#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wva s TYR 3 N 0.00 2.87 0.36 7.33 1.51 -1.26 -5.05 117.35 123.11 2wva s TYR 3 Ca 0.00 -0.12 0.08 0.00 -1.01 0.00 0.00 57.07 56.02 2wva s TYR 3 Cb 0.00 -1.41 -0.04 0.00 -0.11 0.00 0.00 41.96 40.39 2wva s TYR 3 CO 0.00 0.50 0.15 0.95 -1.11 0.00 0.00 175.55 176.04 2wva s THR 4 N -1.62 2.83 0.27 -0.71 -4.23 -1.26 -2.09 115.64 108.83 2wva s THR 4 Ca 0.27 -1.71 -0.02 0.00 -1.18 0.00 0.00 61.69 59.05 2wva s THR 4 Cb -0.10 -2.96 0.30 0.00 1.34 0.00 0.00 72.50 71.08 2wva s THR 4 CO 0.18 -0.14 1.64 0.58 -0.54 0.00 0.00 174.62 176.34 2wva h VAL 5 N 1.53 0.33 -0.39 2.29 2.07 -1.32 0.26 116.25 121.02 2wva h VAL 5 Ca -0.43 -0.06 -0.14 0.00 0.82 0.00 0.00 66.70 66.89 2wva h VAL 5 Cb 1.25 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 2wva h VAL 5 CO 0.65 0.03 -0.29 1.23 0.02 0.00 0.00 177.57 179.20 2wva h GLY 6 N 0.16 0.97 2.00 2.17 0.00 -1.59 -2.77 103.07 104.01 2wva h GLY 6 Ca 0.49 -0.94 -0.10 0.00 0.00 0.00 0.00 47.33 46.78 2wva h GLY 6 CO -0.66 0.85 -0.49 -0.91 0.00 0.00 0.00 176.54 175.33 2wva h THR 7 N 0.70 0.88 0.01 4.70 1.35 -1.57 -1.85 112.91 117.13 2wva h THR 7 Ca 0.07 -2.11 -0.00 0.00 -0.55 0.00 0.00 66.41 63.82 2wva h THR 7 Cb 0.88 2.34 0.00 0.00 -1.73 0.00 0.00 68.15 69.63 2wva h THR 7 CO 0.08 0.48 -0.00 0.22 -0.25 0.00 0.00 175.52 176.04 2wva h TYR 8 N 0.00 -0.01 -0.30 4.73 5.03 -0.49 -1.48 116.97 124.46 2wva h TYR 8 Ca -0.00 -0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.34 2wva h TYR 8 Cb 1.30 0.00 -0.03 0.00 1.55 0.00 0.00 36.73 39.55 2wva h TYR 8 CO 0.00 0.05 0.10 1.25 -1.32 0.00 0.00 178.16 178.24 2wva h LEU 9 N -0.07 0.11 -1.02 2.82 5.85 -1.44 -1.74 115.31 119.82 2wva h LEU 9 Ca -0.00 0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.81 2wva h LEU 9 Cb 0.06 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.05 2wva h LEU 9 CO 0.00 0.10 0.65 0.00 -0.34 0.00 0.00 178.44 178.85 2wva h ALA 10 N 1.19 1.40 -0.14 1.25 0.00 -1.21 -1.33 119.26 120.42 2wva h ALA 10 Ca 0.13 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2wva h ALA 10 Cb 0.10 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2wva h ALA 10 CO -0.14 0.45 -0.06 1.49 0.00 0.00 0.00 179.25 181.00 2wva h GLU 11 N 1.18 0.29 -0.83 0.00 4.57 -0.93 -1.81 114.58 117.05 2wva h GLU 11 Ca 0.43 -0.13 0.11 0.00 -1.18 0.00 0.00 59.36 58.59 2wva h GLU 11 Cb 0.15 -0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 28.65 2wva h GLU 11 CO -0.16 0.61 0.47 0.00 -1.18 0.00 0.00 179.01 178.74 2wva h ARG 12 N -0.04 0.73 -0.71 1.92 2.47 -0.94 0.20 114.38 118.01 2wva h ARG 12 Ca 0.03 -0.04 -0.06 0.00 -1.26 0.00 0.00 59.98 58.65 2wva h ARG 12 Cb 0.52 -0.16 -0.03 0.00 -1.65 0.00 0.00 29.97 28.64 2wva h ARG 12 CO 0.02 0.48 0.22 -0.07 0.56 0.00 0.00 179.97 181.18 2wva h LEU 13 N 0.75 1.04 -0.66 3.04 3.38 -1.13 -2.39 115.31 119.34 2wva h LEU 13 Ca 0.42 -0.21 -0.10 0.00 0.09 0.00 0.00 57.88 58.08 2wva h LEU 13 Cb 0.44 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2wva h LEU 13 CO -0.28 0.97 -0.03 0.58 0.09 0.00 0.00 178.44 179.78 2wva h VAL 14 N 1.05 1.26 0.00 1.22 2.07 -0.38 -2.41 116.25 119.06 2wva h VAL 14 Ca 0.23 -1.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.57 2wva h VAL 14 Cb 0.31 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2wva h VAL 14 CO -0.01 0.42 -0.08 1.56 0.02 0.00 0.00 177.57 179.48 2wva h GLN 15 N 0.92 0.00 -0.19 1.57 4.20 -0.22 -1.70 115.11 119.70 2wva h GLN 15 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 2wva h GLN 15 Cb 0.57 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.35 2wva h GLN 15 CO 0.03 0.08 0.00 0.44 -0.67 0.00 0.00 178.83 178.71 2wva n ILE 16 N -3.93 0.23 0.00 2.54 -5.35 -0.94 -4.92 119.36 106.99 2wva n ILE 16 Ca -0.02 -0.45 0.00 0.00 -0.27 0.00 0.00 62.75 62.00 2wva n ILE 16 Cb 0.17 0.67 0.00 0.00 -1.74 0.00 0.00 39.64 38.73 2wva n ILE 16 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wva n GLY 17 N 1.26 0.79 3.72 3.28 0.00 -0.64 -4.88 105.19 108.73 2wva n GLY 17 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2wva n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wva s LEU 18 N 0.00 4.37 0.00 0.99 1.02 -0.93 -4.88 118.68 119.26 2wva s LEU 18 Ca 0.00 2.44 0.14 0.00 0.02 0.00 0.00 54.13 56.72 2wva s LEU 18 Cb 0.00 -3.59 -0.07 0.00 0.02 0.00 0.00 46.19 42.55 2wva s LEU 18 CO 0.00 -0.71 0.67 0.29 0.02 0.00 0.00 176.35 176.62 2wva n LYS 19 N 3.92 2.21 -3.91 1.70 4.76 -1.26 -4.50 118.16 121.08 2wva n LYS 19 Ca 0.12 -0.38 -0.09 0.00 -2.87 0.00 0.00 58.31 55.09 2wva n LYS 19 Cb 0.41 -1.17 -0.09 0.00 -1.84 0.00 0.00 35.03 32.34 2wva n LYS 19 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2wva s HIS 20 N -1.98 0.18 0.06 2.13 3.76 -1.26 -0.96 115.29 117.22 2wva s HIS 20 Ca 0.08 -0.52 0.01 0.00 -0.15 0.00 0.00 55.06 54.49 2wva s HIS 20 Cb 0.11 -0.12 -0.03 0.00 1.11 0.00 0.00 32.58 33.65 2wva s HIS 20 CO 0.45 -0.42 -0.06 -3.38 -0.85 0.00 0.00 174.74 170.47 2wva s HIS 21 N -2.98 0.66 -0.03 1.40 -3.43 -0.57 -4.65 115.29 105.69 2wva s HIS 21 Ca -0.02 -0.68 0.00 0.00 -0.80 0.00 0.00 55.06 53.57 2wva s HIS 21 Cb 0.01 -0.40 -0.04 0.00 -1.43 0.00 0.00 32.58 30.72 2wva s HIS 21 CO -0.06 -0.15 0.01 -0.06 -2.00 0.00 0.00 174.74 172.48 2wva s PHE 22 N -2.28 3.13 0.01 0.38 0.40 -0.13 -0.54 117.98 118.95 2wva s PHE 22 Ca -0.03 0.13 -0.12 0.00 -0.60 0.00 0.00 56.93 56.31 2wva s PHE 22 Cb -0.04 -1.71 0.02 0.00 0.51 0.00 0.00 43.02 41.79 2wva s PHE 22 CO -0.02 0.48 0.26 0.00 0.70 0.00 0.00 175.22 176.64 2wva s ALA 23 N -1.05 -0.61 -0.11 5.36 0.00 0.63 0.54 121.76 126.52 2wva s ALA 23 Ca 0.18 0.08 -0.00 0.00 0.00 0.00 0.00 51.96 52.22 2wva s ALA 23 Cb -0.12 0.17 0.02 0.00 0.00 0.00 0.00 23.12 23.20 2wva s ALA 23 CO 0.09 -0.30 -0.08 0.08 0.00 0.00 0.00 175.76 175.55 2wva s VAL 24 N -1.81 1.03 0.57 0.00 1.01 -0.69 -1.40 120.40 119.10 2wva s VAL 24 Ca -0.11 -0.30 -0.19 0.00 0.00 0.00 0.00 61.98 61.38 2wva s VAL 24 Cb -0.04 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 2wva s VAL 24 CO 0.01 0.37 1.21 0.00 0.00 0.00 0.00 175.10 176.68 2wva s ALA 25 N 1.64 2.62 -0.05 5.51 0.00 -1.26 -4.15 121.76 126.07 2wva s ALA 25 Ca 0.04 1.01 -0.30 0.00 0.00 0.00 0.00 51.96 52.70 2wva s ALA 25 Cb -0.13 -3.44 0.08 0.00 0.00 0.00 0.00 23.12 19.63 2wva s ALA 25 CO -0.07 -1.09 0.73 0.20 0.00 0.00 0.00 175.76 175.52 2wva s GLY 26 N -1.54 -0.53 0.60 0.00 0.00 -1.26 -4.85 107.32 99.73 2wva s GLY 26 Ca 0.75 1.36 0.29 0.00 0.00 0.00 0.00 44.72 47.13 2wva s GLY 26 CO 0.33 0.90 2.06 1.29 0.00 0.00 0.00 173.10 177.68 2wva h ASP 27 N 2.83 0.00 0.84 1.64 2.03 -2.00 0.29 116.42 122.05 2wva h ASP 27 Ca -0.26 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.04 2wva h ASP 27 Cb 1.16 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.66 2wva h ASP 27 CO 0.37 0.00 0.00 -1.22 -1.03 0.00 0.00 179.24 177.36 2wva n TYR 28 N -3.71 0.14 -0.37 4.15 4.01 -1.26 -3.78 117.16 116.33 2wva n TYR 28 Ca 0.03 0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 2wva n TYR 28 Cb 0.39 -0.57 0.00 0.00 -0.31 0.00 0.00 39.34 38.84 2wva n TYR 28 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2wva n ASN 29 N -1.62 0.82 -0.03 7.72 0.23 0.96 -3.68 115.26 119.67 2wva n ASN 29 Ca 0.05 -1.20 -0.10 0.00 -0.53 0.00 0.00 54.58 52.80 2wva n ASN 29 Cb 0.28 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.94 2wva n ASN 29 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 2wva h LEU 30 N 0.00 0.16 -0.66 -4.53 3.38 -1.50 0.17 115.31 112.33 2wva h LEU 30 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 2wva h LEU 30 Cb 0.35 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 2wva h LEU 30 CO 0.00 0.12 0.13 0.58 0.09 0.00 0.00 178.44 179.35 2wva h VAL 31 N 0.21 1.26 -0.53 1.22 2.07 -1.88 -1.43 116.25 117.18 2wva h VAL 31 Ca 0.07 -1.00 0.06 0.00 0.82 0.00 0.00 66.70 66.65 2wva h VAL 31 Cb 0.00 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 30.36 2wva h VAL 31 CO -0.04 0.38 0.24 0.25 0.02 0.00 0.00 177.57 178.42 2wva h LEU 32 N 0.99 0.31 -1.07 2.57 5.85 -1.75 -1.75 115.31 120.45 2wva h LEU 32 Ca 0.20 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 2wva h LEU 32 Cb 0.41 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.40 2wva h LEU 32 CO 0.01 0.21 0.45 -0.07 -0.34 0.00 0.00 178.44 178.70 2wva h LEU 33 N 0.46 0.98 -0.50 2.25 3.38 -0.29 -1.59 115.31 119.99 2wva h LEU 33 Ca 0.24 -0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.19 2wva h LEU 33 Cb 0.20 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 2wva h LEU 33 CO -0.20 0.77 0.23 0.44 0.09 0.00 0.00 178.44 179.77 2wva h ASP 34 N 1.11 0.30 -0.06 -0.43 3.32 -0.56 -0.90 116.42 119.20 2wva h ASP 34 Ca 0.28 0.04 -0.10 0.00 0.02 0.00 0.00 57.03 57.27 2wva h ASP 34 Cb -0.00 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 2wva h ASP 34 CO -0.05 0.21 -0.28 0.78 -1.72 0.00 0.00 179.24 178.18 2wva h ASN 35 N 0.44 0.51 -0.05 6.45 2.35 -0.58 -2.42 115.58 122.29 2wva h ASN 35 Ca 0.23 -0.18 -0.10 0.00 -0.55 0.00 0.00 56.30 55.70 2wva h ASN 35 Cb 0.18 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2wva h ASN 35 CO -0.19 0.78 -0.26 -0.07 -1.65 0.00 0.00 177.43 176.04 2wva h LEU 36 N 0.44 0.48 -2.01 1.61 3.38 -0.94 -2.69 115.31 115.57 2wva h LEU 36 Ca 0.06 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 2wva h LEU 36 Cb 0.71 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 2wva h LEU 36 CO 0.05 0.73 -0.00 -0.07 0.09 0.00 0.00 178.44 179.25 2wva h LEU 37 N 0.42 0.00 -1.41 1.67 3.38 -0.67 -2.88 115.31 115.82 2wva h LEU 37 Ca 0.06 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 2wva h LEU 37 Cb 0.68 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2wva h LEU 37 CO 0.05 0.00 -0.28 -0.07 0.09 0.00 0.00 178.44 178.23 2wva h LEU 38 N 0.00 0.02 -8.66 1.67 3.38 -1.30 -3.39 115.31 107.03 2wva h LEU 38 Ca -0.00 -0.01 -0.60 0.00 0.09 0.00 0.00 57.88 57.36 2wva h LEU 38 Cb 0.33 -0.01 -0.11 0.00 0.09 0.00 0.00 40.66 40.97 2wva h LEU 38 CO 0.00 0.30 0.57 0.21 0.09 0.00 0.00 178.44 179.61 2wva s ASN 39 N -6.96 6.49 0.00 -0.43 3.84 -1.09 -4.90 114.94 111.90 2wva s ASN 39 Ca -0.03 0.10 0.30 0.00 0.21 0.00 0.00 52.86 53.44 2wva s ASN 39 Cb 0.15 -2.45 1.56 0.00 -0.55 0.00 0.00 41.25 39.96 2wva s ASN 39 CO 0.72 -1.05 2.05 0.29 -2.79 0.00 0.00 177.10 176.32 2wva n LYS 40 N 7.15 0.75 0.00 0.43 4.76 -1.26 -3.49 118.16 126.50 2wva n LYS 40 Ca 0.06 -0.10 0.15 0.00 -2.87 0.00 0.00 58.31 55.54 2wva n LYS 40 Cb 0.48 -1.50 0.77 0.00 -1.84 0.00 0.00 35.03 32.94 2wva n LYS 40 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2wva n ASN 41 N -1.04 0.05 -3.95 4.39 3.02 -1.26 -4.77 115.26 111.72 2wva n ASN 41 Ca 0.18 -0.30 -0.09 0.00 -0.03 0.00 0.00 54.58 54.34 2wva n ASN 41 Cb 0.21 -0.22 -0.09 0.00 -0.61 0.00 0.00 39.78 39.06 2wva n ASN 41 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wva s MET 42 N -2.49 0.57 0.18 3.52 0.23 -1.23 -4.71 119.30 115.37 2wva s MET 42 Ca 0.31 -0.79 0.00 0.00 -1.03 0.00 0.00 55.69 54.18 2wva s MET 42 Cb 0.20 0.22 -0.04 0.00 -1.53 0.00 0.00 34.83 33.68 2wva s MET 42 CO 0.45 -0.14 0.35 -1.21 -2.03 0.00 0.00 175.02 172.45 2wva s GLU 43 N -2.66 3.50 -0.29 3.16 2.02 -0.14 -4.92 118.70 119.36 2wva s GLU 43 Ca -0.05 -0.41 -0.11 0.00 0.02 0.00 0.00 54.97 54.42 2wva s GLU 43 Cb -0.01 -2.88 -0.04 0.00 0.10 0.00 0.00 34.13 31.30 2wva s GLU 43 CO -0.05 0.45 0.19 -1.14 0.02 0.00 0.00 175.26 174.73 2wva s GLN 44 N -3.25 3.80 -0.18 1.61 0.74 -1.26 -1.51 119.66 119.61 2wva s GLN 44 Ca 0.37 -0.42 -0.04 0.00 0.05 0.00 0.00 55.36 55.32 2wva s GLN 44 Cb -0.11 -3.66 -0.02 0.00 1.10 0.00 0.00 33.01 30.32 2wva s GLN 44 CO 0.29 -0.25 -0.03 0.08 -0.55 0.00 0.00 175.29 174.83 2wva s VAL 45 N 1.73 3.77 0.06 1.34 1.01 0.30 -4.97 120.40 123.65 2wva s VAL 45 Ca 0.07 -0.38 -0.09 0.00 0.00 0.00 0.00 61.98 61.57 2wva s VAL 45 Cb -0.16 -2.68 -0.06 0.00 0.00 0.00 0.00 36.38 33.48 2wva s VAL 45 CO 0.10 0.46 0.37 -0.31 0.00 0.00 0.00 175.10 175.72 2wva s TYR 46 N 0.80 3.59 0.34 5.22 2.02 -1.26 -0.27 117.35 127.79 2wva s TYR 46 Ca -0.01 0.75 0.09 0.00 -0.37 0.00 0.00 57.07 57.54 2wva s TYR 46 Cb -0.14 -2.13 -0.06 0.00 -0.40 0.00 0.00 41.96 39.22 2wva s TYR 46 CO 0.02 0.54 -0.09 0.00 -1.57 0.00 0.00 175.55 174.45 2wva s ASN 49 N -5.61 0.55 0.24 0.00 2.20 -1.26 -5.07 114.94 105.98 2wva s ASN 49 Ca -0.15 -1.44 0.10 0.00 -0.94 0.00 0.00 52.86 50.43 2wva s ASN 49 Cb 0.01 0.36 0.21 0.00 -2.00 0.00 0.00 41.25 39.84 2wva s ASN 49 CO 0.62 -0.85 1.52 -0.33 -2.94 0.00 0.00 177.10 175.13 2wva h GLU 50 N 2.51 0.00 -0.18 3.55 3.07 -1.91 -0.97 114.58 120.65 2wva h GLU 50 Ca -0.35 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.50 2wva h GLU 50 Cb 1.25 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.15 2wva h GLU 50 CO 0.53 0.71 0.07 1.25 -1.40 0.00 0.00 179.01 180.17 2wva h LEU 51 N 0.00 0.25 -1.49 1.33 5.85 -1.87 -1.26 115.31 118.12 2wva h LEU 51 Ca -0.01 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.51 2wva h LEU 51 Cb 1.27 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 2wva h LEU 51 CO 0.09 0.35 -0.11 0.78 -0.34 0.00 0.00 178.44 179.21 2wva h ASN 52 N 0.14 0.18 -0.23 1.25 4.21 -1.91 -2.08 115.58 117.14 2wva h ASN 52 Ca 0.06 -0.03 -0.03 0.00 1.21 0.00 0.00 56.30 57.51 2wva h ASN 52 Cb 0.17 -0.05 -0.01 0.00 -1.12 0.00 0.00 38.32 37.32 2wva h ASN 52 CO -0.00 0.32 0.05 0.00 -1.29 0.00 0.00 177.43 176.50 2wva h GLY 54 N 0.20 0.71 2.00 0.00 0.00 -0.97 -1.97 103.07 103.03 2wva h GLY 54 Ca 0.07 -0.29 -0.09 0.00 0.00 0.00 0.00 47.33 47.02 2wva h GLY 54 CO 0.00 0.29 -0.42 0.74 0.00 0.00 0.00 176.54 177.14 2wva h PHE 55 N 0.66 0.00 -0.46 5.60 0.04 -1.23 -0.51 116.94 121.03 2wva h PHE 55 Ca 0.18 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.89 2wva h PHE 55 Cb -0.01 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.12 2wva h PHE 55 CO -0.03 0.42 0.07 0.77 -0.60 0.00 0.00 178.31 178.95 2wva h SER 56 N 0.00 0.73 -0.71 2.17 0.02 -0.46 -0.66 113.55 114.64 2wva h SER 56 Ca -0.00 -0.26 -0.06 0.00 -0.84 0.00 0.00 61.79 60.62 2wva h SER 56 Cb 0.92 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.24 2wva h SER 56 CO 0.06 0.81 0.20 0.00 -1.14 0.00 0.00 176.83 176.76 2wva h ALA 57 N 0.95 0.94 -0.63 3.77 0.00 -0.98 -0.76 119.26 122.55 2wva h ALA 57 Ca 0.14 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.85 2wva h ALA 57 Cb 0.39 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 2wva h ALA 57 CO 0.01 0.64 0.37 1.49 0.00 0.00 0.00 179.25 181.76 2wva h GLU 58 N 1.06 0.70 -0.22 0.00 4.22 -0.88 0.24 114.58 119.70 2wva h GLU 58 Ca 0.23 -0.04 -0.13 0.00 0.08 0.00 0.00 59.36 59.49 2wva h GLU 58 Cb 0.33 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2wva h GLU 58 CO -0.00 0.46 -0.41 0.78 -2.18 0.00 0.00 179.01 177.65 2wva h GLY 59 N 0.72 0.58 0.99 1.92 0.00 -0.69 -2.84 103.07 103.74 2wva h GLY 59 Ca 0.26 -0.58 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 2wva h GLY 59 CO -0.13 0.53 0.30 -1.82 0.00 0.00 0.00 176.54 175.42 2wva h TYR 60 N 0.44 0.76 -0.46 5.60 3.20 -0.63 -2.29 116.97 123.59 2wva h TYR 60 Ca 0.04 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.94 2wva h TYR 60 Cb 0.91 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.91 2wva h TYR 60 CO 0.03 0.56 0.31 0.00 -1.64 0.00 0.00 178.16 177.42 2wva h ALA 61 N 1.13 1.90 0.00 1.82 0.00 -0.81 0.22 119.26 123.53 2wva h ALA 61 Ca 0.19 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2wva h ALA 61 Cb 0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2wva h ALA 61 CO -0.03 0.02 -0.35 0.00 0.00 0.00 0.00 179.25 178.90 2wva h ARG 62 N 0.41 0.00 0.13 0.00 3.08 -1.18 0.16 114.38 116.98 2wva h ARG 62 Ca 0.20 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.91 2wva h ARG 62 Cb 0.25 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 2wva h ARG 62 CO -0.05 0.35 -1.75 0.00 -1.07 0.00 0.00 179.97 177.45 2wva h ALA 63 N 1.65 0.34 0.00 0.04 0.00 -0.81 -3.42 119.26 117.06 2wva h ALA 63 Ca -0.00 -1.24 0.00 0.00 0.00 0.00 0.00 54.91 53.67 2wva h ALA 63 Cb 0.62 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2wva h ALA 63 CO 0.05 1.20 0.00 1.63 0.00 0.00 0.00 179.25 182.13 2wva n LYS 64 N -3.46 5.20 0.00 0.00 4.76 0.59 -4.92 118.16 120.34 2wva n LYS 64 Ca -0.23 -0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.10 2wva n LYS 64 Cb 1.06 -0.61 0.00 0.00 -1.84 0.00 0.00 35.03 33.64 2wva n LYS 64 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wva n GLY 65 N 0.77 2.94 3.71 0.72 0.00 0.56 -4.97 105.19 108.92 2wva n GLY 65 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2wva n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wva s ALA 66 N -2.81 -0.55 0.16 4.61 0.00 -1.25 -4.32 121.76 117.60 2wva s ALA 66 Ca 0.00 -0.74 -0.25 0.00 0.00 0.00 0.00 51.96 50.98 2wva s ALA 66 Cb 0.00 0.93 0.06 0.00 0.00 0.00 0.00 23.12 24.12 2wva s ALA 66 CO 0.00 -0.93 0.95 0.00 0.00 0.00 0.00 175.76 175.78 2wva s ALA 67 N -3.57 -1.63 -0.02 0.00 0.00 -1.03 -3.82 121.76 111.69 2wva s ALA 67 Ca 0.18 0.09 -0.04 0.00 0.00 0.00 0.00 51.96 52.19 2wva s ALA 67 Cb -0.03 0.65 0.00 0.00 0.00 0.00 0.00 23.12 23.75 2wva s ALA 67 CO 0.10 -1.05 0.09 0.00 0.00 0.00 0.00 175.76 174.90 2wva s ALA 68 N -3.29 -0.21 -0.02 0.00 0.00 -1.26 -0.27 121.76 116.71 2wva s ALA 68 Ca 0.12 0.09 0.03 0.00 0.00 0.00 0.00 51.96 52.21 2wva s ALA 68 Cb -0.02 -0.07 -0.00 0.00 0.00 0.00 0.00 23.12 23.03 2wva s ALA 68 CO 0.03 -0.09 -0.11 0.00 0.00 0.00 0.00 175.76 175.59 2wva s ALA 69 N -0.38 0.96 -0.14 0.00 0.00 -0.28 -0.96 121.76 120.95 2wva s ALA 69 Ca -0.05 -0.43 0.02 0.00 0.00 0.00 0.00 51.96 51.51 2wva s ALA 69 Cb -0.03 -0.31 0.01 0.00 0.00 0.00 0.00 23.12 22.80 2wva s ALA 69 CO 0.00 0.19 -0.20 0.08 0.00 0.00 0.00 175.76 175.83 2wva s VAL 70 N -0.00 1.93 0.32 0.00 1.01 0.19 -0.38 120.40 123.46 2wva s VAL 70 Ca -0.00 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.11 2wva s VAL 70 Cb -0.07 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 2wva s VAL 70 CO 0.00 0.52 0.14 0.68 0.00 0.00 0.00 175.10 176.44 2wva s VAL 71 N 0.94 0.49 0.31 2.92 -7.23 0.05 -1.71 120.40 116.17 2wva s VAL 71 Ca -0.05 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.14 2wva s VAL 71 Cb -0.15 -2.53 -0.03 0.00 0.56 0.00 0.00 36.38 34.22 2wva s VAL 71 CO -0.04 0.00 0.48 0.28 -0.31 0.00 0.00 175.10 175.52 2wva s THR 72 N -3.53 5.16 0.17 5.32 -1.32 -1.26 -0.90 115.64 119.27 2wva s THR 72 Ca 0.34 -0.61 -0.34 0.00 -1.21 0.00 0.00 61.69 59.87 2wva s THR 72 Cb 0.05 -3.85 -0.14 0.00 -1.51 0.00 0.00 72.50 67.05 2wva s THR 72 CO 0.16 -0.47 1.56 0.00 -2.21 0.00 0.00 174.62 173.66 2wva n TYR 73 N -1.60 2.26 0.00 9.09 9.36 -1.13 -1.98 117.16 133.16 2wva n TYR 73 Ca -0.06 0.29 0.00 0.00 3.32 0.00 0.00 57.90 61.45 2wva n TYR 73 Cb 0.56 -2.53 0.00 0.00 -0.63 0.00 0.00 39.34 36.74 2wva n TYR 73 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 2wva n SER 74 N 3.24 0.00 0.12 2.98 7.64 -1.26 -3.94 113.62 122.40 2wva n SER 74 Ca 0.16 0.00 0.03 0.00 1.01 0.00 0.00 58.87 60.07 2wva n SER 74 Cb 0.29 0.00 0.41 0.00 -1.01 0.00 0.00 64.21 63.90 2wva n SER 74 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 2wva h VAL 75 N 0.00 1.16 0.00 0.44 -1.51 -1.75 -2.01 116.25 112.58 2wva h VAL 75 Ca 0.00 -0.69 -0.06 0.00 -1.23 0.00 0.00 66.70 64.72 2wva h VAL 75 Cb 0.00 1.15 -0.01 0.00 -2.13 0.00 0.00 31.29 30.30 2wva h VAL 75 CO 0.00 0.22 -0.35 1.23 -1.23 0.00 0.00 177.57 177.43 2wva h GLY 76 N 0.68 0.00 0.99 5.19 0.00 -1.60 -3.40 103.07 104.92 2wva h GLY 76 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2wva h GLY 76 CO 0.02 0.00 0.12 0.00 0.00 0.00 0.00 176.54 176.67 2wva h ALA 77 N -0.40 0.23 -0.39 3.60 0.00 -1.38 -2.97 119.26 117.95 2wva h ALA 77 Ca -0.09 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.86 2wva h ALA 77 Cb 0.84 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 2wva h ALA 77 CO -0.05 -0.28 0.08 -0.07 0.00 0.00 0.00 179.25 178.93 2wva h LEU 78 N 0.23 0.02 -0.74 0.00 4.07 -1.59 0.21 115.31 117.51 2wva h LEU 78 Ca 0.07 0.06 -0.10 0.00 0.08 0.00 0.00 57.88 57.98 2wva h LEU 78 Cb -0.01 0.08 -0.02 0.00 1.08 0.00 0.00 40.66 41.80 2wva h LEU 78 CO -0.01 0.04 -0.16 0.77 -1.08 0.00 0.00 178.44 178.00 2wva h SER 79 N 0.21 0.80 0.02 -0.43 4.64 -1.77 -2.75 113.55 114.27 2wva h SER 79 Ca 0.18 -0.26 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 2wva h SER 79 Cb 0.22 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2wva h SER 79 CO -0.24 0.96 -0.04 0.00 -0.87 0.00 0.00 176.83 176.64 2wva h ALA 80 N 1.11 1.85 -0.89 5.18 0.00 -1.00 -1.52 119.26 123.99 2wva h ALA 80 Ca 0.11 -0.07 0.22 0.00 0.00 0.00 0.00 54.91 55.17 2wva h ALA 80 Cb 0.66 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.36 2wva h ALA 80 CO 0.05 0.11 0.60 0.74 0.00 0.00 0.00 179.25 180.76 2wva h PHE 81 N 0.06 0.41 -0.60 0.00 0.04 -0.34 0.12 116.94 116.63 2wva h PHE 81 Ca 0.01 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 2wva h PHE 81 Cb 0.12 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 38.12 2wva h PHE 81 CO 0.00 0.10 0.29 0.22 -0.60 0.00 0.00 178.31 178.32 2wva h ASP 82 N 0.30 0.79 0.17 2.17 1.82 -1.39 0.26 116.42 120.53 2wva h ASP 82 Ca 0.46 -0.13 -0.12 0.00 -0.39 0.00 0.00 57.03 56.85 2wva h ASP 82 Cb 1.30 -0.20 -0.01 0.00 0.68 0.00 0.00 39.33 41.09 2wva h ASP 82 CO -0.14 0.70 -0.43 0.00 -1.61 0.00 0.00 179.24 177.75 2wva h ALA 83 N 1.12 1.00 -0.18 -0.78 0.00 -0.97 -2.46 119.26 116.99 2wva h ALA 83 Ca 0.21 -0.44 -0.19 0.00 0.00 0.00 0.00 54.91 54.50 2wva h ALA 83 Cb 0.12 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.82 2wva h ALA 83 CO -0.03 0.62 -0.61 0.82 0.00 0.00 0.00 179.25 180.05 2wva h ILE 84 N 0.28 1.30 -1.00 0.00 1.08 -0.44 -0.12 117.51 118.62 2wva h ILE 84 Ca 0.02 -1.83 0.16 0.00 -0.39 0.00 0.00 64.86 62.82 2wva h ILE 84 Cb 0.88 1.93 -0.10 0.00 -3.07 0.00 0.00 36.82 36.46 2wva h ILE 84 CO 0.07 0.58 0.61 1.23 -0.69 0.00 0.00 178.15 179.95 2wva h GLY 85 N 0.45 1.71 1.21 5.37 0.00 -0.49 0.57 103.07 111.88 2wva h GLY 85 Ca -0.03 -0.39 -0.12 0.00 0.00 0.00 0.00 47.33 46.80 2wva h GLY 85 CO 0.13 0.04 -0.17 -1.33 0.00 0.00 0.00 176.54 175.21 2wva h GLY 86 N 0.86 0.99 1.33 4.60 0.00 -0.92 -0.10 103.07 109.83 2wva h GLY 86 Ca 0.54 -0.82 -0.08 0.00 0.00 0.00 0.00 47.33 46.97 2wva h GLY 86 CO -0.33 0.75 -0.02 0.00 0.00 0.00 0.00 176.54 176.94 2wva h ALA 87 N 1.00 1.06 -0.03 3.60 0.00 0.06 -0.82 119.26 124.12 2wva h ALA 87 Ca 0.12 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2wva h ALA 87 Cb 0.71 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2wva h ALA 87 CO 0.05 0.59 0.02 -0.92 0.00 0.00 0.00 179.25 178.99 2wva h TYR 88 N 0.75 0.04 0.00 0.00 5.03 -0.42 -1.06 116.97 121.31 2wva h TYR 88 Ca 0.14 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.44 2wva h TYR 88 Cb 0.49 -0.01 -0.00 0.00 1.55 0.00 0.00 36.73 38.75 2wva h TYR 88 CO 0.03 0.12 -0.04 0.00 -1.32 0.00 0.00 178.16 176.94 2wva h ALA 89 N 0.92 1.92 -0.54 1.82 0.00 -0.76 -2.44 119.26 120.17 2wva h ALA 89 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2wva h ALA 89 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2wva h ALA 89 CO -0.00 0.05 0.00 0.39 0.00 0.00 0.00 179.25 179.69 2wva n GLU 90 N -4.47 3.19 -3.58 0.00 -0.58 -0.34 -4.73 120.64 110.13 2wva n GLU 90 Ca -0.03 -2.61 -0.19 0.00 -0.42 0.00 0.00 57.16 53.91 2wva n GLU 90 Cb 0.13 -1.64 0.06 0.00 -0.57 0.00 0.00 31.44 29.41 2wva n GLU 90 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2wva n ASN 91 N 0.88 -1.60 -4.14 1.62 3.02 -0.51 -5.01 115.26 109.53 2wva n ASN 91 Ca 0.21 -0.73 -0.29 0.00 -0.03 0.00 0.00 54.58 53.73 2wva n ASN 91 Cb 0.70 -4.53 -0.17 0.00 -0.61 0.00 0.00 39.78 35.17 2wva n ASN 91 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2wva s LEU 92 N -6.52 1.91 -1.20 3.41 1.43 -0.58 -4.66 118.68 112.47 2wva s LEU 92 Ca 0.01 -0.47 -0.19 0.00 -1.03 0.00 0.00 54.13 52.44 2wva s LEU 92 Cb -0.00 -1.20 -0.02 0.00 0.03 0.00 0.00 46.19 44.99 2wva s LEU 92 CO 0.78 0.09 1.92 -2.65 0.23 0.00 0.00 176.35 176.72 2wva n PRO 93 N 3.76 2.36 -3.31 1.29 -0.02 -1.26 -2.91 135.00 134.92 2wva n PRO 93 Ca -0.20 -2.65 -0.38 0.00 -2.02 0.00 0.00 63.50 58.24 2wva n PRO 93 Cb 0.52 -3.42 -0.06 0.00 -0.02 0.00 0.00 33.50 30.52 2wva n PRO 93 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2wva s VAL 94 N 6.13 5.18 -0.36 -1.45 1.01 -1.26 -2.46 120.40 127.19 2wva s VAL 94 Ca 0.57 0.93 -0.13 0.00 0.00 0.00 0.00 61.98 63.36 2wva s VAL 94 Cb 0.07 -3.81 -0.00 0.00 0.00 0.00 0.00 36.38 32.63 2wva s VAL 94 CO 0.07 0.30 0.24 -0.63 0.00 0.00 0.00 175.10 175.07 2wva s ILE 95 N 0.84 5.07 -0.23 2.22 1.01 0.63 -1.71 121.20 129.02 2wva s ILE 95 Ca 0.25 -0.45 -0.14 0.00 0.00 0.00 0.00 60.65 60.31 2wva s ILE 95 Cb -0.15 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 2wva s ILE 95 CO 0.10 -0.10 0.32 -0.22 0.00 0.00 0.00 174.94 175.04 2wva s LEU 96 N 1.67 4.11 -0.16 2.97 2.96 -0.46 -1.13 118.68 128.63 2wva s LEU 96 Ca 0.05 0.33 0.00 0.00 -0.22 0.00 0.00 54.13 54.30 2wva s LEU 96 Cb -0.18 -2.37 0.00 0.00 0.50 0.00 0.00 46.19 44.14 2wva s LEU 96 CO 0.09 -0.07 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.26 2wva s ILE 97 N 1.48 2.56 -0.01 6.68 1.09 0.49 -0.75 121.20 132.74 2wva s ILE 97 Ca 0.15 -0.80 0.03 0.00 -1.10 0.00 0.00 60.65 58.93 2wva s ILE 97 Cb -0.15 -2.08 -0.03 0.00 -1.06 0.00 0.00 42.46 39.14 2wva s ILE 97 CO 0.08 0.52 -0.07 -0.55 -0.10 0.00 0.00 174.94 174.81 2wva s SER 98 N 0.94 4.58 0.72 3.58 0.15 0.53 -0.77 113.70 123.43 2wva s SER 98 Ca -0.03 -0.13 -0.13 0.00 0.70 0.00 0.00 55.95 56.36 2wva s SER 98 Cb -0.15 -1.08 0.03 0.00 -1.71 0.00 0.00 66.02 63.12 2wva s SER 98 CO -0.02 0.30 1.11 -0.83 1.20 0.00 0.00 173.24 175.00 2wva s GLY 99 N -1.25 1.97 0.22 9.45 0.00 -0.08 -1.35 107.32 116.28 2wva s GLY 99 Ca 0.16 0.48 -0.03 0.00 0.00 0.00 0.00 44.72 45.32 2wva s GLY 99 CO 0.06 0.84 0.22 0.00 0.00 0.00 0.00 173.10 174.21 2wva s ALA 100 N -2.53 0.89 0.68 3.20 0.00 -0.44 -2.85 121.76 120.72 2wva s ALA 100 Ca 0.65 -1.54 -0.17 0.00 0.00 0.00 0.00 51.96 50.91 2wva s ALA 100 Cb -0.20 1.32 -0.01 0.00 0.00 0.00 0.00 23.12 24.23 2wva s ALA 100 CO 0.48 -0.66 0.99 -2.30 0.00 0.00 0.00 175.76 174.27 2wva n PRO 101 N -0.32 0.67 -1.55 0.00 -0.02 -1.26 -1.12 135.00 131.40 2wva n PRO 101 Ca 0.01 0.28 -0.51 0.00 -2.02 0.00 0.00 63.50 61.26 2wva n PRO 101 Cb 0.65 -2.23 -0.05 0.00 -0.02 0.00 0.00 33.50 31.85 2wva n PRO 101 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2wva n ASN 102 N -1.41 0.87 0.03 2.55 2.85 -1.26 -3.50 115.26 115.39 2wva n ASN 102 Ca 0.14 1.14 0.06 0.00 -0.11 0.00 0.00 54.58 55.81 2wva n ASN 102 Cb 0.49 -1.12 0.28 0.00 1.24 0.00 0.00 39.78 40.66 2wva n ASN 102 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 2wva n ASN 103 N 2.01 0.13 0.14 1.20 6.94 -1.26 -1.47 115.26 122.95 2wva n ASN 103 Ca 0.17 0.54 0.13 0.00 -0.02 0.00 0.00 54.58 55.40 2wva n ASN 103 Cb 0.20 -0.57 0.48 0.00 -2.36 0.00 0.00 39.78 37.53 2wva n ASN 103 CO 0.00 0.00 0.00 0.78 -1.03 0.00 0.00 177.26 177.01 2wva h ASN 104 N 0.00 0.00 0.58 0.53 2.35 -1.95 -3.28 115.58 113.81 2wva h ASN 104 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2wva h ASN 104 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 2wva h ASN 104 CO 0.00 0.00 -0.34 0.47 -1.65 0.00 0.00 177.43 175.91 2wva n ASP 105 N -2.36 0.43 -4.77 5.81 8.00 -0.54 -4.75 116.55 118.36 2wva n ASP 105 Ca 0.03 -0.16 -0.38 0.00 0.71 0.00 0.00 54.79 55.00 2wva n ASP 105 Cb 0.30 0.05 -0.04 0.00 -0.02 0.00 0.00 41.12 41.41 2wva n ASP 105 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 2wva s HIS 106 N -2.92 3.31 -1.61 1.24 3.76 -1.24 -3.50 115.29 114.33 2wva s HIS 106 Ca 0.14 1.65 -0.09 0.00 -0.15 0.00 0.00 55.06 56.60 2wva s HIS 106 Cb 0.18 -3.20 0.09 0.00 1.11 0.00 0.00 32.58 30.76 2wva s HIS 106 CO 0.63 -0.70 0.44 0.00 -0.85 0.00 0.00 174.74 174.27 2wva n ALA 107 N 0.24 -1.66 -0.07 -1.40 0.00 -1.26 -4.81 120.51 111.55 2wva n ALA 107 Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2wva n ALA 107 Cb 0.48 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.89 2wva n ALA 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wva n ALA 108 N -4.39 1.45 -2.82 0.00 0.00 -1.23 -5.02 120.51 108.50 2wva n ALA 108 Ca -0.13 -0.08 -0.10 0.00 0.00 0.00 0.00 53.44 53.12 2wva n ALA 108 Cb 0.59 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.07 2wva n ALA 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wva n GLY 109 N 0.53 0.22 3.65 0.00 0.00 -1.26 -5.04 105.19 103.29 2wva n GLY 109 Ca 0.00 -0.31 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 2wva n GLY 109 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wva s HIS 110 N -3.00 3.27 -0.03 1.61 4.02 -1.26 -4.99 115.29 114.91 2wva s HIS 110 Ca 0.21 0.11 -0.23 0.00 1.02 0.00 0.00 55.06 56.16 2wva s HIS 110 Cb -0.09 -2.06 -0.04 0.00 -1.02 0.00 0.00 32.58 29.37 2wva s HIS 110 CO 0.26 0.20 0.70 0.08 1.02 0.00 0.00 174.74 177.00 2wva s VAL 111 N 0.23 4.94 0.06 -0.90 1.01 -1.26 -4.42 120.40 120.06 2wva s VAL 111 Ca 0.04 1.46 0.09 0.00 0.00 0.00 0.00 61.98 63.57 2wva s VAL 111 Cb -0.12 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 2wva s VAL 111 CO 0.00 0.31 -0.25 -0.76 0.00 0.00 0.00 175.10 174.41 2wva s LEU 112 N 0.42 2.19 0.65 3.92 1.43 -1.26 -5.10 118.68 120.93 2wva s LEU 112 Ca 0.37 -0.60 -0.17 0.00 -1.03 0.00 0.00 54.13 52.70 2wva s LEU 112 Cb -0.19 -1.16 -0.04 0.00 0.03 0.00 0.00 46.19 44.83 2wva s LEU 112 CO 0.19 0.21 0.84 0.00 0.23 0.00 0.00 176.35 177.82 2wva n HIS 113 N 1.64 0.34 -0.49 0.29 1.44 -1.26 -2.21 115.22 114.98 2wva n HIS 113 Ca -0.17 0.41 0.00 0.00 -2.01 0.00 0.00 57.72 55.95 2wva n HIS 113 Cb 0.53 -2.07 0.00 0.00 0.12 0.00 0.00 29.99 28.57 2wva n HIS 113 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2wva n HIS 114 N -2.04 0.00 -3.56 -1.40 8.25 -1.26 -4.99 115.22 110.22 2wva n HIS 114 Ca 0.13 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.40 2wva n HIS 114 Cb 0.48 -0.60 0.02 0.00 1.12 0.00 0.00 29.99 31.01 2wva n HIS 114 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wva n ALA 115 N 0.80 0.77 0.40 -1.41 0.00 -0.94 -4.26 120.51 115.88 2wva n ALA 115 Ca 0.00 -1.73 0.14 0.00 0.00 0.00 0.00 53.44 51.85 2wva n ALA 115 Cb 0.00 0.64 0.48 0.00 0.00 0.00 0.00 19.45 20.57 2wva n ALA 115 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2wva h LEU 116 N 0.00 0.00 0.00 0.00 3.38 -1.90 -3.46 115.31 113.32 2wva h LEU 116 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2wva h LEU 116 Cb 1.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2wva h LEU 116 CO 0.39 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.53 2wva n GLY 117 N 0.44 0.49 3.14 0.83 0.00 -1.26 -5.08 105.19 103.75 2wva n GLY 117 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 2wva n GLY 117 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wva n LYS 118 N -1.81 -0.26 -0.44 1.61 5.02 -1.26 -4.90 118.16 116.12 2wva n LYS 118 Ca 0.00 -2.06 0.10 0.00 -2.02 0.00 0.00 58.31 54.32 2wva n LYS 118 Cb 0.00 -0.69 0.31 0.00 -0.02 0.00 0.00 35.03 34.63 2wva n LYS 118 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2wva n THR 119 N -2.82 1.39 -4.72 -0.18 -2.24 -1.26 -4.56 114.28 99.90 2wva n THR 119 Ca 0.13 -1.12 -0.26 0.00 -2.27 0.00 0.00 64.05 60.53 2wva n THR 119 Cb 0.48 0.32 -0.14 0.00 -2.10 0.00 0.00 70.33 68.88 2wva n THR 119 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2wva s ASP 120 N -1.01 2.51 -0.18 3.42 -4.77 -1.26 -4.60 116.67 110.77 2wva s ASP 120 Ca 0.46 -0.50 0.15 0.00 -3.30 0.00 0.00 52.55 49.35 2wva s ASP 120 Cb 0.27 -0.22 0.39 0.00 -1.09 0.00 0.00 42.92 42.27 2wva s ASP 120 CO 0.26 0.18 1.25 -1.22 0.70 0.00 0.00 175.17 176.34 2wva n TYR 121 N 1.97 0.27 0.73 2.11 4.01 -1.26 -4.64 117.16 120.34 2wva n TYR 121 Ca -0.17 -1.22 0.12 0.00 -0.16 0.00 0.00 57.90 56.47 2wva n TYR 121 Cb 0.53 -0.25 0.24 0.00 -0.31 0.00 0.00 39.34 39.55 2wva n TYR 121 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 2wva n HIS 122 N -1.18 0.37 -0.07 -0.72 -0.00 -1.26 -4.32 115.22 108.05 2wva n HIS 122 Ca 0.20 0.11 -0.04 0.00 0.46 0.00 0.00 57.72 58.45 2wva n HIS 122 Cb 0.74 -0.54 0.19 0.00 -0.12 0.00 0.00 29.99 30.26 2wva n HIS 122 CO 0.00 0.00 0.00 0.10 0.46 0.00 0.00 176.34 176.90 2wva h TYR 123 N 0.00 0.75 -0.43 1.57 -0.00 -2.00 -2.40 116.97 114.47 2wva h TYR 123 Ca 0.00 -0.11 -0.02 0.00 -0.00 0.00 0.00 58.73 58.60 2wva h TYR 123 Cb 0.66 -0.20 -0.02 0.00 -0.00 0.00 0.00 36.73 37.16 2wva h TYR 123 CO 0.00 0.73 0.19 0.37 -0.00 0.00 0.00 178.16 179.44 2wva h GLN 124 N 0.66 0.63 0.04 0.10 4.15 -1.96 -0.53 115.11 118.20 2wva h GLN 124 Ca 0.13 -0.10 0.01 0.00 0.77 0.00 0.00 58.65 59.46 2wva h GLN 124 Cb 0.46 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.02 2wva h GLN 124 CO 0.02 0.56 -0.13 1.25 -1.93 0.00 0.00 178.83 178.61 2wva h LEU 125 N 0.55 -0.35 -0.84 -2.39 5.85 -1.78 -1.00 115.31 115.34 2wva h LEU 125 Ca 0.14 0.05 0.12 0.00 0.84 0.00 0.00 57.88 59.04 2wva h LEU 125 Cb 0.16 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.24 2wva h LEU 125 CO -0.01 -0.18 0.45 -0.33 -0.34 0.00 0.00 178.44 178.03 2wva h GLU 126 N -0.24 0.68 -0.45 1.25 5.08 -1.12 -0.64 114.58 119.14 2wva h GLU 126 Ca 0.03 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 2wva h GLU 126 Cb 0.27 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2wva h GLU 126 CO -0.09 0.45 0.07 0.52 -1.00 0.00 0.00 179.01 178.95 2wva h MET 127 N 0.70 0.75 -0.43 2.33 2.86 -0.70 -3.00 114.93 117.43 2wva h MET 127 Ca 0.44 -0.20 0.03 0.00 -2.06 0.00 0.00 59.70 57.90 2wva h MET 127 Cb 0.53 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.08 2wva h MET 127 CO -0.31 0.77 0.29 0.00 1.06 0.00 0.00 176.91 178.72 2wva h ALA 128 N 0.94 1.81 0.00 6.32 0.00 0.20 -2.13 119.26 126.40 2wva h ALA 128 Ca 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2wva h ALA 128 Cb 0.39 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2wva h ALA 128 CO 0.01 0.14 -0.03 0.87 0.00 0.00 0.00 179.25 180.25 2wva h LYS 129 N 0.48 0.00 0.00 0.00 1.57 -1.11 -1.64 116.57 115.88 2wva h LYS 129 Ca 0.17 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 2wva h LYS 129 Cb 0.10 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 2wva h LYS 129 CO -0.04 0.03 -0.04 -0.91 -0.57 0.00 0.00 179.45 177.92 2wva h ASN 130 N 0.00 0.00 0.00 0.86 2.35 -1.49 -3.33 115.58 113.97 2wva h ASN 130 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2wva h ASN 130 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 2wva h ASN 130 CO 0.00 0.04 -0.17 2.30 -1.65 0.00 0.00 177.43 177.95 2wva n ILE 131 N -3.13 0.87 -4.25 2.81 -5.35 -0.63 -5.06 119.36 104.62 2wva n ILE 131 Ca 0.01 -1.02 -0.14 0.00 -0.27 0.00 0.00 62.75 61.34 2wva n ILE 131 Cb 0.38 0.28 -0.10 0.00 -1.74 0.00 0.00 39.64 38.46 2wva n ILE 131 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2wva s THR 132 N -1.25 0.68 -0.72 7.28 -4.23 -1.10 -4.41 115.64 111.88 2wva s THR 132 Ca 0.12 -1.98 0.24 0.00 -1.18 0.00 0.00 61.69 58.89 2wva s THR 132 Cb 0.11 -2.16 0.05 0.00 1.34 0.00 0.00 72.50 71.83 2wva s THR 132 CO 0.01 -0.44 1.36 0.00 -0.54 0.00 0.00 174.62 175.01 2wva n ALA 133 N -0.26 3.01 -3.60 3.99 0.00 -0.33 -4.89 120.51 118.43 2wva n ALA 133 Ca -0.06 -0.26 -0.13 0.00 0.00 0.00 0.00 53.44 52.99 2wva n ALA 133 Cb 0.63 -1.17 -0.06 0.00 0.00 0.00 0.00 19.45 18.85 2wva n ALA 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wva s ALA 134 N -3.13 -1.87 -0.14 0.00 0.00 -1.26 -5.02 121.76 110.35 2wva s ALA 134 Ca 0.07 1.75 -0.06 0.00 0.00 0.00 0.00 51.96 53.72 2wva s ALA 134 Cb 0.14 -0.93 0.06 0.00 0.00 0.00 0.00 23.12 22.39 2wva s ALA 134 CO 0.71 -0.31 0.31 0.00 0.00 0.00 0.00 175.76 176.47 2wva s ALA 135 N -0.27 -0.74 -0.01 0.00 0.00 -1.26 -0.97 121.76 118.51 2wva s ALA 135 Ca -0.02 1.18 0.01 0.00 0.00 0.00 0.00 51.96 53.13 2wva s ALA 135 Cb -0.03 -0.85 0.00 0.00 0.00 0.00 0.00 23.12 22.25 2wva s ALA 135 CO 0.01 -0.35 -0.04 -1.21 0.00 0.00 0.00 175.76 174.18 2wva s GLU 136 N 1.63 0.36 -0.13 0.00 0.41 -0.20 -4.97 118.70 115.80 2wva s GLU 136 Ca -0.07 -0.12 -0.05 0.00 -0.41 0.00 0.00 54.97 54.33 2wva s GLU 136 Cb -0.10 -0.37 -0.04 0.00 -1.78 0.00 0.00 34.13 31.84 2wva s GLU 136 CO -0.10 0.05 0.05 0.00 -0.49 0.00 0.00 175.26 174.77 2wva s ALA 137 N 0.11 3.45 -0.29 5.21 0.00 -1.26 -2.12 121.76 126.86 2wva s ALA 137 Ca -0.01 -0.75 -0.04 0.00 0.00 0.00 0.00 51.96 51.17 2wva s ALA 137 Cb -0.04 -1.75 0.03 0.00 0.00 0.00 0.00 23.12 21.36 2wva s ALA 137 CO -0.00 0.44 0.01 0.42 0.00 0.00 0.00 175.76 176.63 2wva s ILE 138 N -0.42 3.29 -0.07 0.00 1.01 0.22 -4.95 121.20 120.26 2wva s ILE 138 Ca 0.09 -1.08 0.17 0.00 0.00 0.00 0.00 60.65 59.83 2wva s ILE 138 Cb -0.12 -2.77 -0.25 0.00 0.01 0.00 0.00 42.46 39.32 2wva s ILE 138 CO 0.02 0.02 0.27 -1.22 0.00 0.00 0.00 174.94 174.03 2wva n TYR 139 N 4.72 0.00 -4.22 3.97 4.01 -1.26 -1.81 117.16 122.57 2wva n TYR 139 Ca -0.14 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.42 2wva n TYR 139 Cb 0.46 -0.56 -0.11 0.00 -0.31 0.00 0.00 39.34 38.82 2wva n TYR 139 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2wva s THR 140 N -2.95 1.22 0.31 -0.72 -4.23 -1.26 -4.77 115.64 103.25 2wva s THR 140 Ca -0.07 -1.63 0.01 0.00 -1.18 0.00 0.00 61.69 58.83 2wva s THR 140 Cb 0.09 -1.42 0.18 0.00 1.34 0.00 0.00 72.50 72.70 2wva s THR 140 CO 0.72 -0.40 1.88 -0.65 -0.54 0.00 0.00 174.62 175.63 2wva h PRO 141 N 3.67 0.73 0.00 3.99 0.11 -1.89 -2.65 132.00 135.96 2wva h PRO 141 Ca -0.40 -0.12 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 2wva h PRO 141 Cb 1.19 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 2wva h PRO 141 CO 0.49 0.64 -0.02 0.93 -0.21 0.00 0.00 178.00 179.83 2wva h GLU 142 N 0.71 0.00 0.00 1.05 3.07 -1.97 -1.59 114.58 115.85 2wva h GLU 142 Ca 0.16 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.01 2wva h GLU 142 Cb 0.22 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.13 2wva h GLU 142 CO -0.01 0.02 -0.14 0.93 -1.40 0.00 0.00 179.01 178.41 2wva h GLU 143 N 0.00 0.00 -0.11 2.33 5.08 -1.90 -3.39 114.58 116.59 2wva h GLU 143 Ca -0.00 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 2wva h GLU 143 Cb 0.03 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 2wva h GLU 143 CO 0.00 0.06 -0.12 0.00 -1.00 0.00 0.00 179.01 177.95 2wva h ALA 144 N 1.94 -0.04 -0.27 3.43 0.00 -1.30 -2.84 119.26 120.17 2wva h ALA 144 Ca -0.00 0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.99 2wva h ALA 144 Cb 1.05 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 19.05 2wva h ALA 144 CO 0.01 -0.58 0.04 -1.35 0.00 0.00 0.00 179.25 177.37 2wva h PRO 145 N -0.15 0.13 -0.53 0.00 0.11 -1.76 0.20 132.00 130.00 2wva h PRO 145 Ca 0.08 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.17 2wva h PRO 145 Cb 0.27 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.33 2wva h PRO 145 CO -0.20 0.09 0.29 0.00 -0.21 0.00 0.00 178.00 177.96 2wva h ALA 146 N 1.21 0.68 -0.29 -0.75 0.00 -1.83 -1.32 119.26 116.97 2wva h ALA 146 Ca 0.13 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 2wva h ALA 146 Cb 0.14 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2wva h ALA 146 CO -0.18 0.21 -0.49 0.87 0.00 0.00 0.00 179.25 179.66 2wva h LYS 147 N 0.71 0.80 -0.04 0.00 1.57 -1.20 -0.45 116.57 117.97 2wva h LYS 147 Ca 0.19 -0.48 -0.00 0.00 -1.87 0.00 0.00 60.65 58.49 2wva h LYS 147 Cb 0.05 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 2wva h LYS 147 CO -0.03 1.11 0.03 0.82 -0.57 0.00 0.00 179.45 180.80 2wva h ILE 148 N 0.63 1.05 -0.68 1.86 2.04 -0.47 -2.63 117.51 119.31 2wva h ILE 148 Ca 0.03 -0.13 -0.02 0.00 1.00 0.00 0.00 64.86 65.73 2wva h ILE 148 Cb 1.08 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 38.18 2wva h ILE 148 CO 0.11 0.04 0.35 0.44 0.00 0.00 0.00 178.15 179.09 2wva h ASP 149 N 0.02 0.87 -0.16 1.72 3.32 -1.14 -2.35 116.42 118.70 2wva h ASP 149 Ca 0.02 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.95 2wva h ASP 149 Cb 0.04 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 2wva h ASP 149 CO -0.00 0.74 0.10 -0.74 -1.72 0.00 0.00 179.24 177.62 2wva h HIS 150 N 0.94 0.20 -0.20 4.55 -0.00 -0.98 -0.06 115.15 119.60 2wva h HIS 150 Ca 0.24 0.00 -0.14 0.00 -0.00 0.00 0.00 60.37 60.46 2wva h HIS 150 Cb 0.08 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.42 2wva h HIS 150 CO 0.00 0.15 -0.48 -0.39 -0.00 0.00 0.00 177.93 177.21 2wva h VAL 151 N 0.20 1.32 -0.25 5.26 -1.51 -1.40 -1.57 116.25 118.29 2wva h VAL 151 Ca 0.06 -1.69 -0.10 0.00 -1.23 0.00 0.00 66.70 63.74 2wva h VAL 151 Cb 0.00 1.68 -0.00 0.00 -2.13 0.00 0.00 31.29 30.84 2wva h VAL 151 CO -0.01 0.53 -0.22 0.40 -1.23 0.00 0.00 177.57 177.04 2wva h ILE 152 N 0.41 1.31 -0.80 7.19 2.04 -1.31 -0.63 117.51 125.73 2wva h ILE 152 Ca 0.02 -1.37 0.02 0.00 1.00 0.00 0.00 64.86 64.54 2wva h ILE 152 Cb 0.99 1.64 -0.05 0.00 -0.74 0.00 0.00 36.82 38.67 2wva h ILE 152 CO 0.09 0.43 0.52 0.11 0.00 0.00 0.00 178.15 179.29 2wva h LYS 153 N 0.30 0.99 -0.37 2.37 1.57 -0.94 -2.19 116.57 118.30 2wva h LYS 153 Ca 0.04 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 2wva h LYS 153 Cb 0.76 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 2wva h LYS 153 CO 0.06 0.66 0.03 1.15 -0.57 0.00 0.00 179.45 180.78 2wva h THR 154 N 1.02 1.25 -0.33 -0.16 2.02 -1.17 -1.03 112.91 114.51 2wva h THR 154 Ca 0.31 -0.91 0.05 0.00 0.77 0.00 0.00 66.41 66.62 2wva h THR 154 Cb -0.03 1.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.46 2wva h THR 154 CO -0.10 0.31 0.07 0.00 0.37 0.00 0.00 175.52 176.17 2wva h ALA 155 N 0.89 0.35 -0.46 6.16 0.00 -0.86 -0.92 119.26 124.42 2wva h ALA 155 Ca 0.11 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 2wva h ALA 155 Cb 0.41 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2wva h ALA 155 CO 0.01 -0.33 -0.13 -0.07 0.00 0.00 0.00 179.25 178.73 2wva h LEU 156 N 0.19 0.85 -0.09 0.00 3.38 -1.29 0.51 115.31 118.87 2wva h LEU 156 Ca 0.15 -0.27 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 2wva h LEU 156 Cb 0.16 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2wva h LEU 156 CO -0.20 0.99 -0.24 -0.09 0.09 0.00 0.00 178.44 178.99 2wva h ARG 157 N 0.76 0.31 0.00 1.13 2.43 -0.93 -3.33 114.38 114.76 2wva h ARG 157 Ca 0.12 -0.23 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2wva h ARG 157 Cb 0.64 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2wva h ARG 157 CO 0.04 0.84 -0.65 0.93 -1.51 0.00 0.00 179.97 179.62 2wva h GLU 158 N -0.16 0.00 -5.56 0.20 4.39 -1.21 -3.48 114.58 108.76 2wva h GLU 158 Ca -0.01 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.39 2wva h GLU 158 Cb 0.86 0.00 0.18 0.00 -0.10 0.00 0.00 28.75 29.69 2wva h GLU 158 CO 0.05 0.00 -0.79 1.63 -1.16 0.00 0.00 179.01 178.74 2wva n LYS 159 N -2.65 -5.31 -4.06 2.33 4.76 0.16 -5.00 118.16 108.38 2wva n LYS 159 Ca 0.02 0.85 -0.08 0.00 -2.87 0.00 0.00 58.31 56.22 2wva n LYS 159 Cb 0.52 -5.82 -0.10 0.00 -1.84 0.00 0.00 35.03 27.78 2wva n LYS 159 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2wva s LYS 160 N -5.07 0.54 0.70 1.97 -0.14 -1.15 -3.01 119.74 113.58 2wva s LYS 160 Ca 0.13 -1.04 -0.11 0.00 -1.36 0.00 0.00 55.97 53.59 2wva s LYS 160 Cb -0.02 0.13 0.01 0.00 -1.68 0.00 0.00 37.83 36.27 2wva s LYS 160 CO 0.73 -0.08 1.06 -1.25 -0.76 0.00 0.00 175.35 175.05 2wva s PRO 161 N -3.14 2.91 0.26 -1.68 0.04 -1.15 -4.26 135.00 127.98 2wva s PRO 161 Ca 0.00 0.88 0.02 0.00 0.04 0.00 0.00 61.00 61.94 2wva s PRO 161 Cb 0.02 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.52 2wva s PRO 161 CO -0.07 -1.10 0.08 0.14 0.04 0.00 0.00 177.00 176.09 2wva s VAL 162 N -3.08 0.63 -0.04 -0.36 -7.23 -0.69 -1.18 120.40 108.45 2wva s VAL 162 Ca 0.58 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.78 2wva s VAL 162 Cb -0.14 -2.60 0.00 0.00 0.56 0.00 0.00 36.38 34.20 2wva s VAL 162 CO 0.55 -0.05 -0.12 -0.47 -0.31 0.00 0.00 175.10 174.69 2wva s TYR 163 N -3.70 1.29 0.00 2.82 5.04 -0.14 -1.36 117.35 121.30 2wva s TYR 163 Ca 0.36 -0.36 0.05 0.00 -2.44 0.00 0.00 57.07 54.68 2wva s TYR 163 Cb 0.08 -0.90 -0.01 0.00 0.35 0.00 0.00 41.96 41.47 2wva s TYR 163 CO 0.13 -0.14 -0.15 -0.51 -1.34 0.00 0.00 175.55 173.54 2wva s LEU 164 N 0.18 2.06 0.05 6.97 1.43 0.07 -1.03 118.68 128.41 2wva s LEU 164 Ca -0.04 -0.32 0.06 0.00 -1.03 0.00 0.00 54.13 52.80 2wva s LEU 164 Cb -0.10 -0.74 -0.02 0.00 0.03 0.00 0.00 46.19 45.35 2wva s LEU 164 CO 0.01 0.15 -0.18 -1.83 0.23 0.00 0.00 176.35 174.74 2wva s GLU 165 N -0.54 1.15 -0.08 1.70 -1.05 -0.90 -0.35 118.70 118.63 2wva s GLU 165 Ca 0.05 -0.87 0.00 0.00 -0.15 0.00 0.00 54.97 54.00 2wva s GLU 165 Cb -0.06 -1.23 0.02 0.00 -0.44 0.00 0.00 34.13 32.42 2wva s GLU 165 CO -0.00 0.31 -0.06 0.42 0.95 0.00 0.00 175.26 176.88 2wva s ILE 166 N -0.86 0.79 0.20 1.83 1.01 -0.45 -0.61 121.20 123.11 2wva s ILE 166 Ca 0.05 -0.18 -0.33 0.00 0.00 0.00 0.00 60.65 60.18 2wva s ILE 166 Cb -0.08 -0.83 -0.14 0.00 0.01 0.00 0.00 42.46 41.42 2wva s ILE 166 CO 0.02 0.31 1.45 0.00 0.00 0.00 0.00 174.94 176.72 2wva n ALA 167 N 4.66 0.97 0.30 9.38 0.00 -0.75 -1.33 120.51 133.74 2wva n ALA 167 Ca -0.15 0.43 0.17 0.00 0.00 0.00 0.00 53.44 53.89 2wva n ALA 167 Cb 0.50 -2.28 0.95 0.00 0.00 0.00 0.00 19.45 18.63 2wva n ALA 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wva n ASN 169 N -3.60 2.44 -0.27 0.00 6.94 -1.26 -4.00 115.26 115.51 2wva n ASN 169 Ca -0.03 -1.84 0.05 0.00 -0.02 0.00 0.00 54.58 52.75 2wva n ASN 169 Cb 0.11 -0.16 0.01 0.00 -2.36 0.00 0.00 39.78 37.39 2wva n ASN 169 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 2wva n ILE 170 N 0.84 0.00 0.18 1.53 -5.35 -0.87 -4.65 119.36 111.04 2wva n ILE 170 Ca 0.17 -0.42 0.14 0.00 -0.27 0.00 0.00 62.75 62.37 2wva n ILE 170 Cb 0.45 1.14 0.72 0.00 -1.74 0.00 0.00 39.64 40.21 2wva n ILE 170 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wva h ALA 171 N 1.81 2.06 -0.03 -1.28 0.00 -1.69 -0.94 119.26 119.18 2wva h ALA 171 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wva h ALA 171 Cb 0.36 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2wva h ALA 171 CO 0.00 -0.24 -0.07 0.43 0.00 0.00 0.00 179.25 179.37 2wva n SER 172 N -4.28 2.84 -4.80 0.00 7.64 -1.26 -1.65 113.62 112.10 2wva n SER 172 Ca 0.01 -1.92 -0.35 0.00 1.01 0.00 0.00 58.87 57.63 2wva n SER 172 Cb 0.28 0.07 -0.07 0.00 -1.01 0.00 0.00 64.21 63.48 2wva n SER 172 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2wva s MET 173 N -2.04 4.40 0.48 1.43 1.00 -0.36 -4.80 119.30 119.41 2wva s MET 173 Ca 0.26 1.21 -0.22 0.00 0.00 0.00 0.00 55.69 56.94 2wva s MET 173 Cb 0.19 -2.49 -0.07 0.00 0.00 0.00 0.00 34.83 32.46 2wva s MET 173 CO 0.33 0.13 1.15 -2.14 0.00 0.00 0.00 175.02 174.49 2wva s PRO 174 N -2.62 3.68 0.36 2.03 0.02 -1.26 -1.36 135.00 135.85 2wva s PRO 174 Ca 0.56 1.71 -0.06 0.00 0.02 0.00 0.00 61.00 63.24 2wva s PRO 174 Cb -0.14 -2.31 0.02 0.00 0.02 0.00 0.00 34.50 32.09 2wva s PRO 174 CO 0.18 -0.60 0.56 0.00 -0.33 0.00 0.00 177.00 176.81 2wva s ALA 176 N -2.84 -0.16 0.17 0.00 0.00 -1.26 -4.23 121.76 113.44 2wva s ALA 176 Ca 0.27 0.03 0.02 0.00 0.00 0.00 0.00 51.96 52.27 2wva s ALA 176 Cb -0.02 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 2wva s ALA 176 CO 0.18 -3.68 0.32 0.00 0.00 0.00 0.00 175.76 172.58 2wva s ALA 177 N -2.48 3.93 0.23 0.00 0.00 -1.26 -4.72 121.76 117.46 2wva s ALA 177 Ca 0.68 -0.99 -0.30 0.00 0.00 0.00 0.00 51.96 51.35 2wva s ALA 177 Cb -0.25 -1.83 -0.09 0.00 0.00 0.00 0.00 23.12 20.95 2wva s ALA 177 CO 0.63 0.49 1.17 -2.14 0.00 0.00 0.00 175.76 175.92 2wva s PRO 178 N -3.31 4.53 0.00 0.00 0.02 -1.26 -5.07 135.00 129.91 2wva s PRO 178 Ca 0.35 1.88 0.00 0.00 0.02 0.00 0.00 61.00 63.26 2wva s PRO 178 Cb -0.11 -3.21 0.00 0.00 0.02 0.00 0.00 34.50 31.20 2wva s PRO 178 CO 0.29 0.01 0.00 0.41 -0.33 0.00 0.00 177.00 177.37 2wva n GLY 179 N 1.72 -1.52 3.77 0.52 0.00 -1.26 -5.00 105.19 103.42 2wva n GLY 179 Ca 0.02 -1.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.07 2wva n GLY 179 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wva n PRO 180 N -0.66 2.69 -0.09 1.61 -0.02 -1.26 -4.92 135.00 132.36 2wva n PRO 180 Ca 0.00 0.95 0.22 0.00 -2.02 0.00 0.00 63.50 62.65 2wva n PRO 180 Cb 0.00 -2.69 0.67 0.00 -0.02 0.00 0.00 33.50 31.46 2wva n PRO 180 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wva h ALA 181 N 3.35 2.54 0.00 3.55 0.00 -1.94 -2.50 119.26 124.26 2wva h ALA 181 Ca -0.50 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 2wva h ALA 181 Cb 1.24 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2wva h ALA 181 CO 0.67 -0.74 -0.04 0.66 0.00 0.00 0.00 179.25 179.81 2wva h SER 182 N 0.07 0.00 0.16 0.00 4.64 -1.93 -1.26 113.55 115.23 2wva h SER 182 Ca 0.33 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.63 2wva h SER 182 Cb 1.20 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2wva h SER 182 CO -0.03 0.04 -0.08 0.00 -0.87 0.00 0.00 176.83 175.89 2wva h ALA 183 N 1.96 1.55 0.00 5.18 0.00 -1.83 -2.81 119.26 123.30 2wva h ALA 183 Ca -0.00 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 2wva h ALA 183 Cb 0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2wva h ALA 183 CO 0.01 0.10 -0.48 -0.07 0.00 0.00 0.00 179.25 178.80 2wva h LEU 184 N 0.00 0.00 -0.36 0.00 3.38 -1.42 -3.19 115.31 113.72 2wva h LEU 184 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2wva h LEU 184 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2wva h LEU 184 CO 0.01 0.48 -0.70 0.49 0.09 0.00 0.00 178.44 178.81 2wva n PHE 185 N -3.40 0.00 -1.68 1.13 3.72 -1.08 -4.56 117.46 111.59 2wva n PHE 185 Ca 0.01 0.00 -0.50 0.00 -0.05 0.00 0.00 57.45 56.91 2wva n PHE 185 Cb 0.63 -0.05 -0.05 0.00 -0.94 0.00 0.00 39.48 39.08 2wva n PHE 185 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2wva n ASN 186 N -0.96 3.29 -4.11 4.37 5.15 -1.12 -4.97 115.26 116.92 2wva n ASN 186 Ca 0.07 0.96 -0.08 0.00 -0.60 0.00 0.00 54.58 54.93 2wva n ASN 186 Cb 0.38 -1.34 -0.10 0.00 -0.53 0.00 0.00 39.78 38.18 2wva n ASN 186 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2wva s ASP 187 N 4.19 0.65 0.64 1.20 2.15 -1.26 -5.02 116.67 119.22 2wva s ASP 187 Ca 0.94 -1.00 -0.16 0.00 0.43 0.00 0.00 52.55 52.76 2wva s ASP 187 Cb -0.74 0.17 -0.01 0.00 -0.30 0.00 0.00 42.92 42.04 2wva s ASP 187 CO 0.53 -0.56 1.13 -1.83 -0.17 0.00 0.00 175.17 174.27 2wva s GLU 188 N -3.89 2.84 0.49 4.34 -1.05 -1.26 -5.04 118.70 115.14 2wva s GLU 188 Ca 0.08 1.51 0.01 0.00 -0.15 0.00 0.00 54.97 56.42 2wva s GLU 188 Cb 0.07 -1.95 0.01 0.00 -0.44 0.00 0.00 34.13 31.83 2wva s GLU 188 CO -0.09 -1.24 0.71 0.00 0.95 0.00 0.00 175.26 175.60 2wva s ALA 189 N -2.13 3.84 0.57 -0.84 0.00 -1.26 -5.05 121.76 116.89 2wva s ALA 189 Ca 0.70 -1.19 -0.21 0.00 0.00 0.00 0.00 51.96 51.26 2wva s ALA 189 Cb -0.23 -2.09 -0.04 0.00 0.00 0.00 0.00 23.12 20.75 2wva s ALA 189 CO 0.38 -0.53 1.25 0.43 0.00 0.00 0.00 175.76 177.29 2wva n SER 190 N -2.18 2.09 -4.67 0.00 7.64 -1.26 -4.92 113.62 110.32 2wva n SER 190 Ca 0.04 0.92 -0.43 0.00 1.01 0.00 0.00 58.87 60.42 2wva n SER 190 Cb 0.59 -1.52 -0.02 0.00 -1.01 0.00 0.00 64.21 62.24 2wva n SER 190 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2wva s ASP 191 N -1.06 6.86 0.11 6.43 2.15 -0.12 -4.94 116.67 126.10 2wva s ASP 191 Ca 0.74 1.92 -0.25 0.00 0.43 0.00 0.00 52.55 55.40 2wva s ASP 191 Cb -0.42 -2.54 -0.08 0.00 -0.30 0.00 0.00 42.92 39.58 2wva s ASP 191 CO 0.47 -0.79 1.67 -0.08 -0.17 0.00 0.00 175.17 176.27 2wva h GLU 192 N 8.49 -0.31 -0.96 4.34 4.57 -1.91 0.12 114.58 128.92 2wva h GLU 192 Ca -0.32 0.02 0.10 0.00 -1.18 0.00 0.00 59.36 57.97 2wva h GLU 192 Cb 1.14 0.07 -0.08 0.00 -0.16 0.00 0.00 28.75 29.73 2wva h GLU 192 CO 0.95 -0.21 0.60 0.00 -1.18 0.00 0.00 179.01 179.17 2wva h ALA 193 N 0.54 1.39 -0.21 2.92 0.00 -1.99 -1.05 119.26 120.86 2wva h ALA 193 Ca 0.04 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2wva h ALA 193 Cb 0.36 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2wva h ALA 193 CO -0.13 0.26 -0.16 0.77 0.00 0.00 0.00 179.25 180.00 2wva h SER 194 N 1.00 0.51 -0.19 0.00 0.02 -1.78 -1.15 113.55 111.96 2wva h SER 194 Ca 0.45 -0.45 0.05 0.00 -0.84 0.00 0.00 61.79 61.00 2wva h SER 194 Cb 0.35 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.70 2wva h SER 194 CO -0.23 0.85 -0.12 0.25 -1.14 0.00 0.00 176.83 176.43 2wva h LEU 195 N 0.17 -0.40 -0.68 5.07 5.85 -0.13 0.11 115.31 125.30 2wva h LEU 195 Ca 0.04 0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 2wva h LEU 195 Cb 0.68 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.89 2wva h LEU 195 CO 0.04 -0.16 0.22 0.78 -0.34 0.00 0.00 178.44 178.98 2wva h ASN 196 N -0.12 0.99 -0.40 1.25 2.35 -1.20 -1.94 115.58 116.51 2wva h ASN 196 Ca 0.11 -0.20 -0.10 0.00 -0.55 0.00 0.00 56.30 55.56 2wva h ASN 196 Cb 0.29 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 2wva h ASN 196 CO -0.27 0.93 -0.10 0.00 -1.65 0.00 0.00 177.43 176.34 2wva h ALA 197 N 1.10 0.94 -0.62 -0.83 0.00 -0.84 -0.90 119.26 118.11 2wva h ALA 197 Ca 0.22 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 2wva h ALA 197 Cb 0.29 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2wva h ALA 197 CO -0.01 0.62 0.05 0.00 0.00 0.00 0.00 179.25 179.92 2wva h ALA 198 N 1.12 0.83 -0.05 0.00 0.00 -0.59 -0.60 119.26 119.97 2wva h ALA 198 Ca 0.13 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2wva h ALA 198 Cb 0.60 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2wva h ALA 198 CO 0.04 0.64 -0.00 0.28 0.00 0.00 0.00 179.25 180.20 2wva h VAL 199 N 0.97 1.26 -0.91 0.00 2.07 -1.16 -2.03 116.25 116.44 2wva h VAL 199 Ca 0.18 -0.78 0.01 0.00 0.82 0.00 0.00 66.70 66.93 2wva h VAL 199 Cb 0.50 1.69 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 2wva h VAL 199 CO 0.02 0.21 0.60 -0.33 0.02 0.00 0.00 177.57 178.09 2wva h GLU 200 N -0.21 1.19 -0.12 1.57 4.39 -1.08 -0.83 114.58 119.49 2wva h GLU 200 Ca 0.01 -0.07 -0.09 0.00 0.34 0.00 0.00 59.36 59.55 2wva h GLU 200 Cb 0.34 -0.27 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2wva h GLU 200 CO 0.00 0.79 -0.31 0.93 -1.16 0.00 0.00 179.01 179.27 2wva h GLU 201 N 1.23 0.22 -0.34 2.33 4.39 -1.08 -1.18 114.58 120.16 2wva h GLU 201 Ca 0.33 -0.08 -0.10 0.00 0.34 0.00 0.00 59.36 59.84 2wva h GLU 201 Cb -0.14 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.49 2wva h GLU 201 CO -0.07 0.52 -0.19 1.15 -1.16 0.00 0.00 179.01 179.26 2wva h THR 202 N 0.20 1.29 -0.32 1.13 2.02 -0.59 -1.08 112.91 115.57 2wva h THR 202 Ca 0.03 -1.32 -0.00 0.00 0.77 0.00 0.00 66.41 65.88 2wva h THR 202 Cb 0.65 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.47 2wva h THR 202 CO 0.05 0.43 0.19 -0.07 0.37 0.00 0.00 175.52 176.49 2wva h LEU 203 N 0.50 0.38 -0.92 2.58 3.38 -0.91 -1.89 115.31 118.43 2wva h LEU 203 Ca 0.07 -0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.04 2wva h LEU 203 Cb 0.74 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.33 2wva h LEU 203 CO 0.06 0.32 0.59 0.11 0.09 0.00 0.00 178.44 179.60 2wva h LYS 204 N 0.40 1.05 -0.71 1.13 1.57 -1.16 -0.91 116.57 117.95 2wva h LYS 204 Ca 0.11 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.76 2wva h LYS 204 Cb 0.01 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.06 2wva h LYS 204 CO -0.02 0.70 0.17 0.35 -0.57 0.00 0.00 179.45 180.07 2wva h PHE 205 N 1.08 1.20 -0.25 -1.35 3.57 -0.83 -2.88 116.94 117.48 2wva h PHE 205 Ca 0.39 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.75 2wva h PHE 205 Cb 0.13 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 38.53 2wva h PHE 205 CO -0.02 0.97 0.00 0.44 -2.23 0.00 0.00 178.31 177.48 2wva n ILE 206 N -4.23 0.31 -0.09 1.41 -5.35 -0.74 -4.46 119.36 106.21 2wva n ILE 206 Ca 0.05 -0.54 -0.08 0.00 -0.27 0.00 0.00 62.75 61.91 2wva n ILE 206 Cb 0.27 0.77 -0.01 0.00 -1.74 0.00 0.00 39.64 38.93 2wva n ILE 206 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wva h ALA 207 N 4.35 -0.14 -1.24 -1.28 0.00 -0.94 -2.76 119.26 117.24 2wva h ALA 207 Ca 0.00 0.10 -0.60 0.00 0.00 0.00 0.00 54.91 54.40 2wva h ALA 207 Cb 0.77 0.61 -0.40 0.00 0.00 0.00 0.00 17.79 18.77 2wva h ALA 207 CO 0.00 -0.69 -0.49 0.09 0.00 0.00 0.00 179.25 178.16 2wva n ASN 208 N -5.40 5.21 -3.66 0.00 3.02 -1.26 -4.84 115.26 108.33 2wva n ASN 208 Ca 0.00 -3.74 -0.29 0.00 -0.03 0.00 0.00 54.58 50.52 2wva n ASN 208 Cb 0.32 -0.52 -0.15 0.00 -0.61 0.00 0.00 39.78 38.82 2wva n ASN 208 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2wva s ARG 209 N -3.63 0.49 0.03 3.52 0.52 -1.04 -5.04 118.95 113.80 2wva s ARG 209 Ca 0.50 -0.78 0.03 0.00 -0.52 0.00 0.00 55.73 54.96 2wva s ARG 209 Cb 0.41 -1.68 -0.25 0.00 0.52 0.00 0.00 34.95 33.96 2wva s ARG 209 CO -0.15 -0.96 0.94 0.22 0.02 0.00 0.00 175.30 175.38 2wva h ASP 210 N 8.23 0.20 -1.63 0.23 3.58 -1.88 -3.41 116.42 121.74 2wva h ASP 210 Ca -0.16 -0.27 -0.66 0.00 0.42 0.00 0.00 57.03 56.36 2wva h ASP 210 Cb 1.03 -0.06 -0.13 0.00 1.72 0.00 0.00 39.33 41.88 2wva h ASP 210 CO 0.44 1.23 1.36 -0.54 -2.88 0.00 0.00 179.24 178.85 2wva s LYS 211 N -2.64 3.71 -0.24 0.28 1.02 -1.26 -2.66 119.74 117.94 2wva s LYS 211 Ca -0.05 -1.63 -0.10 0.00 0.02 0.00 0.00 55.97 54.21 2wva s LYS 211 Cb 0.08 -5.20 -0.05 0.00 -0.52 0.00 0.00 37.83 32.14 2wva s LYS 211 CO 0.84 -2.02 0.16 0.08 -0.92 0.00 0.00 175.35 173.49 2wva s VAL 212 N 3.71 5.31 0.02 3.17 1.01 -1.26 -0.17 120.40 132.18 2wva s VAL 212 Ca 0.42 0.16 0.04 0.00 0.00 0.00 0.00 61.98 62.61 2wva s VAL 212 Cb -0.01 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 2wva s VAL 212 CO -0.06 0.34 -0.10 0.00 0.00 0.00 0.00 175.10 175.28 2wva s ALA 213 N 1.14 2.91 -0.19 5.51 0.00 -0.06 -3.27 121.76 127.80 2wva s ALA 213 Ca 0.07 -1.07 -0.05 0.00 0.00 0.00 0.00 51.96 50.92 2wva s ALA 213 Cb -0.14 -1.02 -0.02 0.00 0.00 0.00 0.00 23.12 21.93 2wva s ALA 213 CO 0.05 0.60 -0.01 0.08 0.00 0.00 0.00 175.76 176.49 2wva s VAL 214 N -0.98 3.92 -0.34 0.00 1.01 0.16 -0.11 120.40 124.06 2wva s VAL 214 Ca 0.17 -0.33 -0.06 0.00 0.00 0.00 0.00 61.98 61.76 2wva s VAL 214 Cb -0.11 -2.76 0.04 0.00 0.00 0.00 0.00 36.38 33.55 2wva s VAL 214 CO 0.07 0.44 0.10 -0.22 0.00 0.00 0.00 175.10 175.49 2wva s LEU 215 N 0.90 4.29 -0.11 3.92 2.96 0.07 -0.65 118.68 130.05 2wva s LEU 215 Ca 0.01 -1.16 -0.27 0.00 -0.22 0.00 0.00 54.13 52.48 2wva s LEU 215 Cb -0.14 -1.85 -0.02 0.00 0.50 0.00 0.00 46.19 44.68 2wva s LEU 215 CO 0.02 -0.32 0.91 -0.69 -1.32 0.00 0.00 176.35 174.94 2wva s VAL 216 N 1.39 4.85 0.33 1.68 1.01 0.56 -0.66 120.40 129.57 2wva s VAL 216 Ca -0.02 1.83 0.07 0.00 0.00 0.00 0.00 61.98 63.87 2wva s VAL 216 Cb -0.20 -4.22 -0.02 0.00 0.00 0.00 0.00 36.38 31.94 2wva s VAL 216 CO 0.02 0.05 0.36 -0.83 0.00 0.00 0.00 175.10 174.70 2wva s GLY 217 N 1.08 1.68 0.00 4.51 0.00 0.48 -1.13 107.32 113.93 2wva s GLY 217 Ca 0.44 -1.56 0.24 0.00 0.00 0.00 0.00 44.72 43.84 2wva s GLY 217 CO 0.17 -1.49 1.92 -1.14 0.00 0.00 0.00 173.10 172.55 2wva n SER 218 N -1.47 0.00 -1.11 1.64 3.41 -1.08 -2.26 113.62 112.75 2wva n SER 218 Ca -0.02 -1.19 0.09 0.00 -0.26 0.00 0.00 58.87 57.49 2wva n SER 218 Cb 0.59 0.00 0.27 0.00 -0.26 0.00 0.00 64.21 64.81 2wva n SER 218 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2wva n LYS 219 N -0.89 3.09 -0.27 4.33 5.02 -0.38 -4.58 118.16 124.50 2wva n LYS 219 Ca 0.18 -2.53 -0.05 0.00 -2.02 0.00 0.00 58.31 53.89 2wva n LYS 219 Cb 0.08 -1.59 0.06 0.00 -0.02 0.00 0.00 35.03 33.57 2wva n LYS 219 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2wva h LEU 220 N 3.14 0.89 -0.55 -0.35 5.85 -1.59 -2.01 115.31 120.69 2wva h LEU 220 Ca 0.00 -0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.53 2wva h LEU 220 Cb 1.08 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 2wva h LEU 220 CO 0.09 0.70 -0.15 -0.09 -0.34 0.00 0.00 178.44 178.65 2wva h ARG 221 N 1.01 1.00 0.00 1.25 2.43 -1.84 -2.32 114.38 115.91 2wva h ARG 221 Ca 0.26 -0.39 -0.02 0.00 -0.81 0.00 0.00 59.98 59.02 2wva h ARG 221 Cb -0.02 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.48 2wva h ARG 221 CO -0.05 1.07 -0.10 0.00 -1.51 0.00 0.00 179.97 179.38 2wva h ALA 222 N 0.93 1.72 -0.00 2.80 0.00 -1.77 0.59 119.26 123.52 2wva h ALA 222 Ca 0.13 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2wva h ALA 222 Cb 0.72 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2wva h ALA 222 CO 0.06 0.13 -0.08 0.00 0.00 0.00 0.00 179.25 179.36 2wva n ALA 223 N -2.47 2.67 -2.82 0.00 0.00 -0.78 -4.92 120.51 112.17 2wva n ALA 223 Ca -0.03 -0.22 -0.22 0.00 0.00 0.00 0.00 53.44 52.98 2wva n ALA 223 Cb 0.18 -1.39 0.02 0.00 0.00 0.00 0.00 19.45 18.26 2wva n ALA 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wva n GLY 224 N 1.29 -0.49 0.27 0.00 0.00 0.20 -4.47 105.19 101.98 2wva n GLY 224 Ca 0.14 0.07 0.07 0.00 0.00 0.00 0.00 46.02 46.30 2wva n GLY 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wva n ALA 225 N -3.08 2.34 -0.17 4.61 0.00 -0.90 -4.68 120.51 118.63 2wva n ALA 225 Ca -0.15 -2.04 -0.06 0.00 0.00 0.00 0.00 53.44 51.18 2wva n ALA 225 Cb 0.64 -0.36 0.03 0.00 0.00 0.00 0.00 19.45 19.75 2wva n ALA 225 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2wva h GLU 226 N 0.55 0.61 -0.30 0.00 5.08 -1.88 -1.62 114.58 117.02 2wva h GLU 226 Ca 0.00 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 2wva h GLU 226 Cb 0.95 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 2wva h GLU 226 CO 0.04 0.40 -0.25 1.49 -1.00 0.00 0.00 179.01 179.70 2wva h GLU 227 N 0.62 0.70 0.00 2.33 4.81 -1.93 -2.91 114.58 118.21 2wva h GLU 227 Ca 0.19 -0.35 -0.05 0.00 -0.13 0.00 0.00 59.36 59.03 2wva h GLU 227 Cb -0.02 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 2wva h GLU 227 CO -0.07 0.96 -0.21 0.00 -0.73 0.00 0.00 179.01 178.96 2wva h ALA 228 N 0.73 1.40 -0.33 2.92 0.00 -1.86 -2.43 119.26 119.69 2wva h ALA 228 Ca 0.05 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.64 2wva h ALA 228 Cb 0.81 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2wva h ALA 228 CO 0.06 0.27 -0.34 0.00 0.00 0.00 0.00 179.25 179.25 2wva h ALA 229 N 1.79 0.79 -0.38 0.00 0.00 -1.10 -1.19 119.26 119.17 2wva h ALA 229 Ca -0.00 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 2wva h ALA 229 Cb 0.45 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2wva h ALA 229 CO 0.03 0.65 0.15 0.28 0.00 0.00 0.00 179.25 180.36 2wva h VAL 230 N 0.61 1.19 -0.66 0.00 2.07 -1.33 0.11 116.25 118.24 2wva h VAL 230 Ca 0.06 -0.57 0.03 0.00 0.82 0.00 0.00 66.70 67.04 2wva h VAL 230 Cb 0.86 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 2wva h VAL 230 CO 0.08 0.21 0.40 0.11 0.02 0.00 0.00 177.57 178.39 2wva h LYS 231 N 0.46 0.76 -0.49 1.57 1.57 -1.28 0.06 116.57 119.22 2wva h LYS 231 Ca 0.13 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.74 2wva h LYS 231 Cb 0.18 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2wva h LYS 231 CO -0.01 0.50 -0.17 0.35 -0.57 0.00 0.00 179.45 179.55 2wva h PHE 232 N 0.78 1.11 -0.57 -1.35 3.57 -1.06 -2.33 116.94 117.09 2wva h PHE 232 Ca 0.27 -0.26 -0.09 0.00 3.53 0.00 0.00 57.97 61.43 2wva h PHE 232 Cb 0.05 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.51 2wva h PHE 232 CO -0.05 1.07 -0.01 0.00 -2.23 0.00 0.00 178.31 177.09 2wva h ALA 233 N 0.88 0.91 -0.57 2.41 0.00 -0.45 -0.36 119.26 122.08 2wva h ALA 233 Ca 0.12 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 2wva h ALA 233 Cb 0.74 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2wva h ALA 233 CO 0.06 0.65 -0.04 -0.44 0.00 0.00 0.00 179.25 179.48 2wva h ASP 234 N 0.91 1.01 -0.30 0.00 3.32 -0.94 -0.36 116.42 120.06 2wva h ASP 234 Ca 0.16 -0.30 -0.07 0.00 0.02 0.00 0.00 57.03 56.84 2wva h ASP 234 Cb 0.54 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2wva h ASP 234 CO 0.03 1.08 -0.08 0.00 -1.72 0.00 0.00 179.24 178.55 2wva h ALA 235 N 1.01 0.41 -0.45 3.45 0.00 -1.08 -3.21 119.26 119.39 2wva h ALA 235 Ca 0.16 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 2wva h ALA 235 Cb 0.59 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2wva h ALA 235 CO 0.04 0.25 -0.01 1.25 0.00 0.00 0.00 179.25 180.78 2wva h LEU 236 N 0.35 0.79 1.73 0.00 5.85 -1.01 -3.37 115.31 119.65 2wva h LEU 236 Ca 0.07 -0.31 -0.30 0.00 0.84 0.00 0.00 57.88 58.18 2wva h LEU 236 Cb 0.58 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 2wva h LEU 236 CO 0.03 0.91 -0.35 0.61 -0.34 0.00 0.00 178.44 179.30 2wva n GLY 237 N -0.36 0.26 2.54 3.75 0.00 -0.15 -0.71 105.19 110.52 2wva n GLY 237 Ca 0.00 -0.27 -0.14 0.00 0.00 0.00 0.00 46.02 45.61 2wva n GLY 237 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wva n GLY 238 N -1.05 1.08 3.73 -0.02 0.00 -1.24 -3.96 105.19 103.73 2wva n GLY 238 Ca -0.17 -2.06 -0.41 0.00 0.00 0.00 0.00 46.02 43.38 2wva n GLY 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wva s ALA 239 N -2.86 3.29 -0.17 4.61 0.00 -1.20 -4.75 121.76 120.69 2wva s ALA 239 Ca 0.42 0.39 0.01 0.00 0.00 0.00 0.00 51.96 52.78 2wva s ALA 239 Cb -0.03 -3.14 0.01 0.00 0.00 0.00 0.00 23.12 19.97 2wva s ALA 239 CO 0.28 -0.04 -0.18 0.08 0.00 0.00 0.00 175.76 175.89 2wva s VAL 240 N 0.29 2.31 0.10 0.00 1.01 0.07 0.38 120.40 124.56 2wva s VAL 240 Ca 0.43 -0.87 0.09 0.00 0.00 0.00 0.00 61.98 61.63 2wva s VAL 240 Cb -0.21 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 2wva s VAL 240 CO 0.25 0.53 -0.24 0.00 0.00 0.00 0.00 175.10 175.64 2wva s ALA 241 N 1.05 2.08 -0.07 5.51 0.00 0.17 -0.68 121.76 129.82 2wva s ALA 241 Ca -0.01 -1.33 -0.03 0.00 0.00 0.00 0.00 51.96 50.59 2wva s ALA 241 Cb -0.14 -0.33 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 2wva s ALA 241 CO -0.06 0.45 0.09 0.95 0.00 0.00 0.00 175.76 177.20 2wva s THR 242 N -1.06 4.96 0.69 0.00 -4.23 -1.02 -0.32 115.64 114.66 2wva s THR 242 Ca 0.10 -0.11 -0.13 0.00 -1.18 0.00 0.00 61.69 60.37 2wva s THR 242 Cb -0.10 -3.19 0.01 0.00 1.34 0.00 0.00 72.50 70.57 2wva s THR 242 CO 0.05 0.52 1.08 -0.04 -0.54 0.00 0.00 174.62 175.69 2wva s MET 243 N -1.26 2.76 0.23 3.99 -1.94 -0.29 -0.95 119.30 121.83 2wva s MET 243 Ca 0.18 1.21 -0.08 0.00 -1.71 0.00 0.00 55.69 55.28 2wva s MET 243 Cb -0.12 -1.96 0.37 0.00 2.01 0.00 0.00 34.83 35.13 2wva s MET 243 CO 0.07 -1.26 1.69 0.00 -0.01 0.00 0.00 175.02 175.51 2wva h ALA 244 N -0.39 0.79 0.00 3.03 0.00 -1.90 -0.09 119.26 120.70 2wva h ALA 244 Ca -0.45 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2wva h ALA 244 Cb 1.23 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.26 2wva h ALA 244 CO 0.54 -0.34 0.00 0.00 0.00 0.00 0.00 179.25 179.45 2wva n ALA 245 N -2.68 2.26 -0.04 0.00 0.00 -1.26 -2.83 120.51 115.95 2wva n ALA 245 Ca 0.11 -0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.54 2wva n ALA 245 Cb 0.39 -1.40 0.25 0.00 0.00 0.00 0.00 19.45 18.69 2wva n ALA 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wva n ALA 246 N -1.26 2.37 -1.68 0.00 0.00 -0.05 -4.70 120.51 115.20 2wva n ALA 246 Ca 0.12 -1.13 -0.57 0.00 0.00 0.00 0.00 53.44 51.86 2wva n ALA 246 Cb 0.18 -0.82 -0.07 0.00 0.00 0.00 0.00 19.45 18.75 2wva n ALA 246 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2wva n LYS 247 N 1.41 1.05 -0.56 0.00 3.00 -1.13 -0.37 118.16 121.56 2wva n LYS 247 Ca 0.20 0.38 0.00 0.00 -0.00 0.00 0.00 58.31 58.89 2wva n LYS 247 Cb 0.58 -2.04 0.00 0.00 0.00 0.00 0.00 35.03 33.57 2wva n LYS 247 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2wva n SER 248 N 4.45 0.00 -0.11 3.14 3.41 -1.26 -4.26 113.62 118.99 2wva n SER 248 Ca 0.24 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.99 2wva n SER 248 Cb 0.13 0.00 0.75 0.00 -0.26 0.00 0.00 64.21 64.83 2wva n SER 248 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2wva n PHE 249 N -2.00 0.01 -3.79 7.33 3.01 0.50 -4.74 117.46 117.79 2wva n PHE 249 Ca 0.00 -0.01 -0.13 0.00 1.01 0.00 0.00 57.45 58.33 2wva n PHE 249 Cb 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.36 2wva n PHE 249 CO 0.00 0.00 0.00 0.12 1.01 0.00 0.00 176.76 177.89 2wva s PHE 250 N -1.99 -0.27 0.05 1.38 5.36 -1.26 -4.82 117.98 116.43 2wva s PHE 250 Ca 0.40 0.65 -0.30 0.00 -0.96 0.00 0.00 56.93 56.71 2wva s PHE 250 Cb 0.19 0.09 -0.08 0.00 -0.34 0.00 0.00 43.02 42.88 2wva s PHE 250 CO 0.32 -0.15 1.71 -2.14 -1.46 0.00 0.00 175.22 173.50 2wva s PRO 251 N 0.04 4.18 0.00 10.12 0.02 -1.26 -4.89 135.00 143.22 2wva s PRO 251 Ca -0.01 2.36 0.28 0.00 0.02 0.00 0.00 61.00 63.66 2wva s PRO 251 Cb -0.02 -3.75 1.14 0.00 0.02 0.00 0.00 34.50 31.89 2wva s PRO 251 CO 0.01 -0.79 1.82 0.39 -0.33 0.00 0.00 177.00 178.09 2wva n GLU 252 N 6.15 0.49 0.00 5.54 1.02 -1.26 -2.69 120.64 129.89 2wva n GLU 252 Ca 0.17 -0.16 0.12 0.00 -0.02 0.00 0.00 57.16 57.26 2wva n GLU 252 Cb 0.41 -1.50 0.18 0.00 -0.02 0.00 0.00 31.44 30.51 2wva n GLU 252 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2wva n GLU 253 N -1.11 0.58 -1.84 3.49 1.02 -1.26 -4.87 120.64 116.65 2wva n GLU 253 Ca 0.12 -0.41 -0.41 0.00 -0.02 0.00 0.00 57.16 56.44 2wva n GLU 253 Cb 0.29 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.20 2wva n GLU 253 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2wva s ASN 254 N -2.70 6.46 0.48 1.62 3.84 -1.09 -4.86 114.94 118.68 2wva s ASN 254 Ca 0.17 2.86 0.32 0.00 0.21 0.00 0.00 52.86 56.41 2wva s ASN 254 Cb 0.18 -2.63 1.72 0.00 -0.55 0.00 0.00 41.25 39.97 2wva s ASN 254 CO 0.63 -0.86 1.97 -0.65 -2.79 0.00 0.00 177.10 175.40 2wva h PRO 255 N 5.10 0.00 0.00 0.43 0.11 -1.91 -1.65 132.00 134.08 2wva h PRO 255 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2wva h PRO 255 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2wva h PRO 255 CO 0.80 0.00 -0.78 0.72 -0.21 0.00 0.00 178.00 178.54 2wva n HIS 256 N -2.63 0.04 -2.45 0.65 8.25 -1.26 -4.91 115.22 112.91 2wva n HIS 256 Ca -0.02 0.01 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 2wva n HIS 256 Cb 0.07 -0.18 -0.03 0.00 1.12 0.00 0.00 29.99 30.98 2wva n HIS 256 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 2wva s TYR 257 N -3.03 3.12 -1.25 4.41 5.04 -0.62 -0.76 117.35 124.26 2wva s TYR 257 Ca 0.09 1.18 0.13 0.00 -2.44 0.00 0.00 57.07 56.02 2wva s TYR 257 Cb 0.16 -3.44 0.01 0.00 0.35 0.00 0.00 41.96 39.04 2wva s TYR 257 CO 0.78 -1.38 0.76 0.44 -1.34 0.00 0.00 175.55 174.81 2wva n ILE 258 N 4.77 0.00 0.00 3.14 -5.35 0.14 -4.92 119.36 117.14 2wva n ILE 258 Ca 0.12 -0.37 0.00 0.00 -0.27 0.00 0.00 62.75 62.22 2wva n ILE 258 Cb 0.46 1.17 0.00 0.00 -1.74 0.00 0.00 39.64 39.53 2wva n ILE 258 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wva n GLY 259 N 1.01 -0.19 3.71 3.28 0.00 -1.26 -4.81 105.19 106.94 2wva n GLY 259 Ca 0.06 -2.22 -0.42 0.00 0.00 0.00 0.00 46.02 43.44 2wva n GLY 259 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wva s THR 260 N 0.00 4.59 -0.39 2.61 2.01 -1.26 -2.43 115.64 120.77 2wva s THR 260 Ca 0.00 1.91 -0.12 0.00 0.31 0.00 0.00 61.69 63.79 2wva s THR 260 Cb 0.00 -4.22 0.04 0.00 0.01 0.00 0.00 72.50 68.32 2wva s THR 260 CO 0.00 0.18 0.25 -0.55 -0.69 0.00 0.00 174.62 173.80 2wva s SER 261 N 0.82 5.83 -0.42 3.53 0.15 -0.13 -1.59 113.70 121.89 2wva s SER 261 Ca 0.53 -1.06 0.09 0.00 0.70 0.00 0.00 55.95 56.20 2wva s SER 261 Cb -0.24 -2.06 0.33 0.00 -1.71 0.00 0.00 66.02 62.34 2wva s SER 261 CO 0.29 -0.44 0.90 1.87 1.20 0.00 0.00 173.24 177.06 2wva n TRP 262 N 5.04 -1.40 -0.34 3.44 -0.00 -1.26 -4.09 117.44 118.82 2wva n TRP 262 Ca -0.11 -2.94 0.00 0.00 -0.00 0.00 0.00 57.50 54.44 2wva n TRP 262 Cb 0.46 0.61 0.00 0.00 -0.00 0.00 0.00 31.31 32.38 2wva n TRP 262 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2wva n GLY 263 N 0.45 3.16 0.00 5.87 0.00 -1.26 -1.30 105.19 112.12 2wva n GLY 263 Ca 0.15 -0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.22 2wva n GLY 263 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2wva n GLU 264 N 14.00 0.80 -0.66 1.61 0.28 -1.26 -2.31 120.64 133.09 2wva n GLU 264 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.01 2wva n GLU 264 Cb 0.00 -1.50 0.21 0.00 1.43 0.00 0.00 31.44 31.58 2wva n GLU 264 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 2wva n VAL 265 N -1.03 2.45 -1.15 3.84 0.24 -0.42 -5.03 118.33 117.23 2wva n VAL 265 Ca 0.19 -2.45 -0.30 0.00 -2.04 0.00 0.00 64.34 59.74 2wva n VAL 265 Cb 0.10 -0.30 0.13 0.00 -1.47 0.00 0.00 33.84 32.31 2wva n VAL 265 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2wva s SER 266 N -2.36 3.61 0.79 -1.34 0.01 -0.98 -4.65 113.70 108.78 2wva s SER 266 Ca 0.43 1.64 -0.14 0.00 1.31 0.00 0.00 55.95 59.19 2wva s SER 266 Cb 0.38 -2.30 0.07 0.00 0.21 0.00 0.00 66.02 64.38 2wva s SER 266 CO 0.03 -2.57 1.21 -0.31 0.41 0.00 0.00 173.24 172.00 2wva s TYR 267 N -2.88 1.86 0.12 2.43 1.51 -0.62 -4.89 117.35 114.87 2wva s TYR 267 Ca 0.63 1.66 -0.35 0.00 -1.01 0.00 0.00 57.07 58.00 2wva s TYR 267 Cb -0.18 -3.48 -0.15 0.00 -0.11 0.00 0.00 41.96 38.04 2wva s TYR 267 CO 0.57 -2.79 1.52 -2.30 -1.11 0.00 0.00 175.55 171.44 2wva n PRO 268 N -3.18 1.83 0.00 -1.71 -0.02 -1.26 -1.72 135.00 128.94 2wva n PRO 268 Ca 0.13 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 2wva n PRO 268 Cb 0.50 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 2wva n PRO 268 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wva n GLY 269 N 3.21 3.09 0.23 -1.23 0.00 -1.26 -4.82 105.19 104.40 2wva n GLY 269 Ca 0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 2wva n GLY 269 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wva h VAL 270 N 0.00 1.28 -0.46 1.61 2.07 -1.65 -1.88 116.25 117.23 2wva h VAL 270 Ca 0.00 -1.29 0.02 0.00 0.82 0.00 0.00 66.70 66.25 2wva h VAL 270 Cb 0.00 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 2wva h VAL 270 CO 0.00 0.43 0.28 -0.08 0.02 0.00 0.00 177.57 178.21 2wva h GLU 271 N 0.56 0.55 -0.36 1.57 4.81 -1.85 -1.43 114.58 118.42 2wva h GLU 271 Ca 0.08 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 2wva h GLU 271 Cb 0.71 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.95 2wva h GLU 271 CO 0.05 0.36 0.13 0.87 -0.73 0.00 0.00 179.01 179.69 2wva h LYS 272 N 0.56 0.55 -0.80 1.92 1.57 -1.92 -1.93 116.57 116.53 2wva h LYS 272 Ca 0.18 -0.11 0.06 0.00 -1.87 0.00 0.00 60.65 58.91 2wva h LYS 272 Cb -0.01 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.16 2wva h LYS 272 CO -0.07 0.55 0.49 1.15 -0.57 0.00 0.00 179.45 181.00 2wva h THR 273 N 0.44 1.03 -0.34 -0.16 2.02 -1.00 0.36 112.91 115.26 2wva h THR 273 Ca 0.12 -0.31 -0.13 0.00 0.77 0.00 0.00 66.41 66.87 2wva h THR 273 Cb 0.22 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.67 2wva h THR 273 CO -0.01 0.16 -0.30 0.24 0.37 0.00 0.00 175.52 175.98 2wva h MET 274 N 0.90 0.72 -0.30 6.66 2.86 -1.14 -1.48 114.93 123.14 2wva h MET 274 Ca 0.35 -0.32 -0.08 0.00 -2.06 0.00 0.00 59.70 57.58 2wva h MET 274 Cb 0.16 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 2wva h MET 274 CO -0.17 0.93 -0.17 -0.22 1.06 0.00 0.00 176.91 178.34 2wva h LYS 275 N 0.61 0.54 0.00 1.72 3.64 -0.67 -3.19 116.57 119.22 2wva h LYS 275 Ca 0.07 -0.18 -0.06 0.00 -1.27 0.00 0.00 60.65 59.21 2wva h LYS 275 Cb 0.82 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.58 2wva h LYS 275 CO 0.07 0.69 -0.59 0.93 -2.27 0.00 0.00 179.45 178.28 2wva h GLU 276 N 0.49 0.00 -6.66 1.90 4.39 -0.69 -3.47 114.58 110.54 2wva h GLU 276 Ca 0.08 0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.20 2wva h GLU 276 Cb 0.58 0.00 0.12 0.00 -0.10 0.00 0.00 28.75 29.35 2wva h GLU 276 CO 0.04 0.21 0.30 0.00 -1.16 0.00 0.00 179.01 178.39 2wva n ALA 277 N -2.20 0.56 0.10 3.43 0.00 -0.58 -4.89 120.51 116.93 2wva n ALA 277 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2wva n ALA 277 Cb 0.65 -2.14 -0.02 0.00 0.00 0.00 0.00 19.45 17.93 2wva n ALA 277 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2wva h ASP 278 N 2.01 0.00 -3.71 0.00 3.32 -0.92 -3.46 116.42 113.67 2wva h ASP 278 Ca -0.44 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.43 2wva h ASP 278 Cb 1.32 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.60 2wva h ASP 278 CO 0.60 0.60 -0.47 0.00 -1.72 0.00 0.00 179.24 178.24 2wva s ALA 279 N -2.91 -0.53 -0.18 3.45 0.00 -1.02 -4.70 121.76 115.87 2wva s ALA 279 Ca 0.02 0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.67 2wva s ALA 279 Cb 0.08 -0.41 0.02 0.00 0.00 0.00 0.00 23.12 22.81 2wva s ALA 279 CO 0.77 -0.12 -0.19 0.08 0.00 0.00 0.00 175.76 176.30 2wva s VAL 280 N 0.37 2.17 -0.46 0.00 1.01 0.30 -0.88 120.40 122.92 2wva s VAL 280 Ca -0.02 -0.91 -0.15 0.00 0.00 0.00 0.00 61.98 60.90 2wva s VAL 280 Cb -0.04 -1.91 0.06 0.00 0.00 0.00 0.00 36.38 34.49 2wva s VAL 280 CO -0.02 0.53 0.37 -0.63 0.00 0.00 0.00 175.10 175.36 2wva s ILE 281 N 1.25 5.24 -0.34 2.22 1.01 0.85 -0.54 121.20 130.89 2wva s ILE 281 Ca 0.04 -0.95 -0.18 0.00 0.00 0.00 0.00 60.65 59.55 2wva s ILE 281 Cb -0.13 -4.07 -0.01 0.00 0.01 0.00 0.00 42.46 38.26 2wva s ILE 281 CO -0.11 -0.51 0.52 0.00 0.00 0.00 0.00 174.94 174.85 2wva s ALA 282 N 1.65 3.49 -0.56 9.38 0.00 -0.28 -0.75 121.76 134.68 2wva s ALA 282 Ca 0.04 -0.95 -0.19 0.00 0.00 0.00 0.00 51.96 50.86 2wva s ALA 282 Cb -0.23 -3.01 0.08 0.00 0.00 0.00 0.00 23.12 19.96 2wva s ALA 282 CO 0.08 -1.17 0.70 -0.51 0.00 0.00 0.00 175.76 174.86 2wva s LEU 283 N 2.41 5.10 -1.20 0.00 1.43 0.17 -1.16 118.68 125.44 2wva s LEU 283 Ca 0.19 -1.16 -0.11 0.00 -1.03 0.00 0.00 54.13 52.02 2wva s LEU 283 Cb -0.15 -2.38 -0.02 0.00 0.03 0.00 0.00 46.19 43.67 2wva s LEU 283 CO 0.13 -1.06 0.75 0.00 0.23 0.00 0.00 176.35 176.40 2wva n ALA 284 N 6.42 -2.35 -2.26 4.21 0.00 0.13 -0.39 120.51 126.28 2wva n ALA 284 Ca -0.08 -0.17 -0.30 0.00 0.00 0.00 0.00 53.44 52.90 2wva n ALA 284 Cb 0.44 -3.55 -0.03 0.00 0.00 0.00 0.00 19.45 16.31 2wva n ALA 284 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2wva s PRO 285 N -5.80 3.73 -0.27 0.00 0.04 -1.26 -1.25 135.00 130.19 2wva s PRO 285 Ca 0.30 0.35 0.01 0.00 0.04 0.00 0.00 61.00 61.70 2wva s PRO 285 Cb -0.09 -2.44 0.05 0.00 0.04 0.00 0.00 34.50 32.06 2wva s PRO 285 CO 0.83 -0.00 -0.07 0.08 0.04 0.00 0.00 177.00 177.88 2wva s VAL 286 N -2.35 2.50 -0.52 -0.36 1.01 -1.26 -4.86 120.40 114.55 2wva s VAL 286 Ca 0.49 -1.51 -0.17 0.00 0.00 0.00 0.00 61.98 60.79 2wva s VAL 286 Cb -0.10 -2.44 0.09 0.00 0.00 0.00 0.00 36.38 33.93 2wva s VAL 286 CO 0.32 -0.04 0.53 -0.36 0.00 0.00 0.00 175.10 175.55 2wva s PHE 287 N 1.17 3.16 0.19 5.22 0.08 -1.26 -4.80 117.98 121.74 2wva s PHE 287 Ca -0.07 -0.96 0.01 0.00 0.12 0.00 0.00 56.93 56.03 2wva s PHE 287 Cb -0.20 -3.58 -0.00 0.00 -0.57 0.00 0.00 43.02 38.67 2wva s PHE 287 CO -0.04 -1.00 0.02 0.27 -0.10 0.00 0.00 175.22 174.37 2wva n ASN 288 N 5.63 2.07 0.22 1.36 0.23 -1.26 -4.97 115.26 118.53 2wva n ASN 288 Ca -0.11 -1.86 0.06 0.00 -0.53 0.00 0.00 54.58 52.14 2wva n ASN 288 Cb 0.43 0.22 0.49 0.00 -2.08 0.00 0.00 39.78 38.84 2wva n ASN 288 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 2wva h ASP 289 N 0.53 0.00 0.11 0.53 2.03 -1.97 -2.12 116.42 115.53 2wva h ASP 289 Ca -0.15 0.00 -0.21 0.00 -0.73 0.00 0.00 57.03 55.94 2wva h ASP 289 Cb 0.49 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.01 2wva h ASP 289 CO 0.25 0.27 -0.87 1.88 -1.03 0.00 0.00 179.24 179.73 2wva h TYR 290 N 0.00 0.66 0.00 4.15 -1.99 -1.96 0.31 116.97 118.15 2wva h TYR 290 Ca -0.00 -0.44 0.00 0.00 2.00 0.00 0.00 58.73 60.29 2wva h TYR 290 Cb 0.54 -0.04 0.00 0.00 2.00 0.00 0.00 36.73 39.23 2wva h TYR 290 CO 0.00 1.31 0.00 -1.13 -0.00 0.00 0.00 178.16 178.34 2wva n SER 291 N -4.07 0.84 -1.35 3.88 3.41 -1.12 -1.84 113.62 113.37 2wva n SER 291 Ca -0.13 0.59 0.11 0.00 -0.26 0.00 0.00 58.87 59.18 2wva n SER 291 Cb 0.83 -0.81 0.32 0.00 -0.26 0.00 0.00 64.21 64.29 2wva n SER 291 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2wva n THR 292 N -2.30 1.14 -3.53 6.66 -2.24 -0.81 -4.77 114.28 108.42 2wva n THR 292 Ca 0.05 -1.04 -0.25 0.00 -2.27 0.00 0.00 64.05 60.55 2wva n THR 292 Cb 0.41 0.44 0.05 0.00 -2.10 0.00 0.00 70.33 69.13 2wva n THR 292 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2wva n THR 293 N 1.50 -6.94 -2.82 4.28 -1.04 -0.77 -0.61 114.28 107.88 2wva n THR 293 Ca 0.24 -0.97 -0.15 0.00 -2.04 0.00 0.00 64.05 61.13 2wva n THR 293 Cb 0.66 -5.04 0.03 0.00 -1.82 0.00 0.00 70.33 64.15 2wva n THR 293 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2wva n GLY 294 N -1.57 -0.12 2.41 3.41 0.00 0.11 -2.69 105.19 106.74 2wva n GLY 294 Ca -0.09 -0.16 -0.14 0.00 0.00 0.00 0.00 46.02 45.63 2wva n GLY 294 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2wva n TRP 295 N -4.11 -0.03 0.08 1.61 7.02 -1.11 -4.70 117.44 116.20 2wva n TRP 295 Ca -0.07 0.00 0.06 0.00 -1.02 0.00 0.00 57.50 56.47 2wva n TRP 295 Cb 0.58 -2.58 -0.03 0.00 -2.42 0.00 0.00 31.31 26.85 2wva n TRP 295 CO 0.00 0.00 0.00 1.79 -2.02 0.00 0.00 177.69 177.46 2wva h THR 296 N 0.00 0.25 -3.10 -0.99 1.35 -1.03 -3.42 112.91 105.97 2wva h THR 296 Ca -0.30 -1.47 -0.62 0.00 -0.55 0.00 0.00 66.41 63.47 2wva h THR 296 Cb 0.95 1.78 -0.41 0.00 -1.73 0.00 0.00 68.15 68.74 2wva h THR 296 CO 0.43 0.14 -0.63 -0.62 -0.25 0.00 0.00 175.52 174.59 2wva s ASP 297 N -5.61 4.32 -0.14 5.36 2.15 0.22 -5.05 116.67 117.93 2wva s ASP 297 Ca -0.01 -3.46 -0.01 0.00 0.43 0.00 0.00 52.55 49.50 2wva s ASP 297 Cb 0.09 -1.49 -0.02 0.00 -0.30 0.00 0.00 42.92 41.20 2wva s ASP 297 CO 0.79 -0.15 -0.11 -0.63 -0.17 0.00 0.00 175.17 174.91 2wva s ILE 298 N -0.86 3.24 0.36 4.11 1.01 -1.26 -4.55 121.20 123.24 2wva s ILE 298 Ca 0.23 -0.59 -0.28 0.00 0.00 0.00 0.00 60.65 60.00 2wva s ILE 298 Cb -0.11 -2.38 -0.11 0.00 0.01 0.00 0.00 42.46 39.87 2wva s ILE 298 CO -0.11 0.52 1.47 -2.84 0.00 0.00 0.00 174.94 173.98 2wva s PRO 299 N 0.37 4.15 -0.10 2.79 0.02 -1.26 -4.88 135.00 136.09 2wva s PRO 299 Ca -0.09 2.51 -0.29 0.00 0.02 0.00 0.00 61.00 63.15 2wva s PRO 299 Cb -0.15 -2.99 -0.07 0.00 0.02 0.00 0.00 34.50 31.30 2wva s PRO 299 CO 0.05 -0.49 2.09 0.34 -0.33 0.00 0.00 177.00 178.66 2wva s ASP 300 N -0.12 5.94 0.45 2.53 -1.08 -1.26 -4.86 116.67 118.27 2wva s ASP 300 Ca 0.53 2.24 0.15 0.00 -0.52 0.00 0.00 52.55 54.96 2wva s ASP 300 Cb -0.45 -2.52 1.09 0.00 -1.46 0.00 0.00 42.92 39.58 2wva s ASP 300 CO 0.60 -1.52 2.00 -0.65 0.52 0.00 0.00 175.17 176.11 2wva h PRO 301 N 12.88 0.32 0.00 4.34 0.11 -1.96 -0.91 132.00 146.78 2wva h PRO 301 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2wva h PRO 301 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2wva h PRO 301 CO 0.95 0.21 0.00 1.63 -0.21 0.00 0.00 178.00 180.58 2wva n LYS 302 N -4.46 0.22 0.00 1.05 4.01 -1.26 -3.03 118.16 114.69 2wva n LYS 302 Ca 0.09 0.34 0.07 0.00 -0.51 0.00 0.00 58.31 58.29 2wva n LYS 302 Cb 0.37 -1.85 -0.01 0.00 -0.51 0.00 0.00 35.03 33.04 2wva n LYS 302 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 2wva n LYS 303 N -2.25 1.76 -3.31 1.97 5.02 -0.37 -5.02 118.16 115.95 2wva n LYS 303 Ca 0.04 -0.74 -0.38 0.00 -2.02 0.00 0.00 58.31 55.20 2wva n LYS 303 Cb 0.31 -1.24 -0.06 0.00 -0.02 0.00 0.00 35.03 34.02 2wva n LYS 303 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2wva s LEU 304 N -2.00 4.22 -0.31 -0.35 2.96 -1.06 -0.54 118.68 121.59 2wva s LEU 304 Ca 0.12 0.72 -0.10 0.00 -0.22 0.00 0.00 54.13 54.65 2wva s LEU 304 Cb 0.12 -2.66 -0.01 0.00 0.50 0.00 0.00 46.19 44.14 2wva s LEU 304 CO 0.39 -0.06 0.16 -0.69 -1.32 0.00 0.00 176.35 174.82 2wva s VAL 305 N 1.03 4.67 -0.54 1.68 1.01 0.29 -4.70 120.40 123.85 2wva s VAL 305 Ca 0.24 -0.36 -0.16 0.00 0.00 0.00 0.00 61.98 61.70 2wva s VAL 305 Cb -0.15 -3.36 0.12 0.00 0.00 0.00 0.00 36.38 32.99 2wva s VAL 305 CO 0.09 0.09 0.50 -0.22 0.00 0.00 0.00 175.10 175.56 2wva s LEU 306 N 1.63 6.10 -0.67 3.92 2.96 0.37 -1.13 118.68 131.86 2wva s LEU 306 Ca 0.05 -1.73 -0.08 0.00 -0.22 0.00 0.00 54.13 52.15 2wva s LEU 306 Cb -0.17 -2.21 0.17 0.00 0.50 0.00 0.00 46.19 44.48 2wva s LEU 306 CO 0.07 -0.85 0.54 0.00 -1.32 0.00 0.00 176.35 174.79 2wva s ALA 307 N 1.65 3.73 0.71 5.97 0.00 -0.31 -0.46 121.76 133.06 2wva s ALA 307 Ca 0.03 -3.14 -0.09 0.00 0.00 0.00 0.00 51.96 48.77 2wva s ALA 307 Cb -0.29 -3.02 0.05 0.00 0.00 0.00 0.00 23.12 19.86 2wva s ALA 307 CO 0.04 -2.13 1.05 -1.21 0.00 0.00 0.00 175.76 173.51 2wva s GLU 308 N 0.31 2.34 0.48 0.00 0.41 0.23 0.22 118.70 122.70 2wva s GLU 308 Ca 0.15 -0.02 0.20 0.00 -0.41 0.00 0.00 54.97 54.89 2wva s GLU 308 Cb -0.18 -2.11 1.23 0.00 -1.78 0.00 0.00 34.13 31.29 2wva s GLU 308 CO -0.05 -1.22 1.98 -1.35 -0.49 0.00 0.00 175.26 174.13 2wva h PRO 309 N -0.66 0.19 0.00 0.39 0.11 -1.90 -3.17 132.00 126.97 2wva h PRO 309 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2wva h PRO 309 Cb 1.30 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2wva h PRO 309 CO 0.62 0.13 -0.00 0.54 -0.21 0.00 0.00 178.00 179.08 2wva n ARG 310 N -4.43 1.70 -3.62 1.05 1.74 -1.26 -0.71 116.66 111.14 2wva n ARG 310 Ca 0.11 -1.08 -0.10 0.00 -0.77 0.00 0.00 57.85 56.00 2wva n ARG 310 Cb 0.53 -0.79 -0.03 0.00 -1.02 0.00 0.00 32.46 31.15 2wva n ARG 310 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2wva s SER 311 N -0.59 -0.37 -0.04 0.55 1.04 -0.92 -1.96 113.70 111.41 2wva s SER 311 Ca 0.00 -0.29 0.01 0.00 0.48 0.00 0.00 55.95 56.15 2wva s SER 311 Cb 0.00 0.59 0.02 0.00 0.10 0.00 0.00 66.02 66.72 2wva s SER 311 CO 0.00 -1.02 -0.06 -0.69 0.98 0.00 0.00 173.24 172.45 2wva s VAL 312 N -3.82 0.61 -0.25 5.02 1.01 -0.64 -0.60 120.40 121.72 2wva s VAL 312 Ca 0.05 -0.20 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 2wva s VAL 312 Cb -0.01 -0.60 0.00 0.00 0.00 0.00 0.00 36.38 35.77 2wva s VAL 312 CO -0.07 0.23 -0.00 -0.69 0.00 0.00 0.00 175.10 174.57 2wva s VAL 313 N 0.67 3.53 -0.12 2.92 1.01 0.39 0.03 120.40 128.83 2wva s VAL 313 Ca -0.09 -0.62 -0.08 0.00 0.00 0.00 0.00 61.98 61.19 2wva s VAL 313 Cb -0.13 -2.71 0.04 0.00 0.00 0.00 0.00 36.38 33.59 2wva s VAL 313 CO 0.01 0.28 0.30 0.54 0.00 0.00 0.00 175.10 176.22 2wva s VAL 314 N 1.47 -0.02 -1.66 2.92 0.11 -0.43 -0.48 120.40 122.31 2wva s VAL 314 Ca 0.04 0.08 -0.02 0.00 -2.93 0.00 0.00 61.98 59.16 2wva s VAL 314 Cb -0.16 -0.44 0.00 0.00 -1.53 0.00 0.00 36.38 34.26 2wva s VAL 314 CO -0.01 0.03 0.22 -3.20 -3.33 0.00 0.00 175.10 168.81 2wva n ASN 315 N 3.77 -5.88 -0.47 3.54 5.15 -1.26 -1.72 115.26 118.38 2wva n ASN 315 Ca -0.20 -0.11 -0.06 0.00 -0.60 0.00 0.00 54.58 53.60 2wva n ASN 315 Cb 0.55 -4.83 -0.02 0.00 -0.53 0.00 0.00 39.78 34.95 2wva n ASN 315 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2wva n GLY 316 N -1.20 0.72 3.11 8.20 0.00 -1.26 -5.03 105.19 109.73 2wva n GLY 316 Ca -0.19 -0.78 -0.24 0.00 0.00 0.00 0.00 46.02 44.81 2wva n GLY 316 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wva s ILE 317 N -2.22 1.25 -0.22 -0.61 1.01 -0.70 -5.13 121.20 114.58 2wva s ILE 317 Ca 0.00 -0.63 -0.10 0.00 0.00 0.00 0.00 60.65 59.92 2wva s ILE 317 Cb 0.00 -1.08 -0.05 0.00 0.01 0.00 0.00 42.46 41.34 2wva s ILE 317 CO 0.00 0.36 0.14 -0.60 0.00 0.00 0.00 174.94 174.85 2wva s ARG 318 N -0.02 4.13 -0.52 2.79 3.52 -1.26 -1.32 118.95 126.27 2wva s ARG 318 Ca -0.01 -0.25 0.02 0.00 -0.13 0.00 0.00 55.73 55.36 2wva s ARG 318 Cb -0.10 -3.47 0.13 0.00 -1.56 0.00 0.00 34.95 29.96 2wva s ARG 318 CO 0.01 0.19 0.28 -0.06 -0.81 0.00 0.00 175.30 174.91 2wva s PHE 319 N 0.69 3.33 0.91 5.12 0.08 0.10 -4.99 117.98 123.21 2wva s PHE 319 Ca 0.08 -3.01 -0.12 0.00 0.12 0.00 0.00 56.93 54.00 2wva s PHE 319 Cb -0.12 -2.94 0.14 0.00 -0.57 0.00 0.00 43.02 39.52 2wva s PHE 319 CO 0.01 -0.80 1.09 -1.25 -0.10 0.00 0.00 175.22 174.18 2wva s PRO 320 N -0.04 1.16 -1.33 0.24 0.04 -1.26 -1.62 135.00 132.18 2wva s PRO 320 Ca 0.16 0.72 0.00 0.00 0.04 0.00 0.00 61.00 61.92 2wva s PRO 320 Cb -0.24 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2wva s PRO 320 CO -0.02 -2.28 0.00 0.43 0.04 0.00 0.00 177.00 175.17 2wva n SER 321 N -3.90 -4.62 -4.06 6.66 7.64 -0.84 -4.86 113.62 109.64 2wva n SER 321 Ca 0.07 0.02 -0.32 0.00 1.01 0.00 0.00 58.87 59.64 2wva n SER 321 Cb 0.56 -3.74 -0.15 0.00 -1.01 0.00 0.00 64.21 59.87 2wva n SER 321 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2wva s VAL 322 N -2.75 2.16 0.11 0.44 1.01 -0.83 -0.95 120.40 119.59 2wva s VAL 322 Ca 0.00 -1.71 -0.30 0.00 0.00 0.00 0.00 61.98 59.97 2wva s VAL 322 Cb 0.00 -2.31 -0.06 0.00 0.00 0.00 0.00 36.38 34.01 2wva s VAL 322 CO 0.00 -0.10 1.02 -1.00 0.00 0.00 0.00 175.10 175.02 2wva s HIS 323 N 1.09 3.70 0.30 5.22 3.76 -1.26 -2.17 115.29 125.93 2wva s HIS 323 Ca -0.07 1.69 0.06 0.00 -0.15 0.00 0.00 55.06 56.59 2wva s HIS 323 Cb -0.20 -3.15 0.75 0.00 1.11 0.00 0.00 32.58 31.08 2wva s HIS 323 CO -0.05 -0.17 1.76 1.25 -0.85 0.00 0.00 174.74 176.68 2wva h LEU 324 N 5.77 0.74 -0.61 0.89 5.85 -1.06 -0.79 115.31 126.09 2wva h LEU 324 Ca -0.43 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.39 2wva h LEU 324 Cb 1.21 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 2wva h LEU 324 CO 0.73 0.24 0.35 0.50 -0.34 0.00 0.00 178.44 179.92 2wva h LYS 325 N 0.71 0.83 -0.27 1.25 3.64 -1.84 0.17 116.57 121.07 2wva h LYS 325 Ca 0.58 -0.08 -0.14 0.00 -1.27 0.00 0.00 60.65 59.73 2wva h LYS 325 Cb 0.94 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.59 2wva h LYS 325 CO -0.40 0.61 -0.38 -0.44 -2.27 0.00 0.00 179.45 176.57 2wva h ASP 326 N 0.82 0.81 -0.15 4.20 3.32 -1.59 -2.00 116.42 121.83 2wva h ASP 326 Ca 0.22 -0.51 0.01 0.00 0.02 0.00 0.00 57.03 56.77 2wva h ASP 326 Cb 0.01 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 2wva h ASP 326 CO -0.04 1.16 0.06 0.22 -1.72 0.00 0.00 179.24 178.92 2wva h TYR 327 N 0.49 0.11 -0.54 4.55 3.20 -1.06 0.64 116.97 124.37 2wva h TYR 327 Ca 0.03 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.84 2wva h TYR 327 Cb 0.97 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 39.19 2wva h TYR 327 CO 0.08 0.06 0.07 -0.07 -1.64 0.00 0.00 178.16 176.66 2wva h LEU 328 N 0.14 0.86 -0.23 2.82 3.38 -0.95 -0.16 115.31 121.18 2wva h LEU 328 Ca 0.06 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 2wva h LEU 328 Cb 0.02 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2wva h LEU 328 CO -0.05 0.91 0.03 0.74 0.09 0.00 0.00 178.44 180.16 2wva h THR 329 N 0.78 1.23 -0.68 0.22 2.02 -1.20 -0.54 112.91 114.75 2wva h THR 329 Ca 0.16 -0.79 -0.06 0.00 0.77 0.00 0.00 66.41 66.49 2wva h THR 329 Cb 0.43 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 68.13 2wva h THR 329 CO 0.01 0.25 0.17 -0.09 0.37 0.00 0.00 175.52 176.23 2wva h ARG 330 N 0.17 1.08 -0.78 6.66 9.65 -0.84 -2.80 114.38 127.52 2wva h ARG 330 Ca 0.07 -0.26 -0.04 0.00 -1.10 0.00 0.00 59.98 58.65 2wva h ARG 330 Cb 0.34 -0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 28.74 2wva h ARG 330 CO 0.01 0.96 0.32 1.25 2.80 0.00 0.00 179.97 185.31 2wva h LEU 331 N 1.02 1.06 -2.27 3.80 5.85 -0.91 -2.21 115.31 121.65 2wva h LEU 331 Ca 0.21 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 2wva h LEU 331 Cb 0.36 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 2wva h LEU 331 CO 0.00 0.93 -0.02 0.00 -0.34 0.00 0.00 178.44 179.02 2wva h ALA 332 N 1.22 1.05 0.00 1.25 0.00 -0.83 -1.50 119.26 120.45 2wva h ALA 332 Ca 0.26 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.04 2wva h ALA 332 Cb 0.19 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2wva h ALA 332 CO -0.02 0.02 -0.68 1.96 0.00 0.00 0.00 179.25 180.53 2wva h GLN 333 N 0.00 0.00 0.00 0.00 4.20 -1.31 -3.39 115.11 114.61 2wva h GLN 333 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2wva h GLN 333 Cb 0.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.02 2wva h GLN 333 CO 0.00 0.51 -1.18 1.63 -0.67 0.00 0.00 178.83 179.12 2wva n LYS 334 N -3.18 0.36 -2.43 1.46 5.02 -0.96 -5.04 118.16 113.39 2wva n LYS 334 Ca 0.00 -0.04 -0.35 0.00 -2.02 0.00 0.00 58.31 55.90 2wva n LYS 334 Cb 0.77 -1.10 -0.02 0.00 -0.02 0.00 0.00 35.03 34.66 2wva n LYS 334 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2wva s VAL 335 N -2.30 3.54 0.42 -0.18 0.11 -0.61 -5.05 120.40 116.32 2wva s VAL 335 Ca -0.02 0.97 0.08 0.00 -2.93 0.00 0.00 61.98 60.08 2wva s VAL 335 Cb 0.03 -3.39 -0.01 0.00 -1.53 0.00 0.00 36.38 31.48 2wva s VAL 335 CO 0.20 -0.20 0.44 -0.94 -3.33 0.00 0.00 175.10 171.27 2wva s SER 336 N -1.88 5.23 0.13 3.54 1.04 -1.26 -4.85 113.70 115.66 2wva s SER 336 Ca 0.69 -0.65 -0.31 0.00 0.48 0.00 0.00 55.95 56.16 2wva s SER 336 Cb -0.20 -0.60 -0.11 0.00 0.10 0.00 0.00 66.02 65.22 2wva s SER 336 CO 0.23 -0.69 1.82 0.29 0.98 0.00 0.00 173.24 175.87 2wva n LYS 337 N -1.64 2.76 -3.65 4.02 4.01 -1.26 -4.65 118.16 117.75 2wva n LYS 337 Ca 0.05 1.00 -0.28 0.00 -0.51 0.00 0.00 58.31 58.58 2wva n LYS 337 Cb 0.61 -2.89 -0.11 0.00 -0.51 0.00 0.00 35.03 32.13 2wva n LYS 337 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 2wva s LYS 338 N 2.51 1.70 0.00 1.97 -0.14 0.11 -4.96 119.74 120.93 2wva s LYS 338 Ca 0.81 -2.74 0.30 0.00 -1.36 0.00 0.00 55.97 52.98 2wva s LYS 338 Cb -0.49 -2.44 1.49 0.00 -1.68 0.00 0.00 37.83 34.70 2wva s LYS 338 CO 0.37 -1.34 2.00 0.25 -0.76 0.00 0.00 175.35 175.87 2wva n THR 339 N 2.40 0.00 -0.29 2.17 -2.24 -1.25 -3.68 114.28 111.39 2wva n THR 339 Ca 0.25 -0.08 -0.00 0.00 -2.27 0.00 0.00 64.05 61.94 2wva n THR 339 Cb 0.41 -0.13 0.06 0.00 -2.10 0.00 0.00 70.33 68.57 2wva n THR 339 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2wva h GLY 340 N 4.95 0.27 1.55 3.38 0.00 -1.81 0.89 103.07 112.30 2wva h GLY 340 Ca 0.00 0.38 -0.21 0.00 0.00 0.00 0.00 47.33 47.51 2wva h GLY 340 CO 0.00 -0.26 -0.84 0.00 0.00 0.00 0.00 176.54 175.45 2wva h ALA 341 N 1.48 0.47 -0.55 3.60 0.00 -1.76 -1.63 119.26 120.86 2wva h ALA 341 Ca 0.34 -0.66 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 2wva h ALA 341 Cb 0.59 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2wva h ALA 341 CO -0.84 0.79 -0.08 1.25 0.00 0.00 0.00 179.25 180.37 2wva h LEU 342 N 0.26 1.02 -0.39 0.00 5.85 -1.63 -0.83 115.31 119.59 2wva h LEU 342 Ca -0.05 -0.34 -0.03 0.00 0.84 0.00 0.00 57.88 58.30 2wva h LEU 342 Cb 1.44 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 2wva h LEU 342 CO 0.14 1.12 0.14 0.44 -0.34 0.00 0.00 178.44 179.94 2wva h ASP 343 N 0.90 0.55 -0.60 1.25 3.32 -0.82 -1.71 116.42 119.30 2wva h ASP 343 Ca 0.15 -0.19 0.05 0.00 0.02 0.00 0.00 57.03 57.06 2wva h ASP 343 Cb 0.64 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 40.00 2wva h ASP 343 CO 0.04 0.59 0.32 0.15 -1.72 0.00 0.00 179.24 178.63 2wva h PHE 344 N 0.48 0.59 0.02 4.55 3.57 -1.20 -0.94 116.94 124.02 2wva h PHE 344 Ca 0.13 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.66 2wva h PHE 344 Cb 0.23 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 2wva h PHE 344 CO 0.00 0.28 -0.10 0.35 -2.23 0.00 0.00 178.31 176.62 2wva h PHE 345 N 0.61 -0.25 -1.00 0.41 3.57 -0.85 -2.64 116.94 116.79 2wva h PHE 345 Ca 0.27 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.82 2wva h PHE 345 Cb 0.17 0.11 -0.06 0.00 2.79 0.00 0.00 35.95 38.95 2wva h PHE 345 CO -0.09 -0.15 0.65 0.87 -2.23 0.00 0.00 178.31 177.36 2wva h LYS 346 N -0.18 1.20 0.00 1.11 1.57 -1.06 -2.05 116.57 117.17 2wva h LYS 346 Ca 0.03 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2wva h LYS 346 Cb 0.21 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.25 2wva h LYS 346 CO -0.08 0.80 0.00 -1.13 -0.57 0.00 0.00 179.45 178.47 2wva n SER 347 N -4.46 0.07 0.21 0.86 3.41 -0.38 -2.04 113.62 111.28 2wva n SER 347 Ca 0.14 0.52 0.10 0.00 -0.26 0.00 0.00 58.87 59.37 2wva n SER 347 Cb 0.12 -0.53 0.27 0.00 -0.26 0.00 0.00 64.21 63.81 2wva n SER 347 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2wva h LEU 348 N 0.00 0.00 -1.29 1.04 3.38 -1.08 -3.47 115.31 113.89 2wva h LEU 348 Ca 0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 2wva h LEU 348 Cb 0.26 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 40.84 2wva h LEU 348 CO 0.00 0.18 -0.85 0.59 0.09 0.00 0.00 178.44 178.46 2wva n ASN 349 N -3.20 -2.62 0.08 -0.43 3.02 -0.87 -4.80 115.26 106.44 2wva n ASN 349 Ca 0.02 -1.01 0.12 0.00 -0.03 0.00 0.00 54.58 53.68 2wva n ASN 349 Cb 0.53 -2.83 0.46 0.00 -0.61 0.00 0.00 39.78 37.33 2wva n ASN 349 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wva n ALA 350 N -4.41 2.01 0.00 5.41 0.00 -1.26 -5.01 120.51 117.26 2wva n ALA 350 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2wva n ALA 350 Cb 0.54 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.57 2wva n ALA 350 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wva n GLY 351 N 0.75 -2.36 3.94 0.00 0.00 -1.26 -4.79 105.19 101.47 2wva n GLY 351 Ca 0.04 -1.56 -0.25 0.00 0.00 0.00 0.00 46.02 44.25 2wva n GLY 351 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wva s GLU 352 N -0.90 2.14 -0.01 1.61 2.56 -1.26 -4.75 118.70 118.10 2wva s GLU 352 Ca 0.00 -0.36 -0.30 0.00 0.00 0.00 0.00 54.97 54.31 2wva s GLU 352 Cb 0.00 -2.20 -0.07 0.00 2.00 0.00 0.00 34.13 33.86 2wva s GLU 352 CO 0.00 -1.24 1.71 -1.17 -0.56 0.00 0.00 175.26 174.00 2wva s LEU 353 N -5.22 4.35 -0.19 2.70 2.96 -1.26 -4.85 118.68 117.18 2wva s LEU 353 Ca 0.61 2.37 -0.29 0.00 -0.22 0.00 0.00 54.13 56.59 2wva s LEU 353 Cb -0.10 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.01 2wva s LEU 353 CO 0.44 -0.94 1.88 -0.75 -1.32 0.00 0.00 176.35 175.66 2wva s LYS 354 N 3.83 3.61 0.12 1.98 2.20 -1.26 -4.98 119.74 125.24 2wva s LYS 354 Ca 0.76 1.92 0.08 0.00 -0.36 0.00 0.00 55.97 58.37 2wva s LYS 354 Cb -0.36 -4.18 -0.04 0.00 -1.51 0.00 0.00 37.83 31.74 2wva s LYS 354 CO 0.32 -1.53 -0.13 0.15 -0.36 0.00 0.00 175.35 173.80 2wva s LYS 355 N 5.24 1.97 0.59 4.03 1.02 -1.26 -5.12 119.74 126.21 2wva s LYS 355 Ca 0.84 -1.12 -0.16 0.00 0.02 0.00 0.00 55.97 55.55 2wva s LYS 355 Cb -0.30 -2.21 -0.04 0.00 -0.52 0.00 0.00 37.83 34.76 2wva s LYS 355 CO 0.34 0.49 1.06 0.00 -0.92 0.00 0.00 175.35 176.32 2wva s ALA 356 N -1.24 2.73 0.42 5.17 0.00 -1.26 -5.06 121.76 122.52 2wva s ALA 356 Ca 0.20 0.41 -0.02 0.00 0.00 0.00 0.00 51.96 52.55 2wva s ALA 356 Cb -0.11 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 2wva s ALA 356 CO 0.12 -0.82 0.67 0.00 0.00 0.00 0.00 175.76 175.73 2wva s ALA 357 N -2.43 3.58 -0.38 0.00 0.00 -1.26 -4.98 121.76 116.29 2wva s ALA 357 Ca 0.64 -0.78 -0.43 0.00 0.00 0.00 0.00 51.96 51.39 2wva s ALA 357 Cb -0.16 -2.31 -0.17 0.00 0.00 0.00 0.00 23.12 20.48 2wva s ALA 357 CO 0.37 -0.23 1.70 -2.30 0.00 0.00 0.00 175.76 175.30 2wva n PRO 358 N -2.03 0.66 -1.56 0.00 -0.02 -1.26 -4.91 135.00 125.87 2wva n PRO 358 Ca -0.02 0.24 -0.31 0.00 -2.02 0.00 0.00 63.50 61.40 2wva n PRO 358 Cb 0.56 -1.85 0.05 0.00 -0.02 0.00 0.00 33.50 32.25 2wva n PRO 358 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wva s ALA 359 N 3.40 2.64 -0.02 3.55 0.00 -1.26 -4.95 121.76 125.12 2wva s ALA 359 Ca 1.02 0.07 -0.31 0.00 0.00 0.00 0.00 51.96 52.74 2wva s ALA 359 Cb -1.25 -3.17 -0.09 0.00 0.00 0.00 0.00 23.12 18.60 2wva s ALA 359 CO 0.73 -1.27 1.99 -3.47 0.00 0.00 0.00 175.76 173.73 2wva n ASP 360 N -3.16 3.89 -0.23 0.00 2.03 -1.26 -4.86 116.55 112.95 2wva n ASP 360 Ca 0.07 0.84 0.22 0.00 0.52 0.00 0.00 54.79 56.44 2wva n ASP 360 Cb 0.54 -1.49 0.57 0.00 -0.72 0.00 0.00 41.12 40.01 2wva n ASP 360 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2wva h PRO 361 N 10.80 0.29 -0.01 -0.67 0.11 -1.93 0.10 132.00 140.68 2wva h PRO 361 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2wva h PRO 361 Cb 1.25 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2wva h PRO 361 CO 0.95 0.19 -0.23 -1.13 -0.21 0.00 0.00 178.00 177.57 2wva n SER 362 N -4.46 1.45 -4.79 -2.05 3.41 -1.26 -0.13 113.62 105.80 2wva n SER 362 Ca 0.19 -1.21 -0.35 0.00 -0.26 0.00 0.00 58.87 57.24 2wva n SER 362 Cb 0.78 0.16 -0.03 0.00 -0.26 0.00 0.00 64.21 64.86 2wva n SER 362 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wva s ALA 363 N -2.36 2.93 0.24 7.33 0.00 0.35 -4.93 121.76 125.32 2wva s ALA 363 Ca 0.26 0.68 -0.30 0.00 0.00 0.00 0.00 51.96 52.60 2wva s ALA 363 Cb 0.19 -3.28 -0.14 0.00 0.00 0.00 0.00 23.12 19.89 2wva s ALA 363 CO 0.48 -0.34 1.15 -2.30 0.00 0.00 0.00 175.76 174.75 2wva n PRO 364 N -0.67 1.45 -1.96 0.00 -0.02 -1.26 -3.62 135.00 128.92 2wva n PRO 364 Ca 0.08 0.51 -0.41 0.00 -2.02 0.00 0.00 63.50 61.66 2wva n PRO 364 Cb 0.51 -1.99 -0.02 0.00 -0.02 0.00 0.00 33.50 31.98 2wva n PRO 364 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2wva s LEU 365 N 0.39 4.38 0.26 2.45 2.96 -0.07 -4.78 118.68 124.26 2wva s LEU 365 Ca 0.65 2.74 0.09 0.00 -0.22 0.00 0.00 54.13 57.39 2wva s LEU 365 Cb -0.74 -3.63 -0.05 0.00 0.50 0.00 0.00 46.19 42.27 2wva s LEU 365 CO 0.55 -0.75 -0.13 0.68 -1.32 0.00 0.00 176.35 175.38 2wva s VAL 366 N -0.05 1.97 0.20 1.68 -7.23 -1.26 -4.66 120.40 111.05 2wva s VAL 366 Ca 0.60 -2.24 -0.11 0.00 -1.81 0.00 0.00 61.98 58.42 2wva s VAL 366 Cb -0.43 -2.29 0.13 0.00 0.56 0.00 0.00 36.38 34.34 2wva s VAL 366 CO 0.45 -0.42 1.74 -1.13 -0.31 0.00 0.00 175.10 175.43 2wva h ASN 367 N 2.35 0.17 -0.72 4.85 -1.24 -1.95 -1.92 115.58 117.12 2wva h ASN 367 Ca -0.40 0.08 0.02 0.00 0.71 0.00 0.00 56.30 56.71 2wva h ASN 367 Cb 1.24 0.07 -0.04 0.00 0.73 0.00 0.00 38.32 40.32 2wva h ASN 367 CO 0.64 0.11 0.47 0.00 -1.29 0.00 0.00 177.43 177.36 2wva h ALA 368 N 1.39 1.52 -0.43 1.57 0.00 -1.96 -1.43 119.26 119.93 2wva h ALA 368 Ca 0.28 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 2wva h ALA 368 Cb 0.34 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2wva h ALA 368 CO -0.30 0.43 -0.18 1.49 0.00 0.00 0.00 179.25 180.69 2wva h GLU 369 N 0.93 0.83 0.04 0.00 4.57 -1.75 0.55 114.58 119.76 2wva h GLU 369 Ca 0.27 -0.31 -0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2wva h GLU 369 Cb -0.05 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.49 2wva h GLU 369 CO -0.07 0.94 -0.02 0.82 -1.18 0.00 0.00 179.01 179.50 2wva h ILE 370 N 0.73 1.02 -0.96 2.32 2.04 -1.13 -2.31 117.51 119.20 2wva h ILE 370 Ca 0.11 -0.19 0.06 0.00 1.00 0.00 0.00 64.86 65.84 2wva h ILE 370 Cb 0.69 1.14 -0.06 0.00 -0.74 0.00 0.00 36.82 37.85 2wva h ILE 370 CO 0.05 0.05 0.62 0.00 0.00 0.00 0.00 178.15 178.87 2wva h ALA 371 N 0.81 1.45 -0.06 1.87 0.00 -1.02 -0.91 119.26 121.40 2wva h ALA 371 Ca -0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2wva h ALA 371 Cb 0.13 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2wva h ALA 371 CO 0.01 0.41 0.03 -0.09 0.00 0.00 0.00 179.25 179.61 2wva h ARG 372 N 1.12 0.09 -0.47 0.00 2.43 -0.75 -1.16 114.38 115.64 2wva h ARG 372 Ca 0.41 -0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.45 2wva h ARG 372 Cb 0.17 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.69 2wva h ARG 372 CO -0.16 0.21 -0.17 1.96 -1.51 0.00 0.00 179.97 180.30 2wva h GLN 373 N -0.04 0.92 -0.45 0.20 4.20 -0.99 -1.25 115.11 117.70 2wva h GLN 373 Ca 0.02 -0.36 -0.03 0.00 0.06 0.00 0.00 58.65 58.34 2wva h GLN 373 Cb 0.15 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 2wva h GLN 373 CO -0.00 1.02 0.16 0.28 -0.67 0.00 0.00 178.83 179.62 2wva h VAL 374 N 0.81 1.21 -0.77 -0.54 2.07 -1.16 -2.70 116.25 115.17 2wva h VAL 374 Ca 0.12 -0.68 0.02 0.00 0.82 0.00 0.00 66.70 66.98 2wva h VAL 374 Cb 0.71 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 2wva h VAL 374 CO 0.05 0.25 0.51 -0.08 0.02 0.00 0.00 177.57 178.32 2wva h GLU 375 N 0.59 0.96 0.00 1.57 4.81 -0.91 -0.38 114.58 121.21 2wva h GLU 375 Ca 0.15 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2wva h GLU 375 Cb 0.22 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.39 2wva h GLU 375 CO -0.01 0.63 0.00 0.00 -0.73 0.00 0.00 179.01 178.90 2wva n ALA 376 N -2.42 1.64 0.95 2.92 0.00 -0.50 -1.99 120.51 121.11 2wva n ALA 376 Ca 0.09 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.66 2wva n ALA 376 Cb 0.08 -1.29 0.32 0.00 0.00 0.00 0.00 19.45 18.57 2wva n ALA 376 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wva n LEU 377 N -1.78 0.42 -4.69 0.00 4.77 -0.16 -4.91 117.00 110.65 2wva n LEU 377 Ca 0.03 0.14 -0.42 0.00 -0.03 0.00 0.00 56.01 55.73 2wva n LEU 377 Cb 0.19 -0.30 -0.03 0.00 -2.33 0.00 0.00 43.42 40.95 2wva n LEU 377 CO 0.15 0.07 1.12 -0.76 -1.33 0.00 0.00 177.39 176.64 2wva s LEU 378 N -3.16 4.32 0.29 2.23 1.43 -0.84 -4.97 118.68 117.98 2wva s LEU 378 Ca 0.11 2.13 0.05 0.00 -1.03 0.00 0.00 54.13 55.39 2wva s LEU 378 Cb 0.17 -3.56 -0.06 0.00 0.03 0.00 0.00 46.19 42.77 2wva s LEU 378 CO 0.66 -0.71 -0.02 0.42 0.23 0.00 0.00 176.35 176.93 2wva s THR 379 N 2.31 1.44 -1.05 5.49 -4.23 -1.26 -4.82 115.64 113.52 2wva s THR 379 Ca 0.64 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 59.08 2wva s THR 379 Cb -0.32 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 70.99 2wva s THR 379 CO 0.27 -0.22 0.90 -2.65 -0.54 0.00 0.00 174.62 172.38 2wva n PRO 380 N -0.59 0.00 -0.27 3.99 -0.02 -1.26 -0.66 135.00 136.19 2wva n PRO 380 Ca -0.05 0.41 0.07 0.00 -2.02 0.00 0.00 63.50 61.91 2wva n PRO 380 Cb 0.64 -1.53 0.20 0.00 -0.02 0.00 0.00 33.50 32.79 2wva n PRO 380 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2wva n ASN 381 N -1.40 3.29 -4.89 2.55 5.15 -1.26 -3.41 115.26 115.29 2wva n ASN 381 Ca 0.00 -2.19 -0.32 0.00 -0.60 0.00 0.00 54.58 51.47 2wva n ASN 381 Cb 0.03 -0.33 -0.05 0.00 -0.53 0.00 0.00 39.78 38.91 2wva n ASN 381 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2wva s THR 382 N -1.34 5.28 -0.08 -0.44 2.01 0.16 -1.61 115.64 119.63 2wva s THR 382 Ca 0.30 -0.34 0.02 0.00 0.31 0.00 0.00 61.69 61.99 2wva s THR 382 Cb 0.18 -3.52 0.01 0.00 0.01 0.00 0.00 72.50 69.18 2wva s THR 382 CO 0.17 0.22 -0.13 -0.89 -0.69 0.00 0.00 174.62 173.30 2wva s THR 383 N -1.41 1.22 -0.26 -0.82 2.01 -0.24 -0.78 115.64 115.36 2wva s THR 383 Ca 0.31 -0.52 -0.08 0.00 0.31 0.00 0.00 61.69 61.71 2wva s THR 383 Cb -0.13 -1.12 -0.03 0.00 0.01 0.00 0.00 72.50 71.23 2wva s THR 383 CO 0.23 0.38 0.11 -0.69 -0.69 0.00 0.00 174.62 173.95 2wva s VAL 384 N 0.75 4.57 -0.27 3.82 1.01 0.03 -0.45 120.40 129.87 2wva s VAL 384 Ca -0.13 -0.11 -0.20 0.00 0.00 0.00 0.00 61.98 61.54 2wva s VAL 384 Cb -0.16 -3.17 -0.02 0.00 0.00 0.00 0.00 36.38 33.04 2wva s VAL 384 CO 0.03 0.29 0.59 -0.63 0.00 0.00 0.00 175.10 175.38 2wva s ILE 385 N 1.65 5.00 -0.26 2.22 -1.09 0.36 -0.62 121.20 128.46 2wva s ILE 385 Ca 0.06 0.99 -0.03 0.00 -2.23 0.00 0.00 60.65 59.45 2wva s ILE 385 Cb -0.15 -3.91 0.02 0.00 -1.58 0.00 0.00 42.46 36.84 2wva s ILE 385 CO 0.06 0.01 -0.03 0.00 -1.23 0.00 0.00 174.94 173.75 2wva s ALA 386 N 2.46 2.78 0.49 9.38 0.00 -0.80 -1.08 121.76 135.00 2wva s ALA 386 Ca 0.24 -1.49 -0.20 0.00 0.00 0.00 0.00 51.96 50.52 2wva s ALA 386 Cb -0.15 -1.80 -0.08 0.00 0.00 0.00 0.00 23.12 21.08 2wva s ALA 386 CO 0.09 -0.88 1.04 -2.00 0.00 0.00 0.00 175.76 174.02 2wva s GLU 387 N 1.35 3.78 0.21 0.00 2.56 -0.56 -4.53 118.70 121.51 2wva s GLU 387 Ca 0.00 1.37 -0.32 0.00 0.00 0.00 0.00 54.97 56.02 2wva s GLU 387 Cb -0.17 -2.09 -0.14 0.00 2.00 0.00 0.00 34.13 33.73 2wva s GLU 387 CO -0.03 -0.45 1.45 2.41 -0.56 0.00 0.00 175.26 178.08 2wva n THR 388 N -0.98 0.65 0.00 -1.70 -1.04 -1.26 -2.92 114.28 107.03 2wva n THR 388 Ca 0.09 -0.16 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 2wva n THR 388 Cb 0.52 -1.46 0.00 0.00 -1.82 0.00 0.00 70.33 67.57 2wva n THR 388 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2wva n GLY 389 N 2.51 0.74 0.30 3.41 0.00 -1.26 -4.79 105.19 106.09 2wva n GLY 389 Ca 0.13 -2.06 0.20 0.00 0.00 0.00 0.00 46.02 44.29 2wva n GLY 389 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2wva h ASP 390 N 0.00 0.00 -0.00 1.61 3.58 -1.96 -1.27 116.42 118.38 2wva h ASP 390 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2wva h ASP 390 Cb 0.00 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 2wva h ASP 390 CO 0.00 0.00 0.00 0.28 -2.88 0.00 0.00 179.24 176.64 2wva h SER 391 N 0.00 0.00 -0.20 2.28 0.02 -1.87 0.11 113.55 113.89 2wva h SER 391 Ca 0.00 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.00 2wva h SER 391 Cb 0.21 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.69 2wva h SER 391 CO 0.00 0.00 -0.20 -0.50 -1.14 0.00 0.00 176.83 174.99 2wva h TRP 392 N 0.00 -0.52 0.02 3.45 4.06 -1.10 -1.47 115.95 120.40 2wva h TRP 392 Ca 0.00 0.03 -0.25 0.00 2.06 0.00 0.00 58.89 60.73 2wva h TRP 392 Cb 0.00 0.26 0.01 0.00 -1.00 0.00 0.00 29.16 28.43 2wva h TRP 392 CO 0.00 -0.28 -1.03 0.74 -3.56 0.00 0.00 178.44 174.31 2wva h PHE 393 N -0.22 0.84 -0.25 0.49 0.04 -1.31 -2.00 116.94 114.52 2wva h PHE 393 Ca 0.12 -0.47 0.02 0.00 2.80 0.00 0.00 57.97 60.44 2wva h PHE 393 Cb 0.40 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.44 2wva h PHE 393 CO -0.34 1.30 0.12 -0.91 -0.60 0.00 0.00 178.31 177.89 2wva h ASN 394 N 0.30 0.19 -0.76 2.17 2.35 -1.03 -2.81 115.58 115.99 2wva h ASN 394 Ca -0.12 0.01 0.01 0.00 -0.55 0.00 0.00 56.30 55.65 2wva h ASN 394 Cb 1.69 -0.03 -0.04 0.00 0.05 0.00 0.00 38.32 39.99 2wva h ASN 394 CO 0.19 0.14 0.50 0.00 -1.65 0.00 0.00 177.43 176.61 2wva h ALA 395 N 1.13 0.97 0.00 -0.83 0.00 -1.26 -2.62 119.26 116.65 2wva h ALA 395 Ca 0.10 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2wva h ALA 395 Cb 0.03 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 2wva h ALA 395 CO -0.07 0.37 -0.02 0.37 0.00 0.00 0.00 179.25 179.90 2wva h GLN 396 N 1.02 0.00 -0.01 0.00 5.75 -1.16 -1.81 115.11 118.90 2wva h GLN 396 Ca 0.28 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.78 2wva h GLN 396 Cb -0.11 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.44 2wva h GLN 396 CO -0.07 0.02 -0.07 0.54 -2.65 0.00 0.00 178.83 176.60 2wva n ARG 397 N -3.90 0.96 -3.23 1.69 1.74 -0.99 -4.88 116.66 108.05 2wva n ARG 397 Ca -0.03 -0.36 -0.39 0.00 -0.77 0.00 0.00 57.85 56.31 2wva n ARG 397 Cb 0.10 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.00 2wva n ARG 397 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2wva s MET 398 N -2.28 4.32 -0.09 5.56 -1.94 -0.68 -5.04 119.30 119.14 2wva s MET 398 Ca 0.34 0.65 -0.30 0.00 -1.71 0.00 0.00 55.69 54.67 2wva s MET 398 Cb 0.21 -3.38 -0.02 0.00 2.01 0.00 0.00 34.83 33.65 2wva s MET 398 CO 0.43 0.28 1.03 0.21 -0.01 0.00 0.00 175.02 176.95 2wva s LYS 399 N 0.15 4.43 -0.25 2.03 2.47 -1.26 -5.03 119.74 122.29 2wva s LYS 399 Ca 0.30 1.43 -0.12 0.00 -1.56 0.00 0.00 55.97 56.02 2wva s LYS 399 Cb -0.17 -3.53 -0.05 0.00 -1.46 0.00 0.00 37.83 32.62 2wva s LYS 399 CO 0.15 -0.30 0.21 -0.51 0.16 0.00 0.00 175.35 175.06 2wva s LEU 400 N 1.90 4.09 0.56 5.43 1.43 -1.26 -5.00 118.68 125.83 2wva s LEU 400 Ca 0.50 0.14 -0.21 0.00 -1.03 0.00 0.00 54.13 53.53 2wva s LEU 400 Cb -0.19 -2.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.80 2wva s LEU 400 CO 0.20 0.00 1.36 -2.84 0.23 0.00 0.00 176.35 175.30 2wva s PRO 401 N 1.33 3.02 0.10 1.29 0.02 -1.26 -4.42 135.00 135.08 2wva s PRO 401 Ca 0.09 2.24 -0.34 0.00 0.02 0.00 0.00 61.00 63.02 2wva s PRO 401 Cb -0.14 -2.19 -0.14 0.00 0.02 0.00 0.00 34.50 32.05 2wva s PRO 401 CO 0.07 -1.28 1.64 0.09 -0.33 0.00 0.00 177.00 177.18 2wva n ASN 402 N -1.18 3.09 0.00 2.53 4.13 -1.26 -1.53 115.26 121.05 2wva n ASN 402 Ca 0.11 1.06 0.00 0.00 1.68 0.00 0.00 54.58 57.43 2wva n ASN 402 Cb 0.45 -1.40 0.00 0.00 -1.54 0.00 0.00 39.78 37.29 2wva n ASN 402 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wva n GLY 403 N 3.60 2.31 3.77 7.41 0.00 -1.26 -4.47 105.19 116.55 2wva n GLY 403 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 2wva n GLY 403 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wva s ALA 404 N -2.37 3.28 0.10 4.61 0.00 -0.58 -4.60 121.76 122.21 2wva s ALA 404 Ca 0.00 1.07 0.09 0.00 0.00 0.00 0.00 51.96 53.12 2wva s ALA 404 Cb 0.00 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 2wva s ALA 404 CO 0.00 -0.55 -0.20 1.03 0.00 0.00 0.00 175.76 176.04 2wva s ARG 405 N -2.06 1.78 -0.06 0.00 1.81 0.04 -4.88 118.95 115.59 2wva s ARG 405 Ca 0.53 -1.16 0.06 0.00 -1.72 0.00 0.00 55.73 53.44 2wva s ARG 405 Cb -0.34 -2.09 -0.01 0.00 -0.45 0.00 0.00 34.95 32.06 2wva s ARG 405 CO 0.44 0.49 -0.23 0.08 -0.68 0.00 0.00 175.30 175.40 2wva s VAL 406 N -1.07 1.91 -0.20 3.52 1.01 -1.26 -0.79 120.40 123.52 2wva s VAL 406 Ca 0.16 -0.98 -0.04 0.00 0.00 0.00 0.00 61.98 61.13 2wva s VAL 406 Cb -0.10 -1.62 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 2wva s VAL 406 CO 0.08 0.53 -0.04 -1.61 0.00 0.00 0.00 175.10 174.06 2wva s GLU 407 N -0.08 3.47 0.09 2.72 0.41 0.21 -4.83 118.70 120.70 2wva s GLU 407 Ca -0.05 -0.59 0.10 0.00 -0.41 0.00 0.00 54.97 54.02 2wva s GLU 407 Cb -0.14 -2.97 -0.03 0.00 -1.78 0.00 0.00 34.13 29.21 2wva s GLU 407 CO 0.04 -0.05 -0.26 0.71 -0.49 0.00 0.00 175.26 175.21 2wva s TYR 408 N 1.10 2.28 -0.53 1.61 2.02 -1.26 -1.90 117.35 120.68 2wva s TYR 408 Ca 0.01 -0.39 0.05 0.00 -0.37 0.00 0.00 57.07 56.37 2wva s TYR 408 Cb -0.15 -1.29 0.37 0.00 -0.40 0.00 0.00 41.96 40.50 2wva s TYR 408 CO 0.00 0.24 1.03 -1.91 -1.57 0.00 0.00 175.55 173.35 2wva n GLU 409 N 1.29 3.34 0.01 -0.62 2.13 -1.26 -4.90 120.64 120.64 2wva n GLU 409 Ca -0.18 -4.70 0.14 0.00 0.66 0.00 0.00 57.16 53.08 2wva n GLU 409 Cb 0.53 -2.25 0.58 0.00 0.27 0.00 0.00 31.44 30.57 2wva n GLU 409 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 2wva n MET 410 N -0.35 0.03 -0.10 5.31 2.81 -1.26 -0.25 117.12 123.31 2wva n MET 410 Ca 0.35 0.04 -0.22 0.00 -1.81 0.00 0.00 57.70 56.05 2wva n MET 410 Cb 0.50 -1.54 -0.12 0.00 -0.71 0.00 0.00 33.22 31.36 2wva n MET 410 CO 0.00 0.00 0.00 0.94 1.51 0.00 0.00 175.97 178.42 2wva n GLN 411 N -1.59 0.58 -0.02 0.03 -0.06 -1.26 -4.54 117.38 110.52 2wva n GLN 411 Ca 0.07 0.55 -0.09 0.00 -2.00 0.00 0.00 57.00 55.53 2wva n GLN 411 Cb 0.34 -1.74 -0.07 0.00 -4.06 0.00 0.00 30.24 24.71 2wva n GLN 411 CO 0.00 0.00 0.00 2.35 -0.20 0.00 0.00 177.06 179.21 2wva h TRP 412 N -0.93 -0.07 -4.34 3.69 -0.00 -1.85 -3.49 115.95 108.97 2wva h TRP 412 Ca -0.37 -0.00 -0.26 0.00 -0.00 0.00 0.00 58.89 58.26 2wva h TRP 412 Cb 1.37 0.02 0.10 0.00 -0.00 0.00 0.00 29.16 30.65 2wva h TRP 412 CO 0.09 0.45 -0.48 0.41 -0.00 0.00 0.00 178.44 178.91 2wva n GLY 413 N 1.34 -0.08 3.54 2.65 0.00 0.65 -4.96 105.19 108.34 2wva n GLY 413 Ca -0.06 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 2wva n GLY 413 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2wva s HIS 414 N -3.22 2.89 0.42 1.61 5.04 -1.26 -4.98 115.29 115.79 2wva s HIS 414 Ca 0.31 0.20 -0.26 0.00 -1.54 0.00 0.00 55.06 53.76 2wva s HIS 414 Cb -0.13 -3.94 -0.09 0.00 0.04 0.00 0.00 32.58 28.45 2wva s HIS 414 CO 0.50 -1.16 1.41 0.96 -2.34 0.00 0.00 174.74 174.10 2wva s ILE 415 N 3.72 2.19 0.00 0.89 -4.36 -1.26 -1.19 121.20 121.19 2wva s ILE 415 Ca 0.33 0.18 0.00 0.00 -0.26 0.00 0.00 60.65 60.90 2wva s ILE 415 Cb -0.11 -3.11 0.00 0.00 1.25 0.00 0.00 42.46 40.49 2wva s ILE 415 CO 0.23 0.03 0.00 0.61 0.24 0.00 0.00 174.94 176.05 2wva n GLY 416 N 0.58 2.27 0.31 6.27 0.00 -1.23 -4.89 105.19 108.50 2wva n GLY 416 Ca 0.04 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.13 2wva n GLY 416 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2wva h TRP 417 N 0.00 0.78 -0.63 1.61 7.01 -1.48 -2.94 115.95 120.30 2wva h TRP 417 Ca 0.00 0.03 0.09 0.00 2.11 0.00 0.00 58.89 61.13 2wva h TRP 417 Cb 0.00 -0.22 -0.04 0.00 -2.10 0.00 0.00 29.16 26.80 2wva h TRP 417 CO 0.00 0.20 0.42 0.66 -2.79 0.00 0.00 178.44 176.93 2wva h SER 418 N 0.64 0.43 0.35 2.65 4.64 -1.91 -1.76 113.55 118.59 2wva h SER 418 Ca 0.46 0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.77 2wva h SER 418 Cb 0.63 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 2wva h SER 418 CO -0.35 0.26 -0.17 0.58 -0.87 0.00 0.00 176.83 176.28 2wva h VAL 419 N 0.48 0.45 -0.00 0.95 2.07 -1.88 0.54 116.25 118.86 2wva h VAL 419 Ca 0.29 -0.70 -0.10 0.00 0.82 0.00 0.00 66.70 67.01 2wva h VAL 419 Cb 0.50 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 2wva h VAL 419 CO -0.09 0.10 -0.49 1.55 0.02 0.00 0.00 177.57 178.66 2wva h PRO 420 N -0.96 0.00 -0.56 1.57 0.13 -1.71 -2.24 132.00 128.23 2wva h PRO 420 Ca -0.05 -0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.05 2wva h PRO 420 Cb 0.52 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.63 2wva h PRO 420 CO 0.08 0.49 0.21 0.00 -0.23 0.00 0.00 178.00 178.55 2wva h ALA 421 N 1.51 0.73 -0.52 -0.56 0.00 -1.31 -0.05 119.26 119.06 2wva h ALA 421 Ca -0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 2wva h ALA 421 Cb 0.86 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2wva h ALA 421 CO 0.06 0.36 0.14 0.00 0.00 0.00 0.00 179.25 179.81 2wva h ALA 422 N 1.06 1.27 0.56 0.00 0.00 -0.69 0.11 119.26 121.58 2wva h ALA 422 Ca 0.19 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2wva h ALA 422 Cb 0.22 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.81 2wva h ALA 422 CO -0.01 0.51 -0.27 0.35 0.00 0.00 0.00 179.25 179.83 2wva h PHE 423 N 0.76 -0.70 -0.74 0.00 3.57 -0.97 -0.11 116.94 118.75 2wva h PHE 423 Ca 0.17 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.66 2wva h PHE 423 Cb 0.26 0.23 -0.04 0.00 2.79 0.00 0.00 35.95 39.20 2wva h PHE 423 CO 0.01 -0.43 0.46 0.78 -2.23 0.00 0.00 178.31 176.90 2wva h GLY 424 N -0.75 1.05 0.94 2.40 0.00 -0.72 -1.30 103.07 104.69 2wva h GLY 424 Ca -0.08 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 46.83 2wva h GLY 424 CO 0.12 0.41 0.14 -1.82 0.00 0.00 0.00 176.54 175.40 2wva h TYR 425 N 1.00 0.40 -0.27 5.60 5.03 -0.76 -1.97 116.97 126.00 2wva h TYR 425 Ca 0.27 -0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.54 2wva h TYR 425 Cb -0.07 -0.13 -0.01 0.00 1.55 0.00 0.00 36.73 38.07 2wva h TYR 425 CO -0.02 0.36 0.10 0.00 -1.32 0.00 0.00 178.16 177.28 2wva h ALA 426 N 1.01 1.66 -0.28 1.82 0.00 -0.53 0.15 119.26 123.09 2wva h ALA 426 Ca 0.10 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 2wva h ALA 426 Cb 0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2wva h ALA 426 CO -0.01 0.27 -0.30 0.28 0.00 0.00 0.00 179.25 179.48 2wva h VAL 427 N 0.38 1.28 0.00 0.00 2.07 -0.94 -2.58 116.25 116.46 2wva h VAL 427 Ca 0.10 -1.40 -0.02 0.00 0.82 0.00 0.00 66.70 66.20 2wva h VAL 427 Cb 0.10 1.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 2wva h VAL 427 CO -0.01 0.45 -0.55 1.23 0.02 0.00 0.00 177.57 178.71 2wva h GLY 428 N 1.02 0.00 -5.96 2.17 0.00 -0.42 -3.38 103.07 96.51 2wva h GLY 428 Ca 0.06 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.90 2wva h GLY 428 CO 0.06 0.00 -1.15 0.00 0.00 0.00 0.00 176.54 175.45 2wva n ALA 429 N -2.16 2.22 0.31 3.60 0.00 0.38 -4.80 120.51 120.05 2wva n ALA 429 Ca 0.01 -3.49 0.20 0.00 0.00 0.00 0.00 53.44 50.16 2wva n ALA 429 Cb 0.57 -0.91 0.95 0.00 0.00 0.00 0.00 19.45 20.07 2wva n ALA 429 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2wva h PRO 430 N 3.09 0.00 0.00 0.00 0.14 -1.65 -2.52 132.00 131.06 2wva h PRO 430 Ca 0.10 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.24 2wva h PRO 430 Cb 0.93 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.07 2wva h PRO 430 CO 0.52 0.01 0.00 1.05 0.14 0.00 0.00 178.00 179.72 2wva h GLU 431 N 0.00 0.00 -6.66 0.86 9.09 -1.92 -3.46 114.58 112.49 2wva h GLU 431 Ca -0.00 0.00 -0.50 0.00 0.05 0.00 0.00 59.36 58.91 2wva h GLU 431 Cb 0.25 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.36 2wva h GLU 431 CO 0.00 0.00 -0.05 1.03 0.05 0.00 0.00 179.01 180.04 2wva s ARG 432 N -3.30 3.60 -0.50 1.06 0.52 -0.95 -5.03 118.95 114.35 2wva s ARG 432 Ca 0.06 0.04 -0.29 0.00 -0.52 0.00 0.00 55.73 55.03 2wva s ARG 432 Cb 0.10 -2.54 0.02 0.00 0.52 0.00 0.00 34.95 33.05 2wva s ARG 432 CO 0.52 0.05 1.27 0.50 0.02 0.00 0.00 175.30 177.67 2wva s ARG 433 N -4.08 3.55 -0.34 3.54 3.52 -0.63 -4.96 118.95 119.55 2wva s ARG 433 Ca 0.45 0.55 -0.12 0.00 -0.13 0.00 0.00 55.73 56.48 2wva s ARG 433 Cb -0.10 -4.00 -0.02 0.00 -1.56 0.00 0.00 34.95 29.27 2wva s ARG 433 CO 0.35 -1.61 0.23 -0.80 -0.81 0.00 0.00 175.30 172.66 2wva s ASN 434 N 3.33 6.01 -0.09 -2.12 0.01 -1.26 -1.08 114.94 119.73 2wva s ASN 434 Ca 0.51 -0.43 0.00 0.00 -0.71 0.00 0.00 52.86 52.23 2wva s ASN 434 Cb -0.09 -2.12 -0.03 0.00 0.41 0.00 0.00 41.25 39.42 2wva s ASN 434 CO 0.29 -0.23 -0.08 -0.63 -1.51 0.00 0.00 177.10 174.94 2wva s ILE 435 N 1.71 3.58 -0.16 0.60 1.01 0.41 -0.94 121.20 127.41 2wva s ILE 435 Ca 0.06 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.21 2wva s ILE 435 Cb -0.17 -2.48 0.01 0.00 0.01 0.00 0.00 42.46 39.82 2wva s ILE 435 CO 0.10 0.57 -0.18 -0.22 0.00 0.00 0.00 174.94 175.20 2wva s LEU 436 N -0.41 2.27 -0.37 2.97 2.96 0.12 -0.49 118.68 125.74 2wva s LEU 436 Ca 0.06 -0.57 -0.05 0.00 -0.22 0.00 0.00 54.13 53.35 2wva s LEU 436 Cb -0.12 -1.51 0.07 0.00 0.50 0.00 0.00 46.19 45.13 2wva s LEU 436 CO 0.02 0.05 0.15 -0.04 -1.32 0.00 0.00 176.35 175.21 2wva s MET 437 N 1.00 2.40 -0.01 1.98 -1.94 -0.24 0.59 119.30 123.08 2wva s MET 437 Ca -0.02 -1.45 0.02 0.00 -1.71 0.00 0.00 55.69 52.53 2wva s MET 437 Cb -0.15 -3.51 -0.00 0.00 2.01 0.00 0.00 34.83 33.18 2wva s MET 437 CO -0.05 -0.84 -0.07 0.54 -0.01 0.00 0.00 175.02 174.59 2wva s VAL 438 N 1.30 0.60 0.64 -6.03 0.11 -0.78 -1.49 120.40 114.75 2wva s VAL 438 Ca 0.01 -0.30 -0.11 0.00 -2.93 0.00 0.00 61.98 58.66 2wva s VAL 438 Cb -0.21 -0.52 -0.03 0.00 -1.53 0.00 0.00 36.38 34.09 2wva s VAL 438 CO -0.00 0.18 1.04 -0.83 -3.33 0.00 0.00 175.10 172.16 2wva s GLY 439 N -0.02 1.66 0.21 6.54 0.00 -1.26 -1.06 107.32 113.38 2wva s GLY 439 Ca 0.01 -0.08 -0.10 0.00 0.00 0.00 0.00 44.72 44.54 2wva s GLY 439 CO -0.00 0.20 1.86 1.29 0.00 0.00 0.00 173.10 176.45 2wva h ASP 440 N -0.42 0.87 -0.68 1.64 2.03 -1.63 -1.33 116.42 116.90 2wva h ASP 440 Ca -0.44 -0.04 -0.04 0.00 -0.73 0.00 0.00 57.03 55.78 2wva h ASP 440 Cb 1.20 -0.22 -0.03 0.00 -0.83 0.00 0.00 39.33 39.45 2wva h ASP 440 CO 0.61 0.65 0.28 1.23 -1.03 0.00 0.00 179.24 180.98 2wva h GLY 441 N 1.01 1.09 0.94 7.15 0.00 -1.86 -2.89 103.07 108.50 2wva h GLY 441 Ca 0.27 -0.58 -0.11 0.00 0.00 0.00 0.00 47.33 46.90 2wva h GLY 441 CO -0.05 0.55 -0.27 1.76 0.00 0.00 0.00 176.54 178.52 2wva h SER 442 N 0.96 0.69 -0.92 0.19 0.02 -1.86 -3.12 113.55 109.52 2wva h SER 442 Ca 0.23 -0.48 0.19 0.00 -0.84 0.00 0.00 61.79 60.89 2wva h SER 442 Cb 0.20 -0.20 -0.07 0.00 0.14 0.00 0.00 62.40 62.47 2wva h SER 442 CO -0.02 1.03 0.60 0.15 -1.14 0.00 0.00 176.83 177.45 2wva h PHE 443 N 0.37 0.69 0.00 3.45 3.57 -1.09 -1.46 116.94 122.47 2wva h PHE 443 Ca 0.04 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 2wva h PHE 443 Cb 0.84 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.37 2wva h PHE 443 CO 0.07 0.19 -0.02 1.96 -2.23 0.00 0.00 178.31 178.28 2wva h GLN 444 N 0.52 0.00 -0.07 1.11 4.20 -1.44 0.70 115.11 120.12 2wva h GLN 444 Ca 0.49 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 59.05 2wva h GLN 444 Cb 1.05 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.81 2wva h GLN 444 CO -0.22 0.02 -0.60 -0.07 -0.67 0.00 0.00 178.83 177.29 2wva h LEU 445 N 0.00 0.27 -1.52 1.46 4.07 -1.41 -3.37 115.31 114.81 2wva h LEU 445 Ca -0.00 -0.15 0.00 0.00 0.08 0.00 0.00 57.88 57.81 2wva h LEU 445 Cb 0.37 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.04 2wva h LEU 445 CO 0.00 0.80 -0.20 0.35 -1.08 0.00 0.00 178.44 178.31 2wva n THR 446 N -3.88 0.08 -0.39 0.22 -2.24 -1.07 -4.92 114.28 102.08 2wva n THR 446 Ca -0.02 -0.09 0.31 0.00 -2.27 0.00 0.00 64.05 61.98 2wva n THR 446 Cb 0.61 0.75 0.58 0.00 -2.10 0.00 0.00 70.33 70.17 2wva n THR 446 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wva h ALA 447 N 0.00 2.43 0.00 6.98 0.00 -1.04 -1.99 119.26 125.63 2wva h ALA 447 Ca 0.00 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2wva h ALA 447 Cb 1.15 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 2wva h ALA 447 CO 0.00 -1.03 -0.00 -0.56 0.00 0.00 0.00 179.25 177.66 2wva h GLN 448 N 0.18 0.00 0.00 0.00 -0.00 -1.91 -1.98 115.11 111.40 2wva h GLN 448 Ca 0.77 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.42 2wva h GLN 448 Cb 2.16 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.64 2wva h GLN 448 CO -0.47 0.00 0.00 -1.91 -0.00 0.00 0.00 178.83 176.45 2wva n GLU 449 N -3.53 0.14 0.12 0.06 4.07 -0.75 -0.93 120.64 119.82 2wva n GLU 449 Ca -0.03 0.44 0.05 0.00 -0.06 0.00 0.00 57.16 57.56 2wva n GLU 449 Cb 0.08 -1.81 0.49 0.00 -0.06 0.00 0.00 31.44 30.15 2wva n GLU 449 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 2wva h VAL 450 N 0.00 1.08 -0.24 6.31 2.07 -1.59 -1.45 116.25 122.43 2wva h VAL 450 Ca 0.00 -0.24 0.02 0.00 0.82 0.00 0.00 66.70 67.29 2wva h VAL 450 Cb 0.26 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 2wva h VAL 450 CO 0.00 0.09 0.16 0.00 0.02 0.00 0.00 177.57 177.85 2wva h ALA 451 N 1.81 1.91 -0.02 1.67 0.00 -1.25 -1.18 119.26 122.20 2wva h ALA 451 Ca 0.08 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.80 2wva h ALA 451 Cb 0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2wva h ALA 451 CO -0.01 0.07 -0.76 1.96 0.00 0.00 0.00 179.25 180.51 2wva h GLN 452 N 0.26 0.16 -0.60 0.00 1.08 -1.40 0.34 115.11 114.95 2wva h GLN 452 Ca 0.10 -0.15 -0.01 0.00 -1.45 0.00 0.00 58.65 57.14 2wva h GLN 452 Cb 0.07 0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.50 2wva h GLN 452 CO -0.02 0.84 0.35 0.52 -0.95 0.00 0.00 178.83 179.58 2wva h MET 453 N 0.10 0.82 -0.39 1.46 2.86 -1.07 -1.15 114.93 117.56 2wva h MET 453 Ca -0.02 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 2wva h MET 453 Cb 1.33 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.80 2wva h MET 453 CO 0.11 0.60 0.22 0.28 1.06 0.00 0.00 176.91 179.18 2wva h VAL 454 N 0.81 1.15 -0.51 -2.22 2.07 -1.06 -0.67 116.25 115.82 2wva h VAL 454 Ca 0.21 -0.38 0.05 0.00 0.82 0.00 0.00 66.70 67.41 2wva h VAL 454 Cb -0.00 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 30.40 2wva h VAL 454 CO -0.04 0.15 0.23 -0.09 0.02 0.00 0.00 177.57 177.85 2wva h ARG 455 N 0.51 0.44 -0.61 1.57 2.43 -0.57 -2.05 114.38 116.10 2wva h ARG 455 Ca 0.14 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 2wva h ARG 455 Cb 0.05 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 2wva h ARG 455 CO -0.02 0.29 0.00 1.28 -1.51 0.00 0.00 179.97 180.01 2wva n LEU 456 N -4.92 3.59 -3.78 3.80 4.77 -0.47 -4.95 117.00 115.04 2wva n LEU 456 Ca 0.05 -1.81 -0.24 0.00 -0.03 0.00 0.00 56.01 53.98 2wva n LEU 456 Cb 0.16 -0.47 0.03 0.00 -2.33 0.00 0.00 43.42 40.81 2wva n LEU 456 CO 0.27 0.68 -0.01 0.29 -1.33 0.00 0.00 177.39 177.30 2wva n LYS 457 N 0.93 -5.13 -3.34 3.23 5.02 -0.61 -4.95 118.16 113.31 2wva n LYS 457 Ca 0.20 0.61 -0.38 0.00 -2.02 0.00 0.00 58.31 56.71 2wva n LYS 457 Cb 0.65 -5.27 -0.07 0.00 -0.02 0.00 0.00 35.03 30.32 2wva n LYS 457 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2wva s LEU 458 N -6.90 4.18 -0.02 -0.35 1.43 -0.36 -4.25 118.68 112.41 2wva s LEU 458 Ca 0.24 0.61 -0.04 0.00 -1.03 0.00 0.00 54.13 53.91 2wva s LEU 458 Cb -0.12 -2.59 -0.15 0.00 0.03 0.00 0.00 46.19 43.36 2wva s LEU 458 CO 0.82 -0.08 2.96 -0.81 0.23 0.00 0.00 176.35 179.47 2wva n PRO 459 N 4.37 1.63 -2.23 1.29 -0.05 -1.26 -0.95 135.00 137.79 2wva n PRO 459 Ca -0.07 -0.66 -0.42 0.00 -0.05 0.00 0.00 63.50 62.29 2wva n PRO 459 Cb 0.51 -1.62 -0.03 0.00 -0.05 0.00 0.00 33.50 32.31 2wva n PRO 459 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 175.50 175.53 2wva s VAL 460 N 0.48 3.50 -0.32 0.52 1.01 -1.26 -4.68 120.40 119.65 2wva s VAL 460 Ca 0.41 1.07 -0.18 0.00 0.00 0.00 0.00 61.98 63.27 2wva s VAL 460 Cb 0.20 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.88 2wva s VAL 460 CO -0.01 0.08 0.52 -0.63 0.00 0.00 0.00 175.10 175.07 2wva s ILE 461 N 1.18 5.02 -0.26 2.22 1.01 -0.11 -1.06 121.20 129.19 2wva s ILE 461 Ca 0.63 0.54 -0.07 0.00 0.00 0.00 0.00 60.65 61.75 2wva s ILE 461 Cb -0.35 -3.93 -0.01 0.00 0.01 0.00 0.00 42.46 38.18 2wva s ILE 461 CO 0.30 -0.13 0.07 -0.63 0.00 0.00 0.00 174.94 174.55 2wva s ILE 462 N 2.40 4.13 -0.58 2.92 1.01 0.44 0.16 121.20 131.68 2wva s ILE 462 Ca 0.20 -0.38 -0.18 0.00 0.00 0.00 0.00 60.65 60.29 2wva s ILE 462 Cb -0.15 -3.00 0.11 0.00 0.01 0.00 0.00 42.46 39.43 2wva s ILE 462 CO 0.12 0.25 0.65 -0.36 0.00 0.00 0.00 174.94 175.61 2wva s PHE 463 N 1.57 3.06 -0.49 3.97 0.08 0.20 -0.09 117.98 126.27 2wva s PHE 463 Ca 0.05 -1.03 -0.24 0.00 0.12 0.00 0.00 56.93 55.83 2wva s PHE 463 Cb -0.16 -3.95 0.03 0.00 -0.57 0.00 0.00 43.02 38.38 2wva s PHE 463 CO 0.03 -1.22 0.88 -1.17 -0.10 0.00 0.00 175.22 173.63 2wva s LEU 464 N 2.43 4.15 -0.62 -0.37 1.98 -0.72 -1.86 118.68 123.66 2wva s LEU 464 Ca 0.10 -0.15 -0.25 0.00 -2.89 0.00 0.00 54.13 50.94 2wva s LEU 464 Cb -0.25 -2.97 0.05 0.00 0.66 0.00 0.00 46.19 43.67 2wva s LEU 464 CO 0.06 -1.06 1.05 -0.63 -1.89 0.00 0.00 176.35 173.88 2wva s ILE 465 N 3.64 4.18 -0.87 6.68 -1.09 -0.22 -0.74 121.20 132.78 2wva s ILE 465 Ca 0.32 0.22 -0.16 0.00 -2.23 0.00 0.00 60.65 58.80 2wva s ILE 465 Cb -0.12 -4.69 0.19 0.00 -1.58 0.00 0.00 42.46 36.27 2wva s ILE 465 CO 0.22 -1.40 0.89 0.21 -1.23 0.00 0.00 174.94 173.63 2wva s ASN 466 N 3.28 6.73 -0.18 3.58 3.84 0.13 -1.69 114.94 130.63 2wva s ASN 466 Ca 0.31 -2.49 0.16 0.00 0.21 0.00 0.00 52.86 51.05 2wva s ASN 466 Cb -0.12 -2.27 0.59 0.00 -0.55 0.00 0.00 41.25 38.90 2wva s ASN 466 CO 0.17 -0.73 1.49 -0.46 -2.79 0.00 0.00 177.10 174.78 2wva n ASN 467 N 4.82 4.28 -3.49 -4.21 0.23 -1.25 -2.62 115.26 113.01 2wva n ASN 467 Ca 0.17 -2.96 -0.22 0.00 -0.53 0.00 0.00 54.58 51.05 2wva n ASN 467 Cb 0.48 -0.57 0.06 0.00 -2.08 0.00 0.00 39.78 37.67 2wva n ASN 467 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2wva n TYR 468 N -0.20 -2.15 -0.16 -2.53 9.36 -1.26 -3.81 117.16 116.41 2wva n TYR 468 Ca 0.23 0.73 0.00 0.00 3.32 0.00 0.00 57.90 62.18 2wva n TYR 468 Cb 0.95 -4.05 0.00 0.00 -0.63 0.00 0.00 39.34 35.61 2wva n TYR 468 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2wva n GLY 469 N -1.44 0.78 3.31 2.98 0.00 -1.26 -4.66 105.19 104.90 2wva n GLY 469 Ca -0.14 -1.88 -0.43 0.00 0.00 0.00 0.00 46.02 43.56 2wva n GLY 469 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wva n TYR 470 N 3.96 4.41 -0.25 1.61 4.01 -0.58 -4.43 117.16 125.89 2wva n TYR 470 Ca 0.00 -3.15 -0.03 0.00 -0.16 0.00 0.00 57.90 54.56 2wva n TYR 470 Cb 0.00 -2.21 0.14 0.00 -0.31 0.00 0.00 39.34 36.96 2wva n TYR 470 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 2wva h THR 471 N 4.53 1.24 -0.80 -0.72 2.02 -1.91 -1.10 112.91 116.17 2wva h THR 471 Ca 0.36 -0.68 -0.03 0.00 0.77 0.00 0.00 66.41 66.83 2wva h THR 471 Cb 0.81 0.27 -0.04 0.00 -1.74 0.00 0.00 68.15 67.45 2wva h THR 471 CO 1.39 0.29 0.39 -0.29 0.37 0.00 0.00 175.52 177.66 2wva h ILE 472 N 1.08 1.25 -0.70 3.11 2.10 -1.93 -0.95 117.51 121.47 2wva h ILE 472 Ca 0.26 -0.70 -0.06 0.00 1.08 0.00 0.00 64.86 65.44 2wva h ILE 472 Cb 0.12 0.23 -0.03 0.00 -1.09 0.00 0.00 36.82 36.05 2wva h ILE 472 CO -0.03 0.30 0.20 -0.08 -1.08 0.00 0.00 178.15 177.45 2wva h GLU 473 N 1.14 1.08 -0.64 2.19 4.57 -1.80 -2.63 114.58 118.49 2wva h GLU 473 Ca 0.28 -0.24 -0.02 0.00 -1.18 0.00 0.00 59.36 58.20 2wva h GLU 473 Cb 0.11 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.52 2wva h GLU 473 CO -0.04 0.94 0.31 0.28 -1.18 0.00 0.00 179.01 179.32 2wva h VAL 474 N 1.04 1.21 -0.00 0.32 2.07 -0.33 0.34 116.25 120.89 2wva h VAL 474 Ca 0.22 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2wva h VAL 474 Cb 0.32 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 2wva h VAL 474 CO -0.00 0.24 -0.10 0.23 0.02 0.00 0.00 177.57 177.95 2wva n MET 475 N -4.35 0.48 -0.09 1.57 2.81 -0.45 -3.74 117.12 113.36 2wva n MET 475 Ca 0.06 -0.13 -0.10 0.00 -1.81 0.00 0.00 57.70 55.72 2wva n MET 475 Cb 0.13 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.11 2wva n MET 475 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 2wva n ILE 476 N -1.15 1.48 -3.63 2.02 5.41 -0.73 -3.92 119.36 118.84 2wva n ILE 476 Ca 0.13 0.12 -0.01 0.00 1.00 0.00 0.00 62.75 63.98 2wva n ILE 476 Cb 0.28 -2.32 -0.04 0.00 -0.71 0.00 0.00 39.64 36.85 2wva n ILE 476 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 2wva s HIS 477 N -2.67 -1.33 0.18 1.39 5.04 0.03 -4.69 115.29 113.25 2wva s HIS 477 Ca -0.26 2.26 -0.15 0.00 -1.54 0.00 0.00 55.06 55.38 2wva s HIS 477 Cb 0.04 0.77 -0.07 0.00 0.04 0.00 0.00 32.58 33.36 2wva s HIS 477 CO 0.38 -0.67 0.60 0.34 -2.34 0.00 0.00 174.74 173.05 2wva s ASP 478 N 2.88 6.86 0.14 9.88 2.15 -1.25 -4.46 116.67 132.87 2wva s ASP 478 Ca -0.05 1.15 -0.24 0.00 0.43 0.00 0.00 52.55 53.85 2wva s ASP 478 Cb -0.12 -2.32 0.08 0.00 -0.30 0.00 0.00 42.92 40.26 2wva s ASP 478 CO -0.19 0.06 1.08 -0.83 -0.17 0.00 0.00 175.17 175.13 2wva s GLY 479 N -1.77 0.01 0.58 2.66 0.00 -1.26 -5.03 107.32 102.51 2wva s GLY 479 Ca 0.40 -0.18 0.34 0.00 0.00 0.00 0.00 44.72 45.29 2wva s GLY 479 CO 0.20 2.54 2.19 -2.55 0.00 0.00 0.00 173.10 175.47 2wva h PRO 480 N 2.00 0.00 0.00 2.90 0.11 -1.99 -2.30 132.00 132.72 2wva h PRO 480 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2wva h PRO 480 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2wva h PRO 480 CO 0.34 0.04 0.00 2.48 -0.21 0.00 0.00 178.00 180.65 2wva n TYR 481 N -3.44 0.00 1.21 0.65 0.18 -1.26 -2.32 117.16 112.17 2wva n TYR 481 Ca -0.02 0.00 0.13 0.00 1.88 0.00 0.00 57.90 59.89 2wva n TYR 481 Cb 0.17 -0.25 0.31 0.00 -0.38 0.00 0.00 39.34 39.18 2wva n TYR 481 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 2wva n ASN 482 N -1.25 1.27 -4.83 9.48 3.02 -0.87 -4.89 115.26 117.19 2wva n ASN 482 Ca 0.09 -1.06 -0.37 0.00 -0.03 0.00 0.00 54.58 53.21 2wva n ASN 482 Cb 0.13 0.19 -0.06 0.00 -0.61 0.00 0.00 39.78 39.43 2wva n ASN 482 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2wva s ASN 483 N -2.46 6.86 0.30 6.41 0.01 -0.98 -1.53 114.94 123.54 2wva s ASN 483 Ca 0.24 1.04 0.05 0.00 -0.71 0.00 0.00 52.86 53.48 2wva s ASN 483 Cb 0.19 -2.28 -0.06 0.00 0.41 0.00 0.00 41.25 39.51 2wva s ASN 483 CO 0.52 0.27 0.01 0.27 -1.51 0.00 0.00 177.10 176.65 2wva s ILE 484 N -1.17 1.35 -0.25 0.60 -4.36 -1.26 -4.98 121.20 111.13 2wva s ILE 484 Ca 0.28 -2.05 -0.29 0.00 -0.26 0.00 0.00 60.65 58.33 2wva s ILE 484 Cb -0.17 -2.60 0.01 0.00 1.25 0.00 0.00 42.46 40.95 2wva s ILE 484 CO 0.16 -0.16 1.04 -0.75 0.24 0.00 0.00 174.94 175.47 2wva s LYS 485 N -3.82 4.22 0.36 0.37 2.47 -1.26 -4.90 119.74 117.18 2wva s LYS 485 Ca 0.33 1.29 -0.28 0.00 -1.56 0.00 0.00 55.97 55.75 2wva s LYS 485 Cb 0.07 -3.66 -0.10 0.00 -1.46 0.00 0.00 37.83 32.68 2wva s LYS 485 CO 0.13 -0.68 1.31 1.21 0.16 0.00 0.00 175.35 177.48 2wva s ASN 486 N 1.30 6.58 0.31 1.43 2.47 -1.26 -5.05 114.94 120.72 2wva s ASN 486 Ca 0.44 2.68 0.08 0.00 0.42 0.00 0.00 52.86 56.48 2wva s ASN 486 Cb -0.14 -2.64 -0.04 0.00 -1.45 0.00 0.00 41.25 36.97 2wva s ASN 486 CO 0.08 -0.67 0.13 0.26 -3.72 0.00 0.00 177.10 173.19 2wva s TRP 487 N -1.19 2.78 -1.28 0.43 0.51 -1.26 -5.04 118.94 113.89 2wva s TRP 487 Ca 0.52 -0.30 -0.14 0.00 -2.12 0.00 0.00 56.10 54.06 2wva s TRP 487 Cb -0.39 -1.53 0.12 0.00 -0.81 0.00 0.00 33.47 30.87 2wva s TRP 487 CO 0.51 0.41 1.70 -3.47 -0.51 0.00 0.00 176.95 175.59 2wva n ASP 488 N -1.12 4.96 -0.27 2.95 2.03 -1.26 -4.86 116.55 118.97 2wva n ASP 488 Ca -0.04 -2.97 0.02 0.00 0.52 0.00 0.00 54.79 52.32 2wva n ASP 488 Cb 0.60 -1.62 0.15 0.00 -0.72 0.00 0.00 41.12 39.53 2wva n ASP 488 CO 0.00 0.00 0.00 1.88 -1.92 0.00 0.00 177.20 177.16 2wva h TYR 489 N 6.89 0.80 -0.83 -0.67 0.05 -1.99 -0.41 116.97 120.81 2wva h TYR 489 Ca 0.40 0.03 0.08 0.00 0.05 0.00 0.00 58.73 59.29 2wva h TYR 489 Cb 0.80 -0.24 -0.07 0.00 1.01 0.00 0.00 36.73 38.23 2wva h TYR 489 CO 1.27 0.34 0.49 0.00 -1.05 0.00 0.00 178.16 179.21 2wva h ALA 490 N 1.43 1.16 0.00 3.88 0.00 -1.89 -1.54 119.26 122.31 2wva h ALA 490 Ca 0.37 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2wva h ALA 490 Cb 0.32 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2wva h ALA 490 CO -0.23 0.17 0.00 0.78 0.00 0.00 0.00 179.25 179.96 2wva h GLY 491 N 0.86 0.00 2.00 0.00 0.00 -1.41 -2.62 103.07 101.90 2wva h GLY 491 Ca 0.38 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.70 2wva h GLY 491 CO -0.21 0.00 -0.07 -2.00 0.00 0.00 0.00 176.54 174.26 2wva h LEU 492 N 0.00 0.00 -0.12 3.11 5.85 -0.91 -2.99 115.31 120.25 2wva h LEU 492 Ca 0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 2wva h LEU 492 Cb 0.41 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2wva h LEU 492 CO 0.00 0.07 0.06 0.24 -0.34 0.00 0.00 178.44 178.47 2wva h MET 493 N 0.00 0.16 0.00 1.25 2.86 -1.59 -2.08 114.93 115.54 2wva h MET 493 Ca -0.00 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2wva h MET 493 Cb 0.15 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.77 2wva h MET 493 CO 0.01 0.19 -0.05 0.93 1.06 0.00 0.00 176.91 179.05 2wva h GLU 494 N 0.09 0.00 -0.20 1.72 4.39 -1.73 -0.17 114.58 118.68 2wva h GLU 494 Ca 0.04 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.69 2wva h GLU 494 Cb 0.07 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 2wva h GLU 494 CO -0.01 0.05 -0.07 0.28 -1.16 0.00 0.00 179.01 178.10 2wva h VAL 495 N 0.00 1.30 0.00 3.13 2.07 -1.44 -2.28 116.25 119.02 2wva h VAL 495 Ca -0.00 -1.09 -0.08 0.00 0.82 0.00 0.00 66.70 66.35 2wva h VAL 495 Cb 0.48 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 2wva h VAL 495 CO 0.01 0.33 -0.38 -0.26 0.02 0.00 0.00 177.57 177.28 2wva h PHE 496 N 0.11 0.00 -0.06 1.57 0.04 -0.74 -3.00 116.94 114.86 2wva h PHE 496 Ca 0.05 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 2wva h PHE 496 Cb 0.54 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.69 2wva h PHE 496 CO 0.06 0.38 0.01 -0.91 -0.60 0.00 0.00 178.31 177.25 2wva h ASN 497 N 0.00 0.10 -4.30 2.17 2.35 -1.04 -3.46 115.58 111.40 2wva h ASN 497 Ca -0.00 -0.27 -0.38 0.00 -0.55 0.00 0.00 56.30 55.09 2wva h ASN 497 Cb 0.97 -0.03 0.06 0.00 0.05 0.00 0.00 38.32 39.38 2wva h ASN 497 CO 0.05 0.34 -0.57 0.61 -1.65 0.00 0.00 177.43 176.21 2wva n GLY 498 N -0.37 -0.44 3.73 2.83 0.00 -0.86 -2.97 105.19 107.11 2wva n GLY 498 Ca -0.07 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2wva n GLY 498 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wva s ASN 499 N -2.77 6.51 0.00 1.61 0.01 -1.26 -1.14 114.94 117.90 2wva s ASN 499 Ca 0.30 2.76 0.00 0.00 -0.71 0.00 0.00 52.86 55.22 2wva s ASN 499 Cb -0.13 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 38.91 2wva s ASN 499 CO 0.38 -0.84 0.00 0.61 -1.51 0.00 0.00 177.10 175.74 2wva n GLY 500 N 2.91 0.74 0.00 0.66 0.00 -1.26 -5.04 105.19 103.20 2wva n GLY 500 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2wva n GLY 500 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wva n GLY 501 N -2.12 2.45 0.33 -0.02 0.00 -0.29 -5.02 105.19 100.52 2wva n GLY 501 Ca 0.00 -1.88 -0.05 0.00 0.00 0.00 0.00 46.02 44.10 2wva n GLY 501 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2wva h TYR 502 N 0.00 1.10 -0.13 1.61 0.05 -1.97 -3.45 116.97 114.17 2wva h TYR 502 Ca 0.00 -0.09 0.00 0.00 0.05 0.00 0.00 58.73 58.69 2wva h TYR 502 Cb 0.00 -0.33 0.00 0.00 1.01 0.00 0.00 36.73 37.41 2wva h TYR 502 CO 0.00 0.85 0.00 -0.40 -1.05 0.00 0.00 178.16 177.56 2wva n ASP 503 N -4.28 0.00 -3.21 3.88 5.68 -1.26 -5.19 116.55 112.17 2wva n ASP 503 Ca 0.06 0.00 -0.08 0.00 -0.50 0.00 0.00 54.79 54.27 2wva n ASP 503 Cb 0.20 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.19 2wva n ASP 503 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 2wva s SER 504 N 1.00 -0.06 0.18 -1.12 1.04 -1.26 -4.31 113.70 109.17 2wva s SER 504 Ca 0.00 -1.00 -0.23 0.00 0.48 0.00 0.00 55.95 55.21 2wva s SER 504 Cb 0.00 0.81 0.06 0.00 0.10 0.00 0.00 66.02 66.99 2wva s SER 504 CO 0.00 -1.58 0.63 -0.83 0.98 0.00 0.00 173.24 172.43 2wva s GLY 505 N -3.03 -0.52 -0.13 7.32 0.00 -1.16 -4.90 107.32 104.90 2wva s GLY 505 Ca 0.14 0.36 0.17 0.00 0.00 0.00 0.00 44.72 45.39 2wva s GLY 505 CO 0.10 0.12 1.20 0.00 0.00 0.00 0.00 173.10 174.52 2wva n ALA 506 N -0.39 3.18 -1.71 3.20 0.00 -1.26 -4.91 120.51 118.62 2wva n ALA 506 Ca -0.15 -2.94 -0.31 0.00 0.00 0.00 0.00 53.44 50.04 2wva n ALA 506 Cb 0.64 -0.51 0.02 0.00 0.00 0.00 0.00 19.45 19.61 2wva n ALA 506 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2wva s GLY 507 N -2.78 1.76 -0.00 0.00 0.00 -1.26 -3.73 107.32 101.30 2wva s GLY 507 Ca 0.37 0.07 0.04 0.00 0.00 0.00 0.00 44.72 45.20 2wva s GLY 507 CO -0.11 0.37 -0.12 0.54 0.00 0.00 0.00 173.10 173.78 2wva s LYS 508 N -4.88 0.97 -0.12 2.90 1.02 -0.61 -4.84 119.74 114.19 2wva s LYS 508 Ca 0.58 -0.47 0.03 0.00 0.02 0.00 0.00 55.97 56.13 2wva s LYS 508 Cb -0.13 -0.94 0.00 0.00 -0.52 0.00 0.00 37.83 36.25 2wva s LYS 508 CO 0.50 0.26 -0.23 0.20 -0.92 0.00 0.00 175.35 175.16 2wva s GLY 509 N -0.38 1.33 0.08 -3.33 0.00 -1.26 -0.36 107.32 103.41 2wva s GLY 509 Ca 0.04 -1.02 0.03 0.00 0.00 0.00 0.00 44.72 43.78 2wva s GLY 509 CO -0.00 -0.18 -0.09 1.08 0.00 0.00 0.00 173.10 173.90 2wva s LEU 510 N 0.56 2.38 0.01 0.66 1.43 0.02 -4.86 118.68 118.89 2wva s LEU 510 Ca -0.13 -0.78 0.04 0.00 -1.03 0.00 0.00 54.13 52.23 2wva s LEU 510 Cb -0.17 -0.24 -0.03 0.00 0.03 0.00 0.00 46.19 45.78 2wva s LEU 510 CO 0.04 -0.27 -0.10 -0.54 0.23 0.00 0.00 176.35 175.70 2wva s LYS 511 N -2.64 2.42 -0.16 1.70 1.02 -1.26 0.14 119.74 120.96 2wva s LYS 511 Ca 0.03 -0.79 -0.02 0.00 0.02 0.00 0.00 55.97 55.21 2wva s LYS 511 Cb -0.03 -2.41 0.05 0.00 -0.52 0.00 0.00 37.83 34.91 2wva s LYS 511 CO -0.01 0.59 0.00 0.00 -0.92 0.00 0.00 175.35 175.01 2wva s ALA 512 N -0.96 1.11 -0.47 5.17 0.00 0.34 -4.78 121.76 122.16 2wva s ALA 512 Ca 0.16 -0.63 0.05 0.00 0.00 0.00 0.00 51.96 51.54 2wva s ALA 512 Cb -0.11 -1.08 0.01 0.00 0.00 0.00 0.00 23.12 21.94 2wva s ALA 512 CO 0.07 -0.91 0.48 1.63 0.00 0.00 0.00 175.76 177.02 2wva n LYS 513 N 5.01 1.97 -3.99 0.00 5.02 -1.26 -1.74 118.16 123.17 2wva n LYS 513 Ca -0.09 -0.49 -0.09 0.00 -2.02 0.00 0.00 58.31 55.62 2wva n LYS 513 Cb 0.48 -0.95 -0.08 0.00 -0.02 0.00 0.00 35.03 34.46 2wva n LYS 513 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2wva s THR 514 N -0.81 0.13 0.29 -0.18 -4.23 -1.26 -0.89 115.64 108.68 2wva s THR 514 Ca 0.04 -1.50 0.02 0.00 -1.18 0.00 0.00 61.69 59.07 2wva s THR 514 Cb 0.04 -1.64 0.29 0.00 1.34 0.00 0.00 72.50 72.53 2wva s THR 514 CO 0.11 -0.59 1.84 1.23 -0.54 0.00 0.00 174.62 176.67 2wva h GLY 515 N 2.80 1.61 1.07 3.99 0.00 -1.58 -1.31 103.07 109.65 2wva h GLY 515 Ca -0.34 -0.42 -0.09 0.00 0.00 0.00 0.00 47.33 46.48 2wva h GLY 515 CO 0.57 0.17 0.01 -1.33 0.00 0.00 0.00 176.54 175.96 2wva h GLY 516 N 0.99 1.12 1.29 4.60 0.00 -0.83 -0.96 103.07 109.28 2wva h GLY 516 Ca 0.49 -0.81 -0.10 0.00 0.00 0.00 0.00 47.33 46.91 2wva h GLY 516 CO -0.25 0.75 -0.09 0.83 0.00 0.00 0.00 176.54 177.78 2wva h GLU 517 N 0.93 0.85 -0.23 4.80 5.08 -1.61 -2.27 114.58 122.13 2wva h GLU 517 Ca 0.17 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 2wva h GLU 517 Cb 0.54 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2wva h GLU 517 CO 0.03 0.90 0.07 1.25 -1.00 0.00 0.00 179.01 180.27 2wva h LEU 518 N 0.77 0.33 -0.63 1.33 5.85 -1.01 -0.11 115.31 121.84 2wva h LEU 518 Ca 0.13 -0.20 0.03 0.00 0.84 0.00 0.00 57.88 58.68 2wva h LEU 518 Cb 0.59 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 2wva h LEU 518 CO 0.04 0.44 0.38 0.00 -0.34 0.00 0.00 178.44 178.96 2wva h ALA 519 N 0.90 0.81 -0.57 1.25 0.00 -1.07 0.75 119.26 121.34 2wva h ALA 519 Ca 0.07 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 2wva h ALA 519 Cb 0.22 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2wva h ALA 519 CO -0.00 0.12 -0.06 0.93 0.00 0.00 0.00 179.25 180.23 2wva h GLU 520 N 0.75 1.06 -0.54 0.00 4.39 -1.32 -2.54 114.58 116.38 2wva h GLU 520 Ca 0.25 -0.37 0.00 0.00 0.34 0.00 0.00 59.36 59.59 2wva h GLU 520 Cb 0.04 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.58 2wva h GLU 520 CO -0.11 1.07 0.34 0.00 -1.16 0.00 0.00 179.01 179.14 2wva h ALA 521 N 0.95 0.68 -0.78 3.43 0.00 -0.33 -2.42 119.26 120.80 2wva h ALA 521 Ca 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2wva h ALA 521 Cb 0.63 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 2wva h ALA 521 CO 0.04 0.15 0.49 0.82 0.00 0.00 0.00 179.25 180.76 2wva h ILE 522 N 0.73 1.21 -0.21 0.00 2.04 -0.72 -0.50 117.51 120.05 2wva h ILE 522 Ca 0.19 -0.41 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 2wva h ILE 522 Cb -0.04 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.11 2wva h ILE 522 CO -0.04 0.21 0.13 0.11 0.00 0.00 0.00 178.15 178.56 2wva h LYS 523 N 1.06 0.28 -0.76 2.37 1.57 -1.04 -1.79 116.57 118.26 2wva h LYS 523 Ca 0.28 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 59.05 2wva h LYS 523 Cb -0.09 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.12 2wva h LYS 523 CO -0.06 0.22 0.50 0.28 -0.57 0.00 0.00 179.45 179.83 2wva h VAL 524 N 0.26 1.20 -0.46 0.50 2.07 -0.95 -2.19 116.25 116.68 2wva h VAL 524 Ca 0.08 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.19 2wva h VAL 524 Cb 0.01 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.84 2wva h VAL 524 CO -0.01 0.19 0.10 0.00 0.02 0.00 0.00 177.57 177.87 2wva h ALA 525 N 1.53 0.61 -0.07 1.67 0.00 -0.75 -2.26 119.26 119.99 2wva h ALA 525 Ca 0.28 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 2wva h ALA 525 Cb -0.12 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2wva h ALA 525 CO -0.06 0.30 -0.39 -0.07 0.00 0.00 0.00 179.25 179.03 2wva h LEU 526 N 0.61 0.15 0.00 0.00 3.38 -1.04 -2.48 115.31 115.93 2wva h LEU 526 Ca 0.14 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2wva h LEU 526 Cb 0.34 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2wva h LEU 526 CO 0.00 0.53 -0.04 0.00 0.09 0.00 0.00 178.44 179.02 2wva n ALA 527 N -2.47 2.36 -2.92 1.53 0.00 -0.85 -4.63 120.51 113.53 2wva n ALA 527 Ca -0.02 -0.07 -0.44 0.00 0.00 0.00 0.00 53.44 52.92 2wva n ALA 527 Cb 0.45 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.42 2wva n ALA 527 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2wva s ASN 528 N -3.89 6.43 0.00 0.00 2.47 -0.87 -4.84 114.94 114.24 2wva s ASN 528 Ca 0.12 -1.62 0.24 0.00 0.42 0.00 0.00 52.86 52.02 2wva s ASN 528 Cb 0.15 -2.40 0.47 0.00 -1.45 0.00 0.00 41.25 38.03 2wva s ASN 528 CO 0.58 -1.20 1.42 0.35 -3.72 0.00 0.00 177.10 174.53 2wva n THR 529 N 5.65 0.18 0.72 -5.21 -2.24 -1.26 -4.30 114.28 107.82 2wva n THR 529 Ca 0.11 -0.52 0.08 0.00 -2.27 0.00 0.00 64.05 61.45 2wva n THR 529 Cb 0.47 1.03 -0.05 0.00 -2.10 0.00 0.00 70.33 69.69 2wva n THR 529 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2wva n ASP 530 N 1.07 1.17 -3.64 3.42 8.00 -1.26 -4.63 116.55 120.68 2wva n ASP 530 Ca 0.17 -1.08 0.01 0.00 0.71 0.00 0.00 54.79 54.59 2wva n ASP 530 Cb 0.53 0.74 -0.00 0.00 -0.02 0.00 0.00 41.12 42.36 2wva n ASP 530 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2wva s GLY 531 N -2.18 -0.37 0.71 0.44 0.00 -1.24 -4.34 107.32 100.33 2wva s GLY 531 Ca 0.10 0.57 -0.14 0.00 0.00 0.00 0.00 44.72 45.25 2wva s GLY 531 CO 0.52 0.36 1.12 2.56 0.00 0.00 0.00 173.10 177.66 2wva s PRO 532 N -2.52 2.47 -0.16 2.90 0.04 -0.13 -4.20 135.00 133.41 2wva s PRO 532 Ca 0.15 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.61 2wva s PRO 532 Cb 0.04 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.70 2wva s PRO 532 CO -0.03 -1.51 -0.14 0.99 0.04 0.00 0.00 177.00 176.36 2wva s THR 533 N -2.41 1.58 -0.27 1.26 2.01 -0.23 -1.57 115.64 116.02 2wva s THR 533 Ca 0.67 -0.69 -0.12 0.00 0.31 0.00 0.00 61.69 61.86 2wva s THR 533 Cb -0.21 -1.51 -0.05 0.00 0.01 0.00 0.00 72.50 70.74 2wva s THR 533 CO 0.46 0.42 0.23 -0.22 -0.69 0.00 0.00 174.62 174.82 2wva s LEU 534 N 1.47 4.05 -0.39 4.42 0.20 0.52 -0.42 118.68 128.53 2wva s LEU 534 Ca 0.04 0.10 -0.08 0.00 0.69 0.00 0.00 54.13 54.89 2wva s LEU 534 Cb -0.13 -2.20 0.07 0.00 -0.43 0.00 0.00 46.19 43.49 2wva s LEU 534 CO -0.10 -0.06 0.21 -0.63 -0.29 0.00 0.00 176.35 175.47 2wva s ILE 535 N 1.67 4.00 -0.52 6.68 1.01 0.87 -0.80 121.20 134.12 2wva s ILE 535 Ca 0.09 -1.37 -0.28 0.00 0.00 0.00 0.00 60.65 59.09 2wva s ILE 535 Cb -0.15 -3.42 0.03 0.00 0.01 0.00 0.00 42.46 38.93 2wva s ILE 535 CO 0.09 -0.42 1.13 -0.70 0.00 0.00 0.00 174.94 175.04 2wva s GLU 536 N 1.39 3.61 -0.22 2.79 2.12 0.12 -1.76 118.70 126.76 2wva s GLU 536 Ca 0.02 0.38 -0.11 0.00 0.36 0.00 0.00 54.97 55.62 2wva s GLU 536 Cb -0.22 -3.95 -0.05 0.00 0.26 0.00 0.00 34.13 30.17 2wva s GLU 536 CO 0.02 -1.48 0.16 0.00 -0.54 0.00 0.00 175.26 173.42 2wva s PHE 538 N 0.77 3.21 0.11 0.00 0.40 -0.71 0.21 117.98 121.97 2wva s PHE 538 Ca 0.08 -0.16 -0.01 0.00 -0.60 0.00 0.00 56.93 56.24 2wva s PHE 538 Cb -0.13 -2.41 -0.04 0.00 0.51 0.00 0.00 43.02 40.95 2wva s PHE 538 CO 0.02 -0.30 0.04 0.96 0.70 0.00 0.00 175.22 176.63 2wva s ILE 539 N 1.71 0.14 0.72 0.64 -4.36 -1.08 -4.57 121.20 114.41 2wva s ILE 539 Ca 0.06 -1.89 -0.12 0.00 -0.26 0.00 0.00 60.65 58.44 2wva s ILE 539 Cb -0.17 -1.93 0.03 0.00 1.25 0.00 0.00 42.46 41.64 2wva s ILE 539 CO 0.10 -0.58 1.08 -0.83 0.24 0.00 0.00 174.94 174.95 2wva s GLY 540 N -3.02 1.80 0.15 6.27 0.00 -1.26 -3.97 107.32 107.29 2wva s GLY 540 Ca 0.20 0.29 -0.15 0.00 0.00 0.00 0.00 44.72 45.06 2wva s GLY 540 CO -0.01 0.62 1.76 -0.09 0.00 0.00 0.00 173.10 175.39 2wva h ARG 541 N -0.69 0.66 0.00 2.90 2.43 -1.94 -2.69 114.38 115.05 2wva h ARG 541 Ca -0.44 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 2wva h ARG 541 Cb 1.23 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 2wva h ARG 541 CO 0.54 0.52 0.00 0.39 -1.51 0.00 0.00 179.97 179.91 2wva n GLU 542 N -4.67 0.14 -2.68 0.20 4.71 -1.26 -4.45 120.64 112.63 2wva n GLU 542 Ca 0.02 0.28 -0.43 0.00 -0.01 0.00 0.00 57.16 57.01 2wva n GLU 542 Cb 0.08 -1.72 -0.01 0.00 -1.01 0.00 0.00 31.44 28.79 2wva n GLU 542 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2wva s ASP 543 N -3.84 6.82 0.35 1.62 2.15 -1.02 -4.91 116.67 117.84 2wva s ASP 543 Ca 0.08 -2.38 0.04 0.00 0.43 0.00 0.00 52.55 50.71 2wva s ASP 543 Cb 0.11 -2.53 -0.04 0.00 -0.30 0.00 0.00 42.92 40.17 2wva s ASP 543 CO 0.43 -1.12 0.12 0.00 -0.17 0.00 0.00 175.17 174.43 2wva s THR 545 N -3.37 2.54 0.34 0.00 -4.23 -1.26 -4.92 115.64 104.74 2wva s THR 545 Ca 0.30 0.30 0.04 0.00 -1.18 0.00 0.00 61.69 61.16 2wva s THR 545 Cb 0.05 -3.00 0.18 0.00 1.34 0.00 0.00 72.50 71.06 2wva s THR 545 CO 0.16 -0.10 1.90 -0.33 -0.54 0.00 0.00 174.62 175.70 2wva h GLU 546 N 0.41 0.58 -0.51 3.99 5.08 -2.00 -3.11 114.58 119.02 2wva h GLU 546 Ca -0.49 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 57.75 2wva h GLU 546 Cb 1.30 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 2wva h GLU 546 CO 0.53 0.55 0.26 0.93 -1.00 0.00 0.00 179.01 180.28 2wva h GLU 547 N 0.57 0.73 -0.60 2.33 3.07 -1.96 -2.10 114.58 116.62 2wva h GLU 547 Ca 0.13 -0.10 0.03 0.00 -0.50 0.00 0.00 59.36 58.92 2wva h GLU 547 Cb 0.25 -0.14 -0.04 0.00 -0.84 0.00 0.00 28.75 27.98 2wva h GLU 547 CO -0.00 0.59 0.36 1.25 -1.40 0.00 0.00 179.01 179.82 2wva h LEU 548 N 0.68 0.59 -0.10 1.33 5.85 -1.93 0.12 115.31 121.85 2wva h LEU 548 Ca 0.18 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2wva h LEU 548 Cb 0.09 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 40.99 2wva h LEU 548 CO -0.02 0.41 0.05 0.58 -0.34 0.00 0.00 178.44 179.12 2wva h VAL 549 N 0.72 1.10 0.13 1.05 2.07 -1.51 0.42 116.25 120.23 2wva h VAL 549 Ca 0.24 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 2wva h VAL 549 Cb 0.02 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 2wva h VAL 549 CO -0.10 0.09 -0.06 0.11 0.02 0.00 0.00 177.57 177.63 2wva h LYS 550 N 0.06 -0.17 -0.59 1.57 1.57 -1.15 -2.91 116.57 114.96 2wva h LYS 550 Ca 0.04 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 2wva h LYS 550 Cb 0.10 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 2wva h LYS 550 CO -0.01 -0.06 0.31 2.35 -0.57 0.00 0.00 179.45 181.47 2wva h TRP 551 N -0.23 0.82 -0.84 -1.35 7.01 -0.70 -2.99 115.95 117.68 2wva h TRP 551 Ca -0.02 -0.03 0.11 0.00 2.11 0.00 0.00 58.89 61.06 2wva h TRP 551 Cb 0.18 -0.26 -0.08 0.00 -2.10 0.00 0.00 29.16 26.90 2wva h TRP 551 CO -0.05 0.61 0.47 0.78 -2.79 0.00 0.00 178.44 177.46 2wva h GLY 552 N 0.80 1.32 1.05 2.65 0.00 -0.14 -1.62 103.07 107.13 2wva h GLY 552 Ca 0.20 -0.30 -0.05 0.00 0.00 0.00 0.00 47.33 47.18 2wva h GLY 552 CO -0.03 0.09 0.27 0.50 0.00 0.00 0.00 176.54 177.37 2wva h LYS 553 N 0.76 1.17 -0.33 4.80 1.57 -1.36 -1.32 116.57 121.85 2wva h LYS 553 Ca 0.42 -0.23 -0.09 0.00 -1.87 0.00 0.00 60.65 58.88 2wva h LYS 553 Cb 0.45 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2wva h LYS 553 CO -0.28 0.97 -0.15 0.00 -0.57 0.00 0.00 179.45 179.43 2wva h ARG 554 N 1.13 0.69 -0.05 3.15 2.47 -1.42 -2.11 114.38 118.24 2wva h ARG 554 Ca 0.25 -0.29 0.01 0.00 -1.26 0.00 0.00 59.98 58.68 2wva h ARG 554 Cb 0.27 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.56 2wva h ARG 554 CO -0.01 0.89 0.00 0.28 0.56 0.00 0.00 179.97 181.69 2wva h VAL 555 N 0.46 0.97 -0.75 2.04 2.07 -1.16 -0.89 116.25 118.99 2wva h VAL 555 Ca 0.08 -0.01 0.08 0.00 0.82 0.00 0.00 66.70 67.67 2wva h VAL 555 Cb 0.68 0.95 -0.07 0.00 -1.52 0.00 0.00 31.29 31.33 2wva h VAL 555 CO 0.05 0.00 0.41 0.00 0.02 0.00 0.00 177.57 178.05 2wva h ALA 556 N 1.04 1.04 -0.35 1.67 0.00 -1.20 -0.42 119.26 121.02 2wva h ALA 556 Ca 0.02 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2wva h ALA 556 Cb 0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2wva h ALA 556 CO -0.04 0.06 0.17 0.00 0.00 0.00 0.00 179.25 179.45 2wva h ALA 557 N 1.41 0.46 -0.46 0.00 0.00 -1.06 -1.65 119.26 117.96 2wva h ALA 557 Ca 0.35 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.18 2wva h ALA 557 Cb 0.29 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2wva h ALA 557 CO -0.23 0.01 0.29 0.00 0.00 0.00 0.00 179.25 179.32 2wva h ALA 558 N 1.03 0.58 -0.55 0.00 0.00 -0.70 -2.16 119.26 117.46 2wva h ALA 558 Ca 0.12 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2wva h ALA 558 Cb 0.11 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2wva h ALA 558 CO -0.02 -0.01 0.27 -0.91 0.00 0.00 0.00 179.25 178.59 2wva h ASN 559 N 0.58 0.69 -0.01 0.00 -0.26 -0.79 -3.15 115.58 112.63 2wva h ASN 559 Ca 0.18 -0.06 0.00 0.00 -0.56 0.00 0.00 56.30 55.86 2wva h ASN 559 Cb -0.02 -0.18 0.00 0.00 -1.06 0.00 0.00 38.32 37.06 2wva h ASN 559 CO -0.06 0.59 -0.13 -1.54 -1.06 0.00 0.00 177.43 175.22 2wva n SER 560 N -4.37 2.52 -4.68 5.81 3.41 -0.64 -4.98 113.62 110.69 2wva n SER 560 Ca 0.05 -1.78 -0.45 0.00 -0.26 0.00 0.00 58.87 56.43 2wva n SER 560 Cb 0.12 0.13 -0.03 0.00 -0.26 0.00 0.00 64.21 64.17 2wva n SER 560 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2wva n ARG 561 N 0.80 2.24 -0.67 4.33 1.85 -0.83 -4.90 116.66 119.48 2wva n ARG 561 Ca 0.13 0.80 -0.31 0.00 -1.00 0.00 0.00 57.85 57.47 2wva n ARG 561 Cb 0.53 -2.54 0.17 0.00 -1.05 0.00 0.00 32.46 29.57 2wva n ARG 561 CO 0.00 0.00 0.00 0.36 -0.01 0.00 0.00 177.63 177.98 2wva n LYS 562 N 2.87 -0.60 -2.16 2.89 2.85 -1.26 -4.92 118.16 117.83 2wva n LYS 562 Ca 0.14 -0.11 -0.41 0.00 -1.05 0.00 0.00 58.31 56.88 2wva n LYS 562 Cb 0.31 -2.31 -0.03 0.00 -0.65 0.00 0.00 35.03 32.35 2wva n LYS 562 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 177.40 175.21 2wva s PRO 563 N -4.52 4.35 0.58 -1.58 0.02 -1.26 -5.01 135.00 127.58 2wva s PRO 563 Ca 0.66 2.13 -0.17 0.00 0.02 0.00 0.00 61.00 63.64 2wva s PRO 563 Cb -0.23 -3.17 -0.04 0.00 0.02 0.00 0.00 34.50 31.08 2wva s PRO 563 CO 0.59 -0.30 1.06 0.08 -0.33 0.00 0.00 177.00 178.11 2wva s VAL 564 N 0.06 3.75 -0.10 3.83 1.01 -1.26 -5.00 120.40 122.69 2wva s VAL 564 Ca 0.57 0.88 -0.26 0.00 0.00 0.00 0.00 61.98 63.17 2wva s VAL 564 Cb -0.38 -3.38 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 2wva s VAL 564 CO 0.40 -0.44 0.84 0.21 0.00 0.00 0.00 175.10 176.11 2wva s ASN 565 N -2.60 7.08 0.00 3.32 2.47 -1.26 -5.32 114.94 118.63 2wva s ASN 565 Ca 0.65 1.31 0.00 0.00 0.42 0.00 0.00 52.86 55.24 2wva s ASN 565 Cb -0.17 -2.48 0.00 0.00 -1.45 0.00 0.00 41.25 37.16 2wva s ASN 565 CO 0.34 -0.29 0.00 2.29 -3.72 0.00 0.00 177.10 175.72