#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i9g s THR 2 N 0.00 4.48 0.01 3.84 2.01 -1.26 -5.00 115.64 119.71 3i9g s THR 2 Ca 0.00 1.78 -0.16 0.00 0.31 0.00 0.00 61.69 63.61 3i9g s THR 2 Cb 0.00 -4.14 -0.06 0.00 0.01 0.00 0.00 72.50 68.31 3i9g s THR 2 CO 0.00 0.03 0.46 -0.89 -0.69 0.00 0.00 174.62 173.53 3i9g s THR 3 N 1.93 4.96 -0.19 -0.82 2.01 -1.26 -4.77 115.64 117.50 3i9g s THR 3 Ca 0.53 0.96 -0.01 0.00 0.31 0.00 0.00 61.69 63.48 3i9g s THR 3 Cb -0.22 -3.78 0.01 0.00 0.01 0.00 0.00 72.50 68.51 3i9g s THR 3 CO 0.22 0.55 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.87 3i9g s VAL 4 N -0.91 2.62 -0.33 3.82 1.01 -1.26 -1.53 120.40 123.82 3i9g s VAL 4 Ca 0.25 -0.76 -0.07 0.00 0.00 0.00 0.00 61.98 61.41 3i9g s VAL 4 Cb -0.17 -2.14 0.03 0.00 0.00 0.00 0.00 36.38 34.10 3i9g s VAL 4 CO 0.15 0.50 0.11 -0.89 0.00 0.00 0.00 175.10 174.97 3i9g s THR 5 N 1.27 3.96 -0.14 3.92 2.01 0.30 -4.39 115.64 122.56 3i9g s THR 5 Ca 0.04 -0.97 -0.06 0.00 0.31 0.00 0.00 61.69 61.00 3i9g s THR 5 Cb -0.14 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.15 3i9g s THR 5 CO -0.07 -0.12 0.09 -1.58 -0.69 0.00 0.00 174.62 172.24 3i9g s GLN 6 N 1.45 3.62 0.01 4.92 0.74 -1.26 -0.86 119.66 128.28 3i9g s GLN 6 Ca 0.00 -0.27 -0.11 0.00 0.05 0.00 0.00 55.36 55.03 3i9g s GLN 6 Cb -0.19 -3.15 0.01 0.00 1.10 0.00 0.00 33.01 30.79 3i9g s GLN 6 CO 0.03 0.54 0.23 -1.54 -0.55 0.00 0.00 175.29 174.01 3i9g s SER 7 N -0.37 -0.07 0.75 6.67 1.04 -0.32 -4.50 113.70 116.90 3i9g s SER 7 Ca 0.10 -0.14 -0.12 0.00 0.48 0.00 0.00 55.95 56.27 3i9g s SER 7 Cb -0.12 0.28 0.04 0.00 0.10 0.00 0.00 66.02 66.33 3i9g s SER 7 CO 0.02 -0.48 1.13 -2.16 0.98 0.00 0.00 173.24 172.73 3i9g s PRO 8 N -1.81 2.46 0.36 4.02 0.04 -1.26 -1.17 135.00 137.64 3i9g s PRO 8 Ca -0.11 0.34 0.18 0.00 0.04 0.00 0.00 61.00 61.45 3i9g s PRO 8 Cb -0.04 -1.99 0.65 0.00 0.04 0.00 0.00 34.50 33.16 3i9g s PRO 8 CO 0.01 -1.29 1.72 0.77 0.04 0.00 0.00 177.00 178.25 3i9g h SER 9 N -0.84 0.00 -3.72 6.66 0.02 -1.79 -3.40 113.55 110.48 3i9g h SER 9 Ca -0.46 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.31 3i9g h SER 9 Cb 1.28 0.00 -0.27 0.00 0.14 0.00 0.00 62.40 63.55 3i9g h SER 9 CO 0.64 0.40 -0.49 -0.36 -1.14 0.00 0.00 176.83 175.88 3i9g s PHE 10 N -3.62 -0.23 -0.12 3.45 0.40 -1.26 -1.08 117.98 115.53 3i9g s PHE 10 Ca -0.00 0.56 -0.06 0.00 -0.60 0.00 0.00 56.93 56.83 3i9g s PHE 10 Cb 0.11 0.06 0.05 0.00 0.51 0.00 0.00 43.02 43.75 3i9g s PHE 10 CO 0.69 -0.12 0.27 -1.17 0.70 0.00 0.00 175.22 175.59 3i9g s LEU 11 N 0.32 0.34 -0.13 -0.37 2.96 -0.28 -4.93 118.68 116.58 3i9g s LEU 11 Ca -0.02 0.58 -0.08 0.00 -0.22 0.00 0.00 54.13 54.40 3i9g s LEU 11 Cb -0.03 0.84 -0.04 0.00 0.50 0.00 0.00 46.19 47.45 3i9g s LEU 11 CO -0.01 -0.17 0.15 -0.44 -1.32 0.00 0.00 176.35 174.55 3i9g s SER 12 N 1.26 6.36 0.09 3.68 0.01 -1.26 -0.84 113.70 122.99 3i9g s SER 12 Ca -0.09 0.43 -0.13 0.00 1.31 0.00 0.00 55.95 57.47 3i9g s SER 12 Cb -0.10 -2.08 0.02 0.00 0.21 0.00 0.00 66.02 64.07 3i9g s SER 12 CO -0.09 0.36 0.31 0.00 0.41 0.00 0.00 173.24 174.22 3i9g s ALA 13 N -0.73 -0.64 0.30 1.44 0.00 -0.82 -4.87 121.76 116.43 3i9g s ALA 13 Ca 0.14 -0.20 -0.12 0.00 0.00 0.00 0.00 51.96 51.77 3i9g s ALA 13 Cb -0.12 0.51 -0.08 0.00 0.00 0.00 0.00 23.12 23.43 3i9g s ALA 13 CO 0.03 -0.53 0.67 -1.12 0.00 0.00 0.00 175.76 174.81 3i9g s SER 14 N -2.58 6.69 0.17 0.00 0.01 -1.26 -0.52 113.70 116.21 3i9g s SER 14 Ca 0.01 1.12 -0.33 0.00 1.31 0.00 0.00 55.95 58.06 3i9g s SER 14 Cb 0.02 -2.31 -0.15 0.00 0.21 0.00 0.00 66.02 63.79 3i9g s SER 14 CO -0.09 -0.18 1.29 0.52 0.41 0.00 0.00 173.24 175.20 3i9g n VAL 15 N -0.40 0.67 0.00 3.43 0.31 -1.26 -1.41 118.33 119.67 3i9g n VAL 15 Ca 0.02 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 3i9g n VAL 15 Cb 0.53 -1.06 0.00 0.00 -0.91 0.00 0.00 33.84 32.40 3i9g n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3i9g n GLY 16 N 2.27 2.13 3.76 2.92 0.00 0.13 -4.92 105.19 111.49 3i9g n GLY 16 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 3i9g n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3i9g s ASP 17 N -1.91 3.78 -0.06 1.61 -0.00 -0.50 -3.94 116.67 115.65 3i9g s ASP 17 Ca 0.00 1.26 0.04 0.00 -0.00 0.00 0.00 52.55 53.85 3i9g s ASP 17 Cb 0.00 -1.94 -0.02 0.00 -0.00 0.00 0.00 42.92 40.96 3i9g s ASP 17 CO 0.00 -2.42 -0.16 -0.60 -0.00 0.00 0.00 175.17 172.00 3i9g s ARG 18 N -5.10 2.59 0.10 8.23 3.52 -1.26 -1.15 118.95 125.87 3i9g s ARG 18 Ca 0.63 -0.73 0.04 0.00 -0.13 0.00 0.00 55.73 55.54 3i9g s ARG 18 Cb -0.16 -2.37 -0.04 0.00 -1.56 0.00 0.00 34.95 30.82 3i9g s ARG 18 CO 0.55 0.55 -0.10 0.14 -0.81 0.00 0.00 175.30 175.63 3i9g s VAL 19 N -0.55 0.95 -0.07 7.11 -7.23 -0.64 -5.01 120.40 114.97 3i9g s VAL 19 Ca 0.08 -1.65 0.01 0.00 -1.81 0.00 0.00 61.98 58.61 3i9g s VAL 19 Cb -0.11 -1.37 0.02 0.00 0.56 0.00 0.00 36.38 35.47 3i9g s VAL 19 CO 0.01 -0.56 -0.08 -0.89 -0.31 0.00 0.00 175.10 173.27 3i9g s THR 20 N -2.45 0.89 0.08 5.32 2.01 -1.26 -1.52 115.64 118.72 3i9g s THR 20 Ca 0.06 -0.30 0.06 0.00 0.31 0.00 0.00 61.69 61.81 3i9g s THR 20 Cb -0.03 -0.87 -0.04 0.00 0.01 0.00 0.00 72.50 71.58 3i9g s THR 20 CO 0.00 0.31 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.54 3i9g s ILE 21 N 1.00 3.53 0.14 1.82 1.01 0.17 -4.85 121.20 124.01 3i9g s ILE 21 Ca -0.09 -1.11 0.08 0.00 0.00 0.00 0.00 60.65 59.53 3i9g s ILE 21 Cb -0.15 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 3i9g s ILE 21 CO -0.00 0.18 -0.20 0.42 0.00 0.00 0.00 174.94 175.34 3i9g s THR 22 N -1.18 1.78 -0.02 2.92 -4.23 -0.32 -0.73 115.64 113.86 3i9g s THR 22 Ca 0.21 -1.75 0.01 0.00 -1.18 0.00 0.00 61.69 58.99 3i9g s THR 22 Cb -0.11 -1.71 0.01 0.00 1.34 0.00 0.00 72.50 72.02 3i9g s THR 22 CO 0.13 -0.19 -0.03 0.00 -0.54 0.00 0.00 174.62 173.98 3i9g s ILE 24 N 0.43 1.93 0.10 0.00 -1.09 -0.04 -0.98 121.20 121.55 3i9g s ILE 24 Ca -0.05 -0.97 0.05 0.00 -2.23 0.00 0.00 60.65 57.45 3i9g s ILE 24 Cb -0.08 -1.66 -0.04 0.00 -1.58 0.00 0.00 42.46 39.10 3i9g s ILE 24 CO -0.00 0.54 0.03 0.42 -1.23 0.00 0.00 174.94 174.69 3i9g s THR 25 N 0.14 4.15 -0.98 2.92 -4.23 -0.30 -0.54 115.64 116.79 3i9g s THR 25 Ca -0.11 -0.99 0.28 0.00 -1.18 0.00 0.00 61.69 59.69 3i9g s THR 25 Cb -0.16 -3.01 0.24 0.00 1.34 0.00 0.00 72.50 70.91 3i9g s THR 25 CO 0.06 0.07 1.90 0.35 -0.54 0.00 0.00 174.62 176.46 3i9g n THR 26 N 0.38 0.09 -4.22 3.99 -2.24 -0.58 -4.80 114.28 106.90 3i9g n THR 26 Ca -0.10 -0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.54 3i9g n THR 26 Cb 0.52 -0.53 -0.10 0.00 -2.10 0.00 0.00 70.33 68.12 3i9g n THR 26 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3i9g s THR 27 N -3.01 1.04 -0.29 4.28 -4.23 -1.26 -4.95 115.64 107.23 3i9g s THR 27 Ca 0.13 -1.97 -0.29 0.00 -1.18 0.00 0.00 61.69 58.38 3i9g s THR 27 Cb 0.18 -1.74 -0.01 0.00 1.34 0.00 0.00 72.50 72.27 3i9g s THR 27 CO 0.52 -0.74 1.44 -0.62 -0.54 0.00 0.00 174.62 174.67 3i9g s ASP 28 N -3.03 6.51 -0.22 3.99 -1.08 -1.26 -4.64 116.67 116.94 3i9g s ASP 28 Ca 0.14 1.30 0.15 0.00 -0.52 0.00 0.00 52.55 53.62 3i9g s ASP 28 Cb 0.02 -2.54 0.68 0.00 -1.46 0.00 0.00 42.92 39.62 3i9g s ASP 28 CO -0.01 -1.20 1.60 2.30 0.52 0.00 0.00 175.17 178.38 3i9g n ILE 29 N 6.42 2.56 0.00 4.11 -5.35 0.29 -5.00 119.36 122.38 3i9g n ILE 29 Ca 0.17 -1.67 0.00 0.00 -0.27 0.00 0.00 62.75 60.97 3i9g n ILE 29 Cb 0.46 -0.27 0.00 0.00 -1.74 0.00 0.00 39.64 38.09 3i9g n ILE 29 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 3i9g n ASP 30 N 0.01 0.00 -1.75 7.28 5.68 -1.24 -1.16 116.55 125.36 3i9g n ASP 30 Ca 0.26 0.00 0.08 0.00 -0.50 0.00 0.00 54.79 54.62 3i9g n ASP 30 Cb 1.07 0.00 0.39 0.00 -1.14 0.00 0.00 41.12 41.43 3i9g n ASP 30 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3i9g n ASP 31 N 4.29 5.41 -2.43 -1.12 5.68 -1.26 -0.26 116.55 126.85 3i9g n ASP 31 Ca 0.00 -2.83 -0.23 0.00 -0.50 0.00 0.00 54.79 51.23 3i9g n ASP 31 Cb 0.00 -0.65 -0.09 0.00 -1.14 0.00 0.00 41.12 39.23 3i9g n ASP 31 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3i9g n ASP 32 N 0.65 6.27 -4.71 -1.12 8.00 -0.31 -1.29 116.55 124.03 3i9g n ASP 32 Ca 0.27 -2.89 -0.35 0.00 0.71 0.00 0.00 54.79 52.53 3i9g n ASP 32 Cb 1.11 -1.33 -0.09 0.00 -0.02 0.00 0.00 41.12 40.79 3i9g n ASP 32 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 3i9g s MET 33 N -0.40 3.06 0.04 -1.24 1.75 -1.26 -1.56 119.30 119.68 3i9g s MET 33 Ca 0.62 -0.37 0.04 0.00 -1.25 0.00 0.00 55.69 54.73 3i9g s MET 33 Cb 0.33 -2.85 -0.02 0.00 2.84 0.00 0.00 34.83 35.13 3i9g s MET 33 CO -0.12 0.71 -0.11 -0.80 -0.65 0.00 0.00 175.02 174.05 3i9g s ASN 34 N -0.89 1.28 -0.04 1.11 0.01 -0.04 -3.33 114.94 113.05 3i9g s ASN 34 Ca 0.13 -0.46 0.05 0.00 -0.71 0.00 0.00 52.86 51.87 3i9g s ASN 34 Cb -0.11 -0.05 -0.01 0.00 0.41 0.00 0.00 41.25 41.49 3i9g s ASN 34 CO 0.03 -0.05 -0.19 0.26 -1.51 0.00 0.00 177.10 175.64 3i9g s TRP 35 N -0.98 1.79 0.10 2.20 0.52 -0.23 -0.72 118.94 121.61 3i9g s TRP 35 Ca -0.02 -0.47 0.08 0.00 0.02 0.00 0.00 56.10 55.70 3i9g s TRP 35 Cb -0.08 -1.19 -0.03 0.00 -1.15 0.00 0.00 33.47 31.02 3i9g s TRP 35 CO 0.01 -0.13 -0.19 -0.06 0.02 0.00 0.00 176.95 176.60 3i9g s PHE 36 N -0.13 1.66 -0.06 -1.98 0.40 0.01 -0.35 117.98 117.54 3i9g s PHE 36 Ca -0.00 -0.44 0.04 0.00 -0.60 0.00 0.00 56.93 55.93 3i9g s PHE 36 Cb -0.10 -0.90 -0.02 0.00 0.51 0.00 0.00 43.02 42.50 3i9g s PHE 36 CO 0.01 0.19 -0.17 -1.14 0.70 0.00 0.00 175.22 174.81 3i9g s GLN 37 N -2.03 2.56 -0.06 0.44 0.74 -0.31 -1.21 119.66 119.80 3i9g s GLN 37 Ca 0.06 -0.76 -0.00 0.00 0.05 0.00 0.00 55.36 54.71 3i9g s GLN 37 Cb -0.09 -2.33 0.03 0.00 1.10 0.00 0.00 33.01 31.71 3i9g s GLN 37 CO 0.04 0.53 -0.02 -1.14 -0.55 0.00 0.00 175.29 174.15 3i9g s GLN 38 N -0.50 0.69 0.31 1.67 0.74 0.63 0.14 119.66 123.35 3i9g s GLN 38 Ca 0.06 0.01 -0.03 0.00 0.05 0.00 0.00 55.36 55.46 3i9g s GLN 38 Cb -0.12 -0.89 -0.05 0.00 1.10 0.00 0.00 33.01 33.05 3i9g s GLN 38 CO 0.01 -0.20 0.56 -1.21 -0.55 0.00 0.00 175.29 173.90 3i9g s GLU 39 N 1.48 3.58 0.27 1.67 2.02 -1.26 -1.70 118.70 124.76 3i9g s GLU 39 Ca -0.02 -0.08 -0.31 0.00 0.02 0.00 0.00 54.97 54.58 3i9g s GLU 39 Cb -0.13 -2.64 -0.12 0.00 0.10 0.00 0.00 34.13 31.34 3i9g s GLU 39 CO -0.03 0.18 1.61 -2.30 0.02 0.00 0.00 175.26 174.73 3i9g n PRO 40 N -1.23 2.66 -0.93 0.39 -0.02 -1.26 -1.81 135.00 132.80 3i9g n PRO 40 Ca -0.02 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.41 3i9g n PRO 40 Cb 0.55 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 3i9g n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3i9g n GLY 41 N 2.49 0.74 3.59 -1.23 0.00 -1.26 -5.01 105.19 104.50 3i9g n GLY 41 Ca 0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 3i9g n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i9g s LYS 42 N -0.21 2.02 0.56 1.61 1.02 -0.75 -5.13 119.74 118.86 3i9g s LYS 42 Ca 0.00 -1.67 -0.19 0.00 0.02 0.00 0.00 55.97 54.13 3i9g s LYS 42 Cb 0.00 -1.94 -0.05 0.00 -0.52 0.00 0.00 37.83 35.32 3i9g s LYS 42 CO 0.00 0.25 1.12 0.00 -0.92 0.00 0.00 175.35 175.80 3i9g s ALA 43 N -2.47 2.67 0.82 5.17 0.00 -1.26 -4.66 121.76 122.03 3i9g s ALA 43 Ca 0.32 0.77 -0.13 0.00 0.00 0.00 0.00 51.96 52.92 3i9g s ALA 43 Cb -0.03 -3.35 0.08 0.00 0.00 0.00 0.00 23.12 19.82 3i9g s ALA 43 CO 0.18 -0.82 1.14 -2.30 0.00 0.00 0.00 175.76 173.96 3i9g n PRO 44 N -1.46 0.13 -4.87 0.00 -0.02 -1.26 -4.64 135.00 122.87 3i9g n PRO 44 Ca 0.11 0.12 -0.29 0.00 -2.02 0.00 0.00 63.50 61.42 3i9g n PRO 44 Cb 0.51 -2.39 -0.17 0.00 -0.02 0.00 0.00 33.50 31.44 3i9g n PRO 44 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3i9g s LYS 45 N -4.07 2.46 -0.04 -0.52 2.20 0.12 -4.95 119.74 114.94 3i9g s LYS 45 Ca 0.72 -0.67 -0.30 0.00 -0.36 0.00 0.00 55.97 55.36 3i9g s LYS 45 Cb -0.29 -1.94 -0.03 0.00 -1.51 0.00 0.00 37.83 34.06 3i9g s LYS 45 CO 0.52 0.09 1.19 -1.17 -0.36 0.00 0.00 175.35 175.62 3i9g s LEU 46 N 0.56 4.29 -0.28 5.43 2.96 -1.26 -1.16 118.68 129.22 3i9g s LEU 46 Ca -0.15 1.82 -0.11 0.00 -0.22 0.00 0.00 54.13 55.47 3i9g s LEU 46 Cb -0.17 -3.56 -0.13 0.00 0.50 0.00 0.00 46.19 42.83 3i9g s LEU 46 CO 0.05 -0.56 -0.34 0.18 -1.32 0.00 0.00 176.35 174.37 3i9g n LEU 47 N 5.04 2.15 -3.77 -0.68 4.77 0.53 -4.80 117.00 120.23 3i9g n LEU 47 Ca 0.11 0.25 -0.14 0.00 -0.03 0.00 0.00 56.01 56.19 3i9g n LEU 47 Cb 0.46 -0.84 -0.15 0.00 -2.33 0.00 0.00 43.42 40.56 3i9g n LEU 47 CO 0.55 0.65 -0.32 -0.63 -1.33 0.00 0.00 177.39 176.31 3i9g s ILE 48 N -2.51 -0.05 0.47 -0.08 1.01 -1.10 -0.97 121.20 117.97 3i9g s ILE 48 Ca -0.38 0.20 0.07 0.00 0.00 0.00 0.00 60.65 60.54 3i9g s ILE 48 Cb 0.14 -0.12 0.01 0.00 0.01 0.00 0.00 42.46 42.50 3i9g s ILE 48 CO 0.51 0.08 0.43 -0.94 0.00 0.00 0.00 174.94 175.03 3i9g s SER 49 N 1.04 4.94 0.07 3.58 1.04 0.22 -1.07 113.70 123.52 3i9g s SER 49 Ca -0.08 -0.90 -0.34 0.00 0.48 0.00 0.00 55.95 55.11 3i9g s SER 49 Cb -0.12 -0.19 -0.18 0.00 0.10 0.00 0.00 66.02 65.63 3i9g s SER 49 CO -0.03 -0.86 0.82 -0.62 0.98 0.00 0.00 173.24 173.52 3i9g n GLU 50 N -1.69 0.00 -1.40 4.02 1.02 -1.21 -1.76 120.64 119.62 3i9g n GLU 50 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 3i9g n GLU 50 Cb 0.62 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.80 3i9g n GLU 50 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3i9g n GLY 51 N 1.59 0.59 3.78 0.62 0.00 -0.41 -4.06 105.19 107.31 3i9g n GLY 51 Ca 0.18 -0.80 -0.27 0.00 0.00 0.00 0.00 46.02 45.13 3i9g n GLY 51 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3i9g n ASN 52 N 1.67 -5.08 -4.56 1.61 3.02 -1.03 -4.95 115.26 105.93 3i9g n ASN 52 Ca 0.00 -0.70 -0.40 0.00 -0.03 0.00 0.00 54.58 53.45 3i9g n ASN 52 Cb 0.28 -4.32 -0.09 0.00 -0.61 0.00 0.00 39.78 35.04 3i9g n ASN 52 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3i9g s ILE 53 N -3.33 5.13 0.12 2.41 1.01 -0.72 -4.85 121.20 120.97 3i9g s ILE 53 Ca 0.59 0.27 -0.31 0.00 0.00 0.00 0.00 60.65 61.19 3i9g s ILE 53 Cb -0.28 -3.82 -0.08 0.00 0.01 0.00 0.00 42.46 38.29 3i9g s ILE 53 CO 0.79 -0.05 1.33 -0.22 0.00 0.00 0.00 174.94 176.79 3i9g s LEU 54 N 2.13 4.38 0.54 2.97 2.96 -1.26 -0.61 118.68 129.78 3i9g s LEU 54 Ca 0.14 2.26 -0.19 0.00 -0.22 0.00 0.00 54.13 56.13 3i9g s LEU 54 Cb -0.16 -3.59 -0.06 0.00 0.50 0.00 0.00 46.19 42.88 3i9g s LEU 54 CO 0.12 -0.59 1.09 -0.13 -1.32 0.00 0.00 176.35 175.52 3i9g s ARG 55 N 0.89 3.46 0.28 1.98 1.81 -0.14 -4.93 118.95 122.30 3i9g s ARG 55 Ca 0.62 1.49 -0.30 0.00 -1.72 0.00 0.00 55.73 55.82 3i9g s ARG 55 Cb -0.35 -2.03 -0.13 0.00 -0.45 0.00 0.00 34.95 31.99 3i9g s ARG 55 CO 0.31 -0.74 1.38 -2.30 -0.68 0.00 0.00 175.30 173.27 3i9g n PRO 56 N -1.31 2.11 -0.13 3.54 -0.02 -1.26 -1.78 135.00 136.15 3i9g n PRO 56 Ca 0.11 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 3i9g n PRO 56 Cb 0.52 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 3i9g n PRO 56 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3i9g n GLY 57 N 1.71 2.16 3.71 -1.23 0.00 -1.26 -5.03 105.19 105.26 3i9g n GLY 57 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 3i9g n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i9g s VAL 58 N -2.93 4.97 0.44 1.61 1.01 -0.73 -5.02 120.40 119.76 3i9g s VAL 58 Ca 0.00 1.71 -0.24 0.00 0.00 0.00 0.00 61.98 63.45 3i9g s VAL 58 Cb 0.00 -4.16 -0.09 0.00 0.00 0.00 0.00 36.38 32.12 3i9g s VAL 58 CO 0.00 0.21 1.14 -2.65 0.00 0.00 0.00 175.10 173.80 3i9g n PRO 59 N 3.85 1.59 0.00 2.72 -0.02 -1.26 -4.88 135.00 137.00 3i9g n PRO 59 Ca 0.02 0.57 0.12 0.00 -2.02 0.00 0.00 63.50 62.19 3i9g n PRO 59 Cb 0.51 -2.23 0.68 0.00 -0.02 0.00 0.00 33.50 32.44 3i9g n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3i9g n SER 60 N 0.19 0.00 0.13 2.55 3.41 -1.26 -2.21 113.62 116.43 3i9g n SER 60 Ca 0.09 -0.62 0.12 0.00 -0.26 0.00 0.00 58.87 58.19 3i9g n SER 60 Cb 0.40 -0.05 0.49 0.00 -0.26 0.00 0.00 64.21 64.80 3i9g n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3i9g n ARG 61 N -1.05 0.19 -3.29 4.33 1.85 -1.26 -4.55 116.66 112.88 3i9g n ARG 61 Ca 0.17 0.43 -0.39 0.00 -1.00 0.00 0.00 57.85 57.05 3i9g n ARG 61 Cb 0.10 -1.87 -0.07 0.00 -1.05 0.00 0.00 32.46 29.57 3i9g n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3i9g s PHE 62 N -3.32 3.40 0.06 2.89 0.08 -0.94 -1.22 117.98 118.94 3i9g s PHE 62 Ca 0.04 0.77 -0.04 0.00 0.12 0.00 0.00 56.93 57.82 3i9g s PHE 62 Cb 0.09 -2.62 -0.02 0.00 -0.57 0.00 0.00 43.02 39.90 3i9g s PHE 62 CO 0.39 -0.02 0.06 -1.54 -0.10 0.00 0.00 175.22 174.01 3i9g s SER 63 N 1.01 0.30 0.16 1.36 1.04 -0.58 -5.00 113.70 111.99 3i9g s SER 63 Ca 0.24 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 55.91 3i9g s SER 63 Cb -0.15 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.16 3i9g s SER 63 CO 0.09 -0.59 0.03 -0.94 0.98 0.00 0.00 173.24 172.81 3i9g s SER 64 N -2.62 0.81 0.19 7.02 1.04 -1.26 -0.65 113.70 118.23 3i9g s SER 64 Ca 0.02 -1.21 -0.12 0.00 0.48 0.00 0.00 55.95 55.12 3i9g s SER 64 Cb 0.04 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.36 3i9g s SER 64 CO -0.08 -0.65 0.39 -0.94 0.98 0.00 0.00 173.24 172.93 3i9g s SER 65 N -3.13 -0.07 0.00 7.02 1.04 -0.72 -4.94 113.70 112.90 3i9g s SER 65 Ca 0.25 -0.78 0.00 0.00 0.48 0.00 0.00 55.95 55.90 3i9g s SER 65 Cb 0.07 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.69 3i9g s SER 65 CO 0.04 -0.99 0.00 0.61 0.98 0.00 0.00 173.24 173.88 3i9g n GLY 66 N -0.29 3.80 3.36 7.32 0.00 -1.26 -1.03 105.19 117.09 3i9g n GLY 66 Ca -0.07 -1.61 -0.09 0.00 0.00 0.00 0.00 46.02 44.25 3i9g n GLY 66 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3i9g s TYR 67 N -2.07 -0.73 0.00 1.61 5.04 -1.20 -4.81 117.35 115.18 3i9g s TYR 67 Ca 0.00 1.51 0.00 0.00 -2.44 0.00 0.00 57.07 56.14 3i9g s TYR 67 Cb 0.00 0.36 0.00 0.00 0.35 0.00 0.00 41.96 42.67 3i9g s TYR 67 CO 0.00 -0.40 0.00 0.41 -1.34 0.00 0.00 175.55 174.22 3i9g n GLY 68 N 4.39 1.15 0.00 8.97 0.00 0.64 -4.33 105.19 116.01 3i9g n GLY 68 Ca -0.21 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.03 3i9g n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3i9g n THR 69 N 0.00 0.00 -4.84 2.61 -2.24 -1.26 -0.55 114.28 107.99 3i9g n THR 69 Ca 0.00 -0.41 -0.31 0.00 -2.27 0.00 0.00 64.05 61.07 3i9g n THR 69 Cb 0.00 0.95 -0.17 0.00 -2.10 0.00 0.00 70.33 69.01 3i9g n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3i9g s ASP 70 N -0.97 2.82 0.03 3.42 1.01 -1.26 -1.15 116.67 120.57 3i9g s ASP 70 Ca 0.00 -0.52 0.00 0.00 0.71 0.00 0.00 52.55 52.75 3i9g s ASP 70 Cb 0.00 -1.29 -0.02 0.00 1.01 0.00 0.00 42.92 42.61 3i9g s ASP 70 CO 0.00 0.10 -0.04 -0.36 0.21 0.00 0.00 175.17 175.08 3i9g s PHE 71 N 0.64 0.38 0.06 4.23 0.40 -0.15 -3.27 117.98 120.26 3i9g s PHE 71 Ca -0.13 -0.59 0.01 0.00 -0.60 0.00 0.00 56.93 55.62 3i9g s PHE 71 Cb -0.16 -0.26 -0.03 0.00 0.51 0.00 0.00 43.02 43.08 3i9g s PHE 71 CO 0.03 -0.19 -0.05 0.95 0.70 0.00 0.00 175.22 176.66 3i9g s THR 72 N -1.75 0.42 -0.08 0.64 -4.23 -0.20 -0.81 115.64 109.63 3i9g s THR 72 Ca -0.12 -1.48 0.03 0.00 -1.18 0.00 0.00 61.69 58.94 3i9g s THR 72 Cb -0.08 -1.08 0.01 0.00 1.34 0.00 0.00 72.50 72.69 3i9g s THR 72 CO -0.02 -0.71 -0.16 -0.22 -0.54 0.00 0.00 174.62 172.97 3i9g s LEU 73 N -2.33 1.81 -0.12 4.79 2.96 0.09 -1.76 118.68 124.12 3i9g s LEU 73 Ca -0.00 -0.39 0.00 0.00 -0.22 0.00 0.00 54.13 53.52 3i9g s LEU 73 Cb -0.01 -1.03 -0.01 0.00 0.50 0.00 0.00 46.19 45.64 3i9g s LEU 73 CO -0.04 0.08 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.04 3i9g s THR 74 N 0.53 3.00 -0.21 3.68 2.01 0.18 -0.66 115.64 124.17 3i9g s THR 74 Ca -0.16 -0.68 -0.04 0.00 0.31 0.00 0.00 61.69 61.12 3i9g s THR 74 Cb -0.16 -2.25 -0.01 0.00 0.01 0.00 0.00 72.50 70.09 3i9g s THR 74 CO 0.05 0.53 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.84 3i9g s ILE 75 N 0.28 3.37 0.24 1.82 1.01 -0.57 -1.53 121.20 125.81 3i9g s ILE 75 Ca -0.10 -0.50 -0.01 0.00 0.00 0.00 0.00 60.65 60.05 3i9g s ILE 75 Cb -0.16 -2.52 -0.04 0.00 0.01 0.00 0.00 42.46 39.75 3i9g s ILE 75 CO 0.06 0.43 0.43 -0.44 0.00 0.00 0.00 174.94 175.42 3i9g s SER 76 N 1.38 6.37 -1.22 3.58 0.01 -0.35 -1.62 113.70 121.85 3i9g s SER 76 Ca 0.05 0.42 -0.29 0.00 1.31 0.00 0.00 55.95 57.44 3i9g s SER 76 Cb -0.14 -2.02 0.03 0.00 0.21 0.00 0.00 66.02 64.10 3i9g s SER 76 CO -0.03 -0.10 0.67 0.29 0.41 0.00 0.00 173.24 174.48 3i9g n LYS 77 N -0.94 -0.60 -1.61 12.44 5.02 -1.03 -4.74 118.16 126.71 3i9g n LYS 77 Ca -0.05 0.18 -0.54 0.00 -2.02 0.00 0.00 58.31 55.87 3i9g n LYS 77 Cb 0.54 -3.03 -0.07 0.00 -0.02 0.00 0.00 35.03 32.46 3i9g n LYS 77 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3i9g n LEU 78 N -4.81 1.59 -4.86 -0.35 4.77 -0.30 -4.58 117.00 108.46 3i9g n LEU 78 Ca -0.12 1.12 -0.24 0.00 -0.03 0.00 0.00 56.01 56.74 3i9g n LEU 78 Cb 0.58 -1.14 -0.04 0.00 -2.33 0.00 0.00 43.42 40.49 3i9g n LEU 78 CO 0.73 -1.02 -0.15 -1.10 -1.33 0.00 0.00 177.39 174.52 3i9g s GLN 79 N 1.09 3.08 0.35 3.23 -0.21 -1.26 0.21 119.66 126.15 3i9g s GLN 79 Ca 0.88 -0.87 0.10 0.00 0.02 0.00 0.00 55.36 55.49 3i9g s GLN 79 Cb -1.03 -2.71 0.85 0.00 1.00 0.00 0.00 33.01 31.13 3i9g s GLN 79 CO 0.53 0.45 1.82 -1.35 -2.12 0.00 0.00 175.29 174.62 3i9g h PRO 80 N 1.84 0.63 0.00 2.91 0.11 -1.99 0.11 132.00 135.61 3i9g h PRO 80 Ca -0.49 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3i9g h PRO 80 Cb 1.22 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3i9g h PRO 80 CO 0.63 0.42 0.00 -0.85 -0.21 0.00 0.00 178.00 177.99 3i9g n GLU 81 N -4.63 0.11 0.04 1.05 0.00 -1.26 -2.52 120.64 113.43 3i9g n GLU 81 Ca 0.21 0.39 0.13 0.00 0.00 0.00 0.00 57.16 57.88 3i9g n GLU 81 Cb 0.59 -1.73 0.50 0.00 0.00 0.00 0.00 31.44 30.80 3i9g n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3i9g n ASP 82 N -1.94 0.31 -4.50 -1.84 8.00 0.38 -4.67 116.55 112.30 3i9g n ASP 82 Ca 0.02 0.54 -0.42 0.00 0.71 0.00 0.00 54.79 55.64 3i9g n ASP 82 Cb 0.18 -0.62 -0.03 0.00 -0.02 0.00 0.00 41.12 40.63 3i9g n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3i9g s PHE 83 N -3.06 2.73 0.00 1.24 0.08 -1.05 -4.85 117.98 113.07 3i9g s PHE 83 Ca 0.11 -0.84 0.00 0.00 0.12 0.00 0.00 56.93 56.32 3i9g s PHE 83 Cb 0.15 -4.45 0.00 0.00 -0.57 0.00 0.00 43.02 38.15 3i9g s PHE 83 CO 0.50 -1.74 0.00 0.00 -0.10 0.00 0.00 175.22 173.88 3i9g n ALA 84 N 7.88 0.00 -2.76 5.36 0.00 -1.23 -4.91 120.51 124.85 3i9g n ALA 84 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.26 3i9g n ALA 84 Cb 0.49 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.84 3i9g n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3i9g s THR 85 N -2.34 4.39 -0.06 0.00 2.01 -0.69 -1.22 115.64 117.73 3i9g s THR 85 Ca 0.00 -0.21 0.02 0.00 0.31 0.00 0.00 61.69 61.81 3i9g s THR 85 Cb 0.00 -2.88 -0.03 0.00 0.01 0.00 0.00 72.50 69.60 3i9g s THR 85 CO 0.00 0.56 -0.08 -0.31 -0.69 0.00 0.00 174.62 174.10 3i9g s TYR 86 N -0.47 2.89 -0.03 4.92 1.51 0.28 -0.27 117.35 126.18 3i9g s TYR 86 Ca 0.09 -0.01 0.04 0.00 -1.01 0.00 0.00 57.07 56.17 3i9g s TYR 86 Cb -0.12 -1.68 -0.00 0.00 -0.11 0.00 0.00 41.96 40.05 3i9g s TYR 86 CO 0.02 0.32 -0.13 0.71 -1.11 0.00 0.00 175.55 175.35 3i9g s TYR 87 N -0.82 1.33 0.41 2.71 2.02 -0.35 -0.56 117.35 122.09 3i9g s TYR 87 Ca 0.13 -0.35 -0.00 0.00 -0.37 0.00 0.00 57.07 56.48 3i9g s TYR 87 Cb -0.11 -0.91 -0.02 0.00 -0.40 0.00 0.00 41.96 40.53 3i9g s TYR 87 CO 0.02 -0.12 0.63 0.00 -1.57 0.00 0.00 175.55 174.52 3i9g s LEU 89 N -4.48 -0.02 -0.04 0.00 2.96 0.10 -1.81 118.68 115.39 3i9g s LEU 89 Ca 0.45 0.71 -0.22 0.00 -0.22 0.00 0.00 54.13 54.84 3i9g s LEU 89 Cb -0.10 0.99 -0.04 0.00 0.50 0.00 0.00 46.19 47.54 3i9g s LEU 89 CO 0.38 -0.20 0.66 0.00 -1.32 0.00 0.00 176.35 175.87 3i9g s GLN 90 N 1.72 4.41 -0.29 1.98 1.03 -0.74 -0.86 119.66 126.91 3i9g s GLN 90 Ca -0.06 0.83 0.11 0.00 0.04 0.00 0.00 55.36 56.27 3i9g s GLN 90 Cb -0.10 -3.41 0.47 0.00 0.03 0.00 0.00 33.01 29.99 3i9g s GLN 90 CO -0.10 0.17 1.17 -1.13 -2.54 0.00 0.00 175.29 172.85 3i9g n SER 91 N 3.41 4.13 0.08 12.60 3.41 -0.60 -3.53 113.62 133.11 3i9g n SER 91 Ca -0.03 -3.35 -0.23 0.00 -0.26 0.00 0.00 58.87 55.00 3i9g n SER 91 Cb 0.51 -0.38 -0.15 0.00 -0.26 0.00 0.00 64.21 63.93 3i9g n SER 91 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 3i9g h ASP 92 N 2.30 0.63 -5.02 4.04 1.82 -1.86 -3.47 116.42 114.85 3i9g h ASP 92 Ca 0.25 -0.91 -0.05 0.00 -0.39 0.00 0.00 57.03 55.92 3i9g h ASP 92 Cb 1.45 -0.20 -0.15 0.00 0.68 0.00 0.00 39.33 41.11 3i9g h ASP 92 CO 0.63 1.77 0.06 0.54 -1.61 0.00 0.00 179.24 180.63 3i9g s ASN 93 N -7.30 -0.45 0.21 2.28 2.20 -1.26 -5.13 114.94 105.48 3i9g s ASN 93 Ca -0.15 0.13 -0.25 0.00 -0.94 0.00 0.00 52.86 51.65 3i9g s ASN 93 Cb 0.05 0.51 -0.08 0.00 -2.00 0.00 0.00 41.25 39.73 3i9g s ASN 93 CO 0.86 -0.76 0.82 -0.76 -2.94 0.00 0.00 177.10 174.32 3i9g s LEU 94 N -2.13 4.52 0.36 3.54 1.43 -1.26 -3.52 118.68 121.63 3i9g s LEU 94 Ca -0.04 1.69 -0.25 0.00 -1.03 0.00 0.00 54.13 54.50 3i9g s LEU 94 Cb -0.00 -3.51 -0.10 0.00 0.03 0.00 0.00 46.19 42.61 3i9g s LEU 94 CO -0.04 0.13 0.98 -2.16 0.23 0.00 0.00 176.35 175.49 3i9g s PRO 95 N -1.44 4.40 0.27 1.29 0.04 -1.26 -4.92 135.00 133.38 3i9g s PRO 95 Ca 0.40 1.36 -0.30 0.00 0.04 0.00 0.00 61.00 62.50 3i9g s PRO 95 Cb -0.22 -2.63 -0.14 0.00 0.04 0.00 0.00 34.50 31.56 3i9g s PRO 95 CO 0.26 0.10 1.21 1.19 0.04 0.00 0.00 177.00 179.80 3i9g n PHE 96 N 0.18 1.76 -4.02 0.56 3.72 -1.23 -4.70 117.46 113.74 3i9g n PHE 96 Ca 0.04 0.59 -0.13 0.00 -0.05 0.00 0.00 57.45 57.89 3i9g n PHE 96 Cb 0.50 -2.35 -0.13 0.00 -0.94 0.00 0.00 39.48 36.56 3i9g n PHE 96 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3i9g s THR 97 N -0.64 0.25 0.08 4.37 -4.23 -1.23 -5.04 115.64 109.20 3i9g s THR 97 Ca 0.63 -0.35 0.06 0.00 -1.18 0.00 0.00 61.69 60.85 3i9g s THR 97 Cb -0.68 -0.26 -0.04 0.00 1.34 0.00 0.00 72.50 72.87 3i9g s THR 97 CO 0.56 -0.07 -0.09 -0.36 -0.54 0.00 0.00 174.62 174.13 3i9g s PHE 98 N -0.43 2.79 0.90 3.99 0.40 -1.26 -1.79 117.98 122.58 3i9g s PHE 98 Ca -0.03 -0.13 -0.11 0.00 -0.60 0.00 0.00 56.93 56.07 3i9g s PHE 98 Cb -0.03 -1.47 0.13 0.00 0.51 0.00 0.00 43.02 42.15 3i9g s PHE 98 CO -0.00 0.42 1.10 0.20 0.70 0.00 0.00 175.22 177.64 3i9g s GLY 99 N -2.06 1.65 0.00 4.36 0.00 -0.75 -4.64 107.32 105.88 3i9g s GLY 99 Ca 0.21 0.23 0.26 0.00 0.00 0.00 0.00 44.72 45.42 3i9g s GLY 99 CO 0.13 0.68 1.86 0.61 0.00 0.00 0.00 173.10 176.38 3i9g n GLN 100 N -4.01 0.27 0.00 2.90 0.00 -1.26 -4.66 117.38 110.62 3i9g n GLN 100 Ca 0.09 0.05 0.00 0.00 0.00 0.00 0.00 57.00 57.14 3i9g n GLN 100 Cb 0.53 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.27 3i9g n GLN 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3i9g n GLY 101 N 0.96 2.35 2.91 2.61 0.00 -1.26 -5.03 105.19 107.73 3i9g n GLY 101 Ca 0.11 -1.79 -0.28 0.00 0.00 0.00 0.00 46.02 44.06 3i9g n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i9g s THR 102 N -2.27 1.18 -0.23 2.61 2.01 0.27 -4.40 115.64 114.81 3i9g s THR 102 Ca 0.00 -0.59 -0.17 0.00 0.31 0.00 0.00 61.69 61.23 3i9g s THR 102 Cb 0.00 -1.29 -0.03 0.00 0.01 0.00 0.00 72.50 71.19 3i9g s THR 102 CO 0.00 0.21 0.48 -0.75 -0.69 0.00 0.00 174.62 173.86 3i9g s LYS 103 N 1.62 4.12 -0.21 4.92 2.47 -0.24 -0.56 119.74 131.86 3i9g s LYS 103 Ca 0.02 0.30 -0.12 0.00 -1.56 0.00 0.00 55.97 54.60 3i9g s LYS 103 Cb -0.15 -3.60 -0.05 0.00 -1.46 0.00 0.00 37.83 32.58 3i9g s LYS 103 CO -0.08 -0.21 0.23 -0.51 0.16 0.00 0.00 175.35 174.94 3i9g s LEU 104 N 1.85 4.16 0.07 5.43 1.43 -0.35 -1.13 118.68 130.13 3i9g s LEU 104 Ca 0.21 0.29 0.08 0.00 -1.03 0.00 0.00 54.13 53.67 3i9g s LEU 104 Cb -0.15 -2.24 -0.03 0.00 0.03 0.00 0.00 46.19 43.79 3i9g s LEU 104 CO 0.09 0.05 -0.19 -0.70 0.23 0.00 0.00 176.35 175.84 3i9g s GLU 105 N 0.93 1.95 -0.11 1.70 2.12 -0.02 -3.51 118.70 121.76 3i9g s GLU 105 Ca 0.12 -1.06 -0.30 0.00 0.36 0.00 0.00 54.97 54.09 3i9g s GLU 105 Cb -0.13 -2.15 -0.02 0.00 0.26 0.00 0.00 34.13 32.09 3i9g s GLU 105 CO 0.04 0.52 1.13 0.42 -0.54 0.00 0.00 175.26 176.83 3i9g s ILE 106 N -0.99 4.47 0.11 -3.70 1.01 -1.26 -1.95 121.20 118.89 3i9g s ILE 106 Ca 0.16 1.78 -0.30 0.00 0.00 0.00 0.00 60.65 62.28 3i9g s ILE 106 Cb -0.10 -4.14 -0.06 0.00 0.01 0.00 0.00 42.46 38.16 3i9g s ILE 106 CO 0.07 -0.05 1.00 -0.75 0.00 0.00 0.00 174.94 175.21 3i9g s LYS 107 N 2.50 4.65 0.18 2.79 2.20 0.32 -4.85 119.74 127.54 3i9g s LYS 107 Ca 0.52 1.52 0.03 0.00 -0.36 0.00 0.00 55.97 57.68 3i9g s LYS 107 Cb -0.21 -3.36 -0.01 0.00 -1.51 0.00 0.00 37.83 32.74 3i9g s LYS 107 CO 0.17 0.13 0.18 2.89 -0.36 0.00 0.00 175.35 178.36 3i9g n ARG 108 N 2.88 0.25 -1.99 4.03 1.85 -1.26 -4.68 116.66 117.74 3i9g n ARG 108 Ca 0.03 -1.71 -0.32 0.00 -1.00 0.00 0.00 57.85 54.85 3i9g n ARG 108 Cb 0.49 1.45 0.01 0.00 -1.05 0.00 0.00 32.46 33.36 3i9g n ARG 108 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 3i9g s THR 109 N -2.70 3.83 0.31 8.89 -4.23 -1.26 -4.98 115.64 115.50 3i9g s THR 109 Ca 0.20 0.84 -0.30 0.00 -1.18 0.00 0.00 61.69 61.25 3i9g s THR 109 Cb 0.01 -3.38 -0.12 0.00 1.34 0.00 0.00 72.50 70.35 3i9g s THR 109 CO 0.14 -0.54 1.54 0.55 -0.54 0.00 0.00 174.62 175.77 3i9g n VAL 110 N -2.15 1.31 -3.75 2.29 3.14 -1.26 -4.77 118.33 113.15 3i9g n VAL 110 Ca 0.09 -0.33 -0.23 0.00 -2.96 0.00 0.00 64.34 60.90 3i9g n VAL 110 Cb 0.53 -1.90 -0.17 0.00 -1.06 0.00 0.00 33.84 31.23 3i9g n VAL 110 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3i9g s ALA 111 N -0.34 0.67 0.46 1.55 0.00 0.24 -4.94 121.76 119.40 3i9g s ALA 111 Ca 0.61 -0.18 -0.24 0.00 0.00 0.00 0.00 51.96 52.16 3i9g s ALA 111 Cb -0.51 -0.81 -0.07 0.00 0.00 0.00 0.00 23.12 21.73 3i9g s ALA 111 CO 0.53 -0.60 1.24 0.00 0.00 0.00 0.00 175.76 176.93 3i9g s ALA 112 N 1.99 3.02 0.46 0.00 0.00 -1.26 -1.16 121.76 124.80 3i9g s ALA 112 Ca 0.04 1.10 -0.22 0.00 0.00 0.00 0.00 51.96 52.88 3i9g s ALA 112 Cb -0.13 -3.45 -0.08 0.00 0.00 0.00 0.00 23.12 19.46 3i9g s ALA 112 CO -0.06 -0.85 1.07 -1.25 0.00 0.00 0.00 175.76 174.67 3i9g s PRO 113 N -2.61 3.87 0.03 0.00 0.04 -1.26 -4.62 135.00 130.44 3i9g s PRO 113 Ca 0.63 1.51 -0.24 0.00 0.04 0.00 0.00 61.00 62.93 3i9g s PRO 113 Cb -0.34 -2.29 -0.05 0.00 0.04 0.00 0.00 34.50 31.86 3i9g s PRO 113 CO 0.41 -0.39 0.75 -1.12 0.04 0.00 0.00 177.00 176.69 3i9g s SER 114 N -1.71 7.17 -0.09 6.66 0.01 -0.90 -4.84 113.70 120.00 3i9g s SER 114 Ca 0.64 1.40 0.02 0.00 1.31 0.00 0.00 55.95 59.32 3i9g s SER 114 Cb -0.21 -2.45 -0.02 0.00 0.21 0.00 0.00 66.02 63.55 3i9g s SER 114 CO 0.26 0.00 -0.15 -0.69 0.41 0.00 0.00 173.24 173.06 3i9g s VAL 115 N 0.06 2.92 0.02 3.43 1.01 -1.26 -0.28 120.40 126.30 3i9g s VAL 115 Ca 0.38 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.64 3i9g s VAL 115 Cb -0.20 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 3i9g s VAL 115 CO 0.22 0.56 -0.08 -0.36 0.00 0.00 0.00 175.10 175.44 3i9g s PHE 116 N -0.15 0.70 -0.02 5.22 0.08 -0.26 -4.99 117.98 118.55 3i9g s PHE 116 Ca -0.01 -0.30 0.07 0.00 0.12 0.00 0.00 56.93 56.80 3i9g s PHE 116 Cb -0.14 -0.43 -0.02 0.00 -0.57 0.00 0.00 43.02 41.87 3i9g s PHE 116 CO 0.03 -0.03 -0.23 -1.50 -0.10 0.00 0.00 175.22 173.40 3i9g s ILE 117 N -0.77 1.79 -0.19 0.64 2.07 -1.26 -0.56 121.20 122.92 3i9g s ILE 117 Ca -0.03 -0.97 0.01 0.00 -1.41 0.00 0.00 60.65 58.26 3i9g s ILE 117 Cb -0.06 -1.49 0.03 0.00 0.13 0.00 0.00 42.46 41.07 3i9g s ILE 117 CO 0.00 0.51 -0.16 -0.36 -1.91 0.00 0.00 174.94 173.02 3i9g s PHE 118 N -0.50 2.72 0.86 3.50 0.08 0.73 -5.01 117.98 120.36 3i9g s PHE 118 Ca 0.08 -1.69 -0.11 0.00 0.12 0.00 0.00 56.93 55.33 3i9g s PHE 118 Cb -0.09 -1.83 0.11 0.00 -0.57 0.00 0.00 43.02 40.64 3i9g s PHE 118 CO -0.01 -0.79 1.10 -2.14 -0.10 0.00 0.00 175.22 173.28 3i9g s PRO 119 N 1.30 1.51 0.51 0.24 0.02 -1.26 -2.01 135.00 135.31 3i9g s PRO 119 Ca 0.02 1.16 -0.22 0.00 0.02 0.00 0.00 61.00 61.98 3i9g s PRO 119 Cb -0.15 -1.81 -0.06 0.00 0.02 0.00 0.00 34.50 32.50 3i9g s PRO 119 CO -0.11 -2.17 1.30 -1.25 -0.33 0.00 0.00 177.00 174.45 3i9g s PRO 120 N -4.82 3.40 0.59 5.54 0.04 -1.21 -4.84 135.00 133.69 3i9g s PRO 120 Ca 0.64 2.11 -0.16 0.00 0.04 0.00 0.00 61.00 63.62 3i9g s PRO 120 Cb -0.19 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.96 3i9g s PRO 120 CO 0.57 -0.94 1.06 -1.54 0.04 0.00 0.00 177.00 176.19 3i9g s SER 121 N -1.04 5.77 0.29 6.66 1.04 -1.26 -4.94 113.70 120.23 3i9g s SER 121 Ca 0.68 1.85 -0.01 0.00 0.48 0.00 0.00 55.95 58.95 3i9g s SER 121 Cb -0.37 -2.54 0.44 0.00 0.10 0.00 0.00 66.02 63.65 3i9g s SER 121 CO 0.44 -1.17 1.85 0.44 0.98 0.00 0.00 173.24 175.78 3i9g h ASP 122 N 0.50 0.75 -0.74 7.02 3.45 -1.99 -1.45 116.42 123.97 3i9g h ASP 122 Ca -0.47 -0.12 0.01 0.00 0.43 0.00 0.00 57.03 56.88 3i9g h ASP 122 Cb 1.22 -0.20 -0.04 0.00 -0.56 0.00 0.00 39.33 39.76 3i9g h ASP 122 CO 0.57 0.72 0.48 -0.08 -1.57 0.00 0.00 179.24 179.36 3i9g h GLU 123 N 0.80 0.94 -0.36 3.56 4.81 -2.00 -1.77 114.58 120.55 3i9g h GLU 123 Ca 0.18 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.26 3i9g h GLU 123 Cb 0.24 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 3i9g h GLU 123 CO -0.01 0.62 -0.15 0.37 -0.73 0.00 0.00 179.01 179.12 3i9g h GLN 124 N 0.97 0.74 -0.74 1.92 4.15 -1.77 -2.97 115.11 117.41 3i9g h GLN 124 Ca 0.28 -0.31 0.13 0.00 0.77 0.00 0.00 58.65 59.51 3i9g h GLN 124 Cb -0.08 -0.03 -0.05 0.00 0.21 0.00 0.00 27.48 27.53 3i9g h GLN 124 CO -0.07 0.92 0.49 -0.07 -1.93 0.00 0.00 178.83 178.17 3i9g h LEU 125 N 0.53 0.47 -2.37 -2.39 3.38 -0.94 -0.32 115.31 113.68 3i9g h LEU 125 Ca 0.09 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.10 3i9g h LEU 125 Cb 0.68 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 3i9g h LEU 125 CO 0.05 0.26 0.11 0.11 0.09 0.00 0.00 178.44 179.06 3i9g h LYS 126 N 0.51 0.00 -0.02 1.13 1.57 -1.16 -2.32 116.57 116.29 3i9g h LYS 126 Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 3i9g h LYS 126 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.99 3i9g h LYS 126 CO -0.12 0.00 -0.17 -1.13 -0.57 0.00 0.00 179.45 177.46 3i9g n SER 127 N -3.74 2.02 0.00 0.86 3.41 -0.13 -4.96 113.62 111.08 3i9g n SER 127 Ca -0.01 -1.55 0.00 0.00 -0.26 0.00 0.00 58.87 57.05 3i9g n SER 127 Cb 0.21 0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 3i9g n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i9g n GLY 128 N 1.32 0.64 3.21 5.00 0.00 -0.87 -5.07 105.19 109.41 3i9g n GLY 128 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 3i9g n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i9g s THR 129 N -2.00 1.26 -0.14 2.61 2.01 -1.25 -1.40 115.64 116.73 3i9g s THR 129 Ca 0.00 -1.46 0.00 0.00 0.31 0.00 0.00 61.69 60.54 3i9g s THR 129 Cb 0.00 -1.28 0.03 0.00 0.01 0.00 0.00 72.50 71.26 3i9g s THR 129 CO 0.00 -0.26 -0.12 0.00 -0.69 0.00 0.00 174.62 173.55 3i9g s ALA 130 N -1.52 1.71 -0.20 7.40 0.00 0.16 -3.60 121.76 125.71 3i9g s ALA 130 Ca 0.02 -0.83 -0.05 0.00 0.00 0.00 0.00 51.96 51.11 3i9g s ALA 130 Cb -0.08 -1.04 -0.02 0.00 0.00 0.00 0.00 23.12 21.98 3i9g s ALA 130 CO 0.03 -0.44 0.00 -1.12 0.00 0.00 0.00 175.76 174.23 3i9g s SER 131 N 1.55 4.85 -0.17 0.00 0.01 -1.26 -1.27 113.70 117.40 3i9g s SER 131 Ca 0.04 -0.20 -0.05 0.00 1.31 0.00 0.00 55.95 57.05 3i9g s SER 131 Cb -0.13 -1.83 -0.03 0.00 0.21 0.00 0.00 66.02 64.24 3i9g s SER 131 CO -0.10 0.06 0.01 -0.69 0.41 0.00 0.00 173.24 172.93 3i9g s VAL 132 N 1.04 4.30 -0.08 3.43 1.01 0.64 -3.36 120.40 127.38 3i9g s VAL 132 Ca 0.02 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 61.82 3i9g s VAL 132 Cb -0.14 -2.91 -0.01 0.00 0.00 0.00 0.00 36.38 33.31 3i9g s VAL 132 CO 0.02 0.47 -0.19 -0.69 0.00 0.00 0.00 175.10 174.71 3i9g s VAL 133 N 0.44 2.62 -0.11 2.92 1.01 -0.85 -0.00 120.40 126.42 3i9g s VAL 133 Ca -0.00 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.16 3i9g s VAL 133 Cb -0.13 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 34.22 3i9g s VAL 133 CO 0.02 0.56 -0.23 0.00 0.00 0.00 0.00 175.10 175.45 3i9g s LEU 135 N 0.45 2.94 -0.26 0.00 2.96 0.28 -0.85 118.68 124.20 3i9g s LEU 135 Ca -0.16 -0.27 -0.06 0.00 -0.22 0.00 0.00 54.13 53.43 3i9g s LEU 135 Cb -0.17 -1.70 -0.00 0.00 0.50 0.00 0.00 46.19 44.82 3i9g s LEU 135 CO 0.06 0.13 0.03 -0.76 -1.32 0.00 0.00 176.35 174.49 3i9g s LEU 136 N 0.57 3.43 -0.15 -0.68 1.02 0.28 -1.11 118.68 122.05 3i9g s LEU 136 Ca -0.05 -0.53 -0.03 0.00 0.02 0.00 0.00 54.13 53.53 3i9g s LEU 136 Cb -0.15 -1.83 -0.03 0.00 0.02 0.00 0.00 46.19 44.20 3i9g s LEU 136 CO 0.03 -0.10 -0.04 0.21 0.02 0.00 0.00 176.35 176.46 3i9g s ASN 137 N 1.50 4.78 -1.00 2.29 2.47 0.61 -1.11 114.94 124.48 3i9g s ASN 137 Ca 0.04 -0.12 -0.08 0.00 0.42 0.00 0.00 52.86 53.12 3i9g s ASN 137 Cb -0.16 -1.72 -0.04 0.00 -1.45 0.00 0.00 41.25 37.88 3i9g s ASN 137 CO 0.00 0.19 0.83 0.59 -3.72 0.00 0.00 177.10 174.99 3i9g n ASN 138 N 3.37 -6.49 -4.51 -4.21 3.02 -0.86 -2.12 115.26 103.47 3i9g n ASN 138 Ca -0.17 -0.67 -0.25 0.00 -0.03 0.00 0.00 54.58 53.46 3i9g n ASN 138 Cb 0.53 -4.61 -0.10 0.00 -0.61 0.00 0.00 39.78 34.99 3i9g n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 3i9g s PHE 139 N -3.31 2.35 -0.28 3.10 -0.71 0.67 -4.61 117.98 115.20 3i9g s PHE 139 Ca 0.35 -0.43 -0.19 0.00 -1.04 0.00 0.00 56.93 55.62 3i9g s PHE 139 Cb -0.07 -1.21 0.08 0.00 -1.21 0.00 0.00 43.02 40.61 3i9g s PHE 139 CO 0.78 0.64 0.71 -0.47 -1.34 0.00 0.00 175.22 175.55 3i9g s TYR 140 N -2.57 -0.95 1.07 3.49 6.14 -0.31 -0.77 117.35 123.46 3i9g s TYR 140 Ca 0.31 2.03 -0.18 0.00 0.64 0.00 0.00 57.07 59.87 3i9g s TYR 140 Cb -0.01 0.49 0.25 0.00 0.42 0.00 0.00 41.96 43.11 3i9g s TYR 140 CO 0.16 -0.46 1.25 -1.25 0.64 0.00 0.00 175.55 175.89 3i9g s PRO 141 N 1.15 -0.24 0.36 4.97 0.04 -1.26 -0.59 135.00 139.42 3i9g s PRO 141 Ca -0.06 -0.34 0.12 0.00 0.04 0.00 0.00 61.00 60.75 3i9g s PRO 141 Cb -0.05 -1.74 0.67 0.00 0.04 0.00 0.00 34.50 33.42 3i9g s PRO 141 CO -0.12 -3.01 1.80 -0.09 0.04 0.00 0.00 177.00 175.62 3i9g h ARG 142 N -2.07 0.02 -6.47 4.56 2.43 -1.98 -3.44 114.38 107.43 3i9g h ARG 142 Ca -0.44 -0.01 -0.53 0.00 -0.81 0.00 0.00 59.98 58.19 3i9g h ARG 142 Cb 1.25 -0.00 0.03 0.00 -0.42 0.00 0.00 29.97 30.82 3i9g h ARG 142 CO 0.33 0.41 1.01 -1.21 -1.51 0.00 0.00 179.97 179.01 3i9g s GLU 143 N -4.14 4.19 -0.20 0.20 8.01 -1.26 -4.99 118.70 120.52 3i9g s GLU 143 Ca -0.03 2.38 -0.18 0.00 0.01 0.00 0.00 54.97 57.15 3i9g s GLU 143 Cb 0.14 -3.57 0.05 0.00 -4.31 0.00 0.00 34.13 26.44 3i9g s GLU 143 CO 0.73 -0.75 0.52 0.00 0.01 0.00 0.00 175.26 175.78 3i9g s ALA 144 N 2.58 -1.29 -0.18 5.21 0.00 -1.26 -4.63 121.76 122.18 3i9g s ALA 144 Ca 0.75 1.49 -0.03 0.00 0.00 0.00 0.00 51.96 54.16 3i9g s ALA 144 Cb -0.41 -0.87 -0.02 0.00 0.00 0.00 0.00 23.12 21.82 3i9g s ALA 144 CO 0.33 -0.25 -0.05 0.21 0.00 0.00 0.00 175.76 176.00 3i9g s LYS 145 N 0.32 3.54 -0.19 0.00 2.20 -0.28 -4.99 119.74 120.35 3i9g s LYS 145 Ca -0.00 -0.57 -0.00 0.00 -0.36 0.00 0.00 55.97 55.03 3i9g s LYS 145 Cb -0.04 -2.93 0.01 0.00 -1.51 0.00 0.00 37.83 33.36 3i9g s LYS 145 CO 0.00 0.07 -0.15 0.08 -0.36 0.00 0.00 175.35 175.00 3i9g s VAL 146 N 0.79 2.50 -0.11 4.02 1.01 -1.26 -1.07 120.40 126.28 3i9g s VAL 146 Ca -0.02 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.19 3i9g s VAL 146 Cb -0.15 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 34.14 3i9g s VAL 146 CO 0.02 0.50 -0.18 -1.10 0.00 0.00 0.00 175.10 174.34 3i9g s GLN 147 N 1.31 3.14 -0.07 2.72 -0.21 0.56 -4.95 119.66 122.15 3i9g s GLN 147 Ca 0.04 -0.77 -0.13 0.00 0.02 0.00 0.00 55.36 54.52 3i9g s GLN 147 Cb -0.14 -2.46 -0.05 0.00 1.00 0.00 0.00 33.01 31.36 3i9g s GLN 147 CO -0.09 0.25 0.34 -1.58 -2.12 0.00 0.00 175.29 172.09 3i9g s TRP 148 N 0.21 3.61 -0.05 0.91 0.52 -1.26 -0.08 118.94 122.81 3i9g s TRP 148 Ca -0.11 0.80 0.02 0.00 0.02 0.00 0.00 56.10 56.82 3i9g s TRP 148 Cb -0.16 -2.27 0.02 0.00 -1.15 0.00 0.00 33.47 29.91 3i9g s TRP 148 CO 0.06 0.51 -0.08 0.15 0.02 0.00 0.00 176.95 177.61 3i9g s LYS 149 N -0.49 1.17 -0.22 4.98 1.02 -0.27 -1.05 119.74 124.87 3i9g s LYS 149 Ca 0.20 -0.24 0.02 0.00 0.02 0.00 0.00 55.97 55.98 3i9g s LYS 149 Cb -0.15 -1.05 0.04 0.00 -0.52 0.00 0.00 37.83 36.15 3i9g s LYS 149 CO 0.09 -0.03 -0.15 0.08 -0.92 0.00 0.00 175.35 174.43 3i9g s VAL 150 N 0.76 2.07 -1.52 3.17 1.01 -0.51 -1.03 120.40 124.35 3i9g s VAL 150 Ca -0.13 -1.28 -0.04 0.00 0.00 0.00 0.00 61.98 60.53 3i9g s VAL 150 Cb -0.15 -2.04 0.04 0.00 0.00 0.00 0.00 36.38 34.23 3i9g s VAL 150 CO 0.02 0.23 0.36 0.47 0.00 0.00 0.00 175.10 176.18 3i9g n ASP 151 N 4.54 -0.50 0.00 3.32 8.00 0.25 -1.05 116.55 131.11 3i9g n ASP 151 Ca -0.17 -1.10 0.00 0.00 0.71 0.00 0.00 54.79 54.23 3i9g n ASP 151 Cb 0.46 -2.50 0.00 0.00 -0.02 0.00 0.00 41.12 39.06 3i9g n ASP 151 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3i9g n ASN 152 N -2.88 -1.12 -4.63 -2.24 3.02 -1.26 -4.99 115.26 101.15 3i9g n ASN 152 Ca -0.23 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 53.92 3i9g n ASN 152 Cb 0.65 -1.36 -0.07 0.00 -0.61 0.00 0.00 39.78 38.39 3i9g n ASN 152 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3i9g s ALA 153 N -2.33 3.58 0.07 5.41 0.00 -0.21 -5.02 121.76 123.25 3i9g s ALA 153 Ca 0.00 -0.50 -0.31 0.00 0.00 0.00 0.00 51.96 51.15 3i9g s ALA 153 Cb 0.00 -2.89 -0.08 0.00 0.00 0.00 0.00 23.12 20.15 3i9g s ALA 153 CO 0.00 -0.65 1.55 -1.17 0.00 0.00 0.00 175.76 175.50 3i9g s LEU 154 N 2.10 4.35 -0.15 0.00 2.96 -1.26 -1.42 118.68 125.27 3i9g s LEU 154 Ca 0.23 2.39 -0.18 0.00 -0.22 0.00 0.00 54.13 56.35 3i9g s LEU 154 Cb -0.16 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 3i9g s LEU 154 CO 0.09 -0.82 0.49 -1.10 -1.32 0.00 0.00 176.35 173.70 3i9g s GLN 155 N 2.27 4.29 -0.09 1.98 -1.52 -0.22 -4.98 119.66 121.40 3i9g s GLN 155 Ca 0.70 0.44 -0.00 0.00 -1.95 0.00 0.00 55.36 54.55 3i9g s GLN 155 Cb -0.38 -3.48 0.02 0.00 -0.22 0.00 0.00 33.01 28.96 3i9g s GLN 155 CO 0.30 0.05 -0.06 0.45 -0.25 0.00 0.00 175.29 175.79 3i9g s SER 156 N 0.82 1.84 0.00 5.90 0.15 -1.26 -4.59 113.70 116.55 3i9g s SER 156 Ca 0.25 -0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.68 3i9g s SER 156 Cb -0.15 -0.69 0.00 0.00 -1.71 0.00 0.00 66.02 63.47 3i9g s SER 156 CO 0.10 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.03 3i9g n GLY 157 N 4.78 0.70 0.34 9.45 0.00 -1.26 -4.92 105.19 114.29 3i9g n GLY 157 Ca -0.13 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.97 3i9g n GLY 157 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3i9g n ASN 158 N 0.00 1.56 -4.15 1.61 5.03 -1.26 -5.01 115.26 113.05 3i9g n ASN 158 Ca 0.00 -1.28 -0.11 0.00 0.87 0.00 0.00 54.58 54.06 3i9g n ASN 158 Cb 0.00 0.52 -0.10 0.00 -1.02 0.00 0.00 39.78 39.18 3i9g n ASN 158 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 3i9g s SER 159 N -1.99 1.05 0.00 6.41 1.04 -1.26 -2.20 113.70 116.75 3i9g s SER 159 Ca 0.13 -0.95 0.02 0.00 0.48 0.00 0.00 55.95 55.63 3i9g s SER 159 Cb 0.13 0.10 -0.01 0.00 0.10 0.00 0.00 66.02 66.34 3i9g s SER 159 CO 0.44 -0.45 -0.07 -1.10 0.98 0.00 0.00 173.24 173.04 3i9g s GLN 160 N -3.59 0.54 0.14 4.02 -0.21 -0.72 -4.97 119.66 114.87 3i9g s GLN 160 Ca 0.09 -0.31 0.09 0.00 0.02 0.00 0.00 55.36 55.25 3i9g s GLN 160 Cb 0.04 -0.50 -0.04 0.00 1.00 0.00 0.00 33.01 33.51 3i9g s GLN 160 CO -0.05 0.13 -0.14 -1.21 -2.12 0.00 0.00 175.29 171.91 3i9g s GLU 161 N -0.35 1.94 0.00 2.91 2.02 -1.26 -0.90 118.70 123.07 3i9g s GLU 161 Ca 0.01 -1.18 0.00 0.00 0.02 0.00 0.00 54.97 53.82 3i9g s GLU 161 Cb -0.04 -2.16 -0.00 0.00 0.10 0.00 0.00 34.13 32.03 3i9g s GLU 161 CO -0.00 0.47 -0.01 0.45 0.02 0.00 0.00 175.26 176.18 3i9g s SER 162 N -2.40 0.13 -0.04 -0.19 0.15 -0.12 -5.00 113.70 106.24 3i9g s SER 162 Ca 0.21 -0.12 0.04 0.00 0.70 0.00 0.00 55.95 56.78 3i9g s SER 162 Cb -0.10 0.01 -0.00 0.00 -1.71 0.00 0.00 66.02 64.22 3i9g s SER 162 CO 0.13 -0.06 -0.16 -0.69 1.20 0.00 0.00 173.24 173.66 3i9g s VAL 163 N -0.33 1.32 0.75 4.45 1.01 -1.26 -1.08 120.40 125.26 3i9g s VAL 163 Ca -0.03 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.18 3i9g s VAL 163 Cb -0.02 -1.14 0.04 0.00 0.00 0.00 0.00 36.38 35.26 3i9g s VAL 163 CO -0.00 0.38 1.08 0.42 0.00 0.00 0.00 175.10 176.98 3i9g s THR 164 N 0.05 3.55 0.70 3.92 -4.23 -0.50 -5.00 115.64 114.13 3i9g s THR 164 Ca -0.03 0.50 -0.14 0.00 -1.18 0.00 0.00 61.69 60.84 3i9g s THR 164 Cb -0.11 -3.13 0.02 0.00 1.34 0.00 0.00 72.50 70.62 3i9g s THR 164 CO 0.02 -0.66 1.14 -1.61 -0.54 0.00 0.00 174.62 172.97 3i9g s GLU 165 N -4.99 2.50 0.12 3.99 0.41 -1.26 -4.63 118.70 114.83 3i9g s GLU 165 Ca 0.60 1.49 -0.34 0.00 -0.41 0.00 0.00 54.97 56.30 3i9g s GLU 165 Cb -0.16 -1.90 -0.14 0.00 -1.78 0.00 0.00 34.13 30.15 3i9g s GLU 165 CO 0.55 -1.51 1.59 0.94 -0.49 0.00 0.00 175.26 176.35 3i9g n GLN 166 N -2.66 2.03 -1.73 1.61 7.27 -1.26 -4.79 117.38 117.85 3i9g n GLN 166 Ca 0.11 0.73 -0.42 0.00 0.07 0.00 0.00 57.00 57.50 3i9g n GLN 166 Cb 0.52 -2.50 -0.02 0.00 2.41 0.00 0.00 30.24 30.64 3i9g n GLN 166 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 3i9g n ASP 167 N 3.73 3.95 0.27 1.69 -0.08 0.11 -4.86 116.55 121.36 3i9g n ASP 167 Ca 0.18 1.11 0.15 0.00 -1.51 0.00 0.00 54.79 54.71 3i9g n ASP 167 Cb 0.28 -1.59 0.72 0.00 2.34 0.00 0.00 41.12 42.87 3i9g n ASP 167 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3i9g h SER 168 N 5.75 0.00 0.00 1.67 4.64 -1.90 -0.40 113.55 123.31 3i9g h SER 168 Ca -0.45 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.54 3i9g h SER 168 Cb 1.21 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.25 3i9g h SER 168 CO 0.87 0.09 -1.78 0.29 -0.87 0.00 0.00 176.83 175.43 3i9g n LYS 169 N -3.34 0.58 -0.03 4.77 5.02 -1.26 -4.71 118.16 119.19 3i9g n LYS 169 Ca -0.01 0.45 0.05 0.00 -2.02 0.00 0.00 58.31 56.78 3i9g n LYS 169 Cb 0.28 -1.65 0.06 0.00 -0.02 0.00 0.00 35.03 33.71 3i9g n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3i9g n ASP 170 N -4.33 2.06 -1.59 4.39 5.68 -1.24 -4.99 116.55 116.52 3i9g n ASP 170 Ca -0.41 -1.55 -0.19 0.00 -0.50 0.00 0.00 54.79 52.14 3i9g n ASP 170 Cb 0.77 -0.05 -0.07 0.00 -1.14 0.00 0.00 41.12 40.64 3i9g n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3i9g n SER 171 N 0.54 -5.33 -4.91 -1.12 7.64 -0.16 -4.94 113.62 105.34 3i9g n SER 171 Ca 0.07 0.37 -0.21 0.00 1.01 0.00 0.00 58.87 60.12 3i9g n SER 171 Cb 0.29 -4.47 0.06 0.00 -1.01 0.00 0.00 64.21 59.07 3i9g n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3i9g s THR 172 N -2.75 2.45 0.23 0.44 -4.23 -1.26 -4.57 115.64 105.95 3i9g s THR 172 Ca 0.00 -0.79 0.12 0.00 -1.18 0.00 0.00 61.69 59.84 3i9g s THR 172 Cb 0.00 -2.66 -0.05 0.00 1.34 0.00 0.00 72.50 71.14 3i9g s THR 172 CO 0.00 0.00 -0.22 -0.31 -0.54 0.00 0.00 174.62 173.55 3i9g s TYR 173 N -2.77 2.29 0.13 3.99 1.51 0.05 0.04 117.35 122.59 3i9g s TYR 173 Ca 0.61 -0.35 0.06 0.00 -1.01 0.00 0.00 57.07 56.37 3i9g s TYR 173 Cb -0.08 -1.07 -0.04 0.00 -0.11 0.00 0.00 41.96 40.66 3i9g s TYR 173 CO 0.39 0.59 -0.13 -1.12 -1.11 0.00 0.00 175.55 174.17 3i9g s SER 174 N -3.03 1.97 -0.04 2.29 0.01 -1.26 -0.24 113.70 113.40 3i9g s SER 174 Ca 0.25 -0.87 -0.03 0.00 1.31 0.00 0.00 55.95 56.60 3i9g s SER 174 Cb -0.07 -0.06 0.02 0.00 0.21 0.00 0.00 66.02 66.12 3i9g s SER 174 CO 0.12 -0.19 0.11 -0.22 0.41 0.00 0.00 173.24 173.46 3i9g s LEU 175 N -2.69 1.38 0.03 2.44 0.20 -0.27 -1.41 118.68 118.37 3i9g s LEU 175 Ca 0.12 0.22 0.08 0.00 0.69 0.00 0.00 54.13 55.23 3i9g s LEU 175 Cb -0.03 0.33 -0.03 0.00 -0.43 0.00 0.00 46.19 46.04 3i9g s LEU 175 CO 0.03 -0.07 -0.22 -0.94 -0.29 0.00 0.00 176.35 174.86 3i9g s SER 176 N 0.35 3.48 -0.09 3.68 1.04 -0.24 -0.56 113.70 121.36 3i9g s SER 176 Ca -0.02 -0.47 0.02 0.00 0.48 0.00 0.00 55.95 55.95 3i9g s SER 176 Cb -0.04 -0.47 0.01 0.00 0.10 0.00 0.00 66.02 65.62 3i9g s SER 176 CO -0.01 0.27 -0.15 -0.55 0.98 0.00 0.00 173.24 173.79 3i9g s SER 177 N -1.19 2.26 -0.19 7.02 0.15 -0.03 -0.95 113.70 120.77 3i9g s SER 177 Ca 0.13 -0.39 -0.02 0.00 0.70 0.00 0.00 55.95 56.37 3i9g s SER 177 Cb -0.10 -1.02 -0.00 0.00 -1.71 0.00 0.00 66.02 63.19 3i9g s SER 177 CO 0.03 0.03 -0.11 -0.89 1.20 0.00 0.00 173.24 173.50 3i9g s THR 178 N 0.87 2.89 -0.25 6.45 2.01 -0.08 -0.83 115.64 126.71 3i9g s THR 178 Ca -0.10 -0.66 -0.12 0.00 0.31 0.00 0.00 61.69 61.11 3i9g s THR 178 Cb -0.15 -2.27 -0.05 0.00 0.01 0.00 0.00 72.50 70.04 3i9g s THR 178 CO 0.01 0.48 0.25 -0.22 -0.69 0.00 0.00 174.62 174.44 3i9g s LEU 179 N 1.25 4.09 -0.18 4.42 2.96 1.00 -1.75 118.68 130.47 3i9g s LEU 179 Ca 0.03 0.19 -0.03 0.00 -0.22 0.00 0.00 54.13 54.11 3i9g s LEU 179 Cb -0.14 -2.24 -0.01 0.00 0.50 0.00 0.00 46.19 44.30 3i9g s LEU 179 CO -0.05 -0.03 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.00 3i9g s THR 180 N 1.41 3.36 0.18 3.68 2.01 -0.93 -0.26 115.64 125.08 3i9g s THR 180 Ca 0.11 -0.52 0.06 0.00 0.31 0.00 0.00 61.69 61.65 3i9g s THR 180 Cb -0.15 -2.48 -0.05 0.00 0.01 0.00 0.00 72.50 69.84 3i9g s THR 180 CO 0.07 0.47 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.58 3i9g s LEU 181 N 0.94 2.54 0.67 4.42 1.02 -0.39 -4.90 118.68 122.97 3i9g s LEU 181 Ca -0.01 -1.01 -0.16 0.00 0.02 0.00 0.00 54.13 52.97 3i9g s LEU 181 Cb -0.15 -0.53 0.01 0.00 0.02 0.00 0.00 46.19 45.54 3i9g s LEU 181 CO 0.00 -0.24 1.18 -0.94 0.02 0.00 0.00 176.35 176.38 3i9g s SER 182 N -3.22 4.72 0.24 2.29 1.04 -1.26 -0.66 113.70 116.84 3i9g s SER 182 Ca 0.19 2.29 -0.05 0.00 0.48 0.00 0.00 55.95 58.86 3i9g s SER 182 Cb 0.01 -2.58 0.40 0.00 0.10 0.00 0.00 66.02 63.94 3i9g s SER 182 CO 0.04 -1.90 1.76 0.50 0.98 0.00 0.00 173.24 174.62 3i9g h LYS 183 N 0.16 0.53 -0.17 4.02 3.64 -1.50 0.05 116.57 123.31 3i9g h LYS 183 Ca -0.48 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 58.91 3i9g h LYS 183 Cb 1.28 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.94 3i9g h LYS 183 CO 0.52 0.35 -0.09 0.00 -2.27 0.00 0.00 179.45 177.97 3i9g h ALA 184 N 1.48 0.05 -0.50 5.00 0.00 -1.92 -1.09 119.26 122.28 3i9g h ALA 184 Ca 0.38 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.30 3i9g h ALA 184 Cb 0.48 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 3i9g h ALA 184 CO -0.32 -0.53 0.08 -0.44 0.00 0.00 0.00 179.25 178.04 3i9g h ASP 185 N -0.08 0.80 -0.71 0.00 3.32 -1.82 -3.04 116.42 114.88 3i9g h ASP 185 Ca 0.10 -0.26 0.08 0.00 0.02 0.00 0.00 57.03 56.96 3i9g h ASP 185 Cb 0.22 -0.21 -0.06 0.00 0.22 0.00 0.00 39.33 39.49 3i9g h ASP 185 CO -0.22 0.86 0.38 0.22 -1.72 0.00 0.00 179.24 178.76 3i9g h TYR 186 N 0.71 0.70 0.00 4.55 3.20 -0.69 -2.62 116.97 122.81 3i9g h TYR 186 Ca 0.15 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.05 3i9g h TYR 186 Cb 0.40 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.46 3i9g h TYR 186 CO 0.03 0.30 0.00 0.39 -1.64 0.00 0.00 178.16 177.23 3i9g n GLU 187 N -4.81 0.08 -0.22 1.82 1.02 -0.44 -2.91 120.64 115.17 3i9g n GLU 187 Ca 0.10 0.06 0.10 0.00 -0.02 0.00 0.00 57.16 57.40 3i9g n GLU 187 Cb 0.23 -1.50 0.26 0.00 -0.02 0.00 0.00 31.44 30.41 3i9g n GLU 187 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3i9g n LYS 188 N -1.46 2.27 -4.24 3.49 2.85 -0.99 -4.93 118.16 115.15 3i9g n LYS 188 Ca 0.07 -1.95 -0.15 0.00 -1.05 0.00 0.00 58.31 55.24 3i9g n LYS 188 Cb 0.28 -1.46 -0.10 0.00 -0.65 0.00 0.00 35.03 33.10 3i9g n LYS 188 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 177.40 176.34 3i9g s HIS 189 N -1.42 1.26 -0.05 5.58 3.76 -1.15 -5.10 115.29 118.18 3i9g s HIS 189 Ca 0.37 -0.72 -0.07 0.00 -0.15 0.00 0.00 55.06 54.49 3i9g s HIS 189 Cb 0.20 -0.64 -0.03 0.00 1.11 0.00 0.00 32.58 33.22 3i9g s HIS 189 CO 0.28 0.08 -0.15 1.17 -0.85 0.00 0.00 174.74 175.27 3i9g n LYS 190 N -0.03 0.24 -3.29 1.40 4.81 -1.26 -4.67 118.16 115.35 3i9g n LYS 190 Ca -0.11 0.10 -0.40 0.00 -0.87 0.00 0.00 58.31 57.02 3i9g n LYS 190 Cb 0.60 -0.91 -0.08 0.00 0.02 0.00 0.00 35.03 34.66 3i9g n LYS 190 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3i9g s VAL 191 N -2.35 5.08 -0.23 3.15 1.01 -1.26 -0.23 120.40 125.57 3i9g s VAL 191 Ca -0.14 0.59 -0.04 0.00 0.00 0.00 0.00 61.98 62.39 3i9g s VAL 191 Cb 0.03 -3.84 -0.00 0.00 0.00 0.00 0.00 36.38 32.57 3i9g s VAL 191 CO 0.19 0.00 -0.02 -0.31 0.00 0.00 0.00 175.10 174.97 3i9g s TYR 192 N 2.26 3.00 -0.02 5.22 1.51 -0.33 -0.58 117.35 128.42 3i9g s TYR 192 Ca 0.18 -0.95 0.04 0.00 -1.01 0.00 0.00 57.07 55.33 3i9g s TYR 192 Cb -0.16 -2.13 -0.01 0.00 -0.11 0.00 0.00 41.96 39.55 3i9g s TYR 192 CO 0.11 -0.55 -0.14 0.00 -1.11 0.00 0.00 175.55 173.86 3i9g s ALA 193 N 1.48 1.22 -0.23 3.71 0.00 -0.20 -1.19 121.76 126.55 3i9g s ALA 193 Ca 0.05 -0.59 -0.03 0.00 0.00 0.00 0.00 51.96 51.39 3i9g s ALA 193 Cb -0.15 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.62 3i9g s ALA 193 CO -0.02 0.27 -0.06 0.00 0.00 0.00 0.00 175.76 175.95 3i9g s GLU 195 N 1.43 3.66 -0.14 0.00 2.12 0.89 -1.07 118.70 125.58 3i9g s GLU 195 Ca 0.04 -0.50 0.01 0.00 0.36 0.00 0.00 54.97 54.88 3i9g s GLU 195 Cb -0.15 -3.10 -0.00 0.00 0.26 0.00 0.00 34.13 31.14 3i9g s GLU 195 CO -0.04 0.04 -0.16 0.08 -0.54 0.00 0.00 175.26 174.64 3i9g s VAL 196 N 0.93 2.64 -0.12 3.70 1.01 0.86 -0.32 120.40 129.10 3i9g s VAL 196 Ca 0.02 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.21 3i9g s VAL 196 Cb -0.14 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 3i9g s VAL 196 CO 0.02 0.52 -0.14 -0.89 0.00 0.00 0.00 175.10 174.61 3i9g s THR 197 N 0.67 2.95 -0.08 3.92 2.01 -0.23 -1.07 115.64 123.81 3i9g s THR 197 Ca -0.08 -0.70 -0.29 0.00 0.31 0.00 0.00 61.69 60.93 3i9g s THR 197 Cb -0.16 -2.22 0.07 0.00 0.01 0.00 0.00 72.50 70.20 3i9g s THR 197 CO 0.02 0.53 0.66 -2.28 -0.69 0.00 0.00 174.62 172.86 3i9g s HIS 198 N 0.26 -0.64 -0.35 4.92 2.46 -1.26 -1.12 115.29 119.56 3i9g s HIS 198 Ca -0.10 1.18 0.25 0.00 0.47 0.00 0.00 55.06 56.86 3i9g s HIS 198 Cb -0.16 0.37 1.09 0.00 -0.13 0.00 0.00 32.58 33.75 3i9g s HIS 198 CO 0.06 -0.56 1.75 1.96 -2.47 0.00 0.00 174.74 175.48 3i9g h GLN 199 N 3.36 0.00 -0.00 2.88 1.08 -1.93 -1.09 115.11 119.42 3i9g h GLN 199 Ca -0.27 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.93 3i9g h GLN 199 Cb 1.15 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.58 3i9g h GLN 199 CO 0.34 0.00 -0.12 0.41 -0.95 0.00 0.00 178.83 178.51 3i9g n GLY 200 N -0.20 -1.04 3.47 3.46 0.00 -1.26 -4.81 105.19 104.81 3i9g n GLY 200 Ca 0.01 -0.25 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 3i9g n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i9g s LEU 201 N -2.56 3.08 0.29 0.99 1.43 -0.41 -4.41 118.68 117.09 3i9g s LEU 201 Ca 0.26 -0.18 0.04 0.00 -1.03 0.00 0.00 54.13 53.22 3i9g s LEU 201 Cb 0.20 -1.72 0.45 0.00 0.03 0.00 0.00 46.19 45.15 3i9g s LEU 201 CO 0.49 0.19 1.73 0.77 0.23 0.00 0.00 176.35 179.76 3i9g h SER 202 N 6.57 0.40 -5.25 2.29 4.64 -1.87 -3.44 113.55 116.88 3i9g h SER 202 Ca -0.31 -0.14 -0.15 0.00 -0.47 0.00 0.00 61.79 60.72 3i9g h SER 202 Cb 1.20 -0.11 -0.15 0.00 -0.31 0.00 0.00 62.40 63.03 3i9g h SER 202 CO 0.60 0.68 -0.67 -0.94 -0.87 0.00 0.00 176.83 175.63 3i9g s SER 203 N -6.83 0.48 0.41 4.97 1.04 -1.26 -5.14 113.70 107.36 3i9g s SER 203 Ca -0.06 -1.08 -0.25 0.00 0.48 0.00 0.00 55.95 55.04 3i9g s SER 203 Cb 0.14 0.23 -0.11 0.00 0.10 0.00 0.00 66.02 66.38 3i9g s SER 203 CO 0.78 -0.64 1.01 -2.65 0.98 0.00 0.00 173.24 172.73 3i9g n PRO 204 N 0.02 1.37 -4.22 4.02 -0.02 -1.26 -4.93 135.00 129.97 3i9g n PRO 204 Ca -0.11 0.49 -0.34 0.00 -2.02 0.00 0.00 63.50 61.52 3i9g n PRO 204 Cb 0.62 -2.03 -0.11 0.00 -0.02 0.00 0.00 33.50 31.96 3i9g n PRO 204 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3i9g s VAL 205 N -1.26 4.37 -0.14 -1.45 1.01 -0.23 -4.91 120.40 117.79 3i9g s VAL 205 Ca 0.63 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 62.41 3i9g s VAL 205 Cb -0.57 -2.93 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 3i9g s VAL 205 CO 0.57 0.50 -0.12 -0.89 0.00 0.00 0.00 175.10 175.16 3i9g s THR 206 N 0.14 3.07 -0.14 3.92 2.01 -1.26 -0.10 115.64 123.28 3i9g s THR 206 Ca 0.02 -0.65 -0.01 0.00 0.31 0.00 0.00 61.69 61.36 3i9g s THR 206 Cb -0.13 -2.30 -0.02 0.00 0.01 0.00 0.00 72.50 70.07 3i9g s THR 206 CO 0.02 0.51 -0.11 -0.54 -0.69 0.00 0.00 174.62 173.81 3i9g s LYS 207 N 0.48 3.44 0.17 4.92 3.01 -0.24 -4.98 119.74 126.55 3i9g s LYS 207 Ca -0.09 -0.65 -0.04 0.00 -1.01 0.00 0.00 55.97 54.18 3i9g s LYS 207 Cb -0.16 -2.69 -0.03 0.00 -1.01 0.00 0.00 37.83 33.95 3i9g s LYS 207 CO 0.04 0.21 0.18 -1.54 0.51 0.00 0.00 175.35 174.75 3i9g s SER 208 N 0.37 0.15 0.06 2.83 1.04 -1.26 -0.41 113.70 116.49 3i9g s SER 208 Ca -0.09 -1.16 -0.09 0.00 0.48 0.00 0.00 55.95 55.08 3i9g s SER 208 Cb -0.16 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.35 3i9g s SER 208 CO 0.05 -0.85 0.20 0.72 0.98 0.00 0.00 173.24 174.34 3i9g s PHE 209 N -4.06 0.09 -0.17 5.02 -0.12 -0.33 -5.00 117.98 113.41 3i9g s PHE 209 Ca 0.27 -0.41 -0.09 0.00 -0.05 0.00 0.00 56.93 56.65 3i9g s PHE 209 Cb 0.05 -0.03 -0.05 0.00 -0.63 0.00 0.00 43.02 42.36 3i9g s PHE 209 CO 0.06 -0.49 0.15 -0.80 -0.05 0.00 0.00 175.22 174.08 3i9g s ASN 210 N -2.47 6.29 0.33 1.98 0.01 -1.26 -1.18 114.94 118.64 3i9g s ASN 210 Ca -0.00 0.34 -0.29 0.00 -0.71 0.00 0.00 52.86 52.20 3i9g s ASN 210 Cb 0.02 -2.09 -0.12 0.00 0.41 0.00 0.00 41.25 39.47 3i9g s ASN 210 CO -0.07 0.25 1.48 -1.14 -1.51 0.00 0.00 177.10 176.10 3i9g n ARG 211 N 3.01 2.52 0.00 -0.60 0.63 0.69 -2.65 116.66 120.25 3i9g n ARG 211 Ca -0.17 0.89 0.00 0.00 -0.92 0.00 0.00 57.85 57.65 3i9g n ARG 211 Cb 0.53 -2.60 0.00 0.00 0.45 0.00 0.00 32.46 30.84 3i9g n ARG 211 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3i9g n GLY 212 N 1.23 2.28 0.00 5.14 0.00 -1.26 -4.97 105.19 107.60 3i9g n GLY 212 Ca 0.05 -0.60 0.02 0.00 0.00 0.00 0.00 46.02 45.50 3i9g n GLY 212 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50