#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2emn h LEU 7 N 0.00 0.34 -2.93 0.00 5.85 -2.00 -3.32 115.31 113.25 2emn h LEU 7 Ca 0.00 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.37 2emn h LEU 7 Cb 0.00 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.92 2emn h LEU 7 CO 0.00 1.26 0.00 0.49 -0.34 0.00 0.00 178.44 179.85 2emn n PHE 8 N -3.52 0.38 0.27 1.25 3.01 -1.26 -4.65 117.46 112.94 2emn n PHE 8 Ca -0.06 -0.53 0.14 0.00 1.01 0.00 0.00 57.45 58.00 2emn n PHE 8 Cb 0.98 -0.05 0.77 0.00 -0.01 0.00 0.00 39.48 41.17 2emn n PHE 8 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 2emn h THR 9 N 1.55 0.52 -3.80 4.37 1.35 -2.01 -3.38 112.91 111.51 2emn h THR 9 Ca 0.00 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 2emn h THR 9 Cb 0.73 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.43 2emn h THR 9 CO 0.01 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 175.98 2emn n GLY 10 N -0.77 3.67 3.69 5.82 0.00 -1.26 -4.83 105.19 111.51 2emn n GLY 10 Ca -0.02 -2.15 -0.42 0.00 0.00 0.00 0.00 46.02 43.43 2emn n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2emn s VAL 11 N 0.16 4.66 -0.09 1.61 1.01 -1.26 -4.48 120.40 122.01 2emn s VAL 11 Ca 0.00 1.94 -0.00 0.00 0.00 0.00 0.00 61.98 63.92 2emn s VAL 11 Cb 0.00 -4.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.11 2emn s VAL 11 CO 0.00 0.02 -0.06 -0.69 0.00 0.00 0.00 175.10 174.37 2emn s VAL 12 N 1.91 3.74 0.35 2.92 1.01 -0.55 -4.95 120.40 124.83 2emn s VAL 12 Ca 0.51 -0.45 -0.25 0.00 0.00 0.00 0.00 61.98 61.78 2emn s VAL 12 Cb -0.20 -2.55 -0.10 0.00 0.00 0.00 0.00 36.38 33.53 2emn s VAL 12 CO 0.20 0.58 0.97 -2.16 0.00 0.00 0.00 175.10 174.69 2emn s PRO 13 N -0.55 4.48 -0.02 2.72 0.04 -1.26 -1.13 135.00 139.27 2emn s PRO 13 Ca 0.08 1.34 0.06 0.00 0.04 0.00 0.00 61.00 62.52 2emn s PRO 13 Cb -0.12 -2.69 -0.01 0.00 0.04 0.00 0.00 34.50 31.72 2emn s PRO 13 CO 0.02 0.17 -0.19 0.42 0.04 0.00 0.00 177.00 177.47 2emn s ILE 14 N -1.68 1.49 -0.09 0.56 1.01 0.42 -0.95 121.20 121.95 2emn s ILE 14 Ca 0.53 -0.80 0.01 0.00 0.00 0.00 0.00 60.65 60.39 2emn s ILE 14 Cb -0.18 -1.25 0.02 0.00 0.01 0.00 0.00 42.46 41.06 2emn s ILE 14 CO 0.23 0.42 -0.10 -0.22 0.00 0.00 0.00 174.94 175.27 2emn s LEU 15 N -0.38 1.45 -0.09 2.97 1.98 -0.89 -1.73 118.68 122.00 2emn s LEU 15 Ca 0.06 -0.31 0.04 0.00 -2.89 0.00 0.00 54.13 51.03 2emn s LEU 15 Cb -0.08 -0.86 -0.01 0.00 0.66 0.00 0.00 46.19 45.90 2emn s LEU 15 CO -0.00 -0.04 -0.23 -0.69 -1.89 0.00 0.00 176.35 173.50 2emn s VAL 16 N 1.17 2.17 -0.08 1.68 1.01 -0.61 -1.75 120.40 124.00 2emn s VAL 16 Ca -0.05 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 60.93 2emn s VAL 16 Cb -0.14 -1.82 0.03 0.00 0.00 0.00 0.00 36.38 34.45 2emn s VAL 16 CO -0.03 0.56 -0.03 -0.70 0.00 0.00 0.00 175.10 174.91 2emn s GLU 17 N 0.13 0.96 -0.03 2.72 2.12 -0.96 0.97 118.70 124.62 2emn s GLU 17 Ca -0.12 -0.04 0.04 0.00 0.36 0.00 0.00 54.97 55.21 2emn s GLU 17 Cb -0.16 -1.19 -0.01 0.00 0.26 0.00 0.00 34.13 33.03 2emn s GLU 17 CO 0.07 -0.27 -0.15 -1.17 -0.54 0.00 0.00 175.26 173.19 2emn s LEU 18 N 1.80 1.95 -0.09 2.70 0.20 -0.01 -0.63 118.68 124.59 2emn s LEU 18 Ca 0.04 -0.29 0.03 0.00 0.69 0.00 0.00 54.13 54.60 2emn s LEU 18 Cb -0.13 -0.82 0.00 0.00 -0.43 0.00 0.00 46.19 44.82 2emn s LEU 18 CO -0.06 0.16 -0.20 -1.81 -0.29 0.00 0.00 176.35 174.14 2emn s ASP 19 N -0.13 2.73 0.33 3.68 1.01 -1.02 -1.10 116.67 122.17 2emn s ASP 19 Ca 0.01 -0.49 0.04 0.00 0.71 0.00 0.00 52.55 52.82 2emn s ASP 19 Cb -0.08 -1.25 -0.03 0.00 1.01 0.00 0.00 42.92 42.56 2emn s ASP 19 CO 0.01 0.11 0.17 -0.83 0.21 0.00 0.00 175.17 174.84 2emn s GLY 20 N 0.49 2.21 -0.23 0.21 0.00 0.08 -2.27 107.32 107.81 2emn s GLY 20 Ca -0.16 -1.70 -0.07 0.00 0.00 0.00 0.00 44.72 42.79 2emn s GLY 20 CO 0.06 -1.62 0.47 -0.35 0.00 0.00 0.00 173.10 171.66 2emn s ASP 21 N -3.42 -0.46 -0.14 1.64 -1.08 -0.39 -2.67 116.67 110.15 2emn s ASP 21 Ca 0.34 1.06 -0.01 0.00 -0.52 0.00 0.00 52.55 53.42 2emn s ASP 21 Cb 0.04 1.58 0.04 0.00 -1.46 0.00 0.00 42.92 43.12 2emn s ASP 21 CO 0.18 -0.24 -0.04 -0.69 0.52 0.00 0.00 175.17 174.90 2emn s VAL 22 N 2.68 0.93 -1.64 1.11 1.01 -0.42 0.24 120.40 124.31 2emn s VAL 22 Ca -0.01 -0.41 -0.17 0.00 0.00 0.00 0.00 61.98 61.39 2emn s VAL 22 Cb -0.12 -1.08 0.15 0.00 0.00 0.00 0.00 36.38 35.32 2emn s VAL 22 CO -0.15 0.19 0.79 0.59 0.00 0.00 0.00 175.10 176.53 2emn n ASN 23 N 4.95 -3.56 0.00 3.32 4.13 -0.99 -0.01 115.26 123.09 2emn n ASN 23 Ca -0.11 -0.92 0.00 0.00 1.68 0.00 0.00 54.58 55.23 2emn n ASN 23 Cb 0.49 -2.90 0.00 0.00 -1.54 0.00 0.00 39.78 35.82 2emn n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2emn n GLY 24 N -1.40 2.82 3.60 7.41 0.00 -1.26 -4.98 105.19 111.38 2emn n GLY 24 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 2emn n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2emn s HIS 25 N -1.73 1.64 0.16 1.61 3.76 0.98 -4.95 115.29 116.76 2emn s HIS 25 Ca 0.00 0.64 -0.12 0.00 -0.15 0.00 0.00 55.06 55.43 2emn s HIS 25 Cb 0.00 -4.07 -0.07 0.00 1.11 0.00 0.00 32.58 29.56 2emn s HIS 25 CO 0.00 -3.16 0.52 0.15 -0.85 0.00 0.00 174.74 171.40 2emn s LYS 26 N 5.94 3.87 0.15 1.40 1.02 -1.26 -1.30 119.74 129.57 2emn s LYS 26 Ca 0.84 0.35 -0.25 0.00 0.02 0.00 0.00 55.97 56.93 2emn s LYS 26 Cb -0.24 -2.85 0.06 0.00 -0.52 0.00 0.00 37.83 34.28 2emn s LYS 26 CO 0.33 0.44 0.95 -0.59 -0.92 0.00 0.00 175.35 175.56 2emn s PHE 27 N -1.57 -0.14 0.03 3.18 -0.71 -1.09 -4.99 117.98 112.69 2emn s PHE 27 Ca 0.40 -0.17 -0.00 0.00 -1.04 0.00 0.00 56.93 56.12 2emn s PHE 27 Cb -0.13 0.64 -0.02 0.00 -1.21 0.00 0.00 43.02 42.29 2emn s PHE 27 CO 0.20 -0.83 -0.03 -1.12 -1.34 0.00 0.00 175.22 172.09 2emn s SER 28 N -2.93 0.32 -0.02 1.98 0.01 -1.26 -0.74 113.70 111.06 2emn s SER 28 Ca 0.12 -0.62 -0.00 0.00 1.31 0.00 0.00 55.95 56.76 2emn s SER 28 Cb -0.02 0.12 0.03 0.00 0.21 0.00 0.00 66.02 66.37 2emn s SER 28 CO 0.02 -0.37 0.04 -0.69 0.41 0.00 0.00 173.24 172.65 2emn s VAL 29 N -2.03 -0.06 -0.06 3.43 1.01 -0.26 -2.22 120.40 120.21 2emn s VAL 29 Ca -0.10 0.26 0.04 0.00 0.00 0.00 0.00 61.98 62.18 2emn s VAL 29 Cb -0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 36.38 36.20 2emn s VAL 29 CO -0.03 0.11 -0.17 -0.55 0.00 0.00 0.00 175.10 174.46 2emn s SER 30 N 1.33 3.74 0.07 3.32 0.15 -0.76 -0.83 113.70 120.72 2emn s SER 30 Ca -0.06 -0.30 0.04 0.00 0.70 0.00 0.00 55.95 56.33 2emn s SER 30 Cb -0.13 -0.89 -0.03 0.00 -1.71 0.00 0.00 66.02 63.27 2emn s SER 30 CO -0.03 0.30 -0.12 -0.83 1.20 0.00 0.00 173.24 173.76 2emn s GLY 31 N -0.47 0.76 0.02 9.45 0.00 0.27 -0.86 107.32 116.49 2emn s GLY 31 Ca 0.06 -0.96 -0.00 0.00 0.00 0.00 0.00 44.72 43.81 2emn s GLY 31 CO 0.02 -1.00 -0.02 -1.83 0.00 0.00 0.00 173.10 170.27 2emn s GLU 32 N -1.86 0.27 0.00 2.90 4.04 0.14 -1.57 118.70 122.63 2emn s GLU 32 Ca -0.03 -0.49 0.00 0.00 0.04 0.00 0.00 54.97 54.49 2emn s GLU 32 Cb -0.09 0.10 0.00 0.00 0.02 0.00 0.00 34.13 34.16 2emn s GLU 32 CO 0.01 -0.04 0.00 0.41 -1.84 0.00 0.00 175.26 173.80 2emn n GLY 33 N 1.85 -0.60 3.41 -3.83 0.00 -0.71 0.33 105.19 105.64 2emn n GLY 33 Ca -0.22 -0.65 -0.13 0.00 0.00 0.00 0.00 46.02 45.02 2emn n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2emn s GLU 34 N -0.79 1.16 0.06 1.61 -1.05 -0.11 -0.44 118.70 119.13 2emn s GLU 34 Ca 0.00 -0.33 0.03 0.00 -0.15 0.00 0.00 54.97 54.51 2emn s GLU 34 Cb 0.00 0.53 -0.03 0.00 -0.44 0.00 0.00 34.13 34.19 2emn s GLU 34 CO 0.00 -0.46 -0.09 0.20 0.95 0.00 0.00 175.26 175.86 2emn s GLY 35 N -2.33 0.62 -0.32 -3.83 0.00 -0.28 -1.85 107.32 99.32 2emn s GLY 35 Ca -0.02 -0.90 0.04 0.00 0.00 0.00 0.00 44.72 43.83 2emn s GLY 35 CO -0.07 -0.96 0.02 -0.35 0.00 0.00 0.00 173.10 171.75 2emn s ASP 36 N -1.83 4.66 0.11 1.64 -1.08 0.41 -1.48 116.67 119.10 2emn s ASP 36 Ca -0.05 -1.99 -0.21 0.00 -0.52 0.00 0.00 52.55 49.77 2emn s ASP 36 Cb -0.08 -1.57 -0.10 0.00 -1.46 0.00 0.00 42.92 39.71 2emn s ASP 36 CO 0.00 -0.35 1.75 0.00 0.52 0.00 0.00 175.17 177.09 2emn h ALA 37 N 7.67 0.11 -0.04 3.66 0.00 -1.74 0.57 119.26 129.49 2emn h ALA 37 Ca -0.07 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.86 2emn h ALA 37 Cb 1.02 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2emn h ALA 37 CO 0.51 -0.42 0.45 1.15 0.00 0.00 0.00 179.25 180.93 2emn h THR 38 N 0.09 0.02 0.00 0.00 2.02 -1.87 0.46 112.91 113.63 2emn h THR 38 Ca 0.04 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.22 2emn h THR 38 Cb 0.02 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 2emn h THR 38 CO -0.04 0.00 -0.14 -1.22 0.37 0.00 0.00 175.52 174.49 2emn n TYR 39 N -2.89 0.00 -1.28 3.16 4.01 -0.65 -4.90 117.16 114.61 2emn n TYR 39 Ca -0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.64 2emn n TYR 39 Cb 0.50 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.48 2emn n TYR 39 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2emn n GLY 40 N 1.13 1.10 3.84 2.72 0.00 0.19 -4.75 105.19 109.42 2emn n GLY 40 Ca 0.00 -0.48 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 2emn n GLY 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2emn s LYS 41 N -2.70 3.88 0.01 1.61 2.20 -0.53 -1.73 119.74 122.48 2emn s LYS 41 Ca 0.00 0.37 0.05 0.00 -0.36 0.00 0.00 55.97 56.03 2emn s LYS 41 Cb 0.00 -3.22 -0.02 0.00 -1.51 0.00 0.00 37.83 33.08 2emn s LYS 41 CO 0.00 0.70 -0.16 -0.51 -0.36 0.00 0.00 175.35 175.02 2emn s LEU 42 N -1.07 2.10 -0.20 5.43 1.43 0.61 -0.45 118.68 126.53 2emn s LEU 42 Ca 0.23 -0.38 -0.04 0.00 -1.03 0.00 0.00 54.13 52.91 2emn s LEU 42 Cb -0.16 -0.76 0.08 0.00 0.03 0.00 0.00 46.19 45.38 2emn s LEU 42 CO 0.13 0.13 0.17 -0.89 0.23 0.00 0.00 176.35 176.12 2emn s THR 43 N -0.60 -0.23 0.10 5.49 2.01 -0.77 -1.41 115.64 120.22 2emn s THR 43 Ca 0.05 -0.18 0.02 0.00 0.31 0.00 0.00 61.69 61.88 2emn s THR 43 Cb -0.07 -0.67 -0.04 0.00 0.01 0.00 0.00 72.50 71.73 2emn s THR 43 CO 0.00 -0.27 -0.07 -0.76 -0.69 0.00 0.00 174.62 172.83 2emn s LEU 44 N 2.25 2.49 -0.03 4.42 2.01 -0.49 -0.94 118.68 128.39 2emn s LEU 44 Ca 0.05 -0.97 0.01 0.00 0.01 0.00 0.00 54.13 53.24 2emn s LEU 44 Cb -0.16 -0.11 0.02 0.00 0.01 0.00 0.00 46.19 45.95 2emn s LEU 44 CO -0.13 -0.43 -0.04 -0.75 1.01 0.00 0.00 176.35 176.01 2emn s LYS 45 N -3.64 0.65 -0.06 1.70 2.20 0.15 -0.49 119.74 120.25 2emn s LYS 45 Ca 0.10 -0.09 0.04 0.00 -0.36 0.00 0.00 55.97 55.66 2emn s LYS 45 Cb 0.04 -0.68 0.00 0.00 -1.51 0.00 0.00 37.83 35.68 2emn s LYS 45 CO -0.04 -0.04 -0.18 -0.06 -0.36 0.00 0.00 175.35 174.67 2emn s PHE 46 N 0.69 1.84 -0.05 4.03 0.08 -0.31 0.27 117.98 124.54 2emn s PHE 46 Ca -0.09 -0.61 0.05 0.00 0.12 0.00 0.00 56.93 56.40 2emn s PHE 46 Cb -0.12 -1.26 -0.02 0.00 -0.57 0.00 0.00 43.02 41.05 2emn s PHE 46 CO -0.00 -0.24 -0.18 0.42 -0.10 0.00 0.00 175.22 175.12 2emn s ILE 47 N 0.23 2.73 -0.76 0.64 -1.09 -0.04 -1.24 121.20 121.67 2emn s ILE 47 Ca -0.09 -0.85 -0.20 0.00 -2.23 0.00 0.00 60.65 57.28 2emn s ILE 47 Cb -0.14 -2.04 0.11 0.00 -1.58 0.00 0.00 42.46 38.81 2emn s ILE 47 CO 0.04 0.58 0.97 0.00 -1.23 0.00 0.00 174.94 175.30 2emn n THR 49 N 5.59 0.85 -1.06 0.00 -2.24 -0.94 -2.50 114.28 113.98 2emn n THR 49 Ca 0.07 0.21 0.05 0.00 -2.27 0.00 0.00 64.05 62.12 2emn n THR 49 Cb 0.46 -1.10 0.26 0.00 -2.10 0.00 0.00 70.33 67.86 2emn n THR 49 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2emn n THR 50 N -1.28 2.41 0.00 4.28 -2.24 -1.25 -4.97 114.28 111.24 2emn n THR 50 Ca 0.03 -1.96 0.00 0.00 -2.27 0.00 0.00 64.05 59.86 2emn n THR 50 Cb 0.06 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 2emn n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2emn n GLY 51 N -0.51 0.61 3.63 3.38 0.00 -1.04 -4.93 105.19 106.33 2emn n GLY 51 Ca 0.25 -1.46 -0.39 0.00 0.00 0.00 0.00 46.02 44.42 2emn n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2emn s LYS 52 N 0.00 4.08 0.10 1.61 0.00 -1.26 -4.57 119.74 119.70 2emn s LYS 52 Ca 0.00 0.20 -0.33 0.00 0.00 0.00 0.00 55.97 55.83 2emn s LYS 52 Cb 0.00 -3.62 -0.13 0.00 0.00 0.00 0.00 37.83 34.08 2emn s LYS 52 CO 0.00 -0.25 1.70 -0.11 0.00 0.00 0.00 175.35 176.70 2emn n LEU 53 N 5.20 3.40 0.22 2.77 7.94 -1.26 -4.87 117.00 130.40 2emn n LEU 53 Ca -0.07 1.04 0.10 0.00 -1.11 0.00 0.00 56.01 55.97 2emn n LEU 53 Cb 0.50 -1.44 0.46 0.00 0.53 0.00 0.00 43.42 43.47 2emn n LEU 53 CO 0.39 -0.12 0.80 1.55 -1.11 0.00 0.00 177.39 178.90 2emn h PRO 54 N 7.22 0.00 -6.32 1.96 0.13 -1.95 -3.44 132.00 129.59 2emn h PRO 54 Ca -0.46 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.08 2emn h PRO 54 Cb 1.25 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.26 2emn h PRO 54 CO 0.92 0.23 -0.68 0.14 -0.23 0.00 0.00 178.00 178.38 2emn s VAL 55 N -3.67 3.34 0.43 1.56 -7.23 -1.26 -4.84 120.40 108.73 2emn s VAL 55 Ca 0.00 -1.76 -0.26 0.00 -1.81 0.00 0.00 61.98 58.16 2emn s VAL 55 Cb 0.10 -2.71 -0.09 0.00 0.56 0.00 0.00 36.38 34.24 2emn s VAL 55 CO 0.64 -0.23 1.42 -2.65 -0.31 0.00 0.00 175.10 173.97 2emn n PRO 56 N -0.38 2.30 -0.32 4.82 -0.02 -1.26 -4.91 135.00 135.22 2emn n PRO 56 Ca -0.09 0.82 0.02 0.00 -2.02 0.00 0.00 63.50 62.23 2emn n PRO 56 Cb 0.57 -2.60 0.20 0.00 -0.02 0.00 0.00 33.50 31.65 2emn n PRO 56 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 2emn h TRP 57 N 2.42 1.11 -0.25 6.00 4.06 -1.96 -2.52 115.95 124.81 2emn h TRP 57 Ca -0.50 0.03 0.07 0.00 2.06 0.00 0.00 58.89 60.55 2emn h TRP 57 Cb 1.27 -0.37 -0.01 0.00 -1.00 0.00 0.00 29.16 29.05 2emn h TRP 57 CO 0.50 0.62 0.21 -1.35 -3.56 0.00 0.00 178.44 174.86 2emn h PRO 58 N 1.13 0.00 0.00 0.49 0.11 -1.91 -1.90 132.00 129.93 2emn h PRO 58 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 2emn h PRO 58 Cb 0.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.19 2emn h PRO 58 CO -0.13 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.91 2emn n THR 59 N -4.17 0.49 0.60 -1.15 -2.24 -0.95 -2.48 114.28 104.39 2emn n THR 59 Ca 0.03 0.12 0.07 0.00 -2.27 0.00 0.00 64.05 62.00 2emn n THR 59 Cb 0.36 -0.79 0.05 0.00 -2.10 0.00 0.00 70.33 67.84 2emn n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2emn n LEU 60 N -1.36 2.02 0.08 3.22 4.77 -0.71 -4.68 117.00 120.34 2emn n LEU 60 Ca 0.08 -0.94 -0.12 0.00 -0.03 0.00 0.00 56.01 55.00 2emn n LEU 60 Cb 0.18 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.22 2emn n LEU 60 CO 0.16 0.37 0.76 0.58 -1.33 0.00 0.00 177.39 177.93 2emn h VAL 61 N 2.52 0.62 0.00 4.08 2.07 -1.56 0.11 116.25 124.08 2emn h VAL 61 Ca 0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 2emn h VAL 61 Cb 0.57 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2emn h VAL 61 CO 0.00 0.00 -0.18 0.71 0.02 0.00 0.00 177.57 178.12 2emn h THR 62 N -0.29 0.85 0.10 2.57 1.35 -1.83 -3.13 112.91 112.52 2emn h THR 62 Ca 0.04 -0.69 -0.00 0.00 -0.55 0.00 0.00 66.41 65.20 2emn h THR 62 Cb 0.33 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 68.16 2emn h THR 62 CO -0.12 0.18 -0.05 0.74 -0.25 0.00 0.00 175.52 176.02 2emn h THR 63 N 0.00 1.06 0.00 6.82 2.02 -1.46 -3.45 112.91 117.90 2emn h THR 63 Ca -0.00 -1.33 -0.43 0.00 0.77 0.00 0.00 66.41 65.42 2emn h THR 63 Cb 0.39 1.82 0.05 0.00 -1.74 0.00 0.00 68.15 68.67 2emn h THR 63 CO 0.02 0.29 1.91 0.18 0.37 0.00 0.00 175.52 178.29 2emn n LEU 64 N -4.85 2.79 0.00 2.58 7.99 0.24 -5.05 117.00 120.70 2emn n LEU 64 Ca -0.08 -2.19 0.00 0.00 -0.01 0.00 0.00 56.01 53.73 2emn n LEU 64 Cb 0.29 -0.85 0.00 0.00 -0.11 0.00 0.00 43.42 42.75 2emn n LEU 64 CO 0.27 -0.64 0.00 0.52 -1.51 0.00 0.00 177.39 176.03 2emn n VAL 68 N 5.52 0.00 0.43 4.08 0.31 -1.26 -5.00 118.33 122.41 2emn n VAL 68 Ca 0.37 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.73 2emn n VAL 68 Cb 0.25 0.00 0.20 0.00 -0.91 0.00 0.00 33.84 33.37 2emn n VAL 68 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2emn n GLN 69 N 0.00 0.21 0.00 5.55 6.02 -1.26 -2.41 117.38 125.49 2emn n GLN 69 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 57.00 57.13 2emn n GLN 69 Cb 0.00 -1.48 0.69 0.00 1.02 0.00 0.00 30.24 30.47 2emn n GLN 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2emn n PHE 71 N -1.29 0.86 -2.64 0.00 3.72 -1.01 -4.65 117.46 112.44 2emn n PHE 71 Ca 0.13 -0.37 -0.36 0.00 -0.05 0.00 0.00 57.45 56.80 2emn n PHE 71 Cb 0.22 -0.11 -0.05 0.00 -0.94 0.00 0.00 39.48 38.60 2emn n PHE 71 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2emn s SER 72 N -0.85 6.96 -0.38 4.37 0.01 -1.14 -3.76 113.70 118.91 2emn s SER 72 Ca 0.33 1.95 -0.24 0.00 1.31 0.00 0.00 55.95 59.30 2emn s SER 72 Cb 0.20 -2.58 0.01 0.00 0.21 0.00 0.00 66.02 63.86 2emn s SER 72 CO 0.18 -0.34 0.83 -0.60 0.41 0.00 0.00 173.24 173.71 2emn s ARG 73 N -2.40 3.72 -0.39 12.44 3.52 -0.85 -4.77 118.95 130.22 2emn s ARG 73 Ca 0.56 0.32 -0.14 0.00 -0.13 0.00 0.00 55.73 56.34 2emn s ARG 73 Cb -0.20 -3.83 0.02 0.00 -1.56 0.00 0.00 34.95 29.38 2emn s ARG 73 CO 0.25 -0.93 0.26 0.71 -0.81 0.00 0.00 175.30 174.79 2emn s TYR 74 N 3.25 3.24 0.64 5.12 1.51 -1.26 -0.76 117.35 129.08 2emn s TYR 74 Ca 0.33 -0.62 -0.17 0.00 -1.01 0.00 0.00 57.07 55.60 2emn s TYR 74 Cb -0.13 -2.53 -0.06 0.00 -0.11 0.00 0.00 41.96 39.14 2emn s TYR 74 CO 0.19 -0.56 0.59 -2.30 -1.11 0.00 0.00 175.55 172.36 2emn n PRO 75 N 5.11 0.48 -0.32 -1.71 -0.02 -1.26 -4.69 135.00 132.58 2emn n PRO 75 Ca -0.12 0.20 -0.03 0.00 -2.02 0.00 0.00 63.50 61.53 2emn n PRO 75 Cb 0.47 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 2emn n PRO 75 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2emn n ASP 76 N -0.04 -0.61 0.00 2.55 5.75 -1.26 -0.57 116.55 122.37 2emn n ASP 76 Ca 0.11 1.41 0.00 0.00 -0.01 0.00 0.00 54.79 56.31 2emn n ASP 76 Cb 0.49 -0.28 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 2emn n ASP 76 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2emn n HIS 77 N -5.14 0.00 -0.27 2.11 1.44 -1.26 -2.20 115.22 109.91 2emn n HIS 77 Ca 0.06 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.77 2emn n HIS 77 Cb 0.29 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.40 2emn n HIS 77 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 2emn n MET 78 N -0.50 1.88 0.17 -1.40 2.00 0.26 -4.76 117.12 114.77 2emn n MET 78 Ca 0.00 -1.14 0.12 0.00 0.00 0.00 0.00 57.70 56.68 2emn n MET 78 Cb 0.00 -0.87 0.61 0.00 0.00 0.00 0.00 33.22 32.97 2emn n MET 78 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 2emn h LYS 79 N 0.00 0.00 -0.03 0.03 1.57 -1.49 0.43 116.57 117.08 2emn h LYS 79 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2emn h LYS 79 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 2emn h LYS 79 CO 0.00 0.00 0.00 2.89 -0.57 0.00 0.00 179.45 181.77 2emn n ARG 80 N -2.32 1.66 -0.04 3.15 1.85 -1.26 -3.52 116.66 116.17 2emn n ARG 80 Ca -0.01 -0.97 0.05 0.00 -1.00 0.00 0.00 57.85 55.93 2emn n ARG 80 Cb 0.08 -1.47 0.07 0.00 -1.05 0.00 0.00 32.46 30.09 2emn n ARG 80 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2emn n HIS 81 N 0.17 0.11 -2.43 2.89 8.25 0.15 -4.65 115.22 119.72 2emn n HIS 81 Ca 0.19 -0.13 -0.43 0.00 -0.26 0.00 0.00 57.72 57.09 2emn n HIS 81 Cb 0.35 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.45 2emn n HIS 81 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2emn n ASP 82 N 0.55 4.78 -0.20 0.41 -0.08 -1.22 -4.51 116.55 116.27 2emn n ASP 82 Ca 0.07 -2.95 -0.00 0.00 -1.51 0.00 0.00 54.79 50.40 2emn n ASP 82 Cb 0.30 -1.64 0.11 0.00 2.34 0.00 0.00 41.12 42.22 2emn n ASP 82 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 2emn h PHE 83 N 6.79 0.43 -0.23 -0.67 3.04 -1.89 -2.44 116.94 121.95 2emn h PHE 83 Ca 0.44 0.03 0.03 0.00 3.98 0.00 0.00 57.97 62.45 2emn h PHE 83 Cb 0.78 -0.10 -0.06 0.00 2.56 0.00 0.00 35.95 39.12 2emn h PHE 83 CO 1.33 0.13 -0.47 0.74 -2.02 0.00 0.00 178.31 178.01 2emn h PHE 84 N 0.44 -1.43 0.00 0.41 0.04 -1.90 -1.38 116.94 113.12 2emn h PHE 84 Ca 0.30 0.06 -0.05 0.00 2.80 0.00 0.00 57.97 61.08 2emn h PHE 84 Cb 0.35 0.65 -0.01 0.00 2.20 0.00 0.00 35.95 39.15 2emn h PHE 84 CO -0.15 -0.45 -0.25 0.87 -0.60 0.00 0.00 178.31 177.73 2emn h LYS 85 N -0.42 0.00 0.00 1.51 1.57 -1.79 -2.69 116.57 114.75 2emn h LYS 85 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2emn h LYS 85 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 2emn h LYS 85 CO -0.44 0.25 0.00 -1.13 -0.57 0.00 0.00 179.45 177.56 2emn n SER 86 N -4.10 0.50 -0.19 0.86 3.41 -0.58 -2.22 113.62 111.29 2emn n SER 86 Ca -0.02 0.60 0.13 0.00 -0.26 0.00 0.00 58.87 59.32 2emn n SER 86 Cb 0.32 -0.71 0.43 0.00 -0.26 0.00 0.00 64.21 63.98 2emn n SER 86 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2emn n ALA 87 N -1.69 3.02 -2.04 7.33 0.00 -0.82 -4.73 120.51 121.58 2emn n ALA 87 Ca 0.03 -0.36 -0.31 0.00 0.00 0.00 0.00 53.44 52.81 2emn n ALA 87 Cb 0.26 -1.19 -0.02 0.00 0.00 0.00 0.00 19.45 18.50 2emn n ALA 87 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2emn s MET 88 N -2.54 3.79 0.00 0.00 1.00 -0.94 -0.34 119.30 120.26 2emn s MET 88 Ca 0.24 0.64 0.28 0.00 0.00 0.00 0.00 55.69 56.84 2emn s MET 88 Cb 0.19 -2.27 1.01 0.00 0.00 0.00 0.00 34.83 33.77 2emn s MET 88 CO 0.52 -0.20 1.72 -0.35 0.00 0.00 0.00 175.02 176.72 2emn n PRO 89 N -1.67 1.24 -0.23 2.03 -0.04 -1.26 -4.85 135.00 130.22 2emn n PRO 89 Ca 0.04 -0.67 -0.02 0.00 -0.04 0.00 0.00 63.50 62.81 2emn n PRO 89 Cb 0.54 -1.49 0.10 0.00 -0.04 0.00 0.00 33.50 32.61 2emn n PRO 89 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2emn h GLU 90 N 1.64 0.69 0.00 0.54 5.08 -1.89 -2.93 114.58 117.72 2emn h GLU 90 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2emn h GLU 90 Cb 0.46 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2emn h GLU 90 CO 0.00 0.46 0.00 0.41 -1.00 0.00 0.00 179.01 178.88 2emn n GLY 91 N -1.29 -0.35 3.31 -3.84 0.00 0.54 -4.69 105.19 98.88 2emn n GLY 91 Ca 0.08 -2.24 -0.13 0.00 0.00 0.00 0.00 46.02 43.73 2emn n GLY 91 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2emn s TYR 92 N -0.12 -0.26 -0.18 1.61 -0.85 -1.01 -1.59 117.35 114.95 2emn s TYR 92 Ca 0.00 0.26 -0.10 0.00 -0.52 0.00 0.00 57.07 56.71 2emn s TYR 92 Cb 0.00 0.20 -0.05 0.00 0.38 0.00 0.00 41.96 42.49 2emn s TYR 92 CO 0.00 -0.54 0.16 0.08 -1.52 0.00 0.00 175.55 173.73 2emn s VAL 93 N -2.25 5.40 -0.24 -3.49 1.01 0.14 -2.01 120.40 118.97 2emn s VAL 93 Ca -0.07 0.26 -0.01 0.00 0.00 0.00 0.00 61.98 62.16 2emn s VAL 93 Cb -0.01 -3.49 0.03 0.00 0.00 0.00 0.00 36.38 32.90 2emn s VAL 93 CO -0.01 0.46 -0.09 -1.58 0.00 0.00 0.00 175.10 173.89 2emn s GLN 94 N 0.12 2.84 0.09 2.72 0.74 0.83 -2.29 119.66 124.72 2emn s GLN 94 Ca 0.11 -0.96 0.09 0.00 0.05 0.00 0.00 55.36 54.65 2emn s GLN 94 Cb -0.12 -2.90 -0.04 0.00 1.10 0.00 0.00 33.01 31.05 2emn s GLN 94 CO 0.00 -0.37 -0.22 -1.21 -0.55 0.00 0.00 175.29 172.94 2emn s GLU 95 N 1.31 1.74 0.02 1.67 2.02 -0.28 -1.28 118.70 123.90 2emn s GLU 95 Ca 0.01 -1.17 -0.12 0.00 0.02 0.00 0.00 54.97 53.70 2emn s GLU 95 Cb -0.16 -2.04 0.01 0.00 0.10 0.00 0.00 34.13 32.04 2emn s GLU 95 CO -0.06 0.49 0.26 1.03 0.02 0.00 0.00 175.26 177.00 2emn s ARG 96 N -1.78 0.72 -0.19 1.61 0.52 -0.96 -0.62 118.95 118.24 2emn s ARG 96 Ca 0.15 -0.45 -0.01 0.00 -0.52 0.00 0.00 55.73 54.89 2emn s ARG 96 Cb -0.10 0.31 0.05 0.00 0.52 0.00 0.00 34.95 35.73 2emn s ARG 96 CO 0.06 -0.21 -0.01 0.99 0.02 0.00 0.00 175.30 176.15 2emn s THR 97 N -2.16 0.90 -0.16 0.02 2.01 0.31 -2.48 115.64 114.07 2emn s THR 97 Ca -0.08 -0.70 -0.05 0.00 0.31 0.00 0.00 61.69 61.18 2emn s THR 97 Cb -0.03 -1.25 -0.03 0.00 0.01 0.00 0.00 72.50 71.21 2emn s THR 97 CO -0.01 -0.08 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.20 2emn s ILE 98 N 1.70 4.09 -0.25 1.82 1.01 -0.32 -0.64 121.20 128.61 2emn s ILE 98 Ca -0.01 -0.29 -0.04 0.00 0.00 0.00 0.00 60.65 60.31 2emn s ILE 98 Cb -0.17 -2.81 0.00 0.00 0.01 0.00 0.00 42.46 39.50 2emn s ILE 98 CO -0.07 0.48 -0.02 -0.36 0.00 0.00 0.00 174.94 174.97 2emn s PHE 99 N 0.41 3.04 -0.50 3.97 0.08 0.68 -0.52 117.98 125.13 2emn s PHE 99 Ca -0.02 -1.10 -0.23 0.00 0.12 0.00 0.00 56.93 55.69 2emn s PHE 99 Cb -0.14 -2.13 0.04 0.00 -0.57 0.00 0.00 43.02 40.22 2emn s PHE 99 CO 0.02 -0.60 0.84 -0.06 -0.10 0.00 0.00 175.22 175.32 2emn s PHE 100 N 1.45 2.91 -0.35 0.36 0.08 -0.58 -0.66 117.98 121.18 2emn s PHE 100 Ca 0.03 0.01 -0.44 0.00 0.12 0.00 0.00 56.93 56.65 2emn s PHE 100 Cb -0.16 -3.83 -0.19 0.00 -0.57 0.00 0.00 43.02 38.27 2emn s PHE 100 CO -0.02 -1.15 1.55 1.17 -0.10 0.00 0.00 175.22 176.67 2emn n LYS 101 N 6.98 0.33 -2.31 0.44 4.81 -0.69 -0.55 118.16 127.16 2emn n LYS 101 Ca 0.01 0.12 -0.16 0.00 -0.87 0.00 0.00 58.31 57.41 2emn n LYS 101 Cb 0.48 -1.67 -0.01 0.00 0.02 0.00 0.00 35.03 33.85 2emn n LYS 101 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2emn n ASP 102 N 3.92 -4.84 -0.83 3.14 8.00 -1.26 -4.80 116.55 119.88 2emn n ASP 102 Ca 0.28 -0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.76 2emn n ASP 102 Cb 0.02 -3.95 0.00 0.00 -0.02 0.00 0.00 41.12 37.17 2emn n ASP 102 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2emn n ASP 103 N -1.11 0.00 -2.83 -2.24 -0.08 0.28 -4.92 116.55 105.65 2emn n ASP 103 Ca -0.19 -0.83 0.00 0.00 -1.51 0.00 0.00 54.79 52.26 2emn n ASP 103 Cb 0.65 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.11 2emn n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2emn n GLY 104 N 0.00 -2.70 3.02 0.27 0.00 -1.14 -4.45 105.19 100.20 2emn n GLY 104 Ca 0.00 -1.39 -0.10 0.00 0.00 0.00 0.00 46.02 44.53 2emn n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2emn s ASN 105 N -1.63 0.14 -0.01 1.61 2.20 0.17 -1.53 114.94 115.89 2emn s ASN 105 Ca 0.00 -0.34 0.00 0.00 -0.94 0.00 0.00 52.86 51.58 2emn s ASN 105 Cb 0.00 0.14 -0.04 0.00 -2.00 0.00 0.00 41.25 39.35 2emn s ASN 105 CO 0.00 -0.30 0.04 -0.31 -2.94 0.00 0.00 177.10 173.60 2emn s TYR 106 N -1.30 3.20 -0.13 1.54 2.02 0.32 -1.23 117.35 121.77 2emn s TYR 106 Ca -0.14 0.16 -0.00 0.00 -0.37 0.00 0.00 57.07 56.72 2emn s TYR 106 Cb -0.08 -1.72 0.03 0.00 -0.40 0.00 0.00 41.96 39.79 2emn s TYR 106 CO -0.00 0.51 -0.08 0.15 -1.57 0.00 0.00 175.55 174.56 2emn s LYS 107 N -1.59 1.66 0.00 -0.62 1.02 0.86 -1.17 119.74 119.91 2emn s LYS 107 Ca 0.21 -0.37 0.04 0.00 0.02 0.00 0.00 55.97 55.87 2emn s LYS 107 Cb -0.12 -1.77 -0.01 0.00 -0.52 0.00 0.00 37.83 35.41 2emn s LYS 107 CO 0.11 -0.29 -0.13 0.95 -0.92 0.00 0.00 175.35 175.07 2emn s THR 108 N 1.65 1.04 -0.00 2.17 -4.23 -1.04 -0.86 115.64 114.38 2emn s THR 108 Ca 0.04 -0.67 0.04 0.00 -1.18 0.00 0.00 61.69 59.92 2emn s THR 108 Cb -0.13 -0.89 -0.01 0.00 1.34 0.00 0.00 72.50 72.81 2emn s THR 108 CO -0.09 0.21 -0.14 -0.60 -0.54 0.00 0.00 174.62 173.46 2emn s ARG 109 N -0.53 1.08 -0.04 3.99 3.52 0.05 -2.27 118.95 124.75 2emn s ARG 109 Ca 0.04 -0.54 -0.18 0.00 -0.13 0.00 0.00 55.73 54.92 2emn s ARG 109 Cb -0.06 -1.06 0.03 0.00 -1.56 0.00 0.00 34.95 32.31 2emn s ARG 109 CO -0.00 0.28 0.40 0.00 -0.81 0.00 0.00 175.30 175.17 2emn s ALA 110 N -0.42 -1.01 -0.11 6.12 0.00 -0.41 -0.38 121.76 125.56 2emn s ALA 110 Ca 0.05 0.64 0.03 0.00 0.00 0.00 0.00 51.96 52.67 2emn s ALA 110 Cb -0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 23.12 23.01 2emn s ALA 110 CO -0.00 -0.27 -0.21 -1.21 0.00 0.00 0.00 175.76 174.07 2emn s GLU 111 N -1.08 3.14 -0.20 0.00 2.02 -0.31 -0.12 118.70 122.16 2emn s GLU 111 Ca -0.11 -0.83 0.01 0.00 0.02 0.00 0.00 54.97 54.07 2emn s GLU 111 Cb -0.04 -2.39 0.03 0.00 0.10 0.00 0.00 34.13 31.83 2emn s GLU 111 CO 0.05 0.19 -0.16 0.14 0.02 0.00 0.00 175.26 175.49 2emn s VAL 112 N 0.34 2.01 0.18 2.63 -7.23 -0.85 -1.15 120.40 116.34 2emn s VAL 112 Ca -0.17 -1.10 -0.08 0.00 -1.81 0.00 0.00 61.98 58.83 2emn s VAL 112 Cb -0.17 -1.92 -0.01 0.00 0.56 0.00 0.00 36.38 34.83 2emn s VAL 112 CO 0.08 0.36 0.28 -1.59 -0.31 0.00 0.00 175.10 173.92 2emn s LYS 113 N 1.27 1.21 0.11 4.82 -2.85 -0.37 -2.41 119.74 121.52 2emn s LYS 113 Ca 0.01 -1.27 -0.27 0.00 -1.00 0.00 0.00 55.97 53.43 2emn s LYS 113 Cb -0.15 0.37 -0.06 0.00 -2.06 0.00 0.00 37.83 35.92 2emn s LYS 113 CO -0.10 -0.44 0.86 -0.06 0.10 0.00 0.00 175.35 175.70 2emn s PHE 114 N -4.01 3.82 -0.57 1.78 0.08 -1.11 -0.31 117.98 117.67 2emn s PHE 114 Ca 0.22 1.67 0.06 0.00 0.12 0.00 0.00 56.93 59.00 2emn s PHE 114 Cb 0.03 -2.92 0.22 0.00 -0.57 0.00 0.00 43.02 39.78 2emn s PHE 114 CO 0.03 0.31 0.57 0.39 -0.10 0.00 0.00 175.22 176.42 2emn n GLU 115 N 2.45 1.57 0.00 0.44 1.02 0.13 -4.91 120.64 121.34 2emn n GLU 115 Ca -0.01 -4.07 0.00 0.00 -0.02 0.00 0.00 57.16 53.06 2emn n GLU 115 Cb 0.49 -1.94 0.00 0.00 -0.02 0.00 0.00 31.44 29.97 2emn n GLU 115 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2emn n GLY 116 N 1.57 1.39 0.09 0.62 0.00 -1.26 -3.80 105.19 103.80 2emn n GLY 116 Ca 0.25 -0.80 -0.03 0.00 0.00 0.00 0.00 46.02 45.44 2emn n GLY 116 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2emn n ASP 117 N 3.86 0.74 -4.82 1.61 5.75 -1.26 -4.91 116.55 117.53 2emn n ASP 117 Ca 0.00 0.33 -0.38 0.00 -0.01 0.00 0.00 54.79 54.73 2emn n ASP 117 Cb 0.00 0.26 -0.06 0.00 -1.03 0.00 0.00 41.12 40.29 2emn n ASP 117 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2emn s THR 118 N -2.82 4.77 -0.30 2.12 2.01 -1.25 -4.33 115.64 115.84 2emn s THR 118 Ca -0.04 1.15 -0.21 0.00 0.31 0.00 0.00 61.69 62.90 2emn s THR 118 Cb 0.08 -3.87 -0.01 0.00 0.01 0.00 0.00 72.50 68.72 2emn s THR 118 CO 0.82 0.52 0.65 -0.22 -0.69 0.00 0.00 174.62 175.70 2emn s LEU 119 N -1.21 4.13 -0.12 4.42 1.98 -0.13 -0.69 118.68 127.07 2emn s LEU 119 Ca 0.30 0.48 -0.01 0.00 -2.89 0.00 0.00 54.13 52.00 2emn s LEU 119 Cb -0.19 -2.85 -0.02 0.00 0.66 0.00 0.00 46.19 43.78 2emn s LEU 119 CO 0.19 -0.49 -0.08 -0.69 -1.89 0.00 0.00 176.35 173.39 2emn s VAL 120 N 2.65 3.54 -0.33 1.68 1.01 0.57 -2.09 120.40 127.44 2emn s VAL 120 Ca 0.26 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.77 2emn s VAL 120 Cb -0.15 -2.50 0.09 0.00 0.00 0.00 0.00 36.38 33.82 2emn s VAL 120 CO 0.12 0.53 0.03 0.21 0.00 0.00 0.00 175.10 175.99 2emn s ASN 121 N 0.00 4.76 -0.14 3.32 2.47 -0.72 -1.23 114.94 123.40 2emn s ASN 121 Ca -0.01 -1.97 -0.11 0.00 0.42 0.00 0.00 52.86 51.20 2emn s ASN 121 Cb -0.14 -1.64 -0.05 0.00 -1.45 0.00 0.00 41.25 37.98 2emn s ASN 121 CO 0.03 -0.35 0.21 -0.13 -3.72 0.00 0.00 177.10 173.14 2emn s ARG 122 N 0.97 3.93 0.06 0.43 0.52 -0.30 -2.27 118.95 122.30 2emn s ARG 122 Ca 0.06 -0.03 0.02 0.00 -0.52 0.00 0.00 55.73 55.27 2emn s ARG 122 Cb -0.20 -3.32 -0.03 0.00 0.52 0.00 0.00 34.95 31.92 2emn s ARG 122 CO -0.07 0.49 -0.08 0.42 0.02 0.00 0.00 175.30 176.08 2emn s ILE 123 N -0.24 0.62 -0.04 1.52 1.01 0.20 -1.16 121.20 123.10 2emn s ILE 123 Ca 0.15 -1.40 0.02 0.00 0.00 0.00 0.00 60.65 59.42 2emn s ILE 123 Cb -0.13 -1.01 0.01 0.00 0.01 0.00 0.00 42.46 41.34 2emn s ILE 123 CO 0.03 -0.55 -0.09 -1.61 0.00 0.00 0.00 174.94 172.72 2emn s GLU 124 N -2.40 1.10 -0.01 2.79 0.41 0.49 -2.43 118.70 118.64 2emn s GLU 124 Ca -0.02 -0.29 0.03 0.00 -0.41 0.00 0.00 54.97 54.28 2emn s GLU 124 Cb -0.04 -1.00 -0.00 0.00 -1.78 0.00 0.00 34.13 31.30 2emn s GLU 124 CO -0.01 0.05 -0.09 -1.17 -0.49 0.00 0.00 175.26 173.55 2emn s LEU 125 N 0.45 1.96 -0.04 1.80 0.20 -0.96 -0.77 118.68 121.32 2emn s LEU 125 Ca -0.08 -0.16 0.00 0.00 0.69 0.00 0.00 54.13 54.59 2emn s LEU 125 Cb -0.12 -0.47 0.03 0.00 -0.43 0.00 0.00 46.19 45.20 2emn s LEU 125 CO 0.01 0.10 -0.01 -0.75 -0.29 0.00 0.00 176.35 175.41 2emn s LYS 126 N -0.10 0.47 0.02 1.98 2.20 -0.04 -1.26 119.74 123.00 2emn s LYS 126 Ca 0.02 0.04 0.06 0.00 -0.36 0.00 0.00 55.97 55.72 2emn s LYS 126 Cb -0.05 -0.63 -0.02 0.00 -1.51 0.00 0.00 37.83 35.63 2emn s LYS 126 CO -0.00 -0.14 -0.18 0.20 -0.36 0.00 0.00 175.35 174.87 2emn s GLY 127 N 1.11 0.93 0.14 5.54 0.00 0.14 -0.10 107.32 115.07 2emn s GLY 127 Ca -0.08 -0.87 -0.10 0.00 0.00 0.00 0.00 44.72 43.66 2emn s GLY 127 CO -0.02 -0.79 0.28 -0.26 0.00 0.00 0.00 173.10 172.32 2emn s ILE 128 N -0.64 0.09 0.00 0.90 -4.36 -0.36 -2.36 121.20 114.47 2emn s ILE 128 Ca 0.06 -1.20 0.00 0.00 -0.26 0.00 0.00 60.65 59.25 2emn s ILE 128 Cb -0.08 -1.58 0.00 0.00 1.25 0.00 0.00 42.46 42.05 2emn s ILE 128 CO 0.01 -0.41 0.00 0.47 0.24 0.00 0.00 174.94 175.24 2emn n ASP 129 N -0.17 -3.07 -4.66 4.36 8.00 -1.26 -0.66 116.55 119.10 2emn n ASP 129 Ca -0.11 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 54.96 2emn n ASP 129 Cb 0.63 -1.05 -0.02 0.00 -0.02 0.00 0.00 41.12 40.66 2emn n ASP 129 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2emn s PHE 130 N -2.03 2.33 0.47 1.24 0.08 -1.26 -2.88 117.98 115.92 2emn s PHE 130 Ca 0.00 0.55 -0.24 0.00 0.12 0.00 0.00 56.93 57.36 2emn s PHE 130 Cb 0.00 -3.77 -0.07 0.00 -0.57 0.00 0.00 43.02 38.61 2emn s PHE 130 CO 0.00 -2.90 1.28 0.15 -0.10 0.00 0.00 175.22 173.65 2emn s LYS 131 N 3.91 3.65 0.34 0.44 1.02 -1.26 -4.88 119.74 122.96 2emn s LYS 131 Ca 0.66 2.06 0.25 0.00 0.02 0.00 0.00 55.97 58.96 2emn s LYS 131 Cb -0.28 -2.49 0.66 0.00 -0.52 0.00 0.00 37.83 35.21 2emn s LYS 131 CO 0.24 -0.73 1.72 1.05 -0.92 0.00 0.00 175.35 176.71 2emn h GLU 132 N 2.10 0.00 -0.09 1.68 9.09 -1.95 -2.64 114.58 122.77 2emn h GLU 132 Ca -0.50 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.91 2emn h GLU 132 Cb 1.26 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.36 2emn h GLU 132 CO 0.60 0.00 0.00 -0.40 0.05 0.00 0.00 179.01 179.26 2emn n ASP 133 N -2.68 2.54 -4.73 3.06 5.68 -1.26 -4.09 116.55 115.08 2emn n ASP 133 Ca 0.04 -1.84 -0.28 0.00 -0.50 0.00 0.00 54.79 52.21 2emn n ASP 133 Cb 0.45 -0.04 0.11 0.00 -1.14 0.00 0.00 41.12 40.49 2emn n ASP 133 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 2emn s GLY 134 N -1.90 1.66 0.09 6.12 0.00 -0.99 -4.81 107.32 107.49 2emn s GLY 134 Ca 0.33 -0.88 -0.28 0.00 0.00 0.00 0.00 44.72 43.89 2emn s GLY 134 CO 0.31 -0.34 1.66 3.43 0.00 0.00 0.00 173.10 178.15 2emn h ASN 135 N -1.06 -0.56 0.00 1.64 2.35 -1.93 0.84 115.58 116.85 2emn h ASN 135 Ca -0.45 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.35 2emn h ASN 135 Cb 1.30 0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.86 2emn h ASN 135 CO 0.57 -0.32 0.00 -0.38 -1.65 0.00 0.00 177.43 175.65 2emn n ILE 136 N -5.34 0.00 0.24 2.81 -0.00 -1.26 -0.78 119.36 115.03 2emn n ILE 136 Ca -0.09 1.37 0.10 0.00 -0.00 0.00 0.00 62.75 64.13 2emn n ILE 136 Cb 0.25 -2.15 0.61 0.00 -0.00 0.00 0.00 39.64 38.36 2emn n ILE 136 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 2emn h LEU 137 N 0.00 0.00 0.00 1.39 3.38 -1.74 -1.34 115.31 116.99 2emn h LEU 137 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2emn h LEU 137 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2emn h LEU 137 CO 0.00 0.18 0.00 0.61 0.09 0.00 0.00 178.44 179.32 2emn n GLY 138 N -0.66 -1.23 3.71 0.83 0.00 0.29 -4.90 105.19 103.24 2emn n GLY 138 Ca -0.02 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 2emn n GLY 138 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2emn n HIS 139 N -1.44 -2.26 -0.29 1.61 8.25 0.04 -4.88 115.22 116.25 2emn n HIS 139 Ca 0.07 0.91 0.09 0.00 -0.26 0.00 0.00 57.72 58.53 2emn n HIS 139 Cb 0.25 -4.48 0.31 0.00 1.12 0.00 0.00 29.99 27.19 2emn n HIS 139 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2emn n LYS 140 N -4.53 3.23 -3.81 -0.41 5.02 -0.34 -4.93 118.16 112.40 2emn n LYS 140 Ca -0.13 -2.49 -0.35 0.00 -2.02 0.00 0.00 58.31 53.32 2emn n LYS 140 Cb 0.61 -1.76 -0.05 0.00 -0.02 0.00 0.00 35.03 33.80 2emn n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2emn s LEU 141 N -1.54 4.37 0.35 -0.35 1.02 -1.26 -2.73 118.68 118.55 2emn s LEU 141 Ca 0.45 0.50 -0.19 0.00 0.02 0.00 0.00 54.13 54.91 2emn s LEU 141 Cb 0.28 -2.57 -0.10 0.00 0.02 0.00 0.00 46.19 43.82 2emn s LEU 141 CO 0.23 0.28 0.84 -1.61 0.02 0.00 0.00 176.35 176.11 2emn s GLU 142 N -1.69 4.17 -1.32 1.70 2.02 -0.31 -4.87 118.70 118.41 2emn s GLU 142 Ca 0.26 0.93 -0.16 0.00 0.02 0.00 0.00 54.97 56.01 2emn s GLU 142 Cb -0.13 -2.42 0.01 0.00 0.10 0.00 0.00 34.13 31.69 2emn s GLU 142 CO 0.15 0.13 2.06 0.98 0.02 0.00 0.00 175.26 178.60 2emn n TYR 143 N -0.25 3.53 -3.88 1.61 9.36 -1.26 -4.76 117.16 121.52 2emn n TYR 143 Ca 0.04 -2.71 -0.08 0.00 3.32 0.00 0.00 57.90 58.46 2emn n TYR 143 Cb 0.53 -2.47 -0.01 0.00 -0.63 0.00 0.00 39.34 36.76 2emn n TYR 143 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2emn s ASN 144 N 3.84 -0.12 0.01 2.98 2.20 -1.26 -4.79 114.94 117.80 2emn s ASN 144 Ca 0.51 -0.83 -0.03 0.00 -0.94 0.00 0.00 52.86 51.57 2emn s ASN 144 Cb 0.11 0.74 -0.01 0.00 -2.00 0.00 0.00 41.25 40.09 2emn s ASN 144 CO -0.01 -1.41 0.05 -0.47 -2.94 0.00 0.00 177.10 172.32 2emn s TYR 145 N -3.48 0.12 0.32 1.54 5.04 -1.26 -4.73 117.35 114.90 2emn s TYR 145 Ca 0.15 -0.26 0.05 0.00 -2.44 0.00 0.00 57.07 54.56 2emn s TYR 145 Cb -0.05 -0.10 0.05 0.00 0.35 0.00 0.00 41.96 42.22 2emn s TYR 145 CO 0.09 -0.20 0.44 0.09 -1.34 0.00 0.00 175.55 174.62 2emn n ASN 146 N 1.77 1.09 -4.33 4.32 3.02 -1.26 -4.73 115.26 115.13 2emn n ASN 146 Ca -0.22 -1.80 -0.32 0.00 -0.03 0.00 0.00 54.58 52.21 2emn n ASN 146 Cb 0.56 -0.24 -0.15 0.00 -0.61 0.00 0.00 39.78 39.34 2emn n ASN 146 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2emn s SER 147 N -2.94 3.51 0.24 6.41 0.01 -1.26 -4.07 113.70 115.61 2emn s SER 147 Ca 0.33 -0.40 0.02 0.00 1.31 0.00 0.00 55.95 57.20 2emn s SER 147 Cb -0.03 -1.09 -0.05 0.00 0.21 0.00 0.00 66.02 65.06 2emn s SER 147 CO 0.21 0.24 0.06 -1.00 0.41 0.00 0.00 173.24 173.15 2emn s HIS 148 N -0.10 1.53 -0.26 2.43 0.09 -0.96 -4.99 115.29 113.02 2emn s HIS 148 Ca -0.04 -1.08 -0.07 0.00 -0.00 0.00 0.00 55.06 53.88 2emn s HIS 148 Cb -0.14 -0.90 -0.01 0.00 -0.00 0.00 0.00 32.58 31.52 2emn s HIS 148 CO 0.04 -0.22 0.06 -0.80 -0.00 0.00 0.00 174.74 173.83 2emn s ASN 149 N -3.30 5.05 -0.28 1.40 0.02 -1.26 -1.85 114.94 114.71 2emn s ASN 149 Ca 0.33 -0.39 -0.18 0.00 -1.02 0.00 0.00 52.86 51.61 2emn s ASN 149 Cb 0.07 -1.89 -0.02 0.00 0.02 0.00 0.00 41.25 39.42 2emn s ASN 149 CO 0.11 -0.09 0.50 -0.69 0.02 0.00 0.00 177.10 176.96 2emn s VAL 150 N 1.57 5.07 -0.21 1.60 1.01 0.95 -4.76 120.40 125.63 2emn s VAL 150 Ca 0.05 0.75 -0.19 0.00 0.00 0.00 0.00 61.98 62.59 2emn s VAL 150 Cb -0.16 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 2emn s VAL 150 CO 0.03 0.03 0.54 -0.31 0.00 0.00 0.00 175.10 175.38 2emn s TYR 151 N 2.31 3.36 0.07 5.22 2.02 -1.04 0.11 117.35 129.40 2emn s TYR 151 Ca 0.20 0.78 0.06 0.00 -0.37 0.00 0.00 57.07 57.74 2emn s TYR 151 Cb -0.16 -2.70 -0.04 0.00 -0.40 0.00 0.00 41.96 38.67 2emn s TYR 151 CO 0.10 -0.14 -0.10 0.42 -1.57 0.00 0.00 175.55 174.26 2emn s ILE 152 N 1.78 3.39 -0.02 2.71 -1.09 0.45 -0.88 121.20 127.55 2emn s ILE 152 Ca 0.24 -1.13 -0.20 0.00 -2.23 0.00 0.00 60.65 57.34 2emn s ILE 152 Cb -0.15 -2.54 0.04 0.00 -1.58 0.00 0.00 42.46 38.22 2emn s ILE 152 CO 0.10 0.21 0.42 -0.04 -1.23 0.00 0.00 174.94 174.40 2emn s MET 153 N -1.92 0.79 0.42 2.79 -1.94 -0.60 -1.90 119.30 116.94 2emn s MET 153 Ca 0.20 -0.06 -0.21 0.00 -1.71 0.00 0.00 55.69 53.90 2emn s MET 153 Cb -0.11 0.36 -0.11 0.00 2.01 0.00 0.00 34.83 36.98 2emn s MET 153 CO 0.11 -0.23 0.95 0.00 -0.01 0.00 0.00 175.02 175.84 2emn s ALA 154 N -1.32 3.05 -0.56 3.03 0.00 -1.23 0.65 121.76 125.38 2emn s ALA 154 Ca -0.13 0.42 0.04 0.00 0.00 0.00 0.00 51.96 52.29 2emn s ALA 154 Cb -0.04 -3.16 0.14 0.00 0.00 0.00 0.00 23.12 20.07 2emn s ALA 154 CO 0.06 0.12 0.32 0.34 0.00 0.00 0.00 175.76 176.60 2emn s ASP 155 N -2.13 4.29 0.03 0.00 -1.08 -0.00 -4.62 116.67 113.16 2emn s ASP 155 Ca 0.61 -3.19 -0.07 0.00 -0.52 0.00 0.00 52.55 49.38 2emn s ASP 155 Cb -0.10 -1.53 -0.02 0.00 -1.46 0.00 0.00 42.92 39.81 2emn s ASP 155 CO 0.14 -0.20 1.13 0.11 0.52 0.00 0.00 175.17 176.87 2emn h LYS 156 N 6.22 -0.06 -0.36 4.34 1.79 -1.95 0.16 116.57 126.70 2emn h LYS 156 Ca -0.00 0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.52 2emn h LYS 156 Cb 0.86 0.01 -0.08 0.00 -1.58 0.00 0.00 32.23 31.45 2emn h LYS 156 CO 0.66 -0.04 -0.55 -0.56 -1.08 0.00 0.00 179.45 177.88 2emn h GLN 157 N -0.06 -0.41 0.00 3.15 -0.00 -1.97 -1.36 115.11 114.46 2emn h GLN 157 Ca 0.02 0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.70 2emn h GLN 157 Cb 0.12 0.09 0.00 0.00 -0.00 0.00 0.00 27.48 27.70 2emn h GLN 157 CO -0.16 -0.27 0.00 1.63 -0.00 0.00 0.00 178.83 180.02 2emn n LYS 158 N -5.35 0.18 -2.84 0.06 4.76 -1.12 -4.87 118.16 108.99 2emn n LYS 158 Ca -0.04 0.47 -0.12 0.00 -2.87 0.00 0.00 58.31 55.75 2emn n LYS 158 Cb 0.34 -1.89 0.03 0.00 -1.84 0.00 0.00 35.03 31.67 2emn n LYS 158 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2emn n ASN 159 N -2.24 -4.09 0.00 4.39 5.15 0.52 -4.83 115.26 114.17 2emn n ASN 159 Ca 0.01 -0.21 0.00 0.00 -0.60 0.00 0.00 54.58 53.79 2emn n ASN 159 Cb 0.19 -2.83 0.00 0.00 -0.53 0.00 0.00 39.78 36.60 2emn n ASN 159 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2emn n GLY 160 N -1.21 5.17 3.15 8.20 0.00 -0.89 -4.32 105.19 115.29 2emn n GLY 160 Ca -0.03 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.18 2emn n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2emn s ILE 161 N 2.44 0.16 -0.06 -0.61 -4.36 -0.78 -0.82 121.20 117.16 2emn s ILE 161 Ca 0.00 -1.31 0.05 0.00 -0.26 0.00 0.00 60.65 59.12 2emn s ILE 161 Cb 0.00 -1.26 -0.02 0.00 1.25 0.00 0.00 42.46 42.43 2emn s ILE 161 CO 0.00 -0.72 -0.21 -0.54 0.24 0.00 0.00 174.94 173.71 2emn s LYS 162 N -3.53 2.65 0.08 0.37 1.02 0.21 -2.07 119.74 118.47 2emn s LYS 162 Ca 0.03 -0.82 0.07 0.00 0.02 0.00 0.00 55.97 55.26 2emn s LYS 162 Cb 0.04 -2.28 -0.03 0.00 -0.52 0.00 0.00 37.83 35.04 2emn s LYS 162 CO -0.09 0.42 -0.18 0.08 -0.92 0.00 0.00 175.35 174.67 2emn s VAL 163 N -0.24 1.41 -0.28 3.17 1.01 0.11 -1.56 120.40 124.02 2emn s VAL 163 Ca -0.00 -1.37 -0.22 0.00 0.00 0.00 0.00 61.98 60.38 2emn s VAL 163 Cb -0.13 -1.30 0.10 0.00 0.00 0.00 0.00 36.38 35.05 2emn s VAL 163 CO 0.03 -0.10 0.86 0.21 0.00 0.00 0.00 175.10 176.10 2emn s ASN 164 N -1.72 -0.64 0.20 3.32 2.47 -0.06 -1.50 114.94 117.02 2emn s ASN 164 Ca 0.03 1.17 -0.23 0.00 0.42 0.00 0.00 52.86 54.24 2emn s ASN 164 Cb -0.10 1.21 0.05 0.00 -1.45 0.00 0.00 41.25 40.96 2emn s ASN 164 CO 0.03 -0.20 0.89 0.72 -3.72 0.00 0.00 177.10 174.82 2emn s PHE 165 N 0.64 -0.12 -0.07 0.43 -0.71 -1.21 -2.50 117.98 114.44 2emn s PHE 165 Ca -0.02 -0.25 0.05 0.00 -1.04 0.00 0.00 56.93 55.67 2emn s PHE 165 Cb -0.05 0.67 -0.00 0.00 -1.21 0.00 0.00 43.02 42.43 2emn s PHE 165 CO -0.07 -0.98 -0.23 0.21 -1.34 0.00 0.00 175.22 172.81 2emn s LYS 166 N -3.35 2.55 -0.06 1.99 2.20 -1.26 -0.79 119.74 121.01 2emn s LYS 166 Ca 0.13 -0.82 -0.02 0.00 -0.36 0.00 0.00 55.97 54.90 2emn s LYS 166 Cb -0.03 -2.06 -0.04 0.00 -1.51 0.00 0.00 37.83 34.19 2emn s LYS 166 CO 0.04 0.26 0.06 0.42 -0.36 0.00 0.00 175.35 175.78 2emn s ILE 167 N 0.10 4.75 -0.45 5.43 -1.09 0.15 -4.92 121.20 125.17 2emn s ILE 167 Ca -0.10 -0.21 -0.04 0.00 -2.23 0.00 0.00 60.65 58.07 2emn s ILE 167 Cb -0.15 -3.08 0.12 0.00 -1.58 0.00 0.00 42.46 37.77 2emn s ILE 167 CO 0.05 0.51 0.26 -0.13 -1.23 0.00 0.00 174.94 174.41 2emn s ARG 168 N -1.25 2.17 0.05 2.79 0.52 -1.26 -0.61 118.95 121.36 2emn s ARG 168 Ca 0.17 -1.88 -0.19 0.00 -0.52 0.00 0.00 55.73 53.31 2emn s ARG 168 Cb -0.12 -3.68 -0.06 0.00 0.52 0.00 0.00 34.95 31.61 2emn s ARG 168 CO 0.07 -1.11 0.55 -1.01 0.02 0.00 0.00 175.30 173.82 2emn s HIS 169 N 1.07 3.78 0.04 -0.53 3.76 0.60 -4.58 115.29 119.43 2emn s HIS 169 Ca 0.09 1.23 -0.22 0.00 -0.15 0.00 0.00 55.06 56.00 2emn s HIS 169 Cb -0.23 -2.49 -0.06 0.00 1.11 0.00 0.00 32.58 30.91 2emn s HIS 169 CO -0.03 0.56 0.66 -0.80 -0.85 0.00 0.00 174.74 174.27 2emn s ASN 170 N -0.95 7.10 -0.11 1.40 0.02 -1.26 0.14 114.94 121.28 2emn s ASN 170 Ca 0.29 1.32 -0.05 0.00 -1.02 0.00 0.00 52.86 53.39 2emn s ASN 170 Cb -0.19 -2.41 -0.04 0.00 0.02 0.00 0.00 41.25 38.63 2emn s ASN 170 CO 0.18 0.11 0.10 -0.63 0.02 0.00 0.00 177.10 176.88 2emn s ILE 171 N -0.40 5.15 -0.15 0.60 -1.09 -0.86 -1.16 121.20 123.29 2emn s ILE 171 Ca 0.33 0.07 0.07 0.00 -2.23 0.00 0.00 60.65 58.90 2emn s ILE 171 Cb -0.20 -3.22 0.07 0.00 -1.58 0.00 0.00 42.46 37.54 2emn s ILE 171 CO 0.20 0.62 1.06 -1.84 -1.23 0.00 0.00 174.94 173.75 2emn n GLU 172 N 2.03 0.05 -2.24 2.79 0.28 -1.10 -1.32 120.64 121.13 2emn n GLU 172 Ca -0.20 0.45 -0.34 0.00 -0.16 0.00 0.00 57.16 56.92 2emn n GLU 172 Cb 0.55 -1.98 0.02 0.00 1.43 0.00 0.00 31.44 31.45 2emn n GLU 172 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 2emn n ASP 173 N -1.74 6.15 -0.19 -1.84 5.75 -1.26 -4.91 116.55 118.50 2emn n ASP 173 Ca -0.00 -3.77 -0.01 0.00 -0.01 0.00 0.00 54.79 50.99 2emn n ASP 173 Cb 0.33 -0.78 -0.01 0.00 -1.03 0.00 0.00 41.12 39.63 2emn n ASP 173 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2emn n GLY 174 N -0.48 0.14 3.97 6.12 0.00 -0.43 -4.90 105.19 109.60 2emn n GLY 174 Ca 0.46 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.22 2emn n GLY 174 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2emn s SER 175 N -1.06 3.63 -0.07 1.61 1.04 -1.19 -4.91 113.70 112.75 2emn s SER 175 Ca 0.00 -0.18 -0.02 0.00 0.48 0.00 0.00 55.95 56.23 2emn s SER 175 Cb 0.00 0.03 0.03 0.00 0.10 0.00 0.00 66.02 66.18 2emn s SER 175 CO 0.00 -2.37 0.03 -0.69 0.98 0.00 0.00 173.24 171.19 2emn s VAL 176 N -3.52 0.18 -0.19 5.02 1.01 -1.26 -2.02 120.40 119.62 2emn s VAL 176 Ca 0.71 0.20 -0.23 0.00 0.00 0.00 0.00 61.98 62.66 2emn s VAL 176 Cb -0.04 -0.41 -0.02 0.00 0.00 0.00 0.00 36.38 35.91 2emn s VAL 176 CO 0.49 0.19 0.73 -1.58 0.00 0.00 0.00 175.10 174.93 2emn s GLN 177 N 2.05 4.24 0.17 2.72 2.00 0.12 -4.91 119.66 126.04 2emn s GLN 177 Ca 0.05 0.80 -0.13 0.00 -2.00 0.00 0.00 55.36 54.07 2emn s GLN 177 Cb -0.12 -3.59 -0.07 0.00 0.80 0.00 0.00 33.01 30.03 2emn s GLN 177 CO -0.05 -0.31 0.56 -0.51 -0.50 0.00 0.00 175.29 174.48 2emn s LEU 178 N 2.14 4.30 -0.30 3.68 1.43 -1.26 -0.29 118.68 128.37 2emn s LEU 178 Ca 0.33 1.06 -0.03 0.00 -1.03 0.00 0.00 54.13 54.46 2emn s LEU 178 Cb -0.16 -3.37 0.11 0.00 0.03 0.00 0.00 46.19 42.81 2emn s LEU 178 CO 0.11 0.06 0.18 0.00 0.23 0.00 0.00 176.35 176.93 2emn s ALA 179 N -1.54 0.37 0.06 4.21 0.00 0.22 -1.71 121.76 123.37 2emn s ALA 179 Ca 0.40 -0.99 -0.31 0.00 0.00 0.00 0.00 51.96 51.06 2emn s ALA 179 Cb -0.14 -1.53 -0.06 0.00 0.00 0.00 0.00 23.12 21.39 2emn s ALA 179 CO 0.19 -1.73 1.32 -0.51 0.00 0.00 0.00 175.76 175.03 2emn s ASP 180 N 2.03 6.93 -0.16 0.00 1.01 0.16 -0.67 116.67 125.97 2emn s ASP 180 Ca 0.10 2.15 -0.01 0.00 0.71 0.00 0.00 52.55 55.50 2emn s ASP 180 Cb -0.16 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.18 2emn s ASP 180 CO -0.31 -0.60 -0.10 -1.00 0.21 0.00 0.00 175.17 173.36 2emn s HIS 181 N 1.42 2.87 -0.32 4.23 3.76 0.03 -0.23 115.29 127.05 2emn s HIS 181 Ca 0.62 -0.72 0.02 0.00 -0.15 0.00 0.00 55.06 54.83 2emn s HIS 181 Cb -0.33 -1.92 0.08 0.00 1.11 0.00 0.00 32.58 31.53 2emn s HIS 181 CO 0.29 -0.30 0.01 0.71 -0.85 0.00 0.00 174.74 174.60 2emn s TYR 182 N 0.65 3.52 0.01 1.40 2.02 0.19 -3.34 117.35 121.80 2emn s TYR 182 Ca -0.06 -2.58 0.07 0.00 -0.37 0.00 0.00 57.07 54.14 2emn s TYR 182 Cb -0.15 -2.53 -0.03 0.00 -0.40 0.00 0.00 41.96 38.85 2emn s TYR 182 CO 0.02 -0.91 -0.22 -1.14 -1.57 0.00 0.00 175.55 171.73 2emn s GLN 183 N 1.04 2.07 -0.01 -0.62 0.74 -0.56 -0.53 119.66 121.79 2emn s GLN 183 Ca 0.02 -0.96 0.01 0.00 0.05 0.00 0.00 55.36 54.48 2emn s GLN 183 Cb -0.20 -2.11 0.00 0.00 1.10 0.00 0.00 33.01 31.80 2emn s GLN 183 CO -0.06 0.55 -0.03 -1.14 -0.55 0.00 0.00 175.29 174.06 2emn s GLN 184 N -1.03 0.29 -0.04 1.67 0.74 0.21 0.04 119.66 121.54 2emn s GLN 184 Ca 0.12 -0.10 0.02 0.00 0.05 0.00 0.00 55.36 55.45 2emn s GLN 184 Cb -0.10 -0.29 0.01 0.00 1.10 0.00 0.00 33.01 33.72 2emn s GLN 184 CO 0.02 0.05 -0.08 -0.80 -0.55 0.00 0.00 175.29 173.93 2emn s ASN 185 N 0.04 1.22 0.03 6.67 -0.87 -0.88 -1.12 114.94 120.03 2emn s ASN 185 Ca 0.00 -0.19 0.05 0.00 -1.57 0.00 0.00 52.86 51.15 2emn s ASN 185 Cb -0.03 -0.46 -0.02 0.00 -0.02 0.00 0.00 41.25 40.73 2emn s ASN 185 CO -0.00 0.02 -0.14 0.42 -2.57 0.00 0.00 177.10 174.83 2emn s THR 186 N 0.49 1.13 0.67 1.60 -4.23 -0.97 -1.86 115.64 112.47 2emn s THR 186 Ca -0.08 -0.96 -0.14 0.00 -1.18 0.00 0.00 61.69 59.34 2emn s THR 186 Cb -0.12 -1.02 0.00 0.00 1.34 0.00 0.00 72.50 72.71 2emn s THR 186 CO 0.01 0.05 1.08 -2.16 -0.54 0.00 0.00 174.62 173.07 2emn s PRO 187 N -1.03 2.87 0.15 3.99 0.04 -1.26 -0.68 135.00 139.07 2emn s PRO 187 Ca 0.02 1.23 0.23 0.00 0.04 0.00 0.00 61.00 62.52 2emn s PRO 187 Cb -0.08 -1.97 0.02 0.00 0.04 0.00 0.00 34.50 32.51 2emn s PRO 187 CO 0.01 -1.17 1.02 -0.89 0.04 0.00 0.00 177.00 176.01 2emn n ILE 188 N -2.60 0.46 -3.02 0.56 5.41 -0.62 -4.68 119.36 114.86 2emn n ILE 188 Ca 0.09 -0.46 -0.18 0.00 1.00 0.00 0.00 62.75 63.20 2emn n ILE 188 Cb 0.53 -0.20 0.02 0.00 -0.71 0.00 0.00 39.64 39.28 2emn n ILE 188 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2emn s GLY 189 N -4.18 1.91 0.00 7.39 0.00 -1.26 -5.00 107.32 106.18 2emn s GLY 189 Ca 0.00 -1.77 0.22 0.00 0.00 0.00 0.00 44.72 43.16 2emn s GLY 189 CO 0.79 -1.54 1.25 1.22 0.00 0.00 0.00 173.10 174.82 2emn n ASP 190 N -1.93 3.00 -4.81 1.64 8.00 -1.26 -4.94 116.55 116.24 2emn n ASP 190 Ca 0.10 -1.92 -0.33 0.00 0.71 0.00 0.00 54.79 53.34 2emn n ASP 190 Cb 0.60 -0.09 -0.05 0.00 -0.02 0.00 0.00 41.12 41.56 2emn n ASP 190 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2emn s GLY 191 N -1.66 2.39 0.41 0.44 0.00 -1.26 -4.99 107.32 102.66 2emn s GLY 191 Ca 0.29 0.46 -0.27 0.00 0.00 0.00 0.00 44.72 45.20 2emn s GLY 191 CO 0.28 0.75 1.40 2.56 0.00 0.00 0.00 173.10 178.09 2emn s PRO 192 N -3.33 3.94 0.18 2.90 0.04 -1.26 -5.03 135.00 132.45 2emn s PRO 192 Ca 0.64 2.38 0.10 0.00 0.04 0.00 0.00 61.00 64.16 2emn s PRO 192 Cb -0.12 -2.81 -0.04 0.00 0.04 0.00 0.00 34.50 31.56 2emn s PRO 192 CO 0.18 -0.60 -0.20 0.08 0.04 0.00 0.00 177.00 176.51 2emn s VAL 193 N -1.19 2.62 -0.25 -0.36 1.01 -1.26 -4.99 120.40 115.97 2emn s VAL 193 Ca 0.56 -1.86 -0.29 0.00 0.00 0.00 0.00 61.98 60.39 2emn s VAL 193 Cb -0.43 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.69 2emn s VAL 193 CO 0.56 -0.08 1.36 -0.76 0.00 0.00 0.00 175.10 176.18 2emn s LEU 194 N -2.62 3.95 -0.27 3.92 1.43 -1.26 -4.99 118.68 118.84 2emn s LEU 194 Ca 0.21 1.40 -0.16 0.00 -1.03 0.00 0.00 54.13 54.55 2emn s LEU 194 Cb -0.09 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.56 2emn s LEU 194 CO 0.11 -1.05 0.42 -0.76 0.23 0.00 0.00 176.35 175.30 2emn s LEU 195 N 4.34 4.04 0.44 1.79 1.02 -1.26 -4.10 118.68 124.96 2emn s LEU 195 Ca 0.59 0.36 -0.08 0.00 0.02 0.00 0.00 54.13 55.02 2emn s LEU 195 Cb -0.19 -2.50 -0.05 0.00 0.02 0.00 0.00 46.19 43.47 2emn s LEU 195 CO 0.23 -0.21 0.78 -2.16 0.02 0.00 0.00 176.35 175.00 2emn s PRO 196 N 2.14 3.66 0.73 1.29 0.04 -1.26 -4.91 135.00 136.68 2emn s PRO 196 Ca 0.17 0.34 -0.11 0.00 0.04 0.00 0.00 61.00 61.44 2emn s PRO 196 Cb -0.16 -2.38 0.03 0.00 0.04 0.00 0.00 34.50 32.03 2emn s PRO 196 CO 0.10 -0.13 1.07 -0.51 0.04 0.00 0.00 177.00 177.57 2emn s ASP 197 N -3.64 5.09 0.27 6.66 1.11 -1.26 -3.53 116.67 121.37 2emn s ASP 197 Ca 0.49 1.57 -0.31 0.00 0.18 0.00 0.00 52.55 54.49 2emn s ASP 197 Cb -0.10 -2.40 -0.12 0.00 1.07 0.00 0.00 42.92 41.37 2emn s ASP 197 CO 0.38 -1.62 1.58 0.59 1.18 0.00 0.00 175.17 177.28 2emn n ASN 198 N -3.24 3.66 -3.64 0.27 4.13 -1.26 -4.78 115.26 110.41 2emn n ASN 198 Ca 0.08 1.13 -0.04 0.00 1.68 0.00 0.00 54.58 57.43 2emn n ASN 198 Cb 0.54 -1.56 -0.01 0.00 -1.54 0.00 0.00 39.78 37.22 2emn n ASN 198 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 2emn s HIS 199 N 0.18 -0.07 0.39 3.10 -3.43 -0.80 -4.83 115.29 109.83 2emn s HIS 199 Ca 0.67 -0.27 0.04 0.00 -0.80 0.00 0.00 55.06 54.69 2emn s HIS 199 Cb -0.53 0.66 -0.03 0.00 -1.43 0.00 0.00 32.58 31.25 2emn s HIS 199 CO 0.46 -0.88 0.10 1.52 -2.00 0.00 0.00 174.74 173.95 2emn s TYR 200 N -3.00 1.83 -0.15 0.38 1.13 -0.80 -0.41 117.35 116.33 2emn s TYR 200 Ca 0.14 -1.18 0.00 0.00 -1.41 0.00 0.00 57.07 54.62 2emn s TYR 200 Cb -0.02 -1.21 0.02 0.00 -1.10 0.00 0.00 41.96 39.65 2emn s TYR 200 CO 0.03 -0.19 -0.13 -0.51 -2.51 0.00 0.00 175.55 172.24 2emn s LEU 201 N -3.59 1.65 -0.44 -3.49 1.43 0.31 -1.62 118.68 112.93 2emn s LEU 201 Ca 0.26 -0.48 -0.23 0.00 -1.03 0.00 0.00 54.13 52.65 2emn s LEU 201 Cb 0.04 -1.15 0.02 0.00 0.03 0.00 0.00 46.19 45.14 2emn s LEU 201 CO 0.14 -0.07 0.79 -0.55 0.23 0.00 0.00 176.35 176.89 2emn s SER 202 N 1.51 6.43 -0.07 2.29 0.15 -0.15 -0.03 113.70 123.83 2emn s SER 202 Ca 0.05 -0.04 0.05 0.00 0.70 0.00 0.00 55.95 56.71 2emn s SER 202 Cb -0.13 -2.39 -0.01 0.00 -1.71 0.00 0.00 66.02 61.78 2emn s SER 202 CO -0.10 -0.90 -0.24 0.42 1.20 0.00 0.00 173.24 173.62 2emn s THR 203 N 3.29 2.11 -0.06 6.45 -4.23 -0.77 -1.93 115.64 120.50 2emn s THR 203 Ca 0.30 -1.03 0.04 0.00 -1.18 0.00 0.00 61.69 59.82 2emn s THR 203 Cb -0.12 -1.78 -0.02 0.00 1.34 0.00 0.00 72.50 71.92 2emn s THR 203 CO 0.22 0.57 -0.18 -1.10 -0.54 0.00 0.00 174.62 173.58 2emn s GLN 204 N -0.04 2.59 0.00 3.99 -0.21 0.80 -2.26 119.66 124.54 2emn s GLN 204 Ca -0.07 -0.78 0.01 0.00 0.02 0.00 0.00 55.36 54.54 2emn s GLN 204 Cb -0.15 -2.32 -0.01 0.00 1.00 0.00 0.00 33.01 31.54 2emn s GLN 204 CO 0.05 0.50 -0.04 -1.12 -2.12 0.00 0.00 175.29 172.56 2emn s SER 205 N -0.42 0.43 -0.04 5.90 0.01 -1.26 -0.71 113.70 117.62 2emn s SER 205 Ca 0.04 -0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.17 2emn s SER 205 Cb -0.12 -0.03 0.03 0.00 0.21 0.00 0.00 66.02 66.11 2emn s SER 205 CO 0.02 -0.00 -0.01 0.00 0.41 0.00 0.00 173.24 173.65 2emn s ALA 206 N -0.29 0.47 -0.15 1.44 0.00 0.54 -4.38 121.76 119.38 2emn s ALA 206 Ca -0.01 0.06 -0.07 0.00 0.00 0.00 0.00 51.96 51.94 2emn s ALA 206 Cb -0.03 -0.42 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 2emn s ALA 206 CO -0.00 -0.12 0.11 -0.51 0.00 0.00 0.00 175.76 175.24 2emn s LEU 207 N 1.15 4.13 0.21 0.00 1.43 -1.26 -0.78 118.68 123.56 2emn s LEU 207 Ca -0.08 0.28 -0.05 0.00 -1.03 0.00 0.00 54.13 53.25 2emn s LEU 207 Cb -0.14 -2.03 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 2emn s LEU 207 CO -0.02 0.29 0.24 -0.94 0.23 0.00 0.00 176.35 176.16 2emn s SER 208 N -0.31 0.08 0.19 2.29 1.04 0.37 -4.87 113.70 112.49 2emn s SER 208 Ca 0.10 -1.21 0.03 0.00 0.48 0.00 0.00 55.95 55.36 2emn s SER 208 Cb -0.12 0.44 0.03 0.00 0.10 0.00 0.00 66.02 66.47 2emn s SER 208 CO 0.01 -0.93 0.25 0.29 0.98 0.00 0.00 173.24 173.84 2emn n LYS 209 N -0.29 0.94 -3.66 4.02 4.01 -1.26 0.34 118.16 122.25 2emn n LYS 209 Ca -0.00 -1.08 -0.19 0.00 -0.51 0.00 0.00 58.31 56.53 2emn n LYS 209 Cb 0.64 -0.04 -0.17 0.00 -0.51 0.00 0.00 35.03 34.96 2emn n LYS 209 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2emn s ASP 210 N -2.19 1.01 0.15 4.39 2.15 -1.26 -4.81 116.67 116.11 2emn s ASP 210 Ca 0.19 0.17 -0.21 0.00 0.43 0.00 0.00 52.55 53.12 2emn s ASP 210 Cb -0.01 0.08 0.03 0.00 -0.30 0.00 0.00 42.92 42.72 2emn s ASP 210 CO 0.12 -0.25 1.65 1.55 -0.17 0.00 0.00 175.17 178.06 2emn h PRO 211 N 8.40 -0.16 -0.11 4.34 0.13 -2.03 -1.18 132.00 141.39 2emn h PRO 211 Ca -0.13 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 2emn h PRO 211 Cb 1.12 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2emn h PRO 211 CO 0.16 -0.11 0.00 0.09 -0.23 0.00 0.00 178.00 177.91 2emn n ASN 212 N -5.34 0.11 -4.28 1.44 5.03 -1.26 -4.67 115.26 106.29 2emn n ASN 212 Ca -0.01 -1.66 -0.35 0.00 0.87 0.00 0.00 54.58 53.43 2emn n ASN 212 Cb 0.25 -0.05 -0.14 0.00 -1.02 0.00 0.00 39.78 38.82 2emn n ASN 212 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 2emn s GLU 213 N -1.87 3.16 -0.08 3.52 2.56 -0.45 -4.97 118.70 120.56 2emn s GLU 213 Ca 0.00 -0.78 -0.04 0.00 0.00 0.00 0.00 54.97 54.15 2emn s GLU 213 Cb 0.00 -3.06 -0.27 0.00 2.00 0.00 0.00 34.13 32.80 2emn s GLU 213 CO 0.00 -0.30 0.52 0.87 -0.56 0.00 0.00 175.26 175.78 2emn h LYS 214 N 8.10 0.25 -7.31 4.30 1.79 -1.83 -3.45 116.57 118.42 2emn h LYS 214 Ca -0.37 -0.43 -0.52 0.00 -2.18 0.00 0.00 60.65 57.15 2emn h LYS 214 Cb 1.14 0.16 0.14 0.00 -1.58 0.00 0.00 32.23 32.08 2emn h LYS 214 CO 0.60 1.13 0.31 1.03 -1.08 0.00 0.00 179.45 181.43 2emn s ARG 215 N -2.57 2.18 0.22 3.15 0.52 -1.26 -4.96 118.95 116.22 2emn s ARG 215 Ca -0.17 1.20 -0.30 0.00 -0.52 0.00 0.00 55.73 55.93 2emn s ARG 215 Cb 0.07 -1.89 -0.10 0.00 0.52 0.00 0.00 34.95 33.55 2emn s ARG 215 CO 0.80 -1.71 1.46 0.34 0.02 0.00 0.00 175.30 176.21 2emn s ASP 216 N -3.34 6.66 0.19 0.23 -1.08 -1.26 -4.95 116.67 113.12 2emn s ASP 216 Ca 0.62 2.62 -0.16 0.00 -0.52 0.00 0.00 52.55 55.11 2emn s ASP 216 Cb -0.18 -2.61 0.06 0.00 -1.46 0.00 0.00 42.92 38.73 2emn s ASP 216 CO 0.56 -0.72 0.80 0.00 0.52 0.00 0.00 175.17 176.33 2emn n HIS 217 N 2.81 -1.42 -3.76 -5.34 1.44 -1.26 -0.88 115.22 106.81 2emn n HIS 217 Ca 0.09 -1.15 -0.13 0.00 -2.01 0.00 0.00 57.72 54.52 2emn n HIS 217 Cb 0.40 0.57 -0.11 0.00 0.12 0.00 0.00 29.99 30.97 2emn n HIS 217 CO 0.00 0.00 0.00 1.41 -2.81 0.00 0.00 176.34 174.94 2emn s MET 218 N -2.05 0.36 -0.14 -1.40 0.00 -0.37 -4.99 119.30 110.72 2emn s MET 218 Ca 0.17 0.47 -0.04 0.00 0.00 0.00 0.00 55.69 56.29 2emn s MET 218 Cb -0.03 0.15 -0.03 0.00 0.00 0.00 0.00 34.83 34.92 2emn s MET 218 CO 0.06 -0.06 0.01 0.08 0.00 0.00 0.00 175.02 175.11 2emn s VAL 219 N 0.32 4.36 -0.08 10.11 1.01 0.15 -1.16 120.40 135.11 2emn s VAL 219 Ca -0.01 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.78 2emn s VAL 219 Cb -0.03 -2.90 0.02 0.00 0.00 0.00 0.00 36.38 33.46 2emn s VAL 219 CO -0.01 0.53 -0.09 -0.22 0.00 0.00 0.00 175.10 175.30 2emn s LEU 220 N -0.10 1.41 -0.01 3.92 2.96 0.35 -0.47 118.68 126.74 2emn s LEU 220 Ca 0.04 -0.27 0.05 0.00 -0.22 0.00 0.00 54.13 53.73 2emn s LEU 220 Cb -0.13 -0.76 -0.03 0.00 0.50 0.00 0.00 46.19 45.77 2emn s LEU 220 CO 0.02 -0.04 -0.15 -0.22 -1.32 0.00 0.00 176.35 174.65 2emn s LEU 221 N 1.08 2.74 -0.16 -0.68 2.96 0.04 -1.40 118.68 123.26 2emn s LEU 221 Ca -0.07 -0.26 -0.10 0.00 -0.22 0.00 0.00 54.13 53.48 2emn s LEU 221 Cb -0.14 -1.58 0.06 0.00 0.50 0.00 0.00 46.19 45.02 2emn s LEU 221 CO -0.01 0.31 0.40 -0.70 -1.32 0.00 0.00 176.35 175.03 2emn s GLU 222 N -1.04 0.39 -0.13 1.98 2.12 -0.50 -0.34 118.70 121.18 2emn s GLU 222 Ca 0.13 0.74 -0.00 0.00 0.36 0.00 0.00 54.97 56.20 2emn s GLU 222 Cb -0.11 0.00 -0.01 0.00 0.26 0.00 0.00 34.13 34.27 2emn s GLU 222 CO 0.03 -0.14 -0.13 -0.06 -0.54 0.00 0.00 175.26 174.41 2emn s PHE 223 N 1.23 2.81 -0.03 5.30 0.08 0.12 -0.28 117.98 127.20 2emn s PHE 223 Ca -0.08 -0.65 0.01 0.00 0.12 0.00 0.00 56.93 56.33 2emn s PHE 223 Cb -0.08 -1.84 0.02 0.00 -0.57 0.00 0.00 43.02 40.56 2emn s PHE 223 CO -0.11 -0.21 -0.01 0.08 -0.10 0.00 0.00 175.22 174.87 2emn s VAL 224 N 0.34 0.22 -0.02 -0.44 1.01 -0.71 -0.14 120.40 120.67 2emn s VAL 224 Ca -0.11 0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.92 2emn s VAL 224 Cb -0.16 -0.30 0.01 0.00 0.00 0.00 0.00 36.38 35.93 2emn s VAL 224 CO 0.06 0.15 -0.02 0.42 0.00 0.00 0.00 175.10 175.71 2emn s THR 225 N 0.91 0.25 0.52 3.92 -4.23 -0.81 -2.00 115.64 114.20 2emn s THR 225 Ca -0.10 -0.03 -0.18 0.00 -1.18 0.00 0.00 61.69 60.20 2emn s THR 225 Cb -0.13 -0.29 -0.07 0.00 1.34 0.00 0.00 72.50 73.36 2emn s THR 225 CO -0.01 0.12 1.02 0.00 -0.54 0.00 0.00 174.62 175.21 2emn s ALA 226 N 0.54 2.90 0.31 3.99 0.00 0.06 -0.98 121.76 128.59 2emn s ALA 226 Ca -0.06 0.40 -0.13 0.00 0.00 0.00 0.00 51.96 52.18 2emn s ALA 226 Cb -0.09 -3.20 0.05 0.00 0.00 0.00 0.00 23.12 19.89 2emn s ALA 226 CO -0.01 -0.39 0.67 0.00 0.00 0.00 0.00 175.76 176.03 2emn n ALA 227 N -1.42 -1.54 -0.67 0.00 0.00 -0.64 -4.62 120.51 111.62 2emn n ALA 227 Ca 0.08 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.49 2emn n ALA 227 Cb 0.53 0.80 0.00 0.00 0.00 0.00 0.00 19.45 20.78 2emn n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2emn n GLY 228 N -0.46 0.97 0.00 0.00 0.00 -1.26 -1.90 105.19 102.54 2emn n GLY 228 Ca -0.07 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.50 2emn n GLY 228 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71