#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dub s ASN 32 N 0.00 6.40 0.10 0.00 2.20 -1.26 -5.03 114.94 117.35 2dub s ASN 32 Ca 0.00 -1.78 -0.22 0.00 -0.94 0.00 0.00 52.86 49.92 2dub s ASN 32 Cb 0.00 -2.32 -0.07 0.00 -2.00 0.00 0.00 41.25 36.86 2dub s ASN 32 CO 0.00 -1.03 0.66 -0.36 -2.94 0.00 0.00 177.10 173.43 2dub s PHE 33 N 2.36 3.83 -0.13 1.54 0.08 -1.26 -4.99 117.98 119.40 2dub s PHE 33 Ca 0.19 1.42 -0.13 0.00 0.12 0.00 0.00 56.93 58.53 2dub s PHE 33 Cb -0.16 -2.63 -0.25 0.00 -0.57 0.00 0.00 43.02 39.41 2dub s PHE 33 CO -0.00 0.53 0.41 1.96 -0.10 0.00 0.00 175.22 178.01 2dub h GLN 34 N 4.60 0.21 0.00 0.44 1.08 -1.96 -3.42 115.11 116.06 2dub h GLN 34 Ca -0.48 -0.36 0.00 0.00 -1.45 0.00 0.00 58.65 56.36 2dub h GLN 34 Cb 1.21 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 28.77 2dub h GLN 34 CO 0.65 1.17 -1.25 0.66 -0.95 0.00 0.00 178.83 179.12 2dub n TYR 35 N -3.83 0.00 -4.30 2.96 4.01 -1.26 -4.92 117.16 109.82 2dub n TYR 35 Ca -0.30 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.26 2dub n TYR 35 Cb 0.93 -0.18 -0.10 0.00 -0.31 0.00 0.00 39.34 39.67 2dub n TYR 35 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 2dub s ILE 36 N -2.86 1.55 -0.17 -0.72 -4.36 -1.26 0.17 121.20 113.55 2dub s ILE 36 Ca 0.01 -2.02 0.01 0.00 -0.26 0.00 0.00 60.65 58.38 2dub s ILE 36 Cb 0.12 -1.85 0.02 0.00 1.25 0.00 0.00 42.46 42.00 2dub s ILE 36 CO 0.70 -0.54 -0.16 -0.63 0.24 0.00 0.00 174.94 174.55 2dub s ILE 37 N -2.70 1.79 0.26 8.37 1.01 0.44 -4.66 121.20 125.71 2dub s ILE 37 Ca 0.17 -0.80 0.09 0.00 0.00 0.00 0.00 60.65 60.12 2dub s ILE 37 Cb -0.02 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.75 2dub s ILE 37 CO 0.05 0.47 -0.00 0.42 0.00 0.00 0.00 174.94 175.87 2dub s THR 38 N 1.39 3.47 0.00 2.92 -4.23 -1.26 -0.24 115.64 117.69 2dub s THR 38 Ca 0.04 -1.88 0.00 0.00 -1.18 0.00 0.00 61.69 58.67 2dub s THR 38 Cb -0.13 -2.85 0.00 0.00 1.34 0.00 0.00 72.50 70.86 2dub s THR 38 CO -0.11 -0.36 0.00 -1.84 -0.54 0.00 0.00 174.62 171.77 2dub n GLU 39 N -0.85 0.00 -3.30 3.99 0.28 -0.77 -5.01 120.64 114.98 2dub n GLU 39 Ca -0.07 0.00 -0.38 0.00 -0.16 0.00 0.00 57.16 56.55 2dub n GLU 39 Cb 0.59 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.40 2dub n GLU 39 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2dub s LYS 40 N -1.90 4.21 0.26 3.44 1.02 -1.26 -0.75 119.74 124.77 2dub s LYS 40 Ca 0.00 0.61 0.04 0.00 0.02 0.00 0.00 55.97 56.64 2dub s LYS 40 Cb 0.00 -3.31 -0.01 0.00 -0.52 0.00 0.00 37.83 33.98 2dub s LYS 40 CO 0.00 0.46 0.14 1.63 -0.92 0.00 0.00 175.35 176.66 2dub n LYS 41 N 2.50 0.51 -0.46 1.68 4.76 0.50 -4.92 118.16 122.72 2dub n LYS 41 Ca -0.09 -2.38 0.06 0.00 -2.87 0.00 0.00 58.31 53.03 2dub n LYS 41 Cb 0.51 1.58 -0.02 0.00 -1.84 0.00 0.00 35.03 35.26 2dub n LYS 41 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dub n GLY 42 N -0.13 -2.31 3.59 0.72 0.00 -1.26 -1.78 105.19 104.02 2dub n GLY 42 Ca 0.00 -1.36 -0.50 0.00 0.00 0.00 0.00 46.02 44.16 2dub n GLY 42 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dub n LYS 43 N -3.02 1.19 -1.55 1.61 4.81 -1.26 0.38 118.16 120.32 2dub n LYS 43 Ca -0.02 0.43 -0.17 0.00 -0.87 0.00 0.00 58.31 57.69 2dub n LYS 43 Cb 0.22 -2.00 -0.07 0.00 0.02 0.00 0.00 35.03 33.20 2dub n LYS 43 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2dub n ASN 44 N 2.30 -4.39 -4.03 3.14 3.02 -1.26 -2.25 115.26 111.78 2dub n ASN 44 Ca 0.17 0.38 -0.28 0.00 -0.03 0.00 0.00 54.58 54.82 2dub n ASN 44 Cb 0.22 -3.96 -0.03 0.00 -0.61 0.00 0.00 39.78 35.40 2dub n ASN 44 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2dub n SER 45 N -0.96 -0.70 0.07 6.41 3.41 0.16 -4.86 113.62 117.15 2dub n SER 45 Ca -0.17 -1.03 0.12 0.00 -0.26 0.00 0.00 58.87 57.53 2dub n SER 45 Cb 0.55 -2.87 0.22 0.00 -0.26 0.00 0.00 64.21 61.85 2dub n SER 45 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2dub h SER 46 N -1.78 0.00 -3.46 4.04 4.64 -1.22 -3.41 113.55 112.36 2dub h SER 46 Ca -0.63 -0.16 -0.62 0.00 -0.47 0.00 0.00 61.79 59.91 2dub h SER 46 Cb 1.38 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.32 2dub h SER 46 CO 0.66 0.08 -0.52 -0.69 -0.87 0.00 0.00 176.83 175.49 2dub s VAL 47 N -3.16 5.16 -0.33 0.95 1.01 -0.73 -0.29 120.40 123.01 2dub s VAL 47 Ca 0.07 0.11 -0.17 0.00 0.00 0.00 0.00 61.98 61.99 2dub s VAL 47 Cb 0.13 -3.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.12 2dub s VAL 47 CO 0.69 0.39 0.43 -0.83 0.00 0.00 0.00 175.10 175.79 2dub s GLY 48 N 0.80 1.86 -0.26 4.51 0.00 -0.39 -0.37 107.32 113.48 2dub s GLY 48 Ca 0.06 -1.06 -0.10 0.00 0.00 0.00 0.00 44.72 43.62 2dub s GLY 48 CO 0.02 1.12 0.17 -2.27 0.00 0.00 0.00 173.10 172.14 2dub s LEU 49 N 2.20 4.02 -0.18 0.66 2.96 0.07 -0.50 118.68 127.91 2dub s LEU 49 Ca 0.15 0.03 -0.01 0.00 -0.22 0.00 0.00 54.13 54.08 2dub s LEU 49 Cb -0.16 -2.10 -0.00 0.00 0.50 0.00 0.00 46.19 44.43 2dub s LEU 49 CO 0.12 0.01 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.42 2dub s ILE 50 N 1.39 2.90 -0.21 6.68 1.01 -0.04 -1.85 121.20 131.09 2dub s ILE 50 Ca 0.07 -0.67 0.01 0.00 0.00 0.00 0.00 60.65 60.06 2dub s ILE 50 Cb -0.15 -2.27 0.03 0.00 0.01 0.00 0.00 42.46 40.09 2dub s ILE 50 CO 0.07 0.48 -0.15 -1.58 0.00 0.00 0.00 174.94 173.77 2dub s GLN 51 N 1.11 2.81 0.17 2.79 0.74 0.66 -1.20 119.66 126.75 2dub s GLN 51 Ca 0.01 -0.96 -0.32 0.00 0.05 0.00 0.00 55.36 54.14 2dub s GLN 51 Cb -0.14 -2.73 -0.10 0.00 1.10 0.00 0.00 33.01 31.13 2dub s GLN 51 CO -0.03 -0.32 1.61 -0.51 -0.55 0.00 0.00 175.29 175.49 2dub s LEU 52 N 1.26 4.37 -0.50 3.68 1.43 0.71 -0.42 118.68 129.21 2dub s LEU 52 Ca 0.01 2.66 0.05 0.00 -1.03 0.00 0.00 54.13 55.83 2dub s LEU 52 Cb -0.15 -3.59 0.20 0.00 0.03 0.00 0.00 46.19 42.67 2dub s LEU 52 CO -0.09 -0.86 0.46 -3.20 0.23 0.00 0.00 176.35 172.89 2dub n ASN 53 N 4.10 0.99 -2.97 2.29 5.15 0.44 -4.25 115.26 121.01 2dub n ASN 53 Ca 0.14 -2.77 -0.14 0.00 -0.60 0.00 0.00 54.58 51.22 2dub n ASN 53 Cb 0.38 -0.63 0.01 0.00 -0.53 0.00 0.00 39.78 39.01 2dub n ASN 53 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2dub n ARG 54 N 2.09 1.03 -0.21 1.20 1.74 -1.25 -4.47 116.66 116.79 2dub n ARG 54 Ca 0.26 -3.00 0.17 0.00 -0.77 0.00 0.00 57.85 54.51 2dub n ARG 54 Cb 0.45 -1.40 0.51 0.00 -1.02 0.00 0.00 32.46 31.00 2dub n ARG 54 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2dub h PRO 55 N 2.94 0.40 0.00 5.56 0.13 -1.94 -0.22 132.00 138.87 2dub h PRO 55 Ca 0.00 -0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 65.04 2dub h PRO 55 Cb 1.05 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.08 2dub h PRO 55 CO 0.40 0.27 -0.33 0.87 -0.23 0.00 0.00 178.00 178.98 2dub h LYS 56 N 0.42 0.00 -0.58 0.86 1.57 -2.03 -1.58 116.57 115.23 2dub h LYS 56 Ca 0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.21 2dub h LYS 56 Cb 1.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.33 2dub h LYS 56 CO -0.15 0.33 0.00 0.00 -0.57 0.00 0.00 179.45 179.06 2dub n ALA 57 N -2.39 3.71 -4.19 3.86 0.00 -0.65 -4.92 120.51 115.94 2dub n ALA 57 Ca -0.01 -1.89 -0.34 0.00 0.00 0.00 0.00 53.44 51.20 2dub n ALA 57 Cb 0.40 -1.09 -0.03 0.00 0.00 0.00 0.00 19.45 18.73 2dub n ALA 57 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dub n LEU 58 N 0.67 -1.73 -1.90 0.00 4.77 -0.59 -0.74 117.00 117.47 2dub n LEU 58 Ca 0.27 -1.04 -0.18 0.00 -0.03 0.00 0.00 56.01 55.03 2dub n LEU 58 Cb 1.14 -2.06 -0.03 0.00 -2.33 0.00 0.00 43.42 40.14 2dub n LEU 58 CO 0.30 0.32 -0.22 0.59 -1.33 0.00 0.00 177.39 177.06 2dub n ASN 59 N -2.73 -5.27 -4.64 -1.43 3.02 -0.19 -1.40 115.26 102.62 2dub n ASN 59 Ca -0.03 0.11 -0.50 0.00 -0.03 0.00 0.00 54.58 54.13 2dub n ASN 59 Cb 0.54 -4.35 -0.05 0.00 -0.61 0.00 0.00 39.78 35.31 2dub n ASN 59 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dub n ALA 60 N -1.04 0.15 -2.16 5.41 0.00 0.08 -4.32 120.51 118.63 2dub n ALA 60 Ca -0.21 0.46 -0.39 0.00 0.00 0.00 0.00 53.44 53.31 2dub n ALA 60 Cb 0.65 -2.23 -0.02 0.00 0.00 0.00 0.00 19.45 17.85 2dub n ALA 60 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dub n LEU 61 N 3.41 4.64 -4.83 0.00 4.77 0.11 -4.78 117.00 120.31 2dub n LEU 61 Ca 0.19 -3.65 -0.30 0.00 -0.03 0.00 0.00 56.01 52.22 2dub n LEU 61 Cb 0.23 -1.67 0.06 0.00 -2.33 0.00 0.00 43.42 39.71 2dub n LEU 61 CO 0.65 -0.30 0.72 0.00 -1.33 0.00 0.00 177.39 177.13 2dub h ASN 63 N -0.77 0.59 -0.39 0.00 -1.24 -1.96 -1.71 115.58 110.11 2dub h ASN 63 Ca -0.45 0.05 -0.08 0.00 0.71 0.00 0.00 56.30 56.53 2dub h ASN 63 Cb 1.23 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 40.21 2dub h ASN 63 CO 0.60 0.27 -0.07 1.23 -1.29 0.00 0.00 177.43 178.16 2dub h GLY 64 N 0.61 0.79 1.05 1.57 0.00 -1.99 -2.04 103.07 103.06 2dub h GLY 64 Ca 0.47 -0.64 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 2dub h GLY 64 CO -0.22 0.59 0.26 -2.00 0.00 0.00 0.00 176.54 175.17 2dub h LEU 65 N 0.54 1.06 -0.85 3.11 5.85 -1.75 -2.31 115.31 120.97 2dub h LEU 65 Ca 0.10 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 2dub h LEU 65 Cb 0.58 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 2dub h LEU 65 CO 0.03 0.97 0.48 0.40 -0.34 0.00 0.00 178.44 179.99 2dub h ILE 66 N 1.10 1.25 -0.70 4.05 1.08 -1.18 0.27 117.51 123.38 2dub h ILE 66 Ca 0.24 -0.59 -0.06 0.00 -0.39 0.00 0.00 64.86 64.06 2dub h ILE 66 Cb 0.27 0.09 -0.03 0.00 -3.07 0.00 0.00 36.82 34.08 2dub h ILE 66 CO -0.01 0.27 0.19 -0.08 -0.69 0.00 0.00 178.15 177.83 2dub h GLU 67 N 1.18 1.10 -0.21 2.37 4.81 -1.02 -1.43 114.58 121.38 2dub h GLU 67 Ca 0.30 -0.25 -0.18 0.00 -0.13 0.00 0.00 59.36 59.10 2dub h GLU 67 Cb 0.01 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.24 2dub h GLU 67 CO -0.05 0.96 -0.58 0.93 -0.73 0.00 0.00 179.01 179.53 2dub h GLU 68 N 1.05 0.77 -0.53 1.92 5.08 -1.04 -2.33 114.58 119.50 2dub h GLU 68 Ca 0.22 -0.54 0.04 0.00 -1.00 0.00 0.00 59.36 58.08 2dub h GLU 68 Cb 0.34 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 2dub h GLU 68 CO -0.00 1.17 0.28 1.25 -1.00 0.00 0.00 179.01 180.70 2dub h LEU 69 N 0.51 0.42 -1.03 1.33 5.85 -0.75 0.25 115.31 121.89 2dub h LEU 69 Ca -0.01 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 2dub h LEU 69 Cb 1.20 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 2dub h LEU 69 CO 0.13 0.29 0.13 0.78 -0.34 0.00 0.00 178.44 179.42 2dub h ASN 70 N 0.55 0.78 0.20 1.25 2.35 -1.25 -0.23 115.58 119.22 2dub h ASN 70 Ca 0.23 -0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 2dub h ASN 70 Cb 0.11 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.28 2dub h ASN 70 CO -0.15 0.76 -0.10 1.56 -1.65 0.00 0.00 177.43 177.86 2dub h GLN 71 N 0.80 -0.26 -0.83 0.81 4.20 -0.66 -0.33 115.11 118.85 2dub h GLN 71 Ca 0.18 0.02 0.10 0.00 0.06 0.00 0.00 58.65 59.00 2dub h GLN 71 Cb 0.30 0.06 -0.07 0.00 0.30 0.00 0.00 27.48 28.06 2dub h GLN 71 CO -0.00 -0.02 0.48 0.00 -0.67 0.00 0.00 178.83 178.62 2dub h ALA 72 N 0.28 1.19 -0.03 3.87 0.00 -0.28 0.35 119.26 124.64 2dub h ALA 72 Ca -0.03 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dub h ALA 72 Cb 0.36 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2dub h ALA 72 CO 0.04 0.10 0.01 -0.07 0.00 0.00 0.00 179.25 179.34 2dub h LEU 73 N 0.80 0.04 -0.73 0.00 3.38 -0.84 -0.58 115.31 117.38 2dub h LEU 73 Ca 0.40 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 58.27 2dub h LEU 73 Cb 0.37 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 2dub h LEU 73 CO -0.25 0.17 0.45 -0.33 0.09 0.00 0.00 178.44 178.56 2dub h GLU 74 N -0.09 0.83 0.17 1.13 4.39 -0.43 0.14 114.58 120.72 2dub h GLU 74 Ca 0.01 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 2dub h GLU 74 Cb 0.14 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.60 2dub h GLU 74 CO -0.00 0.55 -0.08 1.15 -1.16 0.00 0.00 179.01 179.46 2dub h THR 75 N 0.85 0.86 -0.05 1.13 2.02 -0.70 -1.09 112.91 115.92 2dub h THR 75 Ca 0.30 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.31 2dub h THR 75 Cb 0.08 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 2dub h THR 75 CO -0.13 0.03 -0.11 -0.26 0.37 0.00 0.00 175.52 175.42 2dub h PHE 76 N -0.30 0.08 -0.48 3.16 0.04 -0.81 -1.70 116.94 116.94 2dub h PHE 76 Ca -0.02 -0.01 -0.08 0.00 2.80 0.00 0.00 57.97 60.66 2dub h PHE 76 Cb 0.23 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.34 2dub h PHE 76 CO -0.05 0.19 -0.03 1.49 -0.60 0.00 0.00 178.31 179.32 2dub h GLU 77 N 0.08 0.86 -0.00 1.51 4.57 -0.24 -2.86 114.58 118.51 2dub h GLU 77 Ca 0.02 -0.29 0.00 0.00 -1.18 0.00 0.00 59.36 57.91 2dub h GLU 77 Cb 0.25 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 2dub h GLU 77 CO 0.02 0.92 -0.06 0.39 -1.18 0.00 0.00 179.01 179.09 2dub n GLU 78 N -4.32 0.52 -2.85 1.92 1.02 -0.46 -4.72 120.64 111.75 2dub n GLU 78 Ca 0.00 -0.10 -0.43 0.00 -0.02 0.00 0.00 57.16 56.62 2dub n GLU 78 Cb 0.33 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.21 2dub n GLU 78 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2dub s ASP 79 N -2.55 6.37 0.66 1.62 -1.08 -0.69 -4.90 116.67 116.09 2dub s ASP 79 Ca 0.28 -0.28 0.37 0.00 -0.52 0.00 0.00 52.55 52.40 2dub s ASP 79 Cb 0.20 -2.43 2.03 0.00 -1.46 0.00 0.00 42.92 41.26 2dub s ASP 79 CO 0.48 -1.16 2.17 -0.65 0.52 0.00 0.00 175.17 176.52 2dub h PRO 80 N 9.24 0.00 0.00 4.34 0.11 -1.86 -0.45 132.00 143.39 2dub h PRO 80 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2dub h PRO 80 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2dub h PRO 80 CO 1.06 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.85 2dub h ALA 81 N 1.71 1.00 -2.87 -0.75 0.00 -1.90 -3.44 119.26 113.01 2dub h ALA 81 Ca 0.01 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.31 2dub h ALA 81 Cb 0.32 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.98 2dub h ALA 81 CO -0.00 0.00 -0.27 0.08 0.00 0.00 0.00 179.25 179.06 2dub s VAL 82 N -3.15 5.22 -0.07 0.00 1.01 -0.18 -3.90 120.40 119.33 2dub s VAL 82 Ca 0.09 0.57 0.15 0.00 0.00 0.00 0.00 61.98 62.80 2dub s VAL 82 Cb 0.10 -3.68 -0.23 0.00 0.00 0.00 0.00 36.38 32.58 2dub s VAL 82 CO 0.61 0.25 0.24 0.61 0.00 0.00 0.00 175.10 176.80 2dub n GLY 83 N 4.18 -0.75 3.30 4.51 0.00 0.60 -4.89 105.19 112.15 2dub n GLY 83 Ca -0.10 -0.34 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 2dub n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dub s ALA 84 N -2.83 -1.00 -0.04 4.61 0.00 -1.22 -4.21 121.76 117.07 2dub s ALA 84 Ca -0.07 0.53 0.03 0.00 0.00 0.00 0.00 51.96 52.45 2dub s ALA 84 Cb 0.08 0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.25 2dub s ALA 84 CO 0.66 -0.29 -0.12 0.42 0.00 0.00 0.00 175.76 176.42 2dub s ILE 85 N -1.37 3.26 -0.18 0.00 1.01 0.05 -1.27 121.20 122.70 2dub s ILE 85 Ca -0.13 -0.73 -0.01 0.00 0.00 0.00 0.00 60.65 59.79 2dub s ILE 85 Cb -0.04 -2.32 0.00 0.00 0.01 0.00 0.00 42.46 40.11 2dub s ILE 85 CO 0.05 0.54 -0.14 -0.69 0.00 0.00 0.00 174.94 174.70 2dub s VAL 86 N -0.81 2.67 -0.16 2.92 1.01 0.35 0.04 120.40 126.42 2dub s VAL 86 Ca 0.13 -0.74 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 2dub s VAL 86 Cb -0.11 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 2dub s VAL 86 CO 0.02 0.50 -0.02 -0.22 0.00 0.00 0.00 175.10 175.38 2dub s LEU 87 N 1.18 3.34 0.29 3.92 2.96 0.11 -0.86 118.68 129.61 2dub s LEU 87 Ca 0.02 -0.10 -0.06 0.00 -0.22 0.00 0.00 54.13 53.76 2dub s LEU 87 Cb -0.14 -1.82 -0.01 0.00 0.50 0.00 0.00 46.19 44.73 2dub s LEU 87 CO -0.05 0.16 0.43 0.28 -1.32 0.00 0.00 176.35 175.84 2dub s THR 88 N 0.43 0.00 0.00 3.68 -1.32 -0.34 -0.38 115.64 117.71 2dub s THR 88 Ca -0.02 -1.59 0.00 0.00 -1.21 0.00 0.00 61.69 58.87 2dub s THR 88 Cb -0.14 -2.46 0.00 0.00 -1.51 0.00 0.00 72.50 68.39 2dub s THR 88 CO 0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.04 2dub n GLY 89 N -0.45 4.48 2.17 6.08 0.00 -1.26 -0.20 105.19 116.01 2dub n GLY 89 Ca 0.00 -0.81 -0.13 0.00 0.00 0.00 0.00 46.02 45.07 2dub n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dub n GLY 90 N 2.61 0.47 0.12 -0.02 0.00 0.71 -4.67 105.19 104.41 2dub n GLY 90 Ca 0.00 -1.96 0.01 0.00 0.00 0.00 0.00 46.02 44.07 2dub n GLY 90 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2dub h GLU 91 N 0.00 0.00 0.00 1.61 4.81 -1.98 -3.28 114.58 115.73 2dub h GLU 91 Ca -0.19 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.96 2dub h GLU 91 Cb 0.68 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 2dub h GLU 91 CO 0.20 0.53 -1.42 1.17 -0.73 0.00 0.00 179.01 178.76 2dub n LYS 92 N -3.19 0.63 -3.65 1.92 4.81 -1.26 -3.50 118.16 113.91 2dub n LYS 92 Ca 0.00 0.09 -0.08 0.00 -0.87 0.00 0.00 58.31 57.45 2dub n LYS 92 Cb 0.78 -1.74 -0.08 0.00 0.02 0.00 0.00 35.03 34.00 2dub n LYS 92 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2dub s ALA 93 N -3.19 -1.69 -0.09 3.14 0.00 -1.24 -2.06 121.76 116.63 2dub s ALA 93 Ca -0.03 2.23 -0.24 0.00 0.00 0.00 0.00 51.96 53.91 2dub s ALA 93 Cb 0.10 -1.32 -0.20 0.00 0.00 0.00 0.00 23.12 21.70 2dub s ALA 93 CO 0.82 -0.35 0.86 0.35 0.00 0.00 0.00 175.76 177.44 2dub h PHE 94 N 7.03 -0.05 -0.48 0.00 3.57 0.48 0.20 116.94 127.69 2dub h PHE 94 Ca -0.32 -0.00 0.22 0.00 3.53 0.00 0.00 57.97 61.41 2dub h PHE 94 Cb 1.22 0.02 -0.22 0.00 2.79 0.00 0.00 35.95 39.75 2dub h PHE 94 CO 0.09 0.61 0.18 0.00 -2.23 0.00 0.00 178.31 176.97 2dub s ALA 95 N -3.10 -3.23 -1.65 2.41 0.00 -0.50 -4.37 121.76 111.32 2dub s ALA 95 Ca -0.15 1.62 0.19 0.00 0.00 0.00 0.00 51.96 53.61 2dub s ALA 95 Cb -0.01 -2.37 1.01 0.00 0.00 0.00 0.00 23.12 21.75 2dub s ALA 95 CO 0.58 -1.29 1.55 0.00 0.00 0.00 0.00 175.76 176.60 2dub n ALA 96 N 5.27 2.07 0.00 0.00 0.00 -0.49 -1.70 120.51 125.66 2dub n ALA 96 Ca -0.07 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2dub n ALA 96 Cb 0.54 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.68 2dub n ALA 96 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dub n GLY 97 N 0.24 1.36 3.61 0.00 0.00 -1.04 -4.48 105.19 104.88 2dub n GLY 97 Ca 0.11 -1.94 -0.30 0.00 0.00 0.00 0.00 46.02 43.88 2dub n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dub s ALA 98 N -1.16 0.70 -0.54 4.61 0.00 -1.26 0.04 121.76 124.15 2dub s ALA 98 Ca 0.00 -1.11 -0.17 0.00 0.00 0.00 0.00 51.96 50.68 2dub s ALA 98 Cb 0.00 -2.82 0.10 0.00 0.00 0.00 0.00 23.12 20.40 2dub s ALA 98 CO 0.00 -3.64 0.57 0.34 0.00 0.00 0.00 175.76 173.02 2dub s ASP 99 N -4.10 6.18 0.18 0.00 -1.08 -1.24 -4.35 116.67 112.27 2dub s ASP 99 Ca 0.73 -1.46 -0.12 0.00 -0.52 0.00 0.00 52.55 51.17 2dub s ASP 99 Cb -0.07 -2.25 0.10 0.00 -1.46 0.00 0.00 42.92 39.24 2dub s ASP 99 CO 0.55 -0.91 1.82 0.40 0.52 0.00 0.00 175.17 177.55 2dub h ILE 100 N 5.87 1.18 -0.73 4.11 1.08 -1.95 -2.28 117.51 124.80 2dub h ILE 100 Ca -0.29 -0.41 0.16 0.00 -0.39 0.00 0.00 64.86 63.93 2dub h ILE 100 Cb 1.10 0.33 -0.04 0.00 -3.07 0.00 0.00 36.82 35.14 2dub h ILE 100 CO 1.02 0.19 0.49 0.11 -0.69 0.00 0.00 178.15 179.27 2dub h LYS 101 N 0.84 0.31 0.00 2.37 6.56 -1.99 0.49 116.57 125.14 2dub h LYS 101 Ca 0.22 -0.02 -0.09 0.00 -1.06 0.00 0.00 60.65 59.71 2dub h LYS 101 Cb -0.02 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 31.56 2dub h LYS 101 CO -0.04 0.20 -0.41 0.93 -2.06 0.00 0.00 179.45 178.07 2dub h GLU 102 N 0.31 0.00 0.00 3.15 5.08 -1.83 -3.28 114.58 118.02 2dub h GLU 102 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 2dub h GLU 102 Cb 0.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.19 2dub h GLU 102 CO -0.09 0.41 -0.64 0.00 -1.00 0.00 0.00 179.01 177.69 2dub n MET 103 N -3.52 2.89 -0.41 2.33 0.00 -0.12 -4.63 117.12 113.67 2dub n MET 103 Ca -0.00 -0.01 0.36 0.00 0.00 0.00 0.00 57.70 58.05 2dub n MET 103 Cb 0.54 -1.07 0.70 0.00 0.00 0.00 0.00 33.22 33.39 2dub n MET 103 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 175.97 176.34 2dub h GLN 104 N 0.00 0.09 -0.03 3.17 4.15 -0.17 0.34 115.11 122.66 2dub h GLN 104 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 2dub h GLN 104 Cb 0.30 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.97 2dub h GLN 104 CO 0.00 0.06 -0.05 0.09 -1.93 0.00 0.00 178.83 177.00 2dub n ASN 105 N -4.32 2.85 -4.77 -0.69 3.02 -1.26 -4.99 115.26 105.10 2dub n ASN 105 Ca 0.31 -1.92 -0.33 0.00 -0.03 0.00 0.00 54.58 52.61 2dub n ASN 105 Cb 1.35 0.05 0.04 0.00 -0.61 0.00 0.00 39.78 40.61 2dub n ASN 105 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2dub s ARG 106 N -1.99 2.90 0.46 3.52 1.81 0.11 -5.06 118.95 120.70 2dub s ARG 106 Ca 0.26 1.39 0.06 0.00 -1.72 0.00 0.00 55.73 55.72 2dub s ARG 106 Cb 0.19 -1.96 -0.02 0.00 -0.45 0.00 0.00 34.95 32.71 2dub s ARG 106 CO 0.32 -1.17 0.20 0.95 -0.68 0.00 0.00 175.30 174.91 2dub s THR 107 N -2.30 1.92 0.12 0.02 -4.23 -1.26 -5.00 115.64 104.91 2dub s THR 107 Ca 0.67 -1.71 -0.20 0.00 -1.18 0.00 0.00 61.69 59.27 2dub s THR 107 Cb -0.20 -2.63 -0.08 0.00 1.34 0.00 0.00 72.50 70.92 2dub s THR 107 CO 0.40 0.00 1.76 0.15 -0.54 0.00 0.00 174.62 176.39 2dub h PHE 108 N 1.26 0.17 -0.37 3.99 3.57 -1.99 -1.19 116.94 122.37 2dub h PHE 108 Ca -0.42 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.11 2dub h PHE 108 Cb 1.28 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.94 2dub h PHE 108 CO 0.89 0.10 0.25 1.96 -2.23 0.00 0.00 178.31 179.27 2dub h GLN 109 N 0.19 0.41 0.46 1.11 7.50 -1.98 -0.02 115.11 122.78 2dub h GLN 109 Ca 0.07 -0.02 -0.02 0.00 0.50 0.00 0.00 58.65 59.17 2dub h GLN 109 Cb 0.00 -0.09 0.00 0.00 0.05 0.00 0.00 27.48 27.44 2dub h GLN 109 CO -0.04 0.27 -0.22 -0.44 -1.50 0.00 0.00 178.83 176.91 2dub h ASP 110 N 0.43 -0.52 -0.01 1.46 3.32 -1.69 -0.49 116.42 118.92 2dub h ASP 110 Ca 0.15 -0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.19 2dub h ASP 110 Cb 0.06 0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.70 2dub h ASP 110 CO -0.03 -0.28 -0.29 0.00 -1.72 0.00 0.00 179.24 176.92 2dub h TYR 112 N -0.43 -0.51 0.00 0.00 3.20 -1.02 -2.97 116.97 115.24 2dub h TYR 112 Ca 0.07 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2dub h TYR 112 Cb 0.52 0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.96 2dub h TYR 112 CO -0.32 -0.32 0.00 0.43 -1.64 0.00 0.00 178.16 176.31 2dub n SER 113 N -3.67 2.05 0.00 -2.11 7.64 -0.20 -2.77 113.62 114.56 2dub n SER 113 Ca -0.07 -1.36 0.00 0.00 1.01 0.00 0.00 58.87 58.45 2dub n SER 113 Cb 0.22 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.01 2dub n SER 113 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dub n GLY 114 N 1.35 1.00 7.00 0.23 0.00 -0.83 -4.92 105.19 109.03 2dub n GLY 114 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2dub n GLY 114 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dub n LYS 115 N 0.00 0.00 -3.93 1.61 4.76 -1.12 -5.02 118.16 114.46 2dub n LYS 115 Ca 0.00 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.14 2dub n LYS 115 Cb 0.17 0.00 -0.14 0.00 -1.84 0.00 0.00 35.03 33.23 2dub n LYS 115 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2dub s HIS 119 N 0.00 3.24 0.28 2.13 0.09 -1.26 -5.13 115.29 114.64 2dub s HIS 119 Ca 0.00 -3.18 0.20 0.00 -0.00 0.00 0.00 55.06 52.08 2dub s HIS 119 Cb 0.00 -2.83 0.92 0.00 -0.00 0.00 0.00 32.58 30.67 2dub s HIS 119 CO 0.00 -0.72 1.85 0.11 -0.00 0.00 0.00 174.74 175.98 2dub h TRP 120 N 6.38 0.00 -0.49 1.40 -0.00 -2.00 -3.29 115.95 117.96 2dub h TRP 120 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.84 2dub h TRP 120 Cb 0.88 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.04 2dub h TRP 120 CO 0.55 0.29 0.00 -0.40 -0.00 0.00 0.00 178.44 178.88 2dub n ASP 121 N -3.69 3.23 -0.35 0.11 5.68 -1.26 -4.61 116.55 115.66 2dub n ASP 121 Ca -0.01 -1.96 0.14 0.00 -0.50 0.00 0.00 54.79 52.45 2dub n ASP 121 Cb 0.40 -0.32 0.34 0.00 -1.14 0.00 0.00 41.12 40.40 2dub n ASP 121 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 2dub h HIS 122 N 3.84 1.03 -0.08 2.11 2.76 -2.00 0.06 115.15 122.86 2dub h HIS 122 Ca 0.00 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.23 2dub h HIS 122 Cb 0.86 -0.31 -0.00 0.00 1.55 0.00 0.00 27.41 29.51 2dub h HIS 122 CO 0.32 0.22 0.41 0.97 -1.30 0.00 0.00 177.93 178.56 2dub h ILE 123 N 0.73 0.06 -0.00 6.26 2.10 -1.89 0.42 117.51 125.18 2dub h ILE 123 Ca 0.58 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.52 2dub h ILE 123 Cb 0.94 0.60 0.00 0.00 -1.09 0.00 0.00 36.82 37.28 2dub h ILE 123 CO -0.37 0.00 -0.09 0.35 -1.08 0.00 0.00 178.15 176.96 2dub n THR 124 N -2.99 0.00 0.90 2.19 -2.24 0.01 -3.24 114.28 108.90 2dub n THR 124 Ca -0.00 -0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 2dub n THR 124 Cb 0.48 -0.36 0.18 0.00 -2.10 0.00 0.00 70.33 68.53 2dub n THR 124 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2dub n ARG 125 N -1.49 0.07 -2.30 -0.78 3.00 0.15 -4.89 116.66 110.41 2dub n ARG 125 Ca 0.07 0.01 -0.42 0.00 -0.01 0.00 0.00 57.85 57.50 2dub n ARG 125 Cb 0.34 -1.53 -0.03 0.00 0.00 0.00 0.00 32.46 31.24 2dub n ARG 125 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2dub s ILE 126 N -3.04 3.69 0.09 0.55 -1.09 -1.20 -4.94 121.20 115.26 2dub s ILE 126 Ca 0.09 1.20 0.05 0.00 -2.23 0.00 0.00 60.65 59.77 2dub s ILE 126 Cb 0.17 -3.77 -0.23 0.00 -1.58 0.00 0.00 42.46 37.05 2dub s ILE 126 CO 0.73 0.08 1.18 0.11 -1.23 0.00 0.00 174.94 175.81 2dub h LYS 127 N 6.90 0.06 -7.06 2.79 1.57 -1.91 -3.46 116.57 115.46 2dub h LYS 127 Ca -0.41 -0.10 -0.46 0.00 -1.87 0.00 0.00 60.65 57.80 2dub h LYS 127 Cb 1.21 0.04 0.01 0.00 0.08 0.00 0.00 32.23 33.57 2dub h LYS 127 CO 0.84 1.00 0.37 0.15 -0.57 0.00 0.00 179.45 181.25 2dub s LYS 128 N -2.69 3.96 0.49 3.15 1.02 -1.26 -4.62 119.74 119.80 2dub s LYS 128 Ca -0.01 1.29 -0.23 0.00 0.02 0.00 0.00 55.97 57.04 2dub s LYS 128 Cb 0.09 -2.15 -0.06 0.00 -0.52 0.00 0.00 37.83 35.19 2dub s LYS 128 CO 0.83 -0.28 1.34 -2.14 -0.92 0.00 0.00 175.35 174.18 2dub s PRO 129 N -3.18 3.45 -0.10 -1.68 0.02 -1.26 -4.84 135.00 127.41 2dub s PRO 129 Ca 0.65 2.21 0.01 0.00 0.02 0.00 0.00 61.00 63.89 2dub s PRO 129 Cb -0.14 -2.43 0.02 0.00 0.02 0.00 0.00 34.50 31.96 2dub s PRO 129 CO 0.18 -0.93 -0.12 0.08 -0.33 0.00 0.00 177.00 175.88 2dub s VAL 130 N -1.31 1.27 -0.13 3.83 1.01 -1.26 -0.77 120.40 123.06 2dub s VAL 130 Ca 0.66 -0.50 -0.03 0.00 0.00 0.00 0.00 61.98 62.11 2dub s VAL 130 Cb -0.39 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 2dub s VAL 130 CO 0.48 0.40 -0.01 -0.63 0.00 0.00 0.00 175.10 175.34 2dub s ILE 131 N 1.14 4.15 -0.26 2.22 1.01 0.11 -1.29 121.20 128.28 2dub s ILE 131 Ca -0.05 -0.28 -0.11 0.00 0.00 0.00 0.00 60.65 60.21 2dub s ILE 131 Cb -0.14 -2.79 -0.05 0.00 0.01 0.00 0.00 42.46 39.49 2dub s ILE 131 CO -0.03 0.54 0.17 0.00 0.00 0.00 0.00 174.94 175.62 2dub s ALA 132 N -0.19 3.55 -0.75 9.38 0.00 0.30 0.05 121.76 134.10 2dub s ALA 132 Ca 0.05 -1.00 -0.12 0.00 0.00 0.00 0.00 51.96 50.88 2dub s ALA 132 Cb -0.13 -2.39 0.20 0.00 0.00 0.00 0.00 23.12 20.80 2dub s ALA 132 CO 0.02 -0.39 0.67 0.00 0.00 0.00 0.00 175.76 176.06 2dub s ALA 133 N 1.44 3.93 -0.41 0.00 0.00 0.49 -0.50 121.76 126.70 2dub s ALA 133 Ca 0.07 -3.19 -0.22 0.00 0.00 0.00 0.00 51.96 48.62 2dub s ALA 133 Cb -0.15 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 19.66 2dub s ALA 133 CO 0.08 -2.20 0.74 0.08 0.00 0.00 0.00 175.76 174.46 2dub s VAL 134 N 0.35 4.73 -0.09 0.00 1.01 0.51 -4.32 120.40 122.60 2dub s VAL 134 Ca 0.15 0.53 0.03 0.00 0.00 0.00 0.00 61.98 62.69 2dub s VAL 134 Cb -0.15 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 31.98 2dub s VAL 134 CO -0.06 -0.56 -0.16 0.20 0.00 0.00 0.00 175.10 174.51 2dub s ASN 135 N 1.99 3.80 0.56 3.32 0.01 -1.26 -0.00 114.94 123.35 2dub s ASN 135 Ca 0.28 -0.33 0.00 0.00 -0.71 0.00 0.00 52.86 52.11 2dub s ASN 135 Cb -0.13 -1.18 0.00 0.00 0.41 0.00 0.00 41.25 40.35 2dub s ASN 135 CO 0.19 0.24 0.00 0.61 -1.51 0.00 0.00 177.10 176.64 2dub n GLY 136 N 2.98 1.58 3.72 0.66 0.00 -1.23 -1.96 105.19 110.94 2dub n GLY 136 Ca -0.18 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 2dub n GLY 136 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dub s TYR 137 N 0.00 3.35 -0.42 1.61 2.02 -0.87 -0.54 117.35 122.50 2dub s TYR 137 Ca 0.00 1.17 0.05 0.00 -0.37 0.00 0.00 57.07 57.92 2dub s TYR 137 Cb 0.00 -3.54 0.18 0.00 -0.40 0.00 0.00 41.96 38.20 2dub s TYR 137 CO 0.00 -1.75 0.37 0.00 -1.57 0.00 0.00 175.55 172.60 2dub n ALA 138 N 3.65 2.82 -2.53 3.71 0.00 -0.22 0.26 120.51 128.20 2dub n ALA 138 Ca 0.09 -3.20 -0.29 0.00 0.00 0.00 0.00 53.44 50.04 2dub n ALA 138 Cb 0.44 -0.77 -0.11 0.00 0.00 0.00 0.00 19.45 19.02 2dub n ALA 138 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2dub s LEU 139 N -0.19 2.87 0.00 0.00 1.43 -0.69 -3.07 118.68 119.03 2dub s LEU 139 Ca 0.33 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.95 2dub s LEU 139 Cb 0.06 -1.68 0.00 0.00 0.03 0.00 0.00 46.19 44.59 2dub s LEU 139 CO -0.18 0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.18 2dub n GLY 140 N 0.72 3.29 0.43 -3.19 0.00 -0.14 -0.28 105.19 106.02 2dub n GLY 140 Ca -0.14 0.01 0.25 0.00 0.00 0.00 0.00 46.02 46.14 2dub n GLY 140 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2dub h GLY 141 N 0.00 0.06 1.15 -0.02 0.00 -1.89 0.14 103.07 102.51 2dub h GLY 141 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 47.33 47.19 2dub h GLY 141 CO 0.00 0.00 -0.17 -1.33 0.00 0.00 0.00 176.54 175.04 2dub h GLY 142 N 0.03 1.07 1.07 4.60 0.00 -0.77 -0.82 103.07 108.24 2dub h GLY 142 Ca 0.36 -0.90 -0.12 0.00 0.00 0.00 0.00 47.33 46.66 2dub h GLY 142 CO -0.01 0.82 -0.22 0.00 0.00 0.00 0.00 176.54 177.13 2dub h GLU 144 N 0.74 0.79 -0.37 0.00 5.08 -1.07 -1.59 114.58 118.17 2dub h GLU 144 Ca 0.10 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 2dub h GLU 144 Cb 0.79 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 2dub h GLU 144 CO 0.06 0.77 0.07 1.25 -1.00 0.00 0.00 179.01 180.16 2dub h LEU 145 N 0.75 0.57 -0.89 1.33 5.85 -1.01 -1.61 115.31 120.30 2dub h LEU 145 Ca 0.16 -0.25 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 2dub h LEU 145 Cb 0.38 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 2dub h LEU 145 CO 0.01 0.68 0.31 0.00 -0.34 0.00 0.00 178.44 179.10 2dub h ALA 146 N 0.92 1.12 0.00 1.25 0.00 -1.15 -2.12 119.26 119.28 2dub h ALA 146 Ca 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2dub h ALA 146 Cb 0.34 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2dub h ALA 146 CO 0.00 0.63 0.00 0.52 0.00 0.00 0.00 179.25 180.41 2dub h MET 147 N 1.09 0.00 0.00 0.00 2.86 -1.01 -1.81 114.93 116.07 2dub h MET 147 Ca 0.25 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.87 2dub h MET 147 Cb 0.19 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.85 2dub h MET 147 CO -0.02 0.00 -0.11 0.52 1.06 0.00 0.00 176.91 178.35 2dub h MET 148 N 0.00 0.00 -7.19 1.72 2.07 -0.59 -3.45 114.93 107.49 2dub h MET 148 Ca 0.00 0.00 -0.50 0.00 -2.07 0.00 0.00 59.70 57.13 2dub h MET 148 Cb 0.48 0.00 0.08 0.00 -1.87 0.00 0.00 31.60 30.29 2dub h MET 148 CO 0.00 0.11 0.38 0.00 1.07 0.00 0.00 176.91 178.47 2dub h ASP 150 N 0.27 1.01 -4.42 0.00 3.32 -1.48 -3.45 116.42 111.67 2dub h ASP 150 Ca -0.47 -0.46 -0.43 0.00 0.02 0.00 0.00 57.03 55.70 2dub h ASP 150 Cb 1.23 -0.28 -0.22 0.00 0.22 0.00 0.00 39.33 40.28 2dub h ASP 150 CO 0.56 1.26 -0.79 -0.63 -1.72 0.00 0.00 179.24 177.92 2dub s ILE 151 N -4.43 1.15 -0.09 0.35 1.01 -1.15 -5.05 121.20 112.98 2dub s ILE 151 Ca -0.11 -1.24 0.01 0.00 0.00 0.00 0.00 60.65 59.31 2dub s ILE 151 Cb 0.11 -1.08 0.02 0.00 0.01 0.00 0.00 42.46 41.52 2dub s ILE 151 CO 0.88 -0.15 -0.10 -0.63 0.00 0.00 0.00 174.94 174.94 2dub s ILE 152 N -1.16 1.08 -0.09 2.92 1.01 -1.26 -0.54 121.20 123.17 2dub s ILE 152 Ca -0.01 -0.39 0.01 0.00 0.00 0.00 0.00 60.65 60.27 2dub s ILE 152 Cb -0.09 -1.04 -0.02 0.00 0.01 0.00 0.00 42.46 41.32 2dub s ILE 152 CO 0.02 0.36 -0.12 -0.31 0.00 0.00 0.00 174.94 174.89 2dub s TYR 153 N 1.16 2.79 -0.02 3.97 1.51 0.34 -1.94 117.35 125.17 2dub s TYR 153 Ca -0.05 -0.35 0.06 0.00 -1.01 0.00 0.00 57.07 55.72 2dub s TYR 153 Cb -0.14 -1.75 -0.02 0.00 -0.11 0.00 0.00 41.96 39.93 2dub s TYR 153 CO -0.02 0.02 -0.20 0.00 -1.11 0.00 0.00 175.55 174.24 2dub s ALA 154 N -0.21 2.44 0.64 3.71 0.00 0.09 -0.36 121.76 128.06 2dub s ALA 154 Ca 0.01 -1.08 -0.12 0.00 0.00 0.00 0.00 51.96 50.77 2dub s ALA 154 Cb -0.13 -0.74 -0.02 0.00 0.00 0.00 0.00 23.12 22.22 2dub s ALA 154 CO 0.03 0.55 1.04 0.20 0.00 0.00 0.00 175.76 177.58 2dub s GLY 155 N -0.81 1.79 0.47 0.00 0.00 0.99 -0.54 107.32 109.22 2dub s GLY 155 Ca 0.11 0.10 0.29 0.00 0.00 0.00 0.00 44.72 45.23 2dub s GLY 155 CO 0.01 0.40 1.76 -2.09 0.00 0.00 0.00 173.10 173.18 2dub h GLU 156 N -0.23 0.17 -0.47 2.90 4.81 -0.86 -1.35 114.58 119.55 2dub h GLU 156 Ca -0.45 -0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 58.59 2dub h GLU 156 Cb 1.20 -0.04 -0.11 0.00 0.63 0.00 0.00 28.75 30.44 2dub h GLU 156 CO 0.59 0.11 0.09 1.63 -0.73 0.00 0.00 179.01 180.70 2dub n LYS 157 N -4.43 2.49 -1.34 1.92 5.02 -1.26 -4.64 118.16 115.92 2dub n LYS 157 Ca 0.28 -3.05 -0.31 0.00 -2.02 0.00 0.00 58.31 53.20 2dub n LYS 157 Cb 1.15 -1.93 0.08 0.00 -0.02 0.00 0.00 35.03 34.31 2dub n LYS 157 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dub s ALA 158 N -3.10 2.32 -0.08 7.82 0.00 -0.51 -3.89 121.76 124.32 2dub s ALA 158 Ca 0.47 0.19 -0.05 0.00 0.00 0.00 0.00 51.96 52.57 2dub s ALA 158 Cb 0.40 -3.24 0.04 0.00 0.00 0.00 0.00 23.12 20.32 2dub s ALA 158 CO 0.06 -1.66 0.20 -0.65 0.00 0.00 0.00 175.76 173.71 2dub s GLN 159 N -4.95 0.17 0.06 0.00 -0.21 0.30 -3.01 119.66 112.02 2dub s GLN 159 Ca 0.60 0.42 0.08 0.00 0.02 0.00 0.00 55.36 56.49 2dub s GLN 159 Cb -0.16 -0.10 -0.03 0.00 1.00 0.00 0.00 33.01 33.72 2dub s GLN 159 CO 0.56 -0.14 -0.22 -0.06 -2.12 0.00 0.00 175.29 173.31 2dub s PHE 160 N 1.01 2.44 -0.20 0.91 0.40 -0.70 -1.06 117.98 120.78 2dub s PHE 160 Ca -0.07 -0.33 -0.36 0.00 -0.60 0.00 0.00 56.93 55.57 2dub s PHE 160 Cb -0.09 -1.40 0.14 0.00 0.51 0.00 0.00 43.02 42.18 2dub s PHE 160 CO -0.06 0.22 1.27 0.20 0.70 0.00 0.00 175.22 177.55 2dub s GLY 161 N -1.48 -0.28 -0.50 4.36 0.00 -1.17 -0.59 107.32 107.65 2dub s GLY 161 Ca 0.14 1.60 0.03 0.00 0.00 0.00 0.00 44.72 46.49 2dub s GLY 161 CO 0.04 0.52 0.31 1.20 0.00 0.00 0.00 173.10 175.17 2dub s GLN 162 N -2.30 1.59 0.00 2.90 -1.52 -1.26 -0.96 119.66 118.10 2dub s GLN 162 Ca 0.11 -2.39 0.05 0.00 -1.95 0.00 0.00 55.36 51.17 2dub s GLN 162 Cb -0.00 -2.58 0.20 0.00 -0.22 0.00 0.00 33.01 30.41 2dub s GLN 162 CO -0.04 -1.21 1.15 -0.35 -0.25 0.00 0.00 175.29 174.59 2dub n PRO 163 N 3.05 1.27 -0.31 2.91 -0.04 -1.26 -4.17 135.00 136.45 2dub n PRO 163 Ca 0.13 -0.42 0.24 0.00 -0.04 0.00 0.00 63.50 63.40 2dub n PRO 163 Cb 0.36 -1.12 0.53 0.00 -0.04 0.00 0.00 33.50 33.24 2dub n PRO 163 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2dub h GLU 164 N 0.71 0.34 -0.71 0.54 3.07 -1.90 0.17 114.58 116.80 2dub h GLU 164 Ca 0.00 -0.02 0.01 0.00 -0.50 0.00 0.00 59.36 58.85 2dub h GLU 164 Cb 0.16 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 27.96 2dub h GLU 164 CO 0.00 0.23 0.47 0.97 -1.40 0.00 0.00 179.01 179.28 2dub h ILE 165 N 0.35 1.18 0.00 3.13 6.09 -1.57 -0.32 117.51 126.37 2dub h ILE 165 Ca 0.58 -0.33 0.00 0.00 -1.37 0.00 0.00 64.86 63.74 2dub h ILE 165 Cb 1.55 0.14 0.00 0.00 0.47 0.00 0.00 36.82 38.97 2dub h ILE 165 CO -0.26 0.17 0.00 -0.07 -3.07 0.00 0.00 178.15 174.93 2dub h LEU 166 N 0.96 0.00 -2.71 2.19 3.38 -1.22 -1.74 115.31 116.16 2dub h LEU 166 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2dub h LEU 166 Cb -0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.65 2dub h LEU 166 CO -0.06 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.65 2dub n LEU 167 N -2.56 3.61 -0.28 1.67 4.77 -0.20 -4.94 117.00 119.07 2dub n LEU 167 Ca 0.00 -1.93 -0.03 0.00 -0.03 0.00 0.00 56.01 54.03 2dub n LEU 167 Cb 0.18 -0.39 -0.01 0.00 -2.33 0.00 0.00 43.42 40.87 2dub n LEU 167 CO 0.19 0.89 -0.03 0.61 -1.33 0.00 0.00 177.39 177.71 2dub n GLY 168 N 1.33 0.45 3.39 -0.72 0.00 -0.65 -5.03 105.19 103.95 2dub n GLY 168 Ca 0.20 -0.86 -0.17 0.00 0.00 0.00 0.00 46.02 45.19 2dub n GLY 168 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dub s THR 169 N -2.13 0.00 0.28 2.61 -1.32 -0.76 -5.02 115.64 109.30 2dub s THR 169 Ca 0.00 -1.81 0.11 0.00 -1.21 0.00 0.00 61.69 58.78 2dub s THR 169 Cb 0.00 -2.58 -0.05 0.00 -1.51 0.00 0.00 72.50 68.35 2dub s THR 169 CO 0.00 0.00 -0.17 0.27 -2.21 0.00 0.00 174.62 172.51 2dub s ILE 170 N -3.20 2.29 0.28 5.08 -4.36 -1.26 -1.89 121.20 118.14 2dub s ILE 170 Ca 0.36 -2.34 -0.30 0.00 -0.26 0.00 0.00 60.65 58.11 2dub s ILE 170 Cb 0.01 -2.31 -0.13 0.00 1.25 0.00 0.00 42.46 41.27 2dub s ILE 170 CO 0.25 -0.40 1.33 -2.65 0.24 0.00 0.00 174.94 173.71 2dub n PRO 171 N -0.60 2.00 -0.03 0.37 -0.02 -1.26 -4.89 135.00 130.56 2dub n PRO 171 Ca -0.05 0.71 0.04 0.00 -2.02 0.00 0.00 63.50 62.17 2dub n PRO 171 Cb 0.61 -2.31 0.05 0.00 -0.02 0.00 0.00 33.50 31.83 2dub n PRO 171 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dub n GLY 172 N 1.57 3.53 2.61 -1.23 0.00 -1.26 -4.68 105.19 105.73 2dub n GLY 172 Ca 0.09 -0.43 -0.13 0.00 0.00 0.00 0.00 46.02 45.55 2dub n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dub n ALA 173 N -0.84 3.75 -0.76 4.61 0.00 -1.26 -4.93 120.51 121.09 2dub n ALA 173 Ca 0.06 -3.38 0.00 0.00 0.00 0.00 0.00 53.44 50.12 2dub n ALA 173 Cb 0.41 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.05 2dub n ALA 173 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dub n GLY 174 N -0.25 0.71 0.34 0.00 0.00 -1.26 -4.81 105.19 99.92 2dub n GLY 174 Ca 0.17 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.22 2dub n GLY 174 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2dub h GLY 175 N 0.00 0.95 1.25 -0.02 0.00 -1.92 0.17 103.07 103.50 2dub h GLY 175 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.99 2dub h GLY 175 CO 0.00 0.31 -0.31 -1.30 0.00 0.00 0.00 176.54 175.24 2dub n THR 176 N -4.45 0.00 -0.11 4.70 -2.24 -1.26 -3.32 114.28 107.60 2dub n THR 176 Ca 0.08 -0.01 -0.22 0.00 -2.27 0.00 0.00 64.05 61.63 2dub n THR 176 Cb 0.08 0.01 -0.07 0.00 -2.10 0.00 0.00 70.33 68.25 2dub n THR 176 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dub n GLN 177 N -1.42 0.51 0.06 -0.78 1.13 -0.69 -4.15 117.38 112.04 2dub n GLN 177 Ca 0.07 0.22 -0.09 0.00 -1.94 0.00 0.00 57.00 55.26 2dub n GLN 177 Cb 0.33 -1.37 0.04 0.00 0.11 0.00 0.00 30.24 29.35 2dub n GLN 177 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2dub h ARG 178 N -0.89 0.35 -0.05 -1.09 3.08 -0.90 -2.35 114.38 112.52 2dub h ARG 178 Ca -0.46 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 59.28 2dub h ARG 178 Cb 1.38 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 31.49 2dub h ARG 178 CO -0.28 0.94 -0.01 1.25 -1.07 0.00 0.00 179.97 180.80 2dub h LEU 179 N 0.24 0.09 -0.28 3.04 5.85 -1.68 -2.35 115.31 120.22 2dub h LEU 179 Ca -0.03 -0.34 0.03 0.00 0.84 0.00 0.00 57.88 58.38 2dub h LEU 179 Cb 1.30 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 2dub h LEU 179 CO 0.12 0.41 0.11 0.74 -0.34 0.00 0.00 178.44 179.48 2dub h THR 180 N -0.22 0.94 0.00 1.05 2.02 -1.72 0.33 112.91 115.31 2dub h THR 180 Ca 0.01 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 2dub h THR 180 Cb 0.36 0.68 -0.00 0.00 -1.74 0.00 0.00 68.15 67.46 2dub h THR 180 CO 0.00 0.04 -0.05 0.03 0.37 0.00 0.00 175.52 175.92 2dub h ARG 181 N 0.24 0.00 0.02 6.66 3.08 -1.40 0.19 114.38 123.18 2dub h ARG 181 Ca 0.12 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.80 2dub h ARG 181 Cb 0.08 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.07 2dub h ARG 181 CO -0.11 0.05 -2.26 0.00 -1.07 0.00 0.00 179.97 176.58 2dub n ALA 182 N -2.23 1.35 0.54 0.04 0.00 -0.77 -4.64 120.51 114.81 2dub n ALA 182 Ca -0.02 -1.02 0.08 0.00 0.00 0.00 0.00 53.44 52.48 2dub n ALA 182 Cb 0.17 -0.34 -0.11 0.00 0.00 0.00 0.00 19.45 19.17 2dub n ALA 182 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2dub n VAL 183 N -3.14 0.00 0.00 0.00 0.31 0.11 -4.45 118.33 111.17 2dub n VAL 183 Ca -0.36 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 63.77 2dub n VAL 183 Cb 1.06 0.70 0.00 0.00 -0.91 0.00 0.00 33.84 34.68 2dub n VAL 183 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dub n GLY 184 N 1.43 0.86 0.18 2.92 0.00 0.66 -4.55 105.19 106.69 2dub n GLY 184 Ca 0.01 -1.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.18 2dub n GLY 184 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2dub h LYS 185 N 0.00 0.54 0.32 1.61 3.64 -1.95 -2.28 116.57 118.46 2dub h LYS 185 Ca 0.00 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2dub h LYS 185 Cb 0.00 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 2dub h LYS 185 CO 0.00 0.55 -0.35 1.03 -2.27 0.00 0.00 179.45 178.41 2dub h SER 186 N 0.42 -0.95 -0.60 4.20 0.87 -1.97 0.12 113.55 115.65 2dub h SER 186 Ca 0.12 0.09 -0.09 0.00 -1.23 0.00 0.00 61.79 60.67 2dub h SER 186 Cb 0.23 0.32 -0.02 0.00 -0.44 0.00 0.00 62.40 62.49 2dub h SER 186 CO -0.01 -0.48 0.02 0.25 -0.53 0.00 0.00 176.83 176.08 2dub h LEU 187 N -0.71 1.01 -0.56 2.23 5.85 -1.80 -1.89 115.31 119.45 2dub h LEU 187 Ca -0.02 -0.30 0.01 0.00 0.84 0.00 0.00 57.88 58.42 2dub h LEU 187 Cb 0.65 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 2dub h LEU 187 CO -0.08 1.06 0.36 0.00 -0.34 0.00 0.00 178.44 179.44 2dub h ALA 188 N 0.99 0.71 -0.62 1.25 0.00 -1.21 -0.59 119.26 119.79 2dub h ALA 188 Ca 0.17 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 2dub h ALA 188 Cb 0.53 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2dub h ALA 188 CO 0.03 0.11 0.22 0.52 0.00 0.00 0.00 179.25 180.13 2dub h MET 189 N 0.72 0.95 -0.20 0.00 2.86 -0.61 -0.69 114.93 117.95 2dub h MET 189 Ca 0.21 -0.19 0.01 0.00 -2.06 0.00 0.00 59.70 57.67 2dub h MET 189 Cb -0.04 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.46 2dub h MET 189 CO -0.07 0.82 0.12 1.49 1.06 0.00 0.00 176.91 180.34 2dub h GLU 190 N 0.88 0.24 -0.04 1.72 4.81 -0.83 -0.61 114.58 120.76 2dub h GLU 190 Ca 0.20 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2dub h GLU 190 Cb 0.25 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 2dub h GLU 190 CO -0.01 0.16 -0.00 0.52 -0.73 0.00 0.00 179.01 178.95 2dub h MET 191 N 0.25 0.07 -0.36 1.92 2.86 -0.94 -2.27 114.93 116.46 2dub h MET 191 Ca 0.08 -0.02 -0.10 0.00 -2.06 0.00 0.00 59.70 57.59 2dub h MET 191 Cb -0.01 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 2dub h MET 191 CO -0.03 0.37 -0.18 0.28 1.06 0.00 0.00 176.91 178.41 2dub h VAL 192 N -0.24 1.26 0.00 -2.22 2.07 -1.11 0.28 116.25 116.29 2dub h VAL 192 Ca 0.01 -1.24 -0.09 0.00 0.82 0.00 0.00 66.70 66.21 2dub h VAL 192 Cb 0.34 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 2dub h VAL 192 CO 0.00 0.41 -0.63 -0.07 0.02 0.00 0.00 177.57 177.30 2dub h LEU 193 N 0.60 0.00 0.00 2.57 3.38 -1.15 -3.37 115.31 117.34 2dub h LEU 193 Ca 0.09 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 2dub h LEU 193 Cb 0.65 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2dub h LEU 193 CO 0.05 0.37 -1.60 0.35 0.09 0.00 0.00 178.44 177.70 2dub n THR 194 N -3.08 0.33 -0.84 0.22 -2.24 -0.86 -4.97 114.28 102.84 2dub n THR 194 Ca -0.00 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 2dub n THR 194 Cb 0.70 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 2dub n THR 194 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dub n GLY 195 N 2.10 0.61 3.75 3.38 0.00 0.99 -4.83 105.19 111.20 2dub n GLY 195 Ca -0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 2dub n GLY 195 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dub s ASP 196 N -2.08 4.99 0.17 1.61 1.11 -1.23 -4.38 116.67 116.85 2dub s ASP 196 Ca 0.00 2.29 0.03 0.00 0.18 0.00 0.00 52.55 55.05 2dub s ASP 196 Cb 0.00 -2.59 -0.03 0.00 1.07 0.00 0.00 42.92 41.37 2dub s ASP 196 CO 0.00 -1.72 0.30 -0.13 1.18 0.00 0.00 175.17 174.80 2dub s ARG 197 N -3.60 3.44 0.12 8.23 0.52 -1.26 -4.43 118.95 121.97 2dub s ARG 197 Ca 0.74 -0.63 0.09 0.00 -0.52 0.00 0.00 55.73 55.41 2dub s ARG 197 Cb -0.28 -2.95 -0.04 0.00 0.52 0.00 0.00 34.95 32.21 2dub s ARG 197 CO 0.37 0.50 -0.22 0.96 0.02 0.00 0.00 175.30 176.93 2dub s ILE 198 N -1.80 1.82 0.96 1.52 -4.36 0.24 -4.96 121.20 114.63 2dub s ILE 198 Ca 0.34 -1.63 -0.14 0.00 -0.26 0.00 0.00 60.65 58.96 2dub s ILE 198 Cb -0.11 -1.67 0.17 0.00 1.25 0.00 0.00 42.46 42.10 2dub s ILE 198 CO 0.29 -0.07 1.18 -0.94 0.24 0.00 0.00 174.94 175.64 2dub s SER 199 N -2.03 3.13 0.16 4.36 1.04 -1.26 -1.73 113.70 117.37 2dub s SER 199 Ca 0.09 0.73 -0.12 0.00 0.48 0.00 0.00 55.95 57.13 2dub s SER 199 Cb -0.09 -1.12 0.05 0.00 0.10 0.00 0.00 66.02 64.95 2dub s SER 199 CO 0.05 -2.76 1.66 0.00 0.98 0.00 0.00 173.24 173.16 2dub h ALA 200 N -1.65 0.73 -0.59 5.32 0.00 -1.80 0.08 119.26 121.36 2dub h ALA 200 Ca -0.48 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.15 2dub h ALA 200 Cb 1.30 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 2dub h ALA 200 CO 0.53 0.46 0.20 1.96 0.00 0.00 0.00 179.25 182.40 2dub h GLN 201 N 0.80 0.87 -0.13 0.00 7.50 -1.90 -0.11 115.11 122.13 2dub h GLN 201 Ca 0.17 -0.15 -0.03 0.00 0.50 0.00 0.00 58.65 59.14 2dub h GLN 201 Cb 0.39 -0.14 -0.00 0.00 0.05 0.00 0.00 27.48 27.78 2dub h GLN 201 CO 0.01 0.74 -0.02 -0.44 -1.50 0.00 0.00 178.83 177.63 2dub h ASP 202 N 0.85 0.24 -0.82 1.46 3.32 -1.81 -1.31 116.42 118.36 2dub h ASP 202 Ca 0.20 -0.34 0.01 0.00 0.02 0.00 0.00 57.03 56.92 2dub h ASP 202 Cb 0.23 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 39.67 2dub h ASP 202 CO -0.01 0.52 0.54 0.00 -1.72 0.00 0.00 179.24 178.58 2dub h ALA 203 N 0.73 1.43 -0.09 3.45 0.00 -0.56 0.14 119.26 124.35 2dub h ALA 203 Ca 0.04 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2dub h ALA 203 Cb 0.41 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2dub h ALA 203 CO 0.01 0.52 -0.18 -0.22 0.00 0.00 0.00 179.25 179.38 2dub h LYS 204 N 1.10 0.28 -0.94 0.00 3.64 -0.95 0.37 116.57 120.06 2dub h LYS 204 Ca 0.31 -0.18 0.07 0.00 -1.27 0.00 0.00 60.65 59.57 2dub h LYS 204 Cb -0.10 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 31.68 2dub h LYS 204 CO -0.07 0.77 0.59 0.37 -2.27 0.00 0.00 179.45 178.85 2dub h GLN 205 N -0.18 1.03 0.00 1.90 5.75 -0.89 -1.26 115.11 121.47 2dub h GLN 205 Ca 0.00 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.44 2dub h GLN 205 Cb 0.76 -0.23 0.00 0.00 1.07 0.00 0.00 27.48 29.08 2dub h GLN 205 CO 0.04 0.68 0.00 0.00 -2.65 0.00 0.00 178.83 176.90 2dub h ALA 206 N 1.44 1.00 0.00 3.38 0.00 -0.94 -3.47 119.26 120.67 2dub h ALA 206 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2dub h ALA 206 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2dub h ALA 206 CO -0.18 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.48 2dub n GLY 207 N 0.87 0.84 0.24 0.00 0.00 -0.47 -4.31 105.19 102.36 2dub n GLY 207 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 2dub n GLY 207 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2dub h LEU 208 N 0.00 0.91 -8.66 0.99 5.85 -0.52 -3.45 115.31 110.43 2dub h LEU 208 Ca 0.00 -0.50 -0.53 0.00 0.84 0.00 0.00 57.88 57.69 2dub h LEU 208 Cb 0.00 -0.26 -0.21 0.00 0.37 0.00 0.00 40.66 40.56 2dub h LEU 208 CO 0.00 1.29 -0.81 0.68 -0.34 0.00 0.00 178.44 179.26 2dub s VAL 209 N -4.05 1.64 -0.65 1.05 -7.23 -1.08 -4.70 120.40 105.37 2dub s VAL 209 Ca -0.10 -1.56 0.22 0.00 -1.81 0.00 0.00 61.98 58.72 2dub s VAL 209 Cb 0.10 -1.53 -0.25 0.00 0.56 0.00 0.00 36.38 35.27 2dub s VAL 209 CO 0.88 -0.12 0.79 -1.54 -0.31 0.00 0.00 175.10 174.80 2dub n SER 210 N 1.00 0.64 -3.79 4.85 3.41 -0.82 -4.20 113.62 114.71 2dub n SER 210 Ca -0.19 -0.58 -0.12 0.00 -0.26 0.00 0.00 58.87 57.72 2dub n SER 210 Cb 0.54 1.27 -0.08 0.00 -0.26 0.00 0.00 64.21 65.68 2dub n SER 210 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2dub s LYS 211 N -3.18 0.69 -0.08 4.33 -0.14 -1.25 -5.08 119.74 115.03 2dub s LYS 211 Ca 0.03 -0.41 0.01 0.00 -1.36 0.00 0.00 55.97 54.24 2dub s LYS 211 Cb 0.15 0.30 0.02 0.00 -1.68 0.00 0.00 37.83 36.62 2dub s LYS 211 CO 0.87 -0.20 -0.11 0.42 -0.76 0.00 0.00 175.35 175.57 2dub s ILE 212 N -1.97 1.13 0.15 2.17 1.01 -1.26 -0.73 121.20 121.70 2dub s ILE 212 Ca -0.09 -0.43 0.06 0.00 0.00 0.00 0.00 60.65 60.18 2dub s ILE 212 Cb -0.03 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.33 2dub s ILE 212 CO -0.00 0.36 -0.13 -0.36 0.00 0.00 0.00 174.94 174.81 2dub s PHE 213 N 1.00 1.46 0.54 3.97 0.08 0.30 -4.93 117.98 120.40 2dub s PHE 213 Ca -0.08 -0.61 -0.21 0.00 0.12 0.00 0.00 56.93 56.15 2dub s PHE 213 Cb -0.15 -0.73 -0.06 0.00 -0.57 0.00 0.00 43.02 41.52 2dub s PHE 213 CO -0.00 0.19 1.20 -2.30 -0.10 0.00 0.00 175.22 174.21 2dub n PRO 214 N 0.09 1.42 -0.25 0.24 -0.02 -1.26 -0.21 135.00 135.01 2dub n PRO 214 Ca -0.12 0.53 0.05 0.00 -2.02 0.00 0.00 63.50 61.93 2dub n PRO 214 Cb 0.59 -2.39 0.16 0.00 -0.02 0.00 0.00 33.50 31.84 2dub n PRO 214 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2dub h VAL 215 N 1.17 0.40 -0.21 -1.45 2.07 -1.94 -1.05 116.25 115.25 2dub h VAL 215 Ca -0.49 -0.05 -0.03 0.00 0.82 0.00 0.00 66.70 66.95 2dub h VAL 215 Cb 1.33 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 2dub h VAL 215 CO 0.55 0.03 -0.03 -0.33 0.02 0.00 0.00 177.57 177.81 2dub h GLU 216 N 0.14 0.31 -0.02 1.57 3.07 -2.01 -3.16 114.58 114.48 2dub h GLU 216 Ca 0.40 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.21 2dub h GLU 216 Cb 0.70 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.56 2dub h GLU 216 CO -0.61 0.36 -0.07 0.25 -1.40 0.00 0.00 179.01 177.54 2dub n THR 217 N -4.34 0.00 -0.10 1.13 -2.24 -0.86 -4.73 114.28 103.14 2dub n THR 217 Ca 0.00 -0.47 -0.14 0.00 -2.27 0.00 0.00 64.05 61.17 2dub n THR 217 Cb 0.21 1.27 -0.10 0.00 -2.10 0.00 0.00 70.33 69.61 2dub n THR 217 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2dub h LEU 218 N 2.57 -1.80 -1.43 3.22 5.85 -1.17 0.06 115.31 122.60 2dub h LEU 218 Ca 0.00 0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.95 2dub h LEU 218 Cb 0.58 0.73 -0.03 0.00 0.37 0.00 0.00 40.66 42.31 2dub h LEU 218 CO 0.00 -0.42 0.37 0.58 -0.34 0.00 0.00 178.44 178.63 2dub h VAL 219 N -0.44 1.15 -0.23 1.05 2.07 -1.85 -0.54 116.25 117.46 2dub h VAL 219 Ca 0.06 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 2dub h VAL 219 Cb 0.61 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 2dub h VAL 219 CO -0.54 0.15 0.07 -0.08 0.02 0.00 0.00 177.57 177.18 2dub h GLU 220 N 0.77 0.37 -0.76 1.57 4.81 -1.67 -1.49 114.58 118.18 2dub h GLU 220 Ca 0.21 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.33 2dub h GLU 220 Cb -0.08 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.22 2dub h GLU 220 CO -0.04 0.46 0.37 0.93 -0.73 0.00 0.00 179.01 180.00 2dub h GLU 221 N 0.20 1.08 -0.29 1.92 4.39 -0.34 -1.19 114.58 120.35 2dub h GLU 221 Ca 0.07 -0.15 -0.09 0.00 0.34 0.00 0.00 59.36 59.53 2dub h GLU 221 Cb 0.25 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 2dub h GLU 221 CO -0.00 0.83 -0.22 0.00 -1.16 0.00 0.00 179.01 178.46 2dub h ALA 222 N 1.33 1.08 -0.32 3.43 0.00 -0.95 -2.29 119.26 121.54 2dub h ALA 222 Ca 0.26 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 2dub h ALA 222 Cb 0.10 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2dub h ALA 222 CO -0.03 0.56 -0.28 0.82 0.00 0.00 0.00 179.25 180.32 2dub h ILE 223 N 0.49 1.28 -0.71 0.00 2.04 -0.54 -0.10 117.51 119.97 2dub h ILE 223 Ca 0.07 -1.39 -0.03 0.00 1.00 0.00 0.00 64.86 64.52 2dub h ILE 223 Cb 0.65 1.33 -0.03 0.00 -0.74 0.00 0.00 36.82 38.02 2dub h ILE 223 CO 0.05 0.45 0.33 1.56 0.00 0.00 0.00 178.15 180.54 2dub h GLN 224 N 0.57 1.02 -0.39 2.37 4.20 -0.89 0.17 115.11 122.15 2dub h GLN 224 Ca 0.07 -0.15 -0.11 0.00 0.06 0.00 0.00 58.65 58.52 2dub h GLN 224 Cb 0.77 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 2dub h GLN 224 CO 0.06 0.81 -0.18 0.00 -0.67 0.00 0.00 178.83 178.85 2dub h ALA 226 N 0.81 1.57 0.06 0.00 0.00 -0.58 -1.89 119.26 119.22 2dub h ALA 226 Ca 0.09 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2dub h ALA 226 Cb 0.74 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2dub h ALA 226 CO 0.06 0.32 -0.03 1.49 0.00 0.00 0.00 179.25 181.08 2dub h GLU 227 N 0.27 -0.07 -0.62 0.00 4.81 -0.30 0.11 114.58 118.77 2dub h GLU 227 Ca 0.06 0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.40 2dub h GLU 227 Cb 0.28 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.60 2dub h GLU 227 CO 0.01 0.21 0.19 0.87 -0.73 0.00 0.00 179.01 179.57 2dub h LYS 228 N -0.36 0.34 -0.69 1.92 1.57 -0.93 0.51 116.57 118.93 2dub h LYS 228 Ca -0.01 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 2dub h LYS 228 Cb 0.32 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 2dub h LYS 228 CO 0.01 0.22 0.24 0.82 -0.57 0.00 0.00 179.45 180.17 2dub h ILE 229 N 0.35 1.25 0.00 1.86 2.04 -1.20 -2.31 117.51 119.50 2dub h ILE 229 Ca 0.32 -0.84 -0.04 0.00 1.00 0.00 0.00 64.86 65.30 2dub h ILE 229 Cb 0.45 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 2dub h ILE 229 CO -0.36 0.33 -0.19 0.00 0.00 0.00 0.00 178.15 177.93 2dub h ALA 230 N 1.11 1.33 -0.10 1.87 0.00 0.52 -2.56 119.26 121.43 2dub h ALA 230 Ca 0.22 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2dub h ALA 230 Cb 0.27 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2dub h ALA 230 CO -0.01 0.23 0.03 -0.91 0.00 0.00 0.00 179.25 178.59 2dub h ASN 231 N 0.00 0.11 -4.30 0.00 2.35 -0.37 -3.44 115.58 109.94 2dub h ASN 231 Ca -0.00 -0.01 -0.46 0.00 -0.55 0.00 0.00 56.30 55.29 2dub h ASN 231 Cb 0.44 -0.03 0.13 0.00 0.05 0.00 0.00 38.32 38.91 2dub h ASN 231 CO 0.02 0.12 0.41 0.20 -1.65 0.00 0.00 177.43 176.53 2dub s ASN 232 N -6.97 3.71 0.03 5.81 0.01 -0.97 -4.85 114.94 111.72 2dub s ASN 232 Ca -0.06 0.54 -0.30 0.00 -0.71 0.00 0.00 52.86 52.33 2dub s ASN 232 Cb 0.17 -0.81 -0.06 0.00 0.41 0.00 0.00 41.25 40.95 2dub s ASN 232 CO 0.69 -2.38 1.41 -0.55 -1.51 0.00 0.00 177.10 174.75 2dub s SER 233 N -4.69 6.84 0.13 -1.22 0.15 -1.26 -4.90 113.70 108.75 2dub s SER 233 Ca 0.68 2.17 -0.27 0.00 0.70 0.00 0.00 55.95 59.23 2dub s SER 233 Cb -0.08 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 61.62 2dub s SER 233 CO 0.51 -0.71 1.61 0.11 1.20 0.00 0.00 173.24 175.97 2dub h LYS 234 N 7.62 -0.43 -0.84 5.44 1.57 -1.87 0.90 116.57 128.95 2dub h LYS 234 Ca -0.39 0.03 0.09 0.00 -1.87 0.00 0.00 60.65 58.50 2dub h LYS 234 Cb 1.19 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.53 2dub h LYS 234 CO 0.89 -0.29 0.49 0.97 -0.57 0.00 0.00 179.45 180.95 2dub h ILE 235 N -0.45 0.95 -0.34 1.86 2.10 -1.91 0.87 117.51 120.59 2dub h ILE 235 Ca 0.07 -0.29 -0.17 0.00 1.08 0.00 0.00 64.86 65.56 2dub h ILE 235 Cb 0.56 0.03 -0.00 0.00 -1.09 0.00 0.00 36.82 36.31 2dub h ILE 235 CO -0.30 0.15 -0.44 0.40 -1.08 0.00 0.00 178.15 176.88 2dub h ILE 236 N 0.84 1.28 -0.77 2.19 1.08 -1.86 -2.36 117.51 117.91 2dub h ILE 236 Ca 0.39 -1.62 -0.02 0.00 -0.39 0.00 0.00 64.86 63.22 2dub h ILE 236 Cb 0.31 1.49 -0.04 0.00 -3.07 0.00 0.00 36.82 35.51 2dub h ILE 236 CO -0.23 0.54 0.42 0.58 -0.69 0.00 0.00 178.15 178.77 2dub h VAL 237 N 0.70 1.23 -0.35 1.67 2.07 0.06 -0.76 116.25 120.86 2dub h VAL 237 Ca 0.04 -0.58 -0.05 0.00 0.82 0.00 0.00 66.70 66.93 2dub h VAL 237 Cb 1.03 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 2dub h VAL 237 CO 0.10 0.26 0.01 0.00 0.02 0.00 0.00 177.57 177.96 2dub h ALA 238 N 1.22 1.36 -0.23 1.67 0.00 -0.71 -1.09 119.26 121.48 2dub h ALA 238 Ca 0.27 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 2dub h ALA 238 Cb 0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2dub h ALA 238 CO -0.04 0.44 -0.40 0.52 0.00 0.00 0.00 179.25 179.77 2dub h MET 239 N 0.52 0.67 -0.30 0.00 2.07 -0.86 -2.20 114.93 114.84 2dub h MET 239 Ca 0.11 -0.42 -0.01 0.00 -2.07 0.00 0.00 59.70 57.31 2dub h MET 239 Cb 0.32 0.05 -0.01 0.00 -1.87 0.00 0.00 31.60 30.09 2dub h MET 239 CO 0.01 1.04 0.15 0.00 1.07 0.00 0.00 176.91 179.18 2dub h ALA 240 N 0.63 0.39 -0.87 6.32 0.00 -0.82 -0.85 119.26 124.06 2dub h ALA 240 Ca 0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2dub h ALA 240 Cb 0.99 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 2dub h ALA 240 CO 0.09 -0.06 0.53 -0.22 0.00 0.00 0.00 179.25 179.59 2dub h LYS 241 N 0.36 1.18 -0.42 0.00 3.64 -1.22 -0.59 116.57 119.52 2dub h LYS 241 Ca 0.10 -0.10 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 2dub h LYS 241 Cb 0.11 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 2dub h LYS 241 CO -0.01 0.82 -0.10 1.49 -2.27 0.00 0.00 179.45 179.38 2dub h GLU 242 N 1.20 0.73 0.01 1.90 4.81 -1.02 -2.03 114.58 120.19 2dub h GLU 242 Ca 0.31 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2dub h GLU 242 Cb -0.06 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.25 2dub h GLU 242 CO -0.06 0.81 -0.00 1.03 -0.73 0.00 0.00 179.01 180.05 2dub h SER 243 N 0.67 -0.01 -0.78 1.04 0.87 -0.09 -2.27 113.55 112.98 2dub h SER 243 Ca 0.12 -0.30 0.03 0.00 -1.23 0.00 0.00 61.79 60.41 2dub h SER 243 Cb 0.55 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.47 2dub h SER 243 CO 0.03 0.29 0.50 0.58 -0.53 0.00 0.00 176.83 177.70 2dub h VAL 244 N -0.32 1.13 -0.25 2.23 2.07 -1.11 -1.88 116.25 118.12 2dub h VAL 244 Ca -0.00 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 2dub h VAL 244 Cb 0.31 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 2dub h VAL 244 CO 0.00 0.18 0.05 0.78 0.02 0.00 0.00 177.57 178.60 2dub h ASN 245 N 0.98 0.32 0.30 0.57 2.35 -1.30 -1.86 115.58 116.95 2dub h ASN 245 Ca 0.31 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 2dub h ASN 245 Cb -0.01 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.28 2dub h ASN 245 CO -0.10 0.34 0.00 0.00 -1.65 0.00 0.00 177.43 176.01 2dub h ALA 246 N 1.71 1.00 0.00 -0.83 0.00 -0.73 -2.18 119.26 118.24 2dub h ALA 246 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2dub h ALA 246 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2dub h ALA 246 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2dub h ALA 247 N 2.01 1.00 -0.22 0.00 0.00 -1.33 -0.87 119.26 119.84 2dub h ALA 247 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dub h ALA 247 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2dub h ALA 247 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.44 2dub n PHE 248 N -2.39 0.29 -0.06 0.00 3.72 -0.82 -4.57 117.46 113.63 2dub n PHE 248 Ca -0.02 -0.25 0.00 0.00 -0.05 0.00 0.00 57.45 57.13 2dub n PHE 248 Cb 0.04 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 2dub n PHE 248 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2dub n GLU 249 N 0.75 -0.34 -3.84 -1.08 -0.58 -0.34 -5.09 120.64 110.12 2dub n GLU 249 Ca 0.11 -0.63 -0.07 0.00 -0.42 0.00 0.00 57.16 56.15 2dub n GLU 249 Cb 0.40 -0.97 -0.02 0.00 -0.57 0.00 0.00 31.44 30.28 2dub n GLU 249 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2dub s MET 250 N -0.15 1.77 0.82 3.49 0.23 -1.18 -5.10 119.30 119.19 2dub s MET 250 Ca 0.00 -0.97 -0.11 0.00 -1.03 0.00 0.00 55.69 53.57 2dub s MET 250 Cb 0.00 0.61 0.09 0.00 -1.53 0.00 0.00 34.83 34.00 2dub s MET 250 CO 0.00 -0.81 1.14 0.95 -2.03 0.00 0.00 175.02 174.27 2dub s THR 251 N -3.91 2.56 0.26 3.16 -4.23 -1.26 -4.70 115.64 107.52 2dub s THR 251 Ca 0.11 0.20 -0.03 0.00 -1.18 0.00 0.00 61.69 60.79 2dub s THR 251 Cb -0.06 -2.50 0.24 0.00 1.34 0.00 0.00 72.50 71.52 2dub s THR 251 CO 0.06 -0.22 1.83 0.25 -0.54 0.00 0.00 174.62 176.01 2dub h LEU 252 N -1.22 0.81 0.05 4.79 5.85 -1.97 0.10 115.31 123.73 2dub h LEU 252 Ca -0.44 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.33 2dub h LEU 252 Cb 1.26 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.14 2dub h LEU 252 CO 0.47 0.47 -0.17 0.74 -0.34 0.00 0.00 178.44 179.61 2dub h THR 253 N 0.92 0.59 0.00 1.05 2.02 -1.99 -0.33 112.91 115.17 2dub h THR 253 Ca 0.42 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.49 2dub h THR 253 Cb 0.33 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.32 2dub h THR 253 CO -0.23 0.00 -0.56 -0.33 0.37 0.00 0.00 175.52 174.77 2dub h GLU 254 N -0.31 0.00 -0.54 6.66 4.39 -1.82 -2.33 114.58 120.63 2dub h GLU 254 Ca 0.04 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.68 2dub h GLU 254 Cb 0.35 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 2dub h GLU 254 CO -0.13 0.56 0.10 0.78 -1.16 0.00 0.00 179.01 179.16 2dub h GLY 255 N 1.68 0.95 1.82 -3.84 0.00 -0.36 -0.73 103.07 102.59 2dub h GLY 255 Ca -0.01 -0.62 -0.09 0.00 0.00 0.00 0.00 47.33 46.61 2dub h GLY 255 CO 0.07 0.58 -0.36 3.43 0.00 0.00 0.00 176.54 180.26 2dub h ASN 256 N 0.77 0.21 -0.22 0.19 2.35 -0.88 -0.56 115.58 117.45 2dub h ASN 256 Ca 0.17 -0.08 -0.09 0.00 -0.55 0.00 0.00 56.30 55.74 2dub h ASN 256 Cb 0.38 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.69 2dub h ASN 256 CO 0.01 0.56 -0.23 0.11 -1.65 0.00 0.00 177.43 176.23 2dub h LYS 257 N 0.18 0.54 -0.56 0.81 1.57 -1.02 -1.51 116.57 116.58 2dub h LYS 257 Ca 0.02 -0.29 -0.03 0.00 -1.87 0.00 0.00 60.65 58.48 2dub h LYS 257 Cb 0.73 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.02 2dub h LYS 257 CO 0.05 0.88 0.24 1.25 -0.57 0.00 0.00 179.45 181.30 2dub h LEU 258 N 0.22 0.75 -1.16 2.94 5.85 -0.91 -1.67 115.31 121.33 2dub h LEU 258 Ca 0.03 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.64 2dub h LEU 258 Cb 0.78 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.57 2dub h LEU 258 CO 0.06 0.70 0.58 -0.08 -0.34 0.00 0.00 178.44 179.35 2dub h GLU 259 N 0.76 1.03 -0.10 1.25 4.81 -1.04 -0.97 114.58 120.32 2dub h GLU 259 Ca 0.19 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 2dub h GLU 259 Cb 0.17 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.31 2dub h GLU 259 CO -0.02 0.68 0.04 -0.22 -0.73 0.00 0.00 179.01 178.77 2dub h LYS 260 N 1.06 0.15 -0.82 1.92 1.63 -0.62 0.14 116.57 120.03 2dub h LYS 260 Ca 0.36 -0.03 0.04 0.00 -0.85 0.00 0.00 60.65 60.17 2dub h LYS 260 Cb 0.08 -0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 31.64 2dub h LYS 260 CO -0.12 0.25 0.52 0.87 -3.45 0.00 0.00 179.45 177.52 2dub h LYS 261 N 0.01 0.98 -0.30 1.90 1.79 -0.73 0.69 116.57 120.91 2dub h LYS 261 Ca 0.03 -0.06 -0.13 0.00 -2.18 0.00 0.00 60.65 58.32 2dub h LYS 261 Cb 0.16 -0.22 -0.01 0.00 -1.58 0.00 0.00 32.23 30.57 2dub h LYS 261 CO -0.00 0.65 -0.33 -0.07 -1.08 0.00 0.00 179.45 178.61 2dub h LEU 262 N 1.01 0.67 -0.59 2.94 3.38 -0.98 -1.65 115.31 120.08 2dub h LEU 262 Ca 0.33 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2dub h LEU 262 Cb 0.03 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 2dub h LEU 262 CO -0.12 0.95 0.28 0.15 0.09 0.00 0.00 178.44 179.79 2dub h PHE 263 N 0.55 0.86 -0.68 1.13 3.57 0.27 -2.23 116.94 120.40 2dub h PHE 263 Ca 0.06 -0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 2dub h PHE 263 Cb 0.83 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 39.28 2dub h PHE 263 CO 0.04 0.66 0.18 1.88 -2.23 0.00 0.00 178.31 178.84 2dub h TYR 264 N 0.81 1.11 -0.88 0.41 0.05 -0.71 -2.91 116.97 114.83 2dub h TYR 264 Ca 0.20 -0.12 0.05 0.00 0.05 0.00 0.00 58.73 58.92 2dub h TYR 264 Cb 0.13 -0.32 -0.05 0.00 1.01 0.00 0.00 36.73 37.50 2dub h TYR 264 CO 0.00 0.89 0.58 0.77 -1.05 0.00 0.00 178.16 179.35 2dub h SER 265 N 1.02 0.90 -0.06 3.88 0.02 -0.73 -1.30 113.55 117.28 2dub h SER 265 Ca 0.22 -0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.18 2dub h SER 265 Cb 0.33 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.67 2dub h SER 265 CO -0.00 0.60 0.15 0.71 -1.14 0.00 0.00 176.83 177.14 2dub h THR 266 N 1.03 0.20 0.00 -2.27 1.35 -1.22 0.16 112.91 112.15 2dub h THR 266 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.23 2dub h THR 266 Cb 0.14 0.87 0.00 0.00 -1.73 0.00 0.00 68.15 67.42 2dub h THR 266 CO -0.13 0.00 0.00 0.49 -0.25 0.00 0.00 175.52 175.63 2dub n PHE 267 N -3.33 0.06 0.67 4.73 3.01 -0.49 -2.21 117.46 119.90 2dub n PHE 267 Ca -0.01 0.02 0.09 0.00 1.01 0.00 0.00 57.45 58.56 2dub n PHE 267 Cb 0.23 -0.53 0.26 0.00 -0.01 0.00 0.00 39.48 39.43 2dub n PHE 267 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2dub n ALA 268 N -1.52 2.45 -2.64 4.37 0.00 0.55 -4.91 120.51 118.81 2dub n ALA 268 Ca 0.06 -0.77 -0.24 0.00 0.00 0.00 0.00 53.44 52.48 2dub n ALA 268 Cb 0.28 -0.98 -0.08 0.00 0.00 0.00 0.00 19.45 18.67 2dub n ALA 268 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2dub s THR 269 N -1.51 3.48 0.16 0.00 -4.23 -0.94 -5.04 115.64 107.58 2dub s THR 269 Ca 0.33 -1.74 0.02 0.00 -1.18 0.00 0.00 61.69 59.12 2dub s THR 269 Cb 0.18 -2.81 -0.15 0.00 1.34 0.00 0.00 72.50 71.06 2dub s THR 269 CO 0.25 -0.26 1.38 0.44 -0.54 0.00 0.00 174.62 175.88 2dub h ASP 270 N 2.26 0.29 0.29 3.99 3.32 -1.61 -3.27 116.42 121.69 2dub h ASP 270 Ca -0.45 -0.23 -0.08 0.00 0.02 0.00 0.00 57.03 56.29 2dub h ASP 270 Cb 1.23 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.68 2dub h ASP 270 CO 0.59 1.03 -0.35 0.44 -1.72 0.00 0.00 179.24 179.22 2dub h ASP 271 N 0.13 0.09 0.10 6.45 3.32 -0.34 -0.83 116.42 125.34 2dub h ASP 271 Ca -0.05 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 2dub h ASP 271 Cb 1.50 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.02 2dub h ASP 271 CO 0.14 0.44 -0.05 -0.09 -1.72 0.00 0.00 179.24 177.95 2dub h ARG 272 N 0.08 -0.14 -0.26 3.56 1.12 -1.75 0.56 114.38 117.55 2dub h ARG 272 Ca 0.01 0.01 0.05 0.00 -1.11 0.00 0.00 59.98 58.94 2dub h ARG 272 Cb 0.66 0.03 -0.05 0.00 -0.01 0.00 0.00 29.97 30.60 2dub h ARG 272 CO 0.05 0.08 -0.09 -0.09 -3.11 0.00 0.00 179.97 176.81 2dub h ARG 273 N -0.33 -0.03 -0.62 0.20 9.65 -1.55 -1.39 114.38 120.30 2dub h ARG 273 Ca -0.01 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 58.84 2dub h ARG 273 Cb 0.27 0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 28.83 2dub h ARG 273 CO 0.02 -0.02 0.27 1.49 2.80 0.00 0.00 179.97 184.53 2dub h GLU 274 N -0.03 0.91 -0.00 0.20 4.57 -0.99 -0.73 114.58 118.50 2dub h GLU 274 Ca 0.13 -0.15 0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2dub h GLU 274 Cb 0.23 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 2dub h GLU 274 CO -0.29 0.75 -0.06 0.78 -1.18 0.00 0.00 179.01 179.01 2dub h GLY 275 N 0.85 -0.06 1.44 1.92 0.00 0.88 0.25 103.07 108.35 2dub h GLY 275 Ca 0.21 0.07 -0.17 0.00 0.00 0.00 0.00 47.33 47.44 2dub h GLY 275 CO -0.02 -0.07 -0.61 -0.33 0.00 0.00 0.00 176.54 175.51 2dub h MET 276 N -0.11 0.58 -0.54 4.80 2.86 -1.26 -2.53 114.93 118.73 2dub h MET 276 Ca 0.03 -0.40 -0.01 0.00 -2.06 0.00 0.00 59.70 57.26 2dub h MET 276 Cb 0.14 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.83 2dub h MET 276 CO -0.06 1.01 0.30 1.03 1.06 0.00 0.00 176.91 180.25 2dub h SER 277 N 0.43 0.68 -0.94 1.22 0.87 -0.92 -0.50 113.55 114.38 2dub h SER 277 Ca -0.01 -0.09 0.03 0.00 -1.23 0.00 0.00 61.79 60.49 2dub h SER 277 Cb 1.18 -0.17 -0.05 0.00 -0.44 0.00 0.00 62.40 62.91 2dub h SER 277 CO 0.12 0.57 0.62 0.00 -0.53 0.00 0.00 176.83 177.61 2dub h ALA 278 N 1.13 1.39 -0.12 6.23 0.00 -0.38 0.27 119.26 127.78 2dub h ALA 278 Ca 0.19 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2dub h ALA 278 Cb 0.05 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 2dub h ALA 278 CO -0.03 0.52 -0.13 0.35 0.00 0.00 0.00 179.25 179.96 2dub h PHE 279 N 1.19 0.36 -0.56 0.00 3.57 -0.99 0.12 116.94 120.63 2dub h PHE 279 Ca 0.37 -0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 2dub h PHE 279 Cb -0.01 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.63 2dub h PHE 279 CO -0.00 0.72 0.32 0.28 -2.23 0.00 0.00 178.31 177.40 2dub h VAL 280 N -0.09 1.18 -0.02 1.41 2.07 -0.72 -1.95 116.25 118.13 2dub h VAL 280 Ca 0.02 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2dub h VAL 280 Cb 0.66 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 2dub h VAL 280 CO 0.03 0.19 0.00 -0.62 0.02 0.00 0.00 177.57 177.19 2dub n GLU 281 N -4.63 1.06 -4.12 1.57 1.02 0.93 -4.90 120.64 111.57 2dub n GLU 281 Ca 0.03 -0.08 -0.30 0.00 -0.02 0.00 0.00 57.16 56.79 2dub n GLU 281 Cb 0.07 -1.08 -0.04 0.00 -0.02 0.00 0.00 31.44 30.37 2dub n GLU 281 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2dub n LYS 282 N -0.38 -2.72 -4.14 3.49 4.01 -0.73 -4.96 118.16 112.72 2dub n LYS 282 Ca 0.01 0.33 -0.09 0.00 -0.51 0.00 0.00 58.31 58.04 2dub n LYS 282 Cb 0.05 -4.51 -0.10 0.00 -0.51 0.00 0.00 35.03 29.96 2dub n LYS 282 CO 0.00 0.00 0.00 -0.98 -1.11 0.00 0.00 177.40 175.31 2dub s ARG 283 N -6.84 0.85 0.29 1.97 1.70 0.36 -5.04 118.95 112.25 2dub s ARG 283 Ca 0.23 -1.39 -0.29 0.00 -0.47 0.00 0.00 55.73 53.81 2dub s ARG 283 Cb -0.13 0.21 -0.10 0.00 -0.57 0.00 0.00 34.95 34.37 2dub s ARG 283 CO 0.93 -0.22 1.26 0.21 -1.08 0.00 0.00 175.30 176.40 2dub s LYS 284 N -4.01 4.43 0.28 3.89 2.20 -1.26 -4.25 119.74 121.02 2dub s LYS 284 Ca 0.20 2.09 -0.28 0.00 -0.36 0.00 0.00 55.97 57.61 2dub s LYS 284 Cb 0.08 -3.12 -0.09 0.00 -1.51 0.00 0.00 37.83 33.18 2dub s LYS 284 CO -0.01 -0.11 0.95 0.00 -0.36 0.00 0.00 175.35 175.82 2dub s ALA 285 N -0.89 3.29 -0.61 3.13 0.00 -1.26 -4.94 121.76 120.48 2dub s ALA 285 Ca 0.49 0.60 0.01 0.00 0.00 0.00 0.00 51.96 53.06 2dub s ALA 285 Cb -0.37 -3.21 0.15 0.00 0.00 0.00 0.00 23.12 19.69 2dub s ALA 285 CO 0.47 0.17 0.39 1.21 0.00 0.00 0.00 175.76 178.00 2dub s ASN 286 N -1.35 4.81 0.33 0.00 3.84 -1.26 -5.09 114.94 116.22 2dub s ASN 286 Ca 0.45 -3.11 -0.24 0.00 0.21 0.00 0.00 52.86 50.17 2dub s ASN 286 Cb -0.23 -1.73 -0.10 0.00 -0.55 0.00 0.00 41.25 38.63 2dub s ASN 286 CO 0.29 -0.26 0.92 -0.36 -2.79 0.00 0.00 177.10 174.90 2dub s PHE 287 N -0.43 3.61 -0.06 0.43 0.08 -1.26 -4.97 117.98 115.38 2dub s PHE 287 Ca 0.19 1.69 0.09 0.00 0.12 0.00 0.00 56.93 59.02 2dub s PHE 287 Cb -0.20 -2.87 0.14 0.00 -0.57 0.00 0.00 43.02 39.52 2dub s PHE 287 CO -0.04 0.17 1.03 1.63 -0.10 0.00 0.00 175.22 177.90 2dub n LYS 288 N 0.34 1.47 -3.74 0.44 4.76 -1.26 -4.99 118.16 115.18 2dub n LYS 288 Ca 0.02 -1.85 -0.25 0.00 -2.87 0.00 0.00 58.31 53.37 2dub n LYS 288 Cb 0.51 -1.12 0.04 0.00 -1.84 0.00 0.00 35.03 32.62 2dub n LYS 288 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2dub n ASP 289 N -0.82 -3.25 0.00 4.39 8.00 -1.26 -5.00 116.55 118.60 2dub n ASP 289 Ca 0.08 -0.75 0.00 0.00 0.71 0.00 0.00 54.79 54.82 2dub n ASP 289 Cb 0.52 -4.21 0.00 0.00 -0.02 0.00 0.00 41.12 37.41 2dub n ASP 289 CO 0.00 0.00 0.00 1.57 -0.39 0.00 0.00 177.20 178.38