#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d5m s GLN 3 N 0.00 4.42 0.21 -1.46 0.74 -0.93 -4.97 119.66 117.67 1d5m s GLN 3 Ca 0.00 1.55 -0.32 0.00 0.05 0.00 0.00 55.36 56.63 1d5m s GLN 3 Cb 0.00 -3.51 -0.13 0.00 1.10 0.00 0.00 33.01 30.47 1d5m s GLN 3 CO 0.00 -0.31 1.49 -2.30 -0.55 0.00 0.00 175.29 173.62 1d5m n PRO 4 N 4.74 2.13 -0.77 1.67 -0.02 -1.26 -4.75 135.00 136.74 1d5m n PRO 4 Ca 0.09 0.76 -0.33 0.00 -2.02 0.00 0.00 63.50 62.01 1d5m n PRO 4 Cb 0.48 -2.47 0.13 0.00 -0.02 0.00 0.00 33.50 31.62 1d5m n PRO 4 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1d5m n ASP 5 N 2.63 -1.85 -4.62 2.55 8.00 -1.26 -4.83 116.55 117.17 1d5m n ASP 5 Ca 0.13 0.31 -0.43 0.00 0.71 0.00 0.00 54.79 55.51 1d5m n ASP 5 Cb 0.31 -1.22 -0.03 0.00 -0.02 0.00 0.00 41.12 40.16 1d5m n ASP 5 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 1d5m s PRO 6 N -3.74 3.55 0.79 -0.24 0.02 -1.26 -4.98 135.00 129.14 1d5m s PRO 6 Ca 0.58 1.84 -0.11 0.00 0.02 0.00 0.00 61.00 63.33 1d5m s PRO 6 Cb -0.21 -4.18 0.06 0.00 0.02 0.00 0.00 34.50 30.19 1d5m s PRO 6 CO 0.66 -1.60 1.09 0.15 -0.33 0.00 0.00 177.00 176.97 1d5m s LYS 7 N 5.34 2.15 0.27 5.54 1.02 -1.26 -4.93 119.74 127.87 1d5m s LYS 7 Ca 0.84 1.02 -0.31 0.00 0.02 0.00 0.00 55.97 57.54 1d5m s LYS 7 Cb -0.29 -1.90 -0.12 0.00 -0.52 0.00 0.00 37.83 35.01 1d5m s LYS 7 CO 0.34 -1.68 1.62 -2.30 -0.92 0.00 0.00 175.35 172.41 1d5m n PRO 8 N -3.53 2.68 -0.65 -1.68 -0.02 -1.26 -1.56 135.00 128.98 1d5m n PRO 8 Ca 0.08 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.52 1d5m n PRO 8 Cb 0.54 -2.75 0.00 0.00 -0.02 0.00 0.00 33.50 31.27 1d5m n PRO 8 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1d5m n ASP 9 N 2.58 0.00 0.07 2.55 8.00 -1.26 -4.86 116.55 123.63 1d5m n ASP 9 Ca 0.10 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.54 1d5m n ASP 9 Cb 0.36 -0.44 -0.10 0.00 -0.02 0.00 0.00 41.12 40.92 1d5m n ASP 9 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1d5m h GLU 10 N 2.18 0.00 -6.59 -1.24 4.81 -1.65 -3.45 114.58 108.64 1d5m h GLU 10 Ca 0.00 0.00 -0.52 0.00 -0.13 0.00 0.00 59.36 58.71 1d5m h GLU 10 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1d5m h GLU 10 CO 0.00 0.97 0.39 -0.51 -0.73 0.00 0.00 179.01 179.12 1d5m s LEU 11 N -6.77 4.50 0.30 1.64 1.43 -1.26 -5.00 118.68 113.52 1d5m s LEU 11 Ca 0.01 1.86 -0.30 0.00 -1.03 0.00 0.00 54.13 54.67 1d5m s LEU 11 Cb 0.10 -3.59 -0.11 0.00 0.03 0.00 0.00 46.19 42.62 1d5m s LEU 11 CO 0.81 -0.10 1.56 -1.00 0.23 0.00 0.00 176.35 177.85 1d5m s HIS 12 N -0.05 2.78 -0.23 0.29 3.76 -1.26 -4.97 115.29 115.61 1d5m s HIS 12 Ca 0.48 0.87 -0.10 0.00 -0.15 0.00 0.00 55.06 56.15 1d5m s HIS 12 Cb -0.25 -4.02 -0.05 0.00 1.11 0.00 0.00 32.58 29.37 1d5m s HIS 12 CO 0.31 -3.37 0.14 0.15 -0.85 0.00 0.00 174.74 171.12 1d5m s LYS 13 N -0.67 4.06 0.59 1.40 1.02 -1.26 -4.50 119.74 120.39 1d5m s LYS 13 Ca 0.61 -0.28 0.30 0.00 0.02 0.00 0.00 55.97 56.63 1d5m s LYS 13 Cb -0.47 -3.48 1.84 0.00 -0.52 0.00 0.00 37.83 35.20 1d5m s LYS 13 CO 0.49 0.11 2.26 0.66 -0.92 0.00 0.00 175.35 177.95 1d5m h SER 14 N 7.33 0.00 0.55 2.83 4.64 -1.10 0.53 113.55 128.33 1d5m h SER 14 Ca -0.38 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.90 1d5m h SER 14 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 1d5m h SER 14 CO 0.67 0.00 -0.19 0.77 -0.87 0.00 0.00 176.83 177.21 1d5m h SER 15 N 0.00 0.00 -0.07 4.97 4.64 -1.89 -2.28 113.55 118.92 1d5m h SER 15 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1d5m h SER 15 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1d5m h SER 15 CO -0.00 0.19 0.00 0.29 -0.87 0.00 0.00 176.83 176.44 1d5m n LYS 16 N -3.61 1.62 -3.97 4.77 4.01 0.17 -4.73 118.16 116.42 1d5m n LYS 16 Ca -0.01 -0.91 -0.35 0.00 -0.51 0.00 0.00 58.31 56.53 1d5m n LYS 16 Cb 0.33 -1.44 -0.13 0.00 -0.51 0.00 0.00 35.03 33.28 1d5m n LYS 16 CO 0.00 0.00 0.00 0.12 -1.11 0.00 0.00 177.40 176.41 1d5m s PHE 17 N -1.92 3.03 -1.00 2.13 5.36 -0.86 -1.81 117.98 122.91 1d5m s PHE 17 Ca 0.36 -0.56 0.16 0.00 -0.96 0.00 0.00 56.93 55.93 1d5m s PHE 17 Cb 0.19 -2.12 -0.11 0.00 -0.34 0.00 0.00 43.02 40.64 1d5m s PHE 17 CO 0.30 -0.34 0.73 0.25 -1.46 0.00 0.00 175.22 174.71 1d5m n THR 18 N 4.52 0.00 -0.42 0.12 -2.24 0.19 -4.94 114.28 111.51 1d5m n THR 18 Ca -0.17 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1d5m n THR 18 Cb 0.51 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.81 1d5m n THR 18 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1d5m n GLY 19 N 1.30 -1.58 3.62 3.38 0.00 -1.23 -4.90 105.19 105.78 1d5m n GLY 19 Ca 0.04 -1.55 -0.41 0.00 0.00 0.00 0.00 46.02 44.11 1d5m n GLY 19 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1d5m s LEU 20 N 0.00 4.08 0.32 0.99 1.43 -1.26 -4.84 118.68 119.40 1d5m s LEU 20 Ca 0.00 0.61 0.23 0.00 -1.03 0.00 0.00 54.13 53.94 1d5m s LEU 20 Cb 0.00 -2.81 1.17 0.00 0.03 0.00 0.00 46.19 44.58 1d5m s LEU 20 CO 0.00 -0.38 1.71 -0.03 0.23 0.00 0.00 176.35 177.88 1d5m h MET 21 N 7.99 0.00 -0.27 1.70 1.85 -0.48 -2.19 114.93 123.53 1d5m h MET 21 Ca -0.27 0.00 0.08 0.00 -0.61 0.00 0.00 59.70 58.90 1d5m h MET 21 Cb 1.12 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 33.14 1d5m h MET 21 CO 0.77 0.00 0.22 1.49 -0.40 0.00 0.00 176.91 178.99 1d5m h GLU 22 N 0.00 0.00 0.00 0.39 4.57 -0.92 0.13 114.58 118.75 1d5m h GLU 22 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1d5m h GLU 22 Cb 0.11 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 1d5m h GLU 22 CO 0.00 0.00 0.00 -0.91 -1.18 0.00 0.00 179.01 176.92 1d5m h ASN 23 N 0.00 0.00 0.07 1.04 -0.26 -1.68 -1.59 115.58 113.15 1d5m h ASN 23 Ca 0.13 0.00 -0.37 0.00 -0.56 0.00 0.00 56.30 55.50 1d5m h ASN 23 Cb 0.56 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 37.78 1d5m h ASN 23 CO -0.00 0.00 -2.15 0.80 -1.06 0.00 0.00 177.43 175.02 1d5m n MET 24 N -2.93 0.70 -0.14 0.81 1.56 0.26 -4.37 117.12 113.01 1d5m n MET 24 Ca 0.02 0.24 -0.05 0.00 -0.27 0.00 0.00 57.70 57.64 1d5m n MET 24 Cb 0.35 -1.64 0.04 0.00 2.15 0.00 0.00 33.22 34.12 1d5m n MET 24 CO 0.00 0.00 0.00 -0.22 -0.73 0.00 0.00 175.97 175.02 1d5m h LYS 25 N -0.05 0.40 -0.01 2.12 3.64 -0.83 -1.61 116.57 120.23 1d5m h LYS 25 Ca -0.49 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1d5m h LYS 25 Cb 1.93 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 33.66 1d5m h LYS 25 CO -0.01 0.27 0.14 -0.39 -2.27 0.00 0.00 179.45 177.18 1d5m h VAL 26 N 0.41 0.05 0.00 2.00 -1.51 -1.49 0.26 116.25 115.97 1d5m h VAL 26 Ca 0.20 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 65.59 1d5m h VAL 26 Cb 0.14 0.86 -0.01 0.00 -2.13 0.00 0.00 31.29 30.15 1d5m h VAL 26 CO -0.16 0.00 -0.38 -0.07 -1.23 0.00 0.00 177.57 175.72 1d5m h LEU 27 N 0.00 0.00 -3.00 4.19 3.38 -1.49 -3.33 115.31 115.06 1d5m h LEU 27 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1d5m h LEU 27 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1d5m h LEU 27 CO -0.00 0.38 0.00 -1.22 0.09 0.00 0.00 178.44 177.69 1d5m n TYR 28 N -3.39 0.11 -0.57 1.13 4.02 0.86 -4.82 117.16 114.49 1d5m n TYR 28 Ca 0.01 -0.68 0.00 0.00 -0.01 0.00 0.00 57.90 57.22 1d5m n TYR 28 Cb 0.57 -0.10 0.00 0.00 -0.02 0.00 0.00 39.34 39.79 1d5m n TYR 28 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 1d5m n ASP 29 N -0.68 0.00 -0.28 7.72 8.00 -0.85 -3.69 116.55 126.78 1d5m n ASP 29 Ca 0.08 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.61 1d5m n ASP 29 Cb 0.43 0.00 0.11 0.00 -0.02 0.00 0.00 41.12 41.64 1d5m n ASP 29 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 1d5m h ASP 30 N 0.00 -0.68 -3.05 -2.24 -0.00 -1.92 -3.44 116.42 105.09 1d5m h ASP 30 Ca 0.00 0.24 -0.53 0.00 -0.00 0.00 0.00 57.03 56.74 1d5m h ASP 30 Cb 0.00 0.48 0.06 0.00 -0.00 0.00 0.00 39.33 39.86 1d5m h ASP 30 CO 0.00 -0.26 0.86 0.54 -0.00 0.00 0.00 179.24 180.38 1d5m s ASN 31 N -5.23 6.55 -0.09 4.15 2.20 -1.26 -5.03 114.94 116.23 1d5m s ASN 31 Ca -0.14 2.71 -0.31 0.00 -0.94 0.00 0.00 52.86 54.18 1d5m s ASN 31 Cb 0.23 -2.61 0.12 0.00 -2.00 0.00 0.00 41.25 36.99 1d5m s ASN 31 CO 0.76 -0.82 1.01 -1.38 -2.94 0.00 0.00 177.10 173.73 1d5m s HIS 32 N 0.63 -0.28 -0.00 1.54 -3.43 -1.26 -4.79 115.29 107.71 1d5m s HIS 32 Ca 0.66 0.22 -0.25 0.00 -0.80 0.00 0.00 55.06 54.90 1d5m s HIS 32 Cb -0.44 0.52 -0.05 0.00 -1.43 0.00 0.00 32.58 31.18 1d5m s HIS 32 CO 0.37 -0.40 0.75 0.08 -2.00 0.00 0.00 174.74 173.55 1d5m s VAL 33 N -2.60 4.87 -0.15 -5.38 1.01 0.61 -4.94 120.40 113.82 1d5m s VAL 33 Ca 0.06 1.58 -0.05 0.00 0.00 0.00 0.00 61.98 63.57 1d5m s VAL 33 Cb -0.01 -4.10 0.07 0.00 0.00 0.00 0.00 36.38 32.35 1d5m s VAL 33 CO -0.06 0.31 0.27 -0.94 0.00 0.00 0.00 175.10 174.67 1d5m s SER 34 N 0.35 0.49 0.01 3.32 1.04 -1.25 -1.42 113.70 116.23 1d5m s SER 34 Ca 0.39 0.45 0.03 0.00 0.48 0.00 0.00 55.95 57.30 1d5m s SER 34 Cb -0.19 0.70 -0.01 0.00 0.10 0.00 0.00 66.02 66.62 1d5m s SER 34 CO 0.21 -0.26 -0.09 0.00 0.98 0.00 0.00 173.24 174.09 1d5m s ALA 35 N 2.42 0.71 -0.13 5.32 0.00 0.05 -4.96 121.76 125.17 1d5m s ALA 35 Ca 0.03 -0.50 0.03 0.00 0.00 0.00 0.00 51.96 51.51 1d5m s ALA 35 Cb -0.13 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.88 1d5m s ALA 35 CO -0.10 0.13 -0.22 0.42 0.00 0.00 0.00 175.76 175.99 1d5m s ILE 36 N -0.54 2.12 -1.03 0.00 1.01 -1.26 -0.43 121.20 121.07 1d5m s ILE 36 Ca 0.00 -0.97 -0.12 0.00 0.00 0.00 0.00 60.65 59.56 1d5m s ILE 36 Cb -0.05 -1.84 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 1d5m s ILE 36 CO 0.00 0.55 0.81 -3.20 0.00 0.00 0.00 174.94 173.10 1d5m n ASN 37 N 3.93 -6.08 -4.41 3.58 5.15 -0.29 -4.97 115.26 112.17 1d5m n ASN 37 Ca -0.20 -0.78 -0.22 0.00 -0.60 0.00 0.00 54.58 52.78 1d5m n ASN 37 Cb 0.52 -4.11 -0.10 0.00 -0.53 0.00 0.00 39.78 35.56 1d5m n ASN 37 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1d5m s VAL 38 N -3.34 2.16 -0.01 3.44 -7.23 0.03 -4.78 120.40 110.67 1d5m s VAL 38 Ca 0.37 -2.27 0.06 0.00 -1.81 0.00 0.00 61.98 58.33 1d5m s VAL 38 Cb -0.10 -2.16 -0.02 0.00 0.56 0.00 0.00 36.38 34.67 1d5m s VAL 38 CO 0.81 -0.44 -0.19 -0.75 -0.31 0.00 0.00 175.10 174.23 1d5m s LYS 39 N -3.43 1.48 0.41 4.82 2.20 -1.26 -0.19 119.74 123.78 1d5m s LYS 39 Ca 0.25 -0.68 -0.25 0.00 -0.36 0.00 0.00 55.97 54.93 1d5m s LYS 39 Cb -0.04 -1.45 -0.11 0.00 -1.51 0.00 0.00 37.83 34.73 1d5m s LYS 39 CO 0.11 0.39 1.04 -1.13 -0.36 0.00 0.00 175.35 175.41 1d5m n SER 40 N 2.55 1.42 -0.12 1.43 3.41 -1.25 -4.74 113.62 116.33 1d5m n SER 40 Ca -0.15 1.06 0.06 0.00 -0.26 0.00 0.00 58.87 59.57 1d5m n SER 40 Cb 0.54 -1.37 -0.04 0.00 -0.26 0.00 0.00 64.21 63.08 1d5m n SER 40 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1d5m n ILE 41 N -0.38 0.00 -4.03 -1.33 -5.35 -0.02 -4.96 119.36 103.29 1d5m n ILE 41 Ca 0.09 -0.29 0.04 0.00 -0.27 0.00 0.00 62.75 62.31 1d5m n ILE 41 Cb 0.38 1.06 0.01 0.00 -1.74 0.00 0.00 39.64 39.36 1d5m n ILE 41 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 1d5m n ASP 42 N -0.80 -0.82 -3.87 7.28 2.03 -1.19 -4.86 116.55 114.31 1d5m n ASP 42 Ca 0.03 -1.04 -0.11 0.00 0.52 0.00 0.00 54.79 54.19 1d5m n ASP 42 Cb 0.21 1.24 -0.10 0.00 -0.72 0.00 0.00 41.12 41.75 1d5m n ASP 42 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1d5m s GLN 43 N -2.00 0.43 0.00 -0.67 -0.21 -1.26 -0.07 119.66 115.88 1d5m s GLN 43 Ca 0.26 -0.31 0.00 0.00 0.02 0.00 0.00 55.36 55.33 1d5m s GLN 43 Cb -0.00 0.18 0.00 0.00 1.00 0.00 0.00 33.01 34.19 1d5m s GLN 43 CO -0.02 -0.10 0.00 0.34 -2.12 0.00 0.00 175.29 173.39 1d5m n PHE 44 N 1.69 0.00 -4.07 0.91 7.35 -1.26 -4.94 117.46 117.14 1d5m n PHE 44 Ca -0.21 0.00 -0.22 0.00 -0.76 0.00 0.00 57.45 56.26 1d5m n PHE 44 Cb 0.56 -0.08 -0.04 0.00 0.35 0.00 0.00 39.48 40.27 1d5m n PHE 44 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1d5m s LEU 45 N -4.40 3.74 0.29 -2.13 1.43 -1.26 -5.01 118.68 111.35 1d5m s LEU 45 Ca 0.00 -0.32 0.17 0.00 -1.03 0.00 0.00 54.13 52.95 1d5m s LEU 45 Cb 0.00 -2.29 0.91 0.00 0.03 0.00 0.00 46.19 44.84 1d5m s LEU 45 CO 0.00 -0.09 1.46 0.00 0.23 0.00 0.00 176.35 177.95 1d5m n TYR 46 N -1.20 0.57 -0.52 0.29 0.18 -1.26 -1.55 117.16 113.67 1d5m n TYR 46 Ca -0.07 0.30 0.09 0.00 1.88 0.00 0.00 57.90 60.10 1d5m n TYR 46 Cb 0.58 -0.89 0.29 0.00 -0.38 0.00 0.00 39.34 38.94 1d5m n TYR 46 CO 0.00 0.00 0.00 1.97 -2.08 0.00 0.00 176.86 176.75 1d5m n PHE 47 N -2.11 1.08 -4.45 -3.48 1.16 -1.26 -4.55 117.46 103.84 1d5m n PHE 47 Ca -0.01 -0.60 -0.22 0.00 -1.87 0.00 0.00 57.45 54.75 1d5m n PHE 47 Cb 0.14 -0.16 -0.10 0.00 -1.61 0.00 0.00 39.48 37.75 1d5m n PHE 47 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 1d5m s ASP 48 N -1.09 2.31 -0.03 5.98 1.47 -0.59 -0.62 116.67 124.10 1d5m s ASP 48 Ca 0.43 -1.47 -0.02 0.00 1.18 0.00 0.00 52.55 52.67 1d5m s ASP 48 Cb 0.27 0.14 0.01 0.00 -0.34 0.00 0.00 42.92 43.01 1d5m s ASP 48 CO 0.22 -0.73 0.06 -0.76 0.68 0.00 0.00 175.17 174.64 1d5m s LEU 49 N -3.50 1.52 -0.15 2.11 1.43 -0.25 -4.60 118.68 115.25 1d5m s LEU 49 Ca 0.33 0.13 -0.06 0.00 -1.03 0.00 0.00 54.13 53.50 1d5m s LEU 49 Cb 0.07 0.17 -0.04 0.00 0.03 0.00 0.00 46.19 46.42 1d5m s LEU 49 CO 0.15 -0.06 0.05 -0.63 0.23 0.00 0.00 176.35 176.09 1d5m s ILE 50 N 0.36 4.66 0.15 -0.59 1.01 0.90 -0.12 121.20 127.58 1d5m s ILE 50 Ca -0.03 -0.09 0.11 0.00 0.00 0.00 0.00 60.65 60.64 1d5m s ILE 50 Cb -0.04 -3.05 -0.04 0.00 0.01 0.00 0.00 42.46 39.34 1d5m s ILE 50 CO -0.01 0.52 -0.25 -0.31 0.00 0.00 0.00 174.94 174.88 1d5m s TYR 51 N -0.14 2.32 -0.76 3.97 1.51 0.51 -0.84 117.35 123.92 1d5m s TYR 51 Ca 0.06 -0.37 -0.16 0.00 -1.01 0.00 0.00 57.07 55.59 1d5m s TYR 51 Cb -0.12 -1.21 0.16 0.00 -0.11 0.00 0.00 41.96 40.68 1d5m s TYR 51 CO 0.01 0.40 0.80 0.45 -1.11 0.00 0.00 175.55 176.11 1d5m s SER 52 N -2.29 6.54 -0.15 2.29 0.15 -1.26 -0.61 113.70 118.37 1d5m s SER 52 Ca 0.17 -2.16 0.00 0.00 0.70 0.00 0.00 55.95 54.65 1d5m s SER 52 Cb -0.09 -2.27 0.03 0.00 -1.71 0.00 0.00 66.02 61.98 1d5m s SER 52 CO 0.08 -0.84 -0.10 -0.63 1.20 0.00 0.00 173.24 172.95 1d5m s ILE 53 N 1.45 1.33 0.20 6.45 1.01 -0.78 -4.99 121.20 125.87 1d5m s ILE 53 Ca 0.18 -0.60 -0.21 0.00 0.00 0.00 0.00 60.65 60.02 1d5m s ILE 53 Cb -0.14 -1.35 -0.08 0.00 0.01 0.00 0.00 42.46 40.89 1d5m s ILE 53 CO -0.04 0.31 0.73 -0.54 0.00 0.00 0.00 174.94 175.40 1d5m s LYS 54 N 1.57 4.34 -0.89 2.79 -0.14 -1.26 -3.89 119.74 122.25 1d5m s LYS 54 Ca 0.03 0.94 -0.20 0.00 -1.36 0.00 0.00 55.97 55.39 1d5m s LYS 54 Cb -0.14 -3.01 0.11 0.00 -1.68 0.00 0.00 37.83 33.12 1d5m s LYS 54 CO -0.09 0.46 1.12 0.34 -0.76 0.00 0.00 175.35 176.42 1d5m s ASP 55 N -1.47 6.54 0.37 2.83 2.15 -0.75 -4.84 116.67 121.51 1d5m s ASP 55 Ca 0.40 -1.82 0.27 0.00 0.43 0.00 0.00 52.55 51.83 1d5m s ASP 55 Cb -0.19 -2.41 1.15 0.00 -0.30 0.00 0.00 42.92 41.17 1d5m s ASP 55 CO 0.22 -1.16 1.82 0.71 -0.17 0.00 0.00 175.17 176.59 1d5m h THR 56 N 5.93 0.00 0.00 1.71 1.35 -1.94 0.24 112.91 120.20 1d5m h THR 56 Ca 0.08 -0.32 -0.01 0.00 -0.55 0.00 0.00 66.41 65.61 1d5m h THR 56 Cb 1.03 1.15 -0.00 0.00 -1.73 0.00 0.00 68.15 68.59 1d5m h THR 56 CO 1.14 0.00 -0.08 0.50 -0.25 0.00 0.00 175.52 176.83 1d5m h LYS 57 N 0.00 0.00 0.00 4.72 3.11 -2.00 -3.43 116.57 118.97 1d5m h LYS 57 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1d5m h LYS 57 Cb 0.40 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.63 1d5m h LYS 57 CO 0.00 0.75 0.00 1.28 -2.81 0.00 0.00 179.45 178.67 1d5m n LEU 58 N -4.64 0.31 -1.88 5.20 4.77 -1.23 -5.03 117.00 114.50 1d5m n LEU 58 Ca -0.09 -0.46 -0.15 0.00 -0.03 0.00 0.00 56.01 55.28 1d5m n LEU 58 Cb 0.38 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1d5m n LEU 58 CO 0.25 0.08 -0.13 0.61 -1.33 0.00 0.00 177.39 176.86 1d5m n GLY 59 N 0.30 -0.23 0.02 -0.72 0.00 0.84 -4.92 105.19 100.47 1d5m n GLY 59 Ca 0.00 -0.21 0.13 0.00 0.00 0.00 0.00 46.02 45.94 1d5m n GLY 59 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1d5m n ASN 60 N -1.02 0.26 -3.50 1.61 3.02 -1.26 -3.28 115.26 111.09 1d5m n ASN 60 Ca -0.15 0.32 -0.14 0.00 -0.03 0.00 0.00 54.58 54.58 1d5m n ASN 60 Cb 0.62 -0.34 -0.04 0.00 -0.61 0.00 0.00 39.78 39.41 1d5m n ASN 60 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1d5m s TYR 61 N -3.02 -0.53 0.00 3.10 -0.85 -1.26 -2.62 117.35 112.17 1d5m s TYR 61 Ca 0.12 0.59 0.00 0.00 -0.52 0.00 0.00 57.07 57.26 1d5m s TYR 61 Cb 0.17 0.44 0.00 0.00 0.38 0.00 0.00 41.96 42.95 1d5m s TYR 61 CO 0.59 -0.71 0.00 -0.25 -1.52 0.00 0.00 175.55 173.66 1d5m n ASP 62 N 0.25 4.31 -4.06 -0.18 8.00 -0.57 -1.80 116.55 122.50 1d5m n ASP 62 Ca -0.18 -0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.14 1d5m n ASP 62 Cb 0.61 0.87 -0.14 0.00 -0.02 0.00 0.00 41.12 42.44 1d5m n ASP 62 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1d5m s ASN 63 N -1.73 1.16 -0.09 -2.24 0.01 -1.23 -1.87 114.94 108.96 1d5m s ASN 63 Ca 0.00 -0.29 0.02 0.00 -0.71 0.00 0.00 52.86 51.88 1d5m s ASN 63 Cb 0.00 -0.09 0.01 0.00 0.41 0.00 0.00 41.25 41.58 1d5m s ASN 63 CO 0.00 0.04 -0.15 -0.69 -1.51 0.00 0.00 177.10 174.79 1d5m s VAL 64 N -0.54 1.41 -0.23 1.60 1.01 0.22 -2.28 120.40 121.59 1d5m s VAL 64 Ca 0.01 -0.62 -0.15 0.00 0.00 0.00 0.00 61.98 61.22 1d5m s VAL 64 Cb -0.05 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 1d5m s VAL 64 CO 0.00 0.42 0.38 -0.60 0.00 0.00 0.00 175.10 175.30 1d5m s ARG 65 N 0.75 4.11 -0.30 2.72 3.52 -0.64 -0.36 118.95 128.75 1d5m s ARG 65 Ca -0.12 0.12 -0.05 0.00 -0.13 0.00 0.00 55.73 55.56 1d5m s ARG 65 Cb -0.16 -3.58 0.03 0.00 -1.56 0.00 0.00 34.95 29.68 1d5m s ARG 65 CO 0.02 -0.12 0.04 0.08 -0.81 0.00 0.00 175.30 174.52 1d5m s VAL 66 N 1.58 3.48 -0.05 7.11 1.01 0.83 -1.11 120.40 133.26 1d5m s VAL 66 Ca 0.17 -1.04 -0.14 0.00 0.00 0.00 0.00 61.98 60.97 1d5m s VAL 66 Cb -0.15 -2.89 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 1d5m s VAL 66 CO 0.08 -0.02 0.37 -1.61 0.00 0.00 0.00 175.10 173.92 1d5m s GLU 67 N 1.38 3.94 0.37 2.72 2.02 -0.40 -1.09 118.70 127.65 1d5m s GLU 67 Ca -0.01 0.31 0.08 0.00 0.02 0.00 0.00 54.97 55.37 1d5m s GLU 67 Cb -0.18 -3.26 -0.05 0.00 0.10 0.00 0.00 34.13 30.73 1d5m s GLU 67 CO 0.00 0.59 0.11 -0.06 0.02 0.00 0.00 175.26 175.93 1d5m s PHE 68 N -0.70 2.61 0.28 1.61 0.40 0.21 -1.69 117.98 120.70 1d5m s PHE 68 Ca 0.22 -0.50 0.15 0.00 -0.60 0.00 0.00 56.93 56.20 1d5m s PHE 68 Cb -0.15 -1.74 0.68 0.00 0.51 0.00 0.00 43.02 42.32 1d5m s PHE 68 CO 0.11 0.32 1.77 -0.22 0.70 0.00 0.00 175.22 177.89 1d5m h LYS 69 N 1.58 0.00 -4.02 0.44 3.64 -1.13 -3.46 116.57 113.62 1d5m h LYS 69 Ca -0.43 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 58.78 1d5m h LYS 69 Cb 1.25 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 32.97 1d5m h LYS 69 CO 0.68 0.41 -0.26 0.54 -2.27 0.00 0.00 179.45 178.55 1d5m s ASN 70 N -6.68 0.28 0.28 4.20 2.20 -1.26 -5.05 114.94 108.92 1d5m s ASN 70 Ca -0.01 -1.21 0.01 0.00 -0.94 0.00 0.00 52.86 50.71 1d5m s ASN 70 Cb 0.13 0.56 0.41 0.00 -2.00 0.00 0.00 41.25 40.34 1d5m s ASN 70 CO 0.71 -1.12 1.74 0.50 -2.94 0.00 0.00 177.10 176.00 1d5m h LYS 71 N 2.30 0.57 -0.49 3.55 3.64 -1.88 -3.17 116.57 121.09 1d5m h LYS 71 Ca -0.29 -0.19 0.08 0.00 -1.27 0.00 0.00 60.65 58.98 1d5m h LYS 71 Cb 1.25 -0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.95 1d5m h LYS 71 CO 0.40 0.71 0.10 -0.44 -2.27 0.00 0.00 179.45 177.96 1d5m h ASP 72 N 0.52 0.01 -0.79 4.20 5.19 -1.96 0.13 116.42 123.73 1d5m h ASP 72 Ca 0.09 0.08 -0.02 0.00 -0.62 0.00 0.00 57.03 56.56 1d5m h ASP 72 Cb 0.58 0.11 -0.04 0.00 0.18 0.00 0.00 39.33 40.17 1d5m h ASP 72 CO 0.04 0.04 0.41 -0.07 -3.12 0.00 0.00 179.24 176.54 1d5m h LEU 73 N 0.24 1.00 -0.32 1.55 3.38 -1.95 -0.35 115.31 118.86 1d5m h LEU 73 Ca 0.24 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 1d5m h LEU 73 Cb 0.32 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1d5m h LEU 73 CO -0.31 0.83 0.03 0.00 0.09 0.00 0.00 178.44 179.08 1d5m h ALA 74 N 1.21 0.43 -0.78 1.53 0.00 -1.36 -2.57 119.26 117.72 1d5m h ALA 74 Ca 0.27 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1d5m h ALA 74 Cb 0.07 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1d5m h ALA 74 CO -0.04 0.15 0.37 -0.44 0.00 0.00 0.00 179.25 179.29 1d5m h ASP 75 N 0.36 1.02 -0.51 0.00 3.32 -0.49 0.16 116.42 120.28 1d5m h ASP 75 Ca 0.09 -0.14 0.03 0.00 0.02 0.00 0.00 57.03 57.04 1d5m h ASP 75 Cb 0.39 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.64 1d5m h ASP 75 CO 0.01 0.87 0.29 0.50 -1.72 0.00 0.00 179.24 179.19 1d5m h LYS 76 N 1.10 0.55 0.00 3.56 3.64 -0.91 -3.10 116.57 121.42 1d5m h LYS 76 Ca 0.27 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1d5m h LYS 76 Cb 0.13 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1d5m h LYS 76 CO -0.03 0.36 -0.73 0.66 -2.27 0.00 0.00 179.45 177.44 1d5m n TYR 77 N -4.83 0.01 -0.26 1.91 4.02 -0.98 -4.60 117.16 112.43 1d5m n TYR 77 Ca 0.04 0.00 -0.00 0.00 -0.01 0.00 0.00 57.90 57.93 1d5m n TYR 77 Cb 0.10 -0.15 0.06 0.00 -0.02 0.00 0.00 39.34 39.33 1d5m n TYR 77 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1d5m h LYS 78 N 0.00 -0.04 -0.47 -0.72 3.64 -0.60 -1.65 116.57 116.72 1d5m h LYS 78 Ca 0.00 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 1d5m h LYS 78 Cb 0.51 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.27 1d5m h LYS 78 CO 0.00 -0.03 0.09 -0.25 -2.27 0.00 0.00 179.45 176.99 1d5m n ASP 79 N -5.49 4.02 -4.78 4.20 8.00 -1.26 -3.92 116.55 117.32 1d5m n ASP 79 Ca 0.09 -3.25 -0.31 0.00 0.71 0.00 0.00 54.79 52.03 1d5m n ASP 79 Cb 0.38 -0.64 -0.06 0.00 -0.02 0.00 0.00 41.12 40.78 1d5m n ASP 79 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1d5m s LYS 80 N -2.98 2.96 -0.15 -1.24 1.02 -0.62 -5.02 119.74 113.70 1d5m s LYS 80 Ca 0.48 -0.62 -0.25 0.00 0.02 0.00 0.00 55.97 55.60 1d5m s LYS 80 Cb 0.40 -2.78 -0.02 0.00 -0.52 0.00 0.00 37.83 34.91 1d5m s LYS 80 CO 0.09 0.59 0.81 0.71 -0.92 0.00 0.00 175.35 176.62 1d5m s TYR 81 N -1.34 3.45 0.33 3.18 1.51 -1.26 -4.39 117.35 118.82 1d5m s TYR 81 Ca 0.28 1.25 0.04 0.00 -1.01 0.00 0.00 57.07 57.62 1d5m s TYR 81 Cb -0.12 -2.98 -0.03 0.00 -0.11 0.00 0.00 41.96 38.72 1d5m s TYR 81 CO 0.20 -0.18 0.16 0.14 -1.11 0.00 0.00 175.55 174.76 1d5m s VAL 82 N 1.91 0.39 -0.07 0.71 -7.23 0.74 -1.28 120.40 115.57 1d5m s VAL 82 Ca 0.38 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.56 1d5m s VAL 82 Cb -0.17 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.26 1d5m s VAL 82 CO 0.14 0.00 -0.09 -1.81 -0.31 0.00 0.00 175.10 173.03 1d5m s ASP 83 N -3.43 4.49 -0.08 4.85 1.01 0.32 -0.79 116.67 123.05 1d5m s ASP 83 Ca 0.34 -0.08 0.04 0.00 0.71 0.00 0.00 52.55 53.56 1d5m s ASP 83 Cb 0.04 -1.17 -0.01 0.00 1.01 0.00 0.00 42.92 42.79 1d5m s ASP 83 CO 0.18 0.34 -0.22 -0.69 0.21 0.00 0.00 175.17 174.99 1d5m s VAL 84 N -0.65 2.34 -0.14 -1.27 1.01 0.43 -2.13 120.40 119.99 1d5m s VAL 84 Ca 0.10 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 61.08 1d5m s VAL 84 Cb -0.11 -1.89 0.07 0.00 0.00 0.00 0.00 36.38 34.44 1d5m s VAL 84 CO 0.02 0.56 0.27 0.12 0.00 0.00 0.00 175.10 176.07 1d5m s PHE 85 N -0.05 -0.45 0.05 5.22 5.36 0.25 -0.77 117.98 127.60 1d5m s PHE 85 Ca -0.06 0.98 -0.28 0.00 -0.96 0.00 0.00 56.93 56.61 1d5m s PHE 85 Cb -0.15 -0.03 0.09 0.00 -0.34 0.00 0.00 43.02 42.60 1d5m s PHE 85 CO 0.05 -0.37 1.11 0.20 -1.46 0.00 0.00 175.22 174.74 1d5m s GLY 86 N 2.43 -0.33 -0.20 13.12 0.00 -0.51 -4.26 107.32 117.58 1d5m s GLY 86 Ca 0.01 0.51 -0.20 0.00 0.00 0.00 0.00 44.72 45.04 1d5m s GLY 86 CO -0.09 0.10 0.58 0.00 0.00 0.00 0.00 173.10 173.69 1d5m s ALA 87 N -2.86 3.54 0.42 3.20 0.00 -1.26 -0.28 121.76 124.52 1d5m s ALA 87 Ca 0.12 -0.34 0.07 0.00 0.00 0.00 0.00 51.96 51.82 1d5m s ALA 87 Cb 0.01 -2.90 -0.03 0.00 0.00 0.00 0.00 23.12 20.20 1d5m s ALA 87 CO -0.01 -0.52 0.33 0.54 0.00 0.00 0.00 175.76 176.10 1d5m s ASN 88 N 1.19 4.86 0.15 0.00 4.22 -1.26 -4.56 114.94 119.54 1d5m s ASN 88 Ca 0.27 -0.86 -0.08 0.00 -2.14 0.00 0.00 52.86 50.05 1d5m s ASN 88 Cb -0.16 -0.50 -0.01 0.00 1.28 0.00 0.00 41.25 41.86 1d5m s ASN 88 CO 0.10 -0.65 0.25 -0.72 -2.04 0.00 0.00 177.10 174.04 1d5m s TYR 89 N -2.52 0.43 0.00 1.54 -0.85 -0.49 -4.91 117.35 110.55 1d5m s TYR 89 Ca 0.46 -0.80 0.00 0.00 -0.52 0.00 0.00 57.07 56.20 1d5m s TYR 89 Cb -0.01 -0.11 0.00 0.00 0.38 0.00 0.00 41.96 42.22 1d5m s TYR 89 CO 0.26 -0.68 0.00 0.66 -1.52 0.00 0.00 175.55 174.27 1d5m n TYR 90 N -0.19 0.00 -1.67 -3.49 4.02 -1.26 -1.57 117.16 113.00 1d5m n TYR 90 Ca -0.08 0.00 -0.44 0.00 -0.01 0.00 0.00 57.90 57.38 1d5m n TYR 90 Cb 0.63 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.92 1d5m n TYR 90 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 176.86 176.83 1d5m n TYR 91 N -2.63 2.50 -2.24 -0.72 9.36 -1.26 -1.21 117.16 120.96 1d5m n TYR 91 Ca 0.00 -0.20 -0.12 0.00 3.32 0.00 0.00 57.90 60.90 1d5m n TYR 91 Cb 0.49 -2.74 -0.01 0.00 -0.63 0.00 0.00 39.34 36.45 1d5m n TYR 91 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 1d5m n GLN 92 N 6.53 -1.01 -3.40 2.98 6.02 -1.26 -4.74 117.38 122.49 1d5m n GLN 92 Ca 0.20 0.59 -0.41 0.00 -0.01 0.00 0.00 57.00 57.37 1d5m n GLN 92 Cb 0.37 -4.76 -0.09 0.00 1.02 0.00 0.00 30.24 26.78 1d5m n GLN 92 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1d5m s TYR 94 N 2.02 1.05 0.00 0.00 1.51 -1.26 -4.99 117.35 115.69 1d5m s TYR 94 Ca 0.12 -0.46 0.00 0.00 -1.01 0.00 0.00 57.07 55.72 1d5m s TYR 94 Cb -0.17 -0.60 0.00 0.00 -0.11 0.00 0.00 41.96 41.08 1d5m s TYR 94 CO 0.12 0.02 0.00 1.97 -1.11 0.00 0.00 175.55 176.54 1d5m n PHE 95 N 1.38 0.00 -4.34 2.71 1.16 -1.26 -5.06 117.46 112.06 1d5m n PHE 95 Ca -0.21 0.00 -0.20 0.00 -1.87 0.00 0.00 57.45 55.17 1d5m n PHE 95 Cb 0.54 0.00 -0.15 0.00 -1.61 0.00 0.00 39.48 38.26 1d5m n PHE 95 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 1d5m s SER 96 N 0.00 1.09 0.33 5.98 1.04 -1.26 -5.14 113.70 115.74 1d5m s SER 96 Ca 0.00 -0.17 0.02 0.00 0.48 0.00 0.00 55.95 56.29 1d5m s SER 96 Cb 0.00 -0.28 0.02 0.00 0.10 0.00 0.00 66.02 65.86 1d5m s SER 96 CO 0.00 0.06 0.19 2.29 0.98 0.00 0.00 173.24 176.76 1d5m n LYS 97 N 3.28 1.05 0.00 4.02 2.85 -1.26 -4.66 118.16 123.44 1d5m n LYS 97 Ca -0.18 -2.15 0.00 0.00 -1.05 0.00 0.00 58.31 54.93 1d5m n LYS 97 Cb 0.55 0.31 0.00 0.00 -0.65 0.00 0.00 35.03 35.24 1d5m n LYS 97 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1d5m n LYS 98 N -1.18 0.00 -0.82 -1.58 4.76 -1.26 -5.14 118.16 112.93 1d5m n LYS 98 Ca -0.04 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 1d5m n LYS 98 Cb 0.39 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.58 1d5m n LYS 98 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 1d5m n LYS 109 N 0.00 0.00 0.00 1.97 4.81 -1.20 -5.11 118.16 118.62 1d5m n LYS 109 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1d5m n LYS 109 Cb 0.00 -0.33 0.00 0.00 0.02 0.00 0.00 35.03 34.72 1d5m n LYS 109 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1d5m n ARG 110 N -0.14 0.00 -4.00 1.64 1.74 -1.08 -4.75 116.66 110.07 1d5m n ARG 110 Ca 0.00 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.99 1d5m n ARG 110 Cb 0.00 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.36 1d5m n ARG 110 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 1d5m s LYS 111 N 2.21 1.01 0.19 5.56 -2.85 -1.26 -1.51 119.74 123.09 1d5m s LYS 111 Ca 0.00 -1.21 -0.04 0.00 -1.00 0.00 0.00 55.97 53.72 1d5m s LYS 111 Cb 0.00 0.32 -0.03 0.00 -2.06 0.00 0.00 37.83 36.07 1d5m s LYS 111 CO 0.00 -0.33 0.20 -0.08 0.10 0.00 0.00 175.35 175.24 1d5m s THR 112 N -3.97 0.03 0.12 3.79 -1.32 -0.97 -4.87 115.64 108.46 1d5m s THR 112 Ca 0.16 -1.79 0.03 0.00 -1.21 0.00 0.00 61.69 58.89 1d5m s THR 112 Cb 0.05 -2.26 -0.04 0.00 -1.51 0.00 0.00 72.50 68.73 1d5m s THR 112 CO -0.02 -0.13 -0.09 0.00 -2.21 0.00 0.00 174.62 172.17 1d5m s MET 114 N -3.58 2.00 0.01 0.00 0.23 -0.27 -1.39 119.30 116.30 1d5m s MET 114 Ca 0.13 -1.27 0.05 0.00 -1.03 0.00 0.00 55.69 53.57 1d5m s MET 114 Cb 0.02 0.57 -0.02 0.00 -1.53 0.00 0.00 34.83 33.87 1d5m s MET 114 CO -0.01 -0.93 -0.16 0.71 -2.03 0.00 0.00 175.02 172.60 1d5m s TYR 115 N -2.38 1.39 0.00 3.16 1.51 -1.26 -1.28 117.35 118.48 1d5m s TYR 115 Ca 0.16 -0.31 0.00 0.00 -1.01 0.00 0.00 57.07 55.92 1d5m s TYR 115 Cb -0.05 -0.86 0.00 0.00 -0.11 0.00 0.00 41.96 40.95 1d5m s TYR 115 CO 0.10 0.01 0.00 0.41 -1.11 0.00 0.00 175.55 174.96 1d5m n GLY 116 N 2.31 2.57 2.36 0.71 0.00 -0.68 -4.60 105.19 107.86 1d5m n GLY 116 Ca -0.16 -0.18 -0.13 0.00 0.00 0.00 0.00 46.02 45.55 1d5m n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d5m n GLY 117 N 0.00 1.28 3.42 -0.02 0.00 -1.26 -4.82 105.19 103.79 1d5m n GLY 117 Ca 0.00 -0.43 -0.33 0.00 0.00 0.00 0.00 46.02 45.26 1d5m n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d5m s VAL 118 N -2.48 3.32 0.01 1.61 1.01 -1.26 -0.58 120.40 122.02 1d5m s VAL 118 Ca 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.42 1d5m s VAL 118 Cb 0.00 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 1d5m s VAL 118 CO 0.00 0.52 -0.04 0.42 0.00 0.00 0.00 175.10 176.00 1d5m s THR 119 N 0.26 0.33 0.37 3.92 -4.23 -0.91 -4.98 115.64 110.40 1d5m s THR 119 Ca -0.07 -0.39 -0.28 0.00 -1.18 0.00 0.00 61.69 59.77 1d5m s THR 119 Cb -0.15 -0.32 -0.11 0.00 1.34 0.00 0.00 72.50 73.26 1d5m s THR 119 CO 0.05 -0.05 1.47 1.21 -0.54 0.00 0.00 174.62 176.76 1d5m n GLU 120 N 2.60 2.63 0.06 3.99 2.13 -1.26 -0.52 120.64 130.27 1d5m n GLU 120 Ca -0.15 0.92 -0.03 0.00 0.66 0.00 0.00 57.16 58.56 1d5m n GLU 120 Cb 0.58 -2.64 -0.01 0.00 0.27 0.00 0.00 31.44 29.63 1d5m n GLU 120 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1d5m h HIS 121 N 2.97 -0.18 -3.20 4.31 -0.00 -1.47 -3.40 115.15 114.18 1d5m h HIS 121 Ca -0.50 -0.00 -0.53 0.00 -0.00 0.00 0.00 60.37 59.34 1d5m h HIS 121 Cb 1.25 0.06 0.08 0.00 -0.00 0.00 0.00 27.41 28.79 1d5m h HIS 121 CO 0.53 -0.11 0.91 -0.80 -0.00 0.00 0.00 177.93 178.46 1d5m s ASN 122 N -3.87 6.37 0.00 3.26 0.01 -1.26 -2.28 114.94 117.16 1d5m s ASN 122 Ca -0.03 2.94 0.00 0.00 -0.71 0.00 0.00 52.86 55.06 1d5m s ASN 122 Cb 0.00 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 39.03 1d5m s ASN 122 CO 0.09 -0.93 0.00 0.61 -1.51 0.00 0.00 177.10 175.36 1d5m n GLY 123 N 2.51 0.74 0.00 0.66 0.00 -1.26 -4.87 105.19 102.97 1d5m n GLY 123 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1d5m n GLY 123 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1d5m n ASN 124 N 0.00 1.17 -4.84 1.61 5.15 -0.97 -4.94 115.26 112.44 1d5m n ASN 124 Ca 0.00 -1.39 -0.36 0.00 -0.60 0.00 0.00 54.58 52.23 1d5m n ASN 124 Cb 0.00 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.19 1d5m n ASN 124 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1d5m s GLN 125 N -0.39 3.98 0.09 1.20 -1.52 -1.25 -0.50 119.66 121.26 1d5m s GLN 125 Ca 0.00 0.47 0.05 0.00 -1.95 0.00 0.00 55.36 53.93 1d5m s GLN 125 Cb 0.00 -3.06 -0.04 0.00 -0.22 0.00 0.00 33.01 29.69 1d5m s GLN 125 CO 0.00 0.57 -0.01 -0.51 -0.25 0.00 0.00 175.29 175.09 1d5m s LEU 126 N -1.60 3.43 0.31 2.90 1.43 -0.22 -4.81 118.68 120.11 1d5m s LEU 126 Ca 0.32 -0.19 0.03 0.00 -1.03 0.00 0.00 54.13 53.26 1d5m s LEU 126 Cb -0.16 -2.16 0.52 0.00 0.03 0.00 0.00 46.19 44.42 1d5m s LEU 126 CO 0.18 0.18 1.83 -0.78 0.23 0.00 0.00 176.35 177.99 1d5m h ASP 127 N 3.47 0.56 -4.52 2.29 3.58 -1.99 -3.45 116.42 116.36 1d5m h ASP 127 Ca -0.48 -0.12 -0.29 0.00 0.42 0.00 0.00 57.03 56.56 1d5m h ASP 127 Cb 1.16 -0.15 -0.15 0.00 1.72 0.00 0.00 39.33 41.92 1d5m h ASP 127 CO 0.59 0.64 -0.66 -0.54 -2.88 0.00 0.00 179.24 176.39 1d5m s LYS 128 N -4.94 1.14 0.10 0.28 1.02 -1.26 -5.12 119.74 110.96 1d5m s LYS 128 Ca -0.08 -1.56 -0.31 0.00 0.02 0.00 0.00 55.97 54.04 1d5m s LYS 128 Cb 0.15 -0.26 -0.07 0.00 -0.52 0.00 0.00 37.83 37.13 1d5m s LYS 128 CO 0.78 -0.15 1.37 0.71 -0.92 0.00 0.00 175.35 177.14 1d5m s TYR 129 N -3.67 3.22 -0.03 3.18 1.51 -1.26 -4.68 117.35 115.62 1d5m s TYR 129 Ca 0.26 0.97 -0.11 0.00 -1.01 0.00 0.00 57.07 57.18 1d5m s TYR 129 Cb 0.06 -3.65 -0.05 0.00 -0.11 0.00 0.00 41.96 38.21 1d5m s TYR 129 CO 0.05 -2.27 0.31 0.50 -1.11 0.00 0.00 175.55 173.02 1d5m s ARG 130 N 1.25 3.70 0.07 -0.62 3.52 0.46 -4.86 118.95 122.48 1d5m s ARG 130 Ca 0.64 0.15 -0.12 0.00 -0.13 0.00 0.00 55.73 56.27 1d5m s ARG 130 Cb -0.35 -3.16 -0.06 0.00 -1.56 0.00 0.00 34.95 29.81 1d5m s ARG 130 CO 0.30 0.70 0.43 -1.54 -0.81 0.00 0.00 175.30 174.38 1d5m s SER 131 N -1.24 6.72 -0.10 -2.12 1.04 -1.26 -1.88 113.70 114.86 1d5m s SER 131 Ca 0.23 0.89 0.00 0.00 0.48 0.00 0.00 55.95 57.56 1d5m s SER 131 Cb -0.14 -2.22 0.02 0.00 0.10 0.00 0.00 66.02 63.78 1d5m s SER 131 CO 0.12 0.19 -0.09 -0.63 0.98 0.00 0.00 173.24 173.81 1d5m s ILE 132 N -1.33 1.05 0.01 -1.02 1.01 -0.27 -4.97 121.20 115.68 1d5m s ILE 132 Ca 0.32 -0.35 -0.29 0.00 0.00 0.00 0.00 60.65 60.34 1d5m s ILE 132 Cb -0.15 -1.04 -0.04 0.00 0.01 0.00 0.00 42.46 41.25 1d5m s ILE 132 CO 0.17 0.36 0.92 -0.89 0.00 0.00 0.00 174.94 175.51 1d5m s THR 133 N 1.38 4.83 -0.21 2.92 2.01 -1.26 -1.41 115.64 123.90 1d5m s THR 133 Ca -0.01 1.94 -0.05 0.00 0.31 0.00 0.00 61.69 63.88 1d5m s THR 133 Cb -0.14 -4.27 -0.02 0.00 0.01 0.00 0.00 72.50 68.09 1d5m s THR 133 CO -0.05 0.21 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.40 1d5m s VAL 134 N 0.76 3.79 -0.31 3.82 1.01 0.22 -1.97 120.40 127.72 1d5m s VAL 134 Ca 0.48 -0.36 -0.08 0.00 0.00 0.00 0.00 61.98 62.02 1d5m s VAL 134 Cb -0.21 -2.72 0.01 0.00 0.00 0.00 0.00 36.38 33.46 1d5m s VAL 134 CO 0.26 0.42 0.12 -0.13 0.00 0.00 0.00 175.10 175.77 1d5m s ARG 135 N 1.21 3.11 -0.18 2.72 0.52 -0.20 -1.06 118.95 125.06 1d5m s ARG 135 Ca 0.03 -0.86 -0.17 0.00 -0.52 0.00 0.00 55.73 54.22 1d5m s ARG 135 Cb -0.15 -3.48 -0.04 0.00 0.52 0.00 0.00 34.95 31.81 1d5m s ARG 135 CO 0.01 -0.48 0.44 0.08 0.02 0.00 0.00 175.30 175.37 1d5m s VAL 136 N 1.54 5.18 -0.13 3.52 1.01 0.11 -1.26 120.40 130.36 1d5m s VAL 136 Ca 0.03 0.81 -0.02 0.00 0.00 0.00 0.00 61.98 62.80 1d5m s VAL 136 Cb -0.17 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 1d5m s VAL 136 CO 0.04 0.26 -0.06 -0.36 0.00 0.00 0.00 175.10 174.98 1d5m s PHE 137 N 1.17 2.96 -0.30 5.22 0.40 0.22 -3.17 117.98 124.49 1d5m s PHE 137 Ca 0.22 -0.30 0.03 0.00 -0.60 0.00 0.00 56.93 56.27 1d5m s PHE 137 Cb -0.15 -1.88 0.08 0.00 0.51 0.00 0.00 43.02 41.57 1d5m s PHE 137 CO 0.09 0.00 -0.03 -1.21 0.70 0.00 0.00 175.22 174.77 1d5m s GLU 138 N 0.12 1.93 -1.27 0.44 2.02 0.14 -0.20 118.70 121.88 1d5m s GLU 138 Ca -0.02 -1.57 -0.05 0.00 0.02 0.00 0.00 54.97 53.34 1d5m s GLU 138 Cb -0.14 -3.05 0.01 0.00 0.10 0.00 0.00 34.13 31.05 1d5m s GLU 138 CO 0.03 -0.73 1.10 -0.25 0.02 0.00 0.00 175.26 175.42 1d5m n ASP 139 N 4.37 -4.65 0.00 -0.19 8.00 0.16 -2.26 116.55 121.97 1d5m n ASP 139 Ca -0.06 -0.56 0.00 0.00 0.71 0.00 0.00 54.79 54.88 1d5m n ASP 139 Cb 0.42 -4.99 0.00 0.00 -0.02 0.00 0.00 41.12 36.53 1d5m n ASP 139 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1d5m n GLY 140 N -1.65 2.33 3.60 0.44 0.00 -1.26 -5.02 105.19 103.62 1d5m n GLY 140 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 1d5m n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d5m s LYS 141 N -0.20 3.61 -1.28 1.61 -0.14 -0.96 -5.02 119.74 117.36 1d5m s LYS 141 Ca 0.00 -0.42 -0.17 0.00 -1.36 0.00 0.00 55.97 54.02 1d5m s LYS 141 Cb 0.00 -3.00 0.09 0.00 -1.68 0.00 0.00 37.83 33.25 1d5m s LYS 141 CO 0.00 0.38 1.66 1.21 -0.76 0.00 0.00 175.35 177.85 1d5m s ASN 142 N 0.02 6.89 0.20 2.83 3.04 -1.26 0.26 114.94 126.92 1d5m s ASN 142 Ca 0.03 -2.57 0.24 0.00 0.04 0.00 0.00 52.86 50.61 1d5m s ASN 142 Cb -0.13 -2.54 0.44 0.00 -1.54 0.00 0.00 41.25 37.49 1d5m s ASN 142 CO 0.02 -1.07 1.46 -0.07 -3.04 0.00 0.00 177.10 174.40 1d5m h LEU 143 N 11.90 0.00 -7.45 3.21 3.38 -1.90 -3.47 115.31 120.98 1d5m h LEU 143 Ca 0.42 -0.10 -0.16 0.00 0.09 0.00 0.00 57.88 58.13 1d5m h LEU 143 Cb 0.87 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.37 1d5m h LEU 143 CO 1.41 0.05 -0.41 -0.22 0.09 0.00 0.00 178.44 179.36 1d5m s LEU 144 N -4.70 0.94 -0.02 1.67 2.96 -1.23 -5.08 118.68 113.22 1d5m s LEU 144 Ca 0.07 0.54 -0.00 0.00 -0.22 0.00 0.00 54.13 54.51 1d5m s LEU 144 Cb 0.12 0.91 0.03 0.00 0.50 0.00 0.00 46.19 47.74 1d5m s LEU 144 CO 0.69 -0.10 0.04 -0.44 -1.32 0.00 0.00 176.35 175.22 1d5m s SER 145 N 0.22 0.04 0.26 3.68 0.01 -1.26 0.07 113.70 116.72 1d5m s SER 145 Ca -0.01 0.07 -0.02 0.00 1.31 0.00 0.00 55.95 57.31 1d5m s SER 145 Cb -0.02 -0.03 -0.03 0.00 0.21 0.00 0.00 66.02 66.16 1d5m s SER 145 CO -0.00 -0.12 0.27 0.72 0.41 0.00 0.00 173.24 174.52 1d5m s PHE 146 N 0.96 1.12 0.04 2.43 -0.71 -0.23 -4.98 117.98 116.62 1d5m s PHE 146 Ca -0.08 -1.31 0.08 0.00 -1.04 0.00 0.00 56.93 54.58 1d5m s PHE 146 Cb -0.11 -0.38 -0.03 0.00 -1.21 0.00 0.00 43.02 41.28 1d5m s PHE 146 CO -0.03 -0.83 -0.22 -0.51 -1.34 0.00 0.00 175.22 172.29 1d5m s ASP 147 N -3.19 3.51 0.16 1.98 1.01 -1.26 0.73 116.67 119.61 1d5m s ASP 147 Ca 0.35 -0.50 0.09 0.00 0.71 0.00 0.00 52.55 53.19 1d5m s ASP 147 Cb 0.04 -0.46 -0.04 0.00 1.01 0.00 0.00 42.92 43.46 1d5m s ASP 147 CO 0.16 0.26 -0.12 0.68 0.21 0.00 0.00 175.17 176.35 1d5m s VAL 148 N -0.87 3.08 0.07 -1.27 -7.23 -0.50 -4.91 120.40 108.76 1d5m s VAL 148 Ca 0.13 -1.60 0.07 0.00 -1.81 0.00 0.00 61.98 58.78 1d5m s VAL 148 Cb -0.10 -2.49 -0.04 0.00 0.56 0.00 0.00 36.38 34.32 1d5m s VAL 148 CO 0.04 -0.03 -0.17 -1.10 -0.31 0.00 0.00 175.10 173.53 1d5m s GLN 149 N -2.58 2.02 -0.07 4.82 1.11 -1.26 -1.12 119.66 122.58 1d5m s GLN 149 Ca 0.23 -1.03 -0.14 0.00 0.01 0.00 0.00 55.36 54.42 1d5m s GLN 149 Cb -0.09 -2.19 0.03 0.00 -1.01 0.00 0.00 33.01 29.74 1d5m s GLN 149 CO 0.13 0.52 0.35 -0.08 0.01 0.00 0.00 175.29 176.22 1d5m s THR 150 N -1.02 0.03 -0.24 -0.19 -1.32 -0.79 -4.94 115.64 107.18 1d5m s THR 150 Ca 0.16 -0.26 0.14 0.00 -1.21 0.00 0.00 61.69 60.52 1d5m s THR 150 Cb -0.11 -0.58 0.60 0.00 -1.51 0.00 0.00 72.50 70.90 1d5m s THR 150 CO 0.07 -0.14 1.55 -0.46 -2.21 0.00 0.00 174.62 173.43 1d5m n ASN 151 N 1.93 4.00 -4.46 8.08 6.94 -1.26 -0.40 115.26 130.09 1d5m n ASN 151 Ca -0.18 -3.20 -0.33 0.00 -0.02 0.00 0.00 54.58 50.85 1d5m n ASN 151 Cb 0.57 -0.62 -0.13 0.00 -2.36 0.00 0.00 39.78 37.23 1d5m n ASN 151 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1d5m s LYS 152 N -2.94 2.83 0.09 -3.83 1.02 -1.26 -1.06 119.74 114.59 1d5m s LYS 152 Ca 0.47 -0.67 -0.18 0.00 0.02 0.00 0.00 55.97 55.61 1d5m s LYS 152 Cb 0.38 -2.49 -0.07 0.00 -0.52 0.00 0.00 37.83 35.13 1d5m s LYS 152 CO 0.09 0.49 1.51 0.87 -0.92 0.00 0.00 175.35 177.39 1d5m h LYS 153 N 5.79 0.50 -4.93 1.68 1.57 -1.11 -3.40 116.57 116.67 1d5m h LYS 153 Ca -0.40 -0.17 -0.67 0.00 -1.87 0.00 0.00 60.65 57.54 1d5m h LYS 153 Cb 1.17 -0.04 -0.31 0.00 0.08 0.00 0.00 32.23 33.13 1d5m h LYS 153 CO 0.52 0.68 -0.75 0.15 -0.57 0.00 0.00 179.45 179.49 1d5m s LYS 154 N -4.91 2.97 0.03 3.15 1.02 -1.26 -1.27 119.74 119.48 1d5m s LYS 154 Ca -0.13 -0.89 0.08 0.00 0.02 0.00 0.00 55.97 55.04 1d5m s LYS 154 Cb 0.08 -2.97 -0.03 0.00 -0.52 0.00 0.00 37.83 34.39 1d5m s LYS 154 CO 0.76 -0.34 -0.21 0.08 -0.92 0.00 0.00 175.35 174.72 1d5m s VAL 155 N 1.36 2.58 0.54 3.17 1.01 -0.21 -4.90 120.40 123.95 1d5m s VAL 155 Ca 0.02 -1.22 -0.19 0.00 0.00 0.00 0.00 61.98 60.59 1d5m s VAL 155 Cb -0.16 -2.05 -0.06 0.00 0.00 0.00 0.00 36.38 34.11 1d5m s VAL 155 CO -0.05 0.37 1.09 0.42 0.00 0.00 0.00 175.10 176.93 1d5m s THR 156 N -0.86 3.47 0.33 3.92 -4.23 -1.26 -0.90 115.64 116.10 1d5m s THR 156 Ca 0.13 0.86 0.02 0.00 -1.18 0.00 0.00 61.69 61.52 1d5m s THR 156 Cb -0.10 -3.33 0.20 0.00 1.34 0.00 0.00 72.50 70.60 1d5m s THR 156 CO 0.04 -0.25 1.91 0.00 -0.54 0.00 0.00 174.62 175.77 1d5m h ALA 157 N 1.09 1.39 -0.29 3.99 0.00 -1.24 -2.77 119.26 121.43 1d5m h ALA 157 Ca -0.49 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.33 1d5m h ALA 157 Cb 1.24 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.77 1d5m h ALA 157 CO 0.57 0.46 -0.07 0.37 0.00 0.00 0.00 179.25 180.58 1d5m h GLN 158 N 0.71 -0.00 0.00 0.00 4.15 -1.91 0.22 115.11 118.28 1d5m h GLN 158 Ca 0.17 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.61 1d5m h GLN 158 Cb 0.16 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.83 1d5m h GLN 158 CO -0.01 -0.00 -0.13 1.49 -1.93 0.00 0.00 178.83 178.24 1d5m h GLU 159 N -0.00 -0.21 -0.81 1.69 4.81 -1.75 0.11 114.58 118.43 1d5m h GLU 159 Ca 0.14 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.36 1d5m h GLU 159 Cb 0.21 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 1d5m h GLU 159 CO -0.30 -0.14 0.42 -0.07 -0.73 0.00 0.00 179.01 178.20 1d5m h LEU 160 N -0.22 1.02 0.22 1.64 3.38 -1.37 -1.56 115.31 118.41 1d5m h LEU 160 Ca 0.05 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1d5m h LEU 160 Cb 0.28 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1d5m h LEU 160 CO -0.13 0.83 -0.10 -0.78 0.09 0.00 0.00 178.44 178.35 1d5m h ASP 161 N 1.13 -0.25 -0.28 -0.43 1.82 0.04 -0.14 116.42 118.32 1d5m h ASP 161 Ca 0.28 -0.03 0.06 0.00 -0.39 0.00 0.00 57.03 56.95 1d5m h ASP 161 Cb 0.05 0.06 -0.07 0.00 0.68 0.00 0.00 39.33 40.06 1d5m h ASP 161 CO -0.04 -0.13 -0.16 0.22 -1.61 0.00 0.00 179.24 177.52 1d5m h TYR 162 N -0.35 -0.40 -0.89 0.28 3.20 -0.54 0.20 116.97 118.47 1d5m h TYR 162 Ca -0.03 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1d5m h TYR 162 Cb 0.27 0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.71 1d5m h TYR 162 CO -0.05 -0.24 0.56 -0.07 -1.64 0.00 0.00 178.16 176.72 1d5m h LEU 163 N -0.13 1.05 0.22 2.82 3.38 -1.17 0.18 115.31 121.66 1d5m h LEU 163 Ca 0.15 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1d5m h LEU 163 Cb 0.36 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1d5m h LEU 163 CO -0.36 0.79 -0.11 0.74 0.09 0.00 0.00 178.44 179.59 1d5m h THR 164 N 1.22 0.83 -0.18 0.22 2.02 -0.18 -2.24 112.91 114.59 1d5m h THR 164 Ca 0.32 -0.27 -0.08 0.00 0.77 0.00 0.00 66.41 67.16 1d5m h THR 164 Cb -0.08 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1d5m h THR 164 CO -0.06 0.06 -0.24 0.03 0.37 0.00 0.00 175.52 175.68 1d5m h ARG 165 N -0.43 0.33 -0.67 6.66 3.08 -0.82 -1.83 114.38 120.70 1d5m h ARG 165 Ca -0.03 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 1d5m h ARG 165 Cb 0.33 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 1d5m h ARG 165 CO 0.05 0.56 0.41 1.25 -1.07 0.00 0.00 179.97 181.17 1d5m h HIS 166 N 0.30 0.88 -0.28 3.04 2.76 -0.52 0.54 115.15 121.87 1d5m h HIS 166 Ca 0.05 -0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.16 1d5m h HIS 166 Cb 0.59 -0.29 -0.01 0.00 1.55 0.00 0.00 27.41 29.25 1d5m h HIS 166 CO 0.01 0.60 -0.03 -0.92 -1.30 0.00 0.00 177.93 176.29 1d5m h TYR 167 N 0.91 0.57 -0.14 5.26 3.20 -1.06 -2.64 116.97 123.07 1d5m h TYR 167 Ca 0.24 -0.11 -0.07 0.00 3.14 0.00 0.00 58.73 61.93 1d5m h TYR 167 Cb -0.03 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 1d5m h TYR 167 CO -0.02 0.69 -0.23 -0.07 -1.64 0.00 0.00 178.16 176.89 1d5m h LEU 168 N 0.29 0.23 -0.11 2.82 3.38 -0.92 -0.67 115.31 120.34 1d5m h LEU 168 Ca 0.08 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1d5m h LEU 168 Cb 0.48 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1d5m h LEU 168 CO 0.02 0.48 0.01 0.58 0.09 0.00 0.00 178.44 179.62 1d5m h VAL 169 N 0.22 1.23 -0.07 1.22 2.07 0.20 0.23 116.25 121.34 1d5m h VAL 169 Ca 0.04 -0.71 -0.18 0.00 0.82 0.00 0.00 66.70 66.67 1d5m h VAL 169 Cb 0.54 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 1d5m h VAL 169 CO 0.04 0.20 -0.71 0.11 0.02 0.00 0.00 177.57 177.23 1d5m h LYS 170 N -0.06 0.35 0.00 1.57 1.57 -1.34 -2.66 116.57 116.01 1d5m h LYS 170 Ca 0.03 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1d5m h LYS 170 Cb 0.30 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1d5m h LYS 170 CO 0.00 0.93 -1.55 0.09 -0.57 0.00 0.00 179.45 178.35 1d5m n ASN 171 N -3.83 0.84 -0.13 0.86 3.02 -0.27 -4.59 115.26 111.16 1d5m n ASN 171 Ca -0.04 -0.26 0.02 0.00 -0.03 0.00 0.00 54.58 54.28 1d5m n ASN 171 Cb 0.70 1.60 0.03 0.00 -0.61 0.00 0.00 39.78 41.49 1d5m n ASN 171 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1d5m n LYS 172 N -1.93 1.06 -4.25 3.52 4.76 0.74 -5.01 118.16 117.05 1d5m n LYS 172 Ca -0.01 -1.29 -0.35 0.00 -2.87 0.00 0.00 58.31 53.78 1d5m n LYS 172 Cb 0.42 -0.83 -0.04 0.00 -1.84 0.00 0.00 35.03 32.74 1d5m n LYS 172 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1d5m n LYS 173 N -0.42 -2.60 -0.28 1.97 5.02 -0.81 -4.79 118.16 116.24 1d5m n LYS 173 Ca 0.03 0.32 0.11 0.00 -2.02 0.00 0.00 58.31 56.74 1d5m n LYS 173 Cb 0.51 -4.83 0.26 0.00 -0.02 0.00 0.00 35.03 30.94 1d5m n LYS 173 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1d5m h LEU 174 N -1.47 0.06 -8.26 -0.35 5.85 -1.57 -3.39 115.31 106.18 1d5m h LEU 174 Ca -0.60 0.17 -0.52 0.00 0.84 0.00 0.00 57.88 57.77 1d5m h LEU 174 Cb 1.38 0.22 -0.29 0.00 0.37 0.00 0.00 40.66 42.34 1d5m h LEU 174 CO 0.77 -0.09 -0.82 -0.31 -0.34 0.00 0.00 178.44 177.65 1d5m s TYR 175 N -5.96 1.43 0.34 1.25 4.12 -1.26 -4.52 117.35 112.75 1d5m s TYR 175 Ca -0.12 -0.28 0.04 0.00 0.02 0.00 0.00 57.07 56.72 1d5m s TYR 175 Cb 0.24 -0.93 -0.06 0.00 -1.52 0.00 0.00 41.96 39.70 1d5m s TYR 175 CO 0.77 -0.04 0.07 -1.21 0.02 0.00 0.00 175.55 175.16 1d5m s GLU 176 N -0.33 1.69 0.16 -0.62 2.02 -0.51 -4.95 118.70 116.16 1d5m s GLU 176 Ca 0.05 -1.96 -0.21 0.00 0.02 0.00 0.00 54.97 52.88 1d5m s GLU 176 Cb -0.07 -0.83 0.07 0.00 0.10 0.00 0.00 34.13 33.40 1d5m s GLU 176 CO -0.00 -0.23 1.63 0.35 0.02 0.00 0.00 175.26 177.02 1d5m h PHE 177 N 2.06 -0.60 0.00 1.61 3.57 -1.95 -3.13 116.94 118.50 1d5m h PHE 177 Ca -0.40 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.14 1d5m h PHE 177 Cb 1.25 0.32 0.00 0.00 2.79 0.00 0.00 35.95 40.31 1d5m h PHE 177 CO 0.71 -0.31 -0.18 -0.97 -2.23 0.00 0.00 178.31 175.34 1d5m h ASN 178 N -0.19 0.00 0.00 0.41 -1.24 -1.92 0.16 115.58 112.80 1d5m h ASN 178 Ca 0.17 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.18 1d5m h ASN 178 Cb 0.45 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.50 1d5m h ASN 178 CO -0.45 0.54 0.00 -3.20 -1.29 0.00 0.00 177.43 173.03 1d5m n ASN 179 N -4.47 0.52 -3.81 1.15 2.85 -1.25 -1.02 115.26 109.23 1d5m n ASN 179 Ca -0.03 0.00 -0.12 0.00 -0.11 0.00 0.00 54.58 54.32 1d5m n ASN 179 Cb 0.09 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 41.02 1d5m n ASN 179 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1d5m s SER 180 N 1.12 -0.11 0.30 1.20 0.15 -1.26 -1.43 113.70 113.66 1d5m s SER 180 Ca 0.00 0.02 0.25 0.00 0.70 0.00 0.00 55.95 56.92 1d5m s SER 180 Cb 0.00 0.29 1.00 0.00 -1.71 0.00 0.00 66.02 65.60 1d5m s SER 180 CO 0.00 -0.38 1.76 1.55 1.20 0.00 0.00 173.24 177.37 1d5m h PRO 181 N 4.24 0.00 -5.74 5.44 0.13 -1.79 -3.43 132.00 130.84 1d5m h PRO 181 Ca -0.30 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.17 1d5m h PRO 181 Cb 1.19 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.19 1d5m h PRO 181 CO 0.40 0.00 -0.57 0.71 -0.23 0.00 0.00 178.00 178.31 1d5m s TYR 182 N -3.34 3.32 -0.06 1.56 1.51 -1.26 -2.71 117.35 116.37 1d5m s TYR 182 Ca 0.05 0.28 -0.25 0.00 -1.01 0.00 0.00 57.07 56.13 1d5m s TYR 182 Cb 0.10 -1.89 -0.23 0.00 -0.11 0.00 0.00 41.96 39.82 1d5m s TYR 182 CO 0.45 0.50 1.02 1.49 -1.11 0.00 0.00 175.55 177.90 1d5m h GLU 183 N 5.37 0.13 -4.79 -0.62 4.57 -0.34 -3.41 114.58 115.48 1d5m h GLU 183 Ca -0.50 -0.13 -0.27 0.00 -1.18 0.00 0.00 59.36 57.28 1d5m h GLU 183 Cb 1.20 0.04 -0.15 0.00 -0.16 0.00 0.00 28.75 29.68 1d5m h GLU 183 CO 0.58 0.88 -0.68 0.95 -1.18 0.00 0.00 179.01 179.56 1d5m s THR 184 N -3.13 0.77 -0.29 0.32 -4.23 -1.21 -0.61 115.64 107.25 1d5m s THR 184 Ca -0.16 -1.98 -0.16 0.00 -1.18 0.00 0.00 61.69 58.21 1d5m s THR 184 Cb 0.00 -1.92 0.16 0.00 1.34 0.00 0.00 72.50 72.09 1d5m s THR 184 CO 0.73 -0.66 1.04 -0.83 -0.54 0.00 0.00 174.62 174.35 1d5m s GLY 185 N -3.13 0.14 0.03 3.99 0.00 -1.26 -1.94 107.32 105.16 1d5m s GLY 185 Ca 0.18 3.30 0.02 0.00 0.00 0.00 0.00 44.72 48.22 1d5m s GLY 185 CO 0.00 2.66 -0.06 -2.52 0.00 0.00 0.00 173.10 173.18 1d5m s TYR 186 N 1.31 0.55 -0.16 1.90 -0.85 -0.82 -0.33 117.35 118.95 1d5m s TYR 186 Ca -0.09 -0.44 -0.02 0.00 -0.52 0.00 0.00 57.07 56.00 1d5m s TYR 186 Cb -0.03 -0.34 -0.01 0.00 0.38 0.00 0.00 41.96 41.95 1d5m s TYR 186 CO -0.14 -0.09 -0.09 -1.50 -1.52 0.00 0.00 175.55 172.21 1d5m s ILE 187 N -1.21 3.29 -0.09 -3.49 2.07 -0.54 -1.29 121.20 119.93 1d5m s ILE 187 Ca -0.09 -0.56 0.01 0.00 -1.41 0.00 0.00 60.65 58.60 1d5m s ILE 187 Cb -0.09 -2.43 -0.02 0.00 0.13 0.00 0.00 42.46 40.05 1d5m s ILE 187 CO 0.00 0.49 -0.11 -0.75 -1.91 0.00 0.00 174.94 172.66 1d5m s LYS 188 N 0.74 3.00 -0.17 3.50 2.20 0.85 -1.54 119.74 128.31 1d5m s LYS 188 Ca -0.04 -0.64 -0.05 0.00 -0.36 0.00 0.00 55.97 54.88 1d5m s LYS 188 Cb -0.15 -2.58 -0.03 0.00 -1.51 0.00 0.00 37.83 33.56 1d5m s LYS 188 CO 0.02 0.45 0.01 -0.06 -0.36 0.00 0.00 175.35 175.41 1d5m s PHE 189 N -0.25 3.12 -0.14 4.03 0.40 -0.11 -1.16 117.98 123.87 1d5m s PHE 189 Ca 0.02 -0.16 0.01 0.00 -0.60 0.00 0.00 56.93 56.20 1d5m s PHE 189 Cb -0.13 -2.02 0.02 0.00 0.51 0.00 0.00 43.02 41.40 1d5m s PHE 189 CO 0.03 0.02 -0.14 0.42 0.70 0.00 0.00 175.22 176.24 1d5m s ILE 190 N 0.44 1.57 -0.10 0.64 1.01 -0.25 -2.14 121.20 122.36 1d5m s ILE 190 Ca -0.01 -0.64 -0.02 0.00 0.00 0.00 0.00 60.65 59.99 1d5m s ILE 190 Cb -0.13 -1.47 0.04 0.00 0.01 0.00 0.00 42.46 40.90 1d5m s ILE 190 CO 0.02 0.46 0.02 -0.70 0.00 0.00 0.00 174.94 174.73 1d5m s GLU 191 N 1.43 0.54 -1.31 2.79 2.12 0.74 -1.33 118.70 123.68 1d5m s GLU 191 Ca 0.04 0.01 -0.02 0.00 0.36 0.00 0.00 54.97 55.35 1d5m s GLU 191 Cb -0.13 -1.23 -0.00 0.00 0.26 0.00 0.00 34.13 33.03 1d5m s GLU 191 CO -0.10 -0.40 0.65 0.09 -0.54 0.00 0.00 175.26 174.97 1d5m n ASN 192 N 5.15 -1.45 0.00 -1.70 3.02 -1.26 -1.83 115.26 117.19 1d5m n ASN 192 Ca -0.07 -0.87 0.00 0.00 -0.03 0.00 0.00 54.58 53.61 1d5m n ASN 192 Cb 0.49 -3.82 0.00 0.00 -0.61 0.00 0.00 39.78 35.84 1d5m n ASN 192 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1d5m n GLU 193 N -4.26 0.00 -3.41 3.52 1.02 -1.26 -4.98 120.64 111.27 1d5m n GLU 193 Ca -0.28 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.50 1d5m n GLU 193 Cb 0.67 -1.01 -0.06 0.00 -0.02 0.00 0.00 31.44 31.03 1d5m n GLU 193 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1d5m s ASN 194 N -0.68 6.79 0.32 1.62 6.03 -0.76 -4.94 114.94 123.33 1d5m s ASN 194 Ca 0.00 1.01 -0.01 0.00 -1.03 0.00 0.00 52.86 52.83 1d5m s ASN 194 Cb 0.00 -2.26 -0.01 0.00 -3.03 0.00 0.00 41.25 35.95 1d5m s ASN 194 CO 0.00 0.14 0.40 -0.94 -2.03 0.00 0.00 177.10 174.67 1d5m s SER 195 N -1.65 0.93 -0.08 3.54 1.04 -1.26 -0.18 113.70 116.03 1d5m s SER 195 Ca 0.35 -1.49 -0.30 0.00 0.48 0.00 0.00 55.95 54.99 1d5m s SER 195 Cb -0.15 0.61 0.11 0.00 0.10 0.00 0.00 66.02 66.68 1d5m s SER 195 CO 0.18 -1.19 0.90 0.72 0.98 0.00 0.00 173.24 174.83 1d5m s PHE 196 N -3.32 -0.41 0.19 5.02 -0.12 -0.91 -2.19 117.98 116.24 1d5m s PHE 196 Ca 0.33 0.56 -0.00 0.00 -0.05 0.00 0.00 56.93 57.77 1d5m s PHE 196 Cb 0.01 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 42.83 1d5m s PHE 196 CO 0.20 -0.47 0.08 1.67 -0.05 0.00 0.00 175.22 176.66 1d5m s TRP 197 N -1.88 1.16 0.01 3.49 1.48 -1.26 -0.93 118.94 121.00 1d5m s TRP 197 Ca -0.01 -1.25 0.03 0.00 -1.06 0.00 0.00 56.10 53.82 1d5m s TRP 197 Cb -0.01 -0.62 -0.01 0.00 -1.16 0.00 0.00 33.47 31.67 1d5m s TRP 197 CO -0.01 -0.48 -0.11 0.71 -4.06 0.00 0.00 176.95 173.00 1d5m s TYR 198 N -3.98 0.95 -0.17 1.66 4.12 -0.59 -4.97 117.35 114.38 1d5m s TYR 198 Ca 0.32 -0.24 -0.27 0.00 0.02 0.00 0.00 57.07 56.90 1d5m s TYR 198 Cb 0.07 -0.59 -0.01 0.00 -1.52 0.00 0.00 41.96 39.91 1d5m s TYR 198 CO 0.08 -0.01 0.91 0.34 0.02 0.00 0.00 175.55 176.90 1d5m s ASP 199 N -0.59 7.05 0.00 2.29 -1.08 -1.26 -1.46 116.67 121.61 1d5m s ASP 199 Ca 0.02 1.30 0.27 0.00 -0.52 0.00 0.00 52.55 53.62 1d5m s ASP 199 Cb -0.05 -2.49 0.94 0.00 -1.46 0.00 0.00 42.92 39.85 1d5m s ASP 199 CO 0.00 -0.47 1.68 0.23 0.52 0.00 0.00 175.17 177.13 1d5m n MET 200 N 5.41 0.90 -3.88 4.34 2.81 0.56 -4.92 117.12 122.34 1d5m n MET 200 Ca 0.07 -0.48 -0.33 0.00 -1.81 0.00 0.00 57.70 55.16 1d5m n MET 200 Cb 0.48 -1.49 -0.05 0.00 -0.71 0.00 0.00 33.22 31.46 1d5m n MET 200 CO 0.00 0.00 0.00 1.41 1.51 0.00 0.00 175.97 178.89 1d5m s MET 201 N -2.42 3.46 0.67 0.03 0.00 -1.25 -4.98 119.30 114.81 1d5m s MET 201 Ca 0.28 -0.32 -0.15 0.00 0.00 0.00 0.00 55.69 55.50 1d5m s MET 201 Cb 0.20 -3.06 0.01 0.00 0.00 0.00 0.00 34.83 31.97 1d5m s MET 201 CO 0.48 0.64 1.12 -1.25 0.00 0.00 0.00 175.02 176.01 1d5m s PRO 202 N -2.14 2.71 0.84 4.11 0.04 -1.26 -4.78 135.00 134.52 1d5m s PRO 202 Ca 0.31 1.41 -0.11 0.00 0.04 0.00 0.00 61.00 62.65 1d5m s PRO 202 Cb -0.13 -1.94 0.10 0.00 0.04 0.00 0.00 34.50 32.57 1d5m s PRO 202 CO 0.22 -1.32 1.09 0.00 0.04 0.00 0.00 177.00 177.03 1d5m s ALA 203 N -2.33 1.86 0.61 8.56 0.00 -1.26 -4.59 121.76 124.60 1d5m s ALA 203 Ca 0.67 0.08 -0.19 0.00 0.00 0.00 0.00 51.96 52.53 1d5m s ALA 203 Cb -0.21 -3.23 -0.03 0.00 0.00 0.00 0.00 23.12 19.65 1d5m s ALA 203 CO 0.42 -2.10 1.23 -2.14 0.00 0.00 0.00 175.76 173.18 1d5m s PRO 204 N -4.92 2.86 0.00 0.00 0.02 -1.26 -4.64 135.00 127.05 1d5m s PRO 204 Ca 0.62 1.90 0.00 0.00 0.02 0.00 0.00 61.00 63.54 1d5m s PRO 204 Cb -0.18 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.44 1d5m s PRO 204 CO 0.57 -1.32 0.00 0.41 -0.33 0.00 0.00 177.00 176.33 1d5m n GLY 205 N 0.62 0.74 0.74 0.52 0.00 -0.75 -4.84 105.19 102.23 1d5m n GLY 205 Ca 0.14 -2.09 0.08 0.00 0.00 0.00 0.00 46.02 44.15 1d5m n GLY 205 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1d5m n ASP 206 N 1.69 2.64 -4.08 1.61 5.68 -1.26 0.52 116.55 123.35 1d5m n ASP 206 Ca 0.00 -1.77 -0.18 0.00 -0.50 0.00 0.00 54.79 52.34 1d5m n ASP 206 Cb 0.00 -0.08 -0.13 0.00 -1.14 0.00 0.00 41.12 39.77 1d5m n ASP 206 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1d5m s LYS 207 N -1.32 0.74 -0.18 0.11 2.20 -1.26 -3.69 119.74 116.34 1d5m s LYS 207 Ca 0.23 -0.59 -0.01 0.00 -0.36 0.00 0.00 55.97 55.24 1d5m s LYS 207 Cb 0.15 -0.68 -0.00 0.00 -1.51 0.00 0.00 37.83 35.79 1d5m s LYS 207 CO 0.22 0.17 -0.12 0.12 -0.36 0.00 0.00 175.35 175.37 1d5m s PHE 208 N -0.73 2.84 -0.73 4.03 5.36 -1.26 -4.91 117.98 122.57 1d5m s PHE 208 Ca -0.00 -1.08 -0.18 0.00 -0.96 0.00 0.00 56.93 54.71 1d5m s PHE 208 Cb -0.07 -1.96 0.14 0.00 -0.34 0.00 0.00 43.02 40.79 1d5m s PHE 208 CO 0.01 -0.53 0.82 0.34 -1.46 0.00 0.00 175.22 174.40 1d5m s ASP 209 N 1.06 6.44 0.13 6.13 -1.08 -1.26 -4.92 116.67 123.17 1d5m s ASP 209 Ca -0.00 -1.91 -0.20 0.00 -0.52 0.00 0.00 52.55 49.92 1d5m s ASP 209 Cb -0.15 -2.30 -0.03 0.00 -1.46 0.00 0.00 42.92 38.98 1d5m s ASP 209 CO -0.03 -0.96 1.73 1.56 0.52 0.00 0.00 175.17 177.98 1d5m h GLN 210 N 8.74 0.09 -0.22 4.34 4.20 -1.94 -0.97 115.11 129.36 1d5m h GLN 210 Ca -0.08 -0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.66 1d5m h GLN 210 Cb 1.06 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.78 1d5m h GLN 210 CO 1.01 0.06 -0.04 1.03 -0.67 0.00 0.00 178.83 180.22 1d5m h SER 211 N 0.09 -0.16 0.71 1.46 0.87 -1.91 -1.19 113.55 113.41 1d5m h SER 211 Ca 0.09 0.06 -0.07 0.00 -1.23 0.00 0.00 61.79 60.64 1d5m h SER 211 Cb 0.11 0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.18 1d5m h SER 211 CO -0.15 -0.05 -0.33 0.11 -0.53 0.00 0.00 176.83 175.88 1d5m h LYS 212 N 0.02 0.00 -0.11 2.24 1.57 -1.95 -2.19 116.57 116.15 1d5m h LYS 212 Ca 0.10 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 1d5m h LYS 212 Cb 0.15 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 1d5m h LYS 212 CO -0.21 0.33 -0.14 -0.92 -0.57 0.00 0.00 179.45 177.95 1d5m h TYR 213 N 0.00 0.36 0.00 -1.35 3.20 -0.70 -3.13 116.97 115.35 1d5m h TYR 213 Ca -0.00 -0.11 -0.01 0.00 3.14 0.00 0.00 58.73 61.74 1d5m h TYR 213 Cb 0.78 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.97 1d5m h TYR 213 CO 0.00 0.73 -0.04 -0.07 -1.64 0.00 0.00 178.16 177.13 1d5m h LEU 214 N -0.12 0.00 -2.08 2.82 3.38 -1.10 -3.06 115.31 115.15 1d5m h LEU 214 Ca 0.01 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.03 1d5m h LEU 214 Cb 0.68 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1d5m h LEU 214 CO 0.03 0.04 0.33 -0.03 0.09 0.00 0.00 178.44 178.91 1d5m h MET 215 N 0.00 0.00 0.00 1.13 4.05 -1.34 -0.04 114.93 118.73 1d5m h MET 215 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1d5m h MET 215 Cb 0.37 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.17 1d5m h MET 215 CO 0.01 0.00 0.00 0.00 0.23 0.00 0.00 176.91 177.15 1d5m h MET 216 N 0.00 0.00 -0.01 0.39 -0.00 -1.73 -0.26 114.93 113.33 1d5m h MET 216 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.78 1d5m h MET 216 Cb 0.74 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.34 1d5m h MET 216 CO -0.00 0.00 -0.19 0.66 -0.00 0.00 0.00 176.91 177.38 1d5m n TYR 217 N -2.48 0.00 0.22 -0.10 0.53 -0.03 -4.33 117.16 110.96 1d5m n TYR 217 Ca -0.01 0.00 0.04 0.00 -1.02 0.00 0.00 57.90 56.91 1d5m n TYR 217 Cb 0.09 -0.10 0.20 0.00 -1.03 0.00 0.00 39.34 38.50 1d5m n TYR 217 CO 0.00 0.00 0.00 0.27 -1.02 0.00 0.00 176.86 176.11 1d5m n ASN 218 N -0.48 0.11 -0.06 7.72 6.94 -0.11 -1.48 115.26 127.90 1d5m n ASN 218 Ca 0.14 0.54 0.14 0.00 -0.02 0.00 0.00 54.58 55.38 1d5m n ASN 218 Cb 0.34 -0.56 0.60 0.00 -2.36 0.00 0.00 39.78 37.81 1d5m n ASN 218 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1d5m n ASP 219 N -1.63 0.31 -2.92 0.53 5.75 -1.26 -0.62 116.55 116.71 1d5m n ASP 219 Ca 0.01 -0.30 -0.21 0.00 -0.01 0.00 0.00 54.79 54.29 1d5m n ASP 219 Cb 0.08 -0.14 0.01 0.00 -1.03 0.00 0.00 41.12 40.03 1d5m n ASP 219 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1d5m n ASN 220 N -1.15 -5.07 -4.69 -1.12 5.15 -0.55 -4.87 115.26 102.96 1d5m n ASN 220 Ca 0.12 -0.19 -0.44 0.00 -0.60 0.00 0.00 54.58 53.47 1d5m n ASN 220 Cb 0.29 -4.17 -0.03 0.00 -0.53 0.00 0.00 39.78 35.34 1d5m n ASN 220 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1d5m n LYS 221 N -3.59 2.24 -4.47 1.20 4.81 -1.26 -4.89 118.16 112.21 1d5m n LYS 221 Ca -0.11 0.80 -0.24 0.00 -0.87 0.00 0.00 58.31 57.89 1d5m n LYS 221 Cb 0.61 -2.53 -0.10 0.00 0.02 0.00 0.00 35.03 33.03 1d5m n LYS 221 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 1d5m s MET 222 N 0.02 1.68 0.05 1.64 -1.94 -1.26 -0.69 119.30 118.80 1d5m s MET 222 Ca 0.71 -1.77 -0.03 0.00 -1.71 0.00 0.00 55.69 52.89 1d5m s MET 222 Cb -0.62 -1.76 -0.03 0.00 2.01 0.00 0.00 34.83 34.43 1d5m s MET 222 CO 0.45 0.33 0.03 0.14 -0.01 0.00 0.00 175.02 175.95 1d5m s VAL 223 N -2.52 0.19 -0.32 -6.03 -7.23 -0.08 -4.85 120.40 99.56 1d5m s VAL 223 Ca 0.30 -1.54 -0.22 0.00 -1.81 0.00 0.00 61.98 58.71 1d5m s VAL 223 Cb -0.05 -1.32 -0.00 0.00 0.56 0.00 0.00 36.38 35.57 1d5m s VAL 223 CO 0.15 -0.85 0.71 -1.81 -0.31 0.00 0.00 175.10 172.99 1d5m s ASP 224 N -2.70 6.57 0.61 4.85 1.01 -1.26 -1.04 116.67 124.70 1d5m s ASP 224 Ca 0.03 0.49 0.30 0.00 0.71 0.00 0.00 52.55 54.09 1d5m s ASP 224 Cb 0.05 -2.37 1.69 0.00 1.01 0.00 0.00 42.92 43.30 1d5m s ASP 224 CO -0.09 -0.57 2.06 0.77 0.21 0.00 0.00 175.17 177.54 1d5m h SER 225 N 8.21 0.00 1.26 0.27 4.64 -1.39 -1.12 113.55 125.42 1d5m h SER 225 Ca -0.25 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.95 1d5m h SER 225 Cb 1.11 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.18 1d5m h SER 225 CO 0.85 0.00 -0.55 0.50 -0.87 0.00 0.00 176.83 176.76 1d5m h LYS 226 N 0.00 0.00 -0.00 4.77 3.64 -1.89 -3.36 116.57 119.72 1d5m h LYS 226 Ca 0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1d5m h LYS 226 Cb 0.60 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1d5m h LYS 226 CO -0.00 0.55 -0.33 -0.25 -2.27 0.00 0.00 179.45 177.15 1d5m n ASP 227 N -3.32 0.59 -4.81 4.20 8.00 -0.49 -5.03 116.55 115.69 1d5m n ASP 227 Ca 0.01 -0.80 -0.35 0.00 0.71 0.00 0.00 54.79 54.36 1d5m n ASP 227 Cb 0.71 0.85 -0.06 0.00 -0.02 0.00 0.00 41.12 42.60 1d5m n ASP 227 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1d5m s VAL 228 N -1.63 4.40 -0.01 2.53 -7.23 -0.79 -4.46 120.40 113.22 1d5m s VAL 228 Ca 0.04 1.49 0.04 0.00 -1.81 0.00 0.00 61.98 61.75 1d5m s VAL 228 Cb 0.06 -3.80 -0.01 0.00 0.56 0.00 0.00 36.38 33.19 1d5m s VAL 228 CO 0.30 -0.03 -0.13 -0.54 -0.31 0.00 0.00 175.10 174.39 1d5m s LYS 229 N -2.50 1.07 -0.00 4.82 1.02 -0.44 -4.70 119.74 119.01 1d5m s LYS 229 Ca 0.53 -0.50 0.05 0.00 0.02 0.00 0.00 55.97 56.06 1d5m s LYS 229 Cb -0.14 -1.04 -0.03 0.00 -0.52 0.00 0.00 37.83 36.09 1d5m s LYS 229 CO 0.19 0.28 -0.14 0.42 -0.92 0.00 0.00 175.35 175.19 1d5m s ILE 230 N -0.36 3.08 -0.05 2.17 1.01 -0.83 -1.10 121.20 125.12 1d5m s ILE 230 Ca 0.05 -0.91 -0.01 0.00 0.00 0.00 0.00 60.65 59.79 1d5m s ILE 230 Cb -0.05 -2.27 0.03 0.00 0.01 0.00 0.00 42.46 40.17 1d5m s ILE 230 CO -0.00 0.46 -0.00 -1.61 0.00 0.00 0.00 174.94 173.78 1d5m s GLU 231 N -1.14 0.53 -0.19 2.79 2.02 -0.31 -1.04 118.70 121.37 1d5m s GLU 231 Ca 0.14 0.08 -0.04 0.00 0.02 0.00 0.00 54.97 55.17 1d5m s GLU 231 Cb -0.11 -0.80 -0.02 0.00 0.10 0.00 0.00 34.13 33.31 1d5m s GLU 231 CO 0.04 -0.22 -0.03 0.08 0.02 0.00 0.00 175.26 175.14 1d5m s VAL 232 N 1.56 3.68 -0.25 2.63 1.01 -0.39 -0.11 120.40 128.53 1d5m s VAL 232 Ca -0.02 -0.41 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 1d5m s VAL 232 Cb -0.13 -2.64 0.01 0.00 0.00 0.00 0.00 36.38 33.62 1d5m s VAL 232 CO -0.03 0.45 -0.03 -0.31 0.00 0.00 0.00 175.10 175.18 1d5m s TYR 233 N 0.93 3.04 0.09 5.22 1.51 -0.42 0.71 117.35 128.44 1d5m s TYR 233 Ca 0.00 -1.18 0.09 0.00 -1.01 0.00 0.00 57.07 54.97 1d5m s TYR 233 Cb -0.15 -2.12 -0.03 0.00 -0.11 0.00 0.00 41.96 39.55 1d5m s TYR 233 CO 0.01 -0.62 -0.25 -0.51 -1.11 0.00 0.00 175.55 173.07 1d5m s LEU 234 N 1.42 2.25 -0.05 -1.29 1.43 0.73 -1.95 118.68 121.22 1d5m s LEU 234 Ca 0.03 -0.66 0.05 0.00 -1.03 0.00 0.00 54.13 52.52 1d5m s LEU 234 Cb -0.16 -1.13 -0.01 0.00 0.03 0.00 0.00 46.19 44.92 1d5m s LEU 234 CO -0.03 0.17 -0.21 0.42 0.23 0.00 0.00 176.35 176.93 1d5m s THR 235 N -0.97 1.77 0.03 5.49 -4.23 -0.82 0.38 115.64 117.29 1d5m s THR 235 Ca 0.11 -0.91 -0.03 0.00 -1.18 0.00 0.00 61.69 59.68 1d5m s THR 235 Cb -0.10 -1.51 -0.04 0.00 1.34 0.00 0.00 72.50 72.19 1d5m s THR 235 CO 0.04 0.50 0.23 0.42 -0.54 0.00 0.00 174.62 175.27 1d5m s THR 236 N -0.07 5.36 -2.00 3.99 -4.23 -1.26 0.40 115.64 117.83 1d5m s THR 236 Ca -0.04 -0.10 0.18 0.00 -1.18 0.00 0.00 61.69 60.55 1d5m s THR 236 Cb -0.13 -3.58 0.51 0.00 1.34 0.00 0.00 72.50 70.65 1d5m s THR 236 CO 0.03 0.26 1.47 0.29 -0.54 0.00 0.00 174.62 176.14