO 0.31 -2.26 1.81 -0.08 0.98 0.00 0.00 173.24 174.00 1t6n h GLU 70 N -1.29 0.83 -0.54 4.02 4.81 -1.94 0.15 114.58 120.61 1t6n h GLU 70 Ca -0.49 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 58.67 1t6n h GLU 70 Cb 1.31 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.48 1t6n h GLU 70 CO 0.62 0.55 0.24 0.28 -0.73 0.00 0.00 179.01 179.96 1t6n h VAL 71 N 0.85 1.21 -0.41 0.32 2.07 -1.92 -1.29 116.25 117.09 1t6n h VAL 71 Ca 0.47 -0.63 -0.11 0.00 0.82 0.00 0.00 66.70 67.25 1t6n h VAL 71 Cb 0.53 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 1t6n h VAL 71 CO -0.29 0.25 -0.18 1.56 0.02 0.00 0.00 177.57 178.93 1t6n h GLN 72 N 0.74 0.78 -0.68 1.57 4.20 -1.38 0.38 115.11 120.71 1t6n h GLN 72 Ca 0.18 -0.29 -0.03 0.00 0.06 0.00 0.00 58.65 58.57 1t6n h GLN 72 Cb 0.16 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 1t6n h GLN 72 CO -0.02 0.90 0.31 1.25 -0.67 0.00 0.00 178.83 180.60 1t6n h HIS 73 N 0.69 0.98 0.00 2.96 2.76 -0.45 -2.06 115.15 120.03 1t6n h HIS 73 Ca 0.10 -0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 1t6n h HIS 73 Cb 0.68 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 29.33 1t6n h HIS 73 CO 0.04 0.73 -0.78 0.39 -1.30 0.00 0.00 177.93 177.00 1t6n n GLU 74 N -4.33 0.20 -0.11 5.26 1.02 -0.51 -4.52 120.64 117.65 1t6n n GLU 74 Ca 0.06 0.02 -0.20 0.00 -0.02 0.00 0.00 57.16 57.02 1t6n n GLU 74 Cb 0.15 -1.59 -0.09 0.00 -0.02 0.00 0.00 31.44 29.88 1t6n n GLU 74 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1t6n h ILE 76 N -0.43 0.68 -0.86 0.00 2.04 -1.59 0.25 117.51 117.60 1t6n h ILE 76 Ca -0.55 -0.07 0.09 0.00 1.00 0.00 0.00 64.86 65.33 1t6n h ILE 76 Cb 1.64 0.46 -0.07 0.00 -0.74 0.00 0.00 36.82 38.12 1t6n h ILE 76 CO -0.22 0.04 0.51 -0.65 0.00 0.00 0.00 178.15 177.83 1t6n h PRO 77 N 0.20 0.85 0.10 2.37 0.11 -1.79 0.12 132.00 133.96 1t6n h PRO 77 Ca 0.25 -0.05 -0.27 0.00 0.11 0.00 0.00 66.00 66.05 1t6n h PRO 77 Cb 0.36 -0.19 0.01 0.00 0.11 0.00 0.00 31.00 31.29 1t6n h PRO 77 CO -0.36 0.57 -1.16 1.96 -0.21 0.00 0.00 178.00 178.79 1t6n h GLN 78 N 0.88 0.36 -0.52 1.05 7.50 -1.73 -3.26 115.11 119.40 1t6n h GLN 78 Ca 0.40 -0.52 -0.03 0.00 0.50 0.00 0.00 58.65 59.00 1t6n h GLN 78 Cb 0.32 0.18 -0.03 0.00 0.05 0.00 0.00 27.48 28.00 1t6n h GLN 78 CO -0.22 1.21 0.21 0.00 -1.50 0.00 0.00 178.83 178.52 1t6n h ALA 79 N 0.58 1.38 0.00 3.87 0.00 0.11 -2.08 119.26 123.12 1t6n h ALA 79 Ca -0.13 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1t6n h ALA 79 Cb 1.85 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 1t6n h ALA 79 CO 0.20 0.46 -0.22 0.82 0.00 0.00 0.00 179.25 180.52 1t6n h ILE 80 N 0.74 0.89 -0.16 0.00 2.04 -0.83 -1.74 117.51 118.46 1t6n h ILE 80 Ca 0.18 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.21 1t6n h ILE 80 Cb 0.15 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 1t6n h ILE 80 CO -0.02 0.21 0.00 0.18 0.00 0.00 0.00 178.15 178.53 1t6n n LEU 81 N -3.89 1.10 0.00 1.44 4.77 -0.81 -4.85 117.00 114.75 1t6n n LEU 81 Ca -0.02 -0.50 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 1t6n n LEU 81 Cb 0.31 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1t6n n LEU 81 CO 0.34 0.25 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 1t6n n GLY 82 N 0.93 0.51 3.78 -0.72 0.00 -0.65 -5.04 105.19 104.01 1t6n n GLY 82 Ca 0.12 -0.31 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 1t6n n GLY 82 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1t6n s MET 83 N -0.62 4.06 0.52 1.61 0.00 -1.02 -4.56 119.30 119.27 1t6n s MET 83 Ca 0.00 1.55 -0.20 0.00 0.00 0.00 0.00 55.69 57.05 1t6n s MET 83 Cb 0.00 -2.48 -0.07 0.00 0.00 0.00 0.00 34.83 32.28 1t6n s MET 83 CO 0.00 -0.24 1.08 -0.51 0.00 0.00 0.00 175.02 175.34 1t6n s ASP 84 N -1.56 6.05 -0.01 1.11 1.11 -1.26 -4.59 116.67 117.52 1t6n s ASP 84 Ca 0.60 2.02 -0.01 0.00 0.18 0.00 0.00 52.55 55.34 1t6n s ASP 84 Cb -0.23 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.20 1t6n s ASP 84 CO 0.28 -0.99 0.04 -0.69 1.18 0.00 0.00 175.17 174.99 1t6n s VAL 85 N -1.93 -0.00 -0.21 -1.27 1.01 -0.65 -1.58 120.40 115.77 1t6n s VAL 85 Ca 0.69 0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.69 1t6n s VAL 85 Cb -0.19 -0.06 0.05 0.00 0.00 0.00 0.00 36.38 36.17 1t6n s VAL 85 CO 0.24 0.00 -0.10 -0.22 0.00 0.00 0.00 175.10 175.03 1t6n s LEU 86 N 0.07 2.47 -0.07 3.92 2.96 -0.67 -0.48 118.68 126.88 1t6n s LEU 86 Ca -0.00 -1.00 0.01 0.00 -0.22 0.00 0.00 54.13 52.92 1t6n s LEU 86 Cb -0.01 -1.27 0.02 0.00 0.50 0.00 0.00 46.19 45.43 1t6n s LEU 86 CO -0.00 -0.16 -0.09 0.00 -1.32 0.00 0.00 176.35 174.78 1t6n s GLN 88 N 1.05 3.22 -0.07 0.00 0.74 0.18 -1.87 119.66 122.91 1t6n s GLN 88 Ca -0.08 -0.73 -0.07 0.00 0.05 0.00 0.00 55.36 54.53 1t6n s GLN 88 Cb -0.14 -3.07 0.02 0.00 1.10 0.00 0.00 33.01 30.91 1t6n s GLN 88 CO -0.01 -0.28 0.20 0.00 -0.55 0.00 0.00 175.29 174.65 1t6n s ALA 89 N 1.45 -0.49 0.86 1.58 0.00 -0.49 -0.86 121.76 123.81 1t6n s ALA 89 Ca 0.04 0.55 -0.11 0.00 0.00 0.00 0.00 51.96 52.44 1t6n s ALA 89 Cb -0.15 -0.32 0.11 0.00 0.00 0.00 0.00 23.12 22.75 1t6n s ALA 89 CO -0.02 -0.09 1.09 0.15 0.00 0.00 0.00 175.76 176.89 1t6n s LYS 90 N 0.11 1.57 0.34 0.00 -0.14 -1.26 -3.76 119.74 116.59 1t6n s LYS 90 Ca -0.00 0.97 -0.28 0.00 -1.36 0.00 0.00 55.97 55.30 1t6n s LYS 90 Cb -0.01 -1.83 -0.12 0.00 -1.68 0.00 0.00 37.83 34.18 1t6n s LYS 90 CO 0.00 -2.07 1.26 0.43 -0.76 0.00 0.00 175.35 174.22 1t6n n SER 91 N -3.78 2.61 0.00 2.83 7.64 -1.26 -2.35 113.62 119.30 1t6n n SER 91 Ca 0.08 1.20 0.00 0.00 1.01 0.00 0.00 58.87 61.16 1t6n n SER 91 Cb 0.54 -1.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.28 1t6n n SER 91 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1t6n n GLY 92 N 0.81 2.78 0.00 0.23 0.00 -1.26 -4.90 105.19 102.85 1t6n n GLY 92 Ca 0.05 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.18 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 0.19 -2.41 1.61 2.81 -0.99 -4.93 117.12 111.40 1t6n n MET 93 Ca 0.00 0.09 -0.05 0.00 -1.81 0.00 0.00 57.70 55.93 1t6n n MET 93 Cb 0.00 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.04 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 0.69 0.19 0.23 3.03 0.00 -1.26 -4.53 105.19 103.53 1t6n n GLY 94 Ca 0.09 -0.25 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.58 0.74 -0.32 1.61 1.57 -1.91 -2.96 116.57 114.72 1t6n h LYS 95 Ca -0.19 -0.20 0.03 0.00 -1.87 0.00 0.00 60.65 58.42 1t6n h LYS 95 Cb 1.11 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.30 1t6n h LYS 95 CO 0.16 0.76 0.12 1.15 -0.57 0.00 0.00 179.45 181.07 1t6n h THR 96 N 0.61 0.93 -0.52 -0.16 2.02 -2.00 -1.78 112.91 112.01 1t6n h THR 96 Ca 0.14 -0.09 0.03 0.00 0.77 0.00 0.00 66.41 67.25 1t6n h THR 96 Cb 0.37 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 1t6n h THR 96 CO 0.01 0.05 0.34 0.00 0.37 0.00 0.00 175.52 176.29 1t6n h ALA 97 N 1.20 1.72 0.41 6.16 0.00 -1.94 0.18 119.26 126.99 1t6n h ALA 97 Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1t6n h ALA 97 Cb 0.10 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1t6n h ALA 97 CO -0.14 0.23 -0.32 0.28 0.00 0.00 0.00 179.25 179.30 1t6n h VAL 98 N 0.61 0.34 0.00 0.00 2.07 -1.15 0.28 116.25 118.39 1t6n h VAL 98 Ca 0.20 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.60 1t6n h VAL 98 Cb 0.06 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 1t6n h VAL 98 CO -0.05 0.00 -0.57 2.19 0.02 0.00 0.00 177.57 179.16 1t6n h PHE 99 N -0.73 0.00 -0.02 1.57 -5.15 -1.34 -1.51 116.94 109.76 1t6n h PHE 99 Ca -0.04 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 57.73 1t6n h PHE 99 Cb 0.63 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.80 1t6n h PHE 99 CO -0.15 0.57 -0.00 0.28 -2.00 0.00 0.00 178.31 177.01 1t6n h VAL 100 N 0.00 1.27 -0.44 0.88 2.07 -0.53 -0.57 116.25 118.93 1t6n h VAL 100 Ca -0.01 -0.81 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 1t6n h VAL 100 Cb 1.31 1.78 -0.02 0.00 -1.52 0.00 0.00 31.29 32.85 1t6n h VAL 100 CO 0.07 0.21 0.12 -0.07 0.02 0.00 0.00 177.57 177.93 1t6n h LEU 101 N -0.30 0.65 -0.73 2.57 3.38 -0.97 -1.47 115.31 118.44 1t6n h LEU 101 Ca 0.00 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 1t6n h LEU 101 Cb 0.35 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1t6n h LEU 101 CO 0.00 0.70 0.39 0.00 0.09 0.00 0.00 178.44 179.62 1t6n h ALA 102 N 0.98 0.94 -0.03 1.53 0.00 -1.24 -0.82 119.26 120.62 1t6n h ALA 102 Ca 0.14 -0.12 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 1t6n h ALA 102 Cb 0.29 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1t6n h ALA 102 CO -0.00 0.47 -0.84 1.79 0.00 0.00 0.00 179.25 180.67 1t6n h THR 103 N 1.02 1.41 -0.19 0.00 1.35 -1.01 -2.54 112.91 112.94 1t6n h THR 103 Ca 0.26 -2.34 -0.11 0.00 -0.55 0.00 0.00 66.41 63.67 1t6n h THR 103 Cb 0.05 2.29 -0.01 0.00 -1.73 0.00 0.00 68.15 68.76 1t6n h THR 103 CO -0.04 0.70 -0.35 -0.07 -0.25 0.00 0.00 175.52 175.51 1t6n h LEU 104 N 0.23 0.42 -0.84 3.87 3.38 -1.12 -0.30 115.31 120.94 1t6n h LEU 104 Ca -0.05 -0.16 -0.10 0.00 0.09 0.00 0.00 57.88 57.66 1t6n h LEU 104 Cb 1.45 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.07 1t6n h LEU 104 CO 0.14 0.74 -0.17 -0.61 0.09 0.00 0.00 178.44 178.63 1t6n h GLN 105 N 0.34 0.67 0.00 1.13 5.75 -1.06 -3.08 115.11 118.86 1t6n h GLN 105 Ca 0.04 -0.24 0.00 0.00 -0.15 0.00 0.00 58.65 58.30 1t6n h GLN 105 Cb 0.78 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.28 1t6n h GLN 105 CO 0.06 0.81 -0.67 1.04 -2.65 0.00 0.00 178.83 177.42 1t6n n GLN 106 N -4.14 0.08 -1.65 1.69 6.02 -0.97 -4.95 117.38 113.47 1t6n n GLN 106 Ca 0.01 0.01 -0.50 0.00 -0.01 0.00 0.00 57.00 56.50 1t6n n GLN 106 Cb 0.39 -1.53 -0.05 0.00 1.02 0.00 0.00 30.24 30.06 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 -1.64 2.50 -3.53 1.08 0.00 -0.14 -4.93 117.00 110.34 1t6n n LEU 107 Ca 0.04 1.08 -0.27 0.00 0.00 0.00 0.00 56.01 56.87 1t6n n LEU 107 Cb 0.36 -1.29 -0.10 0.00 0.00 0.00 0.00 43.42 42.39 1t6n n LEU 107 CO 0.37 -0.56 -0.13 -0.62 0.00 0.00 0.00 177.39 176.45 1t6n n GLU 108 N 3.73 1.38 -1.66 1.96 1.02 -1.26 -5.05 120.64 120.76 1t6n n GLU 108 Ca 0.19 -3.97 -0.46 0.00 -0.02 0.00 0.00 57.16 52.90 1t6n n GLU 108 Cb 0.23 -1.93 -0.04 0.00 -0.02 0.00 0.00 31.44 29.68 1t6n n GLU 108 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1t6n n PRO 109 N 1.82 1.96 -3.85 3.49 -0.04 -1.26 -5.02 135.00 132.10 1t6n n PRO 109 Ca 0.25 0.70 -0.27 0.00 -0.04 0.00 0.00 63.50 64.14 1t6n n PRO 109 Cb 0.43 -2.39 -0.17 0.00 -0.04 0.00 0.00 33.50 31.33 1t6n n PRO 109 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1t6n s VAL 110 N 0.32 0.88 0.19 0.52 1.01 -1.26 -5.11 120.40 116.94 1t6n s VAL 110 Ca 0.73 -0.38 -0.32 0.00 0.00 0.00 0.00 61.98 62.01 1t6n s VAL 110 Cb -0.69 -1.04 -0.15 0.00 0.00 0.00 0.00 36.38 34.49 1t6n s VAL 110 CO 0.45 0.18 1.28 0.41 0.00 0.00 0.00 175.10 177.42 1t6n n THR 111 N 4.97 0.83 -1.06 3.92 -1.04 -1.26 -1.30 114.28 119.34 1t6n n THR 111 Ca -0.11 -0.21 -0.02 0.00 -2.04 0.00 0.00 64.05 61.68 1t6n n THR 111 Cb 0.49 -1.10 -0.01 0.00 -1.82 0.00 0.00 70.33 67.89 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 2.15 0.53 3.04 3.41 0.00 -1.26 -5.02 105.19 108.05 1t6n n GLY 112 Ca 0.14 -0.37 -0.24 0.00 0.00 0.00 0.00 46.02 45.55 1t6n n GLY 112 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1t6n s GLN 113 N -1.26 1.62 -0.25 1.61 0.74 -0.42 -5.02 119.66 116.68 1t6n s GLN 113 Ca 0.00 -0.44 -0.15 0.00 0.05 0.00 0.00 55.36 54.83 1t6n s GLN 113 Cb 0.00 -1.37 -0.04 0.00 1.10 0.00 0.00 33.01 32.70 1t6n s GLN 113 CO 0.00 0.08 0.36 0.08 -0.55 0.00 0.00 175.29 175.26 1t6n s VAL 114 N 0.48 5.19 -0.56 1.34 1.01 -1.25 -4.32 120.40 122.30 1t6n s VAL 114 Ca -0.11 0.57 0.05 0.00 0.00 0.00 0.00 61.98 62.49 1t6n s VAL 114 Cb -0.14 -3.69 0.02 0.00 0.00 0.00 0.00 36.38 32.57 1t6n s VAL 114 CO 0.03 0.19 0.57 -1.54 0.00 0.00 0.00 175.10 174.35 1t6n n SER 115 N 5.06 1.19 -3.86 3.32 3.41 -0.12 -3.58 113.62 119.05 1t6n n SER 115 Ca -0.09 -1.10 -0.19 0.00 -0.26 0.00 0.00 58.87 57.24 1t6n n SER 115 Cb 0.51 0.19 -0.16 0.00 -0.26 0.00 0.00 64.21 64.49 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 -0.62 0.37 -0.12 -3.33 1.01 -1.04 -0.66 120.40 116.01 1t6n s VAL 116 Ca 0.05 -0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.03 1t6n s VAL 116 Cb 0.04 -0.43 0.02 0.00 0.00 0.00 0.00 36.38 36.00 1t6n s VAL 116 CO 0.09 0.19 -0.16 -0.22 0.00 0.00 0.00 175.10 175.00 1t6n s LEU 117 N 1.00 1.75 -0.07 3.92 2.96 -0.18 -1.12 118.68 126.94 1t6n s LEU 117 Ca -0.10 -0.45 0.04 0.00 -0.22 0.00 0.00 54.13 53.40 1t6n s LEU 117 Cb -0.14 -1.14 0.00 0.00 0.50 0.00 0.00 46.19 45.42 1t6n s LEU 117 CO -0.01 0.01 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.15 1t6n s VAL 118 N 1.05 1.66 0.05 1.68 1.01 0.45 -1.08 120.40 125.22 1t6n s VAL 118 Ca -0.05 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.17 1t6n s VAL 118 Cb -0.15 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 1t6n s VAL 118 CO -0.03 0.47 -0.13 -0.04 0.00 0.00 0.00 175.10 175.38 1t6n s MET 119 N 0.32 0.81 0.33 2.72 -1.94 -0.05 -1.08 119.30 120.41 1t6n s MET 119 Ca -0.13 -0.78 -0.08 0.00 -1.71 0.00 0.00 55.69 52.99 1t6n s MET 119 Cb -0.16 -0.79 0.01 0.00 2.01 0.00 0.00 34.83 35.91 1t6n s MET 119 CO 0.06 0.19 0.54 0.00 -0.01 0.00 0.00 175.02 175.79 1t6n n HIS 121 N -0.51 1.10 -3.78 0.00 -0.00 -1.26 -4.60 115.22 106.17 1t6n n HIS 121 Ca -0.02 0.27 -0.37 0.00 0.46 0.00 0.00 57.72 58.06 1t6n n HIS 121 Cb 0.61 -1.16 -0.06 0.00 -0.12 0.00 0.00 29.99 29.26 1t6n n HIS 121 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 1t6n s THR 122 N -2.56 5.41 0.21 3.57 -4.23 -1.26 -5.00 115.64 111.77 1t6n s THR 122 Ca -0.19 0.33 -0.09 0.00 -1.18 0.00 0.00 61.69 60.56 1t6n s THR 122 Cb 0.07 -3.47 0.15 0.00 1.34 0.00 0.00 72.50 70.59 1t6n s THR 122 CO 0.77 0.58 1.81 -0.09 -0.54 0.00 0.00 174.62 177.16 1t6n h ARG 123 N 5.20 1.10 -0.39 3.99 2.43 -1.96 -2.53 114.38 122.22 1t6n h ARG 123 Ca -0.52 -0.15 0.03 0.00 -0.81 0.00 0.00 59.98 58.53 1t6n h ARG 123 Cb 1.22 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.53 1t6n h ARG 123 CO 0.61 0.85 0.19 0.93 -1.51 0.00 0.00 179.97 181.04 1t6n h GLU 124 N 1.09 0.38 -0.45 0.20 3.07 -2.00 -2.59 114.58 114.27 1t6n h GLU 124 Ca 0.27 -0.02 -0.07 0.00 -0.50 0.00 0.00 59.36 59.03 1t6n h GLU 124 Cb 0.09 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 27.90 1t6n h GLU 124 CO -0.04 0.25 -0.01 1.25 -1.40 0.00 0.00 179.01 179.06 1t6n h LEU 125 N 0.39 0.71 -0.79 1.33 5.85 -1.94 -2.14 115.31 118.72 1t6n h LEU 125 Ca 0.17 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.74 1t6n h LEU 125 Cb 0.08 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 1t6n h LEU 125 CO -0.12 0.79 0.51 0.00 -0.34 0.00 0.00 178.44 179.28 1t6n h ALA 126 N 1.29 1.02 0.00 1.25 0.00 -1.08 0.89 119.26 122.63 1t6n h ALA 126 Ca 0.14 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1t6n h ALA 126 Cb 0.45 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1t6n h ALA 126 CO 0.02 0.36 -0.57 0.74 0.00 0.00 0.00 179.25 179.80 1t6n h PHE 127 N 1.02 0.00 -0.22 0.00 -1.00 -1.29 -2.33 116.94 113.12 1t6n h PHE 127 Ca 0.30 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.94 1t6n h PHE 127 Cb -0.05 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.50 1t6n h PHE 127 CO -0.02 0.57 -0.47 1.96 -1.61 0.00 0.00 178.31 178.73 1t6n h GLN 128 N 0.00 0.58 -0.52 1.51 1.08 -0.76 -0.63 115.11 116.38 1t6n h GLN 128 Ca -0.01 -0.33 -0.04 0.00 -1.45 0.00 0.00 58.65 56.83 1t6n h GLN 128 Cb 1.22 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.65 1t6n h GLN 128 CO 0.07 0.93 0.18 0.82 -0.95 0.00 0.00 178.83 179.89 1t6n h ILE 129 N 0.46 1.22 -0.50 2.54 2.04 -0.63 -0.34 117.51 122.30 1t6n h ILE 129 Ca 0.03 -0.72 -0.07 0.00 1.00 0.00 0.00 64.86 65.09 1t6n h ILE 129 Cb 1.00 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1t6n h ILE 129 CO 0.09 0.27 0.02 -1.28 0.00 0.00 0.00 178.15 177.25 1t6n h SER 130 N 0.70 0.79 -0.54 1.72 0.87 -1.23 -1.41 113.55 114.45 1t6n h SER 130 Ca 0.17 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 1t6n h SER 130 Cb 0.24 -0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 61.96 1t6n h SER 130 CO -0.01 0.85 0.36 0.50 -0.53 0.00 0.00 176.83 178.00 1t6n h LYS 131 N 0.78 0.71 -0.76 2.24 1.63 -0.69 -1.83 116.57 118.64 1t6n h LYS 131 Ca 0.15 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.86 1t6n h LYS 131 Cb 0.44 -0.16 -0.03 0.00 -0.60 0.00 0.00 32.23 31.88 1t6n h LYS 131 CO 0.02 0.47 0.28 1.49 -3.45 0.00 0.00 179.45 178.26 1t6n h GLU 132 N 0.73 1.15 -0.81 1.90 4.57 -0.49 -1.17 114.58 120.46 1t6n h GLU 132 Ca 0.20 -0.22 -0.04 0.00 -1.18 0.00 0.00 59.36 58.12 1t6n h GLU 132 Cb -0.08 -0.18 -0.04 0.00 -0.16 0.00 0.00 28.75 28.29 1t6n h GLU 132 CO -0.04 0.94 0.36 1.88 -1.18 0.00 0.00 179.01 180.97 1t6n h TYR 133 N 1.11 1.19 -0.39 0.92 -1.99 -0.82 -1.77 116.97 115.22 1t6n h TYR 133 Ca 0.25 -0.07 -0.05 0.00 2.00 0.00 0.00 58.73 60.87 1t6n h TYR 133 Cb 0.24 -0.36 -0.02 0.00 2.00 0.00 0.00 36.73 38.59 1t6n h TYR 133 CO 0.02 0.88 0.06 0.93 -0.00 0.00 0.00 178.16 180.05 1t6n h GLU 134 N 1.16 0.64 0.14 4.88 5.08 -0.92 -1.52 114.58 124.04 1t6n h GLU 134 Ca 0.27 -0.17 0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1t6n h GLU 134 Cb 0.16 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1t6n h GLU 134 CO -0.03 0.69 -0.21 0.00 -1.00 0.00 0.00 179.01 178.47 1t6n h ARG 135 N 0.49 -0.39 0.00 2.33 2.47 -0.90 -2.80 114.38 115.57 1t6n h ARG 135 Ca 0.12 0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.86 1t6n h ARG 135 Cb 0.36 0.09 0.00 0.00 -1.65 0.00 0.00 29.97 28.77 1t6n h ARG 135 CO 0.01 -0.26 0.00 0.74 0.56 0.00 0.00 179.97 181.02 1t6n h PHE 136 N -0.41 0.00 -0.59 3.04 0.05 -1.32 -3.02 116.94 114.69 1t6n h PHE 136 Ca 0.02 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.81 1t6n h PHE 136 Cb 0.41 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.36 1t6n h PHE 136 CO -0.19 0.00 0.00 -1.13 -0.18 0.00 0.00 178.31 176.81 1t6n n SER 137 N -2.74 5.26 -0.31 2.17 3.41 -0.57 -4.61 113.62 116.22 1t6n n SER 137 Ca 0.02 -2.74 0.10 0.00 -0.26 0.00 0.00 58.87 56.00 1t6n n SER 137 Cb 0.34 -0.64 0.28 0.00 -0.26 0.00 0.00 64.21 63.93 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 3.92 0.58 -0.66 4.33 3.64 -1.37 -0.63 116.57 126.38 1t6n h LYS 138 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1t6n h LYS 138 Cb 1.74 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.43 1t6n h LYS 138 CO 0.37 0.39 0.00 0.66 -2.27 0.00 0.00 179.45 178.60 1t6n n TYR 139 N -4.89 1.43 -3.70 1.91 4.02 -1.26 -4.72 117.16 109.95 1t6n n TYR 139 Ca 0.20 -0.60 -0.37 0.00 -0.01 0.00 0.00 57.90 57.12 1t6n n TYR 139 Cb 0.54 -0.21 -0.10 0.00 -0.02 0.00 0.00 39.34 39.54 1t6n n TYR 139 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 176.86 174.21 1t6n s MET 140 N -1.75 2.47 0.47 -0.72 -1.94 -0.25 -4.90 119.30 112.68 1t6n s MET 140 Ca 0.51 -2.29 -0.24 0.00 -1.71 0.00 0.00 55.69 51.96 1t6n s MET 140 Cb 0.32 -3.74 -0.07 0.00 2.01 0.00 0.00 34.83 33.35 1t6n s MET 140 CO 0.26 -1.16 1.38 -2.14 -0.01 0.00 0.00 175.02 173.35 1t6n s PRO 141 N 0.36 3.58 -1.37 2.03 0.02 -1.26 -3.57 135.00 134.79 1t6n s PRO 141 Ca 0.14 2.30 0.00 0.00 0.02 0.00 0.00 61.00 63.46 1t6n s PRO 141 Cb -0.21 -2.55 0.00 0.00 0.02 0.00 0.00 34.50 31.76 1t6n s PRO 141 CO -0.04 -0.86 0.00 -1.71 -0.33 0.00 0.00 177.00 174.07 1t6n n ASN 142 N -0.39 -4.52 -4.59 2.53 5.15 -1.26 -5.00 115.26 107.19 1t6n n ASN 142 Ca 0.06 0.22 -0.41 0.00 -0.60 0.00 0.00 54.58 53.85 1t6n n ASN 142 Cb 0.43 -3.39 -0.07 0.00 -0.53 0.00 0.00 39.78 36.22 1t6n n ASN 142 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1t6n s VAL 143 N -2.57 4.94 -0.10 3.44 1.01 -1.23 -5.00 120.40 120.88 1t6n s VAL 143 Ca 0.00 0.70 -0.03 0.00 0.00 0.00 0.00 61.98 62.64 1t6n s VAL 143 Cb 0.00 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 1t6n s VAL 143 CO 0.00 -0.19 0.03 -0.54 0.00 0.00 0.00 175.10 174.40 1t6n s LYS 144 N 2.59 3.19 0.01 2.72 1.02 -1.26 -5.00 119.74 123.01 1t6n s LYS 144 Ca 0.24 -0.36 0.04 0.00 0.02 0.00 0.00 55.97 55.91 1t6n s LYS 144 Cb -0.15 -2.90 -0.02 0.00 -0.52 0.00 0.00 37.83 34.24 1t6n s LYS 144 CO 0.13 0.65 -0.14 0.08 -0.92 0.00 0.00 175.35 175.15 1t6n s VAL 145 N -0.71 1.08 0.01 3.17 1.01 -1.26 -0.81 120.40 122.89 1t6n s VAL 145 Ca 0.12 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.35 1t6n s VAL 145 Cb -0.12 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.31 1t6n s VAL 145 CO 0.02 0.17 -0.06 0.00 0.00 0.00 0.00 175.10 175.24 1t6n s ALA 146 N -0.55 0.45 -0.16 5.51 0.00 -0.46 -4.99 121.76 121.57 1t6n s ALA 146 Ca 0.04 -0.42 -0.01 0.00 0.00 0.00 0.00 51.96 51.56 1t6n s ALA 146 Cb -0.06 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.01 1t6n s ALA 146 CO 0.00 0.04 -0.11 0.08 0.00 0.00 0.00 175.76 175.78 1t6n s VAL 147 N -0.62 3.12 -0.65 0.00 1.01 -1.26 -1.15 120.40 120.86 1t6n s VAL 147 Ca -0.03 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 61.38 1t6n s VAL 147 Cb -0.05 -2.34 0.18 0.00 0.00 0.00 0.00 36.38 34.16 1t6n s VAL 147 CO 0.00 0.50 0.49 0.49 0.00 0.00 0.00 175.10 176.58 1t6n n PHE 148 N 3.88 2.48 1.00 5.22 0.99 0.11 -4.92 117.46 126.22 1t6n n PHE 148 Ca -0.18 -4.11 0.11 0.00 -0.00 0.00 0.00 57.45 53.26 1t6n n PHE 148 Cb 0.52 -0.46 -0.02 0.00 -1.00 0.00 0.00 39.48 38.52 1t6n n PHE 148 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1t6n n PHE 149 N 2.02 0.00 0.00 1.38 7.35 -1.26 -2.30 117.46 124.66 1t6n n PHE 149 Ca 0.22 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.91 1t6n n PHE 149 Cb 0.38 -0.07 0.00 0.00 0.35 0.00 0.00 39.48 40.14 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 1.50 0.49 3.42 7.13 0.00 -1.26 -4.56 105.19 111.91 1t6n n GLY 150 Ca 0.05 -0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 1t6n n GLY 150 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1t6n s GLY 151 N 0.00 1.45 0.50 -0.02 0.00 -1.26 -5.08 107.32 102.91 1t6n s GLY 151 Ca 0.00 -1.03 -0.22 0.00 0.00 0.00 0.00 44.72 43.47 1t6n s GLY 151 CO 0.00 -0.83 1.04 1.04 0.00 0.00 0.00 173.10 174.35 1t6n n LEU 152 N 2.33 3.36 -1.70 0.66 4.77 -1.26 -4.29 117.00 120.86 1t6n n LEU 152 Ca -0.17 0.95 -0.01 0.00 -0.03 0.00 0.00 56.01 56.75 1t6n n LEU 152 Cb 0.52 -1.40 -0.01 0.00 -2.33 0.00 0.00 43.42 40.20 1t6n n LEU 152 CO 0.25 -1.49 -0.13 -0.24 -1.33 0.00 0.00 177.39 174.45 1t6n n SER 153 N -0.11 -1.68 0.18 -1.43 2.88 -1.26 -4.84 113.62 107.36 1t6n n SER 153 Ca 0.11 0.25 0.13 0.00 -1.33 0.00 0.00 58.87 58.03 1t6n n SER 153 Cb 0.43 -1.80 0.41 0.00 -0.75 0.00 0.00 64.21 62.51 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 0.76 0.00 -0.85 2.46 2.10 -2.03 -3.06 117.51 116.90 1t6n h ILE 154 Ca -0.11 -0.58 0.04 0.00 1.08 0.00 0.00 64.86 65.29 1t6n h ILE 154 Cb 0.24 1.53 -0.05 0.00 -1.09 0.00 0.00 36.82 37.45 1t6n h ILE 154 CO 0.00 0.00 0.56 0.11 -1.08 0.00 0.00 178.15 177.74 1t6n h LYS 155 N 0.00 0.99 -0.86 2.19 1.79 -1.93 -1.70 116.57 117.05 1t6n h LYS 155 Ca 0.00 -0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 58.39 1t6n h LYS 155 Cb 0.69 -0.22 -0.04 0.00 -1.58 0.00 0.00 32.23 31.08 1t6n h LYS 155 CO 0.00 0.65 0.44 0.87 -1.08 0.00 0.00 179.45 180.34 1t6n h LYS 156 N 1.02 1.21 -0.43 3.15 1.57 -1.86 -0.73 116.57 120.51 1t6n h LYS 156 Ca 0.35 -0.16 -0.13 0.00 -1.87 0.00 0.00 60.65 58.84 1t6n h LYS 156 Cb 0.09 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 1t6n h LYS 156 CO -0.11 0.91 -0.26 -0.44 -0.57 0.00 0.00 179.45 178.98 1t6n h ASP 157 N 1.21 0.94 -0.86 0.86 3.32 -1.53 -2.55 116.42 117.82 1t6n h ASP 157 Ca 0.30 -0.37 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 1t6n h ASP 157 Cb 0.07 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.32 1t6n h ASP 157 CO -0.04 1.14 0.46 -0.33 -1.72 0.00 0.00 179.24 178.74 1t6n h GLU 158 N 0.78 1.21 -0.81 3.56 5.08 -0.83 -1.69 114.58 121.88 1t6n h GLU 158 Ca 0.09 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1t6n h GLU 158 Cb 0.82 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 29.80 1t6n h GLU 158 CO 0.07 0.90 0.39 1.49 -1.00 0.00 0.00 179.01 180.86 1t6n h GLU 159 N 1.21 1.17 -0.39 2.33 4.81 -0.89 0.27 114.58 123.10 1t6n h GLU 159 Ca 0.30 -0.17 -0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1t6n h GLU 159 Cb 0.05 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 1t6n h GLU 159 CO -0.05 0.90 0.08 0.28 -0.73 0.00 0.00 179.01 179.49 1t6n h VAL 160 N 1.15 1.23 -0.35 0.32 2.07 -1.04 0.62 116.25 120.26 1t6n h VAL 160 Ca 0.28 -0.82 -0.05 0.00 0.82 0.00 0.00 66.70 66.92 1t6n h VAL 160 Cb 0.12 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 1t6n h VAL 160 CO -0.04 0.28 -0.01 -0.07 0.02 0.00 0.00 177.57 177.76 1t6n h LEU 161 N 0.48 0.52 0.22 2.57 3.38 -0.95 -0.53 115.31 121.01 1t6n h LEU 161 Ca 0.12 -0.10 -0.33 0.00 0.09 0.00 0.00 57.88 57.65 1t6n h LEU 161 Cb 0.34 -0.14 0.03 0.00 0.09 0.00 0.00 40.66 40.98 1t6n h LEU 161 CO 0.00 0.59 -1.54 0.50 0.09 0.00 0.00 178.44 178.08 1t6n h LYS 162 N 0.52 0.47 0.00 1.13 1.63 -0.73 -3.23 116.57 116.37 1t6n h LYS 162 Ca 0.11 -0.81 -0.09 0.00 -0.85 0.00 0.00 60.65 59.01 1t6n h LYS 162 Cb 0.35 0.30 -0.02 0.00 -0.60 0.00 0.00 32.23 32.27 1t6n h LYS 162 CO 0.01 1.39 -1.93 1.63 -3.45 0.00 0.00 179.45 177.10 1t6n n LYS 163 N -3.71 0.66 -2.92 1.90 5.02 0.19 -4.63 118.16 114.67 1t6n n LYS 163 Ca -0.20 -0.09 -0.13 0.00 -2.02 0.00 0.00 58.31 55.87 1t6n n LYS 163 Cb 1.08 -1.58 0.02 0.00 -0.02 0.00 0.00 35.03 34.53 1t6n n LYS 163 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1t6n n ASN 164 N -2.46 0.18 -4.70 4.39 5.15 -0.24 -5.06 115.26 112.52 1t6n n ASN 164 Ca -0.10 -2.99 -0.56 0.00 -0.60 0.00 0.00 54.58 50.32 1t6n n ASN 164 Cb 0.72 0.01 -0.07 0.00 -0.53 0.00 0.00 39.78 39.90 1t6n n ASN 164 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1t6n s PRO 166 N 3.39 2.87 -0.11 0.00 0.04 -1.26 -4.48 135.00 135.45 1t6n s PRO 166 Ca 0.97 0.55 0.13 0.00 0.04 0.00 0.00 61.00 62.68 1t6n s PRO 166 Cb -1.02 -2.01 -0.24 0.00 0.04 0.00 0.00 34.50 31.27 1t6n s PRO 166 CO 0.63 -1.05 0.40 0.72 0.04 0.00 0.00 177.00 177.74 1t6n n HIS 167 N -3.03 0.63 -4.59 0.56 8.25 0.01 -3.86 115.22 113.19 1t6n n HIS 167 Ca 0.07 0.21 -0.30 0.00 -0.26 0.00 0.00 57.72 57.44 1t6n n HIS 167 Cb 0.56 -1.11 -0.17 0.00 1.12 0.00 0.00 29.99 30.40 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 -2.55 1.76 -0.10 1.59 1.01 -0.73 -0.94 121.20 121.23 1t6n s ILE 168 Ca -0.09 -0.80 0.02 0.00 0.00 0.00 0.00 60.65 59.78 1t6n s ILE 168 Cb 0.07 -1.57 -0.01 0.00 0.01 0.00 0.00 42.46 40.96 1t6n s ILE 168 CO 0.81 0.49 -0.17 -0.69 0.00 0.00 0.00 174.94 175.38 1t6n s VAL 169 N 0.88 2.68 -0.08 2.92 1.01 -0.27 -1.36 120.40 126.18 1t6n s VAL 169 Ca -0.08 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.12 1t6n s VAL 169 Cb -0.15 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.16 1t6n s VAL 169 CO -0.01 0.55 -0.18 -0.69 0.00 0.00 0.00 175.10 174.77 1t6n s VAL 170 N 0.09 1.59 0.00 2.92 1.01 -0.30 -0.41 120.40 125.30 1t6n s VAL 170 Ca -0.08 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.16 1t6n s VAL 170 Cb -0.15 -1.40 0.00 0.00 0.00 0.00 0.00 36.38 34.83 1t6n s VAL 170 CO 0.05 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.22 1t6n n GLY 171 N 3.67 1.27 3.76 4.51 0.00 -0.24 0.05 105.19 118.21 1t6n n GLY 171 Ca -0.21 -0.85 -0.36 0.00 0.00 0.00 0.00 46.02 44.61 1t6n n GLY 171 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1t6n s THR 172 N -2.46 4.86 0.24 2.61 -1.32 -0.97 -2.86 115.64 115.74 1t6n s THR 172 Ca 0.00 -0.04 -0.15 0.00 -1.21 0.00 0.00 61.69 60.29 1t6n s THR 172 Cb 0.00 -3.09 0.30 0.00 -1.51 0.00 0.00 72.50 68.20 1t6n s THR 172 CO 0.00 0.60 1.56 -0.65 -2.21 0.00 0.00 174.62 173.92 1t6n h PRO 173 N 5.19 -0.01 -0.07 7.08 0.11 -1.92 -0.79 132.00 141.60 1t6n h PRO 173 Ca -0.52 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.63 1t6n h PRO 173 Cb 1.21 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.27 1t6n h PRO 173 CO 0.57 -0.00 -0.25 0.78 -0.21 0.00 0.00 178.00 178.88 1t6n h GLY 174 N -0.01 -0.33 1.03 -0.55 0.00 -1.95 0.19 103.07 101.45 1t6n h GLY 174 Ca 0.38 0.31 -0.12 0.00 0.00 0.00 0.00 47.33 47.90 1t6n h GLY 174 CO -0.99 -0.20 -0.21 -0.09 0.00 0.00 0.00 176.54 175.04 1t6n h ARG 175 N -0.35 0.83 -0.51 4.80 9.65 -1.74 -1.55 114.38 125.51 1t6n h ARG 175 Ca 0.08 -0.37 0.01 0.00 -1.10 0.00 0.00 59.98 58.60 1t6n h ARG 175 Cb 0.47 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 29.00 1t6n h ARG 175 CO -0.27 1.01 0.33 0.82 2.80 0.00 0.00 179.97 184.66 1t6n h ILE 176 N 0.64 1.10 -0.62 1.20 1.08 -0.95 -1.36 117.51 118.59 1t6n h ILE 176 Ca 0.08 -0.23 -0.02 0.00 -0.39 0.00 0.00 64.86 64.31 1t6n h ILE 176 Cb 0.77 0.38 -0.03 0.00 -3.07 0.00 0.00 36.82 34.88 1t6n h ILE 176 CO 0.06 0.12 0.32 0.25 -0.69 0.00 0.00 178.15 178.21 1t6n h LEU 177 N 0.66 0.79 -0.44 1.44 5.85 -0.50 -0.34 115.31 122.78 1t6n h LEU 177 Ca 0.20 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.81 1t6n h LEU 177 Cb -0.04 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 1t6n h LEU 177 CO -0.06 0.68 0.29 0.00 -0.34 0.00 0.00 178.44 179.00 1t6n h ALA 178 N 1.14 0.55 -0.38 1.25 0.00 -0.88 0.27 119.26 121.22 1t6n h ALA 178 Ca 0.22 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 1t6n h ALA 178 Cb 0.08 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1t6n h ALA 178 CO -0.03 -0.00 -0.11 -0.07 0.00 0.00 0.00 179.25 179.04 1t6n h LEU 179 N 0.58 0.65 -0.19 0.00 3.38 -1.02 -1.87 115.31 116.84 1t6n h LEU 179 Ca 0.16 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1t6n h LEU 179 Cb -0.06 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 1t6n h LEU 179 CO -0.04 0.79 -0.07 0.00 0.09 0.00 0.00 178.44 179.21 1t6n h ALA 180 N 1.27 0.26 -0.48 1.53 0.00 -0.50 -1.20 119.26 120.14 1t6n h ALA 180 Ca 0.11 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1t6n h ALA 180 Cb 0.54 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1t6n h ALA 180 CO 0.03 0.07 0.20 0.00 0.00 0.00 0.00 179.25 179.55 1t6n h ARG 181 N 0.08 0.69 -0.27 0.00 3.08 -0.29 -2.23 114.38 115.44 1t6n h ARG 181 Ca 0.04 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1t6n h ARG 181 Cb 0.54 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1t6n h ARG 181 CO 0.02 0.57 0.00 0.27 -1.07 0.00 0.00 179.97 179.76 1t6n n ASN 182 N -4.36 1.70 0.00 7.04 2.04 -0.72 -4.92 115.26 116.05 1t6n n ASN 182 Ca 0.04 -1.89 0.00 0.00 -0.44 0.00 0.00 54.58 52.29 1t6n n ASN 182 Cb 0.15 -0.18 0.00 0.00 -2.53 0.00 0.00 39.78 37.22 1t6n n ASN 182 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1t6n n LYS 183 N 0.40 -0.29 -0.07 -3.83 5.02 -0.84 -4.89 118.16 113.66 1t6n n LYS 183 Ca 0.13 0.07 -0.11 0.00 -2.02 0.00 0.00 58.31 56.38 1t6n n LYS 183 Cb 0.29 -3.31 0.03 0.00 -0.02 0.00 0.00 35.03 32.02 1t6n n LYS 183 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1t6n h SER 184 N 0.00 0.84 -3.58 4.39 0.02 -1.50 -3.40 113.55 110.32 1t6n h SER 184 Ca 0.00 -0.39 -0.71 0.00 -0.84 0.00 0.00 61.79 59.86 1t6n h SER 184 Cb 0.14 -0.24 -0.24 0.00 0.14 0.00 0.00 62.40 62.21 1t6n h SER 184 CO 0.00 1.14 -0.50 -0.22 -1.14 0.00 0.00 176.83 176.10 1t6n s LEU 185 N -8.72 4.74 -0.33 5.07 2.96 -0.62 -4.85 118.68 116.93 1t6n s LEU 185 Ca -0.10 -0.93 -0.23 0.00 -0.22 0.00 0.00 54.13 52.65 1t6n s LEU 185 Cb 0.12 -2.05 0.00 0.00 0.50 0.00 0.00 46.19 44.76 1t6n s LEU 185 CO 0.86 -0.38 0.75 0.21 -1.32 0.00 0.00 176.35 176.47 1t6n s ASN 186 N 1.58 6.57 0.00 3.68 3.84 -1.26 -4.31 114.94 125.04 1t6n s ASN 186 Ca 0.03 0.46 0.23 0.00 0.21 0.00 0.00 52.86 53.78 1t6n s ASN 186 Cb -0.19 -2.38 0.57 0.00 -0.55 0.00 0.00 41.25 38.70 1t6n s ASN 186 CO 0.07 -0.64 1.49 0.18 -2.79 0.00 0.00 177.10 175.42 1t6n n LEU 187 N 6.22 3.80 0.00 3.21 4.77 -1.26 -4.51 117.00 129.23 1t6n n LEU 187 Ca 0.02 -1.85 0.10 0.00 -0.03 0.00 0.00 56.01 54.25 1t6n n LEU 187 Cb 0.48 -0.41 0.57 0.00 -2.33 0.00 0.00 43.42 41.73 1t6n n LEU 187 CO 0.51 0.91 0.78 0.29 -1.33 0.00 0.00 177.39 178.55 1t6n n LYS 188 N 1.58 0.72 0.00 3.23 5.02 -1.26 -3.04 118.16 124.42 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 0.61 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 34.21 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 -0.91 0.00 -1.78 2.13 8.25 -1.26 -4.66 115.22 116.99 1t6n n HIS 189 Ca 0.14 -0.32 -0.42 0.00 -0.26 0.00 0.00 57.72 56.87 1t6n n HIS 189 Cb 0.07 -0.03 -0.03 0.00 1.12 0.00 0.00 29.99 31.11 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 -0.63 2.92 -0.54 1.59 -1.09 -1.17 -4.37 121.20 117.91 1t6n s ILE 190 Ca 0.00 0.20 0.10 0.00 -2.23 0.00 0.00 60.65 58.72 1t6n s ILE 190 Cb 0.00 -3.13 -0.09 0.00 -1.58 0.00 0.00 42.46 37.66 1t6n s ILE 190 CO 0.00 -0.01 0.45 0.29 -1.23 0.00 0.00 174.94 174.44 1t6n n LYS 191 N 6.48 3.49 -3.65 2.79 4.76 0.16 -4.39 118.16 127.80 1t6n n LYS 191 Ca 0.18 -0.09 -0.19 0.00 -2.87 0.00 0.00 58.31 55.34 1t6n n LYS 191 Cb 0.40 -0.99 -0.16 0.00 -1.84 0.00 0.00 35.03 32.44 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 -1.86 -0.08 -0.28 2.13 3.76 -1.04 -1.13 115.29 116.80 1t6n s HIS 192 Ca 0.04 0.40 -0.02 0.00 -0.15 0.00 0.00 55.06 55.33 1t6n s HIS 192 Cb 0.08 -0.37 0.04 0.00 1.11 0.00 0.00 32.58 33.43 1t6n s HIS 192 CO 0.39 -0.28 -0.03 0.12 -0.85 0.00 0.00 174.74 174.09 1t6n s PHE 193 N 2.24 3.19 -0.05 1.40 5.36 0.10 -1.01 117.98 129.21 1t6n s PHE 193 Ca 0.04 -1.77 0.04 0.00 -0.96 0.00 0.00 56.93 54.28 1t6n s PHE 193 Cb -0.13 -2.08 -0.00 0.00 -0.34 0.00 0.00 43.02 40.47 1t6n s PHE 193 CO -0.05 -0.78 -0.17 0.42 -1.46 0.00 0.00 175.22 173.18 1t6n s ILE 194 N 1.28 1.43 -0.08 3.12 1.01 -0.24 -1.61 121.20 126.11 1t6n s ILE 194 Ca -0.03 -0.70 0.04 0.00 0.00 0.00 0.00 60.65 59.96 1t6n s ILE 194 Cb -0.19 -1.24 -0.00 0.00 0.01 0.00 0.00 42.46 41.04 1t6n s ILE 194 CO -0.02 0.41 -0.23 -0.76 0.00 0.00 0.00 174.94 174.34 1t6n s LEU 195 N 0.16 2.04 0.08 2.97 1.43 -0.78 -0.88 118.68 123.71 1t6n s LEU 195 Ca -0.07 -0.51 0.09 0.00 -1.03 0.00 0.00 54.13 52.61 1t6n s LEU 195 Cb -0.13 -1.32 -0.03 0.00 0.03 0.00 0.00 46.19 44.73 1t6n s LEU 195 CO 0.03 0.17 -0.22 -0.62 0.23 0.00 0.00 176.35 175.94 1t6n s ASP 196 N 0.22 3.56 -1.43 2.29 -1.08 -0.37 -0.93 116.67 118.94 1t6n s ASP 196 Ca -0.14 -0.56 -0.06 0.00 -0.52 0.00 0.00 52.55 51.27 1t6n s ASP 196 Cb -0.16 -0.44 0.01 0.00 -1.46 0.00 0.00 42.92 40.87 1t6n s ASP 196 CO 0.07 0.22 0.84 -0.62 0.52 0.00 0.00 175.17 176.20 1t6n n GLU 197 N 1.31 -6.10 0.18 4.34 1.02 0.09 -3.98 120.64 117.50 1t6n n GLU 197 Ca -0.17 0.85 0.11 0.00 -0.02 0.00 0.00 57.16 57.94 1t6n n GLU 197 Cb 0.52 -5.74 0.65 0.00 -0.02 0.00 0.00 31.44 26.85 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 0.02 0.68 -0.27 0.00 -0.00 -1.82 -1.62 116.42 113.41 1t6n h ASP 199 Ca 0.08 -0.45 0.02 0.00 -0.00 0.00 0.00 57.03 56.68 1t6n h ASP 199 Cb 0.28 -0.19 -0.01 0.00 -0.00 0.00 0.00 39.33 39.41 1t6n h ASP 199 CO -0.00 0.98 0.18 0.11 -0.00 0.00 0.00 179.24 180.51 1t6n h LYS 200 N 0.38 0.29 0.04 4.15 1.79 -1.82 -0.56 116.57 120.85 1t6n h LYS 200 Ca 0.05 -0.02 -0.08 0.00 -2.18 0.00 0.00 60.65 58.43 1t6n h LYS 200 Cb 0.77 -0.06 0.01 0.00 -1.58 0.00 0.00 32.23 31.36 1t6n h LYS 200 CO 0.06 0.19 -0.33 0.52 -1.08 0.00 0.00 179.45 178.80 1t6n h MET 201 N 0.30 0.15 0.00 3.15 2.86 -1.40 -3.37 114.93 116.61 1t6n h MET 201 Ca 0.11 -0.22 -0.08 0.00 -2.06 0.00 0.00 59.70 57.45 1t6n h MET 201 Cb 0.07 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 1t6n h MET 201 CO -0.02 1.05 -0.38 -0.07 1.06 0.00 0.00 176.91 178.55 1t6n h LEU 202 N -0.64 0.00 -0.86 1.22 3.38 -1.14 -3.13 115.31 114.14 1t6n h LEU 202 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1t6n h LEU 202 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1t6n h LEU 202 CO 0.06 0.38 0.00 1.05 0.09 0.00 0.00 178.44 180.02 1t6n h GLU 203 N 0.00 0.00 -5.09 1.13 4.11 -1.27 -3.41 114.58 110.05 1t6n h GLU 203 Ca -0.00 0.00 -0.65 0.00 0.07 0.00 0.00 59.36 58.77 1t6n h GLU 203 Cb 1.24 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.33 1t6n h GLU 203 CO 0.05 0.00 -0.17 -0.65 0.07 0.00 0.00 179.01 178.31 1t6n s GLN 204 N -3.42 3.59 0.31 1.06 -0.21 -1.23 -4.98 119.66 114.78 1t6n s GLN 204 Ca 0.04 -0.29 0.07 0.00 0.02 0.00 0.00 55.36 55.20 1t6n s GLN 204 Cb 0.09 -3.81 0.81 0.00 1.00 0.00 0.00 33.01 31.10 1t6n s GLN 204 CO 0.51 -0.58 1.73 1.25 -2.12 0.00 0.00 175.29 176.08 1t6n h LEU 205 N 8.91 0.63 -0.28 2.90 5.85 -1.87 0.12 115.31 131.57 1t6n h LEU 205 Ca -0.29 0.13 -0.14 0.00 0.84 0.00 0.00 57.88 58.42 1t6n h LEU 205 Cb 1.13 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.20 1t6n h LEU 205 CO 0.73 0.12 -0.36 -2.24 -0.34 0.00 0.00 178.44 176.36 1t6n h ASP 206 N 0.59 0.80 0.12 1.25 2.03 -1.93 -2.30 116.42 116.98 1t6n h ASP 206 Ca 0.61 -0.50 -0.17 0.00 -0.73 0.00 0.00 57.03 56.24 1t6n h ASP 206 Cb 1.10 -0.23 -0.00 0.00 -0.83 0.00 0.00 39.33 39.37 1t6n h ASP 206 CO -0.46 1.14 -0.64 -0.03 -1.03 0.00 0.00 179.24 178.22 1t6n h MET 207 N 0.48 0.50 -0.12 4.15 4.05 -1.58 -2.72 114.93 119.69 1t6n h MET 207 Ca 0.03 -0.36 0.02 0.00 -0.28 0.00 0.00 59.70 59.12 1t6n h MET 207 Cb 0.95 0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 31.78 1t6n h MET 207 CO 0.09 0.98 -0.03 -0.09 0.23 0.00 0.00 176.91 178.08 1t6n h ARG 208 N 0.36 -0.00 -0.86 0.39 2.43 -0.74 -0.60 114.38 115.37 1t6n h ARG 208 Ca -0.01 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.21 1t6n h ARG 208 Cb 1.20 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.69 1t6n h ARG 208 CO 0.12 -0.00 0.54 0.00 -1.51 0.00 0.00 179.97 179.11 1t6n h ARG 209 N -0.00 0.96 -0.22 0.20 2.47 -1.37 0.10 114.38 116.52 1t6n h ARG 209 Ca 0.06 -0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1t6n h ARG 209 Cb 0.09 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.18 1t6n h ARG 209 CO -0.12 0.64 0.13 -0.44 0.56 0.00 0.00 179.97 180.73 1t6n h ASP 210 N 0.99 0.27 -0.78 7.04 5.19 -1.07 -0.55 116.42 127.51 1t6n h ASP 210 Ca 0.37 -0.06 0.02 0.00 -0.62 0.00 0.00 57.03 56.74 1t6n h ASP 210 Cb 0.15 -0.07 -0.04 0.00 0.18 0.00 0.00 39.33 39.55 1t6n h ASP 210 CO -0.16 0.25 0.51 0.58 -3.12 0.00 0.00 179.24 177.30 1t6n h VAL 211 N 0.26 1.16 -0.51 -1.35 2.07 -0.51 -1.17 116.25 116.19 1t6n h VAL 211 Ca 0.08 -0.34 -0.13 0.00 0.82 0.00 0.00 66.70 67.13 1t6n h VAL 211 Cb 0.04 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.86 1t6n h VAL 211 CO -0.01 0.18 -0.17 1.56 0.02 0.00 0.00 177.57 179.15 1t6n h GLN 212 N 1.00 1.03 -0.46 1.57 4.20 -0.43 -0.30 115.11 121.71 1t6n h GLN 212 Ca 0.30 -0.41 -0.10 0.00 0.06 0.00 0.00 58.65 58.49 1t6n h GLN 212 Cb -0.03 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 1t6n h GLN 212 CO -0.08 1.10 -0.13 1.49 -0.67 0.00 0.00 178.83 180.54 1t6n h GLU 213 N 0.89 0.86 -0.22 1.46 4.81 -0.54 -1.98 114.58 119.86 1t6n h GLU 213 Ca 0.12 -0.31 -0.03 0.00 -0.13 0.00 0.00 59.36 59.02 1t6n h GLU 213 Cb 0.75 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 1t6n h GLU 213 CO 0.06 0.94 0.02 0.82 -0.73 0.00 0.00 179.01 180.12 1t6n h ILE 214 N 0.77 1.24 -0.63 2.32 2.04 -1.08 -3.05 117.51 119.12 1t6n h ILE 214 Ca 0.12 -0.81 0.09 0.00 1.00 0.00 0.00 64.86 65.26 1t6n h ILE 214 Cb 0.65 1.35 -0.07 0.00 -0.74 0.00 0.00 36.82 38.01 1t6n h ILE 214 CO 0.05 0.25 0.26 0.15 0.00 0.00 0.00 178.15 178.86 1t6n h PHE 215 N 0.15 0.46 -0.04 1.37 3.57 -0.87 -0.69 116.94 120.90 1t6n h PHE 215 Ca 0.06 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.60 1t6n h PHE 215 Cb 0.36 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.98 1t6n h PHE 215 CO 0.03 0.14 0.07 -0.09 -2.23 0.00 0.00 178.31 176.22 1t6n h ARG 216 N 0.46 0.00 -0.00 1.11 9.65 -1.26 -1.23 114.38 123.11 1t6n h ARG 216 Ca 0.31 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.19 1t6n h ARG 216 Cb 0.36 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.94 1t6n h ARG 216 CO -0.29 0.00 -0.29 -1.33 2.80 0.00 0.00 179.97 180.86 1t6n n MET 217 N -3.54 0.08 -3.40 0.20 2.81 -0.27 -4.91 117.12 108.10 1t6n n MET 217 Ca -0.02 -0.03 -0.21 0.00 -1.81 0.00 0.00 57.70 55.62 1t6n n MET 217 Cb 0.15 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.16 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 -2.95 4.46 0.66 2.03 -4.23 -0.47 -4.21 115.64 110.95 1t6n s THR 218 Ca 0.14 -0.74 -0.17 0.00 -1.18 0.00 0.00 61.69 59.74 1t6n s THR 218 Cb 0.18 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.42 1t6n s THR 218 CO 0.62 -0.32 1.24 -2.84 -0.54 0.00 0.00 174.62 172.78 1t6n s PRO 219 N -4.28 2.51 0.10 3.99 0.02 -1.26 -4.96 135.00 131.12 1t6n s PRO 219 Ca 0.43 1.90 -0.10 0.00 0.02 0.00 0.00 61.00 63.25 1t6n s PRO 219 Cb -0.10 -1.86 -0.15 0.00 0.02 0.00 0.00 34.50 32.41 1t6n s PRO 219 CO 0.34 -1.59 1.27 0.45 -0.33 0.00 0.00 177.00 177.14 1t6n h HIS 220 N 0.33 0.90 -1.22 6.54 3.86 -1.95 -3.38 115.15 120.23 1t6n h HIS 220 Ca -0.50 -0.46 -0.61 0.00 -1.16 0.00 0.00 60.37 57.64 1t6n h HIS 220 Cb 1.31 -0.11 -0.11 0.00 1.06 0.00 0.00 27.41 29.56 1t6n h HIS 220 CO 0.45 1.28 1.48 -2.00 0.86 0.00 0.00 177.93 180.00 1t6n s GLU 221 N -3.43 3.61 0.18 2.45 2.56 -1.26 -4.89 118.70 117.92 1t6n s GLU 221 Ca -0.08 -1.23 -0.20 0.00 0.00 0.00 0.00 54.97 53.45 1t6n s GLU 221 Cb 0.08 -5.33 0.05 0.00 2.00 0.00 0.00 34.13 30.93 1t6n s GLU 221 CO 0.90 -2.17 0.57 -1.59 -0.56 0.00 0.00 175.26 172.40 1t6n s LYS 222 N 4.72 1.35 -0.02 4.30 -2.85 -1.26 -4.84 119.74 121.14 1t6n s LYS 222 Ca 0.45 -0.68 -0.16 0.00 -1.00 0.00 0.00 55.97 54.58 1t6n s LYS 222 Cb -0.00 0.56 -0.05 0.00 -2.06 0.00 0.00 37.83 36.27 1t6n s LYS 222 CO -0.09 -0.58 0.45 -1.14 0.10 0.00 0.00 175.35 174.08 1t6n s GLN 223 N -3.81 4.06 -0.12 1.78 0.74 -0.29 -4.98 119.66 117.04 1t6n s GLN 223 Ca 0.05 0.46 0.01 0.00 0.05 0.00 0.00 55.36 55.94 1t6n s GLN 223 Cb -0.01 -3.28 0.02 0.00 1.10 0.00 0.00 33.01 30.84 1t6n s GLN 223 CO -0.07 0.56 -0.15 0.08 -0.55 0.00 0.00 175.29 175.15 1t6n s VAL 224 N -0.67 1.56 0.01 1.34 1.01 -1.26 -0.72 120.40 121.66 1t6n s VAL 224 Ca 0.25 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.59 1t6n s VAL 224 Cb -0.17 -1.43 -0.01 0.00 0.00 0.00 0.00 36.38 34.77 1t6n s VAL 224 CO 0.13 0.45 -0.07 -0.04 0.00 0.00 0.00 175.10 175.57 1t6n s MET 225 N 1.10 0.57 0.01 2.72 -1.94 -0.63 -1.63 119.30 119.50 1t6n s MET 225 Ca -0.04 -0.37 0.02 0.00 -1.71 0.00 0.00 55.69 53.60 1t6n s MET 225 Cb -0.14 -0.51 -0.01 0.00 2.01 0.00 0.00 34.83 36.17 1t6n s MET 225 CO -0.04 0.13 -0.08 -1.64 -0.01 0.00 0.00 175.02 173.39 1t6n s MET 226 N -0.49 0.58 0.07 2.03 -1.94 0.37 -1.86 119.30 118.06 1t6n s MET 226 Ca 0.00 -0.40 0.02 0.00 -1.71 0.00 0.00 55.69 53.60 1t6n s MET 226 Cb -0.04 -0.52 -0.03 0.00 2.01 0.00 0.00 34.83 36.25 1t6n s MET 226 CO -0.00 0.13 -0.07 -0.06 -0.01 0.00 0.00 175.02 175.01 1t6n s PHE 227 N -0.49 0.79 -0.15 -0.03 0.40 -0.10 -0.95 117.98 117.45 1t6n s PHE 227 Ca -0.00 -0.69 -0.31 0.00 -0.60 0.00 0.00 56.93 55.32 1t6n s PHE 227 Cb -0.05 -0.46 0.13 0.00 0.51 0.00 0.00 43.02 43.15 1t6n s PHE 227 CO 0.00 -0.11 1.09 0.45 0.70 0.00 0.00 175.22 177.35 1t6n s SER 228 N -2.27 -0.25 0.32 1.36 0.15 -0.78 -0.73 113.70 111.50 1t6n s SER 228 Ca 0.00 0.12 0.18 0.00 0.70 0.00 0.00 55.95 56.95 1t6n s SER 228 Cb -0.03 0.23 0.14 0.00 -1.71 0.00 0.00 66.02 64.66 1t6n s SER 228 CO -0.02 -0.33 1.46 0.00 1.20 0.00 0.00 173.24 175.55 1t6n h ALA 229 N 2.17 0.77 -3.33 5.45 0.00 -1.87 -1.30 119.26 121.15 1t6n h ALA 229 Ca -0.15 -0.32 -0.41 0.00 0.00 0.00 0.00 54.91 54.03 1t6n h ALA 229 Cb 1.19 -0.04 -0.37 0.00 0.00 0.00 0.00 17.79 18.56 1t6n h ALA 229 CO 0.27 0.43 -0.76 0.95 0.00 0.00 0.00 179.25 180.14 1t6n s THR 230 N -3.04 0.31 -0.33 0.00 -4.23 -1.26 -4.43 115.64 102.65 1t6n s THR 230 Ca 0.05 0.12 0.01 0.00 -1.18 0.00 0.00 61.69 60.68 1t6n s THR 230 Cb 0.07 -0.45 0.10 0.00 1.34 0.00 0.00 72.50 73.56 1t6n s THR 230 CO 0.73 0.23 0.10 -0.76 -0.54 0.00 0.00 174.62 174.38 1t6n s LEU 231 N 1.70 2.89 0.93 4.79 1.43 -1.26 -4.64 118.68 124.53 1t6n s LEU 231 Ca 0.01 -1.89 -0.10 0.00 -1.03 0.00 0.00 54.13 51.12 1t6n s LEU 231 Cb -0.13 -1.07 0.15 0.00 0.03 0.00 0.00 46.19 45.18 1t6n s LEU 231 CO -0.04 -0.39 1.13 -0.94 0.23 0.00 0.00 176.35 176.34 1t6n s SER 232 N 1.29 2.86 0.38 2.29 1.04 -1.26 -4.82 113.70 115.48 1t6n s SER 232 Ca 0.11 2.08 0.08 0.00 0.48 0.00 0.00 55.95 58.71 1t6n s SER 232 Cb -0.19 -2.53 0.77 0.00 0.10 0.00 0.00 66.02 64.17 1t6n s SER 232 CO -0.18 -3.12 1.93 0.11 0.98 0.00 0.00 173.24 172.95 1t6n h LYS 233 N -1.88 0.32 -0.08 4.02 1.79 -2.01 -2.59 116.57 116.13 1t6n h LYS 233 Ca -0.45 -0.06 -0.13 0.00 -2.18 0.00 0.00 60.65 57.83 1t6n h LYS 233 Cb 1.27 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.86 1t6n h LYS 233 CO 0.43 0.40 -0.52 1.49 -1.08 0.00 0.00 179.45 180.17 1t6n h GLU 234 N 0.31 0.22 0.00 3.15 4.81 -2.05 -3.26 114.58 117.76 1t6n h GLU 234 Ca 0.07 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.14 1t6n h GLU 234 Cb 0.32 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 1t6n h GLU 234 CO 0.01 0.69 -0.92 0.97 -0.73 0.00 0.00 179.01 179.04 1t6n h ILE 235 N 0.18 0.10 -0.55 2.32 6.09 -1.85 -3.38 117.51 120.42 1t6n h ILE 235 Ca 0.00 -1.18 0.07 0.00 -1.37 0.00 0.00 64.86 62.38 1t6n h ILE 235 Cb 0.98 1.67 -0.06 0.00 0.47 0.00 0.00 36.82 39.88 1t6n h ILE 235 CO 0.08 0.06 0.22 0.03 -3.07 0.00 0.00 178.15 175.47 1t6n h ARG 236 N 0.00 0.41 -0.25 2.19 3.08 -1.51 -1.42 114.38 116.89 1t6n h ARG 236 Ca -0.02 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 1t6n h ARG 236 Cb 1.10 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.04 1t6n h ARG 236 CO 0.01 0.27 0.03 -1.35 -1.07 0.00 0.00 179.97 177.86 1t6n h PRO 237 N 0.42 0.35 -0.68 0.04 0.11 -1.75 -2.07 132.00 128.43 1t6n h PRO 237 Ca 0.26 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.26 1t6n h PRO 237 Cb 0.26 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.28 1t6n h PRO 237 CO -0.24 0.36 0.21 0.28 -0.21 0.00 0.00 178.00 178.40 1t6n h VAL 238 N 0.35 1.25 -0.32 3.15 2.07 -1.49 -2.53 116.25 118.73 1t6n h VAL 238 Ca 0.08 -0.86 -0.08 0.00 0.82 0.00 0.00 66.70 66.66 1t6n h VAL 238 Cb 0.19 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1t6n h VAL 238 CO 0.00 0.34 -0.10 0.00 0.02 0.00 0.00 177.57 177.83 1t6n h ARG 240 N 0.40 0.00 0.00 0.00 3.08 -1.16 -2.32 114.38 114.38 1t6n h ARG 240 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1t6n h ARG 240 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.65 1t6n h ARG 240 CO 0.04 0.04 0.00 0.87 -1.07 0.00 0.00 179.97 179.85 1t6n h LYS 241 N 0.00 0.00 -0.06 0.04 1.57 -1.33 -1.07 116.57 115.72 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 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1t6n h LYS 241 CO 0.01 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 180.08 1t6n n PHE 242 N -2.78 0.05 -4.45 -1.35 3.01 -0.87 -5.00 117.46 106.06 1t6n n PHE 242 Ca -0.01 -0.02 -0.27 0.00 1.01 0.00 0.00 57.45 58.16 1t6n n PHE 242 Cb 0.12 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.49 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 -1.95 2.04 -0.23 -1.08 -1.94 -0.41 -4.88 119.30 110.86 1t6n s MET 243 Ca 0.32 -2.00 0.02 0.00 -1.71 0.00 0.00 55.69 52.31 1t6n s MET 243 Cb 0.20 -1.76 0.05 0.00 2.01 0.00 0.00 34.83 35.33 1t6n s MET 243 CO 0.31 -0.05 -0.13 -0.65 -0.01 0.00 0.00 175.02 174.49 1t6n s GLN 244 N -3.76 2.35 -0.54 2.03 -0.21 -1.26 -4.85 119.66 113.42 1t6n s GLN 244 Ca 0.37 -1.10 -0.14 0.00 0.02 0.00 0.00 55.36 54.50 1t6n s GLN 244 Cb 0.07 -2.70 0.02 0.00 1.00 0.00 0.00 33.01 31.40 1t6n s GLN 244 CO 0.19 -0.46 0.31 -3.47 -2.12 0.00 0.00 175.29 169.74 1t6n n ASP 245 N 4.54 -1.91 -4.82 5.90 2.03 -1.26 -4.59 116.55 116.44 1t6n n ASP 245 Ca -0.16 -0.59 -0.32 0.00 0.52 0.00 0.00 54.79 54.25 1t6n n ASP 245 Cb 0.45 -0.72 0.02 0.00 -0.72 0.00 0.00 41.12 40.14 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 -5.82 3.29 0.24 -0.67 0.04 -1.26 -4.82 135.00 126.00 1t6n s PRO 246 Ca 0.20 1.05 -0.30 0.00 0.04 0.00 0.00 61.00 61.99 1t6n s PRO 246 Cb -0.11 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 1t6n s PRO 246 CO 0.44 -0.82 0.94 1.41 0.04 0.00 0.00 177.00 179.01 1t6n s MET 247 N -4.49 4.85 -0.01 4.56 -2.45 -0.61 -4.92 119.30 116.23 1t6n s MET 247 Ca 0.60 1.49 0.06 0.00 -1.25 0.00 0.00 55.69 56.59 1t6n s MET 247 Cb -0.14 -3.28 -0.02 0.00 1.25 0.00 0.00 34.83 32.64 1t6n s MET 247 CO 0.44 0.51 -0.18 -1.21 1.05 0.00 0.00 175.02 175.62 1t6n s GLU 248 N -1.16 1.46 -0.14 4.11 2.02 -1.26 -1.67 118.70 122.05 1t6n s GLU 248 Ca 0.41 -0.68 -0.06 0.00 0.02 0.00 0.00 54.97 54.65 1t6n s GLU 248 Cb -0.26 -1.43 0.06 0.00 0.10 0.00 0.00 34.13 32.60 1t6n s GLU 248 CO 0.32 0.39 0.32 -1.50 0.02 0.00 0.00 175.26 174.81 1t6n s ILE 249 N -0.47 -0.23 -0.12 -1.63 2.07 -0.79 -5.00 121.20 115.03 1t6n s ILE 249 Ca 0.07 0.17 0.00 0.00 -1.41 0.00 0.00 60.65 59.48 1t6n s ILE 249 Cb -0.07 -0.51 0.02 0.00 0.13 0.00 0.00 42.46 42.03 1t6n s ILE 249 CO -0.00 0.07 -0.10 -0.36 -1.91 0.00 0.00 174.94 172.63 1t6n s PHE 250 N 1.81 1.68 0.00 3.50 0.40 -1.26 -0.65 117.98 123.47 1t6n s PHE 250 Ca -0.05 -0.84 0.00 0.00 -0.60 0.00 0.00 56.93 55.43 1t6n s PHE 250 Cb -0.10 -1.32 0.00 0.00 0.51 0.00 0.00 43.02 42.11 1t6n s PHE 250 CO -0.10 -0.52 0.00 0.28 0.70 0.00 0.00 175.22 175.58