#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dug s ASP 5 N 0.00 2.90 0.03 1.62 -0.00 -1.26 -4.71 116.67 115.25 3dug s ASP 5 Ca 0.00 -0.49 0.09 0.00 -0.00 0.00 0.00 52.55 52.15 3dug s ASP 5 Cb 0.00 -0.87 -0.03 0.00 -0.00 0.00 0.00 42.92 42.02 3dug s ASP 5 CO 0.00 0.22 -0.26 -0.36 -0.00 0.00 0.00 175.17 174.77 3dug s PHE 6 N -0.06 2.27 -0.21 4.23 0.08 -0.78 -2.26 117.98 121.25 3dug s PHE 6 Ca -0.06 -0.41 0.01 0.00 0.12 0.00 0.00 56.93 56.59 3dug s PHE 6 Cb -0.14 -1.38 0.04 0.00 -0.57 0.00 0.00 43.02 40.97 3dug s PHE 6 CO 0.04 0.08 -0.11 -1.17 -0.10 0.00 0.00 175.22 173.96 3dug s LEU 7 N -1.07 2.52 -0.40 -0.37 1.98 -0.91 -0.44 118.68 119.99 3dug s LEU 7 Ca 0.11 -0.99 -0.16 0.00 -2.89 0.00 0.00 54.13 50.21 3dug s LEU 7 Cb -0.10 -1.32 0.01 0.00 0.66 0.00 0.00 46.19 45.44 3dug s LEU 7 CO 0.01 -0.15 0.35 -0.63 -1.89 0.00 0.00 176.35 174.05 3dug s ILE 8 N 1.32 5.19 -0.88 6.68 1.01 -0.42 -0.84 121.20 133.26 3dug s ILE 8 Ca -0.02 -0.39 -0.21 0.00 0.00 0.00 0.00 60.65 60.03 3dug s ILE 8 Cb -0.17 -3.93 0.10 0.00 0.01 0.00 0.00 42.46 38.47 3dug s ILE 8 CO -0.08 -0.28 1.16 -0.54 0.00 0.00 0.00 174.94 175.19 3dug s LYS 9 N 1.90 3.48 0.39 2.79 -0.14 0.84 -3.14 119.74 125.86 3dug s LYS 9 Ca 0.09 -1.39 0.07 0.00 -1.36 0.00 0.00 55.97 53.38 3dug s LYS 9 Cb -0.18 -4.83 0.00 0.00 -1.68 0.00 0.00 37.83 31.14 3dug s LYS 9 CO 0.12 -1.88 0.53 0.45 -0.76 0.00 0.00 175.35 173.80 3dug s SER 10 N 3.91 5.75 0.27 2.83 0.15 -1.26 -0.13 113.70 125.21 3dug s SER 10 Ca 0.33 -0.35 0.11 0.00 0.70 0.00 0.00 55.95 56.74 3dug s SER 10 Cb -0.07 -0.86 0.35 0.00 -1.71 0.00 0.00 66.02 63.73 3dug s SER 10 CO -0.05 -0.64 1.61 0.50 1.20 0.00 0.00 173.24 175.86 3dug h LYS 11 N 0.75 0.00 0.00 5.44 3.64 -1.47 -3.45 116.57 121.47 3dug h LYS 11 Ca -0.42 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 3dug h LYS 11 Cb 1.27 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 3dug h LYS 11 CO 0.48 0.62 0.00 0.41 -2.27 0.00 0.00 179.45 178.70 3dug n GLY 12 N 0.28 3.34 3.49 5.01 0.00 -1.26 -4.85 105.19 111.20 3dug n GLY 12 Ca -0.01 -0.68 -0.32 0.00 0.00 0.00 0.00 46.02 45.01 3dug n GLY 12 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3dug s TYR 13 N -2.00 2.66 -0.22 1.61 1.13 0.86 -0.82 117.35 120.57 3dug s TYR 13 Ca 0.00 -0.19 -0.29 0.00 -1.41 0.00 0.00 57.07 55.18 3dug s TYR 13 Cb 0.00 -1.54 -0.00 0.00 -1.10 0.00 0.00 41.96 39.32 3dug s TYR 13 CO 0.00 0.25 1.18 -1.17 -2.51 0.00 0.00 175.55 173.31 3dug s LEU 14 N -1.22 4.08 -0.29 -3.49 2.96 0.73 0.57 118.68 122.02 3dug s LEU 14 Ca 0.14 1.45 -0.29 0.00 -0.22 0.00 0.00 54.13 55.22 3dug s LEU 14 Cb -0.11 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.04 3dug s LEU 14 CO 0.04 -0.80 1.44 -0.62 -1.32 0.00 0.00 176.35 175.09 3dug s ASP 15 N 1.85 6.50 0.00 3.68 -1.08 0.84 -4.73 116.67 123.73 3dug s ASP 15 Ca 0.51 1.29 0.19 0.00 -0.52 0.00 0.00 52.55 54.03 3dug s ASP 15 Cb -0.18 -2.54 0.86 0.00 -1.46 0.00 0.00 42.92 39.60 3dug s ASP 15 CO 0.14 -1.21 1.62 0.00 0.52 0.00 0.00 175.17 176.23 3dug n ILE 16 N 6.44 0.62 -0.11 4.11 0.00 -1.26 -1.22 119.36 127.94 3dug n ILE 16 Ca 0.17 0.16 -0.25 0.00 0.00 0.00 0.00 62.75 62.83 3dug n ILE 16 Cb 0.46 -0.82 -0.11 0.00 0.00 0.00 0.00 39.64 39.17 3dug n ILE 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3dug n GLN 17 N -1.47 0.60 0.04 9.51 1.13 -1.26 -4.59 117.38 121.35 3dug n GLN 17 Ca 0.05 0.39 -0.19 0.00 -1.94 0.00 0.00 57.00 55.32 3dug n GLN 17 Cb 0.22 -1.63 -0.14 0.00 0.11 0.00 0.00 30.24 28.79 3dug n GLN 17 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 3dug h THR 18 N -0.81 0.91 0.00 5.09 1.35 -1.99 -3.48 112.91 113.97 3dug h THR 18 Ca -0.51 -2.58 0.00 0.00 -0.55 0.00 0.00 66.41 62.77 3dug h THR 18 Cb 1.54 2.65 0.00 0.00 -1.73 0.00 0.00 68.15 70.61 3dug h THR 18 CO -0.25 0.81 0.00 0.61 -0.25 0.00 0.00 175.52 176.44 3dug n GLY 19 N 1.80 0.79 3.89 5.82 0.00 -0.36 -5.09 105.19 112.03 3dug n GLY 19 Ca -0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 3dug n GLY 19 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3dug s GLU 20 N -0.91 3.70 -0.38 1.61 2.56 -1.22 -4.84 118.70 119.22 3dug s GLU 20 Ca 0.00 0.08 -0.22 0.00 0.00 0.00 0.00 54.97 54.83 3dug s GLU 20 Cb 0.00 -2.74 0.01 0.00 2.00 0.00 0.00 34.13 33.40 3dug s GLU 20 CO 0.00 0.37 0.71 0.42 -0.56 0.00 0.00 175.26 176.20 3dug s ILE 21 N -1.78 4.80 -0.11 -3.70 -1.09 -1.26 -0.11 121.20 117.95 3dug s ILE 21 Ca 0.44 0.64 -0.15 0.00 -2.23 0.00 0.00 60.65 59.35 3dug s ILE 21 Cb -0.12 -4.16 -0.05 0.00 -1.58 0.00 0.00 42.46 36.56 3dug s ILE 21 CO 0.24 -0.42 0.38 -0.63 -1.23 0.00 0.00 174.94 173.27 3dug s ILE 22 N 2.92 5.22 -0.63 2.92 -1.09 0.19 -4.85 121.20 125.89 3dug s ILE 22 Ca 0.27 0.74 -0.21 0.00 -2.23 0.00 0.00 60.65 59.22 3dug s ILE 22 Cb -0.14 -3.71 0.09 0.00 -1.58 0.00 0.00 42.46 37.12 3dug s ILE 22 CO 0.17 0.41 0.84 -0.75 -1.23 0.00 0.00 174.94 174.38 3dug s LYS 23 N 0.19 3.08 0.30 2.79 2.20 -1.26 -0.10 119.74 126.94 3dug s LYS 23 Ca 0.21 -1.06 -0.09 0.00 -0.36 0.00 0.00 55.97 54.67 3dug s LYS 23 Cb -0.14 -4.25 0.00 0.00 -1.51 0.00 0.00 37.83 31.93 3dug s LYS 23 CO 0.08 -1.69 0.49 0.00 -0.36 0.00 0.00 175.35 173.87 3dug s ALA 24 N 3.42 0.17 0.22 3.13 0.00 -1.26 -4.94 121.76 122.50 3dug s ALA 24 Ca 0.17 -1.15 0.08 0.00 0.00 0.00 0.00 51.96 51.06 3dug s ALA 24 Cb -0.20 1.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.96 3dug s ALA 24 CO 0.08 -0.83 0.02 -0.51 0.00 0.00 0.00 175.76 174.52 3dug s ASP 25 N -3.11 4.77 -0.13 0.00 1.01 -0.58 -4.47 116.67 114.16 3dug s ASP 25 Ca 0.26 -0.48 0.02 0.00 0.71 0.00 0.00 52.55 53.06 3dug s ASP 25 Cb -0.01 -0.99 0.01 0.00 1.01 0.00 0.00 42.92 42.94 3dug s ASP 25 CO 0.14 0.04 -0.21 -0.76 0.21 0.00 0.00 175.17 174.58 3dug s LEU 26 N -3.35 2.05 -0.25 1.23 1.43 -1.19 -0.76 118.68 117.84 3dug s LEU 26 Ca 0.30 -0.57 -0.11 0.00 -1.03 0.00 0.00 54.13 52.71 3dug s LEU 26 Cb -0.08 -1.39 -0.05 0.00 0.03 0.00 0.00 46.19 44.71 3dug s LEU 26 CO 0.20 0.07 0.21 -0.22 0.23 0.00 0.00 176.35 176.84 3dug s LEU 27 N 0.82 4.10 -0.23 1.79 2.96 0.15 -1.29 118.68 126.96 3dug s LEU 27 Ca -0.08 0.14 -0.01 0.00 -0.22 0.00 0.00 54.13 53.96 3dug s LEU 27 Cb -0.16 -2.18 0.02 0.00 0.50 0.00 0.00 46.19 44.38 3dug s LEU 27 CO -0.01 0.01 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.32 3dug s ILE 28 N 1.29 2.81 -0.03 6.68 -1.09 0.42 -0.31 121.20 130.98 3dug s ILE 28 Ca 0.09 -0.94 -0.04 0.00 -2.23 0.00 0.00 60.65 57.53 3dug s ILE 28 Cb -0.14 -2.38 0.01 0.00 -1.58 0.00 0.00 42.46 38.36 3dug s ILE 28 CO 0.07 0.28 0.10 0.00 -1.23 0.00 0.00 174.94 174.15 3dug s ARG 29 N 1.34 0.21 -1.46 2.79 1.70 -0.80 -1.86 118.95 120.86 3dug s ARG 29 Ca 0.02 -0.03 -0.09 0.00 -0.47 0.00 0.00 55.73 55.15 3dug s ARG 29 Cb -0.16 0.09 0.04 0.00 -0.57 0.00 0.00 34.95 34.35 3dug s ARG 29 CO -0.06 -0.04 0.89 0.09 -1.08 0.00 0.00 175.30 175.11 3dug n ASN 30 N 2.60 -5.58 -0.41 -2.89 3.02 -1.26 -2.00 115.26 108.73 3dug n ASN 30 Ca -0.15 -0.52 -0.05 0.00 -0.03 0.00 0.00 54.58 53.82 3dug n ASN 30 Cb 0.58 -4.46 -0.02 0.00 -0.61 0.00 0.00 39.78 35.27 3dug n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dug n GLY 31 N -1.69 0.67 3.55 7.41 0.00 -1.26 -5.00 105.19 108.87 3dug n GLY 31 Ca -0.02 -0.15 -0.24 0.00 0.00 0.00 0.00 46.02 45.62 3dug n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dug s LYS 32 N -2.04 1.95 -0.59 1.61 3.01 -0.85 -0.45 119.74 122.38 3dug s LYS 32 Ca 0.00 -1.61 -0.25 0.00 -1.01 0.00 0.00 55.97 53.10 3dug s LYS 32 Cb 0.00 -1.94 0.04 0.00 -1.01 0.00 0.00 37.83 34.92 3dug s LYS 32 CO 0.00 0.35 1.00 0.42 0.51 0.00 0.00 175.35 177.63 3dug s ILE 33 N -2.42 4.28 -0.06 2.17 1.01 0.78 -1.91 121.20 125.04 3dug s ILE 33 Ca 0.31 0.26 -0.14 0.00 0.00 0.00 0.00 60.65 61.07 3dug s ILE 33 Cb -0.06 -4.62 -0.30 0.00 0.01 0.00 0.00 42.46 37.49 3dug s ILE 33 CO 0.17 -1.26 0.69 0.00 0.00 0.00 0.00 174.94 174.54 3dug h ALA 34 N 9.44 0.10 -3.74 9.38 0.00 -0.95 0.84 119.26 134.34 3dug h ALA 34 Ca -0.27 -1.06 -0.32 0.00 0.00 0.00 0.00 54.91 53.27 3dug h ALA 34 Cb 1.07 0.40 -0.30 0.00 0.00 0.00 0.00 17.79 18.96 3dug h ALA 34 CO 1.13 0.87 -0.75 -1.21 0.00 0.00 0.00 179.25 179.29 3dug s GLU 35 N -2.54 0.37 -0.11 0.00 2.02 -1.08 -4.60 118.70 112.76 3dug s GLU 35 Ca -0.16 -0.09 0.03 0.00 0.02 0.00 0.00 54.97 54.77 3dug s GLU 35 Cb 0.05 -0.41 -0.00 0.00 0.10 0.00 0.00 34.13 33.86 3dug s GLU 35 CO 0.83 0.02 -0.21 0.42 0.02 0.00 0.00 175.26 176.35 3dug s ILE 36 N 0.26 2.38 -4.39 -1.63 1.01 -1.26 0.31 121.20 117.89 3dug s ILE 36 Ca -0.03 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.72 3dug s ILE 36 Cb -0.06 -1.94 0.00 0.00 0.01 0.00 0.00 42.46 40.47 3dug s ILE 36 CO -0.00 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.09 3dug n GLY 37 N 3.51 0.82 3.56 6.18 0.00 0.06 -4.92 105.19 114.39 3dug n GLY 37 Ca -0.19 -1.81 -0.39 0.00 0.00 0.00 0.00 46.02 43.63 3dug n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dug s LYS 38 N -1.75 3.27 -0.17 1.61 1.02 -1.26 -1.52 119.74 120.93 3dug s LYS 38 Ca 0.00 -0.60 -0.08 0.00 0.02 0.00 0.00 55.97 55.31 3dug s LYS 38 Cb 0.00 -4.87 -0.04 0.00 -0.52 0.00 0.00 37.83 32.40 3dug s LYS 38 CO 0.00 -2.37 0.11 0.42 -0.92 0.00 0.00 175.35 172.59 3dug s ILE 39 N 6.13 5.21 0.04 2.17 1.09 -1.26 -5.07 121.20 129.52 3dug s ILE 39 Ca 0.47 0.11 -0.30 0.00 -1.10 0.00 0.00 60.65 59.83 3dug s ILE 39 Cb -0.04 -3.34 -0.07 0.00 -1.06 0.00 0.00 42.46 37.95 3dug s ILE 39 CO 0.02 0.50 1.56 0.21 -0.10 0.00 0.00 174.94 177.13 3dug s ASN 40 N -0.05 6.69 -0.89 3.58 2.47 -1.26 -4.85 114.94 120.63 3dug s ASN 40 Ca 0.09 2.35 -0.25 0.00 0.42 0.00 0.00 52.86 55.46 3dug s ASN 40 Cb -0.12 -2.56 -0.09 0.00 -1.45 0.00 0.00 41.25 37.04 3dug s ASN 40 CO 0.00 -0.83 2.11 0.28 -3.72 0.00 0.00 177.10 174.94 3dug s THR 41 N 2.57 3.29 0.00 -5.21 -1.32 -1.26 -4.79 115.64 108.93 3dug s THR 41 Ca 0.70 -0.27 0.00 0.00 -1.21 0.00 0.00 61.69 60.91 3dug s THR 41 Cb -0.37 -3.71 0.00 0.00 -1.51 0.00 0.00 72.50 66.91 3dug s THR 41 CO 0.30 -0.61 0.09 1.17 -2.21 0.00 0.00 174.62 173.36 3dug n LYS 42 N 8.78 0.00 -0.03 7.08 4.81 -1.26 -4.91 118.16 132.63 3dug n LYS 42 Ca 0.43 0.23 -0.04 0.00 -0.87 0.00 0.00 58.31 58.06 3dug n LYS 42 Cb 0.46 -0.79 -0.01 0.00 0.02 0.00 0.00 35.03 34.70 3dug n LYS 42 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3dug n ASP 43 N -1.20 1.31 -1.17 3.14 9.92 -1.26 -5.08 116.55 122.22 3dug n ASP 43 Ca 0.00 0.21 0.00 0.00 -0.53 0.00 0.00 54.79 54.47 3dug n ASP 43 Cb 0.00 -0.52 0.00 0.00 -0.64 0.00 0.00 41.12 39.96 3dug n ASP 43 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3dug n ALA 44 N -3.78 0.00 -1.15 2.24 0.00 -1.26 -5.07 120.51 111.48 3dug n ALA 44 Ca -0.07 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.08 3dug n ALA 44 Cb 0.25 0.00 0.15 0.00 0.00 0.00 0.00 19.45 19.85 3dug n ALA 44 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3dug s THR 45 N -0.82 2.55 -0.19 0.00 -4.23 -0.96 -4.69 115.64 107.30 3dug s THR 45 Ca 0.00 0.18 -0.02 0.00 -1.18 0.00 0.00 61.69 60.66 3dug s THR 45 Cb 0.00 -2.63 -0.01 0.00 1.34 0.00 0.00 72.50 71.20 3dug s THR 45 CO 0.00 -0.23 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.08 3dug s VAL 46 N -2.90 3.18 -0.63 2.29 1.01 -1.26 -2.15 120.40 119.94 3dug s VAL 46 Ca 0.64 -0.57 -0.22 0.00 0.00 0.00 0.00 61.98 61.82 3dug s VAL 46 Cb -0.18 -2.41 0.07 0.00 0.00 0.00 0.00 36.38 33.85 3dug s VAL 46 CO 0.57 0.46 0.91 -0.63 0.00 0.00 0.00 175.10 176.42 3dug s ILE 47 N 1.11 4.41 -0.54 2.22 1.01 -0.02 -4.93 121.20 124.47 3dug s ILE 47 Ca 0.01 -0.33 -0.26 0.00 0.00 0.00 0.00 60.65 60.07 3dug s ILE 47 Cb -0.15 -4.62 0.03 0.00 0.01 0.00 0.00 42.46 37.74 3dug s ILE 47 CO -0.02 -1.33 1.04 -0.55 0.00 0.00 0.00 174.94 174.08 3dug s SER 48 N 3.48 6.43 -0.51 3.58 0.15 -1.26 -0.11 113.70 125.47 3dug s SER 48 Ca 0.22 -0.03 0.08 0.00 0.70 0.00 0.00 55.95 56.91 3dug s SER 48 Cb -0.17 -2.49 0.30 0.00 -1.71 0.00 0.00 66.02 61.95 3dug s SER 48 CO 0.11 -1.29 0.76 0.00 1.20 0.00 0.00 173.24 174.03 3dug n ILE 49 N 6.47 1.35 0.29 6.45 3.06 0.81 -4.93 119.36 132.86 3dug n ILE 49 Ca 0.06 -4.94 0.17 0.00 -2.50 0.00 0.00 62.75 55.54 3dug n ILE 49 Cb 0.48 -1.41 0.66 0.00 0.54 0.00 0.00 39.64 39.91 3dug n ILE 49 CO 0.00 0.00 0.00 -0.65 -2.50 0.00 0.00 176.55 173.40 3dug h PRO 50 N 3.49 0.00 -0.02 9.51 0.11 -1.85 -2.97 132.00 140.27 3dug h PRO 50 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 3dug h PRO 50 Cb 0.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.84 3dug h PRO 50 CO 0.67 0.00 -0.17 -0.25 -0.21 0.00 0.00 178.00 178.04 3dug n ASP 51 N -2.98 2.14 -4.61 -2.05 9.92 -1.26 -3.38 116.55 114.33 3dug n ASP 51 Ca 0.01 -1.57 -0.34 0.00 -0.53 0.00 0.00 54.79 52.35 3dug n ASP 51 Cb 0.30 0.23 -0.10 0.00 -0.64 0.00 0.00 41.12 40.90 3dug n ASP 51 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 3dug s LEU 52 N -1.82 3.73 0.11 0.64 1.43 -1.12 -4.84 118.68 116.80 3dug s LEU 52 Ca 0.18 0.04 -0.30 0.00 -1.03 0.00 0.00 54.13 53.02 3dug s LEU 52 Cb 0.15 -1.94 -0.06 0.00 0.03 0.00 0.00 46.19 44.37 3dug s LEU 52 CO 0.33 0.16 1.00 -0.63 0.23 0.00 0.00 176.35 177.44 3dug s ILE 53 N 0.42 4.40 -0.12 -0.59 1.09 -0.85 -2.34 121.20 123.21 3dug s ILE 53 Ca 0.02 1.96 -0.10 0.00 -1.10 0.00 0.00 60.65 61.43 3dug s ILE 53 Cb -0.13 -4.25 -0.05 0.00 -1.06 0.00 0.00 42.46 36.97 3dug s ILE 53 CO 0.01 0.29 0.22 -0.76 -0.10 0.00 0.00 174.94 174.59 3dug s LEU 54 N 0.08 4.35 0.19 2.97 1.02 -0.00 -1.26 118.68 126.02 3dug s LEU 54 Ca 0.48 0.53 0.06 0.00 0.02 0.00 0.00 54.13 55.22 3dug s LEU 54 Cb -0.24 -2.23 -0.05 0.00 0.02 0.00 0.00 46.19 43.69 3dug s LEU 54 CO 0.31 0.29 -0.11 0.27 0.02 0.00 0.00 176.35 177.13 3dug s ILE 55 N -0.50 1.45 0.59 -0.59 -4.36 0.81 -0.19 121.20 118.41 3dug s ILE 55 Ca 0.16 -2.13 -0.19 0.00 -0.26 0.00 0.00 60.65 58.23 3dug s ILE 55 Cb -0.13 -2.01 -0.03 0.00 1.25 0.00 0.00 42.46 41.54 3dug s ILE 55 CO 0.05 -0.62 1.19 -2.84 0.24 0.00 0.00 174.94 172.96 3dug s PRO 56 N -3.71 2.99 0.26 0.37 0.02 -1.26 -0.38 135.00 133.29 3dug s PRO 56 Ca 0.21 1.77 -0.31 0.00 0.02 0.00 0.00 61.00 62.69 3dug s PRO 56 Cb 0.01 -1.94 -0.13 0.00 0.02 0.00 0.00 34.50 32.46 3dug s PRO 56 CO 0.05 -1.17 1.43 0.41 -0.33 0.00 0.00 177.00 177.38 3dug n GLY 57 N 0.40 0.85 3.84 0.52 0.00 0.16 -4.49 105.19 106.48 3dug n GLY 57 Ca 0.13 0.48 -0.32 0.00 0.00 0.00 0.00 46.02 46.31 3dug n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dug s LEU 58 N -0.08 3.71 0.06 0.99 1.43 -0.62 -4.69 118.68 119.48 3dug s LEU 58 Ca 0.66 1.55 0.07 0.00 -1.03 0.00 0.00 54.13 55.39 3dug s LEU 58 Cb -0.62 -4.47 -0.03 0.00 0.03 0.00 0.00 46.19 41.11 3dug s LEU 58 CO 0.50 -0.52 -0.20 -0.04 0.23 0.00 0.00 176.35 176.32 3dug s MET 59 N -3.85 1.26 -0.12 1.70 -1.94 0.68 -1.12 119.30 115.91 3dug s MET 59 Ca 0.59 -1.00 0.02 0.00 -1.71 0.00 0.00 55.69 53.58 3dug s MET 59 Cb -0.10 -1.42 0.01 0.00 2.01 0.00 0.00 34.83 35.34 3dug s MET 59 CO 0.27 0.35 -0.17 0.34 -0.01 0.00 0.00 175.02 175.80 3dug s ASP 60 N -1.43 2.63 0.00 3.03 -1.08 -1.20 -4.69 116.67 113.93 3dug s ASP 60 Ca 0.07 -0.48 0.28 0.00 -0.52 0.00 0.00 52.55 51.89 3dug s ASP 60 Cb -0.09 -1.19 0.99 0.00 -1.46 0.00 0.00 42.92 41.17 3dug s ASP 60 CO 0.03 0.03 1.71 -1.54 0.52 0.00 0.00 175.17 175.91 3dug n SER 61 N 4.20 1.57 -3.32 -0.34 3.41 0.93 -0.45 113.62 119.62 3dug n SER 61 Ca -0.19 -1.51 -0.12 0.00 -0.26 0.00 0.00 58.87 56.79 3dug n SER 61 Cb 0.51 0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.41 3dug n SER 61 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3dug s HIS 62 N -2.02 -0.70 0.22 7.33 5.65 -1.23 -4.62 115.29 119.92 3dug s HIS 62 Ca 0.37 -0.53 0.06 0.00 0.25 0.00 0.00 55.06 55.21 3dug s HIS 62 Cb 0.21 -0.20 -0.05 0.00 -1.18 0.00 0.00 32.58 31.36 3dug s HIS 62 CO 0.34 -1.03 -0.07 0.14 -0.65 0.00 0.00 174.74 173.46 3dug s VAL 63 N 1.54 1.43 -0.47 0.89 -7.23 -0.72 -1.46 120.40 114.38 3dug s VAL 63 Ca 0.17 -2.11 0.05 0.00 -1.81 0.00 0.00 61.98 58.28 3dug s VAL 63 Cb -0.12 -2.21 0.20 0.00 0.56 0.00 0.00 36.38 34.81 3dug s VAL 63 CO -0.04 -0.46 0.44 1.41 -0.31 0.00 0.00 175.10 176.14 3dug n HIS 64 N -0.42 0.23 -0.06 2.82 8.25 0.23 -1.20 115.22 125.07 3dug n HIS 64 Ca -0.07 -3.60 -0.15 0.00 -0.26 0.00 0.00 57.72 53.65 3dug n HIS 64 Cb 0.62 -0.10 -0.06 0.00 1.12 0.00 0.00 29.99 31.57 3dug n HIS 64 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3dug h ILE 65 N 3.79 1.32 -3.36 1.59 2.04 -1.92 -3.40 117.51 117.57 3dug h ILE 65 Ca 0.19 -1.64 -0.58 0.00 1.00 0.00 0.00 64.86 63.83 3dug h ILE 65 Cb 0.86 1.83 -0.08 0.00 -0.74 0.00 0.00 36.82 38.68 3dug h ILE 65 CO 0.49 0.51 -0.07 0.54 0.00 0.00 0.00 178.15 179.62 3dug s VAL 66 N -4.06 5.14 0.00 1.67 0.11 -1.26 -3.78 120.40 118.22 3dug s VAL 66 Ca -0.12 1.04 0.00 0.00 -2.93 0.00 0.00 61.98 59.97 3dug s VAL 66 Cb 0.08 -3.86 0.00 0.00 -1.53 0.00 0.00 36.38 31.06 3dug s VAL 66 CO 0.84 0.27 0.00 0.61 -3.33 0.00 0.00 175.10 173.49 3dug n GLY 67 N 3.39 4.02 3.65 6.54 0.00 -0.77 -4.85 105.19 117.16 3dug n GLY 67 Ca -0.05 -0.45 -0.43 0.00 0.00 0.00 0.00 46.02 45.09 3dug n GLY 67 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dug s ASN 68 N 0.00 6.82 0.00 1.61 3.84 -1.26 -4.58 114.94 121.37 3dug s ASN 68 Ca 0.00 1.44 0.24 0.00 0.21 0.00 0.00 52.86 54.75 3dug s ASN 68 Cb 0.00 -2.54 0.34 0.00 -0.55 0.00 0.00 41.25 38.50 3dug s ASN 68 CO 0.00 -0.91 1.35 0.47 -2.79 0.00 0.00 177.10 175.22 3dug n ASP 69 N 7.09 3.00 -4.74 -4.21 8.00 -1.26 -4.94 116.55 119.50 3dug n ASP 69 Ca 0.14 -1.96 -0.41 0.00 0.71 0.00 0.00 54.79 53.28 3dug n ASP 69 Cb 0.46 -0.08 -0.04 0.00 -0.02 0.00 0.00 41.12 41.44 3dug n ASP 69 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3dug s SER 70 N -1.83 7.22 0.46 -2.24 0.01 -1.26 -5.05 113.70 111.02 3dug s SER 70 Ca 0.32 2.14 0.05 0.00 1.31 0.00 0.00 55.95 59.77 3dug s SER 70 Cb 0.21 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.80 3dug s SER 70 CO 0.31 -0.25 0.11 -0.54 0.41 0.00 0.00 173.24 173.28 3dug s LYS 71 N -0.44 2.15 0.00 12.44 -0.14 -1.26 -4.90 119.74 127.59 3dug s LYS 71 Ca 0.50 -2.11 0.00 0.00 -1.36 0.00 0.00 55.97 52.99 3dug s LYS 71 Cb -0.30 -1.76 0.00 0.00 -1.68 0.00 0.00 37.83 34.08 3dug s LYS 71 CO 0.36 -0.24 0.00 0.41 -0.76 0.00 0.00 175.35 175.12 3dug n GLY 72 N -1.24 -0.49 0.22 -3.33 0.00 -1.26 -4.43 105.19 94.67 3dug n GLY 72 Ca -0.08 -1.78 -0.02 0.00 0.00 0.00 0.00 46.02 44.14 3dug n GLY 72 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3dug h GLU 73 N 0.00 0.38 0.00 1.61 5.08 -2.03 -2.97 114.58 116.65 3dug h GLU 73 Ca 0.00 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 3dug h GLU 73 Cb 0.00 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3dug h GLU 73 CO 0.00 0.63 0.00 1.05 -1.00 0.00 0.00 179.01 179.69 3dug h GLU 74 N 0.33 0.00 -0.37 2.33 4.11 -2.01 -2.58 114.58 116.40 3dug h GLU 74 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.48 3dug h GLU 74 Cb 0.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 3dug h GLU 74 CO 0.05 0.00 0.00 -1.13 0.07 0.00 0.00 179.01 178.00 3dug n SER 75 N -2.43 3.06 0.06 3.06 3.41 -1.12 -4.70 113.62 114.97 3dug n SER 75 Ca -0.01 -1.91 -0.03 0.00 -0.26 0.00 0.00 58.87 56.67 3dug n SER 75 Cb 0.07 -0.24 0.22 0.00 -0.26 0.00 0.00 64.21 64.00 3dug n SER 75 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 3dug h ILE 76 N 3.03 1.28 -0.27 -1.33 6.09 -1.61 -3.06 117.51 121.65 3dug h ILE 76 Ca 0.00 -1.39 0.00 0.00 -1.37 0.00 0.00 64.86 62.10 3dug h ILE 76 Cb 0.79 1.53 0.00 0.00 0.47 0.00 0.00 36.82 39.61 3dug h ILE 76 CO 0.00 0.42 0.00 0.00 -3.07 0.00 0.00 178.15 175.50 3dug n ALA 77 N -2.48 2.90 -1.74 0.18 0.00 -1.26 -5.01 120.51 113.10 3dug n ALA 77 Ca -0.01 -2.18 -0.42 0.00 0.00 0.00 0.00 53.44 50.83 3dug n ALA 77 Cb 0.44 -0.68 -0.00 0.00 0.00 0.00 0.00 19.45 19.21 3dug n ALA 77 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3dug n ASP 78 N -0.40 3.31 -4.84 0.00 8.00 -1.16 -5.01 116.55 116.44 3dug n ASP 78 Ca 0.20 1.21 -0.29 0.00 0.71 0.00 0.00 54.79 56.62 3dug n ASP 78 Cb 0.84 -1.55 0.09 0.00 -0.02 0.00 0.00 41.12 40.48 3dug n ASP 78 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3dug s SER 79 N -0.17 4.42 0.60 -2.24 1.04 -1.26 -4.94 113.70 111.15 3dug s SER 79 Ca 0.55 1.03 0.36 0.00 0.48 0.00 0.00 55.95 58.38 3dug s SER 79 Cb -0.52 -1.67 1.92 0.00 0.10 0.00 0.00 66.02 65.85 3dug s SER 79 CO 0.62 -1.99 2.22 0.77 0.98 0.00 0.00 173.24 175.84 3dug h SER 80 N -1.11 0.00 0.33 7.02 4.64 -2.02 -2.38 113.55 120.04 3dug h SER 80 Ca -0.47 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.83 3dug h SER 80 Cb 1.30 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3dug h SER 80 CO 0.63 0.03 -0.10 0.45 -0.87 0.00 0.00 176.83 176.96 3dug h HIS 81 N 0.00 0.00 -0.49 4.77 3.86 -2.00 -2.00 115.15 119.30 3dug h HIS 81 Ca -0.00 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.14 3dug h HIS 81 Cb 0.17 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.62 3dug h HIS 81 CO 0.00 0.10 0.00 1.98 0.86 0.00 0.00 177.93 180.88 3dug h MET 82 N 0.00 0.81 -0.04 2.45 -1.53 -1.80 -1.66 114.93 113.16 3dug h MET 82 Ca -0.00 -0.22 -0.04 0.00 -3.44 0.00 0.00 59.70 56.01 3dug h MET 82 Cb 0.30 -0.09 -0.01 0.00 -0.55 0.00 0.00 31.60 31.25 3dug h MET 82 CO 0.01 0.81 -0.15 0.78 0.14 0.00 0.00 176.91 178.51 3dug h GLY 83 N 0.98 0.06 0.98 1.39 0.00 -1.52 -1.42 103.07 103.54 3dug h GLY 83 Ca 0.15 -0.03 -0.17 0.00 0.00 0.00 0.00 47.33 47.27 3dug h GLY 83 CO 0.02 0.03 -0.60 -0.84 0.00 0.00 0.00 176.54 175.15 3dug h THR 84 N 0.06 1.33 -0.41 4.70 2.02 -1.35 -1.75 112.91 117.50 3dug h THR 84 Ca 0.01 -1.87 0.03 0.00 0.77 0.00 0.00 66.41 65.35 3dug h THR 84 Cb 0.30 2.12 -0.03 0.00 -1.74 0.00 0.00 68.15 68.79 3dug h THR 84 CO 0.02 0.58 0.22 0.58 0.37 0.00 0.00 175.52 177.28 3dug h VAL 85 N 0.27 0.99 -0.70 3.16 2.07 -1.02 -1.62 116.25 119.40 3dug h VAL 85 Ca -0.04 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 3dug h VAL 85 Cb 1.24 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 3dug h VAL 85 CO 0.12 0.08 0.43 -0.50 0.02 0.00 0.00 177.57 177.73 3dug h TRP 86 N 0.44 0.90 -0.71 1.57 4.06 -1.31 -2.55 115.95 118.34 3dug h TRP 86 Ca 0.17 0.01 0.10 0.00 2.06 0.00 0.00 58.89 61.23 3dug h TRP 86 Cb 0.06 -0.30 -0.07 0.00 -1.00 0.00 0.00 29.16 27.85 3dug h TRP 86 CO -0.09 0.59 0.35 0.78 -3.56 0.00 0.00 178.44 176.51 3dug h GLY 87 N 0.98 1.07 1.00 1.49 0.00 -0.48 0.74 103.07 107.86 3dug h GLY 87 Ca 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.37 3dug h GLY 87 CO -0.05 0.05 0.07 -2.08 0.00 0.00 0.00 176.54 174.53 3dug h VAL 88 N 0.59 1.03 -0.26 4.60 2.07 -1.01 -0.17 116.25 123.10 3dug h VAL 88 Ca 0.35 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.83 3dug h VAL 88 Cb 0.38 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 3dug h VAL 88 CO -0.27 0.03 0.17 0.58 0.02 0.00 0.00 177.57 178.09 3dug h VAL 89 N 0.14 1.06 0.00 2.57 2.07 -1.29 -2.89 116.25 117.91 3dug h VAL 89 Ca 0.04 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.36 3dug h VAL 89 Cb -0.02 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 3dug h VAL 89 CO -0.01 0.06 -0.38 0.78 0.02 0.00 0.00 177.57 178.05 3dug h ASN 90 N 0.35 0.00 -0.31 0.57 2.35 -0.73 -2.46 115.58 115.34 3dug h ASN 90 Ca 0.10 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.75 3dug h ASN 90 Cb -0.04 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 3dug h ASN 90 CO -0.02 0.38 -0.17 0.00 -1.65 0.00 0.00 177.43 175.96 3dug h ALA 91 N 1.62 0.44 -0.08 -0.83 0.00 -0.88 -2.03 119.26 117.49 3dug h ALA 91 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3dug h ALA 91 Cb 0.87 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 3dug h ALA 91 CO 0.05 0.36 0.05 1.49 0.00 0.00 0.00 179.25 181.20 3dug h GLU 92 N 0.42 0.11 -0.87 0.00 4.81 -1.36 -2.18 114.58 115.50 3dug h GLU 92 Ca 0.07 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.35 3dug h GLU 92 Cb 0.71 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.01 3dug h GLU 92 CO 0.05 0.09 0.57 0.87 -0.73 0.00 0.00 179.01 179.86 3dug h LYS 93 N 0.09 0.96 -0.10 1.92 1.57 -1.43 -0.03 116.57 119.55 3dug h LYS 93 Ca 0.03 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 3dug h LYS 93 Cb 0.01 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.10 3dug h LYS 93 CO -0.01 0.64 0.01 1.15 -0.57 0.00 0.00 179.45 180.67 3dug h THR 94 N 0.99 1.23 -0.29 -0.16 2.02 -1.23 -2.59 112.91 112.87 3dug h THR 94 Ca 0.37 -0.71 -0.01 0.00 0.77 0.00 0.00 66.41 66.83 3dug h THR 94 Cb 0.18 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 3dug h THR 94 CO -0.13 0.20 0.14 0.25 0.37 0.00 0.00 175.52 176.35 3dug h LEU 95 N -0.08 0.38 -1.78 2.58 5.85 -0.91 -2.55 115.31 118.80 3dug h LEU 95 Ca 0.03 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.63 3dug h LEU 95 Cb 0.30 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.24 3dug h LEU 95 CO 0.00 0.39 0.00 0.24 -0.34 0.00 0.00 178.44 178.74 3dug h MET 96 N 0.34 0.00 -0.04 1.25 2.86 -1.04 0.94 114.93 119.23 3dug h MET 96 Ca 0.10 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 3dug h MET 96 Cb 0.11 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.77 3dug h MET 96 CO -0.01 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.96 3dug n ALA 97 N -1.94 2.59 -0.38 6.32 0.00 -0.98 -4.87 120.51 121.25 3dug n ALA 97 Ca -0.01 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.05 3dug n ALA 97 Cb 0.14 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.36 3dug n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dug n GLY 98 N 1.10 0.77 3.51 0.00 0.00 0.32 -4.76 105.19 106.13 3dug n GLY 98 Ca 0.19 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 3dug n GLY 98 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dug s PHE 99 N -2.00 3.19 -0.02 1.61 0.08 -0.99 -1.59 117.98 118.26 3dug s PHE 99 Ca 0.00 -0.23 0.13 0.00 0.12 0.00 0.00 56.93 56.95 3dug s PHE 99 Cb 0.00 -2.38 -0.20 0.00 -0.57 0.00 0.00 43.02 39.87 3dug s PHE 99 CO 0.00 -0.32 0.28 0.25 -0.10 0.00 0.00 175.22 175.33 3dug n THR 100 N 5.03 0.00 -3.74 0.64 -2.24 -0.27 -3.75 114.28 109.95 3dug n THR 100 Ca -0.14 -0.29 -0.21 0.00 -2.27 0.00 0.00 64.05 61.14 3dug n THR 100 Cb 0.51 0.21 -0.18 0.00 -2.10 0.00 0.00 70.33 68.77 3dug n THR 100 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3dug s THR 101 N -2.88 0.12 0.15 4.28 2.01 -1.23 -0.68 115.64 117.41 3dug s THR 101 Ca -0.05 0.26 0.06 0.00 0.31 0.00 0.00 61.69 62.28 3dug s THR 101 Cb 0.08 -0.31 -0.04 0.00 0.01 0.00 0.00 72.50 72.24 3dug s THR 101 CO 0.53 0.21 -0.14 0.68 -0.69 0.00 0.00 174.62 175.21 3dug s VAL 102 N 1.93 1.46 -0.43 3.82 -7.23 0.38 -3.26 120.40 117.07 3dug s VAL 102 Ca 0.03 -1.94 -0.08 0.00 -1.81 0.00 0.00 61.98 58.18 3dug s VAL 102 Cb -0.12 -1.77 0.10 0.00 0.56 0.00 0.00 36.38 35.14 3dug s VAL 102 CO -0.04 -0.52 0.26 -0.60 -0.31 0.00 0.00 175.10 173.90 3dug s ARG 103 N -3.17 2.45 -0.03 4.82 3.52 0.40 -0.45 118.95 126.49 3dug s ARG 103 Ca 0.15 -1.61 -0.30 0.00 -0.13 0.00 0.00 55.73 53.84 3dug s ARG 103 Cb -0.02 -3.76 -0.03 0.00 -1.56 0.00 0.00 34.95 29.57 3dug s ARG 103 CO 0.04 -1.03 1.14 1.21 -0.81 0.00 0.00 175.30 175.85 3dug s ASN 104 N 2.20 7.13 0.00 -2.12 2.47 0.04 -1.75 114.94 122.91 3dug s ASN 104 Ca 0.04 1.79 0.00 0.00 0.42 0.00 0.00 52.86 55.11 3dug s ASN 104 Cb -0.24 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.00 3dug s ASN 104 CO -0.00 -0.50 0.94 0.55 -3.72 0.00 0.00 177.10 174.37 3dug n VAL 105 N 4.38 0.89 0.00 -5.21 3.14 -0.34 -2.57 118.33 118.63 3dug n VAL 105 Ca 0.10 -0.92 0.00 0.00 -2.96 0.00 0.00 64.34 60.56 3dug n VAL 105 Cb 0.47 0.56 0.00 0.00 -1.06 0.00 0.00 33.84 33.81 3dug n VAL 105 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3dug n GLY 106 N -0.45 0.52 3.29 7.55 0.00 -1.26 -4.81 105.19 110.03 3dug n GLY 106 Ca 0.00 0.65 -0.11 0.00 0.00 0.00 0.00 46.02 46.56 3dug n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dug s ALA 107 N 0.00 -0.81 0.19 4.61 0.00 -1.18 -4.90 121.76 119.67 3dug s ALA 107 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 51.93 3dug s ALA 107 Cb 0.00 0.53 -0.04 0.00 0.00 0.00 0.00 23.12 23.61 3dug s ALA 107 CO 0.00 -0.55 0.36 0.00 0.00 0.00 0.00 175.76 175.57 3dug s ALA 108 N -3.33 3.88 -0.85 0.00 0.00 -1.26 -2.62 121.76 117.58 3dug s ALA 108 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 51.06 3dug s ALA 108 Cb 0.01 -1.92 0.00 0.00 0.00 0.00 0.00 23.12 21.21 3dug s ALA 108 CO -0.08 0.46 0.00 0.09 0.00 0.00 0.00 175.76 176.23 3dug n ASN 109 N -0.64 -5.05 -1.67 0.00 3.02 -1.26 -2.54 115.26 107.13 3dug n ASN 109 Ca -0.05 0.20 -0.18 0.00 -0.03 0.00 0.00 54.58 54.51 3dug n ASN 109 Cb 0.54 -3.25 -0.05 0.00 -0.61 0.00 0.00 39.78 36.41 3dug n ASN 109 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3dug n TYR 110 N -2.41 -0.32 0.23 3.10 4.01 -1.26 -4.87 117.16 115.64 3dug n TYR 110 Ca -0.08 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.75 3dug n TYR 110 Cb 0.44 -3.31 0.53 0.00 -0.31 0.00 0.00 39.34 36.69 3dug n TYR 110 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3dug h ALA 111 N 0.32 1.18 -0.54 -0.72 0.00 -1.84 -2.41 119.26 115.25 3dug h ALA 111 Ca -0.40 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.25 3dug h ALA 111 Cb 1.25 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3dug h ALA 111 CO 0.54 0.29 0.12 0.38 0.00 0.00 0.00 179.25 180.58 3dug h ASP 112 N 0.00 0.83 0.35 0.00 -0.00 -1.90 -1.70 116.42 114.01 3dug h ASP 112 Ca -0.00 -0.24 -0.09 0.00 -0.00 0.00 0.00 57.03 56.70 3dug h ASP 112 Cb 0.59 -0.22 -0.01 0.00 -0.00 0.00 0.00 39.33 39.69 3dug h ASP 112 CO 0.03 0.86 -0.40 -0.37 -0.00 0.00 0.00 179.24 179.36 3dug h VAL 113 N 0.77 1.29 -0.34 4.15 -1.51 -1.80 -0.73 116.25 118.08 3dug h VAL 113 Ca 0.17 -1.40 -0.05 0.00 -1.23 0.00 0.00 66.70 64.18 3dug h VAL 113 Cb 0.35 1.72 -0.01 0.00 -2.13 0.00 0.00 31.29 31.22 3dug h VAL 113 CO 0.00 0.41 -0.00 0.28 -1.23 0.00 0.00 177.57 177.03 3dug h SER 114 N 0.06 0.59 -0.36 4.19 0.02 -1.26 0.38 113.55 117.18 3dug h SER 114 Ca 0.00 -0.31 -0.11 0.00 -0.84 0.00 0.00 61.79 60.53 3dug h SER 114 Cb 0.73 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.10 3dug h SER 114 CO 0.05 0.76 -0.22 0.58 -1.14 0.00 0.00 176.83 176.86 3dug h VAL 115 N 0.41 1.29 -0.13 2.27 2.07 -1.10 -0.95 116.25 120.11 3dug h VAL 115 Ca 0.10 -1.36 0.02 0.00 0.82 0.00 0.00 66.70 66.27 3dug h VAL 115 Cb 0.45 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 3dug h VAL 115 CO 0.02 0.45 -0.00 -0.09 0.02 0.00 0.00 177.57 177.97 3dug h ARG 116 N 0.57 0.04 -0.53 1.57 2.43 -1.04 -1.28 114.38 116.14 3dug h ARG 116 Ca 0.07 -0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.18 3dug h ARG 116 Cb 0.78 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.30 3dug h ARG 116 CO 0.06 0.03 0.07 -0.44 -1.51 0.00 0.00 179.97 178.18 3dug h ASP 117 N 0.04 0.80 -0.45 -3.80 3.32 -0.85 -1.07 116.42 114.41 3dug h ASP 117 Ca 0.06 -0.17 -0.05 0.00 0.02 0.00 0.00 57.03 56.89 3dug h ASP 117 Cb 0.07 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 3dug h ASP 117 CO -0.10 0.83 0.13 0.00 -1.72 0.00 0.00 179.24 178.38 3dug h ALA 118 N 1.27 1.27 -0.09 3.45 0.00 -0.91 0.76 119.26 125.01 3dug h ALA 118 Ca 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3dug h ALA 118 Cb 0.39 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 3dug h ALA 118 CO 0.01 0.51 -0.03 0.82 0.00 0.00 0.00 179.25 180.56 3dug h ILE 119 N 0.75 1.30 -0.80 0.00 2.04 -0.87 0.36 117.51 120.28 3dug h ILE 119 Ca 0.17 -0.97 0.06 0.00 1.00 0.00 0.00 64.86 65.12 3dug h ILE 119 Cb 0.26 1.76 -0.05 0.00 -0.74 0.00 0.00 36.82 38.06 3dug h ILE 119 CO -0.00 0.27 0.52 -0.08 0.00 0.00 0.00 178.15 178.86 3dug h GLU 120 N -0.16 0.86 -0.00 2.37 4.22 -0.92 -1.10 114.58 119.85 3dug h GLU 120 Ca 0.02 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.41 3dug h GLU 120 Cb 0.44 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3dug h GLU 120 CO 0.01 0.57 -0.02 0.54 -2.18 0.00 0.00 179.01 177.93 3dug n ARG 121 N -4.48 0.89 -1.40 1.92 1.74 0.23 -4.91 116.66 110.66 3dug n ARG 121 Ca 0.12 -0.16 -0.08 0.00 -0.77 0.00 0.00 57.85 56.96 3dug n ARG 121 Cb 0.20 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.12 3dug n ARG 121 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dug n GLY 122 N 1.14 0.82 0.19 -0.13 0.00 -0.42 -4.92 105.19 101.87 3dug n GLY 122 Ca 0.19 -0.66 -0.18 0.00 0.00 0.00 0.00 46.02 45.37 3dug n GLY 122 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3dug h VAL 123 N 0.00 1.32 -3.60 1.61 2.07 -1.14 -3.47 116.25 113.05 3dug h VAL 123 Ca -0.17 -2.04 -0.29 0.00 0.82 0.00 0.00 66.70 65.02 3dug h VAL 123 Cb 0.63 2.26 -0.15 0.00 -1.52 0.00 0.00 31.29 32.51 3dug h VAL 123 CO 0.23 0.63 -0.70 0.27 0.02 0.00 0.00 177.57 178.03 3dug s ILE 124 N -3.50 0.91 0.07 4.57 -4.36 -1.10 -5.02 121.20 112.76 3dug s ILE 124 Ca -0.11 -2.00 -0.19 0.00 -0.26 0.00 0.00 60.65 58.09 3dug s ILE 124 Cb 0.06 -1.87 -0.07 0.00 1.25 0.00 0.00 42.46 41.84 3dug s ILE 124 CO 0.88 -0.72 0.56 0.20 0.24 0.00 0.00 174.94 176.10 3dug s ASN 125 N -3.13 7.05 0.00 4.36 0.01 -1.26 -4.27 114.94 117.69 3dug s ASN 125 Ca 0.17 1.24 0.00 0.00 -0.71 0.00 0.00 52.86 53.56 3dug s ASN 125 Cb 0.04 -2.35 0.00 0.00 0.41 0.00 0.00 41.25 39.35 3dug s ASN 125 CO -0.00 0.28 0.00 0.61 -1.51 0.00 0.00 177.10 176.47 3dug n GLY 126 N 1.73 -0.61 3.79 0.66 0.00 -1.26 -3.23 105.19 106.27 3dug n GLY 126 Ca -0.11 -1.00 -0.30 0.00 0.00 0.00 0.00 46.02 44.61 3dug n GLY 126 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dug s PRO 127 N -2.00 2.01 -0.05 1.61 0.04 -1.26 -4.91 135.00 130.45 3dug s PRO 127 Ca 0.00 0.72 -0.30 0.00 0.04 0.00 0.00 61.00 61.47 3dug s PRO 127 Cb 0.00 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.59 3dug s PRO 127 CO 0.00 -1.69 1.57 0.99 0.04 0.00 0.00 177.00 177.91 3dug s THR 128 N -3.09 3.65 -0.13 1.26 2.01 0.14 -4.86 115.64 114.61 3dug s THR 128 Ca 0.61 0.85 -0.08 0.00 0.31 0.00 0.00 61.69 63.38 3dug s THR 128 Cb -0.15 -3.55 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 3dug s THR 128 CO 0.55 -0.06 0.16 -0.04 -0.69 0.00 0.00 174.62 174.54 3dug s MET 129 N 3.63 3.67 -0.29 4.92 -1.94 -1.26 -0.47 119.30 127.56 3dug s MET 129 Ca 0.70 -0.11 -0.08 0.00 -1.71 0.00 0.00 55.69 54.49 3dug s MET 129 Cb -0.32 -3.25 -0.00 0.00 2.01 0.00 0.00 34.83 33.26 3dug s MET 129 CO 0.27 0.65 0.09 -0.51 -0.01 0.00 0.00 175.02 175.51 3dug s LEU 130 N -0.66 3.80 0.11 -0.03 1.43 0.40 -4.95 118.68 118.77 3dug s LEU 130 Ca 0.14 -0.54 0.06 0.00 -1.03 0.00 0.00 54.13 52.77 3dug s LEU 130 Cb -0.12 -1.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 3dug s LEU 130 CO 0.03 -0.15 -0.06 0.68 0.23 0.00 0.00 176.35 177.08 3dug s VAL 131 N 1.56 3.60 -0.09 -1.59 -7.23 -1.26 -0.78 120.40 114.60 3dug s VAL 131 Ca 0.04 -1.21 0.20 0.00 -1.81 0.00 0.00 61.98 59.20 3dug s VAL 131 Cb -0.17 -2.71 -0.30 0.00 0.56 0.00 0.00 36.38 33.77 3dug s VAL 131 CO 0.04 0.09 0.46 -1.54 -0.31 0.00 0.00 175.10 173.83 3dug n SER 132 N 0.57 0.53 -0.01 4.85 3.41 -1.06 -0.05 113.62 121.86 3dug n SER 132 Ca -0.12 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 3dug n SER 132 Cb 0.52 1.83 0.00 0.00 -0.26 0.00 0.00 64.21 66.31 3dug n SER 132 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dug n GLY 133 N 1.39 -0.73 3.74 5.00 0.00 -1.26 -4.59 105.19 108.74 3dug n GLY 133 Ca -0.03 -1.16 -0.41 0.00 0.00 0.00 0.00 46.02 44.42 3dug n GLY 133 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3dug s PRO 134 N 0.00 4.27 0.46 1.61 0.02 -1.08 -3.08 135.00 137.20 3dug s PRO 134 Ca 0.00 2.29 -0.23 0.00 0.02 0.00 0.00 61.00 63.08 3dug s PRO 134 Cb 0.00 -3.12 -0.07 0.00 0.02 0.00 0.00 34.50 31.32 3dug s PRO 134 CO 0.00 -0.44 1.17 0.00 -0.33 0.00 0.00 177.00 177.41 3dug s ALA 135 N 0.18 2.99 -0.02 -1.55 0.00 -1.26 -4.82 121.76 117.28 3dug s ALA 135 Ca 0.61 0.95 -0.15 0.00 0.00 0.00 0.00 51.96 53.37 3dug s ALA 135 Cb -0.42 -3.39 -0.05 0.00 0.00 0.00 0.00 23.12 19.26 3dug s ALA 135 CO 0.41 -0.67 0.41 -0.51 0.00 0.00 0.00 175.76 175.40 3dug s LEU 136 N -2.98 4.44 0.20 0.00 1.43 -1.26 -4.01 118.68 116.49 3dug s LEU 136 Ca 0.63 0.92 -0.15 0.00 -1.03 0.00 0.00 54.13 54.51 3dug s LEU 136 Cb -0.29 -2.59 0.01 0.00 0.03 0.00 0.00 46.19 43.35 3dug s LEU 136 CO 0.36 0.27 0.47 -0.83 0.23 0.00 0.00 176.35 176.84 3dug s GLY 137 N -0.77 0.17 0.76 -3.19 0.00 -0.98 -1.90 107.32 101.42 3dug s GLY 137 Ca 0.24 -0.52 -0.12 0.00 0.00 0.00 0.00 44.72 44.32 3dug s GLY 137 CO 0.12 -0.46 1.11 -0.26 0.00 0.00 0.00 173.10 173.61 3dug s ILE 138 N -3.93 3.11 0.02 0.90 -4.36 -1.25 -0.01 121.20 115.69 3dug s ILE 138 Ca 0.14 0.36 -0.31 0.00 -0.26 0.00 0.00 60.65 60.58 3dug s ILE 138 Cb -0.00 -3.24 -0.10 0.00 1.25 0.00 0.00 42.46 40.37 3dug s ILE 138 CO 0.01 -0.47 1.95 0.41 0.24 0.00 0.00 174.94 177.08 3dug n THR 139 N -3.25 0.72 -0.99 8.37 -1.04 -1.26 -1.59 114.28 115.24 3dug n THR 139 Ca 0.07 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 3dug n THR 139 Cb 0.57 -2.23 0.00 0.00 -1.82 0.00 0.00 70.33 66.85 3dug n THR 139 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3dug n GLY 140 N 4.51 0.50 3.09 3.41 0.00 -1.26 -5.04 105.19 110.39 3dug n GLY 140 Ca 0.20 -0.10 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 3dug n GLY 140 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dug n GLY 141 N -2.99 -1.58 0.34 -0.02 0.00 -0.62 -4.82 105.19 95.51 3dug n GLY 141 Ca 0.00 -1.68 0.02 0.00 0.00 0.00 0.00 46.02 44.37 3dug n GLY 141 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3dug h HIS 142 N -1.72 0.82 0.00 1.61 -0.00 -1.87 -2.26 115.15 111.73 3dug h HIS 142 Ca -0.35 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 59.99 3dug h HIS 142 Cb 0.96 -0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 28.09 3dug h HIS 142 CO 0.00 0.50 -0.24 0.00 -0.00 0.00 0.00 177.93 178.19 3dug s ASP 144 N -6.22 6.69 -0.40 0.00 2.15 -0.85 -4.89 116.67 113.14 3dug s ASP 144 Ca 0.03 1.58 -0.13 0.00 0.43 0.00 0.00 52.55 54.46 3dug s ASP 144 Cb 0.08 -2.51 0.03 0.00 -0.30 0.00 0.00 42.92 40.22 3dug s ASP 144 CO 0.67 -0.53 0.27 -1.00 -0.17 0.00 0.00 175.17 174.41 3dug s HIS 145 N -2.52 3.25 -0.72 -5.34 3.76 -1.26 -4.76 115.29 107.70 3dug s HIS 145 Ca 0.59 -0.81 -0.02 0.00 -0.15 0.00 0.00 55.06 54.68 3dug s HIS 145 Cb -0.10 -2.61 0.42 0.00 1.11 0.00 0.00 32.58 31.40 3dug s HIS 145 CO 0.27 -0.65 2.02 0.09 -0.85 0.00 0.00 174.74 175.62 3dug n ASN 146 N 5.09 7.59 -0.00 1.40 3.02 -1.26 -4.53 115.26 126.57 3dug n ASN 146 Ca -0.11 -3.81 0.07 0.00 -0.03 0.00 0.00 54.58 50.70 3dug n ASN 146 Cb 0.46 -1.00 -0.09 0.00 -0.61 0.00 0.00 39.78 38.55 3dug n ASN 146 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3dug n LEU 147 N -0.79 0.74 -4.69 3.41 4.32 -1.26 -4.86 117.00 113.88 3dug n LEU 147 Ca 0.60 -0.50 -0.32 0.00 -0.02 0.00 0.00 56.01 55.77 3dug n LEU 147 Cb 0.52 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 42.24 3dug n LEU 147 CO 0.69 0.18 -0.32 -0.76 -1.22 0.00 0.00 177.39 175.96 3dug s LEU 148 N -2.73 3.50 0.78 2.23 1.43 -1.26 -5.11 118.68 117.52 3dug s LEU 148 Ca 0.06 -0.07 -0.15 0.00 -1.03 0.00 0.00 54.13 52.94 3dug s LEU 148 Cb 0.12 -2.11 0.01 0.00 0.03 0.00 0.00 46.19 44.24 3dug s LEU 148 CO 0.64 0.24 0.74 -2.65 0.23 0.00 0.00 176.35 175.55 3dug n PRO 149 N 1.05 0.23 0.23 1.29 -0.02 -1.26 -4.91 135.00 131.61 3dug n PRO 149 Ca -0.13 0.13 0.16 0.00 -2.02 0.00 0.00 63.50 61.64 3dug n PRO 149 Cb 0.52 -2.05 0.75 0.00 -0.02 0.00 0.00 33.50 32.71 3dug n PRO 149 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3dug h PRO 150 N -0.64 0.00 -0.30 0.52 0.13 -2.00 -2.48 132.00 127.22 3dug h PRO 150 Ca -0.46 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.62 3dug h PRO 150 Cb 1.32 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.44 3dug h PRO 150 CO 0.43 0.00 -0.05 0.93 -0.23 0.00 0.00 178.00 179.08 3dug h GLU 151 N 0.00 0.48 0.00 0.86 3.07 -2.03 -2.65 114.58 114.31 3dug h GLU 151 Ca 0.00 -0.11 -0.11 0.00 -0.50 0.00 0.00 59.36 58.64 3dug h GLU 151 Cb 0.23 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.06 3dug h GLU 151 CO 0.00 0.55 -0.51 0.74 -1.40 0.00 0.00 179.01 178.39 3dug h PHE 152 N 0.46 0.00 -6.47 4.33 0.04 -1.80 -3.47 116.94 110.03 3dug h PHE 152 Ca 0.09 0.00 -0.50 0.00 2.80 0.00 0.00 57.97 60.36 3dug h PHE 152 Cb 0.38 0.00 -0.09 0.00 2.20 0.00 0.00 35.95 38.44 3dug h PHE 152 CO 0.01 0.51 -0.82 -1.71 -0.60 0.00 0.00 178.31 175.71 3dug n ASN 153 N -3.78 -2.98 -4.67 2.17 5.15 -1.00 -4.93 115.26 105.22 3dug n ASN 153 Ca -0.01 -0.91 -0.41 0.00 -0.60 0.00 0.00 54.58 52.65 3dug n ASN 153 Cb 0.55 -3.36 -0.05 0.00 -0.53 0.00 0.00 39.78 36.39 3dug n ASN 153 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 3dug s TYR 154 N -3.48 3.41 -0.03 1.20 5.04 -1.26 -5.04 117.35 117.19 3dug s TYR 154 Ca 0.48 1.15 0.08 0.00 -2.44 0.00 0.00 57.07 56.34 3dug s TYR 154 Cb -0.25 -2.94 -0.02 0.00 0.35 0.00 0.00 41.96 39.10 3dug s TYR 154 CO 0.87 -0.21 -0.26 -1.12 -1.34 0.00 0.00 175.55 173.50 3dug s SER 155 N 1.16 3.01 1.05 4.32 0.01 -1.26 -4.87 113.70 117.12 3dug s SER 155 Ca 0.35 -0.47 -0.17 0.00 1.31 0.00 0.00 55.95 56.97 3dug s SER 155 Cb -0.16 -0.42 0.22 0.00 0.21 0.00 0.00 66.02 65.87 3dug s SER 155 CO 0.12 0.30 1.20 -0.94 0.41 0.00 0.00 173.24 174.33 3dug s SER 156 N -0.53 2.26 0.22 2.44 1.04 -1.26 -4.96 113.70 112.92 3dug s SER 156 Ca 0.08 0.56 -0.08 0.00 0.48 0.00 0.00 55.95 56.99 3dug s SER 156 Cb -0.11 -0.80 0.26 0.00 0.10 0.00 0.00 66.02 65.48 3dug s SER 156 CO -0.00 -3.29 1.85 -0.08 0.98 0.00 0.00 173.24 172.70 3dug h GLU 157 N -2.01 0.88 -0.65 4.02 4.81 -1.92 -2.85 114.58 116.86 3dug h GLU 157 Ca -0.46 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 3dug h GLU 157 Cb 1.28 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.46 3dug h GLU 157 CO 0.41 0.58 0.00 0.41 -0.73 0.00 0.00 179.01 179.68 3dug n GLY 158 N -1.31 2.20 3.66 1.92 0.00 -1.26 -4.94 105.19 105.46 3dug n GLY 158 Ca 0.10 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 3dug n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dug s VAL 159 N -1.44 3.41 0.03 1.61 1.01 -1.08 -2.33 120.40 121.61 3dug s VAL 159 Ca 0.44 0.53 0.03 0.00 0.00 0.00 0.00 61.98 62.98 3dug s VAL 159 Cb 0.26 -3.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 3dug s VAL 159 CO 0.26 -0.04 -0.08 0.68 0.00 0.00 0.00 175.10 175.91 3dug s VAL 160 N 4.05 0.63 -0.02 2.92 -7.23 0.99 -4.91 120.40 116.82 3dug s VAL 160 Ca 0.77 -0.80 0.10 0.00 -1.81 0.00 0.00 61.98 60.24 3dug s VAL 160 Cb -0.36 -0.62 0.17 0.00 0.56 0.00 0.00 36.38 36.14 3dug s VAL 160 CO 0.33 -0.15 1.07 0.47 -0.31 0.00 0.00 175.10 176.51 3dug n ASP 161 N 2.01 0.54 -3.58 4.85 8.00 -1.26 -3.89 116.55 123.21 3dug n ASP 161 Ca -0.19 -2.14 -0.11 0.00 0.71 0.00 0.00 54.79 53.06 3dug n ASP 161 Cb 0.56 -0.26 -0.04 0.00 -0.02 0.00 0.00 41.12 41.36 3dug n ASP 161 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3dug s SER 162 N -1.53 -0.34 0.27 -2.24 1.04 -1.26 -5.02 113.70 104.63 3dug s SER 162 Ca 0.14 -0.17 -0.01 0.00 0.48 0.00 0.00 55.95 56.39 3dug s SER 162 Cb 0.16 0.50 0.45 0.00 0.10 0.00 0.00 66.02 67.23 3dug s SER 162 CO -0.06 -0.86 1.88 -0.65 0.98 0.00 0.00 173.24 174.53 3dug h PRO 163 N 2.36 1.10 0.00 4.02 0.11 -1.89 -0.27 132.00 137.43 3dug h PRO 163 Ca -0.34 -0.07 -0.18 0.00 0.11 0.00 0.00 66.00 65.53 3dug h PRO 163 Cb 1.26 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 3dug h PRO 163 CO 0.44 0.73 -0.85 -1.49 -0.21 0.00 0.00 178.00 176.62 3dug h TRP 164 N 1.14 0.05 -0.54 0.65 4.06 -1.96 0.27 115.95 119.61 3dug h TRP 164 Ca 0.44 -0.03 -0.11 0.00 2.06 0.00 0.00 58.89 61.25 3dug h TRP 164 Cb 0.23 -0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.37 3dug h TRP 164 CO -0.00 0.86 -0.11 0.93 -3.56 0.00 0.00 178.44 176.56 3dug h GLU 165 N 0.02 1.03 -0.55 0.49 5.08 -1.89 -2.15 114.58 116.61 3dug h GLU 165 Ca -0.02 -0.39 -0.05 0.00 -1.00 0.00 0.00 59.36 57.91 3dug h GLU 165 Cb 1.50 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.66 3dug h GLU 165 CO 0.11 1.07 0.13 0.00 -1.00 0.00 0.00 179.01 179.33 3dug h ALA 166 N 0.92 0.72 -0.55 3.43 0.00 -0.89 -1.84 119.26 121.05 3dug h ALA 166 Ca 0.14 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 54.90 3dug h ALA 166 Cb 0.68 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 3dug h ALA 166 CO 0.05 0.42 0.23 -0.09 0.00 0.00 0.00 179.25 179.86 3dug h ARG 167 N 0.78 0.42 -0.25 0.00 9.65 -0.87 -2.03 114.38 122.08 3dug h ARG 167 Ca 0.17 -0.03 -0.15 0.00 -1.10 0.00 0.00 59.98 58.88 3dug h ARG 167 Cb 0.34 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.82 3dug h ARG 167 CO 0.00 0.28 -0.44 -0.22 2.80 0.00 0.00 179.97 182.39 3dug h LYS 168 N 0.43 0.63 -0.15 0.20 3.64 -1.15 -1.47 116.57 118.71 3dug h LYS 168 Ca 0.26 -0.34 -0.12 0.00 -1.27 0.00 0.00 60.65 59.17 3dug h LYS 168 Cb 0.26 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 3dug h LYS 168 CO -0.24 0.95 -0.45 1.98 -2.27 0.00 0.00 179.45 179.42 3dug h MET 169 N 0.51 0.36 -0.19 1.90 4.05 -1.04 0.23 114.93 120.75 3dug h MET 169 Ca 0.03 -0.19 -0.01 0.00 -0.28 0.00 0.00 59.70 59.25 3dug h MET 169 Cb 0.97 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.77 3dug h MET 169 CO 0.09 0.74 0.07 0.28 0.23 0.00 0.00 176.91 178.32 3dug h VAL 170 N 0.29 1.17 -0.73 -5.77 2.07 -1.09 -0.01 116.25 112.18 3dug h VAL 170 Ca 0.02 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.02 3dug h VAL 170 Cb 0.91 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.82 3dug h VAL 170 CO 0.08 0.17 0.47 0.03 0.02 0.00 0.00 177.57 178.34 3dug h ARG 171 N 0.14 0.97 -0.20 1.57 3.08 -0.86 -1.76 114.38 117.31 3dug h ARG 171 Ca 0.06 -0.07 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 3dug h ARG 171 Cb 0.20 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.04 3dug h ARG 171 CO -0.00 0.66 -0.57 -0.22 -1.07 0.00 0.00 179.97 178.76 3dug h LYS 172 N 1.00 0.75 -0.44 0.04 3.64 -0.29 -0.77 116.57 120.50 3dug h LYS 172 Ca 0.27 -0.53 0.01 0.00 -1.27 0.00 0.00 60.65 59.12 3dug h LYS 172 Cb -0.09 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 3dug h LYS 172 CO -0.06 1.15 0.29 -0.91 -2.27 0.00 0.00 179.45 177.66 3dug h ASN 173 N 0.47 0.49 -0.86 4.20 2.35 -0.82 -2.00 115.58 119.42 3dug h ASN 173 Ca -0.01 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 3dug h ASN 173 Cb 1.19 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 39.40 3dug h ASN 173 CO 0.12 0.36 0.48 -0.09 -1.65 0.00 0.00 177.43 176.65 3dug h ARG 174 N 0.59 1.19 -0.52 0.81 2.43 -1.27 0.01 114.38 117.61 3dug h ARG 174 Ca 0.16 -0.13 0.06 0.00 -0.81 0.00 0.00 59.98 59.26 3dug h ARG 174 Cb -0.06 -0.24 -0.05 0.00 -0.42 0.00 0.00 29.97 29.21 3dug h ARG 174 CO -0.04 0.86 0.24 -0.22 -1.51 0.00 0.00 179.97 179.30 3dug h LYS 175 N 1.19 0.44 -0.60 0.20 3.64 -0.75 -1.93 116.57 118.76 3dug h LYS 175 Ca 0.30 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 3dug h LYS 175 Cb 0.01 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 3dug h LYS 175 CO -0.05 0.29 0.00 0.66 -2.27 0.00 0.00 179.45 178.08 3dug n TYR 176 N -4.92 0.98 -0.10 1.91 4.02 -0.79 -4.91 117.16 113.35 3dug n TYR 176 Ca 0.05 -0.39 0.00 0.00 -0.01 0.00 0.00 57.90 57.55 3dug n TYR 176 Cb 0.17 -0.17 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 3dug n TYR 176 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dug n GLY 177 N 0.86 1.29 3.77 2.72 0.00 -0.58 -4.92 105.19 108.33 3dug n GLY 177 Ca 0.17 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 3dug n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dug s ALA 178 N -2.00 3.10 -0.09 4.61 0.00 -0.11 -4.93 121.76 122.33 3dug s ALA 178 Ca 0.00 0.88 -0.09 0.00 0.00 0.00 0.00 51.96 52.75 3dug s ALA 178 Cb 0.00 -3.35 -0.28 0.00 0.00 0.00 0.00 23.12 19.49 3dug s ALA 178 CO 0.00 -0.46 0.49 -0.44 0.00 0.00 0.00 175.76 175.35 3dug h ASP 179 N 2.49 0.50 -4.08 0.00 3.32 -0.78 -3.42 116.42 114.44 3dug h ASP 179 Ca -0.49 -0.94 -0.41 0.00 0.02 0.00 0.00 57.03 55.21 3dug h ASP 179 Cb 1.23 -0.16 -0.14 0.00 0.22 0.00 0.00 39.33 40.48 3dug h ASP 179 CO 0.62 1.82 -0.59 -1.48 -1.72 0.00 0.00 179.24 177.89 3dug s LEU 180 N -7.18 1.81 0.00 1.55 2.34 -0.99 -4.23 118.68 111.97 3dug s LEU 180 Ca -0.20 -1.44 0.01 0.00 0.06 0.00 0.00 54.13 52.55 3dug s LEU 180 Cb 0.06 -0.06 0.01 0.00 -0.56 0.00 0.00 46.19 45.63 3dug s LEU 180 CO 0.80 -0.75 0.05 -0.38 -1.06 0.00 0.00 176.35 175.01 3dug n ILE 181 N -0.59 0.00 0.00 1.48 2.08 -0.44 -4.21 119.36 117.67 3dug n ILE 181 Ca -0.01 -0.96 0.00 0.00 0.56 0.00 0.00 62.75 62.34 3dug n ILE 181 Cb 0.66 0.06 0.00 0.00 -0.75 0.00 0.00 39.64 39.61 3dug n ILE 181 CO 0.00 0.00 0.00 2.22 0.56 0.00 0.00 176.55 179.33 3dug n PHE 183 N -0.67 0.00 -3.31 1.39 -1.74 -0.57 -0.99 117.46 111.57 3dug n PHE 183 Ca -0.07 0.00 -0.40 0.00 -0.56 0.00 0.00 57.45 56.43 3dug n PHE 183 Cb 0.26 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.18 3dug n PHE 183 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3dug n ALA 185 N 5.47 2.94 -2.30 0.00 0.00 0.99 -4.65 120.51 122.96 3dug n ALA 185 Ca -0.06 -0.50 -0.17 0.00 0.00 0.00 0.00 53.44 52.71 3dug n ALA 185 Cb 0.50 -0.71 -0.09 0.00 0.00 0.00 0.00 19.45 19.15 3dug n ALA 185 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3dug s THR 186 N -3.39 0.23 0.98 0.00 -4.23 -1.18 0.24 115.64 108.30 3dug s THR 186 Ca -0.06 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.33 3dug s THR 186 Cb 0.13 -2.52 0.18 0.00 1.34 0.00 0.00 72.50 71.64 3dug s THR 186 CO 0.86 0.00 1.09 -0.83 -0.54 0.00 0.00 174.62 175.20 3dug s GLY 187 N -3.32 1.57 0.35 3.99 0.00 -1.00 -4.51 107.32 104.40 3dug s GLY 187 Ca 0.37 -0.32 0.04 0.00 0.00 0.00 0.00 44.72 44.81 3dug s GLY 187 CO 0.17 0.28 0.13 -0.32 0.00 0.00 0.00 173.10 173.37 3dug s GLY 188 N -3.45 2.29 -0.04 0.20 0.00 -1.26 -4.37 107.32 100.69 3dug s GLY 188 Ca 0.65 -1.60 -0.22 0.00 0.00 0.00 0.00 44.72 43.55 3dug s GLY 188 CO 0.57 -1.72 0.99 -2.08 0.00 0.00 0.00 173.10 170.86 3dug h VAL 189 N 2.02 0.85 0.00 1.40 2.07 -1.91 -3.36 116.25 117.32 3dug h VAL 189 Ca -0.35 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.16 3dug h VAL 189 Cb 1.26 1.38 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 3dug h VAL 189 CO 0.56 0.20 0.00 0.23 0.02 0.00 0.00 177.57 178.58 3dug n MET 190 N -4.97 0.16 -2.80 1.57 2.81 -1.26 -4.33 117.12 108.30 3dug n MET 190 Ca -0.08 0.20 -0.28 0.00 -1.81 0.00 0.00 57.70 55.73 3dug n MET 190 Cb 0.26 -1.71 -0.01 0.00 -0.71 0.00 0.00 33.22 31.05 3dug n MET 190 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3dug s SER 191 N -3.93 6.35 -0.02 7.83 1.04 -1.26 -4.98 113.70 118.73 3dug s SER 191 Ca 0.10 0.94 -0.15 0.00 0.48 0.00 0.00 55.95 57.32 3dug s SER 191 Cb 0.13 -2.25 -0.05 0.00 0.10 0.00 0.00 66.02 63.95 3dug s SER 191 CO 0.51 -0.48 0.42 -0.60 0.98 0.00 0.00 173.24 174.07 3dug s ARG 192 N -4.36 4.01 -1.17 4.02 3.52 -1.26 -4.51 118.95 119.20 3dug s ARG 192 Ca 0.48 0.42 -0.01 0.00 -0.13 0.00 0.00 55.73 56.48 3dug s ARG 192 Cb -0.10 -3.26 -0.02 0.00 -1.56 0.00 0.00 34.95 30.01 3dug s ARG 192 CO 0.39 0.59 0.97 -1.71 -0.81 0.00 0.00 175.30 174.73 3dug n ASN 193 N 2.18 -3.02 -3.96 -2.12 2.85 -1.26 -4.60 115.26 105.32 3dug n ASN 193 Ca -0.13 -0.65 -0.20 0.00 -0.11 0.00 0.00 54.58 53.50 3dug n ASN 193 Cb 0.52 -5.11 -0.16 0.00 1.24 0.00 0.00 39.78 36.28 3dug n ASN 193 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 3dug s THR 194 N -3.38 0.66 -0.36 -0.44 -4.23 -1.26 -4.91 115.64 101.72 3dug s THR 194 Ca 0.10 -0.27 -0.22 0.00 -1.18 0.00 0.00 61.69 60.12 3dug s THR 194 Cb -0.01 -0.61 0.01 0.00 1.34 0.00 0.00 72.50 73.22 3dug s THR 194 CO 0.74 0.22 0.73 -0.62 -0.54 0.00 0.00 174.62 175.15 3dug s ASP 195 N 0.38 6.51 0.36 3.99 2.15 -1.26 -4.61 116.67 124.20 3dug s ASP 195 Ca -0.06 0.29 0.06 0.00 0.43 0.00 0.00 52.55 53.27 3dug s ASP 195 Cb -0.10 -2.37 0.73 0.00 -0.30 0.00 0.00 42.92 40.88 3dug s ASP 195 CO 0.00 -0.68 1.97 0.58 -0.17 0.00 0.00 175.17 176.87 3dug h VAL 196 N 5.72 1.04 -0.00 1.11 2.07 -1.85 -2.58 116.25 121.76 3dug h VAL 196 Ca -0.25 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.01 3dug h VAL 196 Cb 1.10 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 3dug h VAL 196 CO 0.88 0.14 -0.44 0.59 0.02 0.00 0.00 177.57 178.76 3dug n ASN 197 N -4.47 0.55 -4.79 0.57 5.03 -1.26 -1.86 115.26 109.02 3dug n ASN 197 Ca 0.10 -0.31 -0.39 0.00 0.87 0.00 0.00 54.58 54.85 3dug n ASN 197 Cb 0.20 0.20 -0.06 0.00 -1.02 0.00 0.00 39.78 39.10 3dug n ASN 197 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3dug s ALA 198 N -2.93 3.53 0.16 5.41 0.00 -1.04 -4.67 121.76 122.22 3dug s ALA 198 Ca 0.13 0.13 -0.30 0.00 0.00 0.00 0.00 51.96 51.93 3dug s ALA 198 Cb 0.18 -2.75 -0.07 0.00 0.00 0.00 0.00 23.12 20.48 3dug s ALA 198 CO 0.67 0.33 1.07 0.21 0.00 0.00 0.00 175.76 178.04 3dug s LYS 199 N -0.98 4.61 -0.05 0.00 2.20 -1.26 -3.23 119.74 121.03 3dug s LYS 199 Ca 0.31 1.66 0.03 0.00 -0.36 0.00 0.00 55.97 57.61 3dug s LYS 199 Cb -0.20 -3.30 -0.03 0.00 -1.51 0.00 0.00 37.83 32.78 3dug s LYS 199 CO 0.21 0.09 -0.12 -0.65 -0.36 0.00 0.00 175.35 174.52 3dug s GLN 200 N -0.20 2.54 0.00 4.03 -0.21 0.14 -4.93 119.66 121.03 3dug s GLN 200 Ca 0.49 -0.67 0.00 0.00 0.02 0.00 0.00 55.36 55.20 3dug s GLN 200 Cb -0.28 -2.42 0.00 0.00 1.00 0.00 0.00 33.01 31.31 3dug s GLN 200 CO 0.33 0.63 0.00 1.19 -2.12 0.00 0.00 175.29 175.32 3dug n PHE 201 N 2.22 0.00 -1.51 0.91 3.72 -1.26 -4.39 117.46 117.14 3dug n PHE 201 Ca -0.17 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 56.92 3dug n PHE 201 Cb 0.52 -0.94 0.07 0.00 -0.94 0.00 0.00 39.48 38.19 3dug n PHE 201 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3dug s THR 202 N -1.85 3.70 0.25 4.37 -4.23 -1.26 -4.91 115.64 111.71 3dug s THR 202 Ca 0.00 0.55 -0.05 0.00 -1.18 0.00 0.00 61.69 61.01 3dug s THR 202 Cb 0.00 -3.25 0.20 0.00 1.34 0.00 0.00 72.50 70.79 3dug s THR 202 CO 0.00 -0.72 1.85 0.25 -0.54 0.00 0.00 174.62 175.46 3dug h LEU 203 N -0.87 1.05 -0.93 4.79 5.85 -1.96 -1.41 115.31 121.83 3dug h LEU 203 Ca -0.45 -0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.21 3dug h LEU 203 Cb 1.23 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.93 3dug h LEU 203 CO 0.56 0.87 0.60 -0.08 -0.34 0.00 0.00 178.44 180.05 3dug h GLU 204 N 1.16 1.10 -0.36 1.25 4.81 -1.99 0.18 114.58 120.73 3dug h GLU 204 Ca 0.29 -0.07 -0.07 0.00 -0.13 0.00 0.00 59.36 59.38 3dug h GLU 204 Cb 0.08 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 3dug h GLU 204 CO -0.04 0.73 -0.06 0.93 -0.73 0.00 0.00 179.01 179.83 3dug h GLU 205 N 1.13 0.68 -0.65 1.92 5.08 -1.84 -2.06 114.58 118.83 3dug h GLU 205 Ca 0.39 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.47 3dug h GLU 205 Cb 0.08 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 3dug h GLU 205 CO -0.14 0.82 0.31 0.52 -1.00 0.00 0.00 179.01 179.52 3dug h MET 206 N 0.48 0.94 -0.62 2.33 2.86 -0.45 -1.81 114.93 118.66 3dug h MET 206 Ca 0.09 -0.14 -0.09 0.00 -2.06 0.00 0.00 59.70 57.50 3dug h MET 206 Cb 0.56 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.03 3dug h MET 206 CO 0.03 0.76 0.04 0.87 1.06 0.00 0.00 176.91 179.67 3dug h LYS 207 N 0.90 1.06 -0.49 1.72 1.57 -0.67 -1.82 116.57 118.84 3dug h LYS 207 Ca 0.22 -0.31 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 3dug h LYS 207 Cb 0.13 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 3dug h LYS 207 CO -0.03 1.01 0.18 0.00 -0.57 0.00 0.00 179.45 180.05 3dug h ALA 208 N 1.05 0.64 0.03 3.86 0.00 -1.11 0.90 119.26 124.62 3dug h ALA 208 Ca 0.18 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3dug h ALA 208 Cb 0.51 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3dug h ALA 208 CO 0.02 0.26 -0.13 0.82 0.00 0.00 0.00 179.25 180.22 3dug h ILE 209 N 0.65 0.67 -0.09 0.00 2.04 -1.17 -2.25 117.51 117.37 3dug h ILE 209 Ca 0.16 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.01 3dug h ILE 209 Cb 0.22 0.67 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 3dug h ILE 209 CO -0.01 0.00 0.02 0.58 0.00 0.00 0.00 178.15 178.74 3dug h VAL 210 N -0.24 1.19 -0.57 1.67 2.07 -1.08 -1.80 116.25 117.49 3dug h VAL 210 Ca 0.04 -0.57 0.05 0.00 0.82 0.00 0.00 66.70 67.03 3dug h VAL 210 Cb 0.28 1.40 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 3dug h VAL 210 CO -0.11 0.16 0.31 -0.78 0.02 0.00 0.00 177.57 177.17 3dug h ASP 211 N -0.06 0.45 -0.46 0.57 3.58 -0.84 -0.54 116.42 119.12 3dug h ASP 211 Ca 0.03 0.03 -0.10 0.00 0.42 0.00 0.00 57.03 57.41 3dug h ASP 211 Cb 0.24 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.21 3dug h ASP 211 CO -0.00 0.31 -0.10 -0.08 -2.88 0.00 0.00 179.24 176.49 3dug h GLU 212 N 0.59 0.88 -0.41 0.28 4.57 -1.29 -1.24 114.58 117.96 3dug h GLU 212 Ca 0.25 -0.33 -0.07 0.00 -1.18 0.00 0.00 59.36 58.03 3dug h GLU 212 Cb 0.13 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 3dug h GLU 212 CO -0.16 0.97 -0.00 0.00 -1.18 0.00 0.00 179.01 178.64 3dug h ALA 213 N 0.88 0.55 -0.62 2.92 0.00 -0.99 -2.89 119.26 119.11 3dug h ALA 213 Ca 0.12 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 3dug h ALA 213 Cb 0.64 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3dug h ALA 213 CO 0.04 0.33 0.04 0.45 0.00 0.00 0.00 179.25 180.11 3dug h HIS 214 N 0.55 1.15 -0.60 0.00 3.86 -1.09 0.30 115.15 119.33 3dug h HIS 214 Ca 0.12 -0.18 0.17 0.00 -1.16 0.00 0.00 60.37 59.32 3dug h HIS 214 Cb 0.48 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.62 3dug h HIS 214 CO 0.04 1.00 0.49 -0.97 0.86 0.00 0.00 177.93 179.35 3dug h ASN 215 N 0.99 0.00 -0.45 2.45 -1.24 -1.05 0.21 115.58 116.49 3dug h ASN 215 Ca 0.18 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.19 3dug h ASN 215 Cb 0.51 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.56 3dug h ASN 215 CO 0.02 0.00 0.00 1.41 -1.29 0.00 0.00 177.43 177.57 3dug n HIS 216 N -4.08 0.58 -2.15 0.67 8.25 -0.76 -4.94 115.22 112.79 3dug n HIS 216 Ca 0.12 -0.32 -0.11 0.00 -0.26 0.00 0.00 57.72 57.15 3dug n HIS 216 Cb 0.73 -0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.83 3dug n HIS 216 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dug n GLY 217 N 1.40 0.00 3.84 -1.41 0.00 0.72 -5.03 105.19 104.72 3dug n GLY 217 Ca 0.19 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.44 3dug n GLY 217 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dug s MET 218 N -4.44 3.27 0.30 1.61 -1.94 0.98 -4.98 119.30 114.10 3dug s MET 218 Ca 0.00 -0.35 -0.10 0.00 -1.71 0.00 0.00 55.69 53.53 3dug s MET 218 Cb 0.00 -3.01 -0.07 0.00 2.01 0.00 0.00 34.83 33.76 3dug s MET 218 CO 0.00 0.69 0.64 0.15 -0.01 0.00 0.00 175.02 176.49 3dug s LYS 219 N -1.62 3.80 -0.16 2.03 1.02 -1.26 -3.27 119.74 120.27 3dug s LYS 219 Ca 0.22 0.34 -0.02 0.00 0.02 0.00 0.00 55.97 56.54 3dug s LYS 219 Cb -0.12 -2.54 -0.01 0.00 -0.52 0.00 0.00 37.83 34.63 3dug s LYS 219 CO 0.13 0.18 -0.09 0.08 -0.92 0.00 0.00 175.35 174.73 3dug s VAL 220 N -2.04 3.25 -0.09 3.17 1.01 -1.26 -1.33 120.40 123.11 3dug s VAL 220 Ca 0.49 -0.57 -0.03 0.00 0.00 0.00 0.00 61.98 61.87 3dug s VAL 220 Cb -0.11 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.83 3dug s VAL 220 CO 0.25 0.49 0.02 0.00 0.00 0.00 0.00 175.10 175.86 3dug s ALA 221 N 0.70 3.38 -0.18 5.51 0.00 -0.16 -1.06 121.76 129.95 3dug s ALA 221 Ca -0.04 -0.78 0.01 0.00 0.00 0.00 0.00 51.96 51.14 3dug s ALA 221 Cb -0.15 -1.56 0.04 0.00 0.00 0.00 0.00 23.12 21.44 3dug s ALA 221 CO 0.02 0.59 -0.12 0.00 0.00 0.00 0.00 175.76 176.25 3dug s ALA 222 N -0.88 1.96 -0.03 0.00 0.00 -0.48 -1.51 121.76 120.81 3dug s ALA 222 Ca 0.13 -1.10 -0.30 0.00 0.00 0.00 0.00 51.96 50.70 3dug s ALA 222 Cb -0.11 -1.20 -0.07 0.00 0.00 0.00 0.00 23.12 21.73 3dug s ALA 222 CO 0.03 -0.66 1.87 -1.58 0.00 0.00 0.00 175.76 175.41 3dug s HIS 223 N 1.43 1.54 -0.24 0.00 2.46 0.17 -0.28 115.29 120.36 3dug s HIS 223 Ca 0.01 -0.10 -0.04 0.00 0.47 0.00 0.00 55.06 55.40 3dug s HIS 223 Cb -0.15 -4.10 0.13 0.00 -0.13 0.00 0.00 32.58 28.33 3dug s HIS 223 CO -0.09 -4.72 0.41 0.00 -2.47 0.00 0.00 174.74 167.87 3dug s ALA 224 N 4.72 -1.22 -0.16 1.58 0.00 -1.01 -0.01 121.76 125.66 3dug s ALA 224 Ca 0.84 1.19 -0.14 0.00 0.00 0.00 0.00 51.96 53.85 3dug s ALA 224 Cb -0.38 -1.61 -0.09 0.00 0.00 0.00 0.00 23.12 21.04 3dug s ALA 224 CO 0.36 -1.11 0.01 0.45 0.00 0.00 0.00 175.76 175.47 3dug h HIS 225 N 8.16 0.00 -3.90 0.00 3.86 -1.79 -1.85 115.15 119.64 3dug h HIS 225 Ca -0.19 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.50 3dug h HIS 225 Cb 1.14 0.00 0.06 0.00 1.06 0.00 0.00 27.41 29.67 3dug h HIS 225 CO 0.17 0.58 0.60 0.20 0.86 0.00 0.00 177.93 180.33 3dug s GLY 226 N -4.42 2.97 0.20 2.45 0.00 -0.78 -2.01 107.32 105.73 3dug s GLY 226 Ca -0.19 1.17 -0.11 0.00 0.00 0.00 0.00 44.72 45.60 3dug s GLY 226 CO 0.36 1.78 1.73 -2.00 0.00 0.00 0.00 173.10 174.97 3dug h LEU 227 N 3.12 0.14 -1.60 0.66 5.85 -1.85 -2.30 115.31 119.32 3dug h LEU 227 Ca -0.49 0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.27 3dug h LEU 227 Cb 1.23 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.34 3dug h LEU 227 CO 0.64 0.09 -0.19 -0.29 -0.34 0.00 0.00 178.44 178.36 3dug h ILE 228 N 0.34 1.14 0.10 4.05 2.10 -1.91 -1.10 117.51 122.23 3dug h ILE 228 Ca 0.28 -0.67 -0.29 0.00 1.08 0.00 0.00 64.86 65.27 3dug h ILE 228 Cb 0.36 1.35 0.03 0.00 -1.09 0.00 0.00 36.82 37.47 3dug h ILE 228 CO -0.31 0.19 -1.19 1.23 -1.08 0.00 0.00 178.15 176.98 3dug h GLY 229 N 0.59 0.71 0.71 8.18 0.00 -1.75 -2.95 103.07 108.57 3dug h GLY 229 Ca 0.00 -1.44 0.04 0.00 0.00 0.00 0.00 47.33 45.93 3dug h GLY 229 CO 0.02 1.27 0.22 -2.22 0.00 0.00 0.00 176.54 175.83 3dug h ILE 230 N 0.28 0.93 -0.17 2.60 2.04 -0.86 -0.35 117.51 121.98 3dug h ILE 230 Ca -0.18 -0.15 0.04 0.00 1.00 0.00 0.00 64.86 65.57 3dug h ILE 230 Cb 1.87 0.47 -0.04 0.00 -0.74 0.00 0.00 36.82 38.38 3dug h ILE 230 CO 0.23 0.08 -0.07 0.11 0.00 0.00 0.00 178.15 178.50 3dug h LYS 231 N 0.43 -0.04 -0.58 2.37 1.57 -1.31 -2.33 116.57 116.68 3dug h LYS 231 Ca 0.21 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.98 3dug h LYS 231 Cb 0.14 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 3dug h LYS 231 CO -0.16 -0.03 0.33 0.00 -0.57 0.00 0.00 179.45 179.02 3dug h ALA 232 N 1.12 0.74 -0.68 3.86 0.00 -1.28 -1.19 119.26 121.83 3dug h ALA 232 Ca 0.09 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3dug h ALA 232 Cb 0.18 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3dug h ALA 232 CO -0.20 0.24 0.35 0.00 0.00 0.00 0.00 179.25 179.64 3dug h ALA 233 N 1.16 0.87 -0.06 0.00 0.00 -0.89 0.23 119.26 120.57 3dug h ALA 233 Ca 0.21 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3dug h ALA 233 Cb 0.02 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 3dug h ALA 233 CO -0.04 0.41 0.01 0.82 0.00 0.00 0.00 179.25 180.46 3dug h ILE 234 N 0.94 1.19 -0.03 0.00 2.04 -1.31 -1.79 117.51 118.55 3dug h ILE 234 Ca 0.24 -0.57 0.01 0.00 1.00 0.00 0.00 64.86 65.54 3dug h ILE 234 Cb 0.07 1.47 -0.00 0.00 -0.74 0.00 0.00 36.82 37.62 3dug h ILE 234 CO -0.03 0.16 0.02 0.50 0.00 0.00 0.00 178.15 178.80 3dug h LYS 235 N -0.13 0.00 0.00 2.37 3.64 -0.87 -0.49 116.57 121.10 3dug h LYS 235 Ca 0.02 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 3dug h LYS 235 Cb 0.24 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 3dug h LYS 235 CO 0.00 0.00 -0.44 0.00 -2.27 0.00 0.00 179.45 176.74 3dug h ALA 236 N 1.98 0.83 0.00 5.00 0.00 -0.27 -3.48 119.26 123.32 3dug h ALA 236 Ca 0.02 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3dug h ALA 236 Cb 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3dug h ALA 236 CO -0.00 0.55 0.00 0.41 0.00 0.00 0.00 179.25 180.21 3dug n GLY 237 N 0.71 1.45 3.76 0.00 0.00 -0.19 -4.70 105.19 106.22 3dug n GLY 237 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 3dug n GLY 237 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dug s VAL 238 N -2.00 3.04 0.05 1.61 -7.23 -0.76 -4.93 120.40 110.17 3dug s VAL 238 Ca 0.00 0.46 0.09 0.00 -1.81 0.00 0.00 61.98 60.72 3dug s VAL 238 Cb 0.00 -2.95 -0.22 0.00 0.56 0.00 0.00 36.38 33.77 3dug s VAL 238 CO 0.00 -0.33 1.01 0.44 -0.31 0.00 0.00 175.10 175.91 3dug h ASP 239 N -0.32 0.00 -4.79 4.85 3.32 -1.46 -3.43 116.42 114.60 3dug h ASP 239 Ca -0.46 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.44 3dug h ASP 239 Cb 1.25 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.59 3dug h ASP 239 CO 0.52 1.00 -0.49 -0.94 -1.72 0.00 0.00 179.24 177.60 3dug s SER 240 N -6.44 -0.01 -0.25 6.45 1.04 -0.97 -1.56 113.70 111.97 3dug s SER 240 Ca -0.01 -0.12 -0.05 0.00 0.48 0.00 0.00 55.95 56.24 3dug s SER 240 Cb 0.09 0.23 -0.01 0.00 0.10 0.00 0.00 66.02 66.43 3dug s SER 240 CO 0.82 -0.32 0.01 -0.69 0.98 0.00 0.00 173.24 174.05 3dug s VAL 241 N -1.15 3.72 0.35 5.02 1.01 -0.21 -1.38 120.40 127.75 3dug s VAL 241 Ca -0.12 -0.50 -0.25 0.00 0.00 0.00 0.00 61.98 61.11 3dug s VAL 241 Cb -0.07 -2.77 -0.10 0.00 0.00 0.00 0.00 36.38 33.44 3dug s VAL 241 CO 0.01 0.30 0.96 -1.61 0.00 0.00 0.00 175.10 174.76 3dug s GLU 242 N 1.51 4.49 0.00 2.72 0.41 0.61 -1.02 118.70 127.41 3dug s GLU 242 Ca 0.05 1.32 0.00 0.00 -0.41 0.00 0.00 54.97 55.93 3dug s GLU 242 Cb -0.15 -2.68 0.00 0.00 -1.78 0.00 0.00 34.13 29.52 3dug s GLU 242 CO -0.00 0.19 0.00 0.72 -0.49 0.00 0.00 175.26 175.68 3dug n HIS 243 N 0.32 0.00 -3.96 1.61 8.25 0.42 -2.41 115.22 119.44 3dug n HIS 243 Ca 0.03 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.18 3dug n HIS 243 Cb 0.51 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.63 3dug n HIS 243 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dug n ALA 244 N 0.00 -1.38 0.09 -1.41 0.00 -0.69 -4.54 120.51 112.58 3dug n ALA 244 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.54 3dug n ALA 244 Cb 0.00 -3.93 0.32 0.00 0.00 0.00 0.00 19.45 15.84 3dug n ALA 244 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3dug h SER 245 N -1.94 0.28 -1.30 0.00 0.02 -1.64 -3.05 113.55 105.92 3dug h SER 245 Ca -0.59 -0.08 -0.61 0.00 -0.84 0.00 0.00 61.79 59.68 3dug h SER 245 Cb 1.38 -0.07 -0.39 0.00 0.14 0.00 0.00 62.40 63.45 3dug h SER 245 CO 0.68 0.50 -0.40 0.49 -1.14 0.00 0.00 176.83 176.96 3dug n PHE 246 N -4.19 3.14 -2.76 3.45 3.72 -0.85 -3.71 117.46 116.27 3dug n PHE 246 Ca -0.01 -2.73 -0.42 0.00 -0.05 0.00 0.00 57.45 54.24 3dug n PHE 246 Cb 0.34 -0.41 -0.03 0.00 -0.94 0.00 0.00 39.48 38.44 3dug n PHE 246 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 3dug s ILE 247 N -5.13 4.84 0.52 4.37 2.07 -1.15 -4.15 121.20 122.57 3dug s ILE 247 Ca 0.51 1.93 0.09 0.00 -1.41 0.00 0.00 60.65 61.76 3dug s ILE 247 Cb 0.42 -4.26 0.06 0.00 0.13 0.00 0.00 42.46 38.80 3dug s ILE 247 CO -0.13 0.06 0.71 1.51 -1.91 0.00 0.00 174.94 175.18 3dug s ASP 248 N 1.07 5.29 0.20 4.50 -4.77 -1.26 -4.88 116.67 116.82 3dug s ASP 248 Ca 0.46 -0.66 -0.11 0.00 -3.30 0.00 0.00 52.55 48.94 3dug s ASP 248 Cb -0.18 -0.09 0.26 0.00 -1.09 0.00 0.00 42.92 41.82 3dug s ASP 248 CO 0.19 -1.14 1.70 0.44 0.70 0.00 0.00 175.17 177.06 3dug h ASP 249 N 0.33 -0.05 -0.63 2.11 3.45 -1.99 -1.34 116.42 118.30 3dug h ASP 249 Ca -0.34 0.11 -0.05 0.00 0.43 0.00 0.00 57.03 57.18 3dug h ASP 249 Cb 1.28 0.16 -0.03 0.00 -0.56 0.00 0.00 39.33 40.19 3dug h ASP 249 CO 0.42 -0.01 0.21 -0.33 -1.57 0.00 0.00 179.24 177.97 3dug h GLU 250 N 0.22 1.00 0.00 3.56 5.08 -2.00 -2.71 114.58 119.74 3dug h GLU 250 Ca 0.29 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3dug h GLU 250 Cb 0.43 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3dug h GLU 250 CO -0.40 0.85 -0.93 0.25 -1.00 0.00 0.00 179.01 177.79 3dug n THR 251 N -4.27 0.27 -0.23 1.13 -2.24 -1.05 -2.23 114.28 105.66 3dug n THR 251 Ca 0.05 -0.29 -0.08 0.00 -2.27 0.00 0.00 64.05 61.47 3dug n THR 251 Cb 0.21 0.04 0.03 0.00 -2.10 0.00 0.00 70.33 68.52 3dug n THR 251 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 3dug h ILE 252 N 0.00 1.25 -0.52 2.28 2.04 -1.15 -1.98 117.51 119.43 3dug h ILE 252 Ca 0.00 -0.89 -0.07 0.00 1.00 0.00 0.00 64.86 64.90 3dug h ILE 252 Cb 0.77 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 3dug h ILE 252 CO 0.00 0.34 0.03 0.44 0.00 0.00 0.00 178.15 178.96 3dug h ASP 253 N 0.93 0.82 -0.48 1.72 3.32 -1.40 -1.42 116.42 119.90 3dug h ASP 253 Ca 0.20 -0.19 0.03 0.00 0.02 0.00 0.00 57.03 57.09 3dug h ASP 253 Cb 0.32 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.62 3dug h ASP 253 CO -0.00 0.86 0.27 0.24 -1.72 0.00 0.00 179.24 178.89 3dug h MET 254 N 0.80 0.52 -0.44 3.56 2.86 -1.32 -1.37 114.93 119.55 3dug h MET 254 Ca 0.16 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.74 3dug h MET 254 Cb 0.43 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 3dug h MET 254 CO 0.02 0.35 0.16 0.00 1.06 0.00 0.00 176.91 178.49 3dug h ALA 255 N 1.23 0.58 -0.27 6.32 0.00 -1.02 -1.97 119.26 124.13 3dug h ALA 255 Ca 0.20 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3dug h ALA 255 Cb 0.06 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3dug h ALA 255 CO -0.11 0.20 0.18 0.82 0.00 0.00 0.00 179.25 180.33 3dug h ILE 256 N 0.57 1.07 -0.21 0.00 2.04 -1.14 0.21 117.51 120.05 3dug h ILE 256 Ca 0.15 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.86 3dug h ILE 256 Cb 0.22 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 3dug h ILE 256 CO -0.01 0.07 0.02 0.50 0.00 0.00 0.00 178.15 178.72 3dug h LYS 257 N 0.36 0.30 -0.15 2.37 3.64 -1.12 -3.10 116.57 118.87 3dug h LYS 257 Ca 0.10 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 3dug h LYS 257 Cb -0.04 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 3dug h LYS 257 CO -0.02 0.32 0.00 0.09 -2.27 0.00 0.00 179.45 177.57 3dug n ASN 258 N -4.38 2.92 -2.14 4.20 3.02 -0.75 -4.97 115.26 113.17 3dug n ASN 258 Ca 0.00 -1.89 -0.19 0.00 -0.03 0.00 0.00 54.58 52.47 3dug n ASN 258 Cb 0.18 -0.09 -0.01 0.00 -0.61 0.00 0.00 39.78 39.25 3dug n ASN 258 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3dug n ASN 259 N 1.21 -5.46 -4.65 6.41 3.02 -0.44 -4.97 115.26 110.38 3dug n ASN 259 Ca 0.14 -0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.26 3dug n ASN 259 Cb 0.53 -4.51 -0.02 0.00 -0.61 0.00 0.00 39.78 35.17 3dug n ASN 259 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3dug s THR 260 N -2.94 4.49 0.37 3.41 2.01 -0.07 -4.92 115.64 117.99 3dug s THR 260 Ca 0.00 1.74 -0.26 0.00 0.31 0.00 0.00 61.69 63.48 3dug s THR 260 Cb 0.00 -4.31 -0.09 0.00 0.01 0.00 0.00 72.50 68.11 3dug s THR 260 CO 0.00 -0.36 1.14 -0.69 -0.69 0.00 0.00 174.62 174.02 3dug s VAL 261 N 3.60 3.30 -0.40 3.82 1.01 -0.60 -4.59 120.40 126.54 3dug s VAL 261 Ca 0.47 1.14 -0.09 0.00 0.00 0.00 0.00 61.98 63.50 3dug s VAL 261 Cb -0.14 -3.66 0.07 0.00 0.00 0.00 0.00 36.38 32.65 3dug s VAL 261 CO 0.14 0.15 0.23 -0.76 0.00 0.00 0.00 175.10 174.85 3dug s LEU 262 N -2.21 5.00 -0.72 3.92 1.02 0.56 -1.05 118.68 125.19 3dug s LEU 262 Ca 0.53 -1.43 -0.19 0.00 0.02 0.00 0.00 54.13 53.06 3dug s LEU 262 Cb -0.30 -1.97 0.12 0.00 0.02 0.00 0.00 46.19 44.06 3dug s LEU 262 CO 0.38 -0.50 0.87 -0.55 0.02 0.00 0.00 176.35 176.57 3dug s SER 263 N 1.96 6.37 -0.17 2.29 0.15 -0.19 -2.43 113.70 121.68 3dug s SER 263 Ca 0.02 -1.68 -0.04 0.00 0.70 0.00 0.00 55.95 54.95 3dug s SER 263 Cb -0.22 -2.33 -0.02 0.00 -1.71 0.00 0.00 66.02 61.73 3dug s SER 263 CO 0.02 -1.09 -0.04 -0.04 1.20 0.00 0.00 173.24 173.30 3dug s MET 264 N 2.59 3.61 -0.99 5.44 -1.94 -1.25 -0.44 119.30 126.32 3dug s MET 264 Ca 0.20 -0.54 -0.07 0.00 -1.71 0.00 0.00 55.69 53.56 3dug s MET 264 Cb -0.16 -2.94 0.25 0.00 2.01 0.00 0.00 34.83 33.98 3dug s MET 264 CO 0.01 0.14 0.94 0.16 -0.01 0.00 0.00 175.02 176.26 3dug s ASP 265 N 0.62 6.74 0.17 3.03 -4.77 -1.22 -4.27 116.67 116.97 3dug s ASP 265 Ca -0.02 -3.50 0.09 0.00 -3.30 0.00 0.00 52.55 45.82 3dug s ASP 265 Cb -0.14 -2.10 -0.08 0.00 -1.09 0.00 0.00 42.92 39.51 3dug s ASP 265 CO 0.02 -0.29 1.36 0.16 0.70 0.00 0.00 175.17 177.12 3dug h ILE 266 N 4.00 1.54 -0.00 2.11 3.07 -1.90 -3.36 117.51 122.98 3dug h ILE 266 Ca 0.15 -3.05 -0.00 0.00 1.55 0.00 0.00 64.86 63.52 3dug h ILE 266 Cb 0.88 2.68 -0.00 0.00 -0.27 0.00 0.00 36.82 40.11 3dug h ILE 266 CO 0.92 0.85 -0.00 0.15 -1.05 0.00 0.00 178.15 179.02 3dug h PHE 267 N 0.00 0.00 -0.17 0.16 3.57 -1.90 -3.35 116.94 115.25 3dug h PHE 267 Ca -0.01 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.54 3dug h PHE 267 Cb 1.61 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.34 3dug h PHE 267 CO 0.00 0.42 0.21 -0.24 -2.23 0.00 0.00 178.31 176.47 3dug h VAL 268 N -0.41 0.38 -0.44 1.41 3.04 -1.77 -1.65 116.25 116.80 3dug h VAL 268 Ca 0.00 0.00 0.02 0.00 -1.01 0.00 0.00 66.70 65.71 3dug h VAL 268 Cb 0.42 0.82 -0.02 0.00 -2.01 0.00 0.00 31.29 30.50 3dug h VAL 268 CO 0.00 0.00 0.30 -1.28 -1.01 0.00 0.00 177.57 175.58 3dug h SER 269 N 0.00 0.44 0.39 3.17 0.87 -1.79 -1.77 113.55 114.86 3dug h SER 269 Ca 0.08 -0.01 -0.13 0.00 -1.23 0.00 0.00 61.79 60.50 3dug h SER 269 Cb 0.51 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 3dug h SER 269 CO -0.00 0.31 -0.56 0.44 -0.53 0.00 0.00 176.83 176.49 3dug h ASP 270 N 0.52 0.21 -0.22 6.23 3.45 -1.55 -2.61 116.42 122.45 3dug h ASP 270 Ca 0.18 -0.11 -0.06 0.00 0.43 0.00 0.00 57.03 57.47 3dug h ASP 270 Cb 0.06 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 38.77 3dug h ASP 270 CO -0.04 0.73 -0.08 0.22 -1.57 0.00 0.00 179.24 178.49 3dug h TYR 271 N 0.14 0.51 -0.17 4.55 3.20 -1.50 -2.57 116.97 121.14 3dug h TYR 271 Ca -0.00 -0.12 -0.02 0.00 3.14 0.00 0.00 58.73 61.73 3dug h TYR 271 Cb 1.03 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.17 3dug h TYR 271 CO 0.02 0.71 0.02 0.82 -1.64 0.00 0.00 178.16 178.08 3dug h ILE 272 N 0.17 1.24 0.00 1.81 2.04 -1.32 0.49 117.51 121.94 3dug h ILE 272 Ca 0.05 -0.78 -0.12 0.00 1.00 0.00 0.00 64.86 65.02 3dug h ILE 272 Cb 0.56 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 3dug h ILE 272 CO 0.03 0.23 -0.58 -0.07 0.00 0.00 0.00 178.15 177.76 3dug h LEU 273 N 0.05 0.00 0.00 1.44 3.38 -1.60 -2.39 115.31 116.20 3dug h LEU 273 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3dug h LEU 273 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3dug h LEU 273 CO 0.01 0.58 0.00 0.61 0.09 0.00 0.00 178.44 179.72 3dug n GLY 274 N 0.41 0.37 0.25 0.83 0.00 -0.97 -4.50 105.19 101.59 3dug n GLY 274 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 3dug n GLY 274 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3dug h GLU 275 N 0.00 0.48 0.00 1.61 4.39 -1.34 -3.18 114.58 116.54 3dug h GLU 275 Ca 0.00 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.56 3dug h GLU 275 Cb 0.00 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.60 3dug h GLU 275 CO 0.00 0.61 -0.01 0.78 -1.16 0.00 0.00 179.01 179.23 3dug h GLY 276 N 0.93 0.00 1.65 -3.84 0.00 -0.13 -3.03 103.07 98.65 3dug h GLY 276 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.38 3dug h GLY 276 CO 0.03 0.00 0.03 0.00 0.00 0.00 0.00 176.54 176.60 3dug h ALA 277 N 1.99 1.50 0.00 3.60 0.00 -1.40 -2.68 119.26 122.27 3dug h ALA 277 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3dug h ALA 277 Cb 0.93 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3dug h ALA 277 CO 0.00 0.37 -1.23 1.17 0.00 0.00 0.00 179.25 179.56 3dug n LYS 278 N -4.33 0.38 0.26 0.00 4.81 -1.24 -4.44 118.16 113.60 3dug n LYS 278 Ca 0.01 -0.05 0.15 0.00 -0.87 0.00 0.00 58.31 57.55 3dug n LYS 278 Cb 0.20 -1.47 0.52 0.00 0.02 0.00 0.00 35.03 34.30 3dug n LYS 278 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3dug h ALA 279 N 2.62 1.00 0.00 3.14 0.00 -1.35 -3.46 119.26 121.20 3dug h ALA 279 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3dug h ALA 279 Cb 0.61 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3dug h ALA 279 CO 0.00 0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.69 3dug n GLY 280 N 0.36 0.64 3.71 0.00 0.00 -1.19 -5.03 105.19 103.68 3dug n GLY 280 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 3dug n GLY 280 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dug s ILE 281 N -1.27 4.24 0.76 -0.61 1.01 -1.08 -5.01 121.20 119.24 3dug s ILE 281 Ca 0.00 1.61 -0.14 0.00 0.00 0.00 0.00 60.65 62.12 3dug s ILE 281 Cb 0.00 -4.03 0.06 0.00 0.01 0.00 0.00 42.46 38.50 3dug s ILE 281 CO 0.00 0.12 1.18 -0.13 0.00 0.00 0.00 174.94 176.10 3dug s ARG 282 N 1.14 2.01 0.31 2.79 0.52 -1.26 -4.83 118.95 119.63 3dug s ARG 282 Ca 0.57 1.64 -0.00 0.00 -0.52 0.00 0.00 55.73 57.42 3dug s ARG 282 Cb -0.27 -1.83 0.51 0.00 0.52 0.00 0.00 34.95 33.88 3dug s ARG 282 CO 0.28 -1.91 1.97 0.93 0.02 0.00 0.00 175.30 176.60 3dug h GLU 283 N -0.61 1.01 -0.21 3.54 4.39 -1.97 -2.25 114.58 118.47 3dug h GLU 283 Ca -0.46 -0.06 -0.08 0.00 0.34 0.00 0.00 59.36 59.10 3dug h GLU 283 Cb 1.28 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 29.69 3dug h GLU 283 CO 0.49 0.67 -0.21 1.49 -1.16 0.00 0.00 179.01 180.28 3dug h GLU 284 N 1.04 0.38 -0.15 2.33 4.81 -1.97 -2.67 114.58 118.35 3dug h GLU 284 Ca 0.30 -0.12 -0.22 0.00 -0.13 0.00 0.00 59.36 59.19 3dug h GLU 284 Cb -0.07 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.29 3dug h GLU 284 CO -0.07 0.58 -0.76 0.77 -0.73 0.00 0.00 179.01 178.80 3dug h SER 285 N 0.35 0.87 -0.08 1.04 0.02 -1.64 -2.89 113.55 111.22 3dug h SER 285 Ca 0.06 -0.56 -0.09 0.00 -0.84 0.00 0.00 61.79 60.36 3dug h SER 285 Cb 0.57 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 3dug h SER 285 CO 0.04 1.36 -0.20 -0.07 -1.14 0.00 0.00 176.83 176.81 3dug h LEU 286 N 0.51 0.48 -0.49 5.07 3.38 -1.33 -0.68 115.31 122.25 3dug h LEU 286 Ca -0.05 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 57.63 3dug h LEU 286 Cb 1.38 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 3dug h LEU 286 CO 0.15 0.69 -0.37 0.78 0.09 0.00 0.00 178.44 179.78 3dug h ASN 287 N 0.43 0.89 1.19 -0.43 2.35 -1.53 -2.52 115.58 115.97 3dug h ASN 287 Ca 0.07 -0.40 -0.03 0.00 -0.55 0.00 0.00 56.30 55.40 3dug h ASN 287 Cb 0.60 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.71 3dug h ASN 287 CO 0.04 1.16 -0.13 0.11 -1.65 0.00 0.00 177.43 176.96 3dug h LYS 288 N 0.70 0.00 -0.09 0.81 1.57 -1.32 -3.02 116.57 115.22 3dug h LYS 288 Ca 0.06 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.64 3dug h LYS 288 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.25 3dug h LYS 288 CO 0.09 0.13 -0.77 1.49 -0.57 0.00 0.00 179.45 179.82 3dug h GLU 289 N 0.00 0.51 0.00 3.15 4.57 -0.94 -3.04 114.58 118.83 3dug h GLU 289 Ca -0.00 -0.43 -0.07 0.00 -1.18 0.00 0.00 59.36 57.67 3dug h GLU 289 Cb 0.76 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.44 3dug h GLU 289 CO 0.02 1.07 -0.36 0.00 -1.18 0.00 0.00 179.01 178.56 3dug h ARG 290 N 0.34 0.00 -0.04 1.92 3.08 -1.37 0.75 114.38 119.07 3dug h ARG 290 Ca -0.04 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.88 3dug h ARG 290 Cb 1.37 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.40 3dug h ARG 290 CO 0.14 0.36 -0.57 -0.07 -1.07 0.00 0.00 179.97 178.76 3dug h LEU 291 N 0.00 0.14 0.01 3.04 4.07 -1.55 -3.40 115.31 117.62 3dug h LEU 291 Ca -0.00 -0.08 -0.40 0.00 0.08 0.00 0.00 57.88 57.48 3dug h LEU 291 Cb 0.72 -0.04 -0.06 0.00 1.08 0.00 0.00 40.66 42.36 3dug h LEU 291 CO 0.05 0.68 -2.24 0.52 -1.08 0.00 0.00 178.44 176.37 3dug n VAL 292 N -3.88 1.54 0.05 1.22 0.31 -1.02 -4.69 118.33 111.87 3dug n VAL 292 Ca -0.02 -0.36 -0.09 0.00 -0.01 0.00 0.00 64.34 63.86 3dug n VAL 292 Cb 0.59 -1.83 -0.06 0.00 -0.91 0.00 0.00 33.84 31.62 3dug n VAL 292 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3dug h GLY 293 N -0.40 -1.21 1.24 2.92 0.00 -1.07 -1.82 103.07 102.73 3dug h GLY 293 Ca -0.60 0.61 -0.04 0.00 0.00 0.00 0.00 47.33 47.31 3dug h GLY 293 CO -0.30 -0.35 0.25 1.70 0.00 0.00 0.00 176.54 177.84 3dug h LYS 294 N -0.42 0.97 -0.00 4.80 3.64 -1.82 -2.97 116.57 120.76 3dug h LYS 294 Ca 0.00 -0.16 -0.13 0.00 -1.27 0.00 0.00 60.65 59.08 3dug h LYS 294 Cb 0.43 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 3dug h LYS 294 CO -0.18 0.80 -0.62 -0.22 -2.27 0.00 0.00 179.45 176.96 3dug h LYS 295 N 0.95 0.01 -0.38 1.90 3.64 -1.82 -3.22 116.57 117.66 3dug h LYS 295 Ca 0.22 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.53 3dug h LYS 295 Cb 0.20 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3dug h LYS 295 CO -0.02 0.63 -0.00 0.37 -2.27 0.00 0.00 179.45 178.15 3dug h GLN 296 N 0.01 0.67 0.00 1.90 4.15 -1.16 -2.47 115.11 118.21 3dug h GLN 296 Ca -0.01 -0.22 -0.13 0.00 0.77 0.00 0.00 58.65 59.07 3dug h GLN 296 Cb 1.10 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.71 3dug h GLN 296 CO 0.08 0.78 -0.62 0.07 -1.93 0.00 0.00 178.83 177.21 3dug h ARG 297 N 0.49 0.00 -0.53 1.69 0.11 -1.63 0.38 114.38 114.88 3dug h ARG 297 Ca 0.11 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.14 3dug h ARG 297 Cb 0.48 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.53 3dug h ARG 297 CO 0.02 0.62 0.17 0.93 0.10 0.00 0.00 179.97 181.81 3dug h GLU 298 N 0.00 0.83 -0.01 0.08 5.08 -1.55 -2.52 114.58 116.49 3dug h GLU 298 Ca -0.01 -0.18 -0.12 0.00 -1.00 0.00 0.00 59.36 58.06 3dug h GLU 298 Cb 1.13 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.24 3dug h GLU 298 CO 0.08 0.76 -0.56 -0.91 -1.00 0.00 0.00 179.01 177.38 3dug h ASN 299 N 0.74 0.04 -0.35 1.42 2.35 -1.28 -2.62 115.58 115.87 3dug h ASN 299 Ca 0.17 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 3dug h ASN 299 Cb 0.28 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.62 3dug h ASN 299 CO -0.01 0.59 0.19 0.15 -1.65 0.00 0.00 177.43 176.70 3dug h PHE 300 N 0.03 0.49 -0.63 1.19 3.57 -0.83 -0.49 116.94 120.27 3dug h PHE 300 Ca -0.00 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.42 3dug h PHE 300 Cb 1.00 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.56 3dug h PHE 300 CO 0.00 0.40 0.18 1.98 -2.23 0.00 0.00 178.31 178.64 3dug h MET 301 N 0.44 0.99 -0.39 1.11 4.05 -1.40 -1.87 114.93 117.87 3dug h MET 301 Ca 0.12 -0.22 -0.10 0.00 -0.28 0.00 0.00 59.70 59.22 3dug h MET 301 Cb 0.08 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.73 3dug h MET 301 CO -0.02 0.89 -0.16 -0.97 0.23 0.00 0.00 176.91 176.87 3dug h ASN 302 N 0.92 0.82 -0.66 1.39 -1.24 -1.38 -2.72 115.58 112.70 3dug h ASN 302 Ca 0.20 -0.39 -0.08 0.00 0.71 0.00 0.00 56.30 56.73 3dug h ASN 302 Cb 0.32 -0.22 -0.03 0.00 0.73 0.00 0.00 38.32 39.12 3dug h ASN 302 CO -0.00 1.03 0.09 0.00 -1.29 0.00 0.00 177.43 177.26 3dug h ALA 303 N 0.81 0.88 -0.08 1.57 0.00 -0.97 -1.07 119.26 120.41 3dug h ALA 303 Ca 0.09 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3dug h ALA 303 Cb 0.71 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 3dug h ALA 303 CO 0.05 0.66 0.03 1.25 0.00 0.00 0.00 179.25 181.25 3dug h HIS 304 N 1.03 0.12 -0.39 0.00 -0.00 -1.37 -1.20 115.15 113.34 3dug h HIS 304 Ca 0.20 -0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.58 3dug h HIS 304 Cb 0.46 -0.04 -0.03 0.00 -0.00 0.00 0.00 27.41 27.81 3dug h HIS 304 CO 0.03 0.24 0.21 0.00 -0.00 0.00 0.00 177.93 178.41 3dug h ARG 305 N -0.03 0.41 0.00 5.26 3.08 -1.32 -1.86 114.38 119.92 3dug h ARG 305 Ca 0.03 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dug h ARG 305 Cb 0.17 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.13 3dug h ARG 305 CO -0.00 0.27 0.00 0.00 -1.07 0.00 0.00 179.97 179.17 3dug h ARG 306 N 0.42 0.00 0.00 0.04 3.08 -1.13 -3.46 114.38 113.34 3dug h ARG 306 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 3dug h ARG 306 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 3dug h ARG 306 CO -0.10 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.21 3dug n GLY 307 N -0.53 1.46 3.80 0.04 0.00 -0.70 -5.03 105.19 104.24 3dug n GLY 307 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3dug n GLY 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dug s ALA 308 N -2.00 3.31 -0.19 4.61 0.00 -0.49 -4.94 121.76 122.06 3dug s ALA 308 Ca 0.00 0.31 -0.29 0.00 0.00 0.00 0.00 51.96 51.98 3dug s ALA 308 Cb 0.00 -2.98 -0.02 0.00 0.00 0.00 0.00 23.12 20.13 3dug s ALA 308 CO 0.00 0.26 1.33 0.42 0.00 0.00 0.00 175.76 177.77 3dug s ILE 309 N -1.63 4.15 -0.13 0.00 1.01 -1.26 -4.58 121.20 118.75 3dug s ILE 309 Ca 0.48 1.36 0.03 0.00 0.00 0.00 0.00 60.65 62.52 3dug s ILE 309 Cb -0.17 -3.96 0.01 0.00 0.01 0.00 0.00 42.46 38.35 3dug s ILE 309 CO 0.21 -0.21 -0.22 -0.63 0.00 0.00 0.00 174.94 174.09 3dug s ILE 310 N 3.86 2.02 0.37 2.92 1.01 -1.26 -0.33 121.20 129.80 3dug s ILE 310 Ca 0.58 -0.96 0.07 0.00 0.00 0.00 0.00 60.65 60.34 3dug s ILE 310 Cb -0.22 -1.79 -0.01 0.00 0.01 0.00 0.00 42.46 40.46 3dug s ILE 310 CO 0.19 0.54 0.46 0.42 0.00 0.00 0.00 174.94 176.55 3dug s THR 311 N 0.78 3.45 -0.73 2.92 -4.23 -1.02 -4.68 115.64 112.12 3dug s THR 311 Ca -0.08 -1.10 -0.23 0.00 -1.18 0.00 0.00 61.69 59.10 3dug s THR 311 Cb -0.16 -3.18 0.07 0.00 1.34 0.00 0.00 72.50 70.57 3dug s THR 311 CO -0.01 -0.09 1.05 0.12 -0.54 0.00 0.00 174.62 175.16 3dug s PHE 312 N -2.29 2.69 -0.07 3.99 5.36 -0.71 -3.91 117.98 123.03 3dug s PHE 312 Ca 0.48 -0.64 0.03 0.00 -0.96 0.00 0.00 56.93 55.84 3dug s PHE 312 Cb -0.08 -4.36 0.01 0.00 -0.34 0.00 0.00 43.02 38.25 3dug s PHE 312 CO 0.31 -1.69 -0.16 0.20 -1.46 0.00 0.00 175.22 172.41 3dug s GLY 313 N 3.76 0.95 -0.05 13.12 0.00 -1.26 -0.05 107.32 123.80 3dug s GLY 313 Ca 0.27 -0.60 0.11 0.00 0.00 0.00 0.00 44.72 44.50 3dug s GLY 313 CO 0.06 -0.07 0.18 -1.30 0.00 0.00 0.00 173.10 171.98 3dug n THR 314 N 3.64 0.26 -3.24 0.90 -2.24 -1.23 -3.45 114.28 108.91 3dug n THR 314 Ca -0.21 -0.33 -0.16 0.00 -2.27 0.00 0.00 64.05 61.07 3dug n THR 314 Cb 0.52 -0.10 0.07 0.00 -2.10 0.00 0.00 70.33 68.73 3dug n THR 314 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3dug n ASP 315 N -2.08 -3.34 -4.74 3.42 -0.08 -0.53 -4.42 116.55 104.78 3dug n ASP 315 Ca -0.08 -0.48 -0.41 0.00 -1.51 0.00 0.00 54.79 52.31 3dug n ASP 315 Cb 0.50 -4.23 -0.02 0.00 2.34 0.00 0.00 41.12 39.71 3dug n ASP 315 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3dug s ALA 316 N -3.28 3.61 0.00 -1.67 0.00 -1.20 -3.11 121.76 116.12 3dug s ALA 316 Ca 0.18 1.30 0.00 0.00 0.00 0.00 0.00 51.96 53.43 3dug s ALA 316 Cb -0.08 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.50 3dug s ALA 316 CO 0.59 -0.71 0.00 0.41 0.00 0.00 0.00 175.76 176.05 3dug n GLY 317 N 2.19 3.76 0.31 0.00 0.00 -1.26 -0.60 105.19 109.59 3dug n GLY 317 Ca 0.06 -0.78 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 3dug n GLY 317 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3dug h ILE 318 N 0.00 0.00 -3.36 -0.61 2.04 -1.89 -3.45 117.51 110.24 3dug h ILE 318 Ca 0.00 -0.13 -0.46 0.00 1.00 0.00 0.00 64.86 65.28 3dug h ILE 318 Cb 0.00 0.00 0.12 0.00 -0.74 0.00 0.00 36.82 36.20 3dug h ILE 318 CO 0.00 0.00 0.28 0.72 0.00 0.00 0.00 178.15 179.15 3dug s PHE 319 N -4.41 1.88 0.21 1.37 -0.71 -1.26 -5.05 117.98 110.01 3dug s PHE 319 Ca -0.11 0.15 -0.30 0.00 -1.04 0.00 0.00 56.93 55.63 3dug s PHE 319 Cb 0.01 -3.54 -0.09 0.00 -1.21 0.00 0.00 43.02 38.19 3dug s PHE 319 CO 0.34 -2.07 1.31 -0.51 -1.34 0.00 0.00 175.22 172.96 3dug s ASP 320 N -4.76 6.88 0.09 1.98 1.11 -1.26 -4.79 116.67 115.92 3dug s ASP 320 Ca 0.68 2.43 -0.31 0.00 0.18 0.00 0.00 52.55 55.53 3dug s ASP 320 Cb -0.06 -2.61 -0.07 0.00 1.07 0.00 0.00 42.92 41.25 3dug s ASP 320 CO 0.48 -0.53 1.40 -1.00 1.18 0.00 0.00 175.17 176.70 3dug s HIS 321 N 0.03 3.13 0.00 4.23 3.76 -1.26 -2.36 115.29 122.82 3dug s HIS 321 Ca 0.56 0.91 0.00 0.00 -0.15 0.00 0.00 55.06 56.38 3dug s HIS 321 Cb -0.37 -3.68 0.00 0.00 1.11 0.00 0.00 32.58 29.64 3dug s HIS 321 CO 0.39 -2.42 0.00 0.41 -0.85 0.00 0.00 174.74 172.27 3dug n GLY 322 N 3.54 2.28 1.38 -2.22 0.00 -1.26 -4.66 105.19 104.25 3dug n GLY 322 Ca 0.12 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.19 3dug n GLY 322 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dug n ASP 323 N 0.00 4.02 0.08 1.61 10.43 -1.00 -4.51 116.55 127.18 3dug n ASP 323 Ca 0.00 -2.57 0.03 0.00 2.57 0.00 0.00 54.79 54.82 3dug n ASP 323 Cb 0.00 -0.60 0.41 0.00 1.84 0.00 0.00 41.12 42.77 3dug n ASP 323 CO 0.00 0.00 0.00 0.78 -1.07 0.00 0.00 177.20 176.91 3dug h ASN 324 N 2.64 0.31 0.49 -2.24 4.21 -1.92 -2.74 115.58 116.33 3dug h ASN 324 Ca 0.00 -0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.47 3dug h ASN 324 Cb 1.42 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 38.54 3dug h ASN 324 CO 0.30 0.36 0.00 0.00 -1.29 0.00 0.00 177.43 176.80 3dug n ALA 325 N -2.49 1.56 0.28 -0.83 0.00 -1.26 -2.54 120.51 115.22 3dug n ALA 325 Ca 0.00 0.01 0.16 0.00 0.00 0.00 0.00 53.44 53.61 3dug n ALA 325 Cb 0.19 -1.26 0.80 0.00 0.00 0.00 0.00 19.45 19.18 3dug n ALA 325 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3dug h LYS 326 N 0.00 0.00 0.00 0.00 1.57 -1.85 -2.82 116.57 113.47 3dug h LYS 326 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dug h LYS 326 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 3dug h LYS 326 CO 0.00 0.07 0.00 0.37 -0.57 0.00 0.00 179.45 179.32 3dug h GLN 327 N 0.00 0.00 -0.63 3.15 4.15 -1.73 -3.22 115.11 116.83 3dug h GLN 327 Ca -0.00 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 3dug h GLN 327 Cb 0.33 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.99 3dug h GLN 327 CO 0.01 0.00 0.34 0.74 -1.93 0.00 0.00 178.83 177.99 3dug h PHE 328 N 0.00 0.86 -0.91 3.99 0.04 -1.74 -1.03 116.94 118.15 3dug h PHE 328 Ca 0.00 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 3dug h PHE 328 Cb 0.44 -0.27 -0.04 0.00 2.20 0.00 0.00 35.95 38.27 3dug h PHE 328 CO 0.00 0.62 0.51 0.00 -0.60 0.00 0.00 178.31 178.84 3dug h ALA 329 N 1.16 1.17 -0.18 2.45 0.00 -1.77 -2.08 119.26 120.01 3dug h ALA 329 Ca 0.22 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 3dug h ALA 329 Cb 0.05 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 3dug h ALA 329 CO -0.03 0.66 -0.20 1.88 0.00 0.00 0.00 179.25 181.55 3dug h TYR 330 N 1.27 0.33 -0.19 0.00 0.05 -1.62 -2.70 116.97 114.11 3dug h TYR 330 Ca 0.32 -0.05 -0.19 0.00 0.05 0.00 0.00 58.73 58.86 3dug h TYR 330 Cb 0.00 -0.09 -0.00 0.00 1.01 0.00 0.00 36.73 37.66 3dug h TYR 330 CO 0.01 0.49 -0.63 1.98 -1.05 0.00 0.00 178.16 178.96 3dug h MET 331 N 0.28 0.67 0.00 4.88 4.05 -0.51 -2.20 114.93 122.09 3dug h MET 331 Ca 0.05 -0.47 -0.21 0.00 -0.28 0.00 0.00 59.70 58.79 3dug h MET 331 Cb 0.52 0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.39 3dug h MET 331 CO 0.03 1.09 -0.90 -0.39 0.23 0.00 0.00 176.91 176.98 3dug h VAL 332 N 0.50 1.46 -0.22 -5.77 -1.51 -1.43 -2.70 116.25 106.58 3dug h VAL 332 Ca -0.01 -2.54 -0.05 0.00 -1.23 0.00 0.00 66.70 62.87 3dug h VAL 332 Cb 1.22 2.44 -0.01 0.00 -2.13 0.00 0.00 31.29 32.80 3dug h VAL 332 CO 0.13 0.75 -0.08 -0.08 -1.23 0.00 0.00 177.57 177.06 3dug h GLU 333 N 0.16 0.34 -0.98 5.19 4.81 -1.40 -2.98 114.58 119.71 3dug h GLU 333 Ca -0.06 -0.07 -0.52 0.00 -0.13 0.00 0.00 59.36 58.58 3dug h GLU 333 Cb 1.53 -0.05 -0.30 0.00 0.63 0.00 0.00 28.75 30.56 3dug h GLU 333 CO 0.14 0.43 0.65 0.91 -0.73 0.00 0.00 179.01 180.41 3dug n TRP 334 N -4.29 3.03 0.00 0.92 7.02 -0.84 -4.89 117.44 118.40 3dug n TRP 334 Ca 0.00 -1.92 0.00 0.00 -1.02 0.00 0.00 57.50 54.56 3dug n TRP 334 Cb 0.25 -0.97 0.00 0.00 -2.42 0.00 0.00 31.31 28.17 3dug n TRP 334 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3dug n GLY 335 N -1.13 0.78 3.90 6.99 0.00 -1.13 -4.09 105.19 110.51 3dug n GLY 335 Ca 0.59 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.30 3dug n GLY 335 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dug s MET 336 N -0.46 3.58 0.47 1.61 -1.94 -1.02 -4.97 119.30 116.57 3dug s MET 336 Ca 0.00 -0.17 -0.20 0.00 -1.71 0.00 0.00 55.69 53.61 3dug s MET 336 Cb 0.00 -2.88 -0.09 0.00 2.01 0.00 0.00 34.83 33.87 3dug s MET 336 CO 0.00 0.48 0.99 0.95 -0.01 0.00 0.00 175.02 177.43 3dug s THR 337 N -1.65 4.21 0.31 2.05 -4.23 -1.26 -4.23 115.64 110.83 3dug s THR 337 Ca 0.40 1.31 0.07 0.00 -1.18 0.00 0.00 61.69 62.28 3dug s THR 337 Cb -0.12 -3.56 0.34 0.00 1.34 0.00 0.00 72.50 70.50 3dug s THR 337 CO 0.26 -0.36 1.63 -0.65 -0.54 0.00 0.00 174.62 174.95 3dug h PRO 338 N 1.57 0.16 -0.39 3.99 0.11 -1.91 0.55 132.00 136.08 3dug h PRO 338 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3dug h PRO 338 Cb 1.19 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 3dug h PRO 338 CO 0.60 0.10 0.25 1.25 -0.21 0.00 0.00 178.00 180.00 3dug h LEU 339 N 0.16 0.44 -1.28 2.35 5.85 -1.90 -2.63 115.31 118.30 3dug h LEU 339 Ca 0.63 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 59.32 3dug h LEU 339 Cb 1.38 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.27 3dug h LEU 339 CO -0.72 0.32 0.24 -0.33 -0.34 0.00 0.00 178.44 177.62 3dug h GLU 340 N 0.52 0.74 -0.45 1.25 5.08 -1.32 0.52 114.58 120.92 3dug h GLU 340 Ca 0.14 -0.09 -0.11 0.00 -1.00 0.00 0.00 59.36 58.30 3dug h GLU 340 Cb -0.06 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 3dug h GLU 340 CO -0.03 0.58 -0.13 0.00 -1.00 0.00 0.00 179.01 178.43 3dug h ALA 341 N 1.53 0.62 -0.06 3.43 0.00 -1.04 -1.41 119.26 122.34 3dug h ALA 341 Ca 0.18 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 3dug h ALA 341 Cb 0.09 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3dug h ALA 341 CO -0.02 0.54 -0.58 0.82 0.00 0.00 0.00 179.25 180.00 3dug h ILE 342 N 0.72 1.39 -0.25 0.00 2.04 -1.07 -2.82 117.51 117.52 3dug h ILE 342 Ca 0.11 -1.95 -0.07 0.00 1.00 0.00 0.00 64.86 63.95 3dug h ILE 342 Cb 0.68 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 38.74 3dug h ILE 342 CO 0.05 0.57 -0.14 1.56 0.00 0.00 0.00 178.15 180.19 3dug h GLN 343 N 0.14 0.42 0.00 2.37 4.20 -0.74 -2.12 115.11 119.37 3dug h GLN 343 Ca -0.00 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.55 3dug h GLN 343 Cb 1.07 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.80 3dug h GLN 343 CO 0.09 0.56 -0.17 0.00 -0.67 0.00 0.00 178.83 178.64 3dug h ALA 344 N 1.47 1.15 -0.38 3.87 0.00 -1.01 -1.26 119.26 123.10 3dug h ALA 344 Ca 0.07 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3dug h ALA 344 Cb 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3dug h ALA 344 CO 0.03 0.21 0.00 0.45 0.00 0.00 0.00 179.25 179.94 3dug n SER 345 N -3.51 3.39 0.00 0.00 2.88 -0.85 -1.73 113.62 113.80 3dug n SER 345 Ca -0.01 -1.97 0.00 0.00 -1.33 0.00 0.00 58.87 55.56 3dug n SER 345 Cb 0.33 -0.24 0.00 0.00 -0.75 0.00 0.00 64.21 63.54 3dug n SER 345 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3dug n THR 346 N 1.41 0.00 0.04 2.46 -2.24 -0.89 -0.23 114.28 114.83 3dug n THR 346 Ca 0.18 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.83 3dug n THR 346 Cb 0.58 -0.23 -0.03 0.00 -2.10 0.00 0.00 70.33 68.56 3dug n THR 346 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 3dug h ILE 347 N 0.00 1.35 -0.24 2.28 3.07 -1.59 -2.06 117.51 120.32 3dug h ILE 347 Ca 0.00 -2.22 -0.06 0.00 1.55 0.00 0.00 64.86 64.12 3dug h ILE 347 Cb 0.00 2.22 -0.01 0.00 -0.27 0.00 0.00 36.82 38.76 3dug h ILE 347 CO 0.00 0.68 -0.10 0.11 -1.05 0.00 0.00 178.15 177.79 3dug h LYS 348 N 0.33 0.49 -0.35 0.16 6.56 -1.50 -2.77 116.57 119.50 3dug h LYS 348 Ca -0.06 -0.21 -0.02 0.00 -1.06 0.00 0.00 60.65 59.30 3dug h LYS 348 Cb 1.46 -0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 33.09 3dug h LYS 348 CO 0.15 0.74 0.14 1.79 -2.06 0.00 0.00 179.45 180.21 3dug h THR 349 N 0.21 1.19 -0.86 -0.16 1.35 -1.66 -2.52 112.91 110.46 3dug h THR 349 Ca 0.06 -0.58 0.16 0.00 -0.55 0.00 0.00 66.41 65.49 3dug h THR 349 Cb 0.59 0.93 -0.10 0.00 -1.73 0.00 0.00 68.15 67.84 3dug h THR 349 CO 0.03 0.21 0.44 0.00 -0.25 0.00 0.00 175.52 175.95 3dug h ALA 350 N 0.98 1.31 -0.26 6.62 0.00 -1.30 0.46 119.26 127.07 3dug h ALA 350 Ca 0.12 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 3dug h ALA 350 Cb 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3dug h ALA 350 CO -0.01 -0.12 -0.13 1.15 0.00 0.00 0.00 179.25 180.14 3dug h THR 351 N 0.60 1.30 -0.71 0.00 2.02 -1.42 -1.93 112.91 112.78 3dug h THR 351 Ca 0.48 -1.23 0.03 0.00 0.77 0.00 0.00 66.41 66.46 3dug h THR 351 Cb 0.71 1.53 -0.04 0.00 -1.74 0.00 0.00 68.15 68.61 3dug h THR 351 CO -0.38 0.39 0.45 0.25 0.37 0.00 0.00 175.52 176.59 3dug h LEU 352 N 0.29 0.74 -1.23 2.58 5.85 -0.77 -1.59 115.31 121.19 3dug h LEU 352 Ca 0.06 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 3dug h LEU 352 Cb 0.65 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 3dug h LEU 352 CO 0.04 0.52 -0.05 -0.26 -0.34 0.00 0.00 178.44 178.35 3dug h PHE 353 N 0.88 0.00 -0.70 1.25 0.04 -0.06 -3.47 116.94 114.88 3dug h PHE 353 Ca 0.28 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.90 3dug h PHE 353 Cb -0.00 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.11 3dug h PHE 353 CO -0.04 0.05 -0.17 0.41 -0.60 0.00 0.00 178.31 177.96 3dug n GLY 354 N 0.18 0.53 3.47 -1.45 0.00 -0.60 -5.03 105.19 102.30 3dug n GLY 354 Ca 0.01 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 45.05 3dug n GLY 354 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dug s ILE 355 N -2.33 3.86 0.55 -0.61 1.01 -0.93 -5.04 121.20 117.70 3dug s ILE 355 Ca 0.00 -0.36 0.08 0.00 0.00 0.00 0.00 60.65 60.36 3dug s ILE 355 Cb 0.00 -2.70 0.06 0.00 0.01 0.00 0.00 42.46 39.83 3dug s ILE 355 CO 0.00 0.48 0.59 -1.61 0.00 0.00 0.00 174.94 174.40 3dug s GLU 356 N 0.55 2.30 -2.01 2.79 0.41 -1.26 -4.48 118.70 117.00 3dug s GLU 356 Ca -0.03 -1.80 0.00 0.00 -0.41 0.00 0.00 54.97 52.73 3dug s GLU 356 Cb -0.14 -2.39 0.00 0.00 -1.78 0.00 0.00 34.13 29.82 3dug s GLU 356 CO 0.03 -0.71 0.00 0.27 -0.49 0.00 0.00 175.26 174.35 3dug n ASN 357 N -1.99 -5.62 -4.21 -0.19 6.94 -1.26 -4.95 115.26 103.97 3dug n ASN 357 Ca 0.07 0.30 -0.12 0.00 -0.02 0.00 0.00 54.58 54.80 3dug n ASN 357 Cb 0.63 -4.81 -0.10 0.00 -2.36 0.00 0.00 39.78 33.14 3dug n ASN 357 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 3dug s ILE 358 N -2.87 0.67 0.00 1.53 -4.36 -1.26 0.86 121.20 115.77 3dug s ILE 358 Ca 0.00 -1.97 0.00 0.00 -0.26 0.00 0.00 60.65 58.42 3dug s ILE 358 Cb 0.00 -1.97 0.00 0.00 1.25 0.00 0.00 42.46 41.74 3dug s ILE 358 CO 0.00 -0.61 0.00 0.61 0.24 0.00 0.00 174.94 175.18 3dug n GLY 359 N -0.17 0.98 2.94 6.27 0.00 -1.26 -4.91 105.19 109.03 3dug n GLY 359 Ca -0.08 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.79 3dug n GLY 359 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dug s GLN 360 N -0.59 0.30 -0.85 1.61 -0.21 -1.26 -4.16 119.66 114.49 3dug s GLN 360 Ca 0.00 -0.17 -0.24 0.00 0.02 0.00 0.00 55.36 54.97 3dug s GLN 360 Cb 0.00 -0.27 0.05 0.00 1.00 0.00 0.00 33.01 33.79 3dug s GLN 360 CO 0.00 0.07 1.29 0.42 -2.12 0.00 0.00 175.29 174.95 3dug s ILE 361 N -0.18 3.97 0.03 1.08 1.01 -1.26 -4.82 121.20 121.03 3dug s ILE 361 Ca 0.00 -0.31 -0.14 0.00 0.00 0.00 0.00 60.65 60.20 3dug s ILE 361 Cb -0.02 -4.93 0.02 0.00 0.01 0.00 0.00 42.46 37.54 3dug s ILE 361 CO -0.00 -1.80 0.30 -0.75 0.00 0.00 0.00 174.94 172.69 3dug s LYS 362 N 4.95 0.78 0.08 2.79 2.20 -1.26 -4.95 119.74 124.32 3dug s LYS 362 Ca 0.37 -0.44 -0.31 0.00 -0.36 0.00 0.00 55.97 55.24 3dug s LYS 362 Cb -0.06 0.34 -0.07 0.00 -1.51 0.00 0.00 37.83 36.53 3dug s LYS 362 CO 0.03 -0.24 1.37 -1.21 -0.36 0.00 0.00 175.35 174.94 3dug s GLU 363 N -2.28 4.32 0.00 4.03 2.02 -1.26 -2.62 118.70 122.92 3dug s GLU 363 Ca -0.07 2.01 0.00 0.00 0.02 0.00 0.00 54.97 56.93 3dug s GLU 363 Cb -0.02 -3.35 0.00 0.00 0.10 0.00 0.00 34.13 30.86 3dug s GLU 363 CO -0.02 -0.45 0.00 0.41 0.02 0.00 0.00 175.26 175.22 3dug n GLY 364 N 3.50 3.23 3.80 -1.39 0.00 0.29 -5.01 105.19 109.62 3dug n GLY 364 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 3dug n GLY 364 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dug s PHE 365 N -2.85 2.91 0.47 1.61 2.99 -1.08 -4.72 117.98 117.31 3dug s PHE 365 Ca 0.00 1.49 -0.23 0.00 0.00 0.00 0.00 56.93 58.18 3dug s PHE 365 Cb 0.00 -2.98 -0.07 0.00 0.00 0.00 0.00 43.02 39.97 3dug s PHE 365 CO 0.00 -1.37 1.26 -0.51 -0.00 0.00 0.00 175.22 174.60 3dug s ASP 366 N -3.29 5.96 -1.55 1.36 -0.00 0.25 -0.16 116.67 119.24 3dug s ASP 366 Ca 0.61 2.54 -0.10 0.00 -0.00 0.00 0.00 52.55 55.60 3dug s ASP 366 Cb -0.16 -2.62 -0.03 0.00 -0.00 0.00 0.00 42.92 40.11 3dug s ASP 366 CO 0.48 -1.08 2.72 0.00 -0.00 0.00 0.00 175.17 177.29 3dug n ALA 367 N -0.46 7.01 -3.38 5.23 0.00 0.40 -4.60 120.51 124.71 3dug n ALA 367 Ca 0.07 -3.69 -0.45 0.00 0.00 0.00 0.00 53.44 49.37 3dug n ALA 367 Cb 0.46 -3.33 -0.05 0.00 0.00 0.00 0.00 19.45 16.53 3dug n ALA 367 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3dug s ASP 368 N 2.13 6.22 -0.05 0.00 1.01 -1.26 -2.08 116.67 122.64 3dug s ASP 368 Ca 0.62 -2.14 0.02 0.00 0.71 0.00 0.00 52.55 51.77 3dug s ASP 368 Cb 0.17 -2.15 0.01 0.00 1.01 0.00 0.00 42.92 41.96 3dug s ASP 368 CO -0.07 -0.72 -0.10 -0.63 0.21 0.00 0.00 175.17 173.87 3dug s ILE 369 N 1.04 0.91 -0.14 0.77 1.01 0.11 0.40 121.20 125.30 3dug s ILE 369 Ca 0.09 -0.37 0.01 0.00 0.00 0.00 0.00 60.65 60.38 3dug s ILE 369 Cb -0.23 -0.85 -0.00 0.00 0.01 0.00 0.00 42.46 41.39 3dug s ILE 369 CO -0.02 0.30 -0.17 -0.69 0.00 0.00 0.00 174.94 174.36 3dug s VAL 370 N 0.59 2.54 -0.11 2.92 1.01 0.48 -0.52 120.40 127.31 3dug s VAL 370 Ca -0.11 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 60.92 3dug s VAL 370 Cb -0.14 -2.05 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 3dug s VAL 370 CO 0.02 0.53 0.28 -0.83 0.00 0.00 0.00 175.10 175.10 3dug s GLY 371 N 0.64 2.25 0.08 4.51 0.00 0.13 -0.13 107.32 114.80 3dug s GLY 371 Ca -0.09 -0.45 0.03 0.00 0.00 0.00 0.00 44.72 44.21 3dug s GLY 371 CO 0.02 0.17 -0.09 0.54 0.00 0.00 0.00 173.10 173.74 3dug s VAL 372 N -0.24 0.77 -0.02 1.40 0.11 -0.39 -1.49 120.40 120.54 3dug s VAL 372 Ca 0.17 -1.48 -0.13 0.00 -2.93 0.00 0.00 61.98 57.61 3dug s VAL 372 Cb -0.14 -1.15 -0.07 0.00 -1.53 0.00 0.00 36.38 33.50 3dug s VAL 372 CO 0.06 -0.53 0.65 0.40 -3.33 0.00 0.00 175.10 172.34 3dug h ILE 373 N 3.82 0.00 -1.85 7.04 2.04 -1.86 -2.27 117.51 124.43 3dug h ILE 373 Ca -0.37 -0.40 -0.48 0.00 1.00 0.00 0.00 64.86 64.61 3dug h ILE 373 Cb 1.19 0.00 0.08 0.00 -0.74 0.00 0.00 36.82 37.35 3dug h ILE 373 CO 0.50 0.00 0.10 -1.61 0.00 0.00 0.00 178.15 177.14 3dug s GLU 374 N -3.14 1.60 -0.12 2.37 2.02 -1.26 -4.60 118.70 115.57 3dug s GLU 374 Ca -0.07 -1.27 -0.29 0.00 0.02 0.00 0.00 54.97 53.36 3dug s GLU 374 Cb 0.01 -2.35 -0.01 0.00 0.10 0.00 0.00 34.13 31.87 3dug s GLU 374 CO 0.20 -1.50 1.07 1.21 0.02 0.00 0.00 175.26 176.26 3dug s ASN 375 N -4.79 7.16 0.51 -0.19 3.84 -1.26 -4.79 114.94 115.43 3dug s ASN 375 Ca 0.67 1.56 0.28 0.00 0.21 0.00 0.00 52.86 55.59 3dug s ASN 375 Cb -0.04 -2.55 1.35 0.00 -0.55 0.00 0.00 41.25 39.45 3dug s ASN 375 CO 0.45 -0.54 2.01 -0.65 -2.79 0.00 0.00 177.10 175.58 3dug h PRO 376 N 7.30 0.00 0.00 0.43 0.11 -1.94 0.67 132.00 138.57 3dug h PRO 376 Ca -0.29 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.79 3dug h PRO 376 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3dug h PRO 376 CO 0.89 0.13 -0.21 -0.07 -0.21 0.00 0.00 178.00 178.54 3dug h LEU 377 N 0.00 0.00 0.00 2.35 4.07 -1.91 -2.95 115.31 116.87 3dug h LEU 377 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3dug h LEU 377 Cb 0.45 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.19 3dug h LEU 377 CO 0.02 0.14 -0.18 0.00 -1.08 0.00 0.00 178.44 177.33 3dug h ALA 378 N 1.86 0.00 -3.69 1.53 0.00 -1.82 -3.46 119.26 113.69 3dug h ALA 378 Ca -0.00 -0.18 -0.63 0.00 0.00 0.00 0.00 54.91 54.09 3dug h ALA 378 Cb 1.11 0.18 -0.38 0.00 0.00 0.00 0.00 17.79 18.70 3dug h ALA 378 CO 0.02 0.18 -0.78 1.21 0.00 0.00 0.00 179.25 179.88 3dug s ASN 379 N -5.58 4.17 0.45 0.00 2.47 0.17 -5.00 114.94 111.62 3dug s ASN 379 Ca -0.05 -1.39 0.25 0.00 0.42 0.00 0.00 52.86 52.08 3dug s ASN 379 Cb 0.01 -1.34 0.90 0.00 -1.45 0.00 0.00 41.25 39.38 3dug s ASN 379 CO 0.08 -0.25 1.81 -0.29 -3.72 0.00 0.00 177.10 174.73 3dug h ILE 380 N 6.68 0.44 -0.14 -5.21 2.10 -1.76 -3.11 117.51 116.52 3dug h ILE 380 Ca -0.16 -1.08 -0.08 0.00 1.08 0.00 0.00 64.86 64.62 3dug h ILE 380 Cb 1.05 1.78 -0.04 0.00 -1.09 0.00 0.00 36.82 38.52 3dug h ILE 380 CO 0.44 0.19 0.10 0.54 -1.08 0.00 0.00 178.15 178.34 3dug n ARG 381 N -3.31 1.19 0.02 2.19 1.74 -1.26 -2.21 116.66 115.02 3dug n ARG 381 Ca 0.01 -0.43 0.02 0.00 -0.77 0.00 0.00 57.85 56.68 3dug n ARG 381 Cb 0.43 -1.17 -0.09 0.00 -1.02 0.00 0.00 32.46 30.62 3dug n ARG 381 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3dug n THR 382 N 0.55 0.96 0.27 0.55 -1.04 -1.18 -4.20 114.28 110.21 3dug n THR 382 Ca 0.08 -0.66 0.14 0.00 -2.04 0.00 0.00 64.05 61.57 3dug n THR 382 Cb 0.62 -0.55 0.79 0.00 -1.82 0.00 0.00 70.33 69.37 3dug n THR 382 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3dug h LEU 383 N 0.00 0.00 -2.00 -4.42 3.38 -1.72 -1.91 115.31 108.64 3dug h LEU 383 Ca -0.16 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 3dug h LEU 383 Cb 1.49 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.23 3dug h LEU 383 CO 0.03 0.08 -0.02 -0.33 0.09 0.00 0.00 178.44 178.29 3dug h GLU 384 N 0.00 0.00 -2.49 1.13 5.08 -1.77 -3.35 114.58 113.18 3dug h GLU 384 Ca -0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 3dug h GLU 384 Cb 0.24 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 29.11 3dug h GLU 384 CO 0.01 0.02 -0.89 -2.00 -1.00 0.00 0.00 179.01 175.15 3dug s GLU 385 N -3.88 0.67 0.61 2.33 2.12 -0.72 -4.98 118.70 114.85 3dug s GLU 385 Ca -0.01 -1.58 -0.13 0.00 0.36 0.00 0.00 54.97 53.60 3dug s GLU 385 Cb 0.11 -1.32 -0.04 0.00 0.26 0.00 0.00 34.13 33.14 3dug s GLU 385 CO 0.51 -1.27 1.03 0.14 -0.54 0.00 0.00 175.26 175.13 3dug s VAL 386 N 0.74 4.36 -0.01 3.70 -7.23 -1.24 -4.72 120.40 115.99 3dug s VAL 386 Ca 0.23 0.91 0.01 0.00 -1.81 0.00 0.00 61.98 61.32 3dug s VAL 386 Cb -0.14 -3.64 -0.01 0.00 0.56 0.00 0.00 36.38 33.15 3dug s VAL 386 CO -0.06 -0.87 0.02 0.00 -0.31 0.00 0.00 175.10 173.88 3dug n ALA 387 N -2.44 2.05 -3.74 1.32 0.00 -0.55 -5.01 120.51 112.13 3dug n ALA 387 Ca 0.07 -0.02 -0.14 0.00 0.00 0.00 0.00 53.44 53.35 3dug n ALA 387 Cb 0.54 -0.03 -0.15 0.00 0.00 0.00 0.00 19.45 19.81 3dug n ALA 387 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3dug s PHE 388 N -1.79 -0.15 -0.10 0.00 5.36 -0.73 -3.91 117.98 116.66 3dug s PHE 388 Ca -0.00 0.47 -0.00 0.00 -0.96 0.00 0.00 56.93 56.43 3dug s PHE 388 Cb 0.01 -0.11 0.02 0.00 -0.34 0.00 0.00 43.02 42.60 3dug s PHE 388 CO 0.03 -0.17 -0.08 0.08 -1.46 0.00 0.00 175.22 173.63 3dug s VAL 389 N 1.26 0.97 -0.11 3.12 1.01 -1.04 0.17 120.40 125.78 3dug s VAL 389 Ca -0.08 -0.28 0.02 0.00 0.00 0.00 0.00 61.98 61.64 3dug s VAL 389 Cb -0.12 -0.99 0.01 0.00 0.00 0.00 0.00 36.38 35.29 3dug s VAL 389 CO -0.06 0.35 -0.18 -0.32 0.00 0.00 0.00 175.10 174.89 3dug s MET 390 N 1.55 2.53 -0.12 2.72 0.00 0.32 -0.54 119.30 125.77 3dug s MET 390 Ca 0.02 -0.68 0.03 0.00 0.00 0.00 0.00 55.69 55.05 3dug s MET 390 Cb -0.13 -2.07 0.01 0.00 0.00 0.00 0.00 34.83 32.64 3dug s MET 390 CO -0.06 -0.01 -0.20 0.21 0.00 0.00 0.00 175.02 174.96 3dug s LYS 391 N 0.83 2.76 -1.60 4.11 2.20 -0.08 -0.71 119.74 127.24 3dug s LYS 391 Ca -0.09 -0.76 -0.15 0.00 -0.36 0.00 0.00 55.97 54.61 3dug s LYS 391 Cb -0.16 -2.23 0.11 0.00 -1.51 0.00 0.00 37.83 34.05 3dug s LYS 391 CO 0.00 0.01 0.85 0.39 -0.36 0.00 0.00 175.35 176.24 3dug n GLU 392 N 4.00 -4.23 -1.01 4.03 1.02 -0.88 -1.70 120.64 121.87 3dug n GLU 392 Ca -0.20 0.48 -0.00 0.00 -0.02 0.00 0.00 57.16 57.42 3dug n GLU 392 Cb 0.52 -5.23 -0.00 0.00 -0.02 0.00 0.00 31.44 26.70 3dug n GLU 392 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dug n GLY 393 N -1.57 0.46 3.26 0.62 0.00 -0.94 -4.16 105.19 102.87 3dug n GLY 393 Ca 0.03 -0.44 -0.32 0.00 0.00 0.00 0.00 46.02 45.29 3dug n GLY 393 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dug s LYS 394 N -0.87 2.84 -0.09 1.61 1.02 -0.69 -4.92 119.74 118.64 3dug s LYS 394 Ca 0.00 -0.87 -0.25 0.00 0.02 0.00 0.00 55.97 54.87 3dug s LYS 394 Cb 0.00 -2.27 -0.03 0.00 -0.52 0.00 0.00 37.83 35.01 3dug s LYS 394 CO 0.00 0.29 0.77 0.54 -0.92 0.00 0.00 175.35 176.03 3dug s VAL 395 N 0.08 4.98 -0.02 3.17 0.11 -1.26 -0.91 120.40 126.55 3dug s VAL 395 Ca -0.10 1.56 0.07 0.00 -2.93 0.00 0.00 61.98 60.58 3dug s VAL 395 Cb -0.16 -4.10 -0.11 0.00 -1.53 0.00 0.00 36.38 30.49 3dug s VAL 395 CO 0.06 0.18 0.13 -1.22 -3.33 0.00 0.00 175.10 170.92 3dug n TYR 396 N 4.22 0.00 -3.91 1.54 4.01 0.30 -4.98 117.16 118.34 3dug n TYR 396 Ca 0.01 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.59 3dug n TYR 396 Cb 0.51 -0.19 -0.16 0.00 -0.31 0.00 0.00 39.34 39.19 3dug n TYR 396 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 3dug s LYS 397 N -2.44 0.20 0.00 -0.72 2.20 -1.09 -4.93 119.74 112.96 3dug s LYS 397 Ca -0.03 0.06 0.00 0.00 -0.36 0.00 0.00 55.97 55.64 3dug s LYS 397 Cb 0.04 -0.36 0.00 0.00 -1.51 0.00 0.00 37.83 36.00 3dug s LYS 397 CO 0.29 -0.10 0.00 0.54 -0.36 0.00 0.00 175.35 175.72