#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d43 s ALA 2 N 0.00 3.48 0.52 2.89 0.00 -1.25 -4.85 121.76 122.56 3d43 s ALA 2 Ca 0.00 0.21 0.17 0.00 0.00 0.00 0.00 51.96 52.34 3d43 s ALA 2 Cb 0.00 -3.35 1.31 0.00 0.00 0.00 0.00 23.12 21.07 3d43 s ALA 2 CO 0.00 -0.66 2.16 0.77 0.00 0.00 0.00 175.76 178.02 3d43 h SER 3 N 7.23 0.00 -3.44 0.00 0.02 -1.98 -3.42 113.55 111.96 3d43 h SER 3 Ca -0.29 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.42 3d43 h SER 3 Cb 1.13 0.00 -0.31 0.00 0.14 0.00 0.00 62.40 63.36 3d43 h SER 3 CO 0.86 0.00 -0.58 -1.58 -1.14 0.00 0.00 176.83 174.39 3d43 s GLN 4 N -5.04 0.11 -0.07 3.45 0.74 -1.26 -5.08 119.66 112.51 3d43 s GLN 4 Ca -0.05 0.38 0.17 0.00 0.05 0.00 0.00 55.36 55.91 3d43 s GLN 4 Cb 0.17 -0.16 -0.22 0.00 1.10 0.00 0.00 33.01 33.90 3d43 s GLN 4 CO 0.66 -0.16 0.48 1.04 -0.55 0.00 0.00 175.29 176.76 3d43 n GLN 5 N 4.14 0.65 -3.85 1.67 6.02 -1.26 -4.65 117.38 120.10 3d43 n GLN 5 Ca -0.26 0.10 -0.30 0.00 -0.01 0.00 0.00 57.00 56.53 3d43 n GLN 5 Cb 0.52 -1.66 -0.14 0.00 1.02 0.00 0.00 30.24 29.98 3d43 n GLN 5 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3d43 s ILE 6 N -2.78 2.07 1.01 5.09 -1.09 -1.26 -1.73 121.20 122.51 3d43 s ILE 6 Ca -0.06 -2.96 -0.11 0.00 -2.23 0.00 0.00 60.65 55.29 3d43 s ILE 6 Cb 0.08 -2.45 0.20 0.00 -1.58 0.00 0.00 42.46 38.71 3d43 s ILE 6 CO 0.83 -0.83 1.08 -2.84 -1.23 0.00 0.00 174.94 171.96 3d43 s PRO 7 N 0.03 0.28 0.29 2.79 0.02 -1.26 -4.72 135.00 132.43 3d43 s PRO 7 Ca 0.17 1.09 0.01 0.00 0.02 0.00 0.00 61.00 62.29 3d43 s PRO 7 Cb -0.25 -1.67 0.54 0.00 0.02 0.00 0.00 34.50 33.13 3d43 s PRO 7 CO -0.00 -2.99 1.87 0.11 -0.33 0.00 0.00 177.00 175.66 3d43 h TRP 8 N -2.11 1.10 -0.02 6.54 5.08 -1.95 -1.43 115.95 123.16 3d43 h TRP 8 Ca -0.52 0.03 -0.12 0.00 1.08 0.00 0.00 58.89 59.36 3d43 h TRP 8 Cb 1.30 -0.36 -0.02 0.00 -3.00 0.00 0.00 29.16 27.09 3d43 h TRP 8 CO 0.39 0.51 -0.55 0.78 -1.28 0.00 0.00 178.44 178.28 3d43 h GLY 9 N 1.02 0.06 0.81 11.11 0.00 -1.92 -0.07 103.07 114.08 3d43 h GLY 9 Ca 0.44 -0.07 -0.06 0.00 0.00 0.00 0.00 47.33 47.65 3d43 h GLY 9 CO -0.20 0.06 -0.10 -2.22 0.00 0.00 0.00 176.54 174.08 3d43 h ILE 10 N 0.04 1.31 -0.99 2.60 1.08 -1.62 -0.98 117.51 118.96 3d43 h ILE 10 Ca -0.00 -1.17 0.02 0.00 -0.39 0.00 0.00 64.86 63.32 3d43 h ILE 10 Cb 0.99 1.65 -0.05 0.00 -3.07 0.00 0.00 36.82 36.34 3d43 h ILE 10 CO 0.08 0.35 0.65 0.11 -0.69 0.00 0.00 178.15 178.65 3d43 h LYS 11 N 0.12 1.28 -0.36 2.37 1.57 -1.15 -1.19 116.57 119.20 3d43 h LYS 11 Ca 0.04 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 3d43 h LYS 11 Cb 0.59 -0.29 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 3d43 h LYS 11 CO 0.03 0.84 0.05 0.00 -0.57 0.00 0.00 179.45 179.80 3d43 h ALA 12 N 1.37 0.48 0.00 3.86 0.00 -0.85 0.10 119.26 124.22 3d43 h ALA 12 Ca 0.37 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 3d43 h ALA 12 Cb -0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 3d43 h ALA 12 CO -0.09 0.20 -0.55 0.97 0.00 0.00 0.00 179.25 179.78 3d43 h ILE 13 N 0.44 1.28 -0.00 0.00 2.10 -0.98 -1.98 117.51 118.36 3d43 h ILE 13 Ca 0.11 -1.96 0.00 0.00 1.08 0.00 0.00 64.86 64.09 3d43 h ILE 13 Cb 0.38 2.09 0.00 0.00 -1.09 0.00 0.00 36.82 38.20 3d43 h ILE 13 CO 0.01 0.54 -0.11 -1.22 -1.08 0.00 0.00 178.15 176.29 3d43 n TYR 14 N -3.72 0.00 -3.90 2.19 4.02 -0.47 -1.66 117.16 113.62 3d43 n TYR 14 Ca -0.01 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.63 3d43 n TYR 14 Cb 0.59 -0.33 -0.01 0.00 -0.02 0.00 0.00 39.34 39.57 3d43 n TYR 14 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3d43 n ASN 15 N -1.31 -0.55 -3.38 7.72 5.15 -0.07 -4.79 115.26 118.03 3d43 n ASN 15 Ca 0.10 -0.97 -0.12 0.00 -0.60 0.00 0.00 54.58 52.99 3d43 n ASN 15 Cb 0.30 -3.24 -0.09 0.00 -0.53 0.00 0.00 39.78 36.22 3d43 n ASN 15 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 3d43 s ASN 16 N -4.35 0.70 0.40 1.20 3.84 -0.62 -5.01 114.94 111.09 3d43 s ASN 16 Ca 0.01 -0.12 0.28 0.00 0.21 0.00 0.00 52.86 53.25 3d43 s ASN 16 Cb -0.00 0.89 1.29 0.00 -0.55 0.00 0.00 41.25 42.87 3d43 s ASN 16 CO 0.87 -0.33 1.85 -0.78 -2.79 0.00 0.00 177.10 175.93 3d43 h ASP 17 N 8.21 0.00 -0.06 -4.21 3.58 -1.93 -2.86 116.42 119.15 3d43 h ASP 17 Ca -0.16 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.29 3d43 h ASP 17 Cb 1.14 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.18 3d43 h ASP 17 CO 0.28 0.00 -0.01 0.35 -2.88 0.00 0.00 179.24 176.98 3d43 n THR 18 N -2.57 2.00 -1.63 2.25 -2.24 -1.26 -5.04 114.28 105.78 3d43 n THR 18 Ca 0.00 -2.21 -0.46 0.00 -2.27 0.00 0.00 64.05 59.11 3d43 n THR 18 Cb 0.20 -0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 68.15 3d43 n THR 18 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3d43 n LEU 19 N -1.22 2.48 -0.01 3.22 7.94 -1.08 -4.91 117.00 123.43 3d43 n LEU 19 Ca 0.17 1.14 0.06 0.00 -1.11 0.00 0.00 56.01 56.28 3d43 n LEU 19 Cb 0.70 -1.35 -0.10 0.00 0.53 0.00 0.00 43.42 43.21 3d43 n LEU 19 CO 0.04 -0.81 -0.62 0.35 -1.11 0.00 0.00 177.39 175.24 3d43 n THR 20 N 1.73 0.00 -3.50 1.96 -2.24 -1.26 -4.91 114.28 106.06 3d43 n THR 20 Ca 0.13 -0.29 -0.10 0.00 -2.27 0.00 0.00 64.05 61.52 3d43 n THR 20 Cb 0.29 0.24 -0.02 0.00 -2.10 0.00 0.00 70.33 68.74 3d43 n THR 20 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3d43 s SER 21 N -3.40 -0.48 0.50 3.42 1.04 -1.26 -4.93 113.70 108.58 3d43 s SER 21 Ca -0.04 -0.09 0.08 0.00 0.48 0.00 0.00 55.95 56.38 3d43 s SER 21 Cb 0.08 0.57 0.03 0.00 0.10 0.00 0.00 66.02 66.80 3d43 s SER 21 CO 0.53 -0.94 0.52 0.42 0.98 0.00 0.00 173.24 174.75 3d43 s THR 22 N -3.63 2.23 0.09 2.02 -4.23 -1.26 -5.15 115.64 105.71 3d43 s THR 22 Ca 0.03 -1.26 -0.21 0.00 -1.18 0.00 0.00 61.69 59.08 3d43 s THR 22 Cb -0.02 -2.49 0.05 0.00 1.34 0.00 0.00 72.50 71.39 3d43 s THR 22 CO -0.09 0.00 0.51 0.28 -0.54 0.00 0.00 174.62 174.77 3d43 s THR 23 N -2.61 0.03 0.00 3.99 -1.32 -1.26 -4.84 115.64 109.63 3d43 s THR 23 Ca 0.48 -0.27 0.00 0.00 -1.21 0.00 0.00 61.69 60.69 3d43 s THR 23 Cb -0.04 -1.02 0.00 0.00 -1.51 0.00 0.00 72.50 69.92 3d43 s THR 23 CO 0.29 -0.15 0.00 0.61 -2.21 0.00 0.00 174.62 173.16 3d43 n GLY 24 N 0.11 2.04 0.00 6.08 0.00 -1.26 -4.52 105.19 107.64 3d43 n GLY 24 Ca -0.18 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.81 3d43 n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d43 n GLY 25 N 0.69 0.68 3.68 -0.02 0.00 -1.26 -0.93 105.19 108.03 3d43 n GLY 25 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 3d43 n GLY 25 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3d43 n SER 26 N 0.00 2.93 0.00 1.61 2.88 -1.25 -1.77 113.62 118.02 3d43 n SER 26 Ca 0.00 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.67 3d43 n SER 26 Cb 0.00 -1.44 0.00 0.00 -0.75 0.00 0.00 64.21 62.02 3d43 n SER 26 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3d43 n GLY 27 N 2.46 2.25 3.78 0.46 0.00 -1.26 -4.71 105.19 108.18 3d43 n GLY 27 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 3d43 n GLY 27 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d43 s ILE 28 N -3.02 5.17 -0.14 -0.61 -1.09 -0.73 -4.43 121.20 116.35 3d43 s ILE 28 Ca 0.00 0.75 -0.12 0.00 -2.23 0.00 0.00 60.65 59.04 3d43 s ILE 28 Cb 0.00 -3.70 -0.05 0.00 -1.58 0.00 0.00 42.46 37.14 3d43 s ILE 28 CO 0.00 0.47 0.26 0.20 -1.23 0.00 0.00 174.94 174.64 3d43 s ASN 29 N -0.24 6.44 -0.32 3.58 0.01 -0.41 -1.28 114.94 122.72 3d43 s ASN 29 Ca 0.22 0.52 -0.06 0.00 -0.71 0.00 0.00 52.86 52.82 3d43 s ASN 29 Cb -0.15 -2.16 0.03 0.00 0.41 0.00 0.00 41.25 39.38 3d43 s ASN 29 CO 0.09 0.18 0.09 -0.63 -1.51 0.00 0.00 177.10 175.33 3d43 s ILE 30 N 0.05 3.81 -0.51 0.60 1.01 0.07 -0.59 121.20 125.64 3d43 s ILE 30 Ca 0.16 -1.01 -0.22 0.00 0.00 0.00 0.00 60.65 59.58 3d43 s ILE 30 Cb -0.13 -3.10 0.04 0.00 0.01 0.00 0.00 42.46 39.28 3d43 s ILE 30 CO 0.04 -0.10 0.79 0.00 0.00 0.00 0.00 174.94 175.67 3d43 s ALA 31 N 1.43 3.27 -0.53 9.38 0.00 0.65 -0.92 121.76 135.04 3d43 s ALA 31 Ca -0.00 -1.33 -0.20 0.00 0.00 0.00 0.00 51.96 50.43 3d43 s ALA 31 Cb -0.19 -3.53 0.06 0.00 0.00 0.00 0.00 23.12 19.46 3d43 s ALA 31 CO 0.03 -2.12 0.70 0.08 0.00 0.00 0.00 175.76 174.44 3d43 s VAL 32 N 3.33 4.76 -0.55 0.00 1.01 -0.01 -0.55 120.40 128.39 3d43 s VAL 32 Ca 0.25 -0.39 -0.20 0.00 0.00 0.00 0.00 61.98 61.65 3d43 s VAL 32 Cb -0.14 -4.37 0.07 0.00 0.00 0.00 0.00 36.38 31.94 3d43 s VAL 32 CO 0.18 -0.91 0.70 -0.76 0.00 0.00 0.00 175.10 174.30 3d43 s LEU 33 N 2.92 5.02 0.00 3.92 1.02 -0.86 -1.75 118.68 128.95 3d43 s LEU 33 Ca 0.18 -1.07 0.00 0.00 0.02 0.00 0.00 54.13 53.26 3d43 s LEU 33 Cb -0.18 -2.41 0.00 0.00 0.02 0.00 0.00 46.19 43.61 3d43 s LEU 33 CO 0.13 -1.03 0.00 -0.67 0.02 0.00 0.00 176.35 174.80 3d43 n ASP 34 N 6.41 0.00 -0.26 2.29 -0.08 -0.36 -4.31 116.55 120.24 3d43 n ASP 34 Ca -0.07 0.00 0.02 0.00 -1.51 0.00 0.00 54.79 53.23 3d43 n ASP 34 Cb 0.44 0.00 0.07 0.00 2.34 0.00 0.00 41.12 43.97 3d43 n ASP 34 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 3d43 n THR 35 N 0.00 0.19 0.00 5.18 -2.24 -1.26 -0.53 114.28 115.62 3d43 n THR 35 Ca 0.00 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 3d43 n THR 35 Cb 0.00 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 3d43 n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d43 n GLY 36 N 0.73 -2.21 3.13 3.38 0.00 -1.26 -3.98 105.19 104.99 3d43 n GLY 36 Ca 0.05 -2.13 -0.12 0.00 0.00 0.00 0.00 46.02 43.82 3d43 n GLY 36 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d43 s VAL 37 N -0.41 0.71 -0.87 1.61 -7.23 -0.18 -3.06 120.40 110.96 3d43 s VAL 37 Ca 0.00 -1.56 -0.19 0.00 -1.81 0.00 0.00 61.98 58.42 3d43 s VAL 37 Cb 0.00 -1.22 0.13 0.00 0.56 0.00 0.00 36.38 35.85 3d43 s VAL 37 CO 0.00 -0.62 1.06 0.20 -0.31 0.00 0.00 175.10 175.44 3d43 s ASN 38 N -2.37 6.55 0.66 4.85 -0.87 -1.26 -2.68 114.94 119.83 3d43 s ASN 38 Ca 0.02 -1.91 0.37 0.00 -1.57 0.00 0.00 52.86 49.77 3d43 s ASN 38 Cb -0.02 -2.39 2.02 0.00 -0.02 0.00 0.00 41.25 40.84 3d43 s ASN 38 CO -0.02 -1.09 2.14 0.71 -2.57 0.00 0.00 177.10 176.27 3d43 h THR 39 N 5.80 0.00 -0.02 1.60 1.35 -1.95 -2.69 112.91 117.00 3d43 h THR 39 Ca 0.07 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.93 3d43 h THR 39 Cb 1.03 0.83 0.00 0.00 -1.73 0.00 0.00 68.15 68.28 3d43 h THR 39 CO 1.10 0.00 -0.39 -1.20 -0.25 0.00 0.00 175.52 174.77 3d43 n SER 40 N -2.97 2.13 -4.53 5.36 7.64 -1.26 -3.59 113.62 116.40 3d43 n SER 40 Ca -0.02 -1.57 -0.53 0.00 1.01 0.00 0.00 58.87 57.76 3d43 n SER 40 Cb 0.22 0.41 -0.06 0.00 -1.01 0.00 0.00 64.21 63.77 3d43 n SER 40 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 3d43 n HIS 41 N 0.17 0.93 0.30 1.43 -0.00 -1.02 -4.68 115.22 112.35 3d43 n HIS 41 Ca 0.10 0.84 0.16 0.00 0.46 0.00 0.00 57.72 59.27 3d43 n HIS 41 Cb 0.47 -2.19 0.95 0.00 -0.12 0.00 0.00 29.99 29.10 3d43 n HIS 41 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 3d43 h PRO 42 N 3.30 0.00 -0.07 1.57 0.13 -1.93 -0.75 132.00 134.25 3d43 h PRO 42 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3d43 h PRO 42 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 3d43 h PRO 42 CO 0.69 0.02 0.00 -0.25 -0.23 0.00 0.00 178.00 178.23 3d43 n ASP 43 N -3.64 1.91 0.00 1.44 10.43 -1.26 -4.04 116.55 121.40 3d43 n ASP 43 Ca -0.03 -1.66 0.00 0.00 2.57 0.00 0.00 54.79 55.67 3d43 n ASP 43 Cb 0.11 -0.04 0.00 0.00 1.84 0.00 0.00 41.12 43.03 3d43 n ASP 43 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3d43 n LEU 44 N 0.49 0.00 -0.10 0.64 4.77 -0.55 -1.67 117.00 120.57 3d43 n LEU 44 Ca 0.18 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.33 3d43 n LEU 44 Cb 0.41 0.00 0.58 0.00 -2.33 0.00 0.00 43.42 42.08 3d43 n LEU 44 CO 0.15 0.00 1.20 1.62 -1.33 0.00 0.00 177.39 179.04 3d43 h VAL 45 N 0.00 0.77 0.00 4.08 3.04 -1.24 0.39 116.25 123.29 3d43 h VAL 45 Ca 0.00 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.61 3d43 h VAL 45 Cb 0.55 0.50 0.00 0.00 -2.01 0.00 0.00 31.29 30.33 3d43 h VAL 45 CO 0.00 0.04 0.00 0.59 -1.01 0.00 0.00 177.57 177.19 3d43 n ASN 46 N -4.43 0.59 -0.22 3.17 3.02 -1.26 -3.43 115.26 112.69 3d43 n ASN 46 Ca 0.13 0.60 0.05 0.00 -0.03 0.00 0.00 54.58 55.33 3d43 n ASN 46 Cb 0.57 -0.74 -0.00 0.00 -0.61 0.00 0.00 39.78 38.99 3d43 n ASN 46 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3d43 n ASN 47 N -2.10 1.19 -4.71 6.41 3.02 0.09 -4.98 115.26 114.18 3d43 n ASN 47 Ca 0.04 -1.10 -0.42 0.00 -0.03 0.00 0.00 54.58 53.07 3d43 n ASN 47 Cb 0.30 0.49 -0.03 0.00 -0.61 0.00 0.00 39.78 39.93 3d43 n ASN 47 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3d43 s VAL 48 N -1.38 3.27 0.00 2.41 1.01 -1.00 -0.57 120.40 124.14 3d43 s VAL 48 Ca 0.08 0.87 0.00 0.00 0.00 0.00 0.00 61.98 62.93 3d43 s VAL 48 Cb 0.08 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.91 3d43 s VAL 48 CO 0.26 0.05 0.00 1.21 0.00 0.00 0.00 175.10 176.62 3d43 n GLU 49 N 4.32 0.19 -4.23 2.72 2.13 0.05 -4.87 120.64 120.95 3d43 n GLU 49 Ca 0.12 0.00 -0.19 0.00 0.66 0.00 0.00 57.16 57.75 3d43 n GLU 49 Cb 0.42 -0.85 -0.12 0.00 0.27 0.00 0.00 31.44 31.17 3d43 n GLU 49 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 3d43 s GLN 50 N -1.69 0.98 -0.29 5.31 -0.21 -0.92 -5.02 119.66 117.83 3d43 s GLN 50 Ca 0.00 -1.15 0.01 0.00 0.02 0.00 0.00 55.36 54.24 3d43 s GLN 50 Cb 0.00 -0.96 0.15 0.00 1.00 0.00 0.00 33.01 33.20 3d43 s GLN 50 CO 0.00 0.20 0.38 0.00 -2.12 0.00 0.00 175.29 173.75 3d43 s LYS 52 N 2.50 0.42 -0.12 0.00 1.02 -0.57 -0.47 119.74 122.53 3d43 s LYS 52 Ca 0.10 -0.69 0.02 0.00 0.02 0.00 0.00 55.97 55.42 3d43 s LYS 52 Cb -0.13 -0.10 -0.00 0.00 -0.52 0.00 0.00 37.83 37.08 3d43 s LYS 52 CO -0.30 0.00 -0.20 0.34 -0.92 0.00 0.00 175.35 174.27 3d43 s ASP 53 N -1.52 3.37 0.00 2.83 3.68 -0.05 -0.73 116.67 124.24 3d43 s ASP 53 Ca -0.13 -0.50 0.10 0.00 2.13 0.00 0.00 52.55 54.15 3d43 s ASP 53 Cb -0.10 -1.48 0.23 0.00 -1.45 0.00 0.00 42.92 40.12 3d43 s ASP 53 CO -0.00 0.15 1.13 0.49 0.13 0.00 0.00 175.17 177.07 3d43 n PHE 54 N 3.63 0.32 0.59 -5.34 3.72 0.43 -0.91 117.46 119.90 3d43 n PHE 54 Ca -0.19 -0.38 0.11 0.00 -0.05 0.00 0.00 57.45 56.94 3d43 n PHE 54 Cb 0.53 -0.02 0.14 0.00 -0.94 0.00 0.00 39.48 39.19 3d43 n PHE 54 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3d43 n THR 55 N 0.47 0.25 -3.08 4.37 -2.24 -1.24 -4.72 114.28 108.09 3d43 n THR 55 Ca 0.09 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 3d43 n THR 55 Cb 0.37 1.21 0.00 0.00 -2.10 0.00 0.00 70.33 69.82 3d43 n THR 55 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d43 n GLY 56 N 1.29 2.42 0.23 3.38 0.00 -1.26 -5.02 105.19 106.21 3d43 n GLY 56 Ca 0.15 -2.13 0.14 0.00 0.00 0.00 0.00 46.02 44.18 3d43 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d43 h ALA 57 N 0.47 1.00 -2.19 4.61 0.00 -1.97 -3.42 119.26 117.75 3d43 h ALA 57 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.52 3d43 h ALA 57 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.65 3d43 h ALA 57 CO 0.00 0.00 -0.66 0.95 0.00 0.00 0.00 179.25 179.54 3d43 s THR 58 N -3.38 1.10 -0.08 0.00 -4.23 -1.26 -5.18 115.64 102.62 3d43 s THR 58 Ca 0.05 -2.04 -0.17 0.00 -1.18 0.00 0.00 61.69 58.35 3d43 s THR 58 Cb 0.07 -2.31 0.04 0.00 1.34 0.00 0.00 72.50 71.64 3d43 s THR 58 CO 0.59 -0.36 0.40 0.28 -0.54 0.00 0.00 174.62 175.00 3d43 s THR 59 N -3.37 0.03 0.88 3.99 -1.32 -1.26 -4.27 115.64 110.31 3d43 s THR 59 Ca 0.27 -0.22 -0.10 0.00 -1.21 0.00 0.00 61.69 60.43 3d43 s THR 59 Cb 0.05 -0.65 0.13 0.00 -1.51 0.00 0.00 72.50 70.52 3d43 s THR 59 CO 0.08 -0.12 1.13 -2.84 -2.21 0.00 0.00 174.62 170.66 3d43 s PRO 60 N -0.66 1.30 -0.38 7.08 0.02 -1.26 -5.11 135.00 135.98 3d43 s PRO 60 Ca -0.08 1.44 -0.11 0.00 0.02 0.00 0.00 61.00 62.28 3d43 s PRO 60 Cb -0.04 -1.77 0.03 0.00 0.02 0.00 0.00 34.50 32.75 3d43 s PRO 60 CO 0.03 -2.40 0.21 0.42 -0.33 0.00 0.00 177.00 174.93 3d43 s ILE 61 N -2.71 4.53 0.57 2.83 1.01 -0.09 -4.96 121.20 122.38 3d43 s ILE 61 Ca 0.65 -0.92 -0.17 0.00 0.00 0.00 0.00 60.65 60.22 3d43 s ILE 61 Cb -0.21 -3.55 -0.05 0.00 0.01 0.00 0.00 42.46 38.65 3d43 s ILE 61 CO 0.58 -0.26 1.05 0.21 0.00 0.00 0.00 174.94 176.52 3d43 s ASN 62 N 1.59 5.92 -1.41 3.58 2.47 -1.26 -0.88 114.94 124.96 3d43 s ASN 62 Ca 0.02 1.85 -0.10 0.00 0.42 0.00 0.00 52.86 55.05 3d43 s ASN 62 Cb -0.19 -2.54 0.03 0.00 -1.45 0.00 0.00 41.25 37.10 3d43 s ASN 62 CO 0.06 -1.07 1.11 0.59 -3.72 0.00 0.00 177.10 174.07 3d43 n ASN 63 N -1.76 -5.57 -3.67 -4.21 3.02 0.38 -4.91 115.26 98.54 3d43 n ASN 63 Ca 0.09 -0.63 -0.08 0.00 -0.03 0.00 0.00 54.58 53.93 3d43 n ASN 63 Cb 0.53 -4.65 -0.09 0.00 -0.61 0.00 0.00 39.78 34.95 3d43 n ASN 63 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3d43 s SER 64 N -3.39 -0.52 -0.36 6.41 0.15 -0.91 -4.99 113.70 110.09 3d43 s SER 64 Ca 0.57 1.10 0.04 0.00 0.70 0.00 0.00 55.95 58.36 3d43 s SER 64 Cb -0.26 1.30 0.24 0.00 -1.71 0.00 0.00 66.02 65.58 3d43 s SER 64 CO 0.76 -0.22 1.22 0.00 1.20 0.00 0.00 173.24 176.20 3d43 s THR 66 N 0.11 4.90 -0.20 0.00 2.01 -1.26 -1.01 115.64 120.19 3d43 s THR 66 Ca 0.14 1.78 -0.23 0.00 0.31 0.00 0.00 61.69 63.70 3d43 s THR 66 Cb 0.23 -4.20 -0.02 0.00 0.01 0.00 0.00 72.50 68.52 3d43 s THR 66 CO -0.08 0.12 0.74 -0.62 -0.69 0.00 0.00 174.62 174.09 3d43 s ASP 67 N 1.01 6.80 0.00 3.53 3.68 -1.09 -4.63 116.67 125.97 3d43 s ASP 67 Ca 0.44 0.98 0.06 0.00 2.13 0.00 0.00 52.55 56.17 3d43 s ASP 67 Cb -0.18 -2.40 0.13 0.00 -1.45 0.00 0.00 42.92 39.01 3d43 s ASP 67 CO 0.19 -0.37 0.99 0.54 0.13 0.00 0.00 175.17 176.64 3d43 n ARG 68 N 5.36 1.83 -0.05 4.34 1.74 -1.26 -4.76 116.66 123.86 3d43 n ARG 68 Ca 0.02 -1.48 -0.10 0.00 -0.77 0.00 0.00 57.85 55.52 3d43 n ARG 68 Cb 0.49 -1.14 -0.03 0.00 -1.02 0.00 0.00 32.46 30.75 3d43 n ARG 68 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3d43 n ASN 69 N 0.19 1.21 0.00 0.55 2.85 -1.26 -5.03 115.26 113.76 3d43 n ASN 69 Ca 0.06 0.20 0.00 0.00 -0.11 0.00 0.00 54.58 54.72 3d43 n ASN 69 Cb 0.28 -0.46 0.00 0.00 1.24 0.00 0.00 39.78 40.84 3d43 n ASN 69 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3d43 n GLY 70 N 2.31 1.69 0.16 8.20 0.00 -1.26 -4.87 105.19 111.42 3d43 n GLY 70 Ca -0.18 -0.36 -0.05 0.00 0.00 0.00 0.00 46.02 45.43 3d43 n GLY 70 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3d43 h HIS 71 N 0.00 0.04 -0.59 1.61 6.17 -1.94 -0.25 115.15 120.19 3d43 h HIS 71 Ca 0.00 0.03 -0.10 0.00 0.71 0.00 0.00 60.37 61.00 3d43 h HIS 71 Cb 0.00 0.04 -0.02 0.00 2.52 0.00 0.00 27.41 29.95 3d43 h HIS 71 CO 0.00 -0.04 -0.03 0.78 0.71 0.00 0.00 177.93 179.36 3d43 h GLY 72 N 0.14 1.15 1.04 5.26 0.00 -1.88 -1.07 103.07 107.70 3d43 h GLY 72 Ca 0.18 -0.87 -0.04 0.00 0.00 0.00 0.00 47.33 46.60 3d43 h GLY 72 CO -0.28 0.80 0.34 -0.84 0.00 0.00 0.00 176.54 176.57 3d43 h THR 73 N 0.96 1.25 -0.20 4.70 2.02 -1.39 -1.50 112.91 118.76 3d43 h THR 73 Ca 0.16 -0.76 -0.02 0.00 0.77 0.00 0.00 66.41 66.56 3d43 h THR 73 Cb 0.59 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 3d43 h THR 73 CO 0.04 0.32 0.04 -0.74 0.37 0.00 0.00 175.52 175.54 3d43 h HIS 74 N 1.13 0.35 -0.38 3.16 6.17 -0.62 -1.50 115.15 123.46 3d43 h HIS 74 Ca 0.27 -0.05 0.00 0.00 0.71 0.00 0.00 60.37 61.30 3d43 h HIS 74 Cb 0.17 -0.10 -0.02 0.00 2.52 0.00 0.00 27.41 29.99 3d43 h HIS 74 CO 0.02 0.47 0.25 0.28 0.71 0.00 0.00 177.93 179.66 3d43 h VAL 75 N 0.13 1.10 -0.71 5.26 2.07 -1.12 -2.35 116.25 120.63 3d43 h VAL 75 Ca 0.06 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 67.44 3d43 h VAL 75 Cb 0.31 0.54 -0.05 0.00 -1.52 0.00 0.00 31.29 30.57 3d43 h VAL 75 CO 0.00 0.09 0.44 0.00 0.02 0.00 0.00 177.57 178.13 3d43 h ALA 76 N 1.14 0.94 -0.21 1.67 0.00 -1.13 -2.39 119.26 119.27 3d43 h ALA 76 Ca 0.14 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 3d43 h ALA 76 Cb -0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3d43 h ALA 76 CO -0.03 0.20 -0.17 0.78 0.00 0.00 0.00 179.25 180.03 3d43 h GLY 77 N 0.85 0.39 1.29 0.00 0.00 -0.88 -0.92 103.07 103.81 3d43 h GLY 77 Ca 0.29 -0.27 -0.11 0.00 0.00 0.00 0.00 47.33 47.24 3d43 h GLY 77 CO -0.13 0.25 -0.20 -0.84 0.00 0.00 0.00 176.54 175.63 3d43 h THR 78 N 0.34 1.27 -0.20 4.70 2.02 -1.00 -1.63 112.91 118.41 3d43 h THR 78 Ca 0.06 -1.31 -0.21 0.00 0.77 0.00 0.00 66.41 65.72 3d43 h THR 78 Cb 0.50 1.16 0.01 0.00 -1.74 0.00 0.00 68.15 68.07 3d43 h THR 78 CO 0.03 0.44 -0.70 0.00 0.37 0.00 0.00 175.52 175.67 3d43 h ALA 79 N 1.06 0.36 0.00 6.16 0.00 -0.94 -1.00 119.26 124.90 3d43 h ALA 79 Ca 0.10 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3d43 h ALA 79 Cb 0.71 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3d43 h ALA 79 CO 0.05 0.68 -0.12 1.47 0.00 0.00 0.00 179.25 181.33 3d43 n LEU 80 N -3.97 0.00 -4.71 0.00 -0.00 -0.40 -0.97 117.00 106.96 3d43 n LEU 80 Ca -0.06 -0.91 -0.38 0.00 -0.00 0.00 0.00 56.01 54.65 3d43 n LEU 80 Cb 0.71 0.00 0.05 0.00 -0.00 0.00 0.00 43.42 44.17 3d43 n LEU 80 CO 0.52 0.73 0.86 0.00 -0.00 0.00 0.00 177.39 179.51 3d43 n ALA 81 N 0.00 1.16 -0.14 1.47 0.00 -0.62 -4.42 120.51 117.96 3d43 n ALA 81 Ca 0.00 0.09 0.02 0.00 0.00 0.00 0.00 53.44 53.55 3d43 n ALA 81 Cb 0.55 -2.29 0.04 0.00 0.00 0.00 0.00 19.45 17.75 3d43 n ALA 81 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3d43 n ASP 82 N -1.04 2.22 0.00 0.00 3.85 -0.67 -0.45 116.55 120.45 3d43 n ASP 82 Ca 0.12 -2.12 0.00 0.00 -0.71 0.00 0.00 54.79 52.08 3d43 n ASP 82 Cb 0.45 -0.09 0.00 0.00 -1.35 0.00 0.00 41.12 40.14 3d43 n ASP 82 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3d43 n GLY 83 N -0.42 2.10 0.00 6.12 0.00 0.51 -4.87 105.19 108.63 3d43 n GLY 83 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3d43 n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d43 n GLY 84 N -2.00 -2.04 0.00 -0.02 0.00 -1.26 -0.56 105.19 99.32 3d43 n GLY 84 Ca 0.00 -1.50 0.07 0.00 0.00 0.00 0.00 46.02 44.59 3d43 n GLY 84 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d43 n SER 85 N -2.14 0.00 -0.59 1.61 7.64 -1.26 -1.57 113.62 117.32 3d43 n SER 85 Ca 0.00 0.06 0.06 0.00 1.01 0.00 0.00 58.87 60.00 3d43 n SER 85 Cb 0.00 -0.28 0.11 0.00 -1.01 0.00 0.00 64.21 63.03 3d43 n SER 85 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3d43 n ASP 86 N -1.28 2.49 -1.73 6.43 5.75 -1.26 -4.99 116.55 121.96 3d43 n ASP 86 Ca 0.07 -1.74 -0.19 0.00 -0.01 0.00 0.00 54.79 52.92 3d43 n ASP 86 Cb 0.12 -0.12 -0.07 0.00 -1.03 0.00 0.00 41.12 40.02 3d43 n ASP 86 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3d43 n GLN 87 N 0.64 -1.49 -0.20 0.11 3.00 -0.61 -4.84 117.38 113.99 3d43 n GLN 87 Ca 0.10 1.10 0.09 0.00 -0.01 0.00 0.00 57.00 58.27 3d43 n GLN 87 Cb 0.37 -5.51 0.19 0.00 0.00 0.00 0.00 30.24 25.29 3d43 n GLN 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3d43 n ALA 88 N 0.54 2.33 -2.93 -1.58 0.00 -0.77 -4.93 120.51 113.17 3d43 n ALA 88 Ca -0.20 -1.05 0.00 0.00 0.00 0.00 0.00 53.44 52.19 3d43 n ALA 88 Cb 0.64 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.43 3d43 n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d43 n GLY 89 N 1.06 2.40 3.91 0.00 0.00 0.28 -3.77 105.19 109.08 3d43 n GLY 89 Ca 0.16 -2.12 -0.27 0.00 0.00 0.00 0.00 46.02 43.79 3d43 n GLY 89 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3d43 s ILE 90 N 0.95 4.38 -0.08 -0.61 -4.36 -1.26 -4.62 121.20 115.60 3d43 s ILE 90 Ca 0.00 0.15 0.04 0.00 -0.26 0.00 0.00 60.65 60.57 3d43 s ILE 90 Cb 0.00 -3.69 -0.01 0.00 1.25 0.00 0.00 42.46 40.00 3d43 s ILE 90 CO 0.00 -0.70 -0.19 -0.31 0.24 0.00 0.00 174.94 173.97 3d43 s TYR 91 N -2.86 2.61 0.42 1.37 2.02 -0.71 -0.36 117.35 119.84 3d43 s TYR 91 Ca 0.50 -0.61 0.04 0.00 -0.37 0.00 0.00 57.07 56.63 3d43 s TYR 91 Cb -0.10 -1.69 0.08 0.00 -0.40 0.00 0.00 41.96 39.85 3d43 s TYR 91 CO 0.45 -0.15 0.58 0.41 -1.57 0.00 0.00 175.55 175.28 3d43 n GLY 92 N 3.03 1.45 0.29 0.71 0.00 0.40 -4.75 105.19 106.31 3d43 n GLY 92 Ca -0.18 -2.12 -0.10 0.00 0.00 0.00 0.00 46.02 43.63 3d43 n GLY 92 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3d43 h VAL 93 N -0.17 1.27 -2.39 1.61 2.07 -0.87 -3.36 116.25 114.41 3d43 h VAL 93 Ca -0.19 -1.16 -0.60 0.00 0.82 0.00 0.00 66.70 65.56 3d43 h VAL 93 Cb 0.82 0.89 -0.41 0.00 -1.52 0.00 0.00 31.29 31.07 3d43 h VAL 93 CO 0.25 0.42 -0.72 0.00 0.02 0.00 0.00 177.57 177.53 3d43 n ALA 94 N -2.48 3.48 0.52 1.67 0.00 -0.14 -4.38 120.51 119.19 3d43 n ALA 94 Ca 0.02 -4.29 0.08 0.00 0.00 0.00 0.00 53.44 49.25 3d43 n ALA 94 Cb 0.35 -0.90 0.35 0.00 0.00 0.00 0.00 19.45 19.25 3d43 n ALA 94 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3d43 n PRO 95 N 1.42 0.02 0.00 0.00 -0.04 -1.03 -1.74 135.00 133.63 3d43 n PRO 95 Ca 0.26 0.25 0.12 0.00 -0.04 0.00 0.00 63.50 64.09 3d43 n PRO 95 Cb 0.43 -1.54 0.17 0.00 -0.04 0.00 0.00 33.50 32.52 3d43 n PRO 95 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3d43 n ASP 96 N -1.58 2.51 -4.80 3.54 10.43 -0.10 -4.54 116.55 122.00 3d43 n ASP 96 Ca 0.04 -1.79 -0.31 0.00 2.57 0.00 0.00 54.79 55.30 3d43 n ASP 96 Cb 0.19 0.08 0.07 0.00 1.84 0.00 0.00 41.12 43.30 3d43 n ASP 96 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3d43 s ALA 97 N -2.10 2.45 -0.22 2.24 0.00 -0.71 -3.83 121.76 119.59 3d43 s ALA 97 Ca 0.28 0.01 -0.10 0.00 0.00 0.00 0.00 51.96 52.15 3d43 s ALA 97 Cb 0.20 -3.17 -0.05 0.00 0.00 0.00 0.00 23.12 20.10 3d43 s ALA 97 CO 0.36 -1.49 0.15 0.16 0.00 0.00 0.00 175.76 174.94 3d43 s ASP 98 N -3.77 6.12 -0.12 0.00 1.47 -0.41 -4.76 116.67 115.19 3d43 s ASP 98 Ca 0.59 0.15 -0.23 0.00 1.18 0.00 0.00 52.55 54.24 3d43 s ASP 98 Cb -0.15 -2.09 -0.03 0.00 -0.34 0.00 0.00 42.92 40.31 3d43 s ASP 98 CO 0.55 0.11 0.72 -0.22 0.68 0.00 0.00 175.17 177.01 3d43 s LEU 99 N 0.81 4.24 -0.40 2.11 2.96 0.27 -0.75 118.68 127.92 3d43 s LEU 99 Ca 0.07 1.11 -0.07 0.00 -0.22 0.00 0.00 54.13 55.03 3d43 s LEU 99 Cb -0.13 -3.09 0.08 0.00 0.50 0.00 0.00 46.19 43.56 3d43 s LEU 99 CO 0.02 -0.23 0.21 0.26 -1.32 0.00 0.00 176.35 175.29 3d43 s TRP 100 N 1.44 3.38 -0.62 5.38 0.52 -0.09 -0.77 118.94 128.18 3d43 s TRP 100 Ca 0.36 -1.78 -0.22 0.00 0.02 0.00 0.00 56.10 54.47 3d43 s TRP 100 Cb -0.17 -2.89 0.07 0.00 -1.15 0.00 0.00 33.47 29.33 3d43 s TRP 100 CO 0.15 -0.87 0.92 0.00 0.02 0.00 0.00 176.95 177.17 3d43 s ALA 101 N 1.33 3.16 -0.32 0.98 0.00 -0.06 -0.83 121.76 126.03 3d43 s ALA 101 Ca 0.03 -1.74 -0.06 0.00 0.00 0.00 0.00 51.96 50.19 3d43 s ALA 101 Cb -0.22 -3.77 0.03 0.00 0.00 0.00 0.00 23.12 19.15 3d43 s ALA 101 CO 0.00 -2.61 0.09 0.71 0.00 0.00 0.00 175.76 173.95 3d43 s TYR 102 N 3.84 3.21 -0.45 0.00 4.12 -0.72 -1.51 117.35 125.84 3d43 s TYR 102 Ca 0.22 -1.27 -0.26 0.00 0.02 0.00 0.00 57.07 55.79 3d43 s TYR 102 Cb -0.17 -2.26 0.03 0.00 -1.52 0.00 0.00 41.96 38.04 3d43 s TYR 102 CO 0.12 -0.68 0.95 0.21 0.02 0.00 0.00 175.55 176.17 3d43 s LYS 103 N 1.43 3.60 -0.00 -0.62 2.20 0.09 -1.22 119.74 125.23 3d43 s LYS 103 Ca -0.00 0.27 0.02 0.00 -0.36 0.00 0.00 55.97 55.90 3d43 s LYS 103 Cb -0.19 -3.91 -0.03 0.00 -1.51 0.00 0.00 37.83 32.20 3d43 s LYS 103 CO 0.02 -1.20 0.09 1.33 -0.36 0.00 0.00 175.35 175.24 3d43 n VAL 104 N 6.40 0.00 -4.53 4.02 0.24 0.31 -0.43 118.33 124.34 3d43 n VAL 104 Ca 0.07 -0.40 -0.34 0.00 -2.04 0.00 0.00 64.34 61.63 3d43 n VAL 104 Cb 0.48 0.94 -0.11 0.00 -1.47 0.00 0.00 33.84 33.68 3d43 n VAL 104 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3d43 s LEU 105 N -2.23 3.25 1.14 1.34 1.43 -0.76 -4.26 118.68 118.59 3d43 s LEU 105 Ca 0.01 -0.03 -0.13 0.00 -1.03 0.00 0.00 54.13 52.95 3d43 s LEU 105 Cb 0.02 -1.73 0.27 0.00 0.03 0.00 0.00 46.19 44.77 3d43 s LEU 105 CO 0.10 0.31 1.04 -0.76 0.23 0.00 0.00 176.35 177.26 3d43 s LEU 106 N -0.48 0.98 0.57 1.79 1.43 0.21 -4.43 118.68 118.75 3d43 s LEU 106 Ca 0.07 1.50 0.29 0.00 -1.03 0.00 0.00 54.13 54.97 3d43 s LEU 106 Cb -0.12 -3.46 1.73 0.00 0.03 0.00 0.00 46.19 44.38 3d43 s LEU 106 CO 0.02 -4.06 2.22 0.44 0.23 0.00 0.00 176.35 175.20 3d43 h ASP 107 N -2.53 0.00 0.42 2.29 3.32 -1.89 0.75 116.42 118.78 3d43 h ASP 107 Ca -0.60 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.45 3d43 h ASP 107 Cb 1.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.88 3d43 h ASP 107 CO 0.51 0.03 0.00 0.77 -1.72 0.00 0.00 179.24 178.83 3d43 h SER 108 N 0.00 0.00 0.00 6.45 4.64 -1.96 -3.40 113.55 119.28 3d43 h SER 108 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d43 h SER 108 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3d43 h SER 108 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3d43 n GLY 109 N -0.62 0.59 3.68 -0.77 0.00 0.26 -5.08 105.19 103.25 3d43 n GLY 109 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 3d43 n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d43 s SER 110 N -2.96 4.82 0.00 1.61 0.01 -1.25 -4.86 113.70 111.06 3d43 s SER 110 Ca 0.00 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 56.80 3d43 s SER 110 Cb 0.00 -1.02 0.00 0.00 0.21 0.00 0.00 66.02 65.21 3d43 s SER 110 CO 0.00 0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.30 3d43 n GLY 111 N -0.56 4.29 3.38 3.44 0.00 -1.26 -0.62 105.19 113.85 3d43 n GLY 111 Ca -0.08 -1.08 -0.31 0.00 0.00 0.00 0.00 46.02 44.55 3d43 n GLY 111 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d43 s TYR 112 N -1.52 2.44 0.28 1.61 1.51 -1.26 -5.00 117.35 115.41 3d43 s TYR 112 Ca 0.00 -0.35 -0.01 0.00 -1.01 0.00 0.00 57.07 55.70 3d43 s TYR 112 Cb 0.00 -1.49 0.40 0.00 -0.11 0.00 0.00 41.96 40.76 3d43 s TYR 112 CO 0.00 0.10 1.84 0.77 -1.11 0.00 0.00 175.55 177.15 3d43 h SER 113 N 5.11 0.80 -0.81 2.29 0.02 -1.99 -2.12 113.55 116.84 3d43 h SER 113 Ca -0.45 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 60.34 3d43 h SER 113 Cb 1.14 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 63.43 3d43 h SER 113 CO 0.47 0.75 0.39 -2.24 -1.14 0.00 0.00 176.83 175.06 3d43 h ASP 114 N 0.84 1.07 -0.40 3.07 2.03 -1.97 -0.45 116.42 120.61 3d43 h ASP 114 Ca 0.19 -0.13 -0.05 0.00 -0.73 0.00 0.00 57.03 56.31 3d43 h ASP 114 Cb 0.24 -0.27 -0.02 0.00 -0.83 0.00 0.00 39.33 38.45 3d43 h ASP 114 CO -0.01 0.90 0.04 0.44 -1.03 0.00 0.00 179.24 179.59 3d43 h ASP 115 N 1.17 0.66 -0.34 4.15 3.32 -1.70 -0.72 116.42 122.97 3d43 h ASP 115 Ca 0.28 -0.28 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 3d43 h ASP 115 Cb 0.12 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 3d43 h ASP 115 CO -0.03 0.77 0.21 0.40 -1.72 0.00 0.00 179.24 178.87 3d43 h ILE 116 N 0.53 1.11 -0.71 0.35 2.04 -1.18 -1.88 117.51 117.76 3d43 h ILE 116 Ca 0.12 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 3d43 h ILE 116 Cb 0.41 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 3d43 h ILE 116 CO 0.01 0.11 0.42 0.00 0.00 0.00 0.00 178.15 178.69 3d43 h ALA 117 N 1.09 0.91 -0.78 1.87 0.00 -0.93 -1.25 119.26 120.18 3d43 h ALA 117 Ca 0.12 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.96 3d43 h ALA 117 Cb -0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 3d43 h ALA 117 CO -0.02 0.39 0.51 0.00 0.00 0.00 0.00 179.25 180.12 3d43 h ALA 118 N 1.22 0.99 -0.24 0.00 0.00 -0.92 -1.61 119.26 118.70 3d43 h ALA 118 Ca 0.25 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.98 3d43 h ALA 118 Cb -0.02 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3d43 h ALA 118 CO -0.05 0.37 -0.42 0.00 0.00 0.00 0.00 179.25 179.15 3d43 h ALA 119 N 1.30 0.83 -0.10 0.00 0.00 -0.88 0.59 119.26 120.99 3d43 h ALA 119 Ca 0.29 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3d43 h ALA 119 Cb -0.08 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 3d43 h ALA 119 CO -0.08 0.65 0.06 0.82 0.00 0.00 0.00 179.25 180.71 3d43 h ILE 120 N 0.46 1.04 -0.60 0.00 2.04 -0.91 -0.15 117.51 119.40 3d43 h ILE 120 Ca 0.04 -0.11 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 3d43 h ILE 120 Cb 0.93 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 3d43 h ILE 120 CO 0.08 0.04 0.10 0.03 0.00 0.00 0.00 178.15 178.40 3d43 h ARG 121 N 0.12 0.96 -0.48 2.37 3.08 -1.15 -2.26 114.38 117.02 3d43 h ARG 121 Ca 0.04 -0.23 -0.12 0.00 0.07 0.00 0.00 59.98 59.73 3d43 h ARG 121 Cb 0.01 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 3d43 h ARG 121 CO -0.01 0.88 -0.17 1.25 -1.07 0.00 0.00 179.97 180.86 3d43 h HIS 122 N 0.91 1.10 -0.53 3.04 2.76 -0.58 -0.13 115.15 121.72 3d43 h HIS 122 Ca 0.19 -0.25 0.05 0.00 -2.20 0.00 0.00 60.37 58.15 3d43 h HIS 122 Cb 0.39 -0.26 -0.05 0.00 1.55 0.00 0.00 27.41 29.04 3d43 h HIS 122 CO 0.03 1.07 0.26 0.00 -1.30 0.00 0.00 177.93 177.98 3d43 h ALA 123 N 0.88 0.68 -0.60 5.26 0.00 -0.85 0.12 119.26 124.75 3d43 h ALA 123 Ca 0.12 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3d43 h ALA 123 Cb 0.74 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 3d43 h ALA 123 CO 0.06 -0.09 0.32 0.00 0.00 0.00 0.00 179.25 179.53 3d43 h ALA 124 N 1.30 0.76 -0.40 0.00 0.00 -1.04 -0.01 119.26 119.87 3d43 h ALA 124 Ca 0.24 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3d43 h ALA 124 Cb 0.17 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3d43 h ALA 124 CO -0.18 0.29 0.08 -0.44 0.00 0.00 0.00 179.25 179.00 3d43 h ASP 125 N 0.81 0.55 0.01 0.00 3.32 -0.42 -1.01 116.42 119.68 3d43 h ASP 125 Ca 0.21 -0.08 -0.18 0.00 0.02 0.00 0.00 57.03 56.99 3d43 h ASP 125 Cb 0.06 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 3d43 h ASP 125 CO -0.03 0.56 -0.63 1.56 -1.72 0.00 0.00 179.24 178.98 3d43 h GLN 126 N 0.58 0.61 -0.36 3.56 1.08 -0.48 0.68 115.11 120.78 3d43 h GLN 126 Ca 0.13 -0.43 0.05 0.00 -1.45 0.00 0.00 58.65 56.95 3d43 h GLN 126 Cb 0.25 0.07 -0.04 0.00 -0.05 0.00 0.00 27.48 27.70 3d43 h GLN 126 CO -0.00 1.05 0.10 0.00 -0.95 0.00 0.00 178.83 179.02 3d43 h ALA 127 N 0.85 0.40 -0.49 3.87 0.00 -0.57 -1.01 119.26 122.32 3d43 h ALA 127 Ca -0.01 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3d43 h ALA 127 Cb 1.21 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 3d43 h ALA 127 CO 0.12 -0.30 0.02 1.15 0.00 0.00 0.00 179.25 180.24 3d43 h THR 128 N 0.23 1.26 -0.66 0.00 2.02 -1.01 -0.39 112.91 114.37 3d43 h THR 128 Ca 0.17 -1.04 -0.07 0.00 0.77 0.00 0.00 66.41 66.23 3d43 h THR 128 Cb 0.17 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 3d43 h THR 128 CO -0.19 0.37 0.14 0.00 0.37 0.00 0.00 175.52 176.20 3d43 h ALA 129 N 0.93 0.87 0.00 6.16 0.00 -0.67 -3.03 119.26 123.52 3d43 h ALA 129 Ca 0.14 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3d43 h ALA 129 Cb 0.49 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3d43 h ALA 129 CO 0.02 0.60 -0.49 1.79 0.00 0.00 0.00 179.25 181.17 3d43 h THR 130 N 0.99 0.00 -2.00 0.00 1.35 -1.11 -3.48 112.91 108.65 3d43 h THR 130 Ca 0.20 -0.75 -0.17 0.00 -0.55 0.00 0.00 66.41 65.14 3d43 h THR 130 Cb 0.40 1.47 0.02 0.00 -1.73 0.00 0.00 68.15 68.31 3d43 h THR 130 CO 0.01 0.00 -0.25 0.61 -0.25 0.00 0.00 175.52 175.64 3d43 n GLY 131 N 1.23 0.15 3.41 5.82 0.00 -0.19 -5.04 105.19 110.58 3d43 n GLY 131 Ca 0.03 -0.42 -0.20 0.00 0.00 0.00 0.00 46.02 45.42 3d43 n GLY 131 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3d43 s THR 132 N -2.74 1.38 -0.05 2.61 -4.23 -0.96 -5.05 115.64 106.61 3d43 s THR 132 Ca 0.11 -2.07 -0.20 0.00 -1.18 0.00 0.00 61.69 58.35 3d43 s THR 132 Cb -0.05 -2.51 -0.05 0.00 1.34 0.00 0.00 72.50 71.23 3d43 s THR 132 CO 0.13 -0.23 0.55 -0.54 -0.54 0.00 0.00 174.62 173.99 3d43 s LYS 133 N -3.80 4.30 -0.01 3.99 -0.14 -1.26 -4.67 119.74 118.14 3d43 s LYS 133 Ca 0.31 0.63 0.02 0.00 -1.36 0.00 0.00 55.97 55.56 3d43 s LYS 133 Cb 0.06 -3.37 0.00 0.00 -1.68 0.00 0.00 37.83 32.84 3d43 s LYS 133 CO 0.12 0.30 -0.05 0.99 -0.76 0.00 0.00 175.35 175.95 3d43 s THR 134 N 0.08 0.42 -0.16 2.17 2.01 -1.26 -1.28 115.64 117.62 3d43 s THR 134 Ca 0.29 -0.20 0.01 0.00 0.31 0.00 0.00 61.69 62.10 3d43 s THR 134 Cb -0.17 -0.37 0.00 0.00 0.01 0.00 0.00 72.50 71.97 3d43 s THR 134 CO 0.15 0.13 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.42 3d43 s ILE 135 N 0.07 2.55 -0.12 1.82 1.01 0.24 -1.99 121.20 124.77 3d43 s ILE 135 Ca -0.00 -0.81 -0.21 0.00 0.00 0.00 0.00 60.65 59.63 3d43 s ILE 135 Cb -0.04 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 3d43 s ILE 135 CO -0.00 0.52 0.60 -0.63 0.00 0.00 0.00 174.94 175.42 3d43 s ILE 136 N 0.86 5.09 -0.22 2.92 1.01 0.51 -0.26 121.20 131.11 3d43 s ILE 136 Ca -0.05 1.18 0.02 0.00 0.00 0.00 0.00 60.65 61.81 3d43 s ILE 136 Cb -0.15 -3.93 0.04 0.00 0.01 0.00 0.00 42.46 38.43 3d43 s ILE 136 CO -0.01 0.24 -0.15 -0.55 0.00 0.00 0.00 174.94 174.47 3d43 s SER 137 N 0.85 3.82 -0.36 3.58 0.15 0.29 -0.70 113.70 121.33 3d43 s SER 137 Ca 0.31 -1.02 0.04 0.00 0.70 0.00 0.00 55.95 55.97 3d43 s SER 137 Cb -0.16 -1.52 0.10 0.00 -1.71 0.00 0.00 66.02 62.73 3d43 s SER 137 CO 0.13 -0.10 0.08 -0.04 1.20 0.00 0.00 173.24 174.51 3d43 s MET 138 N 1.20 1.56 -1.33 5.44 -1.94 0.09 -2.03 119.30 122.28 3d43 s MET 138 Ca -0.02 -1.97 -0.08 0.00 -1.71 0.00 0.00 55.69 51.91 3d43 s MET 138 Cb -0.17 -3.23 0.12 0.00 2.01 0.00 0.00 34.83 33.56 3d43 s MET 138 CO -0.09 -0.96 2.19 0.43 -0.01 0.00 0.00 175.02 176.58 3d43 n SER 139 N 4.12 6.59 -3.47 3.03 7.64 -1.26 -1.68 113.62 128.59 3d43 n SER 139 Ca 0.04 -3.08 -0.15 0.00 1.01 0.00 0.00 58.87 56.70 3d43 n SER 139 Cb 0.41 -1.44 -0.04 0.00 -1.01 0.00 0.00 64.21 62.13 3d43 n SER 139 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 3d43 s LEU 140 N -0.90 -0.58 -0.28 -3.43 0.05 -1.26 -4.85 118.68 107.43 3d43 s LEU 140 Ca 0.48 0.32 -0.31 0.00 0.05 0.00 0.00 54.13 54.67 3d43 s LEU 140 Cb 0.14 2.55 0.18 0.00 -2.05 0.00 0.00 46.19 47.02 3d43 s LEU 140 CO -0.05 -0.80 1.34 -0.83 -0.55 0.00 0.00 176.35 175.46 3d43 s GLY 141 N -2.04 0.01 0.26 -3.48 0.00 -1.26 -4.36 107.32 96.46 3d43 s GLY 141 Ca -0.04 2.61 -0.06 0.00 0.00 0.00 0.00 44.72 47.23 3d43 s GLY 141 CO -0.03 1.01 0.36 -1.35 0.00 0.00 0.00 173.10 173.10 3d43 s SER 142 N -1.23 0.32 0.22 1.64 1.04 -0.68 -4.93 113.70 110.08 3d43 s SER 142 Ca 0.09 -1.25 0.09 0.00 0.48 0.00 0.00 55.95 55.37 3d43 s SER 142 Cb -0.01 0.54 0.16 0.00 0.10 0.00 0.00 66.02 66.81 3d43 s SER 142 CO -0.07 -1.09 1.49 0.77 0.98 0.00 0.00 173.24 175.33 3d43 h SER 143 N 2.32 0.00 -3.16 7.02 4.64 -1.90 0.16 113.55 122.62 3d43 h SER 143 Ca -0.30 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.44 3d43 h SER 143 Cb 1.25 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.28 3d43 h SER 143 CO 0.42 0.75 -0.12 0.00 -0.87 0.00 0.00 176.83 177.01 3d43 s ALA 144 N -3.28 3.61 0.86 5.18 0.00 -1.26 -4.60 121.76 122.27 3d43 s ALA 144 Ca -0.00 -0.10 -0.11 0.00 0.00 0.00 0.00 51.96 51.75 3d43 s ALA 144 Cb 0.12 -2.54 0.11 0.00 0.00 0.00 0.00 23.12 20.80 3d43 s ALA 144 CO 0.78 0.36 1.09 1.21 0.00 0.00 0.00 175.76 179.21 3d43 s ASN 145 N -0.79 3.71 -0.10 0.00 2.47 -1.26 -4.52 114.94 114.45 3d43 s ASN 145 Ca 0.27 1.70 -0.03 0.00 0.42 0.00 0.00 52.86 55.21 3d43 s ASN 145 Cb -0.18 -2.36 0.05 0.00 -1.45 0.00 0.00 41.25 37.32 3d43 s ASN 145 CO 0.15 -2.52 0.15 0.21 -3.72 0.00 0.00 177.10 171.38 3d43 s ASN 146 N -3.29 0.95 0.47 -4.21 3.84 -1.26 -5.05 114.94 106.39 3d43 s ASN 146 Ca 0.63 0.20 0.26 0.00 0.21 0.00 0.00 52.86 54.16 3d43 s ASN 146 Cb -0.18 0.21 1.12 0.00 -0.55 0.00 0.00 41.25 41.85 3d43 s ASN 146 CO 0.57 -0.26 1.91 0.77 -2.79 0.00 0.00 177.10 177.30 3d43 h SER 147 N 8.37 0.00 -0.26 -4.21 4.64 -1.98 0.15 113.55 120.26 3d43 h SER 147 Ca -0.13 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.17 3d43 h SER 147 Cb 1.12 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 3d43 h SER 147 CO 0.16 0.18 0.09 -0.07 -0.87 0.00 0.00 176.83 176.33 3d43 h LEU 148 N 0.00 0.37 -0.62 5.97 3.38 -1.96 -1.17 115.31 121.27 3d43 h LEU 148 Ca -0.00 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.66 3d43 h LEU 148 Cb 0.61 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 3d43 h LEU 148 CO 0.02 0.45 -0.27 0.40 0.09 0.00 0.00 178.44 179.13 3d43 h ILE 149 N 0.26 1.28 -0.18 1.22 2.04 -1.58 -1.83 117.51 118.71 3d43 h ILE 149 Ca 0.08 -1.41 -0.01 0.00 1.00 0.00 0.00 64.86 64.52 3d43 h ILE 149 Cb 0.21 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 3d43 h ILE 149 CO -0.00 0.47 0.07 -1.28 0.00 0.00 0.00 178.15 177.40 3d43 h SER 150 N 0.68 0.26 -0.75 1.72 0.87 -0.91 -0.06 113.55 115.35 3d43 h SER 150 Ca 0.08 -0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.45 3d43 h SER 150 Cb 0.80 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 62.66 3d43 h SER 150 CO 0.07 0.37 0.43 0.77 -0.53 0.00 0.00 176.83 177.94 3d43 h SER 151 N 0.13 0.93 -0.64 6.23 4.64 -1.17 -0.82 113.55 122.85 3d43 h SER 151 Ca 0.06 -0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3d43 h SER 151 Cb 0.20 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 3d43 h SER 151 CO -0.00 0.74 0.29 0.00 -0.87 0.00 0.00 176.83 176.99 3d43 h ALA 152 N 1.42 0.82 -0.72 5.18 0.00 -0.85 -0.49 119.26 124.62 3d43 h ALA 152 Ca 0.27 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.06 3d43 h ALA 152 Cb -0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 3d43 h ALA 152 CO -0.05 0.40 0.46 0.28 0.00 0.00 0.00 179.25 180.35 3d43 h VAL 153 N 0.88 1.12 -0.55 0.00 2.07 -0.37 0.03 116.25 119.44 3d43 h VAL 153 Ca 0.22 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 3d43 h VAL 153 Cb 0.15 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.02 3d43 h VAL 153 CO -0.02 0.17 0.24 0.78 0.02 0.00 0.00 177.57 178.75 3d43 h ASN 154 N 0.91 0.75 -0.03 0.57 2.35 -0.77 0.52 115.58 119.87 3d43 h ASN 154 Ca 0.28 -0.15 0.02 0.00 -0.55 0.00 0.00 56.30 55.90 3d43 h ASN 154 Cb -0.02 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.13 3d43 h ASN 154 CO -0.10 0.69 -0.10 0.22 -1.65 0.00 0.00 177.43 176.50 3d43 h TYR 155 N 0.75 -0.25 -0.40 1.19 3.20 -0.65 0.54 116.97 121.35 3d43 h TYR 155 Ca 0.19 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.06 3d43 h TYR 155 Cb 0.17 0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 3d43 h TYR 155 CO 0.00 -0.15 0.24 0.00 -1.64 0.00 0.00 178.16 176.61 3d43 h ALA 156 N 0.85 0.52 0.00 1.82 0.00 -0.65 -2.58 119.26 119.23 3d43 h ALA 156 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3d43 h ALA 156 Cb 0.22 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 3d43 h ALA 156 CO -0.13 0.02 -0.01 -0.92 0.00 0.00 0.00 179.25 178.22 3d43 h TYR 157 N 0.53 -0.01 0.00 0.00 3.20 -0.70 -1.61 116.97 118.38 3d43 h TYR 157 Ca 0.14 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.01 3d43 h TYR 157 Cb 0.02 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.30 3d43 h TYR 157 CO -0.03 -0.01 0.12 0.77 -1.64 0.00 0.00 178.16 177.37 3d43 h SER 158 N -0.01 0.00 -0.70 -2.11 0.02 -0.66 -1.72 113.55 108.36 3d43 h SER 158 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3d43 h SER 158 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 3d43 h SER 158 CO -0.00 0.00 0.00 0.29 -1.14 0.00 0.00 176.83 175.98 3d43 n LYS 159 N -2.87 3.23 -0.30 3.45 5.02 -0.67 -4.94 118.16 121.07 3d43 n LYS 159 Ca -0.02 -2.78 0.00 0.00 -2.02 0.00 0.00 58.31 53.49 3d43 n LYS 159 Cb 0.17 -1.74 0.00 0.00 -0.02 0.00 0.00 35.03 33.44 3d43 n LYS 159 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d43 n GLY 160 N 1.43 0.84 3.82 0.72 0.00 -0.65 -4.84 105.19 106.51 3d43 n GLY 160 Ca 0.25 -0.10 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 3d43 n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d43 s VAL 161 N -2.00 4.70 -0.03 1.61 1.01 -0.82 -4.30 120.40 120.57 3d43 s VAL 161 Ca 0.00 1.13 -0.17 0.00 0.00 0.00 0.00 61.98 62.94 3d43 s VAL 161 Cb 0.00 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 3d43 s VAL 161 CO 0.00 0.32 0.45 -0.22 0.00 0.00 0.00 175.10 175.65 3d43 s LEU 162 N -1.72 4.41 -0.16 3.92 2.96 -0.84 -4.17 118.68 123.07 3d43 s LEU 162 Ca 0.37 0.95 -0.01 0.00 -0.22 0.00 0.00 54.13 55.22 3d43 s LEU 162 Cb -0.17 -2.67 -0.01 0.00 0.50 0.00 0.00 46.19 43.84 3d43 s LEU 162 CO 0.20 0.20 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.69 3d43 s ILE 163 N -0.44 3.08 -0.06 6.68 1.09 -1.26 -0.37 121.20 129.93 3d43 s ILE 163 Ca 0.25 -0.63 0.04 0.00 -1.10 0.00 0.00 60.65 59.21 3d43 s ILE 163 Cb -0.16 -2.33 0.00 0.00 -1.06 0.00 0.00 42.46 38.91 3d43 s ILE 163 CO 0.13 0.50 -0.17 -0.69 -0.10 0.00 0.00 174.94 174.60 3d43 s VAL 164 N 0.73 1.48 0.04 2.92 1.01 0.12 -0.93 120.40 125.77 3d43 s VAL 164 Ca -0.05 -0.72 -0.09 0.00 0.00 0.00 0.00 61.98 61.11 3d43 s VAL 164 Cb -0.15 -1.29 0.00 0.00 0.00 0.00 0.00 36.38 34.95 3d43 s VAL 164 CO 0.02 0.43 0.20 0.00 0.00 0.00 0.00 175.10 175.74 3d43 s ALA 165 N 0.21 -0.36 0.39 5.51 0.00 -0.03 -0.73 121.76 126.74 3d43 s ALA 165 Ca -0.08 -0.29 -0.26 0.00 0.00 0.00 0.00 51.96 51.33 3d43 s ALA 165 Cb -0.13 0.29 -0.09 0.00 0.00 0.00 0.00 23.12 23.19 3d43 s ALA 165 CO 0.04 -0.37 1.21 0.00 0.00 0.00 0.00 175.76 176.64 3d43 s ALA 166 N -2.61 3.23 0.35 0.00 0.00 -0.68 -1.27 121.76 120.77 3d43 s ALA 166 Ca -0.05 1.06 0.09 0.00 0.00 0.00 0.00 51.96 53.06 3d43 s ALA 166 Cb -0.01 -3.41 0.64 0.00 0.00 0.00 0.00 23.12 20.33 3d43 s ALA 166 CO -0.04 -0.60 1.81 0.00 0.00 0.00 0.00 175.76 176.93 3d43 h ALA 167 N 2.79 1.32 0.00 0.00 0.00 -1.29 -3.36 119.26 118.72 3d43 h ALA 167 Ca -0.49 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.11 3d43 h ALA 167 Cb 1.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3d43 h ALA 167 CO 0.63 0.47 0.00 0.41 0.00 0.00 0.00 179.25 180.76 3d43 n GLY 168 N -0.52 2.25 1.37 0.00 0.00 -1.26 -1.27 105.19 105.76 3d43 n GLY 168 Ca -0.01 -2.08 -0.10 0.00 0.00 0.00 0.00 46.02 43.83 3d43 n GLY 168 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3d43 n ASN 169 N 0.00 3.48 -1.03 1.61 3.02 -1.26 -0.59 115.26 120.49 3d43 n ASN 169 Ca 0.00 -3.82 0.08 0.00 -0.03 0.00 0.00 54.58 50.81 3d43 n ASN 169 Cb 0.00 -0.45 0.25 0.00 -0.61 0.00 0.00 39.78 38.97 3d43 n ASN 169 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3d43 n SER 170 N -0.91 3.83 -4.28 6.41 7.64 -0.95 -4.74 113.62 120.62 3d43 n SER 170 Ca 0.33 -2.45 -0.29 0.00 1.01 0.00 0.00 58.87 57.46 3d43 n SER 170 Cb 0.85 -0.44 0.20 0.00 -1.01 0.00 0.00 64.21 63.80 3d43 n SER 170 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3d43 s GLY 171 N -1.26 1.60 0.00 0.23 0.00 0.20 -4.48 107.32 103.62 3d43 s GLY 171 Ca 0.38 -0.75 0.12 0.00 0.00 0.00 0.00 44.72 44.47 3d43 s GLY 171 CO 0.17 -0.02 1.26 1.58 0.00 0.00 0.00 173.10 176.09 3d43 n TYR 172 N -4.29 0.48 -2.07 1.90 4.11 -0.99 -4.53 117.16 111.77 3d43 n TYR 172 Ca 0.10 -0.48 -0.42 0.00 -0.00 0.00 0.00 57.90 57.10 3d43 n TYR 172 Cb 0.59 -0.02 -0.03 0.00 -0.00 0.00 0.00 39.34 39.88 3d43 n TYR 172 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.86 175.32 3d43 s SER 173 N -1.00 6.72 -0.01 9.48 1.04 -1.26 -4.73 113.70 123.94 3d43 s SER 173 Ca 0.25 2.35 -0.14 0.00 0.48 0.00 0.00 55.95 58.89 3d43 s SER 173 Cb 0.13 -2.57 -0.07 0.00 0.10 0.00 0.00 66.02 63.61 3d43 s SER 173 CO 0.17 -0.78 0.37 1.67 0.98 0.00 0.00 173.24 175.65 3d43 n GLN 174 N 5.01 0.00 -0.84 4.02 7.27 -1.26 -3.08 117.38 128.50 3d43 n GLN 174 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.21 3d43 n GLN 174 Cb 0.42 -0.51 0.00 0.00 2.41 0.00 0.00 30.24 32.56 3d43 n GLN 174 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3d43 n GLY 175 N 0.54 0.49 0.18 1.69 0.00 0.19 -4.97 105.19 103.30 3d43 n GLY 175 Ca 0.07 -0.85 0.12 0.00 0.00 0.00 0.00 46.02 45.35 3d43 n GLY 175 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d43 n THR 176 N -2.84 0.00 -1.63 2.61 -2.24 -0.10 -4.96 114.28 105.12 3d43 n THR 176 Ca 0.00 -0.09 -0.45 0.00 -2.27 0.00 0.00 64.05 61.23 3d43 n THR 176 Cb 0.00 0.67 -0.02 0.00 -2.10 0.00 0.00 70.33 68.88 3d43 n THR 176 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d43 n ILE 177 N -0.92 1.39 -3.77 2.28 3.06 -0.24 -4.65 119.36 116.50 3d43 n ILE 177 Ca 0.08 -0.35 -0.23 0.00 -2.50 0.00 0.00 62.75 59.75 3d43 n ILE 177 Cb 0.37 -1.19 0.01 0.00 0.54 0.00 0.00 39.64 39.36 3d43 n ILE 177 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3d43 n GLY 178 N 1.65 2.69 3.56 4.50 0.00 -0.40 -4.90 105.19 112.30 3d43 n GLY 178 Ca 0.11 -2.28 -0.31 0.00 0.00 0.00 0.00 46.02 43.54 3d43 n GLY 178 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d43 s TYR 179 N -2.46 2.78 -1.68 1.61 1.51 0.55 -0.37 117.35 119.28 3d43 s TYR 179 Ca 0.31 -0.12 0.31 0.00 -1.01 0.00 0.00 57.07 56.56 3d43 s TYR 179 Cb -0.02 -1.53 1.68 0.00 -0.11 0.00 0.00 41.96 41.98 3d43 s TYR 179 CO 0.20 0.36 2.13 -0.35 -1.11 0.00 0.00 175.55 176.77 3d43 n PRO 180 N 1.31 0.68 -0.33 -1.71 -0.04 -1.26 -1.69 135.00 131.96 3d43 n PRO 180 Ca -0.15 -0.01 0.07 0.00 -0.04 0.00 0.00 63.50 63.37 3d43 n PRO 180 Cb 0.52 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.72 3d43 n PRO 180 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3d43 h GLY 181 N 5.00 1.51 1.49 0.55 0.00 -1.68 -1.25 103.07 108.69 3d43 h GLY 181 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.99 3d43 h GLY 181 CO 0.00 0.06 0.00 0.00 0.00 0.00 0.00 176.54 176.60 3d43 n ALA 182 N -2.37 1.93 -1.77 3.60 0.00 0.50 -3.80 120.51 118.59 3d43 n ALA 182 Ca 0.18 -0.08 -0.38 0.00 0.00 0.00 0.00 53.44 53.16 3d43 n ALA 182 Cb 0.39 -1.26 -0.01 0.00 0.00 0.00 0.00 19.45 18.57 3d43 n ALA 182 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3d43 s LEU 183 N -2.49 4.12 0.42 0.00 1.43 -0.47 -1.21 118.68 120.48 3d43 s LEU 183 Ca 0.17 2.41 0.14 0.00 -1.03 0.00 0.00 54.13 55.82 3d43 s LEU 183 Cb 0.11 -4.08 1.01 0.00 0.03 0.00 0.00 46.19 43.25 3d43 s LEU 183 CO 0.24 -0.83 1.93 -0.65 0.23 0.00 0.00 176.35 177.27 3d43 h PRO 184 N 2.39 0.45 -0.34 1.29 0.11 -1.87 -2.20 132.00 131.84 3d43 h PRO 184 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3d43 h PRO 184 Cb 1.24 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3d43 h PRO 184 CO 0.61 0.29 0.00 0.09 -0.21 0.00 0.00 178.00 178.79 3d43 n ASN 185 N -4.48 2.15 -4.38 -2.05 3.02 -1.26 -4.84 115.26 103.41 3d43 n ASN 185 Ca 0.13 -1.91 -0.30 0.00 -0.03 0.00 0.00 54.58 52.48 3d43 n ASN 185 Cb 0.47 -0.22 -0.14 0.00 -0.61 0.00 0.00 39.78 39.28 3d43 n ASN 185 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3d43 s ALA 186 N -1.56 2.36 -0.45 5.41 0.00 -0.83 -4.49 121.76 122.21 3d43 s ALA 186 Ca 0.30 -1.25 -0.23 0.00 0.00 0.00 0.00 51.96 50.79 3d43 s ALA 186 Cb 0.16 -0.56 0.03 0.00 0.00 0.00 0.00 23.12 22.75 3d43 s ALA 186 CO 0.22 0.55 0.75 0.42 0.00 0.00 0.00 175.76 177.70 3d43 s ILE 187 N -0.85 4.69 -0.01 0.00 1.01 -0.10 -4.68 121.20 121.27 3d43 s ILE 187 Ca 0.13 0.35 -0.27 0.00 0.00 0.00 0.00 60.65 60.86 3d43 s ILE 187 Cb -0.10 -4.29 -0.04 0.00 0.01 0.00 0.00 42.46 38.04 3d43 s ILE 187 CO 0.03 -0.69 0.86 0.00 0.00 0.00 0.00 174.94 175.14 3d43 s ALA 188 N 3.18 3.25 -0.21 9.38 0.00 -1.25 -0.85 121.76 135.26 3d43 s ALA 188 Ca 0.28 0.37 -0.03 0.00 0.00 0.00 0.00 51.96 52.59 3d43 s ALA 188 Cb -0.13 -3.16 -0.00 0.00 0.00 0.00 0.00 23.12 19.83 3d43 s ALA 188 CO 0.22 -0.13 -0.08 0.08 0.00 0.00 0.00 175.76 175.85 3d43 s VAL 189 N 0.73 3.09 0.35 0.00 1.01 -0.40 -1.51 120.40 123.67 3d43 s VAL 189 Ca 0.45 -0.59 -0.09 0.00 0.00 0.00 0.00 61.98 61.75 3d43 s VAL 189 Cb -0.20 -2.39 -0.06 0.00 0.00 0.00 0.00 36.38 33.73 3d43 s VAL 189 CO 0.24 0.45 0.68 0.00 0.00 0.00 0.00 175.10 176.47 3d43 s ALA 190 N 1.39 3.46 -0.18 5.51 0.00 -0.34 -0.85 121.76 130.76 3d43 s ALA 190 Ca 0.05 -0.32 -0.14 0.00 0.00 0.00 0.00 51.96 51.55 3d43 s ALA 190 Cb -0.14 -2.55 -0.05 0.00 0.00 0.00 0.00 23.12 20.38 3d43 s ALA 190 CO -0.05 0.13 0.28 0.00 0.00 0.00 0.00 175.76 176.12 3d43 s ALA 191 N -2.22 3.59 0.16 0.00 0.00 -1.26 -1.39 121.76 120.65 3d43 s ALA 191 Ca 0.49 -0.52 -0.02 0.00 0.00 0.00 0.00 51.96 51.91 3d43 s ALA 191 Cb -0.10 -2.40 -0.05 0.00 0.00 0.00 0.00 23.12 20.57 3d43 s ALA 191 CO 0.29 0.02 0.36 -0.51 0.00 0.00 0.00 175.76 175.92 3d43 s LEU 192 N 0.62 4.26 0.31 0.00 1.43 0.30 -0.96 118.68 124.64 3d43 s LEU 192 Ca 0.15 0.44 0.09 0.00 -1.03 0.00 0.00 54.13 53.79 3d43 s LEU 192 Cb -0.13 -3.19 -0.05 0.00 0.03 0.00 0.00 46.19 42.86 3d43 s LEU 192 CO 0.04 0.02 0.04 -1.83 0.23 0.00 0.00 176.35 174.85 3d43 s GLU 193 N -2.97 2.24 -1.40 1.70 -1.05 -0.18 -0.81 118.70 116.24 3d43 s GLU 193 Ca 0.39 -1.56 -0.08 0.00 -0.15 0.00 0.00 54.97 53.56 3d43 s GLU 193 Cb -0.12 -2.09 0.07 0.00 -0.44 0.00 0.00 34.13 31.56 3d43 s GLU 193 CO 0.27 0.22 2.37 -1.71 0.95 0.00 0.00 175.26 177.36 3d43 n ASN 194 N -0.98 6.96 -3.86 0.83 5.15 -1.26 -3.96 115.26 118.13 3d43 n ASN 194 Ca -0.05 -2.97 -0.12 0.00 -0.60 0.00 0.00 54.58 50.85 3d43 n ASN 194 Cb 0.61 -1.47 -0.13 0.00 -0.53 0.00 0.00 39.78 38.26 3d43 n ASN 194 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3d43 s VAL 195 N 0.52 0.01 -0.12 3.44 1.01 -1.26 -5.07 120.40 118.93 3d43 s VAL 195 Ca 0.53 -0.12 -0.06 0.00 0.00 0.00 0.00 61.98 62.33 3d43 s VAL 195 Cb 0.16 -0.14 -0.04 0.00 0.00 0.00 0.00 36.38 36.35 3d43 s VAL 195 CO -0.06 -0.07 0.11 -1.10 0.00 0.00 0.00 175.10 173.99 3d43 s GLN 196 N -0.18 3.44 -0.10 2.72 -1.52 -1.26 -1.14 119.66 121.62 3d43 s GLN 196 Ca -0.02 -0.19 -0.08 0.00 -1.95 0.00 0.00 55.36 53.12 3d43 s GLN 196 Cb -0.02 -3.14 0.03 0.00 -0.22 0.00 0.00 33.01 29.66 3d43 s GLN 196 CO 0.00 0.72 0.25 -1.14 -0.25 0.00 0.00 175.29 174.87 3d43 s GLN 197 N -0.86 0.27 -1.36 2.91 0.74 0.10 -4.86 119.66 116.59 3d43 s GLN 197 Ca 0.14 0.39 -0.03 0.00 0.05 0.00 0.00 55.36 55.92 3d43 s GLN 197 Cb -0.12 0.07 0.01 0.00 1.10 0.00 0.00 33.01 34.08 3d43 s GLN 197 CO 0.03 -0.07 0.21 0.09 -0.55 0.00 0.00 175.29 175.01 3d43 n ASN 198 N 3.29 -4.77 0.00 6.67 5.03 -1.26 -2.11 115.26 122.11 3d43 n ASN 198 Ca -0.16 -0.06 0.00 0.00 0.87 0.00 0.00 54.58 55.23 3d43 n ASN 198 Cb 0.57 -3.96 0.00 0.00 -1.02 0.00 0.00 39.78 35.37 3d43 n ASN 198 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3d43 n GLY 199 N -1.07 0.64 3.28 7.41 0.00 -1.26 -4.81 105.19 109.39 3d43 n GLY 199 Ca -0.14 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.73 3d43 n GLY 199 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3d43 s THR 200 N -2.52 0.32 0.70 2.61 -4.23 -0.90 -5.04 115.64 106.58 3d43 s THR 200 Ca 0.00 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.35 3d43 s THR 200 Cb 0.00 -2.57 0.01 0.00 1.34 0.00 0.00 72.50 71.28 3d43 s THR 200 CO 0.00 0.00 1.07 -1.22 -0.54 0.00 0.00 174.62 173.93 3d43 n TYR 201 N -0.42 1.06 -3.88 3.99 4.02 -1.26 -0.72 117.16 119.94 3d43 n TYR 201 Ca 0.01 0.41 -0.35 0.00 -0.01 0.00 0.00 57.90 57.95 3d43 n TYR 201 Cb 0.66 -2.13 -0.08 0.00 -0.02 0.00 0.00 39.34 37.76 3d43 n TYR 201 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 3d43 s ARG 202 N -3.37 3.93 0.23 -0.72 3.52 -0.30 -3.68 118.95 118.56 3d43 s ARG 202 Ca 0.76 -0.25 -0.30 0.00 -0.13 0.00 0.00 55.73 55.81 3d43 s ARG 202 Cb -0.35 -3.28 -0.09 0.00 -1.56 0.00 0.00 34.95 29.66 3d43 s ARG 202 CO 0.47 0.40 1.38 0.08 -0.81 0.00 0.00 175.30 176.82 3d43 s VAL 203 N 0.05 2.91 0.42 7.11 1.01 -0.22 -1.01 120.40 130.68 3d43 s VAL 203 Ca 0.08 0.76 -0.25 0.00 0.00 0.00 0.00 61.98 62.56 3d43 s VAL 203 Cb -0.12 -3.48 -0.08 0.00 0.00 0.00 0.00 36.38 32.70 3d43 s VAL 203 CO -0.00 0.12 1.30 0.00 0.00 0.00 0.00 175.10 176.52 3d43 s ALA 204 N 0.05 3.20 0.35 5.51 0.00 -0.14 -4.55 121.76 126.18 3d43 s ALA 204 Ca 0.58 1.22 0.06 0.00 0.00 0.00 0.00 51.96 53.82 3d43 s ALA 204 Cb -0.39 -3.49 0.73 0.00 0.00 0.00 0.00 23.12 19.97 3d43 s ALA 204 CO 0.41 -0.87 1.92 -0.44 0.00 0.00 0.00 175.76 176.77 3d43 h ASP 205 N 2.50 0.71 0.99 0.00 3.32 -1.93 -1.96 116.42 120.04 3d43 h ASP 205 Ca -0.50 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 56.57 3d43 h ASP 205 Cb 1.25 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.67 3d43 h ASP 205 CO 0.62 0.42 -0.01 0.10 -1.72 0.00 0.00 179.24 178.65 3d43 h TYR 206 N 0.79 0.00 -2.93 4.55 -0.00 -1.89 -2.63 116.97 114.86 3d43 h TYR 206 Ca 0.38 0.00 -0.53 0.00 0.00 0.00 0.00 58.73 58.58 3d43 h TYR 206 Cb 0.42 0.00 0.04 0.00 0.00 0.00 0.00 36.73 37.19 3d43 h TYR 206 CO -0.00 0.01 0.84 0.45 -0.00 0.00 0.00 178.16 179.46 3d43 s SER 207 N -5.71 6.63 0.40 0.10 0.15 -0.74 -0.63 113.70 113.90 3d43 s SER 207 Ca 0.01 2.58 -0.26 0.00 0.70 0.00 0.00 55.95 58.98 3d43 s SER 207 Cb 0.09 -2.60 -0.09 0.00 -1.71 0.00 0.00 66.02 61.72 3d43 s SER 207 CO 0.55 -0.78 1.25 -0.44 1.20 0.00 0.00 173.24 175.02 3d43 s SER 208 N 1.03 6.42 -0.02 5.45 0.01 0.25 -3.64 113.70 123.20 3d43 s SER 208 Ca 0.68 2.54 -0.02 0.00 1.31 0.00 0.00 55.95 60.46 3d43 s SER 208 Cb -0.42 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.14 3d43 s SER 208 CO 0.33 -0.76 0.13 -0.13 0.41 0.00 0.00 173.24 173.21 3d43 s ARG 209 N -2.22 3.27 0.00 12.44 3.00 -1.26 -4.61 118.95 129.56 3d43 s ARG 209 Ca 0.56 -0.37 0.00 0.00 0.00 0.00 0.00 55.73 55.92 3d43 s ARG 209 Cb -0.36 -3.00 0.00 0.00 0.00 0.00 0.00 34.95 31.60 3d43 s ARG 209 CO 0.45 0.68 0.00 0.41 0.00 0.00 0.00 175.30 176.84 3d43 n GLY 210 N 1.19 0.57 3.32 -3.53 0.00 0.21 -0.93 105.19 106.03 3d43 n GLY 210 Ca -0.13 -1.46 -0.31 0.00 0.00 0.00 0.00 46.02 44.12 3d43 n GLY 210 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d43 s TYR 211 N 0.00 2.37 0.23 1.61 1.51 -1.24 -0.64 117.35 121.18 3d43 s TYR 211 Ca 0.00 -0.42 -0.07 0.00 -1.01 0.00 0.00 57.07 55.56 3d43 s TYR 211 Cb 0.00 -1.52 0.28 0.00 -0.11 0.00 0.00 41.96 40.61 3d43 s TYR 211 CO 0.00 -0.02 1.84 0.82 -1.11 0.00 0.00 175.55 177.08 3d43 h ILE 212 N 4.50 1.04 -0.82 2.71 2.04 -1.97 -3.00 117.51 122.01 3d43 h ILE 212 Ca -0.43 -0.30 0.11 0.00 1.00 0.00 0.00 64.86 65.24 3d43 h ILE 212 Cb 1.13 0.08 -0.06 0.00 -0.74 0.00 0.00 36.82 37.23 3d43 h ILE 212 CO 0.47 0.16 0.53 -1.28 0.00 0.00 0.00 178.15 178.04 3d43 h SER 213 N 0.88 0.64 -0.09 1.72 0.87 -2.01 -2.54 113.55 113.01 3d43 h SER 213 Ca 0.33 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.92 3d43 h SER 213 Cb 0.14 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 3d43 h SER 213 CO -0.16 0.36 0.00 0.35 -0.53 0.00 0.00 176.83 176.85 3d43 n THR 214 N -4.52 0.43 -3.76 2.23 -2.24 -1.22 -4.99 114.28 100.20 3d43 n THR 214 Ca 0.15 -0.71 -0.37 0.00 -2.27 0.00 0.00 64.05 60.84 3d43 n THR 214 Cb 0.38 0.87 -0.06 0.00 -2.10 0.00 0.00 70.33 69.42 3d43 n THR 214 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d43 s ALA 215 N -0.75 3.81 0.00 6.98 0.00 -0.96 -4.45 121.76 126.40 3d43 s ALA 215 Ca 0.10 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.54 3d43 s ALA 215 Cb 0.06 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 21.08 3d43 s ALA 215 CO 0.09 0.54 0.00 0.41 0.00 0.00 0.00 175.76 176.80 3d43 n GLY 216 N 2.05 1.46 0.48 0.00 0.00 -1.18 -4.91 105.19 103.09 3d43 n GLY 216 Ca -0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.97 3d43 n GLY 216 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3d43 n ASP 217 N 0.00 1.70 -3.26 1.61 3.85 -1.26 -4.61 116.55 114.58 3d43 n ASP 217 Ca 0.00 -1.37 -0.23 0.00 -0.71 0.00 0.00 54.79 52.48 3d43 n ASP 217 Cb 0.00 0.17 0.02 0.00 -1.35 0.00 0.00 41.12 39.96 3d43 n ASP 217 CO 0.00 0.00 0.00 -1.22 -1.01 0.00 0.00 177.20 174.97 3d43 n TYR 218 N 0.02 -1.93 -4.07 2.11 4.02 -1.26 -4.98 117.16 111.06 3d43 n TYR 218 Ca 0.13 0.54 -0.20 0.00 -0.01 0.00 0.00 57.90 58.36 3d43 n TYR 218 Cb 0.42 -3.73 -0.16 0.00 -0.02 0.00 0.00 39.34 35.85 3d43 n TYR 218 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 3d43 s VAL 219 N -3.07 0.46 -0.29 -0.72 1.01 -1.26 -5.12 120.40 111.40 3d43 s VAL 219 Ca 0.38 -0.06 -0.24 0.00 0.00 0.00 0.00 61.98 62.07 3d43 s VAL 219 Cb -0.19 -0.51 0.00 0.00 0.00 0.00 0.00 36.38 35.68 3d43 s VAL 219 CO 0.47 0.22 0.82 -0.63 0.00 0.00 0.00 175.10 175.98 3d43 s ILE 220 N 1.08 4.78 0.46 2.22 -1.09 -1.26 -4.98 121.20 122.41 3d43 s ILE 220 Ca -0.09 1.34 0.08 0.00 -2.23 0.00 0.00 60.65 59.74 3d43 s ILE 220 Cb -0.14 -4.16 0.00 0.00 -1.58 0.00 0.00 42.46 36.58 3d43 s ILE 220 CO -0.01 -0.22 0.44 -1.10 -1.23 0.00 0.00 174.94 172.82 3d43 s GLN 221 N 2.99 2.48 0.22 2.79 1.11 -1.26 -4.91 119.66 123.07 3d43 s GLN 221 Ca 0.34 -1.61 -0.32 0.00 0.01 0.00 0.00 55.36 53.78 3d43 s GLN 221 Cb -0.14 -2.38 -0.13 0.00 -1.01 0.00 0.00 33.01 29.34 3d43 s GLN 221 CO 0.11 -0.35 1.51 -1.91 0.01 0.00 0.00 175.29 174.66 3d43 n GLU 222 N -1.68 2.19 -0.18 2.91 2.13 -1.26 -2.20 120.64 122.55 3d43 n GLU 222 Ca 0.04 0.79 0.00 0.00 0.66 0.00 0.00 57.16 58.65 3d43 n GLU 222 Cb 0.62 -2.51 0.00 0.00 0.27 0.00 0.00 31.44 29.82 3d43 n GLU 222 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3d43 n GLY 223 N 2.70 0.73 3.78 8.31 0.00 -0.35 -5.00 105.19 115.36 3d43 n GLY 223 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 3d43 n GLY 223 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3d43 s ASP 224 N -2.84 6.80 0.54 1.61 -0.00 -0.94 -3.68 116.67 118.16 3d43 s ASP 224 Ca 0.00 0.95 -0.19 0.00 -0.00 0.00 0.00 52.55 53.31 3d43 s ASP 224 Cb 0.00 -2.29 -0.06 0.00 -0.00 0.00 0.00 42.92 40.57 3d43 s ASP 224 CO 0.00 0.17 1.11 -0.63 -0.00 0.00 0.00 175.17 175.82 3d43 s ILE 225 N -0.33 3.32 0.04 0.77 -1.09 -1.26 -4.59 121.20 118.07 3d43 s ILE 225 Ca 0.26 0.81 0.00 0.00 -2.23 0.00 0.00 60.65 59.48 3d43 s ILE 225 Cb -0.16 -3.32 0.00 0.00 -1.58 0.00 0.00 42.46 37.40 3d43 s ILE 225 CO 0.13 -0.19 0.00 1.21 -1.23 0.00 0.00 174.94 174.86 3d43 n GLU 226 N -1.30 0.00 -4.60 2.79 2.13 -0.57 -4.18 120.64 114.91 3d43 n GLU 226 Ca 0.11 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.61 3d43 n GLU 226 Cb 0.51 -0.17 -0.12 0.00 0.27 0.00 0.00 31.44 31.93 3d43 n GLU 226 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3d43 s ILE 227 N -1.38 3.26 0.06 6.31 -1.09 -0.94 -0.09 121.20 127.34 3d43 s ILE 227 Ca 0.00 -0.90 0.02 0.00 -2.23 0.00 0.00 60.65 57.53 3d43 s ILE 227 Cb 0.00 -2.38 -0.04 0.00 -1.58 0.00 0.00 42.46 38.46 3d43 s ILE 227 CO 0.00 0.41 0.10 -0.44 -1.23 0.00 0.00 174.94 173.78 3d43 s SER 228 N -1.31 5.71 0.17 3.58 0.01 0.05 -1.19 113.70 120.73 3d43 s SER 228 Ca 0.15 0.07 -0.19 0.00 1.31 0.00 0.00 55.95 57.29 3d43 s SER 228 Cb -0.11 -1.60 0.04 0.00 0.21 0.00 0.00 66.02 64.57 3d43 s SER 228 CO 0.06 0.19 0.54 0.00 0.41 0.00 0.00 173.24 174.43 3d43 s ALA 229 N -1.38 -1.19 0.03 1.44 0.00 -0.49 -4.01 121.76 116.17 3d43 s ALA 229 Ca 0.29 0.06 -0.35 0.00 0.00 0.00 0.00 51.96 51.97 3d43 s ALA 229 Cb -0.12 0.83 -0.13 0.00 0.00 0.00 0.00 23.12 23.69 3d43 s ALA 229 CO 0.22 -0.77 1.68 -2.30 0.00 0.00 0.00 175.76 174.59 3d43 n PRO 230 N -0.34 2.02 0.00 0.00 -0.02 -1.26 -0.54 135.00 134.86 3d43 n PRO 230 Ca -0.13 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 3d43 n PRO 230 Cb 0.63 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 3d43 n PRO 230 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d43 n GLY 231 N 3.76 0.00 3.78 -1.23 0.00 0.01 -3.03 105.19 108.48 3d43 n GLY 231 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 3d43 n GLY 231 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d43 s SER 232 N -1.01 6.74 -1.08 1.61 0.01 -0.96 -0.96 113.70 118.06 3d43 s SER 232 Ca 0.00 0.88 -0.05 0.00 1.31 0.00 0.00 55.95 58.09 3d43 s SER 232 Cb 0.00 -2.27 -0.06 0.00 0.21 0.00 0.00 66.02 63.91 3d43 s SER 232 CO 0.00 0.16 0.93 -0.24 0.41 0.00 0.00 173.24 174.50 3d43 n SER 233 N 2.76 -5.83 -4.48 2.44 2.88 -1.24 -4.71 113.62 105.44 3d43 n SER 233 Ca -0.11 -0.70 -0.37 0.00 -1.33 0.00 0.00 58.87 56.36 3d43 n SER 233 Cb 0.52 -5.17 -0.12 0.00 -0.75 0.00 0.00 64.21 58.68 3d43 n SER 233 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3d43 s VAL 234 N -3.39 4.66 -0.07 2.46 1.01 -0.59 -4.91 120.40 119.57 3d43 s VAL 234 Ca 0.38 -0.15 -0.26 0.00 0.00 0.00 0.00 61.98 61.95 3d43 s VAL 234 Cb -0.05 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 33.05 3d43 s VAL 234 CO 0.74 0.24 0.81 -0.47 0.00 0.00 0.00 175.10 176.42 3d43 s TYR 235 N 1.65 3.57 0.39 5.22 5.04 -1.26 -2.19 117.35 129.77 3d43 s TYR 235 Ca 0.06 1.38 -0.13 0.00 -2.44 0.00 0.00 57.07 55.95 3d43 s TYR 235 Cb -0.16 -2.94 0.05 0.00 0.35 0.00 0.00 41.96 39.26 3d43 s TYR 235 CO 0.06 -0.00 0.74 0.45 -1.34 0.00 0.00 175.55 175.45 3d43 s SER 236 N 0.93 0.22 0.65 4.32 0.15 -0.31 -4.85 113.70 114.81 3d43 s SER 236 Ca 0.42 -1.25 -0.17 0.00 0.70 0.00 0.00 55.95 55.64 3d43 s SER 236 Cb -0.18 0.83 -0.01 0.00 -1.71 0.00 0.00 66.02 64.95 3d43 s SER 236 CO 0.20 -1.64 1.24 0.42 1.20 0.00 0.00 173.24 174.65 3d43 s THR 237 N -2.34 2.35 0.17 6.45 -4.23 -1.26 -0.91 115.64 115.87 3d43 s THR 237 Ca 0.19 0.20 0.05 0.00 -1.18 0.00 0.00 61.69 60.95 3d43 s THR 237 Cb -0.04 -2.99 -0.05 0.00 1.34 0.00 0.00 72.50 70.77 3d43 s THR 237 CO 0.14 -0.06 -0.09 0.86 -0.54 0.00 0.00 174.62 174.93 3d43 s TRP 238 N -1.64 1.39 0.17 3.99 -0.00 -0.58 -2.29 118.94 119.98 3d43 s TRP 238 Ca 0.78 -0.77 0.22 0.00 -0.00 0.00 0.00 56.10 56.34 3d43 s TRP 238 Cb -0.32 -0.72 0.88 0.00 -0.00 0.00 0.00 33.47 33.31 3d43 s TRP 238 CO 0.39 0.10 1.82 0.10 -0.00 0.00 0.00 176.95 179.35 3d43 h TYR 239 N 2.69 0.00 -0.33 5.86 -0.00 -1.88 -2.43 116.97 120.88 3d43 h TYR 239 Ca -0.37 0.00 -0.06 0.00 0.00 0.00 0.00 58.73 58.30 3d43 h TYR 239 Cb 1.20 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.90 3d43 h TYR 239 CO 0.64 0.27 0.01 0.27 -0.00 0.00 0.00 178.16 179.35 3d43 n ASN 240 N -3.47 3.74 0.00 0.10 6.94 -1.26 -4.60 115.26 116.70 3d43 n ASN 240 Ca -0.00 -3.18 0.00 0.00 -0.02 0.00 0.00 54.58 51.38 3d43 n ASN 240 Cb 0.44 -0.58 0.00 0.00 -2.36 0.00 0.00 39.78 37.27 3d43 n ASN 240 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3d43 n GLY 241 N -0.58 1.99 7.00 4.83 0.00 -0.91 -5.06 105.19 112.46 3d43 n GLY 241 Ca 0.26 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.30 3d43 n GLY 241 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d43 n GLY 242 N 1.34 1.55 3.22 -0.02 0.00 -1.26 -4.38 105.19 105.64 3d43 n GLY 242 Ca 0.00 -0.48 -0.09 0.00 0.00 0.00 0.00 46.02 45.45 3d43 n GLY 242 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d43 s TYR 243 N 0.00 0.56 0.21 1.61 1.51 -1.26 -1.53 117.35 118.46 3d43 s TYR 243 Ca 0.00 -0.96 -0.18 0.00 -1.01 0.00 0.00 57.07 54.92 3d43 s TYR 243 Cb 0.00 -0.26 0.03 0.00 -0.11 0.00 0.00 41.96 41.61 3d43 s TYR 243 CO 0.00 -0.58 0.56 1.21 -1.11 0.00 0.00 175.55 175.63 3d43 s ASN 244 N -2.98 -0.26 -0.18 2.29 2.47 -0.09 -4.76 114.94 111.43 3d43 s ASN 244 Ca 0.17 -0.52 0.01 0.00 0.42 0.00 0.00 52.86 52.93 3d43 s ASN 244 Cb 0.06 0.61 0.02 0.00 -1.45 0.00 0.00 41.25 40.48 3d43 s ASN 244 CO -0.02 -1.11 -0.18 -0.89 -3.72 0.00 0.00 177.10 171.18 3d43 s THR 245 N -3.89 2.21 0.20 -5.21 2.01 -1.26 -1.16 115.64 108.54 3d43 s THR 245 Ca 0.11 -0.89 0.00 0.00 0.31 0.00 0.00 61.69 61.22 3d43 s THR 245 Cb -0.02 -1.93 -0.04 0.00 0.01 0.00 0.00 72.50 70.51 3d43 s THR 245 CO -0.00 0.53 0.09 0.27 -0.69 0.00 0.00 174.62 174.81 3d43 s ILE 246 N 1.27 0.32 0.08 1.82 -4.36 -0.93 -4.89 121.20 114.51 3d43 s ILE 246 Ca 0.04 -1.98 0.05 0.00 -0.26 0.00 0.00 60.65 58.50 3d43 s ILE 246 Cb -0.13 -2.41 -0.03 0.00 1.25 0.00 0.00 42.46 41.14 3d43 s ILE 246 CO -0.11 -0.16 -0.14 -0.44 0.24 0.00 0.00 174.94 174.33 3d43 s SER 247 N -3.19 1.74 0.00 4.36 0.01 -1.26 -1.54 113.70 113.81 3d43 s SER 247 Ca 0.34 -0.67 0.00 0.00 1.31 0.00 0.00 55.95 56.92 3d43 s SER 247 Cb 0.07 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.25 3d43 s SER 247 CO 0.09 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.25 3d43 n GLY 248 N 1.06 2.45 0.31 3.44 0.00 -0.13 -4.84 105.19 107.47 3d43 n GLY 248 Ca -0.20 -1.37 0.21 0.00 0.00 0.00 0.00 46.02 44.66 3d43 n GLY 248 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3d43 h THR 249 N 1.16 0.00 -0.47 2.61 1.35 -1.84 -1.32 112.91 114.40 3d43 h THR 249 Ca 0.00 -0.12 0.04 0.00 -0.55 0.00 0.00 66.41 65.77 3d43 h THR 249 Cb 0.00 1.08 -0.03 0.00 -1.73 0.00 0.00 68.15 67.48 3d43 h THR 249 CO 0.00 0.00 0.31 0.28 -0.25 0.00 0.00 175.52 175.86 3d43 h SER 250 N 0.00 0.43 0.74 5.36 0.02 -1.88 -1.66 113.55 116.56 3d43 h SER 250 Ca 0.00 -0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.69 3d43 h SER 250 Cb 0.13 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.53 3d43 h SER 250 CO 0.00 0.29 -1.35 0.24 -1.14 0.00 0.00 176.83 174.87 3d43 h MET 251 N 0.50 0.01 -0.35 3.45 2.86 -1.51 -3.34 114.93 116.54 3d43 h MET 251 Ca 0.19 -0.02 -0.13 0.00 -2.06 0.00 0.00 59.70 57.69 3d43 h MET 251 Cb 0.14 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 3d43 h MET 251 CO -0.05 0.77 -0.28 0.00 1.06 0.00 0.00 176.91 178.42 3d43 h ALA 252 N 0.98 0.50 -0.33 6.32 0.00 -1.23 -3.32 119.26 122.18 3d43 h ALA 252 Ca -0.15 -0.40 0.07 0.00 0.00 0.00 0.00 54.91 54.43 3d43 h ALA 252 Cb 1.89 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 19.51 3d43 h ALA 252 CO 0.11 0.52 -0.08 1.15 0.00 0.00 0.00 179.25 180.95 3d43 h THR 253 N 0.58 0.68 0.00 0.00 2.02 -1.43 -1.51 112.91 113.24 3d43 h THR 253 Ca 0.06 -0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.24 3d43 h THR 253 Cb 0.85 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 3d43 h THR 253 CO 0.07 0.00 -0.02 1.55 0.37 0.00 0.00 175.52 177.49 3d43 h PRO 254 N 0.01 0.00 -0.64 6.66 0.13 -1.73 -0.36 132.00 136.07 3d43 h PRO 254 Ca 0.16 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.30 3d43 h PRO 254 Cb 0.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.34 3d43 h PRO 254 CO -0.33 0.02 0.42 0.45 -0.23 0.00 0.00 178.00 178.33 3d43 h HIS 255 N 0.00 0.79 -0.09 1.56 3.86 -1.38 -0.16 115.15 119.73 3d43 h HIS 255 Ca -0.00 0.02 -0.11 0.00 -1.16 0.00 0.00 60.37 59.12 3d43 h HIS 255 Cb 0.55 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.76 3d43 h HIS 255 CO 0.00 0.49 -0.36 0.28 0.86 0.00 0.00 177.93 179.20 3d43 h VAL 256 N 0.85 1.40 -0.83 2.45 2.07 -1.07 -0.48 116.25 120.64 3d43 h VAL 256 Ca 0.24 -1.72 0.04 0.00 0.82 0.00 0.00 66.70 66.08 3d43 h VAL 256 Cb -0.07 2.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.89 3d43 h VAL 256 CO -0.06 0.50 0.53 0.28 0.02 0.00 0.00 177.57 178.84 3d43 h SER 257 N -0.06 0.88 -0.41 0.57 0.02 -1.11 0.95 113.55 114.39 3d43 h SER 257 Ca -0.02 -0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.89 3d43 h SER 257 Cb 1.00 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.33 3d43 h SER 257 CO 0.07 0.60 0.11 1.23 -1.14 0.00 0.00 176.83 177.71 3d43 h GLY 258 N 1.03 0.69 0.79 -3.77 0.00 -1.03 -0.89 103.07 99.89 3d43 h GLY 258 Ca 0.34 -0.42 0.04 0.00 0.00 0.00 0.00 47.33 47.28 3d43 h GLY 258 CO -0.12 0.39 0.30 -2.00 0.00 0.00 0.00 176.54 175.11 3d43 h LEU 259 N 0.51 0.45 -0.96 3.11 5.85 -0.72 -0.35 115.31 123.21 3d43 h LEU 259 Ca 0.13 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.90 3d43 h LEU 259 Cb 0.29 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 3d43 h LEU 259 CO -0.00 0.31 0.63 0.00 -0.34 0.00 0.00 178.44 179.04 3d43 h ALA 260 N 1.26 1.26 -0.61 1.25 0.00 -0.60 -0.17 119.26 121.67 3d43 h ALA 260 Ca 0.23 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 3d43 h ALA 260 Cb 0.09 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3d43 h ALA 260 CO -0.13 0.53 0.04 0.00 0.00 0.00 0.00 179.25 179.69 3d43 h ALA 261 N 1.39 0.93 -0.43 0.00 0.00 -0.55 0.54 119.26 121.14 3d43 h ALA 261 Ca 0.38 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3d43 h ALA 261 Cb -0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3d43 h ALA 261 CO -0.12 0.65 0.19 -0.22 0.00 0.00 0.00 179.25 179.76 3d43 h LYS 262 N 0.95 0.63 -0.43 0.00 3.64 -0.44 -0.70 116.57 120.22 3d43 h LYS 262 Ca 0.18 -0.10 -0.06 0.00 -1.27 0.00 0.00 60.65 59.40 3d43 h LYS 262 Cb 0.49 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 3d43 h LYS 262 CO 0.02 0.56 0.04 0.82 -2.27 0.00 0.00 179.45 178.62 3d43 h ILE 263 N 0.55 1.25 -0.29 2.00 2.04 -0.85 -1.96 117.51 120.25 3d43 h ILE 263 Ca 0.15 -0.95 -0.06 0.00 1.00 0.00 0.00 64.86 64.99 3d43 h ILE 263 Cb 0.15 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 3d43 h ILE 263 CO -0.02 0.33 -0.09 -0.25 0.00 0.00 0.00 178.15 178.12 3d43 h TRP 264 N 0.58 0.50 -0.05 1.37 2.91 -0.75 -0.91 115.95 119.60 3d43 h TRP 264 Ca 0.13 -0.07 -0.16 0.00 1.13 0.00 0.00 58.89 59.92 3d43 h TRP 264 Cb 0.43 -0.14 -0.01 0.00 -0.51 0.00 0.00 29.16 28.93 3d43 h TRP 264 CO 0.03 0.56 -0.67 0.00 -1.03 0.00 0.00 178.44 177.33 3d43 h ALA 265 N 1.46 0.77 -0.14 2.65 0.00 -0.98 -0.70 119.26 122.33 3d43 h ALA 265 Ca 0.09 -0.59 -0.09 0.00 0.00 0.00 0.00 54.91 54.32 3d43 h ALA 265 Cb 0.44 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3d43 h ALA 265 CO 0.02 0.78 -0.32 0.93 0.00 0.00 0.00 179.25 180.66 3d43 h GLU 266 N 0.15 0.27 -2.12 0.00 5.08 -0.75 -3.37 114.58 113.84 3d43 h GLU 266 Ca -0.02 -0.11 -0.55 0.00 -1.00 0.00 0.00 59.36 57.68 3d43 h GLU 266 Cb 1.21 -0.01 -0.41 0.00 0.50 0.00 0.00 28.75 30.04 3d43 h GLU 266 CO 0.10 0.57 -0.90 0.09 -1.00 0.00 0.00 179.01 177.87 3d43 n ASN 267 N -4.10 2.27 0.00 1.42 5.03 -0.40 -5.00 115.26 114.48 3d43 n ASN 267 Ca -0.01 -3.21 0.12 0.00 0.87 0.00 0.00 54.58 52.35 3d43 n ASN 267 Cb 0.42 -0.62 0.64 0.00 -1.02 0.00 0.00 39.78 39.20 3d43 n ASN 267 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 3d43 n PRO 268 N 0.52 0.51 0.00 3.52 -0.04 -0.31 -2.89 135.00 136.31 3d43 n PRO 268 Ca 0.27 0.04 0.14 0.00 -0.04 0.00 0.00 63.50 63.90 3d43 n PRO 268 Cb 0.51 -1.50 0.52 0.00 -0.04 0.00 0.00 33.50 32.99 3d43 n PRO 268 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3d43 n SER 269 N -1.17 0.89 -4.77 3.54 3.41 -1.26 -4.93 113.62 109.32 3d43 n SER 269 Ca 0.14 -0.93 -0.40 0.00 -0.26 0.00 0.00 58.87 57.42 3d43 n SER 269 Cb 0.14 0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.11 3d43 n SER 269 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3d43 s LEU 270 N -2.35 4.31 0.93 1.04 1.43 -1.14 -5.02 118.68 117.88 3d43 s LEU 270 Ca 0.30 2.74 -0.12 0.00 -1.03 0.00 0.00 54.13 56.02 3d43 s LEU 270 Cb 0.20 -3.76 0.15 0.00 0.03 0.00 0.00 46.19 42.80 3d43 s LEU 270 CO 0.45 -0.74 1.10 -0.94 0.23 0.00 0.00 176.35 176.46 3d43 s SER 271 N -0.53 3.26 0.29 2.29 1.04 -1.26 -4.82 113.70 113.97 3d43 s SER 271 Ca 0.53 1.24 -0.02 0.00 0.48 0.00 0.00 55.95 58.19 3d43 s SER 271 Cb -0.40 -1.91 0.43 0.00 0.10 0.00 0.00 66.02 64.24 3d43 s SER 271 CO 0.53 -2.74 1.93 -0.55 0.98 0.00 0.00 173.24 173.39 3d43 h ASN 272 N -1.62 0.99 -0.54 7.02 -1.07 -1.92 -0.11 115.58 118.32 3d43 h ASN 272 Ca -0.51 -0.01 -0.09 0.00 0.07 0.00 0.00 56.30 55.76 3d43 h ASN 272 Cb 1.31 -0.23 -0.02 0.00 -2.07 0.00 0.00 38.32 37.31 3d43 h ASN 272 CO 0.58 0.68 0.00 0.71 0.07 0.00 0.00 177.43 179.47 3d43 h THR 273 N 1.15 1.26 -0.47 6.14 1.35 -1.93 -0.94 112.91 119.47 3d43 h THR 273 Ca 0.36 -1.11 -0.08 0.00 -0.55 0.00 0.00 66.41 65.03 3d43 h THR 273 Cb 0.02 0.90 -0.02 0.00 -1.73 0.00 0.00 68.15 67.32 3d43 h THR 273 CO -0.11 0.39 -0.03 1.56 -0.25 0.00 0.00 175.52 177.08 3d43 h GLN 274 N 0.83 0.85 -0.87 4.72 4.20 -1.82 -1.06 115.11 121.96 3d43 h GLN 274 Ca 0.15 -0.29 0.03 0.00 0.06 0.00 0.00 58.65 58.61 3d43 h GLN 274 Cb 0.53 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.19 3d43 h GLN 274 CO 0.03 0.91 0.56 1.25 -0.67 0.00 0.00 178.83 180.91 3d43 h LEU 275 N 0.70 0.93 -0.99 1.46 5.85 -0.82 -0.49 115.31 121.96 3d43 h LEU 275 Ca 0.13 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 3d43 h LEU 275 Cb 0.55 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 3d43 h LEU 275 CO 0.03 0.64 0.21 -0.09 -0.34 0.00 0.00 178.44 178.90 3d43 h ARG 276 N 1.09 0.95 -0.48 1.25 2.43 -0.92 -0.48 114.38 118.22 3d43 h ARG 276 Ca 0.34 -0.17 -0.11 0.00 -0.81 0.00 0.00 59.98 59.23 3d43 h ARG 276 Cb -0.00 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 3d43 h ARG 276 CO -0.11 0.80 -0.16 1.03 -1.51 0.00 0.00 179.97 180.02 3d43 h SER 277 N 0.92 0.93 0.21 -3.80 0.87 -0.72 0.81 113.55 112.77 3d43 h SER 277 Ca 0.21 -0.32 0.01 0.00 -1.23 0.00 0.00 61.79 60.46 3d43 h SER 277 Cb 0.24 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.92 3d43 h SER 277 CO -0.01 1.07 -0.26 -1.13 -0.53 0.00 0.00 176.83 175.97 3d43 h ASN 278 N 0.81 -0.72 -0.77 6.23 -0.73 -0.16 -0.31 115.58 119.93 3d43 h ASN 278 Ca 0.12 0.07 0.08 0.00 1.87 0.00 0.00 56.30 58.44 3d43 h ASN 278 Cb 0.70 0.26 -0.06 0.00 0.27 0.00 0.00 38.32 39.48 3d43 h ASN 278 CO 0.05 -0.37 0.44 0.25 -0.37 0.00 0.00 177.43 177.43 3d43 h LEU 279 N -0.53 0.64 -0.78 0.34 5.85 -0.98 -0.11 115.31 119.74 3d43 h LEU 279 Ca 0.01 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 3d43 h LEU 279 Cb 0.51 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.41 3d43 h LEU 279 CO -0.09 0.39 0.48 1.56 -0.34 0.00 0.00 178.44 180.44 3d43 h GLN 280 N 0.77 1.05 -0.44 1.25 4.20 -0.51 -0.82 115.11 120.61 3d43 h GLN 280 Ca 0.35 -0.09 -0.13 0.00 0.06 0.00 0.00 58.65 58.84 3d43 h GLN 280 Cb 0.26 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 3d43 h GLN 280 CO -0.21 0.74 -0.26 0.93 -0.67 0.00 0.00 178.83 179.35 3d43 h GLU 281 N 1.06 0.93 -0.24 1.46 4.39 0.20 -0.18 114.58 122.20 3d43 h GLU 281 Ca 0.28 -0.41 0.05 0.00 0.34 0.00 0.00 59.36 59.61 3d43 h GLU 281 Cb -0.05 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.53 3d43 h GLU 281 CO -0.05 1.07 -0.05 0.00 -1.16 0.00 0.00 179.01 178.81 3d43 h ARG 282 N 0.79 0.01 -0.46 2.33 2.47 -0.81 -2.11 114.38 116.60 3d43 h ARG 282 Ca 0.09 -0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.80 3d43 h ARG 282 Cb 0.83 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.12 3d43 h ARG 282 CO 0.07 0.00 0.22 0.00 0.56 0.00 0.00 179.97 180.82 3d43 h ALA 283 N 1.23 0.59 -0.54 0.04 0.00 -0.91 -2.55 119.26 117.13 3d43 h ALA 283 Ca 0.11 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.97 3d43 h ALA 283 Cb 0.17 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3d43 h ALA 283 CO -0.24 0.16 0.36 -0.22 0.00 0.00 0.00 179.25 179.31 3d43 h LYS 284 N 0.60 0.45 0.00 0.00 3.64 -0.73 -0.97 116.57 119.55 3d43 h LYS 284 Ca 0.16 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3d43 h LYS 284 Cb 0.13 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3d43 h LYS 284 CO -0.02 0.30 0.00 -1.13 -2.27 0.00 0.00 179.45 176.33 3d43 n SER 285 N -4.47 0.00 -3.67 4.20 3.41 -0.82 -3.93 113.62 108.34 3d43 n SER 285 Ca 0.08 0.08 -0.28 0.00 -0.26 0.00 0.00 58.87 58.48 3d43 n SER 285 Cb 0.26 -0.33 -0.11 0.00 -0.26 0.00 0.00 64.21 63.77 3d43 n SER 285 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3d43 s VAL 286 N -2.66 1.66 0.06 -3.33 1.01 -0.37 -5.07 120.40 111.70 3d43 s VAL 286 Ca 0.19 -3.41 -0.31 0.00 0.00 0.00 0.00 61.98 58.46 3d43 s VAL 286 Cb 0.15 -2.11 -0.07 0.00 0.00 0.00 0.00 36.38 34.34 3d43 s VAL 286 CO 0.35 -1.09 1.48 -0.62 0.00 0.00 0.00 175.10 175.22 3d43 s ASP 287 N -0.62 6.76 -0.07 3.32 2.15 -1.25 -1.17 116.67 125.78 3d43 s ASP 287 Ca 0.27 2.30 -0.19 0.00 0.43 0.00 0.00 52.55 55.37 3d43 s ASP 287 Cb -0.03 -2.57 -0.05 0.00 -0.30 0.00 0.00 42.92 39.97 3d43 s ASP 287 CO -0.16 -0.76 0.51 -0.63 -0.17 0.00 0.00 175.17 173.97 3d43 s ILE 288 N 2.06 5.09 0.00 4.11 -1.09 -1.26 -4.90 121.20 125.20 3d43 s ILE 288 Ca 0.67 1.04 0.00 0.00 -2.23 0.00 0.00 60.65 60.14 3d43 s ILE 288 Cb -0.36 -3.85 0.00 0.00 -1.58 0.00 0.00 42.46 36.67 3d43 s ILE 288 CO 0.29 0.38 0.40 0.29 -1.23 0.00 0.00 174.94 175.07 3d43 n LYS 289 N 3.21 0.10 -4.27 2.79 5.02 -1.26 -4.06 118.16 119.68 3d43 n LYS 289 Ca -0.07 -0.47 -0.33 0.00 -2.02 0.00 0.00 58.31 55.41 3d43 n LYS 289 Cb 0.52 -0.75 -0.09 0.00 -0.02 0.00 0.00 35.03 34.69 3d43 n LYS 289 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3d43 s GLY 290 N -0.15 1.90 0.00 0.72 0.00 -1.24 -4.41 107.32 104.13 3d43 s GLY 290 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 44.72 43.82 3d43 s GLY 290 CO 0.00 -0.74 0.00 0.61 0.00 0.00 0.00 173.10 172.97 3d43 n GLY 291 N 1.56 2.41 3.72 0.20 0.00 -1.26 -1.06 105.19 110.76 3d43 n GLY 291 Ca -0.15 -1.94 -0.42 0.00 0.00 0.00 0.00 46.02 43.51 3d43 n GLY 291 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d43 s TYR 292 N -2.87 2.99 0.00 1.61 1.51 -1.26 -1.25 117.35 118.08 3d43 s TYR 292 Ca 0.00 0.52 0.00 0.00 -1.01 0.00 0.00 57.07 56.58 3d43 s TYR 292 Cb 0.00 -4.02 0.00 0.00 -0.11 0.00 0.00 41.96 37.83 3d43 s TYR 292 CO 0.00 -3.79 0.00 0.41 -1.11 0.00 0.00 175.55 171.06 3d43 n GLY 293 N 3.78 2.51 3.77 0.71 0.00 -1.26 -4.68 105.19 110.03 3d43 n GLY 293 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 3d43 n GLY 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d43 s ALA 294 N -2.28 2.99 0.22 4.61 0.00 -0.38 -4.30 121.76 122.62 3d43 s ALA 294 Ca 0.00 0.96 -0.13 0.00 0.00 0.00 0.00 51.96 52.79 3d43 s ALA 294 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.73 3d43 s ALA 294 CO 0.00 -0.69 0.46 0.00 0.00 0.00 0.00 175.76 175.53 3d43 s ALA 295 N -1.52 -0.36 0.19 0.00 0.00 -1.26 -4.79 121.76 114.03 3d43 s ALA 295 Ca 0.63 -0.73 -0.33 0.00 0.00 0.00 0.00 51.96 51.53 3d43 s ALA 295 Cb -0.30 0.99 -0.13 0.00 0.00 0.00 0.00 23.12 23.68 3d43 s ALA 295 CO 0.36 -0.81 1.56 -0.89 0.00 0.00 0.00 175.76 175.98 3d43 n ILE 296 N -0.35 0.28 -2.83 0.00 5.41 -1.26 -4.51 119.36 116.09 3d43 n ILE 296 Ca -0.04 -0.07 0.00 0.00 1.00 0.00 0.00 62.75 63.64 3d43 n ILE 296 Cb 0.62 -1.61 0.00 0.00 -0.71 0.00 0.00 39.64 37.94 3d43 n ILE 296 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3d43 n GLY 297 N 3.12 -1.78 3.70 7.39 0.00 -1.26 -4.84 105.19 111.52 3d43 n GLY 297 Ca 0.15 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 3d43 n GLY 297 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3d43 s ASP 298 N -4.00 6.84 0.18 1.61 3.68 -1.26 -4.79 116.67 118.92 3d43 s ASP 298 Ca 0.00 2.24 -0.04 0.00 2.13 0.00 0.00 52.55 56.88 3d43 s ASP 298 Cb 0.00 -2.58 -0.03 0.00 -1.45 0.00 0.00 42.92 38.86 3d43 s ASP 298 CO 0.00 -0.68 0.18 1.51 0.13 0.00 0.00 175.17 176.31 3d43 s ASP 299 N 1.44 0.15 0.00 -0.34 -4.77 -0.80 -3.12 116.67 109.24 3d43 s ASP 299 Ca 0.64 -1.19 0.30 0.00 -3.30 0.00 0.00 52.55 49.00 3d43 s ASP 299 Cb -0.35 0.39 1.44 0.00 -1.09 0.00 0.00 42.92 43.31 3d43 s ASP 299 CO 0.29 -0.85 1.97 0.00 0.70 0.00 0.00 175.17 177.28 3d43 n TYR 300 N -0.22 0.00 -0.03 2.11 0.18 -1.26 -0.54 117.16 117.40 3d43 n TYR 300 Ca -0.02 0.00 -0.21 0.00 1.88 0.00 0.00 57.90 59.55 3d43 n TYR 300 Cb 0.64 -0.08 -0.13 0.00 -0.38 0.00 0.00 39.34 39.39 3d43 n TYR 300 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3d43 n ALA 301 N -0.71 1.02 -0.15 -3.48 0.00 -1.26 -0.62 120.51 115.31 3d43 n ALA 301 Ca 0.19 -0.72 0.00 0.00 0.00 0.00 0.00 53.44 52.91 3d43 n ALA 301 Cb 0.24 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 19.15 3d43 n ALA 301 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3d43 n SER 302 N -3.44 0.58 0.00 0.00 3.41 -1.22 -4.83 113.62 108.12 3d43 n SER 302 Ca -0.35 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.42 3d43 n SER 302 Cb 1.03 0.22 0.00 0.00 -0.26 0.00 0.00 64.21 65.20 3d43 n SER 302 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d43 n GLY 303 N 0.22 1.96 0.18 5.00 0.00 0.30 -3.11 105.19 109.74 3d43 n GLY 303 Ca 0.00 -0.57 0.05 0.00 0.00 0.00 0.00 46.02 45.49 3d43 n GLY 303 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3d43 h PHE 304 N 0.00 0.00 0.00 1.61 -1.00 -0.70 -2.12 116.94 114.74 3d43 h PHE 304 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3d43 h PHE 304 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 3d43 h PHE 304 CO 0.00 0.41 0.00 0.41 -1.61 0.00 0.00 178.31 177.52 3d43 n GLY 305 N 0.19 0.86 3.22 -1.45 0.00 -1.18 -3.59 105.19 103.24 3d43 n GLY 305 Ca -0.00 -1.82 -0.39 0.00 0.00 0.00 0.00 46.02 43.80 3d43 n GLY 305 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3d43 s PHE 306 N -3.00 3.41 0.37 1.61 5.99 -0.32 -0.77 117.98 125.29 3d43 s PHE 306 Ca 0.00 -1.84 -0.26 0.00 0.00 0.00 0.00 56.93 54.83 3d43 s PHE 306 Cb 0.00 -3.14 -0.09 0.00 0.00 0.00 0.00 43.02 39.80 3d43 s PHE 306 CO 0.00 -0.92 1.15 0.00 -0.00 0.00 0.00 175.22 175.45 3d43 s ALA 307 N 1.34 3.21 0.29 11.12 0.00 -1.26 -4.46 121.76 132.01 3d43 s ALA 307 Ca 0.04 0.94 0.04 0.00 0.00 0.00 0.00 51.96 52.98 3d43 s ALA 307 Cb -0.24 -3.36 -0.03 0.00 0.00 0.00 0.00 23.12 19.48 3d43 s ALA 307 CO -0.00 -0.43 0.20 1.03 0.00 0.00 0.00 175.76 176.55 3d43 s ARG 308 N -2.14 1.58 0.00 0.00 0.52 -1.26 -4.91 118.95 112.73 3d43 s ARG 308 Ca 0.54 -1.90 0.16 0.00 -0.52 0.00 0.00 55.73 54.02 3d43 s ARG 308 Cb -0.30 0.12 0.98 0.00 0.52 0.00 0.00 34.95 36.28 3d43 s ARG 308 CO 0.38 -0.51 1.39 1.33 0.02 0.00 0.00 175.30 177.91