#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 2.96 0.37 7.33 1.51 -1.26 -5.05 117.35 123.21 2wva s TYR 3 Ca 0.00 -0.07 0.08 0.00 -1.01 0.00 0.00 57.07 56.07 2wva s TYR 3 Cb 0.00 -1.48 -0.04 0.00 -0.11 0.00 0.00 41.96 40.33 2wva s TYR 3 CO 0.00 0.50 0.22 0.95 -1.11 0.00 0.00 175.55 176.10 2wva s THR 4 N -1.50 2.82 0.24 -0.71 -4.23 -1.26 -1.91 115.64 109.08 2wva s THR 4 Ca 0.27 -1.58 -0.06 0.00 -1.18 0.00 0.00 61.69 59.13 2wva s THR 4 Cb -0.11 -3.01 0.24 0.00 1.34 0.00 0.00 72.50 70.96 2wva s THR 4 CO 0.19 -0.10 1.67 0.58 -0.54 0.00 0.00 174.62 176.42 2wva h VAL 5 N 1.37 0.46 -0.50 2.29 2.07 -1.31 0.24 116.25 120.87 2wva h VAL 5 Ca -0.43 -0.07 -0.08 0.00 0.82 0.00 0.00 66.70 66.95 2wva h VAL 5 Cb 1.26 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 2wva h VAL 5 CO 0.63 0.03 0.01 1.23 0.02 0.00 0.00 177.57 179.50 2wva h GLY 6 N 0.19 0.94 2.00 2.17 0.00 -1.54 -2.56 103.07 104.27 2wva h GLY 6 Ca 0.40 -0.68 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 2wva h GLY 6 CO -0.56 0.63 -0.32 -0.91 0.00 0.00 0.00 176.54 175.39 2wva h THR 7 N 0.73 0.58 0.03 4.70 1.35 -1.57 -1.58 112.91 117.17 2wva h THR 7 Ca 0.14 -1.66 -0.00 0.00 -0.55 0.00 0.00 66.41 64.34 2wva h THR 7 Cb 0.50 2.16 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 2wva h THR 7 CO 0.02 0.31 -0.02 0.22 -0.25 0.00 0.00 175.52 175.81 2wva h TYR 8 N 0.00 -0.04 -0.47 4.73 5.03 -0.49 -1.45 116.97 124.28 2wva h TYR 8 Ca -0.00 -0.00 0.07 0.00 2.58 0.00 0.00 58.73 61.37 2wva h TYR 8 Cb 1.14 0.01 -0.06 0.00 1.55 0.00 0.00 36.73 39.37 2wva h TYR 8 CO 0.00 0.21 0.15 1.25 -1.32 0.00 0.00 178.16 178.44 2wva h LEU 9 N -0.29 0.12 -0.95 2.82 5.85 -1.38 -1.89 115.31 119.60 2wva h LEU 9 Ca -0.00 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.81 2wva h LEU 9 Cb 0.27 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.30 2wva h LEU 9 CO 0.01 0.10 0.62 0.00 -0.34 0.00 0.00 178.44 178.82 2wva h ALA 10 N 1.33 1.25 -0.26 1.25 0.00 -1.15 -1.47 119.26 120.21 2wva h ALA 10 Ca 0.23 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 2wva h ALA 10 Cb 0.26 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2wva h ALA 10 CO -0.25 0.49 -0.05 1.49 0.00 0.00 0.00 179.25 180.93 2wva h GLU 11 N 1.20 0.50 -0.86 0.00 4.57 -0.97 -1.74 114.58 117.26 2wva h GLU 11 Ca 0.38 -0.18 0.07 0.00 -1.18 0.00 0.00 59.36 58.44 2wva h GLU 11 Cb 0.00 -0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 28.49 2wva h GLU 11 CO -0.12 0.70 0.53 0.00 -1.18 0.00 0.00 179.01 178.94 2wva h ARG 12 N 0.25 0.91 -0.62 1.92 2.47 -1.07 0.15 114.38 118.38 2wva h ARG 12 Ca 0.07 -0.05 -0.10 0.00 -1.26 0.00 0.00 59.98 58.64 2wva h ARG 12 Cb 0.51 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 28.61 2wva h ARG 12 CO 0.02 0.60 0.01 -0.07 0.56 0.00 0.00 179.97 181.10 2wva h LEU 13 N 0.94 1.06 -0.65 3.04 3.38 -1.12 -2.55 115.31 119.42 2wva h LEU 13 Ca 0.39 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2wva h LEU 13 Cb 0.23 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 2wva h LEU 13 CO -0.19 1.10 0.20 0.58 0.09 0.00 0.00 178.44 180.22 2wva h VAL 14 N 1.00 1.25 0.00 1.22 2.07 -0.66 -2.36 116.25 118.77 2wva h VAL 14 Ca 0.18 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 2wva h VAL 14 Cb 0.55 0.59 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 2wva h VAL 14 CO 0.03 0.33 -0.04 1.56 0.02 0.00 0.00 177.57 179.47 2wva h GLN 15 N 0.93 0.00 -0.19 1.57 4.20 -0.37 -1.46 115.11 119.79 2wva h GLN 15 Ca 0.21 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.92 2wva h GLN 15 Cb 0.30 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.08 2wva h GLN 15 CO -0.01 0.04 0.00 0.44 -0.67 0.00 0.00 178.83 178.64 2wva n ILE 16 N -3.94 0.24 0.00 2.54 -5.35 -0.99 -4.91 119.36 106.94 2wva n ILE 16 Ca -0.03 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.95 2wva n ILE 16 Cb 0.13 0.83 0.00 0.00 -1.74 0.00 0.00 39.64 38.86 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 1.31 0.94 3.73 3.28 0.00 -0.55 -4.87 105.19 109.03 2wva n GLY 17 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 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 4.39 0.00 0.99 1.02 -0.91 -4.88 118.68 119.30 2wva s LEU 18 Ca 0.00 2.35 0.12 0.00 0.02 0.00 0.00 54.13 56.62 2wva s LEU 18 Cb 0.00 -3.60 -0.04 0.00 0.02 0.00 0.00 46.19 42.57 2wva s LEU 18 CO 0.00 -0.58 0.66 0.29 0.02 0.00 0.00 176.35 176.75 2wva n LYS 19 N 3.26 2.24 -3.90 1.70 4.76 -1.26 -4.50 118.16 120.46 2wva n LYS 19 Ca 0.09 -0.49 -0.09 0.00 -2.87 0.00 0.00 58.31 54.95 2wva n LYS 19 Cb 0.43 -1.14 -0.08 0.00 -1.84 0.00 0.00 35.03 32.40 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 -1.76 0.20 0.05 2.13 3.76 -1.26 -0.95 115.29 117.46 2wva s HIS 20 Ca 0.09 -0.60 0.00 0.00 -0.15 0.00 0.00 55.06 54.40 2wva s HIS 20 Cb 0.10 -0.12 -0.03 0.00 1.11 0.00 0.00 32.58 33.64 2wva s HIS 20 CO 0.37 -0.47 -0.04 -3.38 -0.85 0.00 0.00 174.74 170.37 2wva s HIS 21 N -3.45 0.52 0.05 1.40 -3.43 -0.57 -4.64 115.29 105.18 2wva s HIS 21 Ca 0.02 -0.77 0.03 0.00 -0.80 0.00 0.00 55.06 53.54 2wva s HIS 21 Cb 0.03 -0.35 -0.04 0.00 -1.43 0.00 0.00 32.58 30.80 2wva s HIS 21 CO -0.09 -0.23 -0.01 -0.06 -2.00 0.00 0.00 174.74 172.36 2wva s PHE 22 N -2.64 3.00 -0.01 0.38 0.40 -0.08 -0.47 117.98 118.58 2wva s PHE 22 Ca -0.03 0.01 -0.21 0.00 -0.60 0.00 0.00 56.93 56.11 2wva s PHE 22 Cb -0.01 -1.59 0.04 0.00 0.51 0.00 0.00 43.02 41.96 2wva s PHE 22 CO -0.04 0.46 0.45 0.00 0.70 0.00 0.00 175.22 176.78 2wva s ALA 23 N -1.19 -1.14 -0.10 5.36 0.00 0.40 0.67 121.76 125.76 2wva s ALA 23 Ca 0.22 0.61 -0.00 0.00 0.00 0.00 0.00 51.96 52.79 2wva s ALA 23 Cb -0.12 0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.17 2wva s ALA 23 CO 0.14 -0.35 -0.07 0.08 0.00 0.00 0.00 175.76 175.56 2wva s VAL 24 N -1.63 0.92 0.56 0.00 1.01 -0.63 -1.51 120.40 119.12 2wva s VAL 24 Ca -0.10 -0.24 -0.20 0.00 0.00 0.00 0.00 61.98 61.44 2wva s VAL 24 Cb -0.02 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 2wva s VAL 24 CO 0.04 0.35 1.23 0.00 0.00 0.00 0.00 175.10 176.72 2wva s ALA 25 N 1.63 2.67 -0.02 5.51 0.00 -1.26 -4.14 121.76 126.16 2wva s ALA 25 Ca 0.03 1.07 -0.30 0.00 0.00 0.00 0.00 51.96 52.76 2wva s ALA 25 Cb -0.13 -3.47 0.07 0.00 0.00 0.00 0.00 23.12 19.60 2wva s ALA 25 CO -0.07 -1.12 0.67 0.20 0.00 0.00 0.00 175.76 175.44 2wva s GLY 26 N -1.41 -0.58 0.59 0.00 0.00 -1.26 -4.84 107.32 99.81 2wva s GLY 26 Ca 0.74 1.19 0.29 0.00 0.00 0.00 0.00 44.72 46.93 2wva s GLY 26 CO 0.36 0.83 2.02 1.29 0.00 0.00 0.00 173.10 177.60 2wva h ASP 27 N 2.83 0.00 0.79 1.64 2.03 -2.00 0.37 116.42 122.07 2wva h ASP 27 Ca -0.28 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.02 2wva h ASP 27 Cb 1.17 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.67 2wva h ASP 27 CO 0.39 0.00 0.00 -1.22 -1.03 0.00 0.00 179.24 177.38 2wva n TYR 28 N -3.77 0.00 -0.31 4.15 4.01 -1.26 -3.70 117.16 116.28 2wva n TYR 28 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 2wva n TYR 28 Cb 0.45 -0.49 0.00 0.00 -0.31 0.00 0.00 39.34 38.99 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 -1.49 0.84 -0.07 7.72 0.23 0.12 -3.66 115.26 118.96 2wva n ASN 29 Ca 0.06 -1.15 -0.08 0.00 -0.53 0.00 0.00 54.58 52.88 2wva n ASN 29 Cb 0.27 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 37.96 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 0.14 -0.57 -4.53 3.38 -1.47 0.21 115.31 112.47 2wva h LEU 30 Ca 0.00 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 2wva h LEU 30 Cb 0.26 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2wva h LEU 30 CO 0.00 0.12 0.10 0.58 0.09 0.00 0.00 178.44 179.33 2wva h VAL 31 N 0.25 1.25 -0.51 1.22 2.07 -1.88 -1.34 116.25 117.31 2wva h VAL 31 Ca 0.12 -0.96 0.07 0.00 0.82 0.00 0.00 66.70 66.75 2wva h VAL 31 Cb 0.07 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 2wva h VAL 31 CO -0.11 0.35 0.17 0.25 0.02 0.00 0.00 177.57 178.26 2wva h LEU 32 N 0.84 0.17 -1.02 2.57 5.85 -1.69 -1.50 115.31 120.54 2wva h LEU 32 Ca 0.17 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 2wva h LEU 32 Cb 0.40 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 2wva h LEU 32 CO 0.01 0.12 0.49 -0.07 -0.34 0.00 0.00 178.44 178.65 2wva h LEU 33 N 0.35 1.04 -0.52 2.25 3.38 -0.17 -1.22 115.31 120.42 2wva h LEU 33 Ca 0.25 -0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.22 2wva h LEU 33 Cb 0.27 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.70 2wva h LEU 33 CO -0.26 0.82 0.18 0.44 0.09 0.00 0.00 178.44 179.71 2wva h ASP 34 N 1.18 0.17 -0.31 -0.43 3.32 -0.37 -1.29 116.42 118.69 2wva h ASP 34 Ca 0.30 0.07 -0.10 0.00 0.02 0.00 0.00 57.03 57.32 2wva h ASP 34 Cb -0.01 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 2wva h ASP 34 CO -0.05 0.12 -0.15 0.78 -1.72 0.00 0.00 179.24 178.21 2wva h ASN 35 N 0.36 0.75 -0.14 6.45 2.35 -0.39 -2.44 115.58 122.52 2wva h ASN 35 Ca 0.26 -0.24 -0.05 0.00 -0.55 0.00 0.00 56.30 55.72 2wva h ASN 35 Cb 0.29 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 2wva h ASN 35 CO -0.27 0.92 -0.04 -0.07 -1.65 0.00 0.00 177.43 176.32 2wva h LEU 36 N 0.68 0.38 -1.18 1.61 3.38 -0.82 -2.54 115.31 116.82 2wva h LEU 36 Ca 0.11 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2wva h LEU 36 Cb 0.64 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2wva h LEU 36 CO 0.04 0.48 0.00 -0.07 0.09 0.00 0.00 178.44 178.98 2wva h LEU 37 N 0.40 0.00 -1.50 1.67 3.38 -0.75 -2.85 115.31 115.66 2wva h LEU 37 Ca 0.09 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 2wva h LEU 37 Cb 0.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2wva h LEU 37 CO 0.01 0.00 -0.26 -0.07 0.09 0.00 0.00 178.44 178.22 2wva h LEU 38 N 0.00 0.00 -8.67 1.67 3.38 -1.30 -3.39 115.31 107.00 2wva h LEU 38 Ca 0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 2wva h LEU 38 Cb 0.54 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.18 2wva h LEU 38 CO 0.00 0.26 0.50 0.21 0.09 0.00 0.00 178.44 179.50 2wva s ASN 39 N -6.78 6.48 0.00 -0.43 3.84 -1.08 -4.90 114.94 112.08 2wva s ASN 39 Ca -0.03 0.08 0.29 0.00 0.21 0.00 0.00 52.86 53.42 2wva s ASN 39 Cb 0.14 -2.43 1.36 0.00 -0.55 0.00 0.00 41.25 39.78 2wva s ASN 39 CO 0.69 -0.98 1.94 0.29 -2.79 0.00 0.00 177.10 176.25 2wva n LYS 40 N 6.96 0.71 0.00 0.43 4.76 -1.26 -3.56 118.16 126.19 2wva n LYS 40 Ca 0.05 -0.18 0.14 0.00 -2.87 0.00 0.00 58.31 55.44 2wva n LYS 40 Cb 0.48 -1.50 0.76 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 -0.99 0.00 -3.91 4.39 3.02 -1.26 -4.78 115.26 111.73 2wva n ASN 41 Ca 0.16 -0.41 -0.09 0.00 -0.03 0.00 0.00 54.58 54.20 2wva n ASN 41 Cb 0.25 -0.18 -0.09 0.00 -0.61 0.00 0.00 39.78 39.15 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 -2.36 0.63 0.17 3.52 0.23 -1.23 -4.71 119.30 115.55 2wva s MET 42 Ca 0.33 -0.77 0.02 0.00 -1.03 0.00 0.00 55.69 54.24 2wva s MET 42 Cb 0.19 0.25 -0.04 0.00 -1.53 0.00 0.00 34.83 33.71 2wva s MET 42 CO 0.39 -0.17 0.31 -1.21 -2.03 0.00 0.00 175.02 172.31 2wva s GLU 43 N -2.77 3.45 -0.29 3.16 2.02 -0.13 -4.92 118.70 119.22 2wva s GLU 43 Ca -0.04 -0.59 -0.11 0.00 0.02 0.00 0.00 54.97 54.26 2wva s GLU 43 Cb -0.00 -2.94 -0.04 0.00 0.10 0.00 0.00 34.13 31.25 2wva s GLU 43 CO -0.05 0.49 0.17 -1.14 0.02 0.00 0.00 175.26 174.75 2wva s GLN 44 N -3.35 3.75 -0.18 1.61 0.74 -1.26 -1.50 119.66 119.46 2wva s GLN 44 Ca 0.35 -0.45 -0.05 0.00 0.05 0.00 0.00 55.36 55.27 2wva s GLN 44 Cb -0.11 -3.62 -0.03 0.00 1.10 0.00 0.00 33.01 30.36 2wva s GLN 44 CO 0.29 -0.25 -0.01 0.08 -0.55 0.00 0.00 175.29 174.84 2wva s VAL 45 N 1.71 3.93 0.08 1.34 1.01 0.38 -4.97 120.40 123.89 2wva s VAL 45 Ca 0.06 -0.33 -0.07 0.00 0.00 0.00 0.00 61.98 61.64 2wva s VAL 45 Cb -0.16 -2.76 -0.05 0.00 0.00 0.00 0.00 36.38 33.41 2wva s VAL 45 CO 0.09 0.45 0.36 -0.31 0.00 0.00 0.00 175.10 175.69 2wva s TYR 46 N 0.77 3.55 0.28 5.22 2.02 -1.26 -0.45 117.35 127.48 2wva s TYR 46 Ca -0.00 0.66 0.09 0.00 -0.37 0.00 0.00 57.07 57.45 2wva s TYR 46 Cb -0.14 -2.07 -0.06 0.00 -0.40 0.00 0.00 41.96 39.29 2wva s TYR 46 CO 0.02 0.51 -0.12 0.00 -1.57 0.00 0.00 175.55 174.40 2wva s ASN 49 N -5.22 1.27 0.26 0.00 2.20 -1.26 -5.07 114.94 107.11 2wva s ASN 49 Ca -0.14 -1.53 0.13 0.00 -0.94 0.00 0.00 52.86 50.38 2wva s ASN 49 Cb 0.02 0.38 0.17 0.00 -2.00 0.00 0.00 41.25 39.82 2wva s ASN 49 CO 0.57 -0.88 1.49 -0.33 -2.94 0.00 0.00 177.10 175.00 2wva h GLU 50 N 2.30 0.00 -0.27 3.55 3.07 -1.91 -1.06 114.58 120.25 2wva h GLU 50 Ca -0.34 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.48 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 0.52 0.63 0.02 1.25 -1.40 0.00 0.00 179.01 180.02 2wva h LEU 51 N 0.00 0.46 -1.20 1.33 5.85 -1.88 -1.45 115.31 118.43 2wva h LEU 51 Ca -0.01 -0.29 -0.06 0.00 0.84 0.00 0.00 57.88 58.37 2wva h LEU 51 Cb 1.34 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.24 2wva h LEU 51 CO 0.08 0.63 -0.07 0.78 -0.34 0.00 0.00 178.44 179.52 2wva h ASN 52 N 0.27 0.44 -0.42 1.25 4.21 -1.92 -1.98 115.58 117.44 2wva h ASN 52 Ca 0.08 -0.10 -0.04 0.00 1.21 0.00 0.00 56.30 57.45 2wva h ASN 52 Cb 0.39 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 37.45 2wva h ASN 52 CO 0.01 0.56 0.10 0.00 -1.29 0.00 0.00 177.43 176.81 2wva h GLY 54 N 0.54 0.75 2.00 0.00 0.00 -0.98 -2.17 103.07 103.20 2wva h GLY 54 Ca 0.13 -0.36 -0.12 0.00 0.00 0.00 0.00 47.33 46.98 2wva h GLY 54 CO 0.00 0.34 -0.57 0.74 0.00 0.00 0.00 176.54 177.06 2wva h PHE 55 N 0.65 0.00 -0.24 5.60 0.04 -1.10 -0.05 116.94 121.85 2wva h PHE 55 Ca 0.17 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.92 2wva h PHE 55 Cb 0.10 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.24 2wva h PHE 55 CO -0.01 0.57 0.08 0.77 -0.60 0.00 0.00 178.31 179.12 2wva h SER 56 N 0.00 0.34 -0.65 2.17 0.02 -0.40 -0.36 113.55 114.67 2wva h SER 56 Ca -0.01 -0.19 0.02 0.00 -0.84 0.00 0.00 61.79 60.78 2wva h SER 56 Cb 1.07 -0.09 -0.04 0.00 0.14 0.00 0.00 62.40 63.48 2wva h SER 56 CO 0.07 0.44 0.41 0.00 -1.14 0.00 0.00 176.83 176.61 2wva h ALA 57 N 0.92 0.85 -0.72 3.77 0.00 -1.16 -0.39 119.26 122.52 2wva h ALA 57 Ca 0.08 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.06 2wva h ALA 57 Cb 0.21 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 2wva h ALA 57 CO -0.00 0.18 0.36 1.49 0.00 0.00 0.00 179.25 181.28 2wva h GLU 58 N 0.82 0.59 -0.16 0.00 4.22 -0.75 -0.11 114.58 119.19 2wva h GLU 58 Ca 0.26 -0.04 -0.16 0.00 0.08 0.00 0.00 59.36 59.51 2wva h GLU 58 Cb -0.01 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2wva h GLU 58 CO -0.09 0.39 -0.56 0.78 -2.18 0.00 0.00 179.01 177.35 2wva h GLY 59 N 0.61 0.53 1.02 1.92 0.00 -0.38 -2.78 103.07 103.99 2wva h GLY 59 Ca 0.36 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 2wva h GLY 59 CO -0.27 0.56 0.50 -1.82 0.00 0.00 0.00 176.54 175.51 2wva h TYR 60 N 0.37 1.17 -0.15 5.60 3.20 -0.52 -2.34 116.97 124.30 2wva h TYR 60 Ca 0.00 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.81 2wva h TYR 60 Cb 1.10 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.98 2wva h TYR 60 CO 0.04 0.79 -0.12 0.00 -1.64 0.00 0.00 178.16 177.24 2wva h ALA 61 N 1.27 1.53 -0.02 1.82 0.00 -0.83 0.27 119.26 123.30 2wva h ALA 61 Ca 0.31 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2wva h ALA 61 Cb -0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2wva h ALA 61 CO -0.05 0.34 -0.24 0.00 0.00 0.00 0.00 179.25 179.29 2wva h ARG 62 N 0.22 0.03 0.17 0.00 3.08 -1.16 0.13 114.38 116.86 2wva h ARG 62 Ca 0.05 -0.01 -0.35 0.00 0.07 0.00 0.00 59.98 59.74 2wva h ARG 62 Cb 0.35 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.40 2wva h ARG 62 CO 0.02 0.27 -1.78 0.00 -1.07 0.00 0.00 179.97 177.42 2wva h ALA 63 N 1.73 0.21 -0.00 0.04 0.00 -0.91 -3.42 119.26 116.91 2wva h ALA 63 Ca 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 54.91 53.73 2wva h ALA 63 Cb 0.44 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2wva h ALA 63 CO 0.03 1.08 -0.05 1.63 0.00 0.00 0.00 179.25 181.94 2wva n LYS 64 N -3.56 4.71 0.00 0.00 4.76 0.80 -4.93 118.16 119.94 2wva n LYS 64 Ca -0.25 -0.15 0.00 0.00 -2.87 0.00 0.00 58.31 55.04 2wva n LYS 64 Cb 1.07 -0.69 0.00 0.00 -1.84 0.00 0.00 35.03 33.58 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 0.80 2.54 3.68 0.72 0.00 0.43 -4.97 105.19 108.39 2wva n GLY 65 Ca 0.00 0.00 -0.10 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 -2.58 -0.36 0.13 4.61 0.00 -1.25 -4.29 121.76 118.02 2wva s ALA 66 Ca 0.00 -0.86 -0.26 0.00 0.00 0.00 0.00 51.96 50.84 2wva s ALA 66 Cb 0.00 0.95 0.07 0.00 0.00 0.00 0.00 23.12 24.14 2wva s ALA 66 CO 0.00 -0.91 0.99 0.00 0.00 0.00 0.00 175.76 175.84 2wva s ALA 67 N -3.39 -1.71 -0.04 0.00 0.00 -1.04 -3.87 121.76 111.71 2wva s ALA 67 Ca 0.20 0.20 -0.04 0.00 0.00 0.00 0.00 51.96 52.32 2wva s ALA 67 Cb -0.03 0.61 0.01 0.00 0.00 0.00 0.00 23.12 23.71 2wva s ALA 67 CO 0.11 -1.04 0.11 0.00 0.00 0.00 0.00 175.76 174.94 2wva s ALA 68 N -3.20 -0.26 -0.05 0.00 0.00 -1.26 -0.59 121.76 116.40 2wva s ALA 68 Ca 0.12 0.30 0.03 0.00 0.00 0.00 0.00 51.96 52.42 2wva s ALA 68 Cb -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.94 2wva s ALA 68 CO 0.01 -0.05 -0.14 0.00 0.00 0.00 0.00 175.76 175.58 2wva s ALA 69 N 0.07 1.32 -0.18 0.00 0.00 -0.17 -0.90 121.76 121.90 2wva s ALA 69 Ca -0.00 -0.54 -0.00 0.00 0.00 0.00 0.00 51.96 51.42 2wva s ALA 69 Cb -0.01 -0.50 0.01 0.00 0.00 0.00 0.00 23.12 22.62 2wva s ALA 69 CO 0.00 0.20 -0.16 0.08 0.00 0.00 0.00 175.76 175.88 2wva s VAL 70 N 0.28 2.51 0.31 0.00 1.01 0.21 -0.36 120.40 124.36 2wva s VAL 70 Ca -0.08 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.13 2wva s VAL 70 Cb -0.12 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 2wva s VAL 70 CO 0.03 0.51 0.11 0.68 0.00 0.00 0.00 175.10 176.43 2wva s VAL 71 N 1.13 0.62 0.38 2.92 -7.23 -0.11 -1.60 120.40 116.51 2wva s VAL 71 Ca 0.01 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.19 2wva s VAL 71 Cb -0.14 -2.58 -0.02 0.00 0.56 0.00 0.00 36.38 34.20 2wva s VAL 71 CO -0.06 0.00 0.57 0.28 -0.31 0.00 0.00 175.10 175.58 2wva s THR 72 N -3.52 4.58 0.19 5.32 -1.32 -1.26 -0.89 115.64 118.75 2wva s THR 72 Ca 0.34 -0.58 -0.32 0.00 -1.21 0.00 0.00 61.69 59.92 2wva s THR 72 Cb 0.06 -3.67 -0.12 0.00 -1.51 0.00 0.00 72.50 67.26 2wva s THR 72 CO 0.15 -0.41 1.72 0.00 -2.21 0.00 0.00 174.62 173.87 2wva n TYR 73 N -1.85 2.68 0.00 9.09 9.36 -1.17 -2.11 117.16 133.16 2wva n TYR 73 Ca -0.02 0.05 0.00 0.00 3.32 0.00 0.00 57.90 61.25 2wva n TYR 73 Cb 0.57 -2.66 0.00 0.00 -0.63 0.00 0.00 39.34 36.62 2wva n TYR 73 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2wva n SER 74 N 4.05 0.00 0.22 2.98 2.88 -1.26 -3.94 113.62 118.55 2wva n SER 74 Ca 0.16 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.78 2wva n SER 74 Cb 0.34 0.00 0.53 0.00 -0.75 0.00 0.00 64.21 64.33 2wva n SER 74 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 2wva h VAL 75 N 0.00 0.93 0.00 2.46 -1.51 -1.75 -1.90 116.25 114.49 2wva h VAL 75 Ca 0.00 -0.86 -0.15 0.00 -1.23 0.00 0.00 66.70 64.46 2wva h VAL 75 Cb 0.00 1.49 -0.02 0.00 -2.13 0.00 0.00 31.29 30.63 2wva h VAL 75 CO 0.00 0.22 -0.86 1.23 -1.23 0.00 0.00 177.57 176.93 2wva h GLY 76 N 0.96 0.00 0.91 5.19 0.00 -1.62 -3.41 103.07 105.11 2wva h GLY 76 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 2wva h GLY 76 CO 0.03 0.00 0.11 0.00 0.00 0.00 0.00 176.54 176.68 2wva h ALA 77 N -0.41 0.34 -0.52 3.60 0.00 -1.34 -2.93 119.26 118.00 2wva h ALA 77 Ca -0.23 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 54.64 2wva h ALA 77 Cb 1.15 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 2wva h ALA 77 CO -0.14 -0.08 0.20 -0.07 0.00 0.00 0.00 179.25 179.16 2wva h LEU 78 N 0.28 0.22 -0.51 0.00 4.07 -1.58 0.13 115.31 117.92 2wva h LEU 78 Ca 0.09 0.06 -0.14 0.00 0.08 0.00 0.00 57.88 57.97 2wva h LEU 78 Cb 0.16 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 41.92 2wva h LEU 78 CO -0.01 0.15 -0.27 0.77 -1.08 0.00 0.00 178.44 178.00 2wva h SER 79 N 0.39 0.96 -0.20 -0.43 4.64 -1.78 -2.77 113.55 114.35 2wva h SER 79 Ca 0.25 -0.38 0.02 0.00 -0.47 0.00 0.00 61.79 61.21 2wva h SER 79 Cb 0.26 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 2wva h SER 79 CO -0.24 1.16 0.14 0.00 -0.87 0.00 0.00 176.83 177.01 2wva h ALA 80 N 0.90 1.98 -0.95 5.18 0.00 -0.92 -1.56 119.26 123.88 2wva h ALA 80 Ca 0.09 -0.01 0.21 0.00 0.00 0.00 0.00 54.91 55.20 2wva h ALA 80 Cb 0.84 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.51 2wva h ALA 80 CO 0.07 -0.01 0.61 0.74 0.00 0.00 0.00 179.25 180.67 2wva h PHE 81 N 0.17 0.67 -0.72 0.00 0.04 -0.51 0.36 116.94 116.95 2wva h PHE 81 Ca 0.08 0.02 0.04 0.00 2.80 0.00 0.00 57.97 60.91 2wva h PHE 81 Cb 0.13 -0.20 -0.05 0.00 2.20 0.00 0.00 35.95 38.03 2wva h PHE 81 CO -0.00 0.16 0.45 0.22 -0.60 0.00 0.00 178.31 178.54 2wva h ASP 82 N 0.49 0.72 0.13 2.17 1.82 -1.40 0.45 116.42 120.80 2wva h ASP 82 Ca 0.51 0.00 -0.18 0.00 -0.39 0.00 0.00 57.03 56.98 2wva h ASP 82 Cb 1.15 -0.15 -0.00 0.00 0.68 0.00 0.00 39.33 41.01 2wva h ASP 82 CO -0.23 0.49 -0.67 0.00 -1.61 0.00 0.00 179.24 177.22 2wva h ALA 83 N 1.32 0.61 -0.37 -0.78 0.00 -0.51 -1.89 119.26 117.64 2wva h ALA 83 Ca 0.30 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 2wva h ALA 83 Cb 0.05 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2wva h ALA 83 CO -0.12 0.73 0.03 0.82 0.00 0.00 0.00 179.25 180.70 2wva h ILE 84 N 0.36 1.25 -0.81 0.00 1.08 -0.35 -0.07 117.51 118.97 2wva h ILE 84 Ca -0.02 -0.93 0.12 0.00 -0.39 0.00 0.00 64.86 63.64 2wva h ILE 84 Cb 1.24 1.13 -0.08 0.00 -3.07 0.00 0.00 36.82 36.03 2wva h ILE 84 CO 0.12 0.31 0.43 1.23 -0.69 0.00 0.00 178.15 179.55 2wva h GLY 85 N 0.47 1.28 0.87 5.37 0.00 -0.08 0.73 103.07 111.71 2wva h GLY 85 Ca 0.11 -0.26 0.03 0.00 0.00 0.00 0.00 47.33 47.21 2wva h GLY 85 CO 0.01 0.03 0.35 -1.33 0.00 0.00 0.00 176.54 175.60 2wva h GLY 86 N 0.66 0.82 1.46 4.60 0.00 -0.79 0.37 103.07 110.18 2wva h GLY 86 Ca 0.42 -0.26 -0.06 0.00 0.00 0.00 0.00 47.33 47.43 2wva h GLY 86 CO -0.31 0.22 0.02 0.00 0.00 0.00 0.00 176.54 176.46 2wva h ALA 87 N 1.25 1.25 -0.44 3.60 0.00 0.10 -1.14 119.26 123.87 2wva h ALA 87 Ca 0.23 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2wva h ALA 87 Cb 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2wva h ALA 87 CO -0.10 0.51 0.19 -0.92 0.00 0.00 0.00 179.25 178.93 2wva h TYR 88 N 0.64 0.65 0.00 0.00 5.03 -0.08 -1.11 116.97 122.10 2wva h TYR 88 Ca 0.13 -0.04 -0.05 0.00 2.58 0.00 0.00 58.73 61.35 2wva h TYR 88 Cb 0.37 -0.20 -0.01 0.00 1.55 0.00 0.00 36.73 38.44 2wva h TYR 88 CO 0.02 0.55 -0.23 0.00 -1.32 0.00 0.00 178.16 177.17 2wva h ALA 89 N 1.04 1.49 -0.47 1.82 0.00 -0.46 -2.70 119.26 119.98 2wva h ALA 89 Ca 0.15 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2wva h ALA 89 Cb 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2wva h ALA 89 CO -0.02 0.29 0.00 0.39 0.00 0.00 0.00 179.25 179.91 2wva n GLU 90 N -4.08 3.34 -3.72 0.00 -0.58 -0.48 -4.74 120.64 110.39 2wva n GLU 90 Ca -0.02 -2.67 -0.25 0.00 -0.42 0.00 0.00 57.16 53.80 2wva n GLU 90 Cb 0.30 -1.73 0.03 0.00 -0.57 0.00 0.00 31.44 29.47 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 0.53 -2.71 -4.11 1.62 3.02 -0.55 -5.00 115.26 108.06 2wva n ASN 91 Ca 0.21 -0.92 -0.29 0.00 -0.03 0.00 0.00 54.58 53.55 2wva n ASN 91 Cb 0.78 -3.69 -0.17 0.00 -0.61 0.00 0.00 39.78 36.09 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 -6.58 1.86 -1.22 3.41 1.43 -0.53 -4.66 118.68 112.39 2wva s LEU 92 Ca 0.19 -0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 52.65 2wva s LEU 92 Cb -0.06 -1.15 -0.02 0.00 0.03 0.00 0.00 46.19 44.99 2wva s LEU 92 CO 0.84 0.08 1.91 -2.65 0.23 0.00 0.00 176.35 176.75 2wva n PRO 93 N 3.83 2.42 -3.45 1.29 -0.02 -1.26 -2.89 135.00 134.93 2wva n PRO 93 Ca -0.20 -2.72 -0.37 0.00 -2.02 0.00 0.00 63.50 58.18 2wva n PRO 93 Cb 0.52 -3.45 -0.06 0.00 -0.02 0.00 0.00 33.50 30.48 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 6.22 5.23 -0.37 -1.45 1.01 -1.26 -2.49 120.40 127.29 2wva s VAL 94 Ca 0.58 0.74 -0.11 0.00 0.00 0.00 0.00 61.98 63.19 2wva s VAL 94 Cb 0.06 -3.71 0.02 0.00 0.00 0.00 0.00 36.38 32.74 2wva s VAL 94 CO 0.07 0.39 0.21 -0.63 0.00 0.00 0.00 175.10 175.14 2wva s ILE 95 N 0.32 4.68 -0.25 2.22 1.01 0.24 -1.78 121.20 127.64 2wva s ILE 95 Ca 0.21 -0.74 -0.15 0.00 0.00 0.00 0.00 60.65 59.96 2wva s ILE 95 Cb -0.14 -3.57 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 2wva s ILE 95 CO 0.08 -0.19 0.39 -0.22 0.00 0.00 0.00 174.94 175.00 2wva s LEU 96 N 1.58 4.07 -0.16 2.97 2.96 -0.68 -1.00 118.68 128.42 2wva s LEU 96 Ca 0.03 0.37 -0.01 0.00 -0.22 0.00 0.00 54.13 54.30 2wva s LEU 96 Cb -0.19 -2.46 -0.01 0.00 0.50 0.00 0.00 46.19 44.03 2wva s LEU 96 CO 0.07 -0.16 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.19 2wva s ILE 97 N 1.87 2.98 -0.05 6.68 1.09 0.51 -0.76 121.20 133.52 2wva s ILE 97 Ca 0.16 -0.66 0.03 0.00 -1.10 0.00 0.00 60.65 59.08 2wva s ILE 97 Cb -0.15 -2.28 -0.03 0.00 -1.06 0.00 0.00 42.46 38.94 2wva s ILE 97 CO 0.09 0.50 -0.12 -0.55 -0.10 0.00 0.00 174.94 174.76 2wva s SER 98 N 0.74 4.20 0.81 3.58 0.15 0.39 -0.93 113.70 122.64 2wva s SER 98 Ca -0.05 -0.16 -0.11 0.00 0.70 0.00 0.00 55.95 56.33 2wva s SER 98 Cb -0.15 -0.93 0.08 0.00 -1.71 0.00 0.00 66.02 63.31 2wva s SER 98 CO 0.01 0.34 1.13 -0.83 1.20 0.00 0.00 173.24 175.10 2wva s GLY 99 N -0.81 1.80 0.22 9.45 0.00 -0.07 -1.37 107.32 116.54 2wva s GLY 99 Ca 0.12 0.49 -0.08 0.00 0.00 0.00 0.00 44.72 45.25 2wva s GLY 99 CO 0.01 0.87 0.33 0.00 0.00 0.00 0.00 173.10 174.31 2wva s ALA 100 N -2.65 0.26 0.70 3.20 0.00 -0.59 -3.06 121.76 119.62 2wva s ALA 100 Ca 0.65 -1.15 -0.16 0.00 0.00 0.00 0.00 51.96 51.30 2wva s ALA 100 Cb -0.21 1.14 0.01 0.00 0.00 0.00 0.00 23.12 24.06 2wva s ALA 100 CO 0.54 -0.74 1.12 -2.30 0.00 0.00 0.00 175.76 174.39 2wva n PRO 101 N -0.32 0.71 -1.50 0.00 -0.02 -1.26 -0.90 135.00 131.72 2wva n PRO 101 Ca -0.01 0.30 -0.50 0.00 -2.02 0.00 0.00 63.50 61.27 2wva n PRO 101 Cb 0.63 -2.36 -0.04 0.00 -0.02 0.00 0.00 33.50 31.71 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 -1.92 0.09 0.00 2.55 2.85 -1.26 -3.53 115.26 114.04 2wva n ASN 102 Ca 0.14 1.15 0.08 0.00 -0.11 0.00 0.00 54.58 55.83 2wva n ASN 102 Cb 0.49 -1.06 0.37 0.00 1.24 0.00 0.00 39.78 40.81 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 1.81 0.00 0.16 1.20 0.23 -1.26 -1.93 115.26 115.46 2wva n ASN 103 Ca 0.17 0.23 0.13 0.00 -0.53 0.00 0.00 54.58 54.57 2wva n ASN 103 Cb 0.22 -0.37 0.41 0.00 -2.08 0.00 0.00 39.78 37.97 2wva n ASN 103 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 2wva h ASN 104 N 0.00 0.00 0.61 0.53 2.35 -1.95 -3.30 115.58 113.82 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 -0.18 0.47 -1.65 0.00 0.00 177.43 176.07 2wva n ASP 105 N -2.53 0.32 -4.77 5.81 8.00 -0.81 -4.74 116.55 117.83 2wva n ASP 105 Ca 0.04 -0.12 -0.38 0.00 0.71 0.00 0.00 54.79 55.04 2wva n ASP 105 Cb 0.39 -0.13 -0.05 0.00 -0.02 0.00 0.00 41.12 41.31 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 -2.79 3.55 -1.62 1.24 3.76 -1.25 -3.59 115.29 114.60 2wva s HIS 106 Ca 0.19 1.73 -0.10 0.00 -0.15 0.00 0.00 55.06 56.74 2wva s HIS 106 Cb 0.19 -3.08 0.09 0.00 1.11 0.00 0.00 32.58 30.89 2wva s HIS 106 CO 0.55 -0.22 0.45 0.00 -0.85 0.00 0.00 174.74 174.68 2wva n ALA 107 N 0.59 -1.65 -0.05 -1.40 0.00 -1.26 -4.81 120.51 111.93 2wva n ALA 107 Ca 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2wva n ALA 107 Cb 0.48 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.84 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 1.44 -2.65 0.00 0.00 -1.24 -5.03 120.51 108.66 2wva n ALA 108 Ca -0.13 -0.06 -0.07 0.00 0.00 0.00 0.00 53.44 53.19 2wva n ALA 108 Cb 0.59 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.06 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 0.58 0.45 3.56 0.00 0.00 -1.26 -5.03 105.19 103.49 2wva n GLY 109 Ca 0.00 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.91 3.13 -0.00 1.61 4.02 -1.26 -4.98 115.29 114.90 2wva s HIS 110 Ca 0.13 -0.12 -0.24 0.00 1.02 0.00 0.00 55.06 55.85 2wva s HIS 110 Cb -0.06 -2.01 -0.05 0.00 -1.02 0.00 0.00 32.58 29.44 2wva s HIS 110 CO 0.16 0.06 0.73 0.08 1.02 0.00 0.00 174.74 176.79 2wva s VAL 111 N 0.35 4.87 0.06 -0.90 1.01 -1.26 -4.42 120.40 120.11 2wva s VAL 111 Ca -0.01 1.53 0.08 0.00 0.00 0.00 0.00 61.98 63.58 2wva s VAL 111 Cb -0.13 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 2wva s VAL 111 CO 0.02 0.33 -0.23 -0.76 0.00 0.00 0.00 175.10 174.45 2wva s LEU 112 N 0.25 2.21 0.65 3.92 1.43 -1.26 -5.10 118.68 120.78 2wva s LEU 112 Ca 0.38 -0.59 -0.17 0.00 -1.03 0.00 0.00 54.13 52.71 2wva s LEU 112 Cb -0.19 -1.06 -0.03 0.00 0.03 0.00 0.00 46.19 44.93 2wva s LEU 112 CO 0.21 0.17 0.91 0.00 0.23 0.00 0.00 176.35 177.87 2wva n HIS 113 N 1.59 0.57 -0.54 0.29 1.44 -1.26 -2.23 115.22 115.08 2wva n HIS 113 Ca -0.18 0.41 0.00 0.00 -2.01 0.00 0.00 57.72 55.95 2wva n HIS 113 Cb 0.53 -2.09 0.00 0.00 0.12 0.00 0.00 29.99 28.55 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 -2.07 0.00 -3.60 -1.40 8.25 -1.26 -5.00 115.22 110.15 2wva n HIS 114 Ca 0.13 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.43 2wva n HIS 114 Cb 0.48 -0.55 0.01 0.00 1.12 0.00 0.00 29.99 31.06 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 0.81 0.64 0.50 -1.41 0.00 -0.95 -4.28 120.51 115.82 2wva n ALA 115 Ca 0.00 -1.49 0.13 0.00 0.00 0.00 0.00 53.44 52.08 2wva n ALA 115 Cb 0.00 0.57 0.44 0.00 0.00 0.00 0.00 19.45 20.46 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 -1.89 -3.46 115.31 113.33 2wva h LEU 116 Ca -0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2wva h LEU 116 Cb 0.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 2wva h LEU 116 CO 0.35 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.49 2wva n GLY 117 N 0.76 0.50 3.04 0.83 0.00 -1.26 -5.08 105.19 103.98 2wva n GLY 117 Ca 0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.59 -0.05 -0.80 1.61 5.02 -1.26 -4.90 118.16 116.20 2wva n LYS 118 Ca 0.00 -2.09 0.01 0.00 -2.02 0.00 0.00 58.31 54.21 2wva n LYS 118 Cb 0.00 -0.57 0.30 0.00 -0.02 0.00 0.00 35.03 34.74 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 -2.62 2.67 -5.15 -0.18 -2.24 -1.26 -4.55 114.28 100.95 2wva n THR 119 Ca 0.13 -1.80 -0.32 0.00 -2.27 0.00 0.00 64.05 59.79 2wva n THR 119 Cb 0.46 -0.31 -0.16 0.00 -2.10 0.00 0.00 70.33 68.23 2wva n THR 119 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wva s ASP 120 N -1.44 3.32 -0.17 3.42 -1.08 -1.26 -4.60 116.67 114.85 2wva s ASP 120 Ca 0.50 -0.46 0.14 0.00 -0.52 0.00 0.00 52.55 52.21 2wva s ASP 120 Cb 0.40 -1.02 0.38 0.00 -1.46 0.00 0.00 42.92 41.22 2wva s ASP 120 CO 0.11 0.23 1.19 -1.22 0.52 0.00 0.00 175.17 176.01 2wva n TYR 121 N 3.03 0.00 0.76 -5.34 4.01 -1.26 -4.67 117.16 113.68 2wva n TYR 121 Ca -0.18 -1.26 0.11 0.00 -0.16 0.00 0.00 57.90 56.42 2wva n TYR 121 Cb 0.52 -0.21 0.06 0.00 -0.31 0.00 0.00 39.34 39.40 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 -1.05 0.16 -0.11 -0.72 -0.00 -1.26 -4.40 115.22 107.83 2wva n HIS 122 Ca 0.17 0.05 -0.05 0.00 0.46 0.00 0.00 57.72 58.35 2wva n HIS 122 Cb 0.71 -0.32 0.15 0.00 -0.12 0.00 0.00 29.99 30.41 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 0.86 -0.19 1.57 -0.00 -2.00 -2.46 116.97 114.76 2wva h TYR 123 Ca 0.00 -0.12 -0.01 0.00 -0.00 0.00 0.00 58.73 58.60 2wva h TYR 123 Cb 0.63 -0.24 -0.01 0.00 -0.00 0.00 0.00 36.73 37.12 2wva h TYR 123 CO 0.00 0.80 0.09 0.37 -0.00 0.00 0.00 178.16 179.42 2wva h GLN 124 N 0.75 0.26 -0.33 0.10 4.15 -1.96 0.24 115.11 118.33 2wva h GLN 124 Ca 0.15 -0.04 0.07 0.00 0.77 0.00 0.00 58.65 59.60 2wva h GLN 124 Cb 0.46 -0.05 -0.08 0.00 0.21 0.00 0.00 27.48 28.03 2wva h GLN 124 CO 0.02 0.29 -0.18 1.25 -1.93 0.00 0.00 178.83 178.27 2wva h LEU 125 N 0.18 -0.61 -0.75 -2.39 5.85 -1.79 -0.58 115.31 115.22 2wva h LEU 125 Ca 0.06 0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.98 2wva h LEU 125 Cb 0.11 0.32 -0.06 0.00 0.37 0.00 0.00 40.66 41.40 2wva h LEU 125 CO -0.01 -0.22 0.43 -0.33 -0.34 0.00 0.00 178.44 177.98 2wva h GLU 126 N -0.14 0.76 -0.58 1.25 5.08 -0.96 -0.53 114.58 119.47 2wva h GLU 126 Ca 0.17 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 2wva h GLU 126 Cb 0.40 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 2wva h GLU 126 CO -0.41 0.50 0.29 0.52 -1.00 0.00 0.00 179.01 178.91 2wva h MET 127 N 0.78 0.83 -0.23 2.33 2.86 -0.56 -2.94 114.93 118.01 2wva h MET 127 Ca 0.34 -0.12 -0.04 0.00 -2.06 0.00 0.00 59.70 57.82 2wva h MET 127 Cb 0.21 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 2wva h MET 127 CO -0.19 0.66 -0.03 0.00 1.06 0.00 0.00 176.91 178.42 2wva h ALA 128 N 1.12 1.54 -0.03 6.32 0.00 0.38 -2.09 119.26 126.50 2wva h ALA 128 Ca 0.20 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2wva h ALA 128 Cb 0.10 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2wva h ALA 128 CO -0.03 0.34 0.04 0.87 0.00 0.00 0.00 179.25 180.47 2wva h LYS 129 N 0.33 0.00 0.00 0.00 1.57 -1.01 -1.82 116.57 115.64 2wva h LYS 129 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2wva h LYS 129 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2wva h LYS 129 CO 0.01 0.00 0.00 -0.91 -0.57 0.00 0.00 179.45 177.98 2wva h ASN 130 N 0.00 0.00 0.00 0.86 2.35 -1.47 -3.33 115.58 113.99 2wva h ASN 130 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2wva h ASN 130 Cb 0.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.47 2wva h ASN 130 CO -0.00 0.00 -0.27 2.30 -1.65 0.00 0.00 177.43 177.81 2wva n ILE 131 N -2.95 0.49 -4.29 2.81 -5.35 -0.70 -5.07 119.36 104.30 2wva n ILE 131 Ca 0.01 -0.57 -0.15 0.00 -0.27 0.00 0.00 62.75 61.77 2wva n ILE 131 Cb 0.31 0.42 -0.10 0.00 -1.74 0.00 0.00 39.64 38.53 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 -0.70 0.73 -0.78 7.28 -4.23 -1.13 -4.40 115.64 112.41 2wva s THR 132 Ca 0.07 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.82 2wva s THR 132 Cb 0.06 -2.34 0.00 0.00 1.34 0.00 0.00 72.50 71.57 2wva s THR 132 CO 0.01 -0.29 1.31 0.00 -0.54 0.00 0.00 174.62 175.11 2wva n ALA 133 N -0.35 3.25 -3.58 3.99 0.00 -0.22 -4.91 120.51 118.69 2wva n ALA 133 Ca -0.04 -0.31 -0.13 0.00 0.00 0.00 0.00 53.44 52.95 2wva n ALA 133 Cb 0.64 -1.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.91 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 -3.11 -1.86 -0.20 0.00 0.00 -1.26 -5.02 121.76 110.31 2wva s ALA 134 Ca 0.08 1.62 -0.09 0.00 0.00 0.00 0.00 51.96 53.57 2wva s ALA 134 Cb 0.15 -0.69 0.08 0.00 0.00 0.00 0.00 23.12 22.66 2wva s ALA 134 CO 0.73 -0.32 0.45 0.00 0.00 0.00 0.00 175.76 176.62 2wva s ALA 135 N -0.65 -1.24 -0.01 0.00 0.00 -1.26 -1.20 121.76 117.40 2wva s ALA 135 Ca -0.04 1.64 0.03 0.00 0.00 0.00 0.00 51.96 53.59 2wva s ALA 135 Cb -0.02 -1.23 -0.00 0.00 0.00 0.00 0.00 23.12 21.86 2wva s ALA 135 CO 0.03 -0.58 -0.09 -1.21 0.00 0.00 0.00 175.76 173.91 2wva s GLU 136 N 2.16 0.78 -0.13 0.00 0.41 -0.35 -4.97 118.70 116.60 2wva s GLU 136 Ca -0.05 -0.32 -0.05 0.00 -0.41 0.00 0.00 54.97 54.14 2wva s GLU 136 Cb -0.10 -0.75 -0.04 0.00 -1.78 0.00 0.00 34.13 31.46 2wva s GLU 136 CO -0.14 0.18 0.04 0.00 -0.49 0.00 0.00 175.26 174.85 2wva s ALA 137 N -0.13 3.40 -0.27 5.21 0.00 -1.26 -2.00 121.76 126.70 2wva s ALA 137 Ca 0.02 -0.76 -0.05 0.00 0.00 0.00 0.00 51.96 51.18 2wva s ALA 137 Cb -0.05 -1.70 0.01 0.00 0.00 0.00 0.00 23.12 21.39 2wva s ALA 137 CO -0.00 0.44 0.02 0.42 0.00 0.00 0.00 175.76 176.64 2wva s ILE 138 N -0.43 3.53 -0.04 0.00 1.01 0.18 -4.95 121.20 120.50 2wva s ILE 138 Ca 0.09 -0.80 0.14 0.00 0.00 0.00 0.00 60.65 60.08 2wva s ILE 138 Cb -0.12 -2.80 -0.21 0.00 0.01 0.00 0.00 42.46 39.34 2wva s ILE 138 CO 0.02 0.15 0.27 -1.22 0.00 0.00 0.00 174.94 174.16 2wva n TYR 139 N 4.79 0.00 -4.20 3.97 4.01 -1.26 -1.94 117.16 122.53 2wva n TYR 139 Ca -0.15 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.43 2wva n TYR 139 Cb 0.48 -0.38 -0.11 0.00 -0.31 0.00 0.00 39.34 39.02 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 -2.89 1.06 0.25 -0.72 -4.23 -1.26 -4.78 115.64 103.07 2wva s THR 140 Ca -0.05 -1.67 -0.05 0.00 -1.18 0.00 0.00 61.69 58.74 2wva s THR 140 Cb 0.08 -1.41 0.19 0.00 1.34 0.00 0.00 72.50 72.70 2wva s THR 140 CO 0.59 -0.52 1.84 -0.65 -0.54 0.00 0.00 174.62 175.34 2wva h PRO 141 N 3.54 1.12 -0.17 3.99 0.11 -1.89 -2.78 132.00 135.93 2wva h PRO 141 Ca -0.38 -0.16 0.05 0.00 0.11 0.00 0.00 66.00 65.62 2wva h PRO 141 Cb 1.19 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 2wva h PRO 141 CO 0.52 0.87 0.13 0.93 -0.21 0.00 0.00 178.00 180.24 2wva h GLU 142 N 1.12 0.00 0.00 1.05 3.07 -1.97 -1.32 114.58 116.52 2wva h GLU 142 Ca 0.27 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.13 2wva h GLU 142 Cb 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.03 2wva h GLU 142 CO -0.03 0.00 -0.31 0.93 -1.40 0.00 0.00 179.01 178.20 2wva h GLU 143 N 0.00 0.00 -0.12 2.33 5.08 -1.92 -3.39 114.58 116.56 2wva h GLU 143 Ca 0.08 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2wva h GLU 143 Cb 0.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2wva h GLU 143 CO -0.00 0.00 0.04 0.00 -1.00 0.00 0.00 179.01 178.05 2wva h ALA 144 N 2.09 0.12 -0.25 3.43 0.00 -1.27 -2.85 119.26 120.53 2wva h ALA 144 Ca 0.00 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.95 2wva h ALA 144 Cb 0.95 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 2wva h ALA 144 CO 0.00 -0.42 0.08 -1.35 0.00 0.00 0.00 179.25 177.56 2wva h PRO 145 N 0.09 0.18 -0.68 0.00 0.11 -1.76 0.11 132.00 130.06 2wva h PRO 145 Ca 0.05 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.11 2wva h PRO 145 Cb 0.03 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 31.06 2wva h PRO 145 CO -0.05 0.12 0.30 0.00 -0.21 0.00 0.00 178.00 178.16 2wva h ALA 146 N 1.16 0.88 -0.30 -0.75 0.00 -1.83 -1.41 119.26 117.02 2wva h ALA 146 Ca 0.11 -0.16 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 2wva h ALA 146 Cb 0.09 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2wva h ALA 146 CO -0.12 0.47 -0.50 0.87 0.00 0.00 0.00 179.25 179.97 2wva h LYS 147 N 0.96 0.86 -0.13 0.00 1.57 -1.24 -1.16 116.57 117.42 2wva h LYS 147 Ca 0.23 -0.53 -0.00 0.00 -1.87 0.00 0.00 60.65 58.48 2wva h LYS 147 Cb 0.17 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 2wva h LYS 147 CO -0.02 1.17 0.07 0.82 -0.57 0.00 0.00 179.45 180.92 2wva h ILE 148 N 0.65 1.08 -0.75 1.86 2.04 -0.67 -2.59 117.51 119.12 2wva h ILE 148 Ca 0.02 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.64 2wva h ILE 148 Cb 1.11 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 2wva h ILE 148 CO 0.11 0.08 0.39 0.44 0.00 0.00 0.00 178.15 179.17 2wva h ASP 149 N 0.12 0.96 -0.24 1.72 3.32 -1.22 -2.42 116.42 118.66 2wva h ASP 149 Ca 0.05 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 2wva h ASP 149 Cb 0.06 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 2wva h ASP 149 CO -0.01 0.80 0.11 -0.74 -1.72 0.00 0.00 179.24 177.68 2wva h HIS 150 N 1.04 0.35 -0.17 4.55 -0.00 -1.12 -0.05 115.15 119.75 2wva h HIS 150 Ca 0.26 -0.02 -0.14 0.00 -0.00 0.00 0.00 60.37 60.47 2wva h HIS 150 Cb 0.07 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.36 2wva h HIS 150 CO 0.00 0.34 -0.48 -0.39 -0.00 0.00 0.00 177.93 177.40 2wva h VAL 151 N 0.25 1.32 -0.10 5.26 -1.51 -1.41 -1.81 116.25 118.26 2wva h VAL 151 Ca 0.08 -1.70 -0.03 0.00 -1.23 0.00 0.00 66.70 63.83 2wva h VAL 151 Cb 0.13 1.71 -0.00 0.00 -2.13 0.00 0.00 31.29 31.00 2wva h VAL 151 CO -0.01 0.52 -0.04 0.40 -1.23 0.00 0.00 177.57 177.22 2wva h ILE 152 N 0.37 1.31 -0.86 7.19 2.04 -1.33 -0.27 117.51 125.95 2wva h ILE 152 Ca 0.02 -1.01 0.06 0.00 1.00 0.00 0.00 64.86 64.93 2wva h ILE 152 Cb 0.98 1.77 -0.06 0.00 -0.74 0.00 0.00 36.82 38.77 2wva h ILE 152 CO 0.09 0.29 0.53 0.11 0.00 0.00 0.00 178.15 179.17 2wva h LYS 153 N -0.14 0.94 -0.43 2.37 1.57 -0.96 -1.85 116.57 118.07 2wva h LYS 153 Ca 0.02 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 2wva h LYS 153 Cb 0.47 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 2wva h LYS 153 CO 0.01 0.62 0.04 1.15 -0.57 0.00 0.00 179.45 180.70 2wva h THR 154 N 0.97 1.25 -0.60 -0.16 2.02 -1.22 -1.55 112.91 113.62 2wva h THR 154 Ca 0.38 -0.95 0.03 0.00 0.77 0.00 0.00 66.41 66.63 2wva h THR 154 Cb 0.18 1.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.58 2wva h THR 154 CO -0.18 0.33 0.37 0.00 0.37 0.00 0.00 175.52 176.41 2wva h ALA 155 N 0.92 0.78 -0.40 6.16 0.00 -0.38 -1.16 119.26 125.18 2wva h ALA 155 Ca 0.13 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 2wva h ALA 155 Cb 0.43 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2wva h ALA 155 CO 0.01 0.11 -0.31 -0.07 0.00 0.00 0.00 179.25 178.99 2wva h LEU 156 N 0.73 0.97 -0.09 0.00 3.38 -1.27 -0.10 115.31 118.94 2wva h LEU 156 Ca 0.24 -0.44 -0.07 0.00 0.09 0.00 0.00 57.88 57.70 2wva h LEU 156 Cb 0.02 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.50 2wva h LEU 156 CO -0.10 1.21 -0.22 -0.09 0.09 0.00 0.00 178.44 179.33 2wva h ARG 157 N 0.74 0.30 0.00 1.13 2.43 -1.05 -3.30 114.38 114.64 2wva h ARG 157 Ca 0.07 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 2wva h ARG 157 Cb 0.90 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.48 2wva h ARG 157 CO 0.08 0.82 -0.52 0.93 -1.51 0.00 0.00 179.97 179.78 2wva h GLU 158 N -0.16 0.00 -5.48 0.20 4.39 -1.29 -3.48 114.58 108.76 2wva h GLU 158 Ca -0.00 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.40 2wva h GLU 158 Cb 0.83 0.00 0.17 0.00 -0.10 0.00 0.00 28.75 29.65 2wva h GLU 158 CO 0.05 0.00 -0.77 1.63 -1.16 0.00 0.00 179.01 178.76 2wva n LYS 159 N -2.60 -5.21 -3.99 2.33 4.76 -0.06 -4.99 118.16 108.40 2wva n LYS 159 Ca 0.03 0.83 -0.08 0.00 -2.87 0.00 0.00 58.31 56.21 2wva n LYS 159 Cb 0.50 -5.74 -0.10 0.00 -1.84 0.00 0.00 35.03 27.86 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 -5.04 0.57 0.71 1.97 -0.14 -1.16 -3.08 119.74 113.57 2wva s LYS 160 Ca 0.13 -0.92 -0.11 0.00 -1.36 0.00 0.00 55.97 53.71 2wva s LYS 160 Cb -0.02 0.21 0.02 0.00 -1.68 0.00 0.00 37.83 36.36 2wva s LYS 160 CO 0.71 -0.13 1.07 -1.25 -0.76 0.00 0.00 175.35 174.99 2wva s PRO 161 N -2.99 2.80 0.29 -1.68 0.04 -1.14 -4.30 135.00 128.01 2wva s PRO 161 Ca -0.02 0.92 0.02 0.00 0.04 0.00 0.00 61.00 61.97 2wva s PRO 161 Cb 0.01 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.53 2wva s PRO 161 CO -0.06 -1.19 0.11 0.14 0.04 0.00 0.00 177.00 176.04 2wva s VAL 162 N -3.05 0.59 -0.03 -0.36 -7.23 -0.73 -1.05 120.40 108.54 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 0.00 -0.10 -0.47 -0.31 0.00 0.00 175.10 174.77 2wva s TYR 163 N -3.61 1.00 0.02 2.82 5.04 -0.34 -1.69 117.35 120.59 2wva s TYR 163 Ca 0.36 -0.25 0.05 0.00 -2.44 0.00 0.00 57.07 54.79 2wva s TYR 163 Cb 0.07 -0.70 -0.02 0.00 0.35 0.00 0.00 41.96 41.66 2wva s TYR 163 CO 0.15 -0.10 -0.14 -0.51 -1.34 0.00 0.00 175.55 173.61 2wva s LEU 164 N 0.14 2.12 0.03 6.97 1.43 0.06 -1.21 118.68 128.22 2wva s LEU 164 Ca -0.03 -0.39 0.05 0.00 -1.03 0.00 0.00 54.13 52.74 2wva s LEU 164 Cb -0.08 -0.65 -0.02 0.00 0.03 0.00 0.00 46.19 45.46 2wva s LEU 164 CO 0.00 0.09 -0.15 -1.83 0.23 0.00 0.00 176.35 174.69 2wva s GLU 165 N -0.85 1.01 -0.08 1.70 -1.05 -0.85 -0.46 118.70 118.12 2wva s GLU 165 Ca 0.03 -0.75 0.01 0.00 -0.15 0.00 0.00 54.97 54.11 2wva s GLU 165 Cb -0.07 -1.03 0.02 0.00 -0.44 0.00 0.00 34.13 32.61 2wva s GLU 165 CO 0.01 0.26 -0.09 0.42 0.95 0.00 0.00 175.26 176.80 2wva s ILE 166 N -0.78 1.01 0.16 1.83 1.01 -0.47 -0.65 121.20 123.32 2wva s ILE 166 Ca 0.03 -0.35 -0.34 0.00 0.00 0.00 0.00 60.65 59.99 2wva s ILE 166 Cb -0.08 -0.98 -0.15 0.00 0.01 0.00 0.00 42.46 41.27 2wva s ILE 166 CO 0.01 0.35 1.45 0.00 0.00 0.00 0.00 174.94 176.75 2wva n ALA 167 N 4.35 0.61 0.30 9.38 0.00 -0.82 -1.55 120.51 132.79 2wva n ALA 167 Ca -0.18 0.46 0.17 0.00 0.00 0.00 0.00 53.44 53.88 2wva n ALA 167 Cb 0.51 -2.24 0.96 0.00 0.00 0.00 0.00 19.45 18.68 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 -3.56 2.12 -0.29 0.00 6.94 -1.26 -4.01 115.26 115.20 2wva n ASN 169 Ca -0.03 -1.76 0.06 0.00 -0.02 0.00 0.00 54.58 52.84 2wva n ASN 169 Cb 0.12 -0.11 0.00 0.00 -2.36 0.00 0.00 39.78 37.43 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 0.63 0.00 0.01 1.53 -5.35 -0.79 -4.65 119.36 110.74 2wva n ILE 170 Ca 0.17 -0.38 0.19 0.00 -0.27 0.00 0.00 62.75 62.47 2wva n ILE 170 Cb 0.42 1.15 0.68 0.00 -1.74 0.00 0.00 39.64 40.15 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 2.18 2.46 -0.28 -1.28 0.00 -1.70 -0.81 119.26 119.83 2wva h ALA 171 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2wva h ALA 171 Cb 0.43 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2wva h ALA 171 CO 0.00 -0.61 0.00 0.43 0.00 0.00 0.00 179.25 179.07 2wva n SER 172 N -4.39 3.08 -4.81 0.00 7.64 -1.26 -1.48 113.62 112.40 2wva n SER 172 Ca 0.09 -1.90 -0.36 0.00 1.01 0.00 0.00 58.87 57.71 2wva n SER 172 Cb 0.57 -0.18 -0.06 0.00 -1.01 0.00 0.00 64.21 63.53 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 -1.37 4.35 0.52 1.43 1.00 -0.31 -4.82 119.30 120.10 2wva s MET 173 Ca 0.31 1.04 -0.21 0.00 0.00 0.00 0.00 55.69 56.83 2wva s MET 173 Cb 0.19 -2.75 -0.06 0.00 0.00 0.00 0.00 34.83 32.21 2wva s MET 173 CO 0.26 0.29 1.21 -2.14 0.00 0.00 0.00 175.02 174.64 2wva s PRO 174 N -2.20 3.41 0.37 2.03 0.02 -1.26 -1.40 135.00 135.97 2wva s PRO 174 Ca 0.48 1.86 -0.06 0.00 0.02 0.00 0.00 61.00 63.31 2wva s PRO 174 Cb -0.16 -2.22 0.02 0.00 0.02 0.00 0.00 34.50 32.16 2wva s PRO 174 CO 0.21 -0.86 0.59 0.00 -0.33 0.00 0.00 177.00 176.61 2wva s ALA 176 N -2.65 0.32 0.15 0.00 0.00 -1.26 -4.22 121.76 114.09 2wva s ALA 176 Ca 0.26 0.09 -0.01 0.00 0.00 0.00 0.00 51.96 52.30 2wva s ALA 176 Cb -0.02 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 2wva s ALA 176 CO 0.19 -3.37 0.34 0.00 0.00 0.00 0.00 175.76 172.92 2wva s ALA 177 N -2.57 3.87 0.22 0.00 0.00 -1.26 -4.73 121.76 117.29 2wva s ALA 177 Ca 0.67 -0.78 -0.30 0.00 0.00 0.00 0.00 51.96 51.56 2wva s ALA 177 Cb -0.23 -1.98 -0.09 0.00 0.00 0.00 0.00 23.12 20.82 2wva s ALA 177 CO 0.62 0.59 1.23 -2.14 0.00 0.00 0.00 175.76 176.06 2wva s PRO 178 N -2.98 4.47 0.00 0.00 0.02 -1.26 -5.07 135.00 130.18 2wva s PRO 178 Ca 0.38 1.96 0.00 0.00 0.02 0.00 0.00 61.00 63.36 2wva s PRO 178 Cb -0.12 -3.20 0.00 0.00 0.02 0.00 0.00 34.50 31.21 2wva s PRO 178 CO 0.28 -0.10 0.00 0.41 -0.33 0.00 0.00 177.00 177.25 2wva n GLY 179 N 1.91 -1.75 3.77 0.52 0.00 -1.26 -4.99 105.19 103.38 2wva n GLY 179 Ca 0.03 -1.52 -0.41 0.00 0.00 0.00 0.00 46.02 44.13 2wva n GLY 179 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2wva s PRO 180 N -1.61 4.10 0.54 1.61 0.02 -1.26 -4.91 135.00 133.49 2wva s PRO 180 Ca 0.00 2.59 0.29 0.00 0.02 0.00 0.00 61.00 63.90 2wva s PRO 180 Cb 0.00 -2.98 1.45 0.00 0.02 0.00 0.00 34.50 32.99 2wva s PRO 180 CO 0.00 -0.58 1.93 0.00 -0.33 0.00 0.00 177.00 178.03 2wva h ALA 181 N 3.52 2.64 0.00 -1.55 0.00 -1.94 -2.50 119.26 119.42 2wva h ALA 181 Ca -0.50 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 2wva h ALA 181 Cb 1.23 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2wva h ALA 181 CO 0.68 -0.88 -0.06 0.66 0.00 0.00 0.00 179.25 179.65 2wva h SER 182 N 0.00 0.00 0.07 0.00 4.64 -1.93 -1.78 113.55 114.55 2wva h SER 182 Ca 0.33 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.64 2wva h SER 182 Cb 1.37 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2wva h SER 182 CO -0.00 0.06 -0.05 0.00 -0.87 0.00 0.00 176.83 175.97 2wva h ALA 183 N 1.94 1.72 0.00 5.18 0.00 -1.83 -2.71 119.26 123.56 2wva h ALA 183 Ca -0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2wva h ALA 183 Cb 0.14 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2wva h ALA 183 CO 0.01 0.06 -0.20 -0.07 0.00 0.00 0.00 179.25 179.05 2wva h LEU 184 N 0.00 0.00 -0.65 0.00 3.38 -1.52 -3.18 115.31 113.33 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 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2wva h LEU 184 CO 0.01 0.20 -0.65 0.49 0.09 0.00 0.00 178.44 178.58 2wva n PHE 185 N -3.20 0.00 -1.67 1.13 3.72 -1.04 -4.54 117.46 111.86 2wva n PHE 185 Ca 0.02 0.00 -0.46 0.00 -0.05 0.00 0.00 57.45 56.97 2wva n PHE 185 Cb 0.54 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.04 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 -0.53 3.74 -4.15 4.37 5.15 -1.13 -4.97 115.26 117.74 2wva n ASN 186 Ca 0.08 0.91 -0.10 0.00 -0.60 0.00 0.00 54.58 54.86 2wva n ASN 186 Cb 0.42 -1.44 -0.10 0.00 -0.53 0.00 0.00 39.78 38.13 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 4.45 1.01 0.67 1.20 2.15 -1.26 -5.02 116.67 119.88 2wva s ASP 187 Ca 0.92 -0.99 -0.15 0.00 0.43 0.00 0.00 52.55 52.76 2wva s ASP 187 Cb -0.57 0.11 0.01 0.00 -0.30 0.00 0.00 42.92 42.17 2wva s ASP 187 CO 0.47 -0.48 1.14 -1.83 -0.17 0.00 0.00 175.17 174.31 2wva s GLU 188 N -3.75 2.62 0.46 4.34 -1.05 -1.26 -5.04 118.70 115.02 2wva s GLU 188 Ca 0.10 1.53 0.02 0.00 -0.15 0.00 0.00 54.97 56.47 2wva s GLU 188 Cb 0.05 -1.92 0.01 0.00 -0.44 0.00 0.00 34.13 31.83 2wva s GLU 188 CO -0.05 -1.41 0.66 0.00 0.95 0.00 0.00 175.26 175.41 2wva s ALA 189 N -2.18 3.96 0.54 -0.84 0.00 -1.26 -5.06 121.76 116.92 2wva s ALA 189 Ca 0.70 -1.27 -0.21 0.00 0.00 0.00 0.00 51.96 51.17 2wva s ALA 189 Cb -0.24 -1.99 -0.06 0.00 0.00 0.00 0.00 23.12 20.83 2wva s ALA 189 CO 0.42 -0.43 1.21 0.43 0.00 0.00 0.00 175.76 177.38 2wva n SER 190 N -2.07 2.00 -4.66 0.00 7.64 -1.26 -4.92 113.62 110.34 2wva n SER 190 Ca 0.04 0.94 -0.43 0.00 1.01 0.00 0.00 58.87 60.44 2wva n SER 190 Cb 0.59 -1.50 -0.02 0.00 -1.01 0.00 0.00 64.21 62.26 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 -0.97 6.83 0.12 6.43 2.15 -0.15 -4.94 116.67 126.14 2wva s ASP 191 Ca 0.72 1.82 -0.22 0.00 0.43 0.00 0.00 52.55 55.30 2wva s ASP 191 Cb -0.44 -2.54 -0.04 0.00 -0.30 0.00 0.00 42.92 39.61 2wva s ASP 191 CO 0.50 -0.85 1.68 -0.08 -0.17 0.00 0.00 175.17 176.25 2wva h GLU 192 N 8.75 -0.16 -0.87 4.34 4.57 -1.91 0.13 114.58 129.43 2wva h GLU 192 Ca -0.30 0.01 0.08 0.00 -1.18 0.00 0.00 59.36 57.97 2wva h GLU 192 Cb 1.13 0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 29.69 2wva h GLU 192 CO 0.97 -0.11 0.53 0.00 -1.18 0.00 0.00 179.01 179.22 2wva h ALA 193 N 0.88 1.22 -0.22 2.92 0.00 -1.99 -1.19 119.26 120.88 2wva h ALA 193 Ca 0.08 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2wva h ALA 193 Cb 0.28 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2wva h ALA 193 CO -0.20 0.22 -0.15 0.77 0.00 0.00 0.00 179.25 179.89 2wva h SER 194 N 0.92 0.51 -0.20 0.00 0.02 -1.79 -1.09 113.55 111.92 2wva h SER 194 Ca 0.40 -0.44 0.05 0.00 -0.84 0.00 0.00 61.79 60.96 2wva h SER 194 Cb 0.26 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.60 2wva h SER 194 CO -0.21 0.84 -0.18 0.25 -1.14 0.00 0.00 176.83 176.40 2wva h LEU 195 N 0.18 -0.58 -0.63 5.07 5.85 -0.38 0.65 115.31 125.47 2wva h LEU 195 Ca 0.04 0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 2wva h LEU 195 Cb 0.67 0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.96 2wva h LEU 195 CO 0.04 -0.22 0.13 0.78 -0.34 0.00 0.00 178.44 178.83 2wva h ASN 196 N -0.19 0.98 -0.55 1.25 2.35 -1.22 -1.82 115.58 116.38 2wva h ASN 196 Ca 0.12 -0.24 -0.08 0.00 -0.55 0.00 0.00 56.30 55.54 2wva h ASN 196 Cb 0.38 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 2wva h ASN 196 CO -0.32 0.97 0.03 0.00 -1.65 0.00 0.00 177.43 176.46 2wva h ALA 197 N 1.04 0.95 -0.61 -0.83 0.00 -0.96 -1.14 119.26 117.72 2wva h ALA 197 Ca 0.20 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 2wva h ALA 197 Cb 0.39 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2wva h ALA 197 CO 0.01 0.64 0.03 0.00 0.00 0.00 0.00 179.25 179.92 2wva h ALA 198 N 1.10 0.90 -0.30 0.00 0.00 -0.63 -0.57 119.26 119.76 2wva h ALA 198 Ca 0.17 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 2wva h ALA 198 Cb 0.49 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2wva h ALA 198 CO 0.02 0.66 -0.03 0.28 0.00 0.00 0.00 179.25 180.18 2wva h VAL 199 N 0.96 1.27 0.00 0.00 2.07 -1.14 -2.02 116.25 117.39 2wva h VAL 199 Ca 0.18 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.67 2wva h VAL 199 Cb 0.52 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 2wva h VAL 199 CO 0.02 0.33 0.00 -0.33 0.02 0.00 0.00 177.57 177.61 2wva h GLU 200 N 0.33 0.00 0.02 1.57 4.39 -1.05 -0.79 114.58 119.06 2wva h GLU 200 Ca 0.08 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.56 2wva h GLU 200 Cb 0.50 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.14 2wva h GLU 200 CO 0.02 0.00 -0.95 0.93 -1.16 0.00 0.00 179.01 177.85 2wva h GLU 201 N 0.00 0.28 -0.48 2.33 4.39 -1.09 -2.74 114.58 117.28 2wva h GLU 201 Ca 0.00 -0.33 -0.13 0.00 0.34 0.00 0.00 59.36 59.24 2wva h GLU 201 Cb 0.72 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.45 2wva h GLU 201 CO 0.00 1.05 -0.21 1.15 -1.16 0.00 0.00 179.01 179.83 2wva h THR 202 N 0.15 1.27 -0.33 1.13 2.02 -0.57 -0.52 112.91 116.06 2wva h THR 202 Ca -0.07 -1.38 -0.03 0.00 0.77 0.00 0.00 66.41 65.71 2wva h THR 202 Cb 1.60 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 69.12 2wva h THR 202 CO 0.15 0.47 0.09 -0.07 0.37 0.00 0.00 175.52 176.54 2wva h LEU 203 N 0.84 0.49 -0.88 2.58 3.38 -1.24 -2.15 115.31 118.32 2wva h LEU 203 Ca 0.11 -0.22 0.07 0.00 0.09 0.00 0.00 57.88 57.92 2wva h LEU 203 Cb 0.79 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.34 2wva h LEU 203 CO 0.07 0.58 0.55 0.11 0.09 0.00 0.00 178.44 179.84 2wva h LYS 204 N 0.37 0.96 -0.52 1.13 1.57 -1.34 -1.07 116.57 117.68 2wva h LYS 204 Ca 0.10 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.74 2wva h LYS 204 Cb 0.28 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2wva h LYS 204 CO -0.00 0.64 -0.02 0.35 -0.57 0.00 0.00 179.45 179.85 2wva h PHE 205 N 0.99 0.95 -0.22 -1.35 3.57 -0.82 -2.94 116.94 117.13 2wva h PHE 205 Ca 0.39 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.74 2wva h PHE 205 Cb 0.19 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.68 2wva h PHE 205 CO -0.03 0.87 0.00 0.44 -2.23 0.00 0.00 178.31 177.36 2wva n ILE 206 N -4.19 0.27 -0.09 1.41 -5.35 -0.83 -4.49 119.36 106.09 2wva n ILE 206 Ca 0.03 -0.54 -0.07 0.00 -0.27 0.00 0.00 62.75 61.89 2wva n ILE 206 Cb 0.33 0.88 -0.01 0.00 -1.74 0.00 0.00 39.64 39.10 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 4.42 -0.09 -1.17 -1.28 0.00 -1.01 -2.72 119.26 117.41 2wva h ALA 207 Ca 0.00 0.10 -0.59 0.00 0.00 0.00 0.00 54.91 54.42 2wva h ALA 207 Cb 0.81 0.58 -0.40 0.00 0.00 0.00 0.00 17.79 18.77 2wva h ALA 207 CO 0.00 -0.66 -0.53 0.09 0.00 0.00 0.00 179.25 178.15 2wva n ASN 208 N -5.40 5.19 -3.70 0.00 3.02 -1.26 -4.83 115.26 108.28 2wva n ASN 208 Ca 0.01 -3.74 -0.30 0.00 -0.03 0.00 0.00 54.58 50.52 2wva n ASN 208 Cb 0.31 -0.49 -0.15 0.00 -0.61 0.00 0.00 39.78 38.84 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 -3.62 0.63 0.06 3.52 0.52 -1.03 -5.04 118.95 113.99 2wva s ARG 209 Ca 0.50 -1.00 0.03 0.00 -0.52 0.00 0.00 55.73 54.74 2wva s ARG 209 Cb 0.41 -1.84 -0.25 0.00 0.52 0.00 0.00 34.95 33.79 2wva s ARG 209 CO -0.11 -1.00 1.05 0.22 0.02 0.00 0.00 175.30 175.48 2wva h ASP 210 N 8.10 0.20 -1.84 0.23 3.58 -1.88 -3.40 116.42 121.41 2wva h ASP 210 Ca -0.14 -0.25 -0.66 0.00 0.42 0.00 0.00 57.03 56.40 2wva h ASP 210 Cb 1.01 -0.06 -0.14 0.00 1.72 0.00 0.00 39.33 41.85 2wva h ASP 210 CO 0.46 1.20 1.21 -0.54 -2.88 0.00 0.00 179.24 178.69 2wva s LYS 211 N -2.66 3.68 -0.23 0.28 1.02 -1.26 -2.71 119.74 117.85 2wva s LYS 211 Ca -0.04 -1.65 -0.11 0.00 0.02 0.00 0.00 55.97 54.19 2wva s LYS 211 Cb 0.08 -5.13 -0.05 0.00 -0.52 0.00 0.00 37.83 32.22 2wva s LYS 211 CO 0.84 -1.95 0.18 0.08 -0.92 0.00 0.00 175.35 173.58 2wva s VAL 212 N 3.45 5.35 0.03 3.17 1.01 -1.26 -0.09 120.40 132.05 2wva s VAL 212 Ca 0.40 0.23 0.04 0.00 0.00 0.00 0.00 61.98 62.65 2wva s VAL 212 Cb -0.02 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 2wva s VAL 212 CO -0.07 0.35 -0.08 0.00 0.00 0.00 0.00 175.10 175.29 2wva s ALA 213 N 1.00 2.97 -0.19 5.51 0.00 -0.01 -3.26 121.76 127.79 2wva s ALA 213 Ca 0.09 -1.08 -0.04 0.00 0.00 0.00 0.00 51.96 50.93 2wva s ALA 213 Cb -0.13 -1.05 -0.02 0.00 0.00 0.00 0.00 23.12 21.91 2wva s ALA 213 CO 0.04 0.62 -0.03 0.08 0.00 0.00 0.00 175.76 176.47 2wva s VAL 214 N -1.04 3.73 -0.32 0.00 1.01 0.14 -0.27 120.40 123.65 2wva s VAL 214 Ca 0.18 -0.40 -0.05 0.00 0.00 0.00 0.00 61.98 61.71 2wva s VAL 214 Cb -0.11 -2.66 0.04 0.00 0.00 0.00 0.00 36.38 33.65 2wva s VAL 214 CO 0.09 0.45 0.06 -0.22 0.00 0.00 0.00 175.10 175.48 2wva s LEU 215 N 0.87 4.12 -0.14 3.92 2.96 0.04 -0.60 118.68 129.85 2wva s LEU 215 Ca -0.00 -1.15 -0.27 0.00 -0.22 0.00 0.00 54.13 52.49 2wva s LEU 215 Cb -0.14 -1.81 -0.01 0.00 0.50 0.00 0.00 46.19 44.72 2wva s LEU 215 CO 0.02 -0.29 0.92 -0.69 -1.32 0.00 0.00 176.35 174.98 2wva s VAL 216 N 1.36 4.83 0.39 1.68 1.01 0.51 -0.46 120.40 129.72 2wva s VAL 216 Ca -0.03 1.84 0.08 0.00 0.00 0.00 0.00 61.98 63.87 2wva s VAL 216 Cb -0.19 -4.22 -0.01 0.00 0.00 0.00 0.00 36.38 31.95 2wva s VAL 216 CO 0.01 0.02 0.41 -0.83 0.00 0.00 0.00 175.10 174.71 2wva s GLY 217 N 1.11 1.96 0.00 4.51 0.00 0.89 -1.18 107.32 114.62 2wva s GLY 217 Ca 0.43 -1.74 0.23 0.00 0.00 0.00 0.00 44.72 43.64 2wva s GLY 217 CO 0.15 -1.59 1.86 -1.14 0.00 0.00 0.00 173.10 172.37 2wva n SER 218 N -1.58 0.12 -1.01 1.64 3.41 -1.07 -2.33 113.62 112.79 2wva n SER 218 Ca 0.03 -1.31 0.09 0.00 -0.26 0.00 0.00 58.87 57.41 2wva n SER 218 Cb 0.60 -0.01 0.24 0.00 -0.26 0.00 0.00 64.21 64.79 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 -0.77 2.75 -0.15 4.33 5.02 -0.47 -4.62 118.16 124.25 2wva n LYS 219 Ca 0.17 -2.35 -0.08 0.00 -2.02 0.00 0.00 58.31 54.03 2wva n LYS 219 Cb 0.10 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 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 3.26 0.54 -0.63 -0.35 5.85 -1.61 -1.66 115.31 120.70 2wva h LEU 220 Ca 0.00 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 2wva h LEU 220 Cb 0.87 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 2wva h LEU 220 CO 0.00 0.46 0.36 -0.09 -0.34 0.00 0.00 178.44 178.82 2wva h ARG 221 N 0.58 0.87 -0.01 1.25 2.43 -1.84 -2.43 114.38 115.23 2wva h ARG 221 Ca 0.16 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2wva h ARG 221 Cb 0.03 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.40 2wva h ARG 221 CO -0.03 0.65 -0.05 0.00 -1.51 0.00 0.00 179.97 179.03 2wva h ALA 222 N 1.17 1.89 -0.00 2.80 0.00 -1.73 0.16 119.26 123.55 2wva h ALA 222 Ca 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2wva h ALA 222 Cb 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2wva h ALA 222 CO -0.04 0.09 -0.02 0.00 0.00 0.00 0.00 179.25 179.28 2wva n ALA 223 N -2.53 2.46 -2.81 0.00 0.00 -0.67 -4.92 120.51 112.04 2wva n ALA 223 Ca -0.03 -0.14 -0.19 0.00 0.00 0.00 0.00 53.44 53.09 2wva n ALA 223 Cb 0.14 -1.47 0.02 0.00 0.00 0.00 0.00 19.45 18.15 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 1.38 -0.35 0.08 0.00 0.00 0.57 -4.51 105.19 102.37 2wva n GLY 224 Ca 0.11 -0.03 0.05 0.00 0.00 0.00 0.00 46.02 46.15 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 -3.06 2.15 -0.18 4.61 0.00 -0.96 -4.70 120.51 118.37 2wva n ALA 225 Ca -0.12 -1.71 -0.05 0.00 0.00 0.00 0.00 53.44 51.56 2wva n ALA 225 Cb 0.61 -0.20 0.05 0.00 0.00 0.00 0.00 19.45 19.92 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 0.14 0.57 -0.24 0.00 5.08 -1.88 -1.55 114.58 116.70 2wva h GLU 226 Ca 0.00 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 2wva h GLU 226 Cb 0.74 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2wva h GLU 226 CO 0.01 0.38 -0.21 1.49 -1.00 0.00 0.00 179.01 179.67 2wva h GLU 227 N 0.58 0.56 0.00 2.33 4.81 -1.93 -2.92 114.58 118.02 2wva h GLU 227 Ca 0.22 -0.29 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 2wva h GLU 227 Cb 0.07 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.45 2wva h GLU 227 CO -0.12 0.88 -0.15 0.00 -0.73 0.00 0.00 179.01 178.89 2wva h ALA 228 N 0.68 1.48 -0.23 2.92 0.00 -1.86 -2.34 119.26 119.91 2wva h ALA 228 Ca 0.04 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 2wva h ALA 228 Cb 0.76 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2wva h ALA 228 CO 0.05 0.18 -0.40 0.00 0.00 0.00 0.00 179.25 179.09 2wva h ALA 229 N 1.85 0.87 -0.28 0.00 0.00 -1.09 -1.11 119.26 119.51 2wva h ALA 229 Ca -0.00 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 2wva h ALA 229 Cb 0.32 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2wva h ALA 229 CO 0.02 0.64 0.02 0.28 0.00 0.00 0.00 179.25 180.21 2wva h VAL 230 N 0.45 1.25 -0.63 0.00 2.07 -1.32 0.28 116.25 118.34 2wva h VAL 230 Ca 0.04 -0.87 0.06 0.00 0.82 0.00 0.00 66.70 66.76 2wva h VAL 230 Cb 0.89 1.27 -0.06 0.00 -1.52 0.00 0.00 31.29 31.88 2wva h VAL 230 CO 0.08 0.28 0.33 0.11 0.02 0.00 0.00 177.57 178.38 2wva h LYS 231 N 0.27 0.59 -0.54 1.57 1.57 -1.31 -0.40 116.57 118.32 2wva h LYS 231 Ca 0.08 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 2wva h LYS 231 Cb 0.39 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 2wva h LYS 231 CO 0.01 0.39 -0.06 0.35 -0.57 0.00 0.00 179.45 179.57 2wva h PHE 232 N 0.61 1.10 -0.66 -1.35 3.57 -1.05 -2.43 116.94 116.73 2wva h PHE 232 Ca 0.29 -0.21 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 2wva h PHE 232 Cb 0.21 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 2wva h PHE 232 CO -0.09 1.01 0.10 0.00 -2.23 0.00 0.00 178.31 177.09 2wva h ALA 233 N 0.94 0.92 -0.53 2.41 0.00 -0.39 -0.65 119.26 121.96 2wva h ALA 233 Ca 0.15 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 2wva h ALA 233 Cb 0.61 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2wva h ALA 233 CO 0.04 0.66 -0.12 -0.44 0.00 0.00 0.00 179.25 179.40 2wva h ASP 234 N 1.02 1.00 -0.29 0.00 3.32 -1.03 -0.06 116.42 120.38 2wva h ASP 234 Ca 0.20 -0.33 -0.05 0.00 0.02 0.00 0.00 57.03 56.87 2wva h ASP 234 Cb 0.45 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2wva h ASP 234 CO 0.01 1.12 0.00 0.00 -1.72 0.00 0.00 179.24 178.66 2wva h ALA 235 N 0.97 0.39 -0.45 3.45 0.00 -1.15 -3.21 119.26 119.26 2wva h ALA 235 Ca 0.14 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 2wva h ALA 235 Cb 0.68 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2wva h ALA 235 CO 0.05 0.13 0.06 1.25 0.00 0.00 0.00 179.25 180.74 2wva h LEU 236 N 0.30 0.72 2.23 0.00 5.85 -1.06 -3.38 115.31 119.98 2wva h LEU 236 Ca 0.08 -0.27 -0.32 0.00 0.84 0.00 0.00 57.88 58.22 2wva h LEU 236 Cb 0.42 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 2wva h LEU 236 CO 0.01 0.81 -0.40 0.61 -0.34 0.00 0.00 178.44 179.13 2wva n GLY 237 N -0.48 -0.25 3.78 3.75 0.00 -0.04 -0.54 105.19 111.40 2wva n GLY 237 Ca 0.00 -0.22 -0.20 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.02 1.54 3.72 -0.02 0.00 -1.24 -3.90 105.19 104.27 2wva n GLY 238 Ca -0.19 -2.16 -0.42 0.00 0.00 0.00 0.00 46.02 43.26 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 -2.83 3.24 -0.18 4.61 0.00 -1.20 -4.75 121.76 120.65 2wva s ALA 239 Ca 0.61 0.62 0.00 0.00 0.00 0.00 0.00 51.96 53.19 2wva s ALA 239 Cb -0.04 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.75 2wva s ALA 239 CO 0.39 -0.19 -0.16 0.08 0.00 0.00 0.00 175.76 175.88 2wva s VAL 240 N 0.56 2.45 0.10 0.00 1.01 0.03 0.23 120.40 124.78 2wva s VAL 240 Ca 0.51 -0.82 0.10 0.00 0.00 0.00 0.00 61.98 61.77 2wva s VAL 240 Cb -0.24 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 2wva s VAL 240 CO 0.29 0.51 -0.25 0.00 0.00 0.00 0.00 175.10 175.66 2wva s ALA 241 N 1.14 2.18 -0.09 5.51 0.00 0.23 -0.79 121.76 129.93 2wva s ALA 241 Ca 0.01 -1.36 -0.04 0.00 0.00 0.00 0.00 51.96 50.57 2wva s ALA 241 Cb -0.14 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 2wva s ALA 241 CO -0.06 0.49 0.09 0.95 0.00 0.00 0.00 175.76 177.22 2wva s THR 242 N -1.02 5.02 0.73 0.00 -4.23 -1.01 -0.37 115.64 114.76 2wva s THR 242 Ca 0.11 -0.04 -0.12 0.00 -1.18 0.00 0.00 61.69 60.46 2wva s THR 242 Cb -0.10 -3.19 0.04 0.00 1.34 0.00 0.00 72.50 70.59 2wva s THR 242 CO 0.05 0.56 1.10 -0.04 -0.54 0.00 0.00 174.62 175.74 2wva s MET 243 N -1.14 2.46 0.22 3.99 -1.94 -0.32 -0.91 119.30 121.66 2wva s MET 243 Ca 0.16 1.23 -0.08 0.00 -1.71 0.00 0.00 55.69 55.29 2wva s MET 243 Cb -0.12 -1.92 0.34 0.00 2.01 0.00 0.00 34.83 35.14 2wva s MET 243 CO 0.06 -1.49 1.72 0.00 -0.01 0.00 0.00 175.02 175.30 2wva h ALA 244 N -0.73 0.84 0.00 3.03 0.00 -1.90 -0.60 119.26 119.90 2wva h ALA 244 Ca -0.45 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2wva h ALA 244 Cb 1.23 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2wva h ALA 244 CO 0.52 -0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.53 2wva n ALA 245 N -2.53 2.32 -0.21 0.00 0.00 -1.26 -2.82 120.51 116.00 2wva n ALA 245 Ca 0.10 -0.13 0.10 0.00 0.00 0.00 0.00 53.44 53.51 2wva n ALA 245 Cb 0.34 -1.41 0.25 0.00 0.00 0.00 0.00 19.45 18.63 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 -1.20 2.33 -1.68 0.00 0.00 -0.23 -4.70 120.51 115.02 2wva n ALA 246 Ca 0.14 -1.20 -0.55 0.00 0.00 0.00 0.00 53.44 51.83 2wva n ALA 246 Cb 0.17 -0.76 -0.07 0.00 0.00 0.00 0.00 19.45 18.79 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 1.27 1.27 -0.66 0.00 3.00 -1.13 -0.48 118.16 121.44 2wva n LYS 247 Ca 0.20 0.46 0.00 0.00 -0.00 0.00 0.00 58.31 58.97 2wva n LYS 247 Cb 0.55 -2.15 0.00 0.00 0.00 0.00 0.00 35.03 33.43 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 4.67 -0.33 -0.31 3.14 3.41 -1.26 -4.26 113.62 118.68 2wva n SER 248 Ca 0.24 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.97 2wva n SER 248 Cb 0.16 -0.06 0.58 0.00 -0.26 0.00 0.00 64.21 64.64 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 -2.11 0.06 -3.78 7.33 3.01 0.37 -4.75 117.46 117.59 2wva n PHE 249 Ca 0.00 -0.03 -0.13 0.00 1.01 0.00 0.00 57.45 58.30 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 -1.94 -0.28 0.07 1.38 5.36 -1.26 -4.82 117.98 116.49 2wva s PHE 250 Ca 0.37 0.67 -0.31 0.00 -0.96 0.00 0.00 56.93 56.70 2wva s PHE 250 Cb 0.19 0.10 -0.09 0.00 -0.34 0.00 0.00 43.02 42.88 2wva s PHE 250 CO 0.30 -0.15 1.73 -2.14 -1.46 0.00 0.00 175.22 173.50 2wva s PRO 251 N 0.06 4.17 0.00 10.12 0.02 -1.26 -4.90 135.00 143.21 2wva s PRO 251 Ca -0.01 2.42 0.28 0.00 0.02 0.00 0.00 61.00 63.71 2wva s PRO 251 Cb -0.02 -3.68 1.00 0.00 0.02 0.00 0.00 34.50 31.82 2wva s PRO 251 CO 0.01 -0.79 1.73 0.39 -0.33 0.00 0.00 177.00 178.00 2wva n GLU 252 N 5.92 0.49 0.00 5.54 1.02 -1.26 -2.84 120.64 129.50 2wva n GLU 252 Ca 0.17 -0.20 0.12 0.00 -0.02 0.00 0.00 57.16 57.23 2wva n GLU 252 Cb 0.40 -1.50 0.21 0.00 -0.02 0.00 0.00 31.44 30.53 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 -1.08 0.75 -1.89 3.49 1.02 -1.26 -4.88 120.64 116.79 2wva n GLU 253 Ca 0.11 -0.52 -0.42 0.00 -0.02 0.00 0.00 57.16 56.32 2wva n GLU 253 Cb 0.31 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.22 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 -2.61 6.52 0.47 1.62 3.84 -1.13 -4.87 114.94 118.78 2wva s ASN 254 Ca 0.19 2.78 0.31 0.00 0.21 0.00 0.00 52.86 56.35 2wva s ASN 254 Cb 0.18 -2.62 1.66 0.00 -0.55 0.00 0.00 41.25 39.93 2wva s ASN 254 CO 0.59 -0.82 1.93 -0.65 -2.79 0.00 0.00 177.10 175.36 2wva h PRO 255 N 5.40 0.00 0.00 0.43 0.11 -1.91 -1.76 132.00 134.28 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 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2wva h PRO 255 CO 0.82 0.00 -0.86 0.72 -0.21 0.00 0.00 178.00 178.47 2wva n HIS 256 N -2.59 0.22 -2.36 0.65 8.25 -1.26 -4.91 115.22 113.21 2wva n HIS 256 Ca -0.02 0.06 -0.43 0.00 -0.26 0.00 0.00 57.72 57.08 2wva n HIS 256 Cb 0.07 -0.38 -0.02 0.00 1.12 0.00 0.00 29.99 30.78 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 -3.13 2.89 -1.26 4.41 5.04 -0.66 -0.79 117.35 123.84 2wva s TYR 257 Ca 0.06 0.97 0.14 0.00 -2.44 0.00 0.00 57.07 55.80 2wva s TYR 257 Cb 0.15 -3.54 -0.01 0.00 0.35 0.00 0.00 41.96 38.91 2wva s TYR 257 CO 0.78 -1.89 0.77 0.44 -1.34 0.00 0.00 175.55 174.30 2wva n ILE 258 N 5.00 0.00 0.00 3.14 -5.35 0.03 -4.92 119.36 117.26 2wva n ILE 258 Ca 0.13 -0.34 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 2wva n ILE 258 Cb 0.45 1.16 0.00 0.00 -1.74 0.00 0.00 39.64 39.51 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 1.08 -0.33 3.71 3.28 0.00 -1.26 -4.80 105.19 106.87 2wva n GLY 259 Ca 0.06 -2.20 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 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 4.86 -0.41 2.61 2.01 -1.26 -2.40 115.64 121.05 2wva s THR 260 Ca 0.00 2.05 -0.14 0.00 0.31 0.00 0.00 61.69 63.91 2wva s THR 260 Cb 0.00 -4.31 0.02 0.00 0.01 0.00 0.00 72.50 68.22 2wva s THR 260 CO 0.00 0.13 0.28 -0.55 -0.69 0.00 0.00 174.62 173.80 2wva s SER 261 N 1.02 6.03 -0.42 3.53 0.15 -0.09 -1.64 113.70 122.29 2wva s SER 261 Ca 0.51 -0.94 0.08 0.00 0.70 0.00 0.00 55.95 56.30 2wva s SER 261 Cb -0.20 -2.13 0.33 0.00 -1.71 0.00 0.00 66.02 62.30 2wva s SER 261 CO 0.26 -0.45 0.94 1.87 1.20 0.00 0.00 173.24 177.06 2wva n TRP 262 N 5.13 -1.60 0.00 3.44 -0.00 -1.26 -4.08 117.44 119.06 2wva n TRP 262 Ca -0.11 -2.83 0.00 0.00 -0.00 0.00 0.00 57.50 54.55 2wva n TRP 262 Cb 0.47 0.76 0.00 0.00 -0.00 0.00 0.00 31.31 32.54 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 0.39 3.13 0.00 5.87 0.00 -1.26 -1.34 105.19 111.98 2wva n GLY 263 Ca 0.14 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.29 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 0.89 -0.55 1.61 0.28 -1.26 -2.37 120.64 133.24 2wva n GLU 264 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 57.03 2wva n GLU 264 Cb 0.00 -1.42 0.20 0.00 1.43 0.00 0.00 31.44 31.65 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 -0.92 2.31 -1.13 3.84 0.24 -0.45 -5.03 118.33 117.18 2wva n VAL 265 Ca 0.18 -2.57 -0.30 0.00 -2.04 0.00 0.00 64.34 59.61 2wva n VAL 265 Cb 0.08 -0.28 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 -2.61 3.57 0.78 -1.34 0.01 -1.00 -4.66 113.70 108.46 2wva s SER 266 Ca 0.41 1.65 -0.14 0.00 1.31 0.00 0.00 55.95 59.18 2wva s SER 266 Cb 0.36 -2.31 0.07 0.00 0.21 0.00 0.00 66.02 64.34 2wva s SER 266 CO 0.01 -2.60 1.22 -0.31 0.41 0.00 0.00 173.24 171.97 2wva s TYR 267 N -2.87 1.85 0.09 2.43 1.51 -0.65 -4.89 117.35 114.82 2wva s TYR 267 Ca 0.63 1.64 -0.35 0.00 -1.01 0.00 0.00 57.07 57.98 2wva s TYR 267 Cb -0.19 -3.52 -0.15 0.00 -0.11 0.00 0.00 41.96 38.00 2wva s TYR 267 CO 0.57 -2.86 1.55 -2.30 -1.11 0.00 0.00 175.55 171.40 2wva n PRO 268 N -3.06 1.82 0.00 -1.71 -0.02 -1.26 -1.88 135.00 128.89 2wva n PRO 268 Ca 0.14 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 2wva n PRO 268 Cb 0.50 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 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 3.30 2.96 0.19 -1.23 0.00 -1.26 -4.82 105.19 104.33 2wva n GLY 269 Ca 0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.11 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 1.21 -0.34 1.61 2.07 -1.69 -1.80 116.25 117.32 2wva h VAL 270 Ca 0.00 -0.69 0.03 0.00 0.82 0.00 0.00 66.70 66.87 2wva h VAL 270 Cb 0.00 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 2wva h VAL 270 CO 0.00 0.24 0.15 -0.08 0.02 0.00 0.00 177.57 177.90 2wva h GLU 271 N 0.48 0.30 -0.41 1.57 4.81 -1.85 -1.11 114.58 118.36 2wva h GLU 271 Ca 0.12 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.32 2wva h GLU 271 Cb 0.25 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2wva h GLU 271 CO -0.00 0.20 0.19 0.87 -0.73 0.00 0.00 179.01 179.54 2wva h LYS 272 N 0.31 0.60 -0.72 1.92 1.57 -1.92 -1.84 116.57 116.50 2wva h LYS 272 Ca 0.15 -0.09 0.06 0.00 -1.87 0.00 0.00 60.65 58.90 2wva h LYS 272 Cb 0.09 -0.11 -0.06 0.00 0.08 0.00 0.00 32.23 32.24 2wva h LYS 272 CO -0.13 0.53 0.41 1.15 -0.57 0.00 0.00 179.45 180.85 2wva h THR 273 N 0.53 0.98 -0.40 -0.16 2.02 -0.89 0.42 112.91 115.41 2wva h THR 273 Ca 0.14 -0.26 -0.12 0.00 0.77 0.00 0.00 66.41 66.95 2wva h THR 273 Cb 0.14 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.69 2wva h THR 273 CO -0.02 0.14 -0.22 0.24 0.37 0.00 0.00 175.52 176.03 2wva h MET 274 N 0.75 0.80 -0.26 6.66 2.86 -1.06 -1.22 114.93 123.46 2wva h MET 274 Ca 0.32 -0.32 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 2wva h MET 274 Cb 0.19 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 2wva h MET 274 CO -0.18 0.94 -0.14 -0.22 1.06 0.00 0.00 176.91 178.37 2wva h LYS 275 N 0.70 0.44 0.00 1.72 3.64 -0.78 -3.19 116.57 119.11 2wva h LYS 275 Ca 0.10 -0.13 -0.06 0.00 -1.27 0.00 0.00 60.65 59.29 2wva h LYS 275 Cb 0.74 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.50 2wva h LYS 275 CO 0.06 0.58 -0.70 0.93 -2.27 0.00 0.00 179.45 178.05 2wva h GLU 276 N 0.41 0.00 -6.67 1.90 4.39 -0.57 -3.47 114.58 110.57 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 0.50 0.00 0.11 0.00 -0.10 0.00 0.00 28.75 29.26 2wva h GLU 276 CO 0.03 0.19 0.37 0.00 -1.16 0.00 0.00 179.01 178.44 2wva n ALA 277 N -2.22 0.78 0.12 3.43 0.00 -0.49 -4.89 120.51 117.24 2wva n ALA 277 Ca -0.00 0.34 0.02 0.00 0.00 0.00 0.00 53.44 53.80 2wva n ALA 277 Cb 0.65 -2.18 0.01 0.00 0.00 0.00 0.00 19.45 17.94 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 2.23 0.00 -3.53 0.00 3.32 -0.85 -3.46 116.42 114.13 2wva h ASP 278 Ca -0.44 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.44 2wva h ASP 278 Cb 1.31 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.58 2wva h ASP 278 CO 0.61 0.49 -0.41 0.00 -1.72 0.00 0.00 179.24 178.21 2wva s ALA 279 N -2.97 -0.71 -0.20 3.45 0.00 -1.04 -4.72 121.76 115.57 2wva s ALA 279 Ca 0.03 1.02 -0.01 0.00 0.00 0.00 0.00 51.96 52.99 2wva s ALA 279 Cb 0.08 -0.62 0.01 0.00 0.00 0.00 0.00 23.12 22.59 2wva s ALA 279 CO 0.76 -0.18 -0.12 0.08 0.00 0.00 0.00 175.76 176.29 2wva s VAL 280 N 0.83 2.68 -0.52 0.00 1.01 0.32 -0.83 120.40 123.89 2wva s VAL 280 Ca -0.05 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 61.00 2wva s VAL 280 Cb -0.07 -2.20 0.09 0.00 0.00 0.00 0.00 36.38 34.21 2wva s VAL 280 CO -0.06 0.46 0.52 -0.63 0.00 0.00 0.00 175.10 175.39 2wva s ILE 281 N 1.37 5.10 -0.31 2.22 1.01 0.63 -0.70 121.20 130.52 2wva s ILE 281 Ca 0.05 -1.10 -0.21 0.00 0.00 0.00 0.00 60.65 59.39 2wva s ILE 281 Cb -0.14 -4.28 -0.00 0.00 0.01 0.00 0.00 42.46 38.04 2wva s ILE 281 CO -0.08 -0.80 0.67 0.00 0.00 0.00 0.00 174.94 174.73 2wva s ALA 282 N 1.96 3.52 -0.52 9.38 0.00 -0.38 -0.78 121.76 134.94 2wva s ALA 282 Ca 0.07 -0.62 -0.18 0.00 0.00 0.00 0.00 51.96 51.23 2wva s ALA 282 Cb -0.25 -3.16 0.08 0.00 0.00 0.00 0.00 23.12 19.78 2wva s ALA 282 CO 0.06 -1.14 0.58 -0.51 0.00 0.00 0.00 175.76 174.75 2wva s LEU 283 N 2.72 5.30 -1.23 0.00 1.43 0.39 -1.32 118.68 125.97 2wva s LEU 283 Ca 0.27 -1.19 -0.14 0.00 -1.03 0.00 0.00 54.13 52.04 2wva s LEU 283 Cb -0.15 -2.34 -0.00 0.00 0.03 0.00 0.00 46.19 43.73 2wva s LEU 283 CO 0.12 -0.88 0.67 0.00 0.23 0.00 0.00 176.35 176.49 2wva n ALA 284 N 5.92 -2.36 -2.11 4.21 0.00 0.14 -0.07 120.51 126.24 2wva n ALA 284 Ca -0.09 -0.25 -0.30 0.00 0.00 0.00 0.00 53.44 52.80 2wva n ALA 284 Cb 0.44 -3.16 -0.02 0.00 0.00 0.00 0.00 19.45 16.72 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 -6.19 3.71 -0.25 0.00 0.04 -1.26 -1.37 135.00 129.67 2wva s PRO 285 Ca 0.30 0.51 0.03 0.00 0.04 0.00 0.00 61.00 61.88 2wva s PRO 285 Cb -0.11 -2.30 0.06 0.00 0.04 0.00 0.00 34.50 32.19 2wva s PRO 285 CO 0.87 -0.20 -0.11 0.08 0.04 0.00 0.00 177.00 177.67 2wva s VAL 286 N -2.64 2.15 -0.54 -0.36 1.01 -1.26 -4.85 120.40 113.91 2wva s VAL 286 Ca 0.52 -1.58 -0.17 0.00 0.00 0.00 0.00 61.98 60.75 2wva s VAL 286 Cb -0.10 -2.24 0.11 0.00 0.00 0.00 0.00 36.38 34.14 2wva s VAL 286 CO 0.39 0.01 0.54 -0.36 0.00 0.00 0.00 175.10 175.67 2wva s PHE 287 N 1.12 3.18 0.08 5.22 0.08 -1.26 -4.81 117.98 121.59 2wva s PHE 287 Ca -0.08 -1.10 0.00 0.00 0.12 0.00 0.00 56.93 55.87 2wva s PHE 287 Cb -0.20 -3.72 -0.00 0.00 -0.57 0.00 0.00 43.02 38.54 2wva s PHE 287 CO -0.06 -1.04 0.00 0.27 -0.10 0.00 0.00 175.22 174.29 2wva n ASN 288 N 5.55 2.13 0.21 1.36 0.23 -1.26 -4.97 115.26 118.50 2wva n ASN 288 Ca -0.12 -1.37 0.07 0.00 -0.53 0.00 0.00 54.58 52.63 2wva n ASN 288 Cb 0.42 0.07 0.46 0.00 -2.08 0.00 0.00 39.78 38.64 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 0.21 0.00 0.12 0.53 2.03 -1.96 -2.28 116.42 115.06 2wva h ASP 289 Ca -0.07 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.01 2wva h ASP 289 Cb 0.21 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 38.74 2wva h ASP 289 CO 0.11 0.29 -0.93 1.88 -1.03 0.00 0.00 179.24 179.56 2wva h TYR 290 N 0.00 0.71 0.00 4.15 -1.99 -1.96 0.26 116.97 118.14 2wva h TYR 290 Ca -0.00 -0.47 0.00 0.00 2.00 0.00 0.00 58.73 60.26 2wva h TYR 290 Cb 0.67 -0.05 0.00 0.00 2.00 0.00 0.00 36.73 39.36 2wva h TYR 290 CO 0.00 1.34 0.00 -1.13 -0.00 0.00 0.00 178.16 178.37 2wva n SER 291 N -4.03 0.80 -1.25 3.88 3.41 -1.14 -1.95 113.62 113.35 2wva n SER 291 Ca -0.13 0.58 0.10 0.00 -0.26 0.00 0.00 58.87 59.16 2wva n SER 291 Cb 0.86 -0.79 0.30 0.00 -0.26 0.00 0.00 64.21 64.31 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 -2.26 1.11 -3.53 6.66 -2.24 -0.87 -4.77 114.28 108.39 2wva n THR 292 Ca 0.05 -1.03 -0.24 0.00 -2.27 0.00 0.00 64.05 60.56 2wva n THR 292 Cb 0.42 0.45 0.05 0.00 -2.10 0.00 0.00 70.33 69.15 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 1.36 -6.93 -2.55 4.28 -1.04 -0.82 -0.71 114.28 107.87 2wva n THR 293 Ca 0.22 -1.05 -0.11 0.00 -2.04 0.00 0.00 64.05 61.07 2wva n THR 293 Cb 0.62 -5.09 0.01 0.00 -1.82 0.00 0.00 70.33 64.06 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 -1.50 0.04 2.43 3.41 0.00 0.91 -2.86 105.19 107.61 2wva n GLY 294 Ca -0.11 -0.35 -0.15 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.91 -0.09 0.07 1.61 7.02 -1.10 -4.69 117.44 116.35 2wva n TRP 295 Ca -0.07 0.00 0.04 0.00 -1.02 0.00 0.00 57.50 56.45 2wva n TRP 295 Cb 0.57 -2.76 -0.04 0.00 -2.42 0.00 0.00 31.31 26.65 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 0.36 -3.11 -0.99 1.35 -1.14 -3.43 112.91 105.96 2wva h THR 296 Ca -0.32 -1.69 -0.62 0.00 -0.55 0.00 0.00 66.41 63.23 2wva h THR 296 Cb 1.04 1.90 -0.41 0.00 -1.73 0.00 0.00 68.15 68.94 2wva h THR 296 CO 0.46 0.21 -0.64 -0.62 -0.25 0.00 0.00 175.52 174.67 2wva s ASP 297 N -5.71 4.27 -0.14 5.36 2.15 0.11 -5.05 116.67 117.67 2wva s ASP 297 Ca -0.01 -3.39 -0.00 0.00 0.43 0.00 0.00 52.55 49.57 2wva s ASP 297 Cb 0.09 -1.47 -0.01 0.00 -0.30 0.00 0.00 42.92 41.22 2wva s ASP 297 CO 0.80 -0.16 -0.13 -0.63 -0.17 0.00 0.00 175.17 174.88 2wva s ILE 298 N -0.77 3.02 0.37 4.11 1.01 -1.26 -4.54 121.20 123.14 2wva s ILE 298 Ca 0.22 -0.67 -0.28 0.00 0.00 0.00 0.00 60.65 59.93 2wva s ILE 298 Cb -0.13 -2.27 -0.10 0.00 0.01 0.00 0.00 42.46 39.97 2wva s ILE 298 CO -0.10 0.52 1.42 -2.84 0.00 0.00 0.00 174.94 173.94 2wva s PRO 299 N 0.43 4.13 -0.05 2.79 0.02 -1.26 -4.88 135.00 136.18 2wva s PRO 299 Ca -0.10 2.43 -0.29 0.00 0.02 0.00 0.00 61.00 63.06 2wva s PRO 299 Cb -0.16 -2.95 -0.08 0.00 0.02 0.00 0.00 34.50 31.33 2wva s PRO 299 CO 0.05 -0.46 2.06 0.34 -0.33 0.00 0.00 177.00 178.66 2wva s ASP 300 N -0.32 6.10 0.46 2.53 -1.08 -1.26 -4.87 116.67 118.23 2wva s ASP 300 Ca 0.53 2.41 0.12 0.00 -0.52 0.00 0.00 52.55 55.09 2wva s ASP 300 Cb -0.44 -2.52 1.05 0.00 -1.46 0.00 0.00 42.92 39.55 2wva s ASP 300 CO 0.59 -1.37 2.08 -0.65 0.52 0.00 0.00 175.17 176.34 2wva h PRO 301 N 12.15 0.30 0.00 4.34 0.11 -1.96 -0.91 132.00 146.03 2wva h PRO 301 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2wva h PRO 301 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2wva h PRO 301 CO 0.95 0.20 0.00 1.63 -0.21 0.00 0.00 178.00 180.57 2wva n LYS 302 N -4.50 0.17 0.00 1.05 4.01 -1.26 -3.03 118.16 114.60 2wva n LYS 302 Ca 0.02 0.29 0.07 0.00 -0.51 0.00 0.00 58.31 58.18 2wva n LYS 302 Cb 0.12 -1.76 -0.02 0.00 -0.51 0.00 0.00 35.03 32.86 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 -2.07 1.98 -3.30 1.97 5.02 -0.37 -5.03 118.16 116.36 2wva n LYS 303 Ca 0.04 -0.57 -0.38 0.00 -2.02 0.00 0.00 58.31 55.38 2wva n LYS 303 Cb 0.30 -1.20 -0.06 0.00 -0.02 0.00 0.00 35.03 34.05 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 -2.07 4.28 -0.30 -0.35 2.96 -1.05 -0.52 118.68 121.62 2wva s LEU 304 Ca 0.10 0.83 -0.08 0.00 -0.22 0.00 0.00 54.13 54.76 2wva s LEU 304 Cb 0.11 -2.71 0.00 0.00 0.50 0.00 0.00 46.19 44.09 2wva s LEU 304 CO 0.40 -0.01 0.11 -0.69 -1.32 0.00 0.00 176.35 174.85 2wva s VAL 305 N 0.65 4.26 -0.50 1.68 1.01 0.12 -4.68 120.40 122.93 2wva s VAL 305 Ca 0.26 -0.55 -0.16 0.00 0.00 0.00 0.00 61.98 61.53 2wva s VAL 305 Cb -0.15 -3.17 0.09 0.00 0.00 0.00 0.00 36.38 33.15 2wva s VAL 305 CO 0.11 0.09 0.45 -0.22 0.00 0.00 0.00 175.10 175.52 2wva s LEU 306 N 1.55 5.78 -0.66 3.92 2.96 0.66 -1.25 118.68 131.65 2wva s LEU 306 Ca 0.04 -1.47 -0.06 0.00 -0.22 0.00 0.00 54.13 52.42 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 0.04 -0.74 0.51 0.00 -1.32 0.00 0.00 176.35 174.83 2wva s ALA 307 N 1.71 3.68 0.71 5.97 0.00 -0.43 -0.13 121.76 133.25 2wva s ALA 307 Ca 0.04 -3.19 -0.10 0.00 0.00 0.00 0.00 51.96 48.71 2wva s ALA 307 Cb -0.26 -2.88 0.03 0.00 0.00 0.00 0.00 23.12 20.02 2wva s ALA 307 CO 0.06 -2.12 1.06 -1.21 0.00 0.00 0.00 175.76 173.55 2wva s GLU 308 N 0.15 2.57 0.53 0.00 0.41 0.64 0.24 118.70 123.23 2wva s GLU 308 Ca 0.16 0.18 0.27 0.00 -0.41 0.00 0.00 54.97 55.17 2wva s GLU 308 Cb -0.18 -2.08 1.40 0.00 -1.78 0.00 0.00 34.13 31.49 2wva s GLU 308 CO -0.05 -1.12 1.96 -1.35 -0.49 0.00 0.00 175.26 174.21 2wva h PRO 309 N -0.64 0.03 0.00 0.39 0.11 -1.90 -3.15 132.00 126.84 2wva h PRO 309 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2wva h PRO 309 Cb 1.28 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2wva h PRO 309 CO 0.63 0.02 0.00 0.54 -0.21 0.00 0.00 178.00 178.98 2wva n ARG 310 N -4.35 1.05 -3.51 1.05 1.74 -1.26 -0.88 116.66 110.50 2wva n ARG 310 Ca 0.13 -0.83 -0.12 0.00 -0.77 0.00 0.00 57.85 56.26 2wva n ARG 310 Cb 0.72 -0.74 -0.03 0.00 -1.02 0.00 0.00 32.46 31.39 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 -0.38 -0.44 -0.05 0.55 1.04 -0.95 -1.72 113.70 111.76 2wva s SER 311 Ca 0.00 -0.09 0.03 0.00 0.48 0.00 0.00 55.95 56.37 2wva s SER 311 Cb 0.00 0.54 0.01 0.00 0.10 0.00 0.00 66.02 66.67 2wva s SER 311 CO 0.00 -0.90 -0.11 -0.69 0.98 0.00 0.00 173.24 172.52 2wva s VAL 312 N -3.61 1.02 -0.24 5.02 1.01 -0.64 -0.26 120.40 122.69 2wva s VAL 312 Ca 0.01 -0.45 -0.04 0.00 0.00 0.00 0.00 61.98 61.49 2wva s VAL 312 Cb 0.00 -0.92 -0.00 0.00 0.00 0.00 0.00 36.38 35.46 2wva s VAL 312 CO -0.11 0.32 -0.01 -0.69 0.00 0.00 0.00 175.10 174.61 2wva s VAL 313 N 0.41 3.50 -0.13 2.92 1.01 0.81 0.14 120.40 129.05 2wva s VAL 313 Ca -0.08 -0.59 -0.08 0.00 0.00 0.00 0.00 61.98 61.22 2wva s VAL 313 Cb -0.12 -2.67 0.05 0.00 0.00 0.00 0.00 36.38 33.63 2wva s VAL 313 CO 0.02 0.31 0.32 0.54 0.00 0.00 0.00 175.10 176.29 2wva s VAL 314 N 1.47 -0.03 -1.45 2.92 0.11 -0.52 -0.25 120.40 122.65 2wva s VAL 314 Ca 0.04 0.09 -0.01 0.00 -2.93 0.00 0.00 61.98 59.18 2wva s VAL 314 Cb -0.15 -0.48 0.00 0.00 -1.53 0.00 0.00 36.38 34.21 2wva s VAL 314 CO -0.02 0.04 0.14 -3.20 -3.33 0.00 0.00 175.10 168.73 2wva n ASN 315 N 3.94 -5.22 -0.74 3.54 5.15 -1.26 -1.79 115.26 118.88 2wva n ASN 315 Ca -0.22 -0.08 -0.08 0.00 -0.60 0.00 0.00 54.58 53.61 2wva n ASN 315 Cb 0.55 -4.24 -0.02 0.00 -0.53 0.00 0.00 39.78 35.54 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 -1.12 0.63 3.07 8.20 0.00 -1.26 -5.03 105.19 109.68 2wva n GLY 316 Ca -0.18 -0.63 -0.23 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.34 1.13 -0.20 -0.61 1.01 -0.74 -5.13 121.20 114.32 2wva s ILE 317 Ca 0.00 -0.55 -0.10 0.00 0.00 0.00 0.00 60.65 60.00 2wva s ILE 317 Cb 0.00 -0.99 -0.05 0.00 0.01 0.00 0.00 42.46 41.43 2wva s ILE 317 CO 0.00 0.34 0.14 -0.60 0.00 0.00 0.00 174.94 174.82 2wva s ARG 318 N 0.13 4.19 -0.50 2.79 3.52 -1.26 -1.44 118.95 126.38 2wva s ARG 318 Ca -0.04 -0.20 0.04 0.00 -0.13 0.00 0.00 55.73 55.40 2wva s ARG 318 Cb -0.10 -3.42 0.13 0.00 -1.56 0.00 0.00 34.95 29.99 2wva s ARG 318 CO 0.01 0.30 0.24 -0.06 -0.81 0.00 0.00 175.30 174.98 2wva s PHE 319 N 0.36 3.24 0.92 5.12 0.08 0.12 -5.00 117.98 122.83 2wva s PHE 319 Ca 0.09 -3.16 -0.12 0.00 0.12 0.00 0.00 56.93 53.86 2wva s PHE 319 Cb -0.11 -2.83 0.14 0.00 -0.57 0.00 0.00 43.02 39.65 2wva s PHE 319 CO -0.02 -0.76 1.09 -1.25 -0.10 0.00 0.00 175.22 174.18 2wva s PRO 320 N -0.18 1.03 -1.20 0.24 0.04 -1.26 -1.63 135.00 132.04 2wva s PRO 320 Ca 0.16 0.86 -0.01 0.00 0.04 0.00 0.00 61.00 62.06 2wva s PRO 320 Cb -0.25 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.51 2wva s PRO 320 CO -0.01 -2.41 0.11 0.43 0.04 0.00 0.00 177.00 175.16 2wva n SER 321 N -4.00 -4.49 -3.97 6.66 7.64 -0.76 -4.87 113.62 109.82 2wva n SER 321 Ca 0.07 -0.06 -0.31 0.00 1.01 0.00 0.00 58.87 59.58 2wva n SER 321 Cb 0.55 -3.57 -0.15 0.00 -1.01 0.00 0.00 64.21 60.02 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 -2.79 1.81 0.12 0.44 1.01 -0.70 -0.97 120.40 119.32 2wva s VAL 322 Ca 0.05 -1.61 -0.30 0.00 0.00 0.00 0.00 61.98 60.13 2wva s VAL 322 Cb -0.02 -2.12 -0.06 0.00 0.00 0.00 0.00 36.38 34.18 2wva s VAL 322 CO 0.07 -0.25 1.04 -1.00 0.00 0.00 0.00 175.10 174.95 2wva s HIS 323 N 1.22 3.69 0.34 5.22 3.76 -1.26 -2.24 115.29 126.02 2wva s HIS 323 Ca -0.01 1.67 0.08 0.00 -0.15 0.00 0.00 55.06 56.65 2wva s HIS 323 Cb -0.19 -3.17 0.80 0.00 1.11 0.00 0.00 32.58 31.13 2wva s HIS 323 CO -0.08 -0.24 1.83 1.25 -0.85 0.00 0.00 174.74 176.65 2wva h LEU 324 N 5.60 0.70 -0.48 0.89 5.85 -1.16 -0.76 115.31 125.95 2wva h LEU 324 Ca -0.43 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 2wva h LEU 324 Cb 1.21 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 2wva h LEU 324 CO 0.73 0.31 0.16 0.50 -0.34 0.00 0.00 178.44 179.80 2wva h LYS 325 N 0.71 0.74 -0.36 1.25 3.64 -1.84 -0.09 116.57 120.63 2wva h LYS 325 Ca 0.51 -0.15 -0.12 0.00 -1.27 0.00 0.00 60.65 59.61 2wva h LYS 325 Cb 0.83 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.54 2wva h LYS 325 CO -0.27 0.69 -0.26 -0.44 -2.27 0.00 0.00 179.45 176.91 2wva h ASP 326 N 0.64 0.85 -0.06 4.20 3.32 -1.59 -2.17 116.42 121.62 2wva h ASP 326 Ca 0.16 -0.44 0.01 0.00 0.02 0.00 0.00 57.03 56.78 2wva h ASP 326 Cb 0.26 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 2wva h ASP 326 CO -0.01 1.11 -0.01 0.22 -1.72 0.00 0.00 179.24 178.83 2wva h TYR 327 N 0.60 -0.02 -0.54 4.55 3.20 -1.06 -0.36 116.97 123.35 2wva h TYR 327 Ca 0.07 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.88 2wva h TYR 327 Cb 0.83 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 39.09 2wva h TYR 327 CO 0.06 -0.02 0.09 -0.07 -1.64 0.00 0.00 178.16 176.58 2wva h LEU 328 N 0.01 0.86 -0.14 2.82 3.38 -1.00 -0.99 115.31 120.24 2wva h LEU 328 Ca 0.03 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 2wva h LEU 328 Cb 0.04 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2wva h LEU 328 CO -0.05 0.90 0.05 0.74 0.09 0.00 0.00 178.44 180.16 2wva h THR 329 N 0.78 1.18 -0.62 0.22 2.02 -1.24 -0.19 112.91 115.06 2wva h THR 329 Ca 0.16 -0.54 -0.06 0.00 0.77 0.00 0.00 66.41 66.74 2wva h THR 329 Cb 0.41 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 68.06 2wva h THR 329 CO 0.01 0.16 0.13 -0.09 0.37 0.00 0.00 175.52 176.11 2wva h ARG 330 N 0.05 0.98 -0.62 6.66 9.65 -1.03 -2.90 114.38 127.16 2wva h ARG 330 Ca 0.05 -0.23 -0.08 0.00 -1.10 0.00 0.00 59.98 58.62 2wva h ARG 330 Cb 0.21 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.64 2wva h ARG 330 CO -0.00 0.88 0.07 1.25 2.80 0.00 0.00 179.97 184.96 2wva h LEU 331 N 0.93 1.02 -2.38 3.80 5.85 -0.99 -2.31 115.31 121.23 2wva h LEU 331 Ca 0.20 -0.28 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 2wva h LEU 331 Cb 0.35 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 2wva h LEU 331 CO 0.00 1.04 -0.03 0.00 -0.34 0.00 0.00 178.44 179.12 2wva h ALA 332 N 1.01 1.12 0.00 1.25 0.00 -0.83 -0.90 119.26 120.93 2wva h ALA 332 Ca 0.18 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 2wva h ALA 332 Cb 0.48 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2wva h ALA 332 CO 0.02 0.03 -0.48 1.96 0.00 0.00 0.00 179.25 180.78 2wva h GLN 333 N 0.00 0.00 0.00 0.00 4.20 -1.34 -3.40 115.11 114.58 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 0.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.96 2wva h GLN 333 CO 0.00 0.48 -1.13 1.63 -0.67 0.00 0.00 178.83 179.14 2wva n LYS 334 N -3.24 0.54 -2.45 1.46 5.02 -0.79 -5.04 118.16 113.66 2wva n LYS 334 Ca 0.02 -0.04 -0.35 0.00 -2.02 0.00 0.00 58.31 55.92 2wva n LYS 334 Cb 0.71 -1.08 -0.03 0.00 -0.02 0.00 0.00 35.03 34.62 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 -2.25 3.57 0.44 -0.18 0.11 -0.41 -5.05 120.40 116.63 2wva s VAL 335 Ca -0.01 1.04 0.08 0.00 -2.93 0.00 0.00 61.98 60.15 2wva s VAL 335 Cb 0.03 -3.46 -0.00 0.00 -1.53 0.00 0.00 36.38 31.42 2wva s VAL 335 CO 0.19 -0.15 0.47 -0.94 -3.33 0.00 0.00 175.10 171.33 2wva s SER 336 N -1.79 5.23 0.12 3.54 1.04 -1.26 -4.84 113.70 115.73 2wva s SER 336 Ca 0.66 -0.68 -0.32 0.00 0.48 0.00 0.00 55.95 56.10 2wva s SER 336 Cb -0.20 -0.49 -0.11 0.00 0.10 0.00 0.00 66.02 65.32 2wva s SER 336 CO 0.24 -0.76 1.81 0.29 0.98 0.00 0.00 173.24 175.80 2wva n LYS 337 N -1.70 2.71 -3.62 4.02 4.01 -1.26 -4.64 118.16 117.67 2wva n LYS 337 Ca 0.06 0.98 -0.27 0.00 -0.51 0.00 0.00 58.31 58.56 2wva n LYS 337 Cb 0.61 -2.86 -0.11 0.00 -0.51 0.00 0.00 35.03 32.16 2wva n LYS 337 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 2wva n LYS 338 N 5.35 1.00 0.00 1.97 4.76 0.30 -4.96 118.16 126.58 2wva n LYS 338 Ca 0.18 -3.81 0.15 0.00 -2.87 0.00 0.00 58.31 51.96 2wva n LYS 338 Cb 0.36 -1.96 0.70 0.00 -1.84 0.00 0.00 35.03 32.29 2wva n LYS 338 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 2wva n THR 339 N 2.36 0.00 -0.33 -0.18 -2.24 -1.25 -3.70 114.28 108.95 2wva n THR 339 Ca 0.25 -0.08 -0.01 0.00 -2.27 0.00 0.00 64.05 61.94 2wva n THR 339 Cb 0.42 -0.12 0.04 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 4.96 0.11 1.56 3.38 0.00 -1.81 0.12 103.07 111.38 2wva h GLY 340 Ca 0.00 0.47 -0.20 0.00 0.00 0.00 0.00 47.33 47.59 2wva h GLY 340 CO 0.00 -0.22 -0.82 0.00 0.00 0.00 0.00 176.54 175.50 2wva h ALA 341 N 1.35 0.49 -0.59 3.60 0.00 -1.76 -1.64 119.26 120.72 2wva h ALA 341 Ca 0.33 -0.65 -0.10 0.00 0.00 0.00 0.00 54.91 54.49 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 -0.90 0.78 -0.02 1.25 0.00 0.00 0.00 179.25 180.36 2wva h LEU 342 N 0.27 1.03 -0.39 0.00 5.85 -1.62 -0.44 115.31 120.01 2wva h LEU 342 Ca -0.05 -0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.32 2wva h LEU 342 Cb 1.42 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 42.16 2wva h LEU 342 CO 0.14 1.09 0.07 0.44 -0.34 0.00 0.00 178.44 179.84 2wva h ASP 343 N 0.95 0.61 -0.68 1.25 3.32 -0.74 -1.88 116.42 119.25 2wva h ASP 343 Ca 0.16 -0.26 0.05 0.00 0.02 0.00 0.00 57.03 57.01 2wva h ASP 343 Cb 0.58 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.91 2wva h ASP 343 CO 0.03 0.71 0.39 0.15 -1.72 0.00 0.00 179.24 178.81 2wva h PHE 344 N 0.48 0.72 -0.04 4.55 3.57 -1.13 -0.89 116.94 124.20 2wva h PHE 344 Ca 0.12 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.65 2wva h PHE 344 Cb 0.36 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 2wva h PHE 344 CO 0.02 0.36 -0.03 0.35 -2.23 0.00 0.00 178.31 176.78 2wva h PHE 345 N 0.73 -0.08 -0.90 0.41 3.57 -0.78 -2.73 116.94 117.16 2wva h PHE 345 Ca 0.30 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.84 2wva h PHE 345 Cb 0.16 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.89 2wva h PHE 345 CO -0.07 -0.05 0.59 0.87 -2.23 0.00 0.00 178.31 177.41 2wva h LYS 346 N -0.04 1.11 0.00 1.11 1.57 -1.02 -2.24 116.57 117.06 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 0.08 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.14 2wva h LYS 346 CO -0.06 0.74 0.00 -1.13 -0.57 0.00 0.00 179.45 178.42 2wva n SER 347 N -4.51 0.07 0.20 0.86 3.41 -0.37 -1.98 113.62 111.30 2wva n SER 347 Ca 0.11 0.52 0.09 0.00 -0.26 0.00 0.00 58.87 59.33 2wva n SER 347 Cb 0.08 -0.53 0.26 0.00 -0.26 0.00 0.00 64.21 63.76 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 -1.27 1.04 3.38 -1.12 -3.47 115.31 113.87 2wva h LEU 348 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 2wva h LEU 348 Cb 0.24 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.83 2wva h LEU 348 CO 0.00 0.22 -0.84 0.59 0.09 0.00 0.00 178.44 178.50 2wva n ASN 349 N -3.22 -2.78 0.11 -0.43 3.02 -0.84 -4.81 115.26 106.32 2wva n ASN 349 Ca 0.02 -0.99 0.12 0.00 -0.03 0.00 0.00 54.58 53.70 2wva n ASN 349 Cb 0.54 -2.92 0.45 0.00 -0.61 0.00 0.00 39.78 37.24 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 -4.42 1.99 0.00 5.41 0.00 -1.26 -5.00 120.51 117.22 2wva n ALA 350 Ca -0.01 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2wva n ALA 350 Cb 0.54 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.56 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 0.69 -2.41 3.94 0.00 0.00 -1.26 -4.79 105.19 101.37 2wva n GLY 351 Ca 0.04 -1.58 -0.24 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.79 2.29 0.00 1.61 2.56 -1.26 -4.76 118.70 118.35 2wva s GLU 352 Ca 0.00 -0.40 -0.30 0.00 0.00 0.00 0.00 54.97 54.27 2wva s GLU 352 Cb 0.00 -2.26 -0.07 0.00 2.00 0.00 0.00 34.13 33.80 2wva s GLU 352 CO 0.00 -1.10 1.73 -1.17 -0.56 0.00 0.00 175.26 174.16 2wva s LEU 353 N -5.12 4.36 -0.20 2.70 2.96 -1.26 -4.85 118.68 117.28 2wva s LEU 353 Ca 0.59 2.41 -0.29 0.00 -0.22 0.00 0.00 54.13 56.63 2wva s LEU 353 Cb -0.11 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 2wva s LEU 353 CO 0.43 -0.95 1.83 -0.75 -1.32 0.00 0.00 176.35 175.60 2wva s LYS 354 N 3.76 3.63 0.12 1.98 2.20 -1.26 -4.98 119.74 125.19 2wva s LYS 354 Ca 0.77 1.86 0.08 0.00 -0.36 0.00 0.00 55.97 58.32 2wva s LYS 354 Cb -0.37 -4.16 -0.04 0.00 -1.51 0.00 0.00 37.83 31.75 2wva s LYS 354 CO 0.33 -1.51 -0.13 0.15 -0.36 0.00 0.00 175.35 173.83 2wva s LYS 355 N 5.17 1.98 0.63 4.03 1.02 -1.26 -5.12 119.74 126.19 2wva s LYS 355 Ca 0.82 -1.13 -0.14 0.00 0.02 0.00 0.00 55.97 55.54 2wva s LYS 355 Cb -0.29 -2.20 -0.02 0.00 -0.52 0.00 0.00 37.83 34.80 2wva s LYS 355 CO 0.33 0.48 1.06 0.00 -0.92 0.00 0.00 175.35 176.30 2wva s ALA 356 N -1.27 2.71 0.37 5.17 0.00 -1.26 -5.06 121.76 122.42 2wva s ALA 356 Ca 0.21 0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.44 2wva s ALA 356 Cb -0.10 -3.21 -0.03 0.00 0.00 0.00 0.00 23.12 19.78 2wva s ALA 356 CO 0.13 -0.98 0.58 0.00 0.00 0.00 0.00 175.76 175.48 2wva s ALA 357 N -2.68 3.71 -0.41 0.00 0.00 -1.26 -4.98 121.76 116.13 2wva s ALA 357 Ca 0.61 -0.94 -0.44 0.00 0.00 0.00 0.00 51.96 51.20 2wva s ALA 357 Cb -0.15 -2.12 -0.18 0.00 0.00 0.00 0.00 23.12 20.67 2wva s ALA 357 CO 0.44 -0.10 1.71 -2.30 0.00 0.00 0.00 175.76 175.51 2wva n PRO 358 N -1.85 0.48 -1.56 0.00 -0.02 -1.26 -4.91 135.00 125.88 2wva n PRO 358 Ca -0.03 0.17 -0.31 0.00 -2.02 0.00 0.00 63.50 61.31 2wva n PRO 358 Cb 0.56 -1.76 0.06 0.00 -0.02 0.00 0.00 33.50 32.34 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 3.54 2.61 -0.02 3.55 0.00 -1.26 -4.95 121.76 125.22 2wva s ALA 359 Ca 1.04 0.05 -0.31 0.00 0.00 0.00 0.00 51.96 52.73 2wva s ALA 359 Cb -1.32 -3.17 -0.09 0.00 0.00 0.00 0.00 23.12 18.54 2wva s ALA 359 CO 0.74 -1.31 1.98 -3.47 0.00 0.00 0.00 175.76 173.70 2wva n ASP 360 N -3.19 3.90 -0.23 0.00 2.03 -1.26 -4.86 116.55 112.93 2wva n ASP 360 Ca 0.07 0.85 0.20 0.00 0.52 0.00 0.00 54.79 56.44 2wva n ASP 360 Cb 0.54 -1.49 0.53 0.00 -0.72 0.00 0.00 41.12 39.98 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 10.67 0.36 -0.01 -0.67 0.11 -1.93 0.69 132.00 141.22 2wva h PRO 361 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2wva h PRO 361 Cb 1.25 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2wva h PRO 361 CO 0.95 0.24 -0.19 -1.13 -0.21 0.00 0.00 178.00 177.66 2wva n SER 362 N -4.49 1.41 -4.79 -2.05 3.41 -1.26 -0.31 113.62 105.53 2wva n SER 362 Ca 0.19 -1.22 -0.34 0.00 -0.26 0.00 0.00 58.87 57.24 2wva n SER 362 Cb 0.71 0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 64.75 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 -2.31 2.88 0.24 7.33 0.00 0.23 -4.94 121.76 125.20 2wva s ALA 363 Ca 0.28 0.64 -0.30 0.00 0.00 0.00 0.00 51.96 52.57 2wva s ALA 363 Cb 0.20 -3.26 -0.14 0.00 0.00 0.00 0.00 23.12 19.91 2wva s ALA 363 CO 0.45 -0.34 1.19 -2.30 0.00 0.00 0.00 175.76 174.76 2wva n PRO 364 N -0.90 1.54 -1.98 0.00 -0.02 -1.26 -3.67 135.00 128.70 2wva n PRO 364 Ca 0.09 0.54 -0.41 0.00 -2.02 0.00 0.00 63.50 61.70 2wva n PRO 364 Cb 0.52 -2.05 -0.02 0.00 -0.02 0.00 0.00 33.50 31.93 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 0.30 4.38 0.26 2.45 2.96 -0.03 -4.79 118.68 124.20 2wva s LEU 365 Ca 0.66 2.72 0.08 0.00 -0.22 0.00 0.00 54.13 57.37 2wva s LEU 365 Cb -0.72 -3.63 -0.05 0.00 0.50 0.00 0.00 46.19 42.29 2wva s LEU 365 CO 0.55 -0.72 -0.13 0.68 -1.32 0.00 0.00 176.35 175.41 2wva s VAL 366 N -0.12 1.92 0.19 1.68 -7.23 -1.26 -4.66 120.40 110.91 2wva s VAL 366 Ca 0.59 -2.23 -0.12 0.00 -1.81 0.00 0.00 61.98 58.41 2wva s VAL 366 Cb -0.43 -2.28 0.10 0.00 0.56 0.00 0.00 36.38 34.33 2wva s VAL 366 CO 0.45 -0.43 1.75 -1.13 -0.31 0.00 0.00 175.10 175.43 2wva h ASN 367 N 2.36 0.19 -0.69 4.85 -1.24 -1.95 -2.07 115.58 117.03 2wva h ASN 367 Ca -0.39 0.06 0.04 0.00 0.71 0.00 0.00 56.30 56.71 2wva h ASN 367 Cb 1.24 0.04 -0.04 0.00 0.73 0.00 0.00 38.32 40.29 2wva h ASN 367 CO 0.64 0.14 0.46 0.00 -1.29 0.00 0.00 177.43 177.37 2wva h ALA 368 N 1.34 1.62 -0.51 1.57 0.00 -1.96 -1.43 119.26 119.89 2wva h ALA 368 Ca 0.25 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 2wva h ALA 368 Cb 0.26 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2wva h ALA 368 CO -0.25 0.30 -0.14 1.49 0.00 0.00 0.00 179.25 180.66 2wva h GLU 369 N 0.82 0.97 -0.05 0.00 4.57 -1.77 0.42 114.58 119.53 2wva h GLU 369 Ca 0.28 -0.37 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 2wva h GLU 369 Cb 0.09 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.62 2wva h GLU 369 CO -0.08 1.04 0.03 0.82 -1.18 0.00 0.00 179.01 179.64 2wva h ILE 370 N 0.86 1.06 -0.96 2.32 2.04 -1.15 -2.07 117.51 119.61 2wva h ILE 370 Ca 0.13 -0.16 0.02 0.00 1.00 0.00 0.00 64.86 65.85 2wva h ILE 370 Cb 0.69 1.07 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 2wva h ILE 370 CO 0.05 0.05 0.63 0.00 0.00 0.00 0.00 178.15 178.88 2wva h ALA 371 N 0.96 1.33 -0.00 1.87 0.00 -1.06 -1.16 119.26 121.20 2wva h ALA 371 Ca 0.02 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2wva h ALA 371 Cb 0.05 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 2wva h ALA 371 CO -0.00 0.61 0.00 -0.09 0.00 0.00 0.00 179.25 179.76 2wva h ARG 372 N 1.28 0.00 -0.38 0.00 2.43 -0.74 -1.06 114.38 115.90 2wva h ARG 372 Ca 0.36 -0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.41 2wva h ARG 372 Cb -0.11 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 2wva h ARG 372 CO -0.09 0.07 -0.25 1.96 -1.51 0.00 0.00 179.97 180.16 2wva h GLN 373 N -0.07 0.78 -0.44 0.20 4.20 -1.01 -1.53 115.11 117.23 2wva h GLN 373 Ca 0.00 -0.33 -0.04 0.00 0.06 0.00 0.00 58.65 58.34 2wva h GLN 373 Cb 0.07 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 2wva h GLN 373 CO -0.00 0.94 0.12 0.28 -0.67 0.00 0.00 178.83 179.50 2wva h VAL 374 N 0.67 1.23 -0.64 -0.54 2.07 -1.18 -2.57 116.25 115.29 2wva h VAL 374 Ca 0.09 -0.78 0.01 0.00 0.82 0.00 0.00 66.70 66.84 2wva h VAL 374 Cb 0.77 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 2wva h VAL 374 CO 0.06 0.28 0.42 -0.08 0.02 0.00 0.00 177.57 178.27 2wva h GLU 375 N 0.58 0.82 0.00 1.57 4.81 -0.85 -0.52 114.58 120.99 2wva h GLU 375 Ca 0.14 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2wva h GLU 375 Cb 0.30 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2wva h GLU 375 CO -0.00 0.54 0.00 0.00 -0.73 0.00 0.00 179.01 178.82 2wva n ALA 376 N -2.44 1.72 0.83 2.92 0.00 -0.61 -1.94 120.51 121.00 2wva n ALA 376 Ca 0.07 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.61 2wva n ALA 376 Cb 0.06 -1.29 0.28 0.00 0.00 0.00 0.00 19.45 18.50 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 -1.68 0.52 -4.68 0.00 4.77 -0.21 -4.91 117.00 110.81 2wva n LEU 377 Ca 0.03 0.17 -0.42 0.00 -0.03 0.00 0.00 56.01 55.76 2wva n LEU 377 Cb 0.20 -0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 41.00 2wva n LEU 377 CO 0.16 0.03 1.18 -0.76 -1.33 0.00 0.00 177.39 176.68 2wva s LEU 378 N -3.50 4.30 0.31 2.23 1.43 -0.82 -4.97 118.68 117.65 2wva s LEU 378 Ca 0.10 2.11 0.06 0.00 -1.03 0.00 0.00 54.13 55.36 2wva s LEU 378 Cb 0.16 -3.55 -0.06 0.00 0.03 0.00 0.00 46.19 42.77 2wva s LEU 378 CO 0.68 -0.78 -0.02 0.42 0.23 0.00 0.00 176.35 176.88 2wva s THR 379 N 2.91 1.55 -0.99 5.49 -4.23 -1.26 -4.80 115.64 114.30 2wva s THR 379 Ca 0.65 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 59.09 2wva s THR 379 Cb -0.31 -2.61 0.00 0.00 1.34 0.00 0.00 72.50 70.92 2wva s THR 379 CO 0.26 -0.18 0.99 -2.65 -0.54 0.00 0.00 174.62 172.50 2wva n PRO 380 N -0.65 0.00 -0.31 3.99 -0.02 -1.26 -0.74 135.00 136.00 2wva n PRO 380 Ca -0.04 0.49 0.08 0.00 -2.02 0.00 0.00 63.50 62.01 2wva n PRO 380 Cb 0.65 -1.51 0.24 0.00 -0.02 0.00 0.00 33.50 32.86 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 -1.49 3.54 -4.88 2.55 5.15 -1.26 -3.41 115.26 115.46 2wva n ASN 381 Ca 0.00 -2.09 -0.31 0.00 -0.60 0.00 0.00 54.58 51.57 2wva n ASN 381 Cb 0.01 -0.38 -0.05 0.00 -0.53 0.00 0.00 39.78 38.83 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 -1.17 5.18 -0.08 -0.44 2.01 0.08 -1.64 115.64 119.58 2wva s THR 382 Ca 0.36 -0.45 0.02 0.00 0.31 0.00 0.00 61.69 61.93 2wva s THR 382 Cb 0.20 -3.50 0.02 0.00 0.01 0.00 0.00 72.50 69.22 2wva s THR 382 CO 0.23 0.16 -0.11 -0.89 -0.69 0.00 0.00 174.62 173.32 2wva s THR 383 N -1.45 1.09 -0.28 -0.82 2.01 -0.28 -0.77 115.64 115.15 2wva s THR 383 Ca 0.33 -0.42 -0.09 0.00 0.31 0.00 0.00 61.69 61.81 2wva s THR 383 Cb -0.13 -1.02 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 2wva s THR 383 CO 0.25 0.35 0.13 -0.69 -0.69 0.00 0.00 174.62 173.98 2wva s VAL 384 N 0.91 4.73 -0.33 3.82 1.01 0.04 -0.51 120.40 130.06 2wva s VAL 384 Ca -0.10 -0.14 -0.21 0.00 0.00 0.00 0.00 61.98 61.53 2wva s VAL 384 Cb -0.15 -3.29 -0.00 0.00 0.00 0.00 0.00 36.38 32.94 2wva s VAL 384 CO 0.01 0.23 0.69 -0.63 0.00 0.00 0.00 175.10 175.39 2wva s ILE 385 N 1.66 4.86 -0.30 2.22 -1.09 0.59 -0.60 121.20 128.55 2wva s ILE 385 Ca 0.06 0.83 -0.07 0.00 -2.23 0.00 0.00 60.65 59.25 2wva s ILE 385 Cb -0.16 -4.09 0.01 0.00 -1.58 0.00 0.00 42.46 36.65 2wva s ILE 385 CO 0.07 -0.27 0.08 0.00 -1.23 0.00 0.00 174.94 173.59 2wva s ALA 386 N 2.79 3.05 0.48 9.38 0.00 -0.76 -1.07 121.76 135.62 2wva s ALA 386 Ca 0.27 -1.48 -0.20 0.00 0.00 0.00 0.00 51.96 50.55 2wva s ALA 386 Cb -0.14 -2.14 -0.08 0.00 0.00 0.00 0.00 23.12 20.75 2wva s ALA 386 CO 0.14 -0.96 1.04 -2.00 0.00 0.00 0.00 175.76 173.98 2wva s GLU 387 N 1.48 3.80 0.12 0.00 2.56 -0.50 -4.53 118.70 121.64 2wva s GLU 387 Ca 0.02 1.37 -0.35 0.00 0.00 0.00 0.00 54.97 56.01 2wva s GLU 387 Cb -0.17 -2.10 -0.15 0.00 2.00 0.00 0.00 34.13 33.70 2wva s GLU 387 CO 0.02 -0.43 1.49 2.41 -0.56 0.00 0.00 175.26 178.19 2wva n THR 388 N -0.95 0.01 0.00 -1.70 -1.04 -1.26 -2.90 114.28 106.44 2wva n THR 388 Ca 0.09 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 2wva n THR 388 Cb 0.52 -1.25 0.00 0.00 -1.82 0.00 0.00 70.33 67.78 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 3.08 0.80 0.27 3.41 0.00 -1.26 -4.80 105.19 106.69 2wva n GLY 389 Ca 0.18 -2.02 0.18 0.00 0.00 0.00 0.00 46.02 44.36 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 0.14 1.61 3.58 -1.96 -1.19 116.42 118.60 2wva h ASP 390 Ca 0.00 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.43 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 -0.09 0.28 -2.88 0.00 0.00 179.24 176.55 2wva h SER 391 N 0.00 0.00 -0.29 2.28 0.02 -1.87 -0.11 113.55 113.58 2wva h SER 391 Ca 0.00 0.00 0.07 0.00 -0.84 0.00 0.00 61.79 61.02 2wva h SER 391 Cb 0.16 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.63 2wva h SER 391 CO 0.00 0.09 -0.16 -0.50 -1.14 0.00 0.00 176.83 175.11 2wva h TRP 392 N 0.00 -0.41 0.10 3.45 4.06 -1.08 -1.48 115.95 120.60 2wva h TRP 392 Ca -0.00 0.03 -0.28 0.00 2.06 0.00 0.00 58.89 60.70 2wva h TRP 392 Cb 0.18 0.22 0.02 0.00 -1.00 0.00 0.00 29.16 28.59 2wva h TRP 392 CO 0.00 -0.24 -1.19 0.74 -3.56 0.00 0.00 178.44 174.19 2wva h PHE 393 N -0.13 0.85 -0.36 0.49 0.04 -1.32 -2.08 116.94 114.43 2wva h PHE 393 Ca 0.15 -0.54 0.04 0.00 2.80 0.00 0.00 57.97 60.42 2wva h PHE 393 Cb 0.36 -0.07 -0.04 0.00 2.20 0.00 0.00 35.95 38.41 2wva h PHE 393 CO -0.35 1.38 0.14 -0.91 -0.60 0.00 0.00 178.31 177.97 2wva h ASN 394 N 0.23 0.18 -0.85 2.17 2.35 -1.07 -2.72 115.58 115.88 2wva h ASN 394 Ca -0.16 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.59 2wva h ASN 394 Cb 1.86 0.01 -0.04 0.00 0.05 0.00 0.00 38.32 40.20 2wva h ASN 394 CO 0.22 0.14 0.42 0.00 -1.65 0.00 0.00 177.43 176.56 2wva h ALA 395 N 1.22 1.13 0.00 -0.83 0.00 -1.25 -2.78 119.26 116.75 2wva h ALA 395 Ca 0.16 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2wva h ALA 395 Cb 0.11 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2wva h ALA 395 CO -0.15 0.66 -0.08 0.37 0.00 0.00 0.00 179.25 180.06 2wva h GLN 396 N 1.22 0.00 -0.00 0.00 5.75 -1.08 -1.78 115.11 119.21 2wva h GLN 396 Ca 0.30 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.80 2wva h GLN 396 Cb 0.10 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.65 2wva h GLN 396 CO -0.04 0.08 -0.07 0.54 -2.65 0.00 0.00 178.83 176.68 2wva n ARG 397 N -4.08 0.85 -3.16 1.69 1.74 -1.05 -4.88 116.66 107.78 2wva n ARG 397 Ca -0.03 -0.28 -0.39 0.00 -0.77 0.00 0.00 57.85 56.38 2wva n ARG 397 Cb 0.16 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.05 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 -2.34 4.37 -0.04 5.56 -1.94 -0.67 -5.04 119.30 119.19 2wva s MET 398 Ca 0.33 0.76 -0.30 0.00 -1.71 0.00 0.00 55.69 54.77 2wva s MET 398 Cb 0.20 -3.39 -0.03 0.00 2.01 0.00 0.00 34.83 33.63 2wva s MET 398 CO 0.44 0.24 1.04 0.21 -0.01 0.00 0.00 175.02 176.95 2wva s LYS 399 N 0.23 4.47 -0.25 2.03 2.47 -1.26 -5.03 119.74 122.40 2wva s LYS 399 Ca 0.33 1.48 -0.10 0.00 -1.56 0.00 0.00 55.97 56.12 2wva s LYS 399 Cb -0.18 -3.49 -0.05 0.00 -1.46 0.00 0.00 37.83 32.65 2wva s LYS 399 CO 0.17 -0.23 0.15 -0.51 0.16 0.00 0.00 175.35 175.09 2wva s LEU 400 N 1.56 3.95 0.65 5.43 1.43 -1.26 -5.00 118.68 125.44 2wva s LEU 400 Ca 0.52 0.02 -0.18 0.00 -1.03 0.00 0.00 54.13 53.46 2wva s LEU 400 Cb -0.21 -2.07 -0.01 0.00 0.03 0.00 0.00 46.19 43.93 2wva s LEU 400 CO 0.23 0.03 1.30 -2.65 0.23 0.00 0.00 176.35 175.49 2wva n PRO 401 N 4.55 1.13 -1.69 1.29 -0.02 -1.26 -4.41 135.00 134.59 2wva n PRO 401 Ca -0.15 0.44 -0.44 0.00 -2.02 0.00 0.00 63.50 61.34 2wva n PRO 401 Cb 0.52 -2.54 -0.03 0.00 -0.02 0.00 0.00 33.50 31.43 2wva n PRO 401 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2wva n ASN 402 N -1.89 3.72 0.00 2.55 4.13 -1.26 -1.68 115.26 120.83 2wva n ASN 402 Ca 0.16 1.04 0.00 0.00 1.68 0.00 0.00 54.58 57.46 2wva n ASN 402 Cb 0.48 -1.51 0.00 0.00 -1.54 0.00 0.00 39.78 37.21 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 3.91 2.56 3.77 7.41 0.00 -1.26 -4.46 105.19 117.12 2wva n GLY 403 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.46 3.26 0.09 4.61 0.00 -0.67 -4.59 121.76 122.00 2wva s ALA 404 Ca 0.00 0.97 0.09 0.00 0.00 0.00 0.00 51.96 53.02 2wva s ALA 404 Cb 0.00 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 2wva s ALA 404 CO 0.00 -0.43 -0.22 1.03 0.00 0.00 0.00 175.76 176.14 2wva s ARG 405 N -2.03 1.72 -0.07 0.00 1.81 0.05 -4.88 118.95 115.56 2wva s ARG 405 Ca 0.53 -1.18 0.06 0.00 -1.72 0.00 0.00 55.73 53.41 2wva s ARG 405 Cb -0.32 -2.04 -0.01 0.00 -0.45 0.00 0.00 34.95 32.14 2wva s ARG 405 CO 0.40 0.49 -0.25 0.08 -0.68 0.00 0.00 175.30 175.34 2wva s VAL 406 N -1.01 2.06 -0.20 3.52 1.01 -1.26 -0.78 120.40 123.74 2wva s VAL 406 Ca 0.15 -1.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.03 2wva s VAL 406 Cb -0.10 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.51 2wva s VAL 406 CO 0.06 0.57 -0.02 -1.61 0.00 0.00 0.00 175.10 174.10 2wva s GLU 407 N -0.05 3.52 0.09 2.72 0.41 0.24 -4.84 118.70 120.79 2wva s GLU 407 Ca -0.07 -0.57 0.09 0.00 -0.41 0.00 0.00 54.97 54.01 2wva s GLU 407 Cb -0.15 -3.02 -0.04 0.00 -1.78 0.00 0.00 34.13 29.14 2wva s GLU 407 CO 0.05 -0.05 -0.24 0.71 -0.49 0.00 0.00 175.26 175.25 2wva s TYR 408 N 1.12 2.39 -0.52 1.61 2.02 -1.26 -1.84 117.35 120.88 2wva s TYR 408 Ca 0.02 -0.35 0.05 0.00 -0.37 0.00 0.00 57.07 56.42 2wva s TYR 408 Cb -0.15 -1.34 0.38 0.00 -0.40 0.00 0.00 41.96 40.45 2wva s TYR 408 CO 0.00 0.27 1.07 -1.91 -1.57 0.00 0.00 175.55 173.41 2wva n GLU 409 N 1.25 3.37 0.03 -0.62 2.13 -1.26 -4.90 120.64 120.64 2wva n GLU 409 Ca -0.17 -4.65 0.12 0.00 0.66 0.00 0.00 57.16 53.12 2wva n GLU 409 Cb 0.52 -2.25 0.51 0.00 0.27 0.00 0.00 31.44 30.49 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 -0.37 0.06 -0.09 5.31 2.81 -1.26 -0.16 117.12 123.42 2wva n MET 410 Ca 0.36 0.12 -0.21 0.00 -1.81 0.00 0.00 57.70 56.15 2wva n MET 410 Cb 0.52 -1.58 -0.12 0.00 -0.71 0.00 0.00 33.22 31.33 2wva n MET 410 CO 0.00 0.00 0.00 0.37 1.51 0.00 0.00 175.97 177.85 2wva h GLN 411 N 0.00 0.03 0.07 0.03 5.75 -1.90 -3.41 115.11 115.67 2wva h GLN 411 Ca 0.00 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.45 2wva h GLN 411 Cb 0.48 0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.05 2wva h GLN 411 CO 0.00 1.02 -0.03 2.35 -2.65 0.00 0.00 178.83 179.52 2wva h TRP 412 N -0.90 -0.08 -5.14 3.99 -0.00 -1.85 -3.49 115.95 108.48 2wva h TRP 412 Ca -0.33 -0.00 -0.30 0.00 -0.00 0.00 0.00 58.89 58.25 2wva h TRP 412 Cb 1.36 0.03 0.14 0.00 -0.00 0.00 0.00 29.16 30.68 2wva h TRP 412 CO 0.11 0.41 -0.63 0.41 -0.00 0.00 0.00 178.44 178.73 2wva n GLY 413 N 1.26 -0.28 3.51 2.65 0.00 0.78 -4.95 105.19 108.16 2wva n GLY 413 Ca -0.06 0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.30 2.80 0.39 1.61 5.04 -1.26 -4.99 115.29 115.58 2wva s HIS 414 Ca 0.18 -0.12 -0.27 0.00 -1.54 0.00 0.00 55.06 53.31 2wva s HIS 414 Cb -0.08 -4.06 -0.10 0.00 0.04 0.00 0.00 32.58 28.38 2wva s HIS 414 CO 0.63 -1.37 1.44 0.44 -2.34 0.00 0.00 174.74 173.54 2wva n ILE 415 N 6.12 2.23 0.00 0.89 -5.35 -1.26 -1.16 119.36 120.83 2wva n ILE 415 Ca 0.00 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.98 2wva n ILE 415 Cb 0.47 -1.87 0.00 0.00 -1.74 0.00 0.00 39.64 36.50 2wva n ILE 415 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wva n GLY 416 N 0.54 3.47 0.27 3.28 0.00 -1.23 -4.89 105.19 106.64 2wva n GLY 416 Ca 0.03 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.11 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 0.31 -0.64 1.61 7.01 -1.47 -2.97 115.95 119.81 2wva h TRP 417 Ca 0.00 0.04 0.11 0.00 2.11 0.00 0.00 58.89 61.15 2wva h TRP 417 Cb 0.00 -0.02 -0.04 0.00 -2.10 0.00 0.00 29.16 27.00 2wva h TRP 417 CO 0.00 -0.07 0.43 0.66 -2.79 0.00 0.00 178.44 176.66 2wva h SER 418 N 0.29 0.37 0.44 2.65 4.64 -1.92 -1.29 113.55 118.73 2wva h SER 418 Ca 0.42 0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.73 2wva h SER 418 Cb 0.72 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 2wva h SER 418 CO -0.50 0.22 -0.21 0.58 -0.87 0.00 0.00 176.83 176.04 2wva h VAL 419 N 0.41 0.27 -0.13 0.95 2.07 -1.88 0.64 116.25 118.58 2wva h VAL 419 Ca 0.30 -0.59 -0.10 0.00 0.82 0.00 0.00 66.70 67.14 2wva h VAL 419 Cb 0.61 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 2wva h VAL 419 CO -0.08 0.06 -0.34 1.55 0.02 0.00 0.00 177.57 178.77 2wva h PRO 420 N -1.05 0.27 -0.73 1.57 0.13 -1.71 -2.04 132.00 128.44 2wva h PRO 420 Ca -0.06 -0.11 -0.02 0.00 -0.87 0.00 0.00 66.00 64.94 2wva h PRO 420 Cb 0.54 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.63 2wva h PRO 420 CO 0.10 0.59 0.39 0.00 -0.23 0.00 0.00 178.00 178.85 2wva h ALA 421 N 1.41 0.94 -0.65 -0.56 0.00 -1.25 -0.16 119.26 118.99 2wva h ALA 421 Ca 0.03 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2wva h ALA 421 Cb 0.72 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2wva h ALA 421 CO 0.05 0.45 0.19 0.00 0.00 0.00 0.00 179.25 179.95 2wva h ALA 422 N 1.20 1.12 0.36 0.00 0.00 -0.66 0.15 119.26 121.43 2wva h ALA 422 Ca 0.26 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2wva h ALA 422 Cb 0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2wva h ALA 422 CO -0.04 0.60 -0.25 0.35 0.00 0.00 0.00 179.25 179.91 2wva h PHE 423 N 0.95 -0.66 -0.69 0.00 3.57 -0.91 0.02 116.94 119.22 2wva h PHE 423 Ca 0.21 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.70 2wva h PHE 423 Cb 0.29 0.24 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 2wva h PHE 423 CO 0.02 -0.38 0.42 0.78 -2.23 0.00 0.00 178.31 176.92 2wva h GLY 424 N -0.60 1.01 0.96 2.40 0.00 -0.77 -1.57 103.07 104.50 2wva h GLY 424 Ca -0.03 -0.42 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 2wva h GLY 424 CO 0.02 0.40 0.22 -1.82 0.00 0.00 0.00 176.54 175.36 2wva h TYR 425 N 0.95 0.64 -0.31 5.60 5.03 -0.67 -2.17 116.97 126.04 2wva h TYR 425 Ca 0.25 -0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.50 2wva h TYR 425 Cb -0.03 -0.20 -0.02 0.00 1.55 0.00 0.00 36.73 38.03 2wva h TYR 425 CO -0.01 0.52 0.05 0.00 -1.32 0.00 0.00 178.16 177.39 2wva h ALA 426 N 1.06 1.52 -0.24 1.82 0.00 -0.48 0.12 119.26 123.08 2wva h ALA 426 Ca 0.15 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 2wva h ALA 426 Cb 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2wva h ALA 426 CO -0.02 0.35 -0.31 0.28 0.00 0.00 0.00 179.25 179.55 2wva h VAL 427 N 0.44 1.28 0.00 0.00 2.07 -1.03 -2.66 116.25 116.35 2wva h VAL 427 Ca 0.10 -1.39 0.00 0.00 0.82 0.00 0.00 66.70 66.24 2wva h VAL 427 Cb 0.21 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 2wva h VAL 427 CO -0.00 0.44 -0.65 1.23 0.02 0.00 0.00 177.57 178.61 2wva h GLY 428 N 1.05 0.00 -5.99 2.17 0.00 -0.56 -3.38 103.07 96.36 2wva h GLY 428 Ca 0.05 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.90 2wva h GLY 428 CO 0.06 0.00 -1.19 0.00 0.00 0.00 0.00 176.54 175.41 2wva n ALA 429 N -2.03 2.01 0.29 3.60 0.00 0.30 -4.78 120.51 119.90 2wva n ALA 429 Ca 0.02 -3.39 0.18 0.00 0.00 0.00 0.00 53.44 50.25 2wva n ALA 429 Cb 0.50 -0.92 0.85 0.00 0.00 0.00 0.00 19.45 19.88 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 3.06 0.00 0.00 0.00 0.14 -1.67 -2.30 132.00 131.23 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 0.96 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.10 2wva h PRO 430 CO 0.50 0.02 0.00 -0.85 0.14 0.00 0.00 178.00 177.80 2wva n GLU 431 N -3.15 0.17 -3.38 0.86 0.00 -1.26 -4.83 120.64 109.05 2wva n GLU 431 Ca -0.01 0.33 -0.26 0.00 0.00 0.00 0.00 57.16 57.23 2wva n GLU 431 Cb 0.23 -1.78 -0.02 0.00 0.00 0.00 0.00 31.44 29.87 2wva n GLU 431 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 2wva s ARG 432 N -3.21 3.53 -0.54 3.44 0.52 -0.87 -5.03 118.95 116.80 2wva s ARG 432 Ca 0.06 -0.22 -0.29 0.00 -0.52 0.00 0.00 55.73 54.77 2wva s ARG 432 Cb 0.10 -2.67 0.03 0.00 0.52 0.00 0.00 34.95 32.93 2wva s ARG 432 CO 0.42 0.18 1.19 0.50 0.02 0.00 0.00 175.30 177.61 2wva s ARG 433 N -4.01 3.58 -0.35 3.54 3.52 -0.65 -4.97 118.95 119.62 2wva s ARG 433 Ca 0.41 0.40 -0.13 0.00 -0.13 0.00 0.00 55.73 56.28 2wva s ARG 433 Cb -0.10 -3.98 -0.01 0.00 -1.56 0.00 0.00 34.95 29.30 2wva s ARG 433 CO 0.34 -1.58 0.24 -0.80 -0.81 0.00 0.00 175.30 172.69 2wva s ASN 434 N 2.88 6.02 -0.12 -2.12 0.01 -1.26 -1.12 114.94 119.22 2wva s ASN 434 Ca 0.46 -0.51 -0.01 0.00 -0.71 0.00 0.00 52.86 52.09 2wva s ASN 434 Cb -0.08 -2.13 -0.02 0.00 0.41 0.00 0.00 41.25 39.43 2wva s ASN 434 CO 0.28 -0.27 -0.08 -0.63 -1.51 0.00 0.00 177.10 174.90 2wva s ILE 435 N 1.70 3.57 -0.18 0.60 1.01 0.33 -0.85 121.20 127.39 2wva s ILE 435 Ca 0.06 -0.50 -0.00 0.00 0.00 0.00 0.00 60.65 60.21 2wva s ILE 435 Cb -0.18 -2.51 0.00 0.00 0.01 0.00 0.00 42.46 39.79 2wva s ILE 435 CO 0.10 0.54 -0.15 -0.22 0.00 0.00 0.00 174.94 175.21 2wva s LEU 436 N -0.06 2.44 -0.38 2.97 2.96 0.13 -0.30 118.68 126.44 2wva s LEU 436 Ca -0.00 -0.51 -0.06 0.00 -0.22 0.00 0.00 54.13 53.34 2wva s LEU 436 Cb -0.13 -1.57 0.07 0.00 0.50 0.00 0.00 46.19 45.06 2wva s LEU 436 CO 0.03 0.04 0.18 -0.04 -1.32 0.00 0.00 176.35 175.24 2wva s MET 437 N 1.10 2.44 -0.01 1.98 -1.94 -0.23 0.68 119.30 123.31 2wva s MET 437 Ca 0.00 -1.46 0.02 0.00 -1.71 0.00 0.00 55.69 52.54 2wva s MET 437 Cb -0.14 -3.59 -0.00 0.00 2.01 0.00 0.00 34.83 33.11 2wva s MET 437 CO -0.05 -0.88 -0.06 0.54 -0.01 0.00 0.00 175.02 174.57 2wva s VAL 438 N 1.33 0.50 0.62 -6.03 0.11 -0.69 -1.41 120.40 114.83 2wva s VAL 438 Ca 0.02 -0.24 -0.11 0.00 -2.93 0.00 0.00 61.98 58.72 2wva s VAL 438 Cb -0.22 -0.44 -0.04 0.00 -1.53 0.00 0.00 36.38 34.16 2wva s VAL 438 CO 0.00 0.15 1.03 -0.83 -3.33 0.00 0.00 175.10 172.12 2wva s GLY 439 N 0.01 1.66 0.19 6.54 0.00 -1.26 -1.18 107.32 113.27 2wva s GLY 439 Ca 0.00 -0.11 -0.12 0.00 0.00 0.00 0.00 44.72 44.50 2wva s GLY 439 CO -0.00 0.16 1.85 1.29 0.00 0.00 0.00 173.10 176.40 2wva h ASP 440 N -0.32 0.76 -0.78 1.64 2.03 -1.59 -1.57 116.42 116.59 2wva h ASP 440 Ca -0.44 -0.04 0.01 0.00 -0.73 0.00 0.00 57.03 55.84 2wva h ASP 440 Cb 1.19 -0.19 -0.04 0.00 -0.83 0.00 0.00 39.33 39.46 2wva h ASP 440 CO 0.62 0.57 0.51 1.23 -1.03 0.00 0.00 179.24 181.15 2wva h GLY 441 N 0.88 1.10 1.05 7.15 0.00 -1.86 -2.88 103.07 108.51 2wva h GLY 441 Ca 0.24 -0.40 -0.16 0.00 0.00 0.00 0.00 47.33 47.00 2wva h GLY 441 CO -0.05 0.38 -0.48 1.76 0.00 0.00 0.00 176.54 178.16 2wva h SER 442 N 1.04 0.85 -0.91 0.19 0.02 -1.85 -3.18 113.55 109.71 2wva h SER 442 Ca 0.29 -0.54 0.14 0.00 -0.84 0.00 0.00 61.79 60.84 2wva h SER 442 Cb -0.10 -0.25 -0.07 0.00 0.14 0.00 0.00 62.40 62.13 2wva h SER 442 CO -0.07 1.23 0.58 0.15 -1.14 0.00 0.00 176.83 177.58 2wva h PHE 443 N 0.51 0.88 0.00 3.45 3.57 -1.11 -1.57 116.94 122.66 2wva h PHE 443 Ca 0.01 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 2wva h PHE 443 Cb 1.08 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.54 2wva h PHE 443 CO 0.08 0.33 -0.06 1.96 -2.23 0.00 0.00 178.31 178.40 2wva h GLN 444 N 0.75 0.00 -0.12 1.11 4.20 -1.49 0.10 115.11 119.67 2wva h GLN 444 Ca 0.45 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 59.02 2wva h GLN 444 Cb 0.66 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.43 2wva h GLN 444 CO -0.21 0.06 -0.54 -0.07 -0.67 0.00 0.00 178.83 177.39 2wva h LEU 445 N 0.00 0.39 -1.72 1.46 4.07 -1.44 -3.37 115.31 114.71 2wva h LEU 445 Ca -0.00 -0.21 0.00 0.00 0.08 0.00 0.00 57.88 57.75 2wva h LEU 445 Cb 0.28 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 41.90 2wva h LEU 445 CO 0.01 0.86 -0.15 0.35 -1.08 0.00 0.00 178.44 178.42 2wva n THR 446 N -3.93 0.28 -0.39 0.22 -2.24 -1.04 -4.91 114.28 102.27 2wva n THR 446 Ca -0.02 -0.31 0.31 0.00 -2.27 0.00 0.00 64.05 61.76 2wva n THR 446 Cb 0.58 0.69 0.58 0.00 -2.10 0.00 0.00 70.33 70.08 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 -0.97 -2.20 119.26 125.49 2wva h ALA 447 Ca 0.00 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2wva h ALA 447 Cb 1.06 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 2wva h ALA 447 CO 0.00 -1.01 -0.01 -0.56 0.00 0.00 0.00 179.25 177.67 2wva h GLN 448 N 0.20 0.00 0.00 0.00 -0.00 -1.91 -1.85 115.11 111.56 2wva h GLN 448 Ca 0.75 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.40 2wva h GLN 448 Cb 2.12 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.60 2wva h GLN 448 CO -0.45 0.01 0.00 -1.91 -0.00 0.00 0.00 178.83 176.48 2wva n GLU 449 N -3.41 0.12 0.09 0.06 4.07 -0.83 -1.05 120.64 119.71 2wva n GLU 449 Ca -0.03 0.38 0.04 0.00 -0.06 0.00 0.00 57.16 57.49 2wva n GLU 449 Cb 0.09 -1.75 0.44 0.00 -0.06 0.00 0.00 31.44 30.17 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 1.12 -0.49 6.31 2.07 -1.57 -1.60 116.25 122.09 2wva h VAL 450 Ca 0.00 -0.42 0.05 0.00 0.82 0.00 0.00 66.70 67.16 2wva h VAL 450 Cb 0.29 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 2wva h VAL 450 CO 0.00 0.15 0.33 0.00 0.02 0.00 0.00 177.57 178.06 2wva h ALA 451 N 1.74 1.88 -0.02 1.67 0.00 -1.30 -0.84 119.26 122.38 2wva h ALA 451 Ca 0.08 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 2wva h ALA 451 Cb 0.14 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2wva h ALA 451 CO -0.00 0.04 -0.69 1.96 0.00 0.00 0.00 179.25 180.56 2wva h GLN 452 N 0.46 0.12 -0.67 0.00 1.08 -1.42 -0.25 115.11 114.42 2wva h GLN 452 Ca 0.21 -0.10 -0.00 0.00 -1.45 0.00 0.00 58.65 57.31 2wva h GLN 452 Cb 0.25 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.67 2wva h GLN 452 CO -0.05 0.76 0.41 0.52 -0.95 0.00 0.00 178.83 179.51 2wva h MET 453 N 0.08 0.91 -0.43 1.46 2.86 -1.00 -0.93 114.93 117.88 2wva h MET 453 Ca -0.01 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.52 2wva h MET 453 Cb 1.22 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 32.67 2wva h MET 453 CO 0.10 0.65 0.15 0.28 1.06 0.00 0.00 176.91 179.15 2wva h VAL 454 N 0.92 1.21 -0.55 -2.22 2.07 -0.96 -1.30 116.25 115.42 2wva h VAL 454 Ca 0.24 -0.67 0.05 0.00 0.82 0.00 0.00 66.70 67.14 2wva h VAL 454 Cb -0.03 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 30.54 2wva h VAL 454 CO -0.05 0.24 0.28 -0.09 0.02 0.00 0.00 177.57 177.98 2wva h ARG 455 N 0.55 0.53 -0.63 1.57 2.43 -0.60 -1.80 114.38 116.42 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 0.23 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2wva h ARG 455 CO -0.01 0.35 0.00 1.28 -1.51 0.00 0.00 179.97 180.08 2wva n LEU 456 N -4.86 3.97 -3.81 3.80 4.77 -0.39 -4.95 117.00 115.52 2wva n LEU 456 Ca 0.05 -2.00 -0.24 0.00 -0.03 0.00 0.00 56.01 53.79 2wva n LEU 456 Cb 0.14 -0.52 0.02 0.00 -2.33 0.00 0.00 43.42 40.73 2wva n LEU 456 CO 0.29 0.68 -0.06 0.29 -1.33 0.00 0.00 177.39 177.26 2wva n LYS 457 N 0.89 -4.67 -3.49 3.23 5.02 -0.61 -4.95 118.16 113.59 2wva n LYS 457 Ca 0.21 0.56 -0.37 0.00 -2.02 0.00 0.00 58.31 56.69 2wva n LYS 457 Cb 0.75 -5.11 -0.08 0.00 -0.02 0.00 0.00 35.03 30.57 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 -6.88 4.18 -0.08 -0.35 1.43 -0.59 -4.27 118.68 112.12 2wva s LEU 458 Ca 0.17 0.44 -0.04 0.00 -1.03 0.00 0.00 54.13 53.67 2wva s LEU 458 Cb -0.09 -2.39 -0.12 0.00 0.03 0.00 0.00 46.19 43.62 2wva s LEU 458 CO 0.83 0.01 2.97 -2.65 0.23 0.00 0.00 176.35 177.75 2wva n PRO 459 N 4.14 1.77 -2.18 1.29 -0.02 -1.26 -1.13 135.00 137.60 2wva n PRO 459 Ca -0.11 -0.94 -0.42 0.00 -2.02 0.00 0.00 63.50 60.02 2wva n PRO 459 Cb 0.51 -1.72 -0.03 0.00 -0.02 0.00 0.00 33.50 32.24 2wva n PRO 459 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2wva s VAL 460 N 0.10 3.30 -0.30 -1.45 1.01 -1.26 -4.68 120.40 117.12 2wva s VAL 460 Ca 0.45 0.95 -0.17 0.00 0.00 0.00 0.00 61.98 63.22 2wva s VAL 460 Cb 0.24 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 2wva s VAL 460 CO -0.03 0.08 0.46 -0.63 0.00 0.00 0.00 175.10 174.99 2wva s ILE 461 N 0.97 5.09 -0.26 2.22 1.01 -0.03 -0.97 121.20 129.23 2wva s ILE 461 Ca 0.63 0.52 -0.06 0.00 0.00 0.00 0.00 60.65 61.75 2wva s ILE 461 Cb -0.37 -3.84 -0.00 0.00 0.01 0.00 0.00 42.46 38.26 2wva s ILE 461 CO 0.31 -0.02 0.04 -0.63 0.00 0.00 0.00 174.94 174.64 2wva s ILE 462 N 2.25 3.84 -0.56 2.92 1.01 0.78 0.21 121.20 131.64 2wva s ILE 462 Ca 0.18 -0.52 -0.19 0.00 0.00 0.00 0.00 60.65 60.13 2wva s ILE 462 Cb -0.16 -2.87 0.09 0.00 0.01 0.00 0.00 42.46 39.54 2wva s ILE 462 CO 0.11 0.25 0.66 -0.36 0.00 0.00 0.00 174.94 175.59 2wva s PHE 463 N 1.52 3.04 -0.47 3.97 0.08 0.21 -0.20 117.98 126.13 2wva s PHE 463 Ca 0.04 -0.87 -0.23 0.00 0.12 0.00 0.00 56.93 55.99 2wva s PHE 463 Cb -0.16 -3.84 0.03 0.00 -0.57 0.00 0.00 43.02 38.49 2wva s PHE 463 CO 0.01 -1.19 0.80 -1.17 -0.10 0.00 0.00 175.22 173.58 2wva s LEU 464 N 2.55 4.27 -0.63 -0.37 1.98 -0.65 -1.71 118.68 124.11 2wva s LEU 464 Ca 0.11 -0.19 -0.25 0.00 -2.89 0.00 0.00 54.13 50.92 2wva s LEU 464 Cb -0.23 -2.92 0.05 0.00 0.66 0.00 0.00 46.19 43.75 2wva s LEU 464 CO 0.07 -0.97 1.05 -0.63 -1.89 0.00 0.00 176.35 173.99 2wva s ILE 465 N 3.37 4.18 -0.92 6.68 -1.09 -0.33 -0.70 121.20 132.39 2wva s ILE 465 Ca 0.29 0.17 -0.16 0.00 -2.23 0.00 0.00 60.65 58.72 2wva s ILE 465 Cb -0.12 -4.69 0.18 0.00 -1.58 0.00 0.00 42.46 36.24 2wva s ILE 465 CO 0.22 -1.42 1.01 0.21 -1.23 0.00 0.00 174.94 173.73 2wva s ASN 466 N 3.33 6.76 -0.19 3.58 3.84 0.11 -1.53 114.94 130.84 2wva s ASN 466 Ca 0.30 -2.47 0.16 0.00 0.21 0.00 0.00 52.86 51.06 2wva s ASN 466 Cb -0.12 -2.31 0.63 0.00 -0.55 0.00 0.00 41.25 38.89 2wva s ASN 466 CO 0.16 -0.80 1.53 -0.46 -2.79 0.00 0.00 177.10 174.74 2wva n ASN 467 N 5.25 4.50 -3.45 -4.21 0.23 -1.25 -2.73 115.26 113.59 2wva n ASN 467 Ca 0.21 -2.94 -0.21 0.00 -0.53 0.00 0.00 54.58 51.11 2wva n ASN 467 Cb 0.47 -0.58 0.06 0.00 -2.08 0.00 0.00 39.78 37.65 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 -0.06 -2.21 0.00 -2.53 9.36 -1.26 -3.79 117.16 116.67 2wva n TYR 468 Ca 0.23 0.75 0.00 0.00 3.32 0.00 0.00 57.90 62.20 2wva n TYR 468 Cb 0.98 -4.05 0.00 0.00 -0.63 0.00 0.00 39.34 35.64 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 -1.40 1.01 3.36 2.98 0.00 -1.26 -4.68 105.19 105.20 2wva n GLY 469 Ca -0.12 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.52 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 3.41 4.50 -0.26 1.61 4.01 -0.54 -4.45 117.16 125.44 2wva n TYR 470 Ca 0.00 -3.13 -0.05 0.00 -0.16 0.00 0.00 57.90 54.56 2wva n TYR 470 Cb 0.00 -2.28 0.06 0.00 -0.31 0.00 0.00 39.34 36.80 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 4.68 1.21 -0.69 -0.72 2.02 -1.89 -0.34 112.91 117.18 2wva h THR 471 Ca 0.38 -0.46 0.03 0.00 0.77 0.00 0.00 66.41 67.12 2wva h THR 471 Cb 0.82 0.21 -0.04 0.00 -1.74 0.00 0.00 68.15 67.40 2wva h THR 471 CO 1.39 0.22 0.46 -0.29 0.37 0.00 0.00 175.52 177.67 2wva h ILE 472 N 0.99 1.12 -0.25 3.11 2.10 -1.93 -0.92 117.51 121.73 2wva h ILE 472 Ca 0.26 -0.30 -0.18 0.00 1.08 0.00 0.00 64.86 65.72 2wva h ILE 472 Cb -0.03 0.18 -0.00 0.00 -1.09 0.00 0.00 36.82 35.89 2wva h ILE 472 CO -0.05 0.16 -0.57 -0.08 -1.08 0.00 0.00 178.15 176.53 2wva h GLU 473 N 0.86 0.78 -0.38 2.19 4.57 -1.76 -2.65 114.58 118.20 2wva h GLU 473 Ca 0.27 -0.51 0.00 0.00 -1.18 0.00 0.00 59.36 57.94 2wva h GLU 473 Cb 0.01 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 2wva h GLU 473 CO -0.07 1.14 0.24 0.28 -1.18 0.00 0.00 179.01 179.42 2wva h VAL 474 N 0.60 1.10 -0.00 0.32 2.07 -0.18 0.05 116.25 120.21 2wva h VAL 474 Ca 0.01 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2wva h VAL 474 Cb 1.17 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 2wva h VAL 474 CO 0.12 0.10 -0.28 0.23 0.02 0.00 0.00 177.57 177.77 2wva n MET 475 N -4.47 0.29 -0.09 1.57 2.81 -0.44 -3.79 117.12 113.00 2wva n MET 475 Ca 0.03 -0.13 -0.12 0.00 -1.81 0.00 0.00 57.70 55.66 2wva n MET 475 Cb 0.07 -1.50 -0.05 0.00 -0.71 0.00 0.00 33.22 31.04 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 -1.24 1.48 -3.64 2.02 5.41 -0.82 -3.96 119.36 118.61 2wva n ILE 476 Ca 0.09 0.07 -0.01 0.00 1.00 0.00 0.00 62.75 63.89 2wva n ILE 476 Cb 0.33 -2.26 -0.04 0.00 -0.71 0.00 0.00 39.64 36.96 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 -2.55 -1.31 0.20 1.39 5.04 -0.06 -4.69 115.29 113.32 2wva s HIS 477 Ca -0.26 2.27 -0.14 0.00 -1.54 0.00 0.00 55.06 55.40 2wva s HIS 477 Cb 0.05 0.78 -0.07 0.00 0.04 0.00 0.00 32.58 33.38 2wva s HIS 477 CO 0.39 -0.65 0.59 0.34 -2.34 0.00 0.00 174.74 173.07 2wva s ASP 478 N 2.83 6.79 0.06 9.88 2.15 -1.25 -4.47 116.67 132.67 2wva s ASP 478 Ca -0.06 1.09 -0.27 0.00 0.43 0.00 0.00 52.55 53.75 2wva s ASP 478 Cb -0.11 -2.29 0.09 0.00 -0.30 0.00 0.00 42.92 40.30 2wva s ASP 478 CO -0.19 0.01 1.18 -0.83 -0.17 0.00 0.00 175.17 175.17 2wva s GLY 479 N -1.95 -0.13 0.58 2.66 0.00 -1.26 -5.03 107.32 102.18 2wva s GLY 479 Ca 0.43 0.09 0.33 0.00 0.00 0.00 0.00 44.72 45.57 2wva s GLY 479 CO 0.20 2.74 2.18 -2.55 0.00 0.00 0.00 173.10 175.66 2wva h PRO 480 N 2.00 0.00 0.00 2.90 0.11 -1.99 -2.27 132.00 132.75 2wva h PRO 480 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2wva h PRO 480 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2wva h PRO 480 CO 0.31 0.05 0.00 2.48 -0.21 0.00 0.00 178.00 180.63 2wva n TYR 481 N -3.46 0.00 1.25 0.65 0.18 -1.26 -2.44 117.16 112.08 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 -0.30 0.35 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 -1.30 1.25 -4.84 9.48 3.02 -0.86 -4.89 115.26 117.13 2wva n ASN 482 Ca 0.07 -1.08 -0.38 0.00 -0.03 0.00 0.00 54.58 53.17 2wva n ASN 482 Cb 0.13 0.15 -0.06 0.00 -0.61 0.00 0.00 39.78 39.39 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 -2.41 6.79 0.30 6.41 0.01 -1.02 -1.46 114.94 123.55 2wva s ASN 483 Ca 0.26 0.95 0.05 0.00 -0.71 0.00 0.00 52.86 53.41 2wva s ASN 483 Cb 0.19 -2.24 -0.06 0.00 0.41 0.00 0.00 41.25 39.55 2wva s ASN 483 CO 0.49 0.30 -0.01 0.27 -1.51 0.00 0.00 177.10 176.65 2wva s ILE 484 N -1.12 1.43 -0.26 0.60 -4.36 -1.26 -4.98 121.20 111.25 2wva s ILE 484 Ca 0.25 -2.06 -0.29 0.00 -0.26 0.00 0.00 60.65 58.29 2wva s ILE 484 Cb -0.16 -2.58 0.01 0.00 1.25 0.00 0.00 42.46 40.97 2wva s ILE 484 CO 0.14 -0.19 1.06 -0.75 0.24 0.00 0.00 174.94 175.44 2wva s LYS 485 N -3.80 4.19 0.39 0.37 2.47 -1.26 -4.90 119.74 117.20 2wva s LYS 485 Ca 0.32 1.27 -0.27 0.00 -1.56 0.00 0.00 55.97 55.73 2wva s LYS 485 Cb 0.06 -3.68 -0.09 0.00 -1.46 0.00 0.00 37.83 32.66 2wva s LYS 485 CO 0.13 -0.73 1.33 1.21 0.16 0.00 0.00 175.35 177.46 2wva s ASN 486 N 1.37 6.38 0.32 1.43 2.47 -1.26 -5.05 114.94 120.60 2wva s ASN 486 Ca 0.45 2.73 0.08 0.00 0.42 0.00 0.00 52.86 56.54 2wva s ASN 486 Cb -0.14 -2.65 -0.04 0.00 -1.45 0.00 0.00 41.25 36.97 2wva s ASN 486 CO 0.09 -0.81 0.12 0.26 -3.72 0.00 0.00 177.10 173.04 2wva s TRP 487 N -1.22 2.74 -1.27 0.43 0.51 -1.26 -5.04 118.94 113.84 2wva s TRP 487 Ca 0.55 -0.32 -0.16 0.00 -2.12 0.00 0.00 56.10 54.05 2wva s TRP 487 Cb -0.40 -1.52 0.12 0.00 -0.81 0.00 0.00 33.47 30.86 2wva s TRP 487 CO 0.52 0.41 1.62 -3.47 -0.51 0.00 0.00 176.95 175.53 2wva n ASP 488 N -1.10 5.04 -0.30 2.95 2.03 -1.26 -4.86 116.55 119.05 2wva n ASP 488 Ca -0.04 -2.95 -0.01 0.00 0.52 0.00 0.00 54.79 52.31 2wva n ASP 488 Cb 0.60 -1.66 0.12 0.00 -0.72 0.00 0.00 41.12 39.46 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 7.29 0.98 -0.89 -0.67 0.05 -1.99 -0.78 116.97 120.96 2wva h TYR 489 Ca 0.39 0.03 0.02 0.00 0.05 0.00 0.00 58.73 59.22 2wva h TYR 489 Cb 0.86 -0.32 -0.05 0.00 1.01 0.00 0.00 36.73 38.23 2wva h TYR 489 CO 1.28 0.53 0.59 0.00 -1.05 0.00 0.00 178.16 179.51 2wva h ALA 490 N 1.37 1.39 0.00 3.88 0.00 -1.89 -1.45 119.26 122.57 2wva h ALA 490 Ca 0.35 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2wva h ALA 490 Cb 0.09 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2wva h ALA 490 CO -0.14 0.54 0.00 0.78 0.00 0.00 0.00 179.25 180.43 2wva h GLY 491 N 1.17 0.00 2.00 0.00 0.00 -1.49 -2.71 103.07 102.05 2wva h GLY 491 Ca 0.34 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.65 2wva h GLY 491 CO -0.09 0.00 -0.10 -2.00 0.00 0.00 0.00 176.54 174.35 2wva h LEU 492 N 0.00 0.00 -0.04 3.11 5.85 -0.96 -3.04 115.31 120.23 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 0.46 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.49 2wva h LEU 492 CO 0.00 0.10 0.03 0.24 -0.34 0.00 0.00 178.44 178.47 2wva h MET 493 N 0.00 0.06 0.00 1.25 2.86 -1.60 -1.94 114.93 115.55 2wva h MET 493 Ca -0.00 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2wva h MET 493 Cb 0.20 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.85 2wva h MET 493 CO 0.01 0.08 -0.03 0.93 1.06 0.00 0.00 176.91 178.96 2wva h GLU 494 N 0.01 0.00 -0.19 1.72 4.39 -1.74 0.04 114.58 118.82 2wva h GLU 494 Ca 0.01 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.67 2wva h GLU 494 Cb 0.04 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 2wva h GLU 494 CO -0.00 0.03 -0.08 0.28 -1.16 0.00 0.00 179.01 178.08 2wva h VAL 495 N 0.00 1.30 0.00 3.13 2.07 -1.43 -2.27 116.25 119.05 2wva h VAL 495 Ca -0.00 -1.11 -0.06 0.00 0.82 0.00 0.00 66.70 66.35 2wva h VAL 495 Cb 0.42 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 2wva h VAL 495 CO 0.00 0.33 -0.29 -0.26 0.02 0.00 0.00 177.57 177.38 2wva h PHE 496 N 0.08 0.00 -0.03 1.57 0.04 -0.78 -3.02 116.94 114.79 2wva h PHE 496 Ca 0.04 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 2wva h PHE 496 Cb 0.55 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.70 2wva h PHE 496 CO 0.06 0.29 -0.00 -0.91 -0.60 0.00 0.00 178.31 177.15 2wva h ASN 497 N 0.00 0.06 -4.08 2.17 2.35 -0.99 -3.45 115.58 111.64 2wva h ASN 497 Ca -0.00 -0.33 -0.38 0.00 -0.55 0.00 0.00 56.30 55.04 2wva h ASN 497 Cb 0.92 -0.02 0.05 0.00 0.05 0.00 0.00 38.32 39.33 2wva h ASN 497 CO 0.04 0.38 -0.56 0.61 -1.65 0.00 0.00 177.43 176.25 2wva n GLY 498 N -0.20 -0.42 3.73 2.83 0.00 -0.86 -2.94 105.19 107.33 2wva n GLY 498 Ca -0.07 0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.71 6.45 0.00 1.61 0.01 -1.26 -1.06 114.94 117.99 2wva s ASN 499 Ca 0.27 2.81 0.00 0.00 -0.71 0.00 0.00 52.86 55.22 2wva s ASN 499 Cb -0.12 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 38.93 2wva s ASN 499 CO 0.33 -0.90 0.00 0.61 -1.51 0.00 0.00 177.10 175.63 2wva n GLY 500 N 3.33 0.75 0.00 0.66 0.00 -1.26 -5.04 105.19 103.63 2wva n GLY 500 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.16 2.44 0.31 -0.02 0.00 -0.22 -5.02 105.19 100.53 2wva n GLY 501 Ca 0.00 -1.89 -0.03 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 0.90 -0.22 1.61 0.05 -1.97 -3.45 116.97 113.89 2wva h TYR 502 Ca 0.00 -0.08 0.00 0.00 0.05 0.00 0.00 58.73 58.70 2wva h TYR 502 Cb 0.00 -0.27 0.00 0.00 1.01 0.00 0.00 36.73 37.47 2wva h TYR 502 CO 0.00 0.74 0.00 -0.40 -1.05 0.00 0.00 178.16 177.45 2wva n ASP 503 N -4.28 0.00 -3.36 3.88 5.68 -1.26 -5.19 116.55 112.02 2wva n ASP 503 Ca 0.04 0.00 -0.08 0.00 -0.50 0.00 0.00 54.79 54.25 2wva n ASP 503 Cb 0.22 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.20 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 -0.05 0.19 -1.12 1.04 -1.26 -4.29 113.70 109.21 2wva s SER 504 Ca 0.00 -0.95 -0.22 0.00 0.48 0.00 0.00 55.95 55.26 2wva s SER 504 Cb 0.00 0.78 0.05 0.00 0.10 0.00 0.00 66.02 66.95 2wva s SER 504 CO 0.00 -1.51 0.62 -0.83 0.98 0.00 0.00 173.24 172.50 2wva s GLY 505 N -3.02 -0.45 -0.14 7.32 0.00 -1.15 -4.90 107.32 104.98 2wva s GLY 505 Ca 0.15 0.23 0.16 0.00 0.00 0.00 0.00 44.72 45.27 2wva s GLY 505 CO 0.10 0.06 1.20 0.00 0.00 0.00 0.00 173.10 174.46 2wva n ALA 506 N -0.39 3.23 -1.69 3.20 0.00 -1.26 -4.90 120.51 118.69 2wva n ALA 506 Ca -0.13 -2.98 -0.31 0.00 0.00 0.00 0.00 53.44 50.02 2wva n ALA 506 Cb 0.63 -0.50 0.03 0.00 0.00 0.00 0.00 19.45 19.62 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 -2.82 1.74 0.00 0.00 0.00 -1.26 -3.74 107.32 101.23 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 -0.10 0.36 -0.13 0.54 0.00 0.00 0.00 173.10 173.78 2wva s LYS 508 N -4.92 0.96 -0.10 2.90 1.02 -0.60 -4.83 119.74 114.17 2wva s LYS 508 Ca 0.58 -0.52 0.04 0.00 0.02 0.00 0.00 55.97 56.08 2wva s LYS 508 Cb -0.13 -0.94 0.00 0.00 -0.52 0.00 0.00 37.83 36.24 2wva s LYS 508 CO 0.51 0.25 -0.23 0.20 -0.92 0.00 0.00 175.35 175.16 2wva s GLY 509 N -0.52 1.32 0.07 -3.33 0.00 -1.26 -0.26 107.32 103.33 2wva s GLY 509 Ca 0.04 -0.97 0.03 0.00 0.00 0.00 0.00 44.72 43.82 2wva s GLY 509 CO -0.00 -0.28 -0.09 1.08 0.00 0.00 0.00 173.10 173.81 2wva s LEU 510 N 0.40 2.34 0.00 0.66 1.43 0.13 -4.88 118.68 118.76 2wva s LEU 510 Ca -0.18 -0.69 0.03 0.00 -1.03 0.00 0.00 54.13 52.26 2wva s LEU 510 Cb -0.18 -0.20 -0.03 0.00 0.03 0.00 0.00 46.19 45.81 2wva s LEU 510 CO 0.08 -0.25 -0.06 -0.54 0.23 0.00 0.00 176.35 175.80 2wva s LYS 511 N -2.26 2.57 -0.18 1.70 1.02 -1.26 0.31 119.74 121.64 2wva s LYS 511 Ca -0.02 -0.71 -0.02 0.00 0.02 0.00 0.00 55.97 55.24 2wva s LYS 511 Cb -0.06 -2.51 0.05 0.00 -0.52 0.00 0.00 37.83 34.79 2wva s LYS 511 CO -0.01 0.61 0.01 0.00 -0.92 0.00 0.00 175.35 175.04 2wva s ALA 512 N -0.99 1.12 -0.71 5.17 0.00 0.01 -4.77 121.76 121.59 2wva s ALA 512 Ca 0.17 -0.70 0.07 0.00 0.00 0.00 0.00 51.96 51.51 2wva s ALA 512 Cb -0.11 -1.13 0.01 0.00 0.00 0.00 0.00 23.12 21.88 2wva s ALA 512 CO 0.07 -1.01 0.56 1.63 0.00 0.00 0.00 175.76 177.02 2wva n LYS 513 N 5.00 1.99 -4.01 0.00 5.02 -1.26 -1.76 118.16 123.15 2wva n LYS 513 Ca -0.09 -0.57 -0.09 0.00 -2.02 0.00 0.00 58.31 55.54 2wva n LYS 513 Cb 0.47 -1.02 -0.09 0.00 -0.02 0.00 0.00 35.03 34.38 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 -1.06 0.14 0.28 -0.18 -4.23 -1.26 -0.85 115.64 108.47 2wva s THR 514 Ca 0.06 -1.56 0.01 0.00 -1.18 0.00 0.00 61.69 59.03 2wva s THR 514 Cb 0.06 -1.63 0.28 0.00 1.34 0.00 0.00 72.50 72.55 2wva s THR 514 CO 0.17 -0.65 1.84 1.23 -0.54 0.00 0.00 174.62 176.67 2wva h GLY 515 N 2.86 1.63 1.06 3.99 0.00 -1.59 -1.24 103.07 109.78 2wva h GLY 515 Ca -0.34 -0.43 -0.08 0.00 0.00 0.00 0.00 47.33 46.48 2wva h GLY 515 CO 0.58 0.18 0.11 -1.33 0.00 0.00 0.00 176.54 176.09 2wva h GLY 516 N 1.02 1.17 1.18 4.60 0.00 -0.96 -0.91 103.07 109.17 2wva h GLY 516 Ca 0.49 -0.78 -0.10 0.00 0.00 0.00 0.00 47.33 46.94 2wva h GLY 516 CO -0.25 0.72 -0.06 0.83 0.00 0.00 0.00 176.54 177.77 2wva h GLU 517 N 1.01 0.97 -0.26 4.80 5.08 -1.61 -2.16 114.58 122.40 2wva h GLU 517 Ca 0.20 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 2wva h GLU 517 Cb 0.43 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2wva h GLU 517 CO 0.01 0.99 0.12 1.25 -1.00 0.00 0.00 179.01 180.38 2wva h LEU 518 N 0.87 0.35 -0.50 1.33 5.85 -1.01 -0.04 115.31 122.17 2wva h LEU 518 Ca 0.15 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.75 2wva h LEU 518 Cb 0.60 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 2wva h LEU 518 CO 0.04 0.40 0.29 0.00 -0.34 0.00 0.00 178.44 178.83 2wva h ALA 519 N 0.97 0.64 -0.64 1.25 0.00 -1.05 0.11 119.26 120.54 2wva h ALA 519 Ca 0.09 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2wva h ALA 519 Cb 0.15 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2wva h ALA 519 CO -0.01 -0.02 0.05 0.93 0.00 0.00 0.00 179.25 180.20 2wva h GLU 520 N 0.58 1.09 -0.53 0.00 4.39 -1.28 -2.51 114.58 116.31 2wva h GLU 520 Ca 0.20 -0.32 -0.00 0.00 0.34 0.00 0.00 59.36 59.58 2wva h GLU 520 Cb 0.04 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 2wva h GLU 520 CO -0.10 1.03 0.31 0.00 -1.16 0.00 0.00 179.01 179.09 2wva h ALA 521 N 1.04 0.68 -0.61 3.43 0.00 -0.34 -2.42 119.26 121.03 2wva h ALA 521 Ca 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2wva h ALA 521 Cb 0.51 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2wva h ALA 521 CO 0.02 0.17 0.38 0.82 0.00 0.00 0.00 179.25 180.64 2wva h ILE 522 N 0.71 1.16 -0.14 0.00 2.04 -0.61 -0.33 117.51 120.35 2wva h ILE 522 Ca 0.19 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 2wva h ILE 522 Cb 0.00 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.36 2wva h ILE 522 CO -0.03 0.17 0.07 0.11 0.00 0.00 0.00 178.15 178.46 2wva h LYS 523 N 0.83 0.21 -0.79 2.37 1.57 -1.10 -1.93 116.57 117.72 2wva h LYS 523 Ca 0.22 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 59.00 2wva h LYS 523 Cb -0.06 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.17 2wva h LYS 523 CO -0.04 0.26 0.52 0.28 -0.57 0.00 0.00 179.45 179.89 2wva h VAL 524 N 0.11 1.15 -0.36 0.50 2.07 -0.95 -2.09 116.25 116.67 2wva h VAL 524 Ca 0.05 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 2wva h VAL 524 Cb 0.12 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 2wva h VAL 524 CO -0.01 0.18 0.06 0.00 0.02 0.00 0.00 177.57 177.83 2wva h ALA 525 N 1.53 0.47 -0.09 1.67 0.00 -0.83 -2.27 119.26 119.74 2wva h ALA 525 Ca 0.31 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2wva h ALA 525 Cb -0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2wva h ALA 525 CO -0.08 0.18 -0.26 -0.07 0.00 0.00 0.00 179.25 179.02 2wva h LEU 526 N 0.43 0.16 0.00 0.00 3.38 -1.04 -2.48 115.31 115.76 2wva h LEU 526 Ca 0.11 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2wva h LEU 526 Cb 0.35 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2wva h LEU 526 CO 0.01 0.42 -0.09 0.00 0.09 0.00 0.00 178.44 178.86 2wva n ALA 527 N -2.48 2.46 -2.92 1.53 0.00 -0.82 -4.63 120.51 113.66 2wva n ALA 527 Ca -0.01 -0.10 -0.44 0.00 0.00 0.00 0.00 53.44 52.89 2wva n ALA 527 Cb 0.35 -1.42 -0.03 0.00 0.00 0.00 0.00 19.45 18.35 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 -3.69 6.41 0.00 0.00 2.47 -0.87 -4.84 114.94 114.43 2wva s ASN 528 Ca 0.12 -1.59 0.25 0.00 0.42 0.00 0.00 52.86 52.06 2wva s ASN 528 Cb 0.16 -2.40 0.44 0.00 -1.45 0.00 0.00 41.25 38.00 2wva s ASN 528 CO 0.59 -1.21 1.40 0.35 -3.72 0.00 0.00 177.10 174.50 2wva n THR 529 N 5.67 0.08 0.80 -5.21 -2.24 -1.26 -4.32 114.28 107.79 2wva n THR 529 Ca 0.10 -0.47 0.08 0.00 -2.27 0.00 0.00 64.05 61.50 2wva n THR 529 Cb 0.47 1.15 -0.05 0.00 -2.10 0.00 0.00 70.33 69.80 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 1.06 1.30 -3.66 3.42 8.00 -1.26 -4.62 116.55 120.79 2wva n ASP 530 Ca 0.16 -1.15 0.01 0.00 0.71 0.00 0.00 54.79 54.52 2wva n ASP 530 Cb 0.53 0.72 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 -2.33 -0.30 0.68 0.44 0.00 -1.25 -4.34 107.32 100.23 2wva s GLY 531 Ca 0.11 0.43 -0.14 0.00 0.00 0.00 0.00 44.72 45.12 2wva s GLY 531 CO 0.57 1.64 1.11 2.56 0.00 0.00 0.00 173.10 178.98 2wva s PRO 532 N -2.35 2.70 -0.15 2.90 0.04 -0.28 -4.17 135.00 133.69 2wva s PRO 532 Ca 0.18 1.35 0.01 0.00 0.04 0.00 0.00 61.00 62.58 2wva s PRO 532 Cb 0.03 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.65 2wva s PRO 532 CO -0.02 -1.32 -0.16 0.99 0.04 0.00 0.00 177.00 176.53 2wva s THR 533 N -2.44 1.68 -0.25 1.26 2.01 -0.14 -1.55 115.64 116.21 2wva s THR 533 Ca 0.66 -0.71 -0.10 0.00 0.31 0.00 0.00 61.69 61.85 2wva s THR 533 Cb -0.20 -1.55 -0.05 0.00 0.01 0.00 0.00 72.50 70.71 2wva s THR 533 CO 0.44 0.48 0.16 -0.22 -0.69 0.00 0.00 174.62 174.78 2wva s LEU 534 N 1.33 4.00 -0.36 4.42 0.20 0.64 -0.16 118.68 128.75 2wva s LEU 534 Ca 0.02 0.04 -0.06 0.00 0.69 0.00 0.00 54.13 54.82 2wva s LEU 534 Cb -0.13 -2.08 0.06 0.00 -0.43 0.00 0.00 46.19 43.60 2wva s LEU 534 CO -0.09 0.02 0.13 -0.63 -0.29 0.00 0.00 176.35 175.49 2wva s ILE 535 N 1.31 3.68 -0.59 6.68 1.01 0.72 -0.70 121.20 133.32 2wva s ILE 535 Ca 0.07 -1.34 -0.26 0.00 0.00 0.00 0.00 60.65 59.12 2wva s ILE 535 Cb -0.14 -3.18 0.04 0.00 0.01 0.00 0.00 42.46 39.18 2wva s ILE 535 CO 0.06 -0.30 1.08 -0.70 0.00 0.00 0.00 174.94 175.08 2wva s GLU 536 N 1.35 3.38 -0.20 2.79 2.12 0.15 -1.64 118.70 126.65 2wva s GLU 536 Ca -0.00 -0.07 -0.14 0.00 0.36 0.00 0.00 54.97 55.11 2wva s GLU 536 Cb -0.21 -4.06 -0.04 0.00 0.26 0.00 0.00 34.13 30.08 2wva s GLU 536 CO 0.01 -1.65 0.32 0.00 -0.54 0.00 0.00 175.26 173.41 2wva s PHE 538 N 0.99 3.23 0.21 0.00 0.40 -0.72 0.10 117.98 122.19 2wva s PHE 538 Ca 0.16 -0.37 0.01 0.00 -0.60 0.00 0.00 56.93 56.13 2wva s PHE 538 Cb -0.14 -2.54 -0.05 0.00 0.51 0.00 0.00 43.02 40.80 2wva s PHE 538 CO 0.06 -0.47 0.06 0.96 0.70 0.00 0.00 175.22 176.53 2wva s ILE 539 N 1.73 0.52 0.74 0.64 -4.36 -1.10 -4.56 121.20 114.80 2wva s ILE 539 Ca 0.06 -1.99 -0.11 0.00 -0.26 0.00 0.00 60.65 58.35 2wva s ILE 539 Cb -0.18 -2.37 0.04 0.00 1.25 0.00 0.00 42.46 41.20 2wva s ILE 539 CO 0.10 -0.23 1.08 -0.83 0.24 0.00 0.00 174.94 175.31 2wva s GLY 540 N -3.22 1.64 0.18 6.27 0.00 -1.26 -3.96 107.32 106.97 2wva s GLY 540 Ca 0.31 -0.09 -0.10 0.00 0.00 0.00 0.00 44.72 44.84 2wva s GLY 540 CO 0.09 0.28 1.71 -0.09 0.00 0.00 0.00 173.10 175.09 2wva h ARG 541 N -0.89 1.01 -0.00 2.90 2.43 -1.94 -2.92 114.38 114.98 2wva h ARG 541 Ca -0.45 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 58.50 2wva h ARG 541 Cb 1.24 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 2wva h ARG 541 CO 0.59 0.89 -0.10 0.39 -1.51 0.00 0.00 179.97 180.22 2wva n GLU 542 N -4.35 0.43 -2.61 0.20 4.71 -1.26 -4.54 120.64 113.23 2wva n GLU 542 Ca 0.04 -0.11 -0.43 0.00 -0.01 0.00 0.00 57.16 56.65 2wva n GLU 542 Cb 0.22 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.15 2wva n GLU 542 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 2wva n ASP 543 N -1.19 4.94 -4.12 1.62 2.03 -1.10 -4.92 116.55 113.82 2wva n ASP 543 Ca 0.12 -2.94 -0.20 0.00 0.52 0.00 0.00 54.79 52.29 2wva n ASP 543 Cb 0.28 -1.67 -0.09 0.00 -0.72 0.00 0.00 41.12 38.92 2wva n ASP 543 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wva s THR 545 N -3.49 2.57 0.29 0.00 -4.23 -1.26 -4.92 115.64 104.60 2wva s THR 545 Ca 0.33 0.30 -0.01 0.00 -1.18 0.00 0.00 61.69 61.13 2wva s THR 545 Cb 0.05 -2.91 0.17 0.00 1.34 0.00 0.00 72.50 71.16 2wva s THR 545 CO 0.16 -0.13 1.86 -0.33 -0.54 0.00 0.00 174.62 175.63 2wva h GLU 546 N 0.08 0.83 -0.63 3.99 5.08 -2.00 -3.13 114.58 118.80 2wva h GLU 546 Ca -0.48 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 57.71 2wva h GLU 546 Cb 1.29 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 2wva h GLU 546 CO 0.52 0.72 0.31 0.93 -1.00 0.00 0.00 179.01 180.48 2wva h GLU 547 N 0.81 0.90 -0.44 2.33 3.07 -1.96 -2.05 114.58 117.24 2wva h GLU 547 Ca 0.19 -0.13 0.01 0.00 -0.50 0.00 0.00 59.36 58.93 2wva h GLU 547 Cb 0.23 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 27.95 2wva h GLU 547 CO -0.01 0.72 0.28 1.25 -1.40 0.00 0.00 179.01 179.85 2wva h LEU 548 N 0.87 0.48 -0.06 1.33 5.85 -1.93 0.89 115.31 122.73 2wva h LEU 548 Ca 0.22 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.93 2wva h LEU 548 Cb 0.11 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 2wva h LEU 548 CO -0.03 0.34 0.04 0.58 -0.34 0.00 0.00 178.44 179.04 2wva h VAL 549 N 0.57 1.02 0.13 1.05 2.07 -1.50 0.43 116.25 120.03 2wva h VAL 549 Ca 0.17 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 2wva h VAL 549 Cb -0.04 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2wva h VAL 549 CO -0.05 0.02 -0.07 0.11 0.02 0.00 0.00 177.57 177.60 2wva h LYS 550 N 0.08 -0.18 -0.56 1.57 1.57 -1.17 -2.87 116.57 115.01 2wva h LYS 550 Ca 0.02 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 2wva h LYS 550 Cb 0.00 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 2wva h LYS 550 CO -0.00 -0.12 0.22 2.35 -0.57 0.00 0.00 179.45 181.32 2wva h TRP 551 N -0.18 0.86 -0.78 -1.35 7.01 -0.74 -3.00 115.95 117.77 2wva h TRP 551 Ca -0.02 -0.07 0.13 0.00 2.11 0.00 0.00 58.89 61.04 2wva h TRP 551 Cb 0.15 -0.26 -0.09 0.00 -2.10 0.00 0.00 29.16 26.86 2wva h TRP 551 CO -0.07 0.70 0.38 0.78 -2.79 0.00 0.00 178.44 177.44 2wva h GLY 552 N 0.77 1.21 1.14 2.65 0.00 -0.09 -1.44 103.07 107.31 2wva h GLY 552 Ca 0.19 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.22 2wva h GLY 552 CO -0.01 -0.01 0.10 0.50 0.00 0.00 0.00 176.54 177.12 2wva h LYS 553 N 0.58 1.05 -0.39 4.80 1.57 -1.36 -1.38 116.57 121.44 2wva h LYS 553 Ca 0.41 -0.27 -0.10 0.00 -1.87 0.00 0.00 60.65 58.82 2wva h LYS 553 Cb 0.54 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 2wva h LYS 553 CO -0.34 0.96 -0.13 0.00 -0.57 0.00 0.00 179.45 179.37 2wva h ARG 554 N 0.99 0.78 -0.12 3.15 2.47 -1.40 -2.16 114.38 118.08 2wva h ARG 554 Ca 0.20 -0.32 0.00 0.00 -1.26 0.00 0.00 59.98 58.60 2wva h ARG 554 Cb 0.42 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.70 2wva h ARG 554 CO 0.01 0.93 0.08 0.28 0.56 0.00 0.00 179.97 181.83 2wva h VAL 555 N 0.59 1.05 -0.89 2.04 2.07 -1.14 -1.31 116.25 118.65 2wva h VAL 555 Ca 0.09 -0.10 0.06 0.00 0.82 0.00 0.00 66.70 67.57 2wva h VAL 555 Cb 0.67 0.89 -0.06 0.00 -1.52 0.00 0.00 31.29 31.27 2wva h VAL 555 CO 0.05 0.04 0.57 0.00 0.02 0.00 0.00 177.57 178.24 2wva h ALA 556 N 1.03 1.22 -0.34 1.67 0.00 -1.21 -1.00 119.26 120.63 2wva h ALA 556 Ca 0.05 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2wva h ALA 556 Cb 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2wva h ALA 556 CO -0.01 0.35 0.07 0.00 0.00 0.00 0.00 179.25 179.66 2wva h ALA 557 N 1.40 0.45 -0.69 0.00 0.00 -1.12 -1.99 119.26 117.31 2wva h ALA 557 Ca 0.38 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2wva h ALA 557 Cb 0.13 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2wva h ALA 557 CO -0.16 0.14 0.44 0.00 0.00 0.00 0.00 179.25 179.66 2wva h ALA 558 N 0.91 0.88 -0.44 0.00 0.00 -0.89 -2.28 119.26 117.43 2wva h ALA 558 Ca 0.10 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2wva h ALA 558 Cb 0.33 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2wva h ALA 558 CO 0.00 0.33 0.05 -0.91 0.00 0.00 0.00 179.25 178.73 2wva h ASN 559 N 0.94 0.65 0.00 0.00 -0.26 -0.96 -3.18 115.58 112.77 2wva h ASN 559 Ca 0.25 -0.13 0.00 0.00 -0.56 0.00 0.00 56.30 55.87 2wva h ASN 559 Cb -0.06 -0.17 0.00 0.00 -1.06 0.00 0.00 38.32 37.03 2wva h ASN 559 CO -0.05 0.69 -0.18 -1.54 -1.06 0.00 0.00 177.43 175.28 2wva n SER 560 N -4.27 2.32 -4.68 5.81 3.41 -0.77 -4.98 113.62 110.46 2wva n SER 560 Ca 0.03 -1.68 -0.45 0.00 -0.26 0.00 0.00 58.87 56.51 2wva n SER 560 Cb 0.25 0.17 -0.03 0.00 -0.26 0.00 0.00 64.21 64.34 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 0.57 2.24 -0.65 4.33 1.85 -0.87 -4.90 116.66 119.23 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 0.50 -2.55 0.18 0.00 -1.05 0.00 0.00 32.46 29.55 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 2.94 -1.02 -2.54 2.89 2.85 -1.26 -4.93 118.16 117.10 2wva n LYS 562 Ca 0.14 -0.25 -0.42 0.00 -1.05 0.00 0.00 58.31 56.74 2wva n LYS 562 Cb 0.31 -2.17 -0.03 0.00 -0.65 0.00 0.00 35.03 32.48 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 -4.29 4.54 0.68 -1.58 0.01 -1.26 -5.02 135.00 128.08 2wva s PRO 563 Ca 0.65 1.66 -0.12 0.00 0.01 0.00 0.00 61.00 63.19 2wva s PRO 563 Cb -0.22 -3.34 0.01 0.00 0.01 0.00 0.00 34.50 30.95 2wva s PRO 563 CO 0.62 -0.05 1.07 0.08 0.01 0.00 0.00 177.00 178.73 2wva s VAL 564 N 0.46 3.82 -0.18 3.83 1.01 -1.26 -5.03 120.40 123.05 2wva s VAL 564 Ca 0.53 0.67 -0.06 0.00 0.00 0.00 0.00 61.98 63.12 2wva s VAL 564 Cb -0.27 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 2wva s VAL 564 CO 0.31 -0.70 0.02 0.21 0.00 0.00 0.00 175.10 174.94 2wva s ASN 565 N -3.43 5.23 0.00 3.32 2.47 -1.26 -5.32 114.94 115.95 2wva s ASN 565 Ca 0.60 -0.04 0.00 0.00 0.42 0.00 0.00 52.86 53.84 2wva s ASN 565 Cb -0.15 -1.89 0.00 0.00 -1.45 0.00 0.00 41.25 37.76 2wva s ASN 565 CO 0.50 0.14 0.00 2.29 -3.72 0.00 0.00 177.10 176.31