#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wva s ARG 6 N 0.00 0.16 0.55 4.33 1.81 -1.26 -5.13 118.95 119.41 1wva s ARG 6 Ca 0.00 0.16 -0.21 0.00 -1.72 0.00 0.00 55.73 53.96 1wva s ARG 6 Cb 0.00 -1.31 -0.05 0.00 -0.45 0.00 0.00 34.95 33.15 1wva s ARG 6 CO 0.00 -0.65 1.27 0.99 -0.68 0.00 0.00 175.30 176.24 1wva s THR 7 N 2.28 2.42 -0.12 0.02 2.01 -1.26 -4.47 115.64 116.52 1wva s THR 7 Ca 0.06 0.30 -0.05 0.00 0.31 0.00 0.00 61.69 62.30 1wva s THR 7 Cb -0.16 -3.14 -0.04 0.00 0.01 0.00 0.00 72.50 69.18 1wva s THR 7 CO -0.11 -0.02 0.09 -0.63 -0.69 0.00 0.00 174.62 173.25 1wva s ILE 8 N -1.43 5.04 -0.44 1.82 -1.09 0.13 -0.32 121.20 124.90 1wva s ILE 8 Ca 0.73 0.03 0.03 0.00 -2.23 0.00 0.00 60.65 59.21 1wva s ILE 8 Cb -0.35 -3.18 0.12 0.00 -1.58 0.00 0.00 42.46 37.47 1wva s ILE 8 CO 0.40 0.60 0.20 -0.83 -1.23 0.00 0.00 174.94 174.08 1wva s GLY 9 N -0.81 1.96 0.28 6.18 0.00 0.23 -1.99 107.32 113.17 1wva s GLY 9 Ca 0.13 -2.76 -0.29 0.00 0.00 0.00 0.00 44.72 41.80 1wva s GLY 9 CO 0.03 1.23 1.07 -0.42 0.00 0.00 0.00 173.10 175.01 1wva s ILE 10 N 0.33 3.60 -0.05 0.90 1.09 -0.87 0.07 121.20 126.27 1wva s ILE 10 Ca 0.15 1.60 -0.02 0.00 -1.10 0.00 0.00 60.65 61.28 1wva s ILE 10 Cb -0.23 -4.01 0.04 0.00 -1.06 0.00 0.00 42.46 37.19 1wva s ILE 10 CO -0.04 0.37 0.09 -0.63 -0.10 0.00 0.00 174.94 174.63 1wva s ILE 11 N -1.18 -0.14 0.27 2.92 1.01 0.08 -0.93 121.20 123.22 1wva s ILE 11 Ca 0.44 0.38 -0.19 0.00 0.00 0.00 0.00 60.65 61.28 1wva s ILE 11 Cb -0.30 -0.19 -0.09 0.00 0.01 0.00 0.00 42.46 41.89 1wva s ILE 11 CO 0.39 0.16 0.76 -0.83 0.00 0.00 0.00 174.94 175.42 1wva s GLY 12 N 2.05 2.54 -0.42 6.18 0.00 0.16 -1.89 107.32 115.94 1wva s GLY 12 Ca 0.02 0.18 0.08 0.00 0.00 0.00 0.00 44.72 45.01 1wva s GLY 12 CO -0.04 0.50 0.79 0.00 0.00 0.00 0.00 173.10 174.35 1wva n ALA 13 N 0.32 0.74 -1.00 3.20 0.00 -1.06 -0.70 120.51 122.00 1wva n ALA 13 Ca 0.00 -2.53 -0.40 0.00 0.00 0.00 0.00 53.44 50.52 1wva n ALA 13 Cb 0.52 -1.04 -0.06 0.00 0.00 0.00 0.00 19.45 18.87 1wva n ALA 13 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1wva n PRO 14 N 0.93 1.40 -5.12 0.00 -0.04 -1.26 -2.60 135.00 128.31 1wva n PRO 14 Ca 0.16 -1.68 -0.32 0.00 -0.04 0.00 0.00 63.50 61.63 1wva n PRO 14 Cb 0.62 -2.79 -0.15 0.00 -0.04 0.00 0.00 33.50 31.14 1wva n PRO 14 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1wva s PHE 15 N 4.98 2.54 0.00 0.54 5.36 -1.26 -4.81 117.98 125.33 1wva s PHE 15 Ca 0.55 -0.55 0.00 0.00 -0.96 0.00 0.00 56.93 55.96 1wva s PHE 15 Cb 0.14 -1.63 0.00 0.00 -0.34 0.00 0.00 43.02 41.19 1wva s PHE 15 CO 0.12 -0.11 0.41 -1.13 -1.46 0.00 0.00 175.22 173.05 1wva n SER 16 N 2.83 0.57 -0.08 6.13 3.41 -1.26 -2.35 113.62 122.87 1wva n SER 16 Ca -0.17 -1.16 0.02 0.00 -0.26 0.00 0.00 58.87 57.29 1wva n SER 16 Cb 0.52 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.57 1wva n SER 16 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1wva n LYS 17 N -0.08 1.10 0.00 4.33 5.02 -1.26 -2.71 118.16 124.56 1wva n LYS 17 Ca 0.00 -0.15 0.13 0.00 -2.02 0.00 0.00 58.31 56.27 1wva n LYS 17 Cb 0.25 -1.08 0.45 0.00 -0.02 0.00 0.00 35.03 34.63 1wva n LYS 17 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wva n GLY 18 N 0.61 -0.72 3.61 0.72 0.00 -1.26 -4.68 105.19 103.47 1wva n GLY 18 Ca 0.04 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.58 1wva n GLY 18 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1wva s GLN 19 N -2.50 1.99 0.16 1.61 1.03 -1.10 -0.74 119.66 120.11 1wva s GLN 19 Ca 0.26 -1.59 -0.02 0.00 0.04 0.00 0.00 55.36 54.04 1wva s GLN 19 Cb 0.19 0.51 0.00 0.00 0.03 0.00 0.00 33.01 33.75 1wva s GLN 19 CO 0.51 -0.87 1.39 -1.00 -2.54 0.00 0.00 175.29 172.78 1wva h PRO 20 N 2.08 0.41 -5.54 9.60 0.13 -1.91 -3.45 132.00 133.31 1wva h PRO 20 Ca -0.29 -0.37 -0.63 0.00 -0.87 0.00 0.00 66.00 63.84 1wva h PRO 20 Cb 1.24 0.09 -0.14 0.00 0.13 0.00 0.00 31.00 32.33 1wva h PRO 20 CO 0.39 1.02 0.20 1.03 -0.23 0.00 0.00 178.00 180.40 1wva s ARG 21 N -3.49 3.53 0.08 0.86 0.52 -1.26 -4.95 118.95 114.24 1wva s ARG 21 Ca -0.06 -0.06 0.09 0.00 -0.52 0.00 0.00 55.73 55.18 1wva s ARG 21 Cb 0.10 -3.87 0.42 0.00 0.52 0.00 0.00 34.95 32.12 1wva s ARG 21 CO 0.85 -0.88 1.27 0.41 0.02 0.00 0.00 175.30 176.96 1wva n GLY 22 N 4.81 -0.72 0.25 -3.53 0.00 -1.26 -3.69 105.19 101.05 1wva n GLY 22 Ca -0.00 0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.15 1wva n GLY 22 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wva h GLY 23 N 0.59 0.00 1.70 -0.02 0.00 -1.95 -3.00 103.07 100.39 1wva h GLY 23 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wva h GLY 23 CO 0.00 0.00 0.09 3.33 0.00 0.00 0.00 176.54 179.96 1wva n VAL 24 N -3.99 1.22 0.16 4.60 0.24 -1.24 0.02 118.33 119.35 1wva n VAL 24 Ca -0.02 0.64 0.03 0.00 -2.04 0.00 0.00 64.34 62.95 1wva n VAL 24 Cb 0.21 -1.64 0.40 0.00 -1.47 0.00 0.00 33.84 31.35 1wva n VAL 24 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 1wva h GLU 25 N 0.00 0.11 -0.02 7.34 5.08 -1.77 -2.10 114.58 123.23 1wva h GLU 25 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1wva h GLU 25 Cb 0.19 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1wva h GLU 25 CO 0.00 0.33 0.02 0.93 -1.00 0.00 0.00 179.01 179.30 1wva h GLU 26 N 0.10 0.00 -0.15 2.33 5.08 -0.66 -3.35 114.58 117.93 1wva h GLU 26 Ca 0.02 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1wva h GLU 26 Cb 0.46 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1wva h GLU 26 CO 0.03 0.00 -0.09 0.41 -1.00 0.00 0.00 179.01 178.36 1wva n GLY 27 N -1.28 -2.47 0.26 -3.84 0.00 -0.79 -1.64 105.19 95.43 1wva n GLY 27 Ca -0.03 0.57 0.03 0.00 0.00 0.00 0.00 46.02 46.60 1wva n GLY 27 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1wva h PRO 28 N 0.00 0.34 0.37 1.61 0.11 -1.72 -0.96 132.00 131.75 1wva h PRO 28 Ca 0.02 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 1wva h PRO 28 Cb 0.06 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 1wva h PRO 28 CO -0.14 0.23 -0.23 1.15 -0.21 0.00 0.00 178.00 178.79 1wva h THR 29 N 0.35 0.51 -0.57 -1.15 2.02 -1.64 -0.48 112.91 111.97 1wva h THR 29 Ca 0.37 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.47 1wva h THR 29 Cb 0.56 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 1wva h THR 29 CO -0.41 0.00 0.02 0.58 0.37 0.00 0.00 175.52 176.08 1wva h VAL 30 N -0.58 1.26 -0.60 3.16 2.07 -1.12 0.17 116.25 120.60 1wva h VAL 30 Ca -0.04 -1.07 -0.04 0.00 0.82 0.00 0.00 66.70 66.38 1wva h VAL 30 Cb 0.48 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 1wva h VAL 30 CO 0.03 0.39 0.22 -0.07 0.02 0.00 0.00 177.57 178.16 1wva h LEU 31 N 0.89 0.81 0.09 2.57 3.38 -1.05 -1.65 115.31 120.34 1wva h LEU 31 Ca 0.17 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1wva h LEU 31 Cb 0.49 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1wva h LEU 31 CO 0.02 0.74 -0.04 0.03 0.09 0.00 0.00 178.44 179.28 1wva h ARG 32 N 0.86 -0.11 -0.08 1.13 3.08 -0.73 -3.17 114.38 115.36 1wva h ARG 32 Ca 0.20 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.28 1wva h ARG 32 Cb 0.20 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 1wva h ARG 32 CO -0.02 0.41 0.26 -0.22 -1.07 0.00 0.00 179.97 179.33 1wva h LYS 33 N -0.73 0.00 0.00 0.04 3.64 -0.83 0.14 116.57 118.83 1wva h LYS 33 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1wva h LYS 33 Cb 0.57 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1wva h LYS 33 CO 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.20 1wva n ALA 34 N -2.06 2.57 -1.66 5.00 0.00 -0.63 -4.87 120.51 118.86 1wva n ALA 34 Ca -0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 53.44 53.33 1wva n ALA 34 Cb 0.34 -1.22 -0.00 0.00 0.00 0.00 0.00 19.45 18.56 1wva n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wva n GLY 35 N 0.70 0.38 0.29 0.00 0.00 0.50 -4.97 105.19 102.09 1wva n GLY 35 Ca 0.10 -0.88 0.02 0.00 0.00 0.00 0.00 46.02 45.26 1wva n GLY 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1wva h LEU 36 N 0.00 0.58 0.06 0.99 5.85 -1.58 -2.58 115.31 118.63 1wva h LEU 36 Ca -0.05 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1wva h LEU 36 Cb 0.68 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1wva h LEU 36 CO 0.06 0.34 -0.03 -0.07 -0.34 0.00 0.00 178.44 178.40 1wva h LEU 37 N 0.71 -0.07 -1.79 2.25 3.38 -1.87 -2.28 115.31 115.64 1wva h LEU 37 Ca 0.36 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1wva h LEU 37 Cb 0.33 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 1wva h LEU 37 CO -0.24 0.18 -0.15 -0.33 0.09 0.00 0.00 178.44 177.99 1wva h GLU 38 N -0.33 0.00 -0.05 1.13 3.07 -1.94 -0.22 114.58 116.23 1wva h GLU 38 Ca -0.01 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.64 1wva h GLU 38 Cb 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 1wva h GLU 38 CO 0.01 0.15 -0.85 0.87 -1.40 0.00 0.00 179.01 177.80 1wva h LYS 39 N 0.00 0.49 -0.06 2.33 1.57 -1.37 0.16 116.57 119.69 1wva h LYS 39 Ca -0.00 -0.46 -0.13 0.00 -1.87 0.00 0.00 60.65 58.19 1wva h LYS 39 Cb 0.35 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1wva h LYS 39 CO 0.02 1.10 -0.56 -0.07 -0.57 0.00 0.00 179.45 179.37 1wva h LEU 40 N 0.31 0.22 -0.60 2.94 3.38 -0.89 -2.56 115.31 118.12 1wva h LEU 40 Ca -0.06 -0.12 -0.15 0.00 0.09 0.00 0.00 57.88 57.64 1wva h LEU 40 Cb 1.46 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.14 1wva h LEU 40 CO 0.15 0.73 -0.59 0.11 0.09 0.00 0.00 178.44 178.93 1wva h LYS 41 N 0.15 0.35 0.00 1.13 1.57 -0.88 -2.48 116.57 116.41 1wva h LYS 41 Ca -0.00 -0.24 -0.03 0.00 -1.87 0.00 0.00 60.65 58.51 1wva h LYS 41 Cb 1.03 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.37 1wva h LYS 41 CO 0.08 0.84 -0.15 0.93 -0.57 0.00 0.00 179.45 180.59 1wva h GLU 42 N 0.26 0.00 0.00 3.15 5.08 -0.30 -3.41 114.58 119.37 1wva h GLU 42 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1wva h GLU 42 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 1wva h GLU 42 CO 0.10 0.15 0.00 1.04 -1.00 0.00 0.00 179.01 179.30 1wva n GLN 43 N -3.92 3.83 -0.81 2.33 6.02 -0.93 -5.02 117.38 118.89 1wva n GLN 43 Ca -0.02 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.02 1wva n GLN 43 Cb 0.24 0.00 0.15 0.00 1.02 0.00 0.00 30.24 31.65 1wva n GLN 43 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 1wva n GLU 44 N 0.00 1.08 -4.55 -1.09 0.28 -1.25 -5.04 120.64 110.07 1wva n GLU 44 Ca 0.00 -2.82 -0.26 0.00 -0.16 0.00 0.00 57.16 53.92 1wva n GLU 44 Cb 0.00 -1.13 -0.14 0.00 1.43 0.00 0.00 31.44 31.61 1wva n GLU 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1wva s ASP 46 N -1.45 6.79 -0.33 0.00 1.01 -1.26 -4.56 116.67 116.86 1wva s ASP 46 Ca 0.08 2.13 -0.12 0.00 0.71 0.00 0.00 52.55 55.35 1wva s ASP 46 Cb -0.09 -2.55 -0.01 0.00 1.01 0.00 0.00 42.92 41.27 1wva s ASP 46 CO 0.03 -0.80 0.22 -0.69 0.21 0.00 0.00 175.17 174.14 1wva s VAL 47 N 2.99 5.09 -0.39 -1.27 1.01 -1.26 0.17 120.40 126.74 1wva s VAL 47 Ca 0.66 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 62.35 1wva s VAL 47 Cb -0.31 -3.62 0.11 0.00 0.00 0.00 0.00 36.38 32.56 1wva s VAL 47 CO 0.26 0.01 0.17 -0.54 0.00 0.00 0.00 175.10 174.99 1wva s LYS 48 N 1.69 1.86 -0.67 2.72 -0.14 -0.84 -5.00 119.74 119.37 1wva s LYS 48 Ca 0.06 -1.85 -0.27 0.00 -1.36 0.00 0.00 55.97 52.54 1wva s LYS 48 Cb -0.17 -3.48 0.03 0.00 -1.68 0.00 0.00 37.83 32.52 1wva s LYS 48 CO 0.09 -1.04 1.30 0.34 -0.76 0.00 0.00 175.35 175.29 1wva s ASP 49 N 1.55 6.19 0.00 2.83 -1.08 -1.26 -2.05 116.67 122.84 1wva s ASP 49 Ca 0.09 -0.16 0.00 0.00 -0.52 0.00 0.00 52.55 51.96 1wva s ASP 49 Cb -0.22 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.69 1wva s ASP 49 CO -0.05 -1.75 0.78 -1.22 0.52 0.00 0.00 175.17 173.44 1wva n TYR 50 N 9.33 0.00 -3.30 -5.34 4.02 -0.11 -4.97 117.16 116.80 1wva n TYR 50 Ca 0.07 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 57.98 1wva n TYR 50 Cb 0.49 -0.01 -0.01 0.00 -0.02 0.00 0.00 39.34 39.79 1wva n TYR 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1wva n GLY 51 N 0.30 -1.75 3.61 2.72 0.00 -1.26 -4.81 105.19 104.00 1wva n GLY 51 Ca 0.00 -1.28 -0.36 0.00 0.00 0.00 0.00 46.02 44.38 1wva n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wva s ASP 52 N -4.07 5.81 0.20 1.61 1.11 -1.26 0.38 116.67 120.44 1wva s ASP 52 Ca 0.00 0.04 -0.32 0.00 0.18 0.00 0.00 52.55 52.45 1wva s ASP 52 Cb 0.00 -2.04 -0.12 0.00 1.07 0.00 0.00 42.92 41.84 1wva s ASP 52 CO 0.00 0.07 1.73 -0.76 1.18 0.00 0.00 175.17 177.38 1wva s LEU 53 N 1.03 4.37 -0.52 1.23 1.43 0.12 -4.87 118.68 121.48 1wva s LEU 53 Ca 0.06 2.85 -0.20 0.00 -1.03 0.00 0.00 54.13 55.81 1wva s LEU 53 Cb -0.14 -3.60 0.06 0.00 0.03 0.00 0.00 46.19 42.54 1wva s LEU 53 CO 0.04 -0.97 0.69 -2.16 0.23 0.00 0.00 176.35 174.18 1wva s PRO 54 N 1.30 3.16 -0.88 1.29 0.04 -1.26 -4.45 135.00 134.21 1wva s PRO 54 Ca 0.75 -0.78 -0.18 0.00 0.04 0.00 0.00 61.00 60.83 1wva s PRO 54 Cb -0.49 -4.09 0.15 0.00 0.04 0.00 0.00 34.50 30.10 1wva s PRO 54 CO 0.32 -1.28 1.01 -0.06 0.04 0.00 0.00 177.00 177.03 1wva s PHE 55 N 2.89 3.26 0.18 0.56 0.08 -1.26 -5.02 117.98 118.66 1wva s PHE 55 Ca 0.18 -1.49 -0.32 0.00 0.12 0.00 0.00 56.93 55.42 1wva s PHE 55 Cb -0.18 -4.15 -0.12 0.00 -0.57 0.00 0.00 43.02 38.00 1wva s PHE 55 CO 0.13 -1.36 1.74 0.00 -0.10 0.00 0.00 175.22 175.63 1wva n ALA 56 N 5.94 2.48 -1.76 5.36 0.00 -1.26 -4.93 120.51 126.34 1wva n ALA 56 Ca 0.19 0.38 -0.36 0.00 0.00 0.00 0.00 53.44 53.65 1wva n ALA 56 Cb 0.48 -2.52 0.01 0.00 0.00 0.00 0.00 19.45 17.42 1wva n ALA 56 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1wva s ASP 57 N 1.58 5.58 -0.53 0.00 3.68 -1.26 -4.99 116.67 120.73 1wva s ASP 57 Ca 0.78 2.31 -0.18 0.00 2.13 0.00 0.00 52.55 57.59 1wva s ASP 57 Cb -0.52 -2.59 0.08 0.00 -1.45 0.00 0.00 42.92 38.43 1wva s ASP 57 CO 0.34 -1.32 0.59 -0.63 0.13 0.00 0.00 175.17 174.28 1wva s ILE 58 N -1.64 4.96 0.15 4.11 -1.09 -1.26 -4.98 121.20 121.46 1wva s ILE 58 Ca 0.73 -0.85 -0.31 0.00 -2.23 0.00 0.00 60.65 57.99 1wva s ILE 58 Cb -0.28 -4.33 -0.07 0.00 -1.58 0.00 0.00 42.46 36.20 1wva s ILE 58 CO 0.32 -0.86 1.53 1.55 -1.23 0.00 0.00 174.94 176.25 1wva h PRO 59 N 8.99 -0.05 -2.79 2.79 0.13 -2.03 -3.06 132.00 135.98 1wva h PRO 59 Ca -0.28 0.00 -0.77 0.00 -0.87 0.00 0.00 66.00 64.07 1wva h PRO 59 Cb 1.10 0.01 -0.30 0.00 0.13 0.00 0.00 31.00 31.93 1wva h PRO 59 CO 1.00 -0.04 0.56 -1.71 -0.23 0.00 0.00 178.00 177.57 1wva n ASN 60 N -5.24 6.00 -4.28 1.44 2.85 -1.26 -4.93 115.26 109.84 1wva n ASN 60 Ca 0.01 -3.43 -0.44 0.00 -0.11 0.00 0.00 54.58 50.62 1wva n ASN 60 Cb 0.27 -1.17 -0.00 0.00 1.24 0.00 0.00 39.78 40.12 1wva n ASN 60 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1wva n ASP 61 N 1.22 5.56 -4.78 1.20 2.03 -1.16 -5.03 116.55 115.58 1wva n ASP 61 Ca 0.27 -3.09 -0.34 0.00 0.52 0.00 0.00 54.79 52.14 1wva n ASP 61 Cb 0.34 -1.34 -0.00 0.00 -0.72 0.00 0.00 41.12 39.40 1wva n ASP 61 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1wva s SER 62 N 0.81 5.81 0.87 1.67 0.01 -1.26 -4.43 113.70 117.18 1wva s SER 62 Ca 0.31 2.04 -0.10 0.00 1.31 0.00 0.00 55.95 59.51 1wva s SER 62 Cb -0.08 -2.57 0.12 0.00 0.21 0.00 0.00 66.02 63.71 1wva s SER 62 CO -0.06 -1.15 1.13 -2.84 0.41 0.00 0.00 173.24 170.73 1wva s PRO 63 N -3.48 1.38 -0.34 12.44 0.02 -1.26 -4.59 135.00 139.17 1wva s PRO 63 Ca 0.69 1.45 -0.04 0.00 0.02 0.00 0.00 61.00 63.12 1wva s PRO 63 Cb -0.20 -1.78 0.06 0.00 0.02 0.00 0.00 34.50 32.60 1wva s PRO 63 CO 0.28 -2.34 0.09 0.12 -0.33 0.00 0.00 177.00 174.82 1wva s PHE 64 N -2.71 3.32 0.00 6.54 5.36 0.62 -4.95 117.98 126.16 1wva s PHE 64 Ca 0.65 -1.78 0.00 0.00 -0.96 0.00 0.00 56.93 54.85 1wva s PHE 64 Cb -0.21 -2.43 0.00 0.00 -0.34 0.00 0.00 43.02 40.04 1wva s PHE 64 CO 0.57 -0.81 0.00 1.04 -1.46 0.00 0.00 175.22 174.56 1wva n GLN 65 N 4.71 0.00 -0.00 10.12 6.02 -1.26 0.87 117.38 137.83 1wva n GLN 65 Ca -0.11 0.00 0.07 0.00 -0.01 0.00 0.00 57.00 56.95 1wva n GLN 65 Cb 0.43 0.00 -0.09 0.00 1.02 0.00 0.00 30.24 31.61 1wva n GLN 65 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.06 177.56 1wva n ILE 66 N 0.00 0.00 -2.41 5.09 3.06 -1.26 -4.95 119.36 118.89 1wva n ILE 66 Ca 0.00 -0.15 -0.43 0.00 -2.50 0.00 0.00 62.75 59.67 1wva n ILE 66 Cb 0.00 0.97 -0.02 0.00 0.54 0.00 0.00 39.64 41.13 1wva n ILE 66 CO 0.00 0.00 0.00 -0.69 -2.50 0.00 0.00 176.55 173.36 1wva s VAL 67 N -2.45 4.25 0.18 9.51 1.01 0.25 -4.33 120.40 128.82 1wva s VAL 67 Ca 0.05 1.52 -0.05 0.00 0.00 0.00 0.00 61.98 63.49 1wva s VAL 67 Cb 0.11 -3.98 -0.06 0.00 0.00 0.00 0.00 36.38 32.46 1wva s VAL 67 CO 0.62 -0.13 0.43 -0.54 0.00 0.00 0.00 175.10 175.48 1wva s LYS 68 N 3.51 3.65 -1.66 2.72 1.02 -0.78 -0.28 119.74 127.92 1wva s LYS 68 Ca 0.55 -0.03 -0.17 0.00 0.02 0.00 0.00 55.97 56.35 1wva s LYS 68 Cb -0.22 -2.79 0.14 0.00 -0.52 0.00 0.00 37.83 34.44 1wva s LYS 68 CO 0.15 0.41 0.85 0.09 -0.92 0.00 0.00 175.35 175.93 1wva n ASN 69 N -0.10 -3.73 -0.30 2.83 3.02 -1.26 -4.69 115.26 111.03 1wva n ASN 69 Ca -0.02 -0.95 0.02 0.00 -0.03 0.00 0.00 54.58 53.61 1wva n ASN 69 Cb 0.52 -3.07 0.16 0.00 -0.61 0.00 0.00 39.78 36.78 1wva n ASN 69 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1wva h PRO 70 N -1.67 0.83 -0.04 3.52 0.13 -1.81 -1.19 132.00 131.78 1wva h PRO 70 Ca -0.59 -0.05 -0.11 0.00 -0.87 0.00 0.00 66.00 64.39 1wva h PRO 70 Cb 1.38 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1wva h PRO 70 CO 0.75 0.55 -0.46 0.00 -0.23 0.00 0.00 178.00 178.61 1wva h ARG 71 N 0.86 0.10 0.03 0.86 3.08 -1.86 -0.31 114.38 117.13 1wva h ARG 71 Ca 0.40 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 60.28 1wva h ARG 71 Cb 0.31 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.37 1wva h ARG 71 CO -0.22 0.54 -0.48 0.77 -1.07 0.00 0.00 179.97 179.51 1wva h SER 72 N 0.08 0.38 -0.26 7.04 0.02 -1.81 -2.07 113.55 116.93 1wva h SER 72 Ca 0.00 -0.82 -0.05 0.00 -0.84 0.00 0.00 61.79 60.08 1wva h SER 72 Cb 0.85 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.26 1wva h SER 72 CO 0.06 1.15 -0.00 0.58 -1.14 0.00 0.00 176.83 177.49 1wva h VAL 73 N -0.35 1.21 -0.07 2.27 2.07 -1.20 -1.78 116.25 118.40 1wva h VAL 73 Ca -0.07 -0.83 -0.17 0.00 0.82 0.00 0.00 66.70 66.45 1wva h VAL 73 Cb 1.25 0.93 0.01 0.00 -1.52 0.00 0.00 31.29 31.96 1wva h VAL 73 CO 0.09 0.29 -0.62 1.23 0.02 0.00 0.00 177.57 178.58 1wva h GLY 74 N 0.87 0.59 2.00 2.17 0.00 -1.08 -2.93 103.07 104.70 1wva h GLY 74 Ca 0.12 -0.92 -0.08 0.00 0.00 0.00 0.00 47.33 46.45 1wva h GLY 74 CO 0.01 0.81 -0.37 1.70 0.00 0.00 0.00 176.54 178.69 1wva h LYS 75 N 0.13 0.00 -0.56 4.80 1.63 -1.33 -1.29 116.57 119.95 1wva h LYS 75 Ca -0.06 0.00 -0.11 0.00 -0.85 0.00 0.00 60.65 59.63 1wva h LYS 75 Cb 1.29 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.90 1wva h LYS 75 CO 0.13 0.37 -0.08 0.00 -3.45 0.00 0.00 179.45 176.42 1wva h ALA 76 N 1.63 0.81 0.05 5.00 0.00 -1.33 -0.56 119.26 124.85 1wva h ALA 76 Ca -0.00 -0.34 -0.26 0.00 0.00 0.00 0.00 54.91 54.31 1wva h ALA 76 Cb 0.90 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 18.50 1wva h ALA 76 CO 0.05 0.67 -1.08 0.77 0.00 0.00 0.00 179.25 179.65 1wva h SER 77 N 0.92 0.73 -0.25 0.00 0.02 -1.34 -2.53 113.55 111.09 1wva h SER 77 Ca 0.15 -0.62 0.03 0.00 -0.84 0.00 0.00 61.79 60.51 1wva h SER 77 Cb 0.64 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 1wva h SER 77 CO 0.04 1.43 0.07 -0.08 -1.14 0.00 0.00 176.83 177.15 1wva h GLU 78 N 0.27 0.17 0.04 3.45 4.81 -1.00 0.63 114.58 122.96 1wva h GLU 78 Ca -0.13 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1wva h GLU 78 Cb 1.74 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 31.09 1wva h GLU 78 CO 0.20 0.11 -0.02 1.96 -0.73 0.00 0.00 179.01 180.53 1wva h GLN 79 N 0.18 -0.05 -0.99 1.92 4.20 -1.17 -2.58 115.11 116.61 1wva h GLN 79 Ca 0.11 0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.90 1wva h GLN 79 Cb 0.10 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 27.82 1wva h GLN 79 CO -0.13 0.02 0.64 1.25 -0.67 0.00 0.00 178.83 179.94 1wva h LEU 80 N -0.11 1.01 -0.12 1.46 5.85 -0.96 -0.03 115.31 122.41 1wva h LEU 80 Ca -0.01 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1wva h LEU 80 Cb 0.10 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 1wva h LEU 80 CO 0.01 0.64 0.07 0.00 -0.34 0.00 0.00 178.44 178.82 1wva h ALA 81 N 1.46 0.15 -0.33 1.25 0.00 0.46 0.29 119.26 122.53 1wva h ALA 81 Ca 0.44 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.28 1wva h ALA 81 Cb 0.20 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1wva h ALA 81 CO -0.18 -0.35 -0.01 0.78 0.00 0.00 0.00 179.25 179.49 1wva h GLY 82 N 0.14 0.54 0.92 0.00 0.00 -1.03 -1.14 103.07 102.51 1wva h GLY 82 Ca 0.04 -0.32 -0.08 0.00 0.00 0.00 0.00 47.33 46.97 1wva h GLY 82 CO -0.01 0.30 -0.12 0.50 0.00 0.00 0.00 176.54 177.21 1wva h LYS 83 N 0.49 0.63 -0.21 4.80 6.56 -0.25 -3.01 116.57 125.58 1wva h LYS 83 Ca 0.10 -0.26 -0.08 0.00 -1.06 0.00 0.00 60.65 59.35 1wva h LYS 83 Cb 0.33 -0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 31.95 1wva h LYS 83 CO 0.01 0.84 -0.22 0.28 -2.06 0.00 0.00 179.45 178.30 1wva h VAL 84 N 0.40 1.24 0.00 0.50 2.07 -0.16 -2.61 116.25 117.69 1wva h VAL 84 Ca 0.07 -1.13 -0.07 0.00 0.82 0.00 0.00 66.70 66.39 1wva h VAL 84 Cb 0.63 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1wva h VAL 84 CO 0.04 0.36 -0.32 0.00 0.02 0.00 0.00 177.57 177.67 1wva h ALA 85 N 1.43 1.25 0.00 1.67 0.00 -1.16 -2.03 119.26 120.42 1wva h ALA 85 Ca 0.06 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 1wva h ALA 85 Cb 0.58 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.33 1wva h ALA 85 CO 0.04 0.40 -0.46 1.49 0.00 0.00 0.00 179.25 180.71 1wva h GLU 86 N 0.00 0.31 -0.76 0.00 4.57 -1.33 -1.69 114.58 115.67 1wva h GLU 86 Ca -0.00 -0.34 -0.05 0.00 -1.18 0.00 0.00 59.36 57.79 1wva h GLU 86 Cb 0.66 0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.31 1wva h GLU 86 CO 0.04 1.03 0.29 -0.39 -1.18 0.00 0.00 179.01 178.80 1wva h VAL 87 N -0.27 1.26 0.00 0.32 -1.51 -1.48 0.81 116.25 115.38 1wva h VAL 87 Ca -0.06 -0.84 0.00 0.00 -1.23 0.00 0.00 66.70 64.57 1wva h VAL 87 Cb 1.20 0.38 0.00 0.00 -2.13 0.00 0.00 31.29 30.74 1wva h VAL 87 CO 0.09 0.34 0.00 0.11 -1.23 0.00 0.00 177.57 176.88 1wva h LYS 88 N 1.11 0.00 0.08 5.19 1.79 -1.40 -2.15 116.57 121.18 1wva h LYS 88 Ca 0.25 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 58.44 1wva h LYS 88 Cb 0.24 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.87 1wva h LYS 88 CO -0.02 0.00 -1.44 -0.22 -1.08 0.00 0.00 179.45 176.69 1wva h LYS 89 N 0.00 0.17 -0.95 3.15 3.64 -0.07 -3.17 116.57 119.34 1wva h LYS 89 Ca 0.00 -0.29 -0.02 0.00 -1.27 0.00 0.00 60.65 59.07 1wva h LYS 89 Cb 0.40 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 1wva h LYS 89 CO 0.00 1.02 0.02 0.09 -2.27 0.00 0.00 179.45 178.31 1wva n ASN 90 N -3.38 2.04 -3.31 4.20 3.02 0.10 -4.87 115.26 113.06 1wva n ASN 90 Ca -0.13 -2.16 -0.11 0.00 -0.03 0.00 0.00 54.58 52.14 1wva n ASN 90 Cb 1.02 -0.53 0.02 0.00 -0.61 0.00 0.00 39.78 39.68 1wva n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wva n GLY 91 N 0.13 -1.21 3.42 7.41 0.00 -1.16 -5.03 105.19 108.75 1wva n GLY 91 Ca 0.05 0.51 -0.10 0.00 0.00 0.00 0.00 46.02 46.49 1wva n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wva s ARG 92 N -4.00 1.30 -0.15 1.61 0.52 -0.88 -4.52 118.95 112.83 1wva s ARG 92 Ca 0.15 -1.23 -0.23 0.00 -0.52 0.00 0.00 55.73 53.90 1wva s ARG 92 Cb -0.04 0.41 -0.02 0.00 0.52 0.00 0.00 34.95 35.82 1wva s ARG 92 CO 0.79 -0.50 0.72 0.42 0.02 0.00 0.00 175.30 176.75 1wva s ILE 93 N -4.00 4.97 -0.01 1.52 -1.09 0.56 -4.23 121.20 118.93 1wva s ILE 93 Ca 0.21 1.41 -0.30 0.00 -2.23 0.00 0.00 60.65 59.74 1wva s ILE 93 Cb 0.02 -4.04 -0.03 0.00 -1.58 0.00 0.00 42.46 36.83 1wva s ILE 93 CO 0.04 0.11 1.00 -0.94 -1.23 0.00 0.00 174.94 173.92 1wva s SER 94 N 1.08 7.34 -0.35 3.58 1.04 -0.66 0.74 113.70 126.47 1wva s SER 94 Ca 0.34 1.67 0.03 0.00 0.48 0.00 0.00 55.95 58.47 1wva s SER 94 Cb -0.17 -2.57 0.10 0.00 0.10 0.00 0.00 66.02 63.49 1wva s SER 94 CO 0.13 -0.30 0.07 -0.22 0.98 0.00 0.00 173.24 173.91 1wva s LEU 95 N 1.14 4.25 -0.28 2.42 0.20 0.11 0.20 118.68 126.73 1wva s LEU 95 Ca 0.52 -2.13 -0.15 0.00 0.69 0.00 0.00 54.13 53.07 1wva s LEU 95 Cb -0.21 -1.48 -0.04 0.00 -0.43 0.00 0.00 46.19 44.03 1wva s LEU 95 CO 0.27 -0.38 0.36 -0.69 -0.29 0.00 0.00 176.35 175.62 1wva s VAL 96 N 0.94 5.18 -0.89 1.68 1.01 -0.09 -0.74 120.40 127.50 1wva s VAL 96 Ca 0.11 0.48 -0.13 0.00 0.00 0.00 0.00 61.98 62.44 1wva s VAL 96 Cb -0.19 -3.70 0.23 0.00 0.00 0.00 0.00 36.38 32.72 1wva s VAL 96 CO -0.10 0.13 0.84 -0.76 0.00 0.00 0.00 175.10 175.21 1wva s LEU 97 N 2.05 6.66 0.00 3.92 1.43 -0.79 -0.95 118.68 130.99 1wva s LEU 97 Ca 0.14 -2.87 0.00 0.00 -1.03 0.00 0.00 54.13 50.37 1wva s LEU 97 Cb -0.16 -2.21 0.00 0.00 0.03 0.00 0.00 46.19 43.85 1wva s LEU 97 CO 0.10 -0.52 0.00 0.61 0.23 0.00 0.00 176.35 176.77 1wva n GLY 98 N 3.73 0.92 0.00 -3.19 0.00 -1.14 -2.58 105.19 102.94 1wva n GLY 98 Ca 0.16 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.23 1wva n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wva n GLY 99 N 5.00 0.27 3.85 -0.02 0.00 -1.07 -4.42 105.19 108.80 1wva n GLY 99 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1wva n GLY 99 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1wva s ASP 100 N -0.41 6.79 0.00 1.61 1.47 -0.99 -0.92 116.67 124.22 1wva s ASP 100 Ca 0.00 1.05 0.00 0.00 1.18 0.00 0.00 52.55 54.78 1wva s ASP 100 Cb 0.00 -2.28 0.00 0.00 -0.34 0.00 0.00 42.92 40.30 1wva s ASP 100 CO 0.00 0.08 0.57 1.57 0.68 0.00 0.00 175.17 178.06 1wva n HIS 101 N 0.66 0.00 0.26 2.11 -0.00 -1.26 -1.79 115.22 115.20 1wva n HIS 101 Ca -0.04 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.81 1wva n HIS 101 Cb 0.52 -0.15 0.71 0.00 -0.00 0.00 0.00 29.99 31.07 1wva n HIS 101 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1wva h SER 102 N 0.00 0.00 0.34 0.26 4.64 -1.76 -1.65 113.55 115.38 1wva h SER 102 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1wva h SER 102 Cb 0.11 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1wva h SER 102 CO 0.00 0.12 -0.00 -0.07 -0.87 0.00 0.00 176.83 176.01 1wva h LEU 103 N 0.00 0.00 -2.04 5.97 3.38 -1.70 -2.53 115.31 118.39 1wva h LEU 103 Ca -0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.05 1wva h LEU 103 Cb 0.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1wva h LEU 103 CO 0.02 0.00 0.23 0.00 0.09 0.00 0.00 178.44 178.77 1wva h ALA 104 N 2.00 2.21 -0.10 1.53 0.00 -1.55 -0.40 119.26 122.96 1wva h ALA 104 Ca -0.00 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.93 1wva h ALA 104 Cb 0.17 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1wva h ALA 104 CO 0.00 -0.38 -0.14 0.82 0.00 0.00 0.00 179.25 179.56 1wva h ILE 105 N 0.00 0.64 -0.23 0.00 2.04 -1.66 -0.37 117.51 117.92 1wva h ILE 105 Ca 0.14 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.85 1wva h ILE 105 Cb 0.59 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1wva h ILE 105 CO -0.00 0.00 -0.44 1.23 0.00 0.00 0.00 178.15 178.94 1wva h GLY 106 N -0.18 0.77 0.64 5.37 0.00 -1.28 -2.15 103.07 106.23 1wva h GLY 106 Ca 0.08 -0.91 0.03 0.00 0.00 0.00 0.00 47.33 46.54 1wva h GLY 106 CO -0.20 0.81 -0.06 0.23 0.00 0.00 0.00 176.54 177.32 1wva h SER 107 N 0.42 -0.20 0.66 0.19 0.87 -0.99 -0.19 113.55 114.31 1wva h SER 107 Ca 0.01 0.06 -0.14 0.00 -1.23 0.00 0.00 61.79 60.48 1wva h SER 107 Cb 1.04 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 63.10 1wva h SER 107 CO 0.10 -0.07 -0.67 0.40 -0.53 0.00 0.00 176.83 176.05 1wva h ILE 108 N -0.03 1.48 0.16 2.23 2.04 -1.14 -2.30 117.51 119.96 1wva h ILE 108 Ca 0.08 -2.28 -0.01 0.00 1.00 0.00 0.00 64.86 63.65 1wva h ILE 108 Cb 0.15 2.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.46 1wva h ILE 108 CO -0.18 0.65 -0.08 0.28 0.00 0.00 0.00 178.15 178.82 1wva h SER 109 N 0.01 -0.19 0.10 1.72 0.02 -1.08 -0.43 113.55 113.70 1wva h SER 109 Ca -0.01 -0.34 -0.01 0.00 -0.84 0.00 0.00 61.79 60.59 1wva h SER 109 Cb 1.18 0.05 -0.00 0.00 0.14 0.00 0.00 62.40 63.77 1wva h SER 109 CO 0.09 0.31 -0.07 1.23 -1.14 0.00 0.00 176.83 177.24 1wva h GLY 110 N -0.75 0.00 0.42 -3.77 0.00 -1.11 -1.44 103.07 96.43 1wva h GLY 110 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 1wva h GLY 110 CO 0.04 0.00 -0.04 0.84 0.00 0.00 0.00 176.54 177.38 1wva h HIS 111 N 0.00 -0.09 0.00 5.60 6.17 -1.35 -3.20 115.15 122.27 1wva h HIS 111 Ca -0.00 -0.00 -0.00 0.00 0.71 0.00 0.00 60.37 61.08 1wva h HIS 111 Cb 0.14 0.03 -0.00 0.00 2.52 0.00 0.00 27.41 30.10 1wva h HIS 111 CO 0.00 0.42 -0.00 0.00 0.71 0.00 0.00 177.93 179.06 1wva h ALA 112 N 0.15 1.00 0.00 5.26 0.00 -0.59 -0.92 119.26 124.16 1wva h ALA 112 Ca -0.01 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1wva h ALA 112 Cb 0.56 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1wva h ALA 112 CO 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 179.25 179.18 1wva h ARG 113 N 0.00 0.00 0.00 0.00 3.08 -1.28 -0.88 114.38 115.30 1wva h ARG 113 Ca -0.00 0.00 -0.39 0.00 0.07 0.00 0.00 59.98 59.66 1wva h ARG 113 Cb 0.15 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.14 1wva h ARG 113 CO 0.00 0.09 -2.47 0.28 -1.07 0.00 0.00 179.97 176.80 1wva n VAL 114 N -3.24 1.48 -3.52 2.04 0.31 -0.52 -4.78 118.33 110.09 1wva n VAL 114 Ca 0.00 -0.57 -0.28 0.00 -0.01 0.00 0.00 64.34 63.48 1wva n VAL 114 Cb 0.34 -1.38 -0.11 0.00 -0.91 0.00 0.00 33.84 31.77 1wva n VAL 114 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 1wva s HIS 115 N -2.51 1.56 -1.23 3.52 3.76 -0.47 -4.97 115.29 114.96 1wva s HIS 115 Ca -0.34 -2.43 0.08 0.00 -0.15 0.00 0.00 55.06 52.22 1wva s HIS 115 Cb 0.09 -1.32 0.39 0.00 1.11 0.00 0.00 32.58 32.85 1wva s HIS 115 CO 0.60 -0.77 1.20 -0.35 -0.85 0.00 0.00 174.74 174.57 1wva n PRO 116 N 2.90 0.06 0.00 8.40 -0.04 -0.34 -2.15 135.00 143.83 1wva n PRO 116 Ca 0.24 0.28 0.13 0.00 -0.04 0.00 0.00 63.50 64.11 1wva n PRO 116 Cb 0.43 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.82 1wva n PRO 116 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1wva n ASP 117 N -1.39 1.43 -4.54 3.54 5.75 -1.26 -4.96 116.55 115.11 1wva n ASP 117 Ca 0.03 -1.30 -0.37 0.00 -0.01 0.00 0.00 54.79 53.14 1wva n ASP 117 Cb 0.08 0.07 0.05 0.00 -1.03 0.00 0.00 41.12 40.29 1wva n ASP 117 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wva n LEU 118 N -0.08 2.33 -4.47 -2.12 -0.00 -0.92 -4.61 117.00 107.14 1wva n LEU 118 Ca 0.16 0.73 -0.30 0.00 -0.00 0.00 0.00 56.01 56.60 1wva n LEU 118 Cb 0.37 -1.29 -0.12 0.00 -0.00 0.00 0.00 43.42 42.38 1wva n LEU 118 CO 0.20 -2.46 -0.49 -0.83 -0.00 0.00 0.00 177.39 173.81 1wva s GLY 119 N -1.30 1.63 -0.07 1.47 0.00 0.21 -4.97 107.32 104.28 1wva s GLY 119 Ca 0.72 -1.27 0.03 0.00 0.00 0.00 0.00 44.72 44.21 1wva s GLY 119 CO 0.51 -1.20 -0.15 0.14 0.00 0.00 0.00 173.10 172.40 1wva s VAL 120 N -1.03 2.95 -0.22 1.40 1.01 0.34 -1.33 120.40 123.52 1wva s VAL 120 Ca 0.16 -0.75 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 1wva s VAL 120 Cb -0.11 -2.16 0.02 0.00 0.00 0.00 0.00 36.38 34.13 1wva s VAL 120 CO 0.07 0.57 -0.11 -0.63 0.00 0.00 0.00 175.10 175.01 1wva s ILE 121 N -0.45 2.65 -0.42 2.22 1.09 -0.80 0.55 121.20 126.04 1wva s ILE 121 Ca 0.05 -0.93 -0.05 0.00 -1.10 0.00 0.00 60.65 58.62 1wva s ILE 121 Cb -0.12 -2.26 0.11 0.00 -1.06 0.00 0.00 42.46 39.13 1wva s ILE 121 CO 0.02 0.35 0.23 0.86 -0.10 0.00 0.00 174.94 176.29 1wva s TRP 122 N 1.33 3.51 -0.40 3.97 -0.11 0.14 -1.73 118.94 125.65 1wva s TRP 122 Ca 0.02 -2.18 -0.22 0.00 1.22 0.00 0.00 56.10 54.94 1wva s TRP 122 Cb -0.15 -3.21 0.01 0.00 -1.50 0.00 0.00 33.47 28.63 1wva s TRP 122 CO -0.07 -0.96 0.75 0.08 -4.62 0.00 0.00 176.95 172.13 1wva s VAL 123 N 1.22 4.74 0.05 5.86 1.01 -0.83 -1.40 120.40 131.05 1wva s VAL 123 Ca 0.06 0.62 -0.27 0.00 0.00 0.00 0.00 61.98 62.40 1wva s VAL 123 Cb -0.23 -4.22 0.09 0.00 0.00 0.00 0.00 36.38 32.01 1wva s VAL 123 CO -0.03 -0.52 0.75 -0.62 0.00 0.00 0.00 175.10 174.68 1wva s ASP 124 N 1.95 -0.48 0.30 3.32 -1.08 -0.88 -0.86 116.67 118.93 1wva s ASP 124 Ca 0.29 0.09 0.23 0.00 -0.52 0.00 0.00 52.55 52.64 1wva s ASP 124 Cb -0.13 0.49 0.28 0.00 -1.46 0.00 0.00 42.92 42.09 1wva s ASP 124 CO 0.19 -0.75 1.40 0.00 0.52 0.00 0.00 175.17 176.53 1wva h ALA 125 N 2.12 0.78 -2.83 3.66 0.00 -1.72 -2.35 119.26 118.93 1wva h ALA 125 Ca -0.27 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.00 1wva h ALA 125 Cb 1.26 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.88 1wva h ALA 125 CO 0.35 0.00 -0.80 -1.01 0.00 0.00 0.00 179.25 177.79 1wva s HIS 126 N -3.24 2.29 -0.08 0.00 3.76 -1.26 -1.11 115.29 115.65 1wva s HIS 126 Ca 0.05 -0.35 0.13 0.00 -0.15 0.00 0.00 55.06 54.74 1wva s HIS 126 Cb 0.08 -1.08 -0.06 0.00 1.11 0.00 0.00 32.58 32.63 1wva s HIS 126 CO 0.71 0.58 1.23 1.79 -0.85 0.00 0.00 174.74 178.19 1wva h THR 127 N 2.86 0.98 -6.06 1.30 1.35 -1.89 -3.47 112.91 107.98 1wva h THR 127 Ca -0.44 -2.48 -0.46 0.00 -0.55 0.00 0.00 66.41 62.48 1wva h THR 127 Cb 1.23 2.44 -0.09 0.00 -1.73 0.00 0.00 68.15 70.00 1wva h THR 127 CO 0.52 0.56 -0.70 0.47 -0.25 0.00 0.00 175.52 176.12 1wva n ASP 128 N -3.17 -4.18 -0.99 5.36 8.00 -1.26 -4.76 116.55 115.55 1wva n ASP 128 Ca -0.02 -0.69 0.00 0.00 0.71 0.00 0.00 54.79 54.80 1wva n ASP 128 Cb 0.82 -3.39 0.21 0.00 -0.02 0.00 0.00 41.12 38.75 1wva n ASP 128 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wva n ILE 129 N -4.37 2.42 -2.62 0.53 0.00 -1.24 -1.84 119.36 112.25 1wva n ILE 129 Ca 0.03 -2.51 -0.33 0.00 0.00 0.00 0.00 62.75 59.94 1wva n ILE 129 Cb 0.52 -0.30 -0.05 0.00 0.00 0.00 0.00 39.64 39.82 1wva n ILE 129 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 1wva s ASN 130 N -2.44 6.76 0.54 9.51 0.01 -1.00 -4.52 114.94 123.81 1wva s ASN 130 Ca 0.43 1.65 0.07 0.00 -0.71 0.00 0.00 52.86 54.30 1wva s ASN 130 Cb 0.38 -2.53 0.05 0.00 0.41 0.00 0.00 41.25 39.56 1wva s ASN 130 CO 0.02 -0.49 0.54 0.42 -1.51 0.00 0.00 177.10 176.08 1wva s THR 131 N -2.37 1.91 0.43 1.60 -4.23 -1.26 -4.23 115.64 107.50 1wva s THR 131 Ca 0.61 -1.31 0.16 0.00 -1.18 0.00 0.00 61.69 59.98 1wva s THR 131 Cb -0.10 -2.22 0.19 0.00 1.34 0.00 0.00 72.50 71.71 1wva s THR 131 CO 0.21 0.00 1.98 -0.65 -0.54 0.00 0.00 174.62 175.63 1wva h PRO 132 N 0.57 0.00 0.00 3.99 0.11 -1.95 -1.31 132.00 133.42 1wva h PRO 132 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1wva h PRO 132 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1wva h PRO 132 CO 0.51 0.20 -0.79 1.28 -0.21 0.00 0.00 178.00 179.00 1wva n LEU 133 N -4.19 0.68 -0.03 2.35 4.77 -1.26 -4.10 117.00 115.23 1wva n LEU 133 Ca -0.02 0.16 0.05 0.00 -0.03 0.00 0.00 56.01 56.17 1wva n LEU 133 Cb 0.26 -0.15 -0.14 0.00 -2.33 0.00 0.00 43.42 41.07 1wva n LEU 133 CO 0.36 -0.04 -0.80 0.35 -1.33 0.00 0.00 177.39 175.93 1wva n THR 134 N -2.12 0.28 -1.72 -5.08 -2.24 -1.11 -4.98 114.28 97.32 1wva n THR 134 Ca 0.03 -0.49 -0.40 0.00 -2.27 0.00 0.00 64.05 60.91 1wva n THR 134 Cb 0.45 -0.07 0.02 0.00 -2.10 0.00 0.00 70.33 68.63 1wva n THR 134 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1wva n THR 135 N -2.26 2.97 -0.02 4.28 5.66 -0.51 -4.87 114.28 119.53 1wva n THR 135 Ca -0.09 -0.50 -0.02 0.00 -3.05 0.00 0.00 64.05 60.39 1wva n THR 135 Cb 0.62 -1.62 -0.04 0.00 -1.55 0.00 0.00 70.33 67.74 1wva n THR 135 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1wva n THR 136 N -0.49 0.29 0.03 1.09 -2.24 -1.26 -4.62 114.28 107.08 1wva n THR 136 Ca 0.08 -0.20 -0.13 0.00 -2.27 0.00 0.00 64.05 61.53 1wva n THR 136 Cb 0.42 -0.70 -0.14 0.00 -2.10 0.00 0.00 70.33 67.81 1wva n THR 136 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1wva h SER 137 N 0.00 0.21 -0.01 3.42 4.64 -1.93 -3.48 113.55 116.40 1wva h SER 137 Ca -0.11 -0.33 -0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1wva h SER 137 Cb 1.16 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1wva h SER 137 CO 0.01 1.28 -0.00 0.61 -0.87 0.00 0.00 176.83 177.86 1wva n GLY 138 N 1.62 0.45 3.65 -0.77 0.00 -1.26 -4.91 105.19 103.97 1wva n GLY 138 Ca -0.15 -0.54 -0.39 0.00 0.00 0.00 0.00 46.02 44.93 1wva n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wva s ASN 139 N -2.50 6.54 0.00 1.61 0.01 -1.26 -1.86 114.94 117.48 1wva s ASN 139 Ca 0.00 0.66 0.14 0.00 -0.71 0.00 0.00 52.86 52.94 1wva s ASN 139 Cb 0.00 -2.30 0.60 0.00 0.41 0.00 0.00 41.25 39.97 1wva s ASN 139 CO 0.00 -0.21 1.42 0.18 -1.51 0.00 0.00 177.10 176.97 1wva n LEU 140 N 4.99 0.00 0.00 0.60 4.77 -0.51 -2.52 117.00 124.32 1wva n LEU 140 Ca -0.04 0.45 0.12 0.00 -0.03 0.00 0.00 56.01 56.52 1wva n LEU 140 Cb 0.50 -0.45 0.64 0.00 -2.33 0.00 0.00 43.42 41.78 1wva n LEU 140 CO 0.42 -0.24 0.92 0.00 -1.33 0.00 0.00 177.39 177.15 1wva n HIS 141 N -1.45 0.00 -1.25 -1.77 1.44 0.08 -2.63 115.22 109.63 1wva n HIS 141 Ca 0.04 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.81 1wva n HIS 141 Cb 0.15 -0.28 0.20 0.00 0.12 0.00 0.00 29.99 30.17 1wva n HIS 141 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1wva n GLY 142 N 0.86 4.76 0.00 -1.39 0.00 -1.05 -4.34 105.19 104.03 1wva n GLY 142 Ca 0.12 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1wva n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1wva n GLN 143 N -1.09 -0.07 -0.24 1.61 6.02 -1.08 -2.37 117.38 120.16 1wva n GLN 143 Ca 0.22 -0.09 0.05 0.00 -0.01 0.00 0.00 57.00 57.16 1wva n GLN 143 Cb 0.80 -0.55 0.17 0.00 1.02 0.00 0.00 30.24 31.68 1wva n GLN 143 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1wva h PRO 144 N 0.00 0.28 -0.48 -1.09 0.13 -1.58 -2.32 132.00 126.95 1wva h PRO 144 Ca 0.00 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.10 1wva h PRO 144 Cb 0.49 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 31.53 1wva h PRO 144 CO 0.00 0.19 0.23 0.28 -0.23 0.00 0.00 178.00 178.47 1wva h VAL 145 N 0.29 1.16 -0.79 1.56 2.07 -1.66 -2.75 116.25 116.14 1wva h VAL 145 Ca 0.40 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 1wva h VAL 145 Cb 0.66 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 1wva h VAL 145 CO -0.48 0.18 0.42 0.77 0.02 0.00 0.00 177.57 178.49 1wva h SER 146 N 0.66 0.98 1.08 0.57 4.64 -1.57 -0.02 113.55 119.89 1wva h SER 146 Ca 0.17 -0.09 -0.03 0.00 -0.47 0.00 0.00 61.79 61.37 1wva h SER 146 Cb 0.06 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 61.90 1wva h SER 146 CO -0.02 0.79 -0.15 -0.26 -0.87 0.00 0.00 176.83 176.32 1wva h PHE 147 N 1.10 0.00 0.08 4.77 -1.00 -1.52 -3.31 116.94 117.07 1wva h PHE 147 Ca 0.28 0.00 -0.29 0.00 2.81 0.00 0.00 57.97 60.77 1wva h PHE 147 Cb 0.04 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.58 1wva h PHE 147 CO 0.01 0.15 -1.55 -0.07 -1.61 0.00 0.00 178.31 175.24 1wva h LEU 148 N 0.00 0.27 -9.62 1.54 3.38 -1.19 -3.38 115.31 106.31 1wva h LEU 148 Ca -0.00 -0.78 -0.54 0.00 0.09 0.00 0.00 57.88 56.65 1wva h LEU 148 Cb 0.73 -0.09 0.06 0.00 0.09 0.00 0.00 40.66 41.45 1wva h LEU 148 CO 0.02 1.66 0.96 0.18 0.09 0.00 0.00 178.44 181.34 1wva n LEU 149 N -3.94 3.79 -0.08 1.67 4.77 -0.10 -1.83 117.00 121.28 1wva n LEU 149 Ca -0.29 1.07 -0.05 0.00 -0.03 0.00 0.00 56.01 56.70 1wva n LEU 149 Cb 0.88 -1.54 0.15 0.00 -2.33 0.00 0.00 43.42 40.58 1wva n LEU 149 CO 0.35 0.07 0.79 0.11 -1.33 0.00 0.00 177.39 177.38 1wva h LYS 150 N 6.52 0.72 0.00 3.23 1.57 -1.30 -2.95 116.57 124.36 1wva h LYS 150 Ca -0.44 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.11 1wva h LYS 150 Cb 1.21 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.46 1wva h LYS 150 CO 0.94 0.82 0.00 0.39 -0.57 0.00 0.00 179.45 181.02 1wva n GLU 151 N -4.16 0.08 0.00 3.15 4.71 -1.26 -2.60 120.64 120.56 1wva n GLU 151 Ca 0.01 0.36 0.10 0.00 -0.01 0.00 0.00 57.16 57.62 1wva n GLU 151 Cb 0.36 -1.67 -0.03 0.00 -1.01 0.00 0.00 31.44 29.10 1wva n GLU 151 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1wva n LEU 152 N -1.82 1.71 -4.77 -4.62 4.32 -1.12 -4.90 117.00 105.79 1wva n LEU 152 Ca 0.02 -0.70 -0.41 0.00 -0.02 0.00 0.00 56.01 54.91 1wva n LEU 152 Cb 0.17 0.00 -0.01 0.00 -1.62 0.00 0.00 43.42 41.96 1wva n LEU 152 CO 0.15 0.33 1.03 -0.75 -1.22 0.00 0.00 177.39 176.93 1wva s LYS 153 N -2.46 4.28 0.00 3.23 2.20 -1.07 -0.35 119.74 125.56 1wva s LYS 153 Ca 0.15 2.33 0.00 0.00 -0.36 0.00 0.00 55.97 58.09 1wva s LYS 153 Cb 0.16 -3.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.44 1wva s LYS 153 CO 0.60 -0.30 0.00 0.41 -0.36 0.00 0.00 175.35 175.70 1wva n GLY 154 N 0.72 3.14 0.00 5.54 0.00 -1.26 -4.77 105.19 108.56 1wva n GLY 154 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1wva n GLY 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wva n LYS 155 N -1.40 0.86 -3.10 1.61 4.76 0.52 -4.92 118.16 116.49 1wva n LYS 155 Ca 0.00 -0.09 -0.42 0.00 -2.87 0.00 0.00 58.31 54.94 1wva n LYS 155 Cb 0.00 -1.23 -0.06 0.00 -1.84 0.00 0.00 35.03 31.90 1wva n LYS 155 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1wva s ILE 156 N -2.66 4.88 0.70 -0.18 -1.09 -1.04 -4.86 121.20 116.95 1wva s ILE 156 Ca -0.03 0.66 -0.13 0.00 -2.23 0.00 0.00 60.65 58.92 1wva s ILE 156 Cb 0.07 -4.08 0.02 0.00 -1.58 0.00 0.00 42.46 36.90 1wva s ILE 156 CO 0.47 -0.30 1.10 -2.16 -1.23 0.00 0.00 174.94 172.82 1wva s PRO 157 N 2.73 2.62 -0.66 2.79 0.04 -1.26 -4.90 135.00 136.35 1wva s PRO 157 Ca 0.25 1.29 -0.27 0.00 0.04 0.00 0.00 61.00 62.31 1wva s PRO 157 Cb -0.14 -1.93 -0.00 0.00 0.04 0.00 0.00 34.50 32.46 1wva s PRO 157 CO 0.14 -1.37 1.64 -0.51 0.04 0.00 0.00 177.00 176.94 1wva s ASP 158 N -2.92 5.61 0.00 6.66 1.01 -1.26 -4.97 116.67 120.80 1wva s ASP 158 Ca 0.64 0.03 -0.18 0.00 0.71 0.00 0.00 52.55 53.76 1wva s ASP 158 Cb -0.19 -2.54 -0.06 0.00 1.01 0.00 0.00 42.92 41.14 1wva s ASP 158 CO 0.47 -2.18 0.50 -0.69 0.21 0.00 0.00 175.17 173.48 1wva s VAL 159 N 7.81 4.95 0.10 -1.27 1.01 -1.26 -5.02 120.40 126.72 1wva s VAL 159 Ca 0.55 1.04 -0.33 0.00 0.00 0.00 0.00 61.98 63.24 1wva s VAL 159 Cb -0.11 -3.82 -0.12 0.00 0.00 0.00 0.00 36.38 32.33 1wva s VAL 159 CO 0.18 0.50 1.74 -2.65 0.00 0.00 0.00 175.10 174.87 1wva n PRO 160 N 2.25 2.41 0.00 2.72 -0.02 -1.26 -1.95 135.00 139.15 1wva n PRO 160 Ca -0.11 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1wva n PRO 160 Cb 0.51 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 1wva n PRO 160 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wva n GLY 161 N 3.93 2.75 2.30 -1.23 0.00 -1.26 -3.27 105.19 108.40 1wva n GLY 161 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 1wva n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1wva n PHE 162 N -0.84 3.12 0.13 1.61 3.01 -0.82 -4.28 117.46 119.39 1wva n PHE 162 Ca 0.00 -2.71 0.04 0.00 1.01 0.00 0.00 57.45 55.79 1wva n PHE 162 Cb 0.00 -0.27 0.03 0.00 -0.01 0.00 0.00 39.48 39.22 1wva n PHE 162 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1wva h SER 163 N 2.41 0.00 1.30 4.37 4.64 -1.94 -3.26 113.55 121.08 1wva h SER 163 Ca 0.35 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.63 1wva h SER 163 Cb 1.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1wva h SER 163 CO 0.86 0.42 -0.17 4.11 -0.87 0.00 0.00 176.83 181.18 1wva h TRP 164 N 0.00 0.00 -2.89 4.77 5.08 -1.98 -3.46 115.95 117.47 1wva h TRP 164 Ca -0.03 0.00 -0.53 0.00 1.08 0.00 0.00 58.89 59.42 1wva h TRP 164 Cb 1.34 0.00 0.03 0.00 -3.00 0.00 0.00 29.16 27.54 1wva h TRP 164 CO 0.00 0.17 0.82 0.08 -1.28 0.00 0.00 178.44 178.22 1wva s VAL 165 N -3.43 2.92 -0.16 0.12 1.01 -1.23 -5.02 120.40 114.61 1wva s VAL 165 Ca 0.03 0.65 0.00 0.00 0.00 0.00 0.00 61.98 62.66 1wva s VAL 165 Cb 0.08 -3.42 0.03 0.00 0.00 0.00 0.00 36.38 33.08 1wva s VAL 165 CO 0.64 0.05 -0.09 -0.89 0.00 0.00 0.00 175.10 174.81 1wva s THR 166 N 1.17 1.32 -0.42 3.92 2.01 -1.26 -5.07 115.64 117.30 1wva s THR 166 Ca 0.68 -0.63 -0.40 0.00 0.31 0.00 0.00 61.69 61.65 1wva s THR 166 Cb -0.41 -1.37 -0.16 0.00 0.01 0.00 0.00 72.50 70.58 1wva s THR 166 CO 0.31 0.28 2.10 -2.65 -0.69 0.00 0.00 174.62 173.97 1wva n PRO 167 N 4.83 0.50 -0.04 4.92 -0.02 -1.26 -4.82 135.00 139.11 1wva n PRO 167 Ca -0.14 0.14 0.02 0.00 -2.02 0.00 0.00 63.50 61.50 1wva n PRO 167 Cb 0.49 -1.92 -0.15 0.00 -0.02 0.00 0.00 33.50 31.90 1wva n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wva s ILE 169 N -3.05 2.19 0.35 0.00 -4.36 -1.08 -4.95 121.20 110.29 1wva s ILE 169 Ca -0.08 -1.04 -0.03 0.00 -0.26 0.00 0.00 60.65 59.24 1wva s ILE 169 Cb 0.10 -1.79 -0.04 0.00 1.25 0.00 0.00 42.46 41.98 1wva s ILE 169 CO 0.86 0.57 0.60 -0.94 0.24 0.00 0.00 174.94 176.27 1wva s SER 170 N -0.36 6.36 0.29 4.36 1.04 -1.26 -0.91 113.70 123.22 1wva s SER 170 Ca 0.02 0.66 0.03 0.00 0.48 0.00 0.00 55.95 57.15 1wva s SER 170 Cb -0.12 -2.12 0.73 0.00 0.10 0.00 0.00 66.02 64.61 1wva s SER 170 CO 0.02 -0.30 1.66 0.00 0.98 0.00 0.00 173.24 175.60 1wva h ALA 171 N 1.08 1.35 0.00 5.32 0.00 -1.96 0.13 119.26 125.18 1wva h ALA 171 Ca -0.48 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1wva h ALA 171 Cb 1.20 0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1wva h ALA 171 CO 0.64 -0.44 0.00 0.36 0.00 0.00 0.00 179.25 179.81 1wva n LYS 172 N -5.16 0.02 -0.53 0.00 2.85 -1.26 -3.41 118.16 110.67 1wva n LYS 172 Ca 0.22 0.26 0.08 0.00 -1.05 0.00 0.00 58.31 57.82 1wva n LYS 172 Cb 0.69 -1.50 0.29 0.00 -0.65 0.00 0.00 35.03 33.86 1wva n LYS 172 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1wva n ASP 173 N -1.48 4.28 -4.03 -5.58 8.00 0.44 -4.96 116.55 113.23 1wva n ASP 173 Ca 0.04 -2.74 -0.15 0.00 0.71 0.00 0.00 54.79 52.64 1wva n ASP 173 Cb 0.15 -0.53 -0.13 0.00 -0.02 0.00 0.00 41.12 40.59 1wva n ASP 173 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1wva s ILE 174 N -2.36 0.56 -0.06 0.53 -1.16 -1.22 -0.51 121.20 116.99 1wva s ILE 174 Ca 0.44 -0.72 0.02 0.00 -0.51 0.00 0.00 60.65 59.88 1wva s ILE 174 Cb 0.32 -0.55 0.02 0.00 0.61 0.00 0.00 42.46 42.86 1wva s ILE 174 CO 0.14 -0.13 -0.09 -0.69 -2.81 0.00 0.00 174.94 171.37 1wva s VAL 175 N -0.79 0.90 -0.07 4.00 1.01 0.19 -3.84 120.40 121.80 1wva s VAL 175 Ca -0.04 -0.33 -0.11 0.00 0.00 0.00 0.00 61.98 61.50 1wva s VAL 175 Cb -0.06 -0.86 -0.05 0.00 0.00 0.00 0.00 36.38 35.41 1wva s VAL 175 CO 0.00 0.31 0.27 -0.31 0.00 0.00 0.00 175.10 175.37 1wva s TYR 176 N 0.84 3.65 -0.09 5.22 2.02 -0.75 0.26 117.35 128.50 1wva s TYR 176 Ca -0.12 0.75 -0.02 0.00 -0.37 0.00 0.00 57.07 57.32 1wva s TYR 176 Cb -0.15 -2.12 0.03 0.00 -0.40 0.00 0.00 41.96 39.32 1wva s TYR 176 CO 0.02 0.67 0.02 0.42 -1.57 0.00 0.00 175.55 175.10 1wva s ILE 177 N -0.98 0.32 0.00 2.71 1.01 -0.50 0.36 121.20 124.13 1wva s ILE 177 Ca 0.19 0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.90 1wva s ILE 177 Cb -0.14 -0.56 0.00 0.00 0.01 0.00 0.00 42.46 41.77 1wva s ILE 177 CO 0.08 0.17 0.00 0.61 0.00 0.00 0.00 174.94 175.81 1wva n GLY 178 N 5.16 0.80 3.66 6.18 0.00 0.03 -2.07 105.19 118.95 1wva n GLY 178 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 1wva n GLY 178 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wva n LEU 179 N 0.00 3.09 0.00 0.99 4.77 -0.88 -4.13 117.00 120.84 1wva n LEU 179 Ca 0.00 1.16 0.00 0.00 -0.03 0.00 0.00 56.01 57.14 1wva n LEU 179 Cb 0.00 -1.42 0.00 0.00 -2.33 0.00 0.00 43.42 39.67 1wva n LEU 179 CO 0.00 -0.86 0.00 -2.11 -1.33 0.00 0.00 177.39 173.09 1wva n ARG 180 N 0.46 0.00 -2.96 3.23 1.85 -0.26 -0.83 116.66 118.15 1wva n ARG 180 Ca 0.07 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.77 1wva n ARG 180 Cb 0.36 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.76 1wva n ARG 180 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1wva n ASP 181 N 0.00 -1.68 -4.82 2.89 2.03 -0.96 -5.07 116.55 108.94 1wva n ASP 181 Ca 0.00 -2.98 -0.37 0.00 0.52 0.00 0.00 54.79 51.97 1wva n ASP 181 Cb 0.25 0.76 -0.07 0.00 -0.72 0.00 0.00 41.12 41.35 1wva n ASP 181 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1wva s VAL 182 N -0.00 5.39 0.65 5.18 1.01 -1.26 -4.65 120.40 126.71 1wva s VAL 182 Ca 0.33 0.35 -0.15 0.00 0.00 0.00 0.00 61.98 62.51 1wva s VAL 182 Cb 0.17 -3.49 -0.01 0.00 0.00 0.00 0.00 36.38 33.05 1wva s VAL 182 CO -0.18 0.55 1.11 -1.81 0.00 0.00 0.00 175.10 174.77 1wva s ASP 183 N -0.56 5.18 0.44 3.32 1.01 -1.26 -4.78 116.67 120.02 1wva s ASP 183 Ca 0.15 2.02 0.16 0.00 0.71 0.00 0.00 52.55 55.59 1wva s ASP 183 Cb -0.13 -2.55 1.07 0.00 1.01 0.00 0.00 42.92 42.32 1wva s ASP 183 CO 0.04 -1.58 1.94 -0.65 0.21 0.00 0.00 175.17 175.13 1wva h PRO 184 N 0.15 0.38 0.04 8.23 0.11 -1.99 0.10 132.00 139.03 1wva h PRO 184 Ca -0.47 -0.02 -0.25 0.00 0.11 0.00 0.00 66.00 65.37 1wva h PRO 184 Cb 1.25 -0.08 0.02 0.00 0.11 0.00 0.00 31.00 32.30 1wva h PRO 184 CO 0.54 0.25 -1.01 0.78 -0.21 0.00 0.00 178.00 178.35 1wva h GLY 185 N 0.39 0.68 1.01 -0.55 0.00 -1.94 -2.80 103.07 99.85 1wva h GLY 185 Ca 0.34 -1.27 0.00 0.00 0.00 0.00 0.00 47.33 46.40 1wva h GLY 185 CO -0.10 1.12 0.57 0.83 0.00 0.00 0.00 176.54 178.97 1wva h GLU 186 N 0.22 1.19 -0.39 4.80 5.08 -1.53 -1.47 114.58 122.49 1wva h GLU 186 Ca -0.14 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.09 1wva h GLU 186 Cb 1.69 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 30.66 1wva h GLU 186 CO 0.20 0.81 0.04 1.25 -1.00 0.00 0.00 179.01 180.30 1wva h HIS 187 N 1.22 0.61 -0.64 4.33 2.76 -0.89 -0.58 115.15 121.96 1wva h HIS 187 Ca 0.33 -0.06 -0.06 0.00 -2.20 0.00 0.00 60.37 58.38 1wva h HIS 187 Cb -0.11 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 28.65 1wva h HIS 187 CO -0.01 0.56 0.15 -0.92 -1.30 0.00 0.00 177.93 176.42 1wva h TYR 188 N 0.57 1.06 -0.22 5.26 3.20 -1.01 -1.98 116.97 123.86 1wva h TYR 188 Ca 0.13 -0.12 -0.11 0.00 3.14 0.00 0.00 58.73 61.77 1wva h TYR 188 Cb 0.30 -0.30 -0.00 0.00 1.54 0.00 0.00 36.73 38.27 1wva h TYR 188 CO 0.01 0.88 -0.28 0.82 -1.64 0.00 0.00 178.16 177.95 1wva h ILE 189 N 0.97 1.33 0.28 1.81 1.08 -0.70 -0.25 117.51 122.02 1wva h ILE 189 Ca 0.20 -1.48 0.00 0.00 -0.39 0.00 0.00 64.86 63.20 1wva h ILE 189 Cb 0.36 1.77 -0.03 0.00 -3.07 0.00 0.00 36.82 35.84 1wva h ILE 189 CO 0.00 0.46 -0.45 -0.07 -0.69 0.00 0.00 178.15 177.40 1wva h LEU 190 N 0.26 -1.27 -0.78 1.44 3.38 -0.91 -0.02 115.31 117.41 1wva h LEU 190 Ca 0.03 0.12 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 1wva h LEU 190 Cb 0.86 0.45 -0.03 0.00 0.09 0.00 0.00 40.66 42.02 1wva h LEU 190 CO 0.07 -0.55 0.21 0.11 0.09 0.00 0.00 178.44 178.37 1wva h LYS 191 N -0.79 1.13 -0.02 1.13 1.79 -1.41 0.70 116.57 119.09 1wva h LYS 191 Ca -0.01 -0.25 -0.01 0.00 -2.18 0.00 0.00 60.65 58.20 1wva h LYS 191 Cb 0.75 -0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 31.23 1wva h LYS 191 CO -0.16 0.97 -0.01 1.15 -1.08 0.00 0.00 179.45 180.31 1wva h THR 192 N 1.08 1.33 0.00 -0.16 2.02 -0.89 -3.21 112.91 113.07 1wva h THR 192 Ca 0.23 -0.98 0.00 0.00 0.77 0.00 0.00 66.41 66.43 1wva h THR 192 Cb 0.32 1.94 0.00 0.00 -1.74 0.00 0.00 68.15 68.67 1wva h THR 192 CO -0.01 0.26 0.00 -0.07 0.37 0.00 0.00 175.52 176.08 1wva h LEU 193 N -0.35 0.00 -1.52 2.58 4.07 -1.02 -3.48 115.31 115.59 1wva h LEU 193 Ca 0.01 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.85 1wva h LEU 193 Cb 0.43 0.00 0.05 0.00 1.08 0.00 0.00 40.66 42.22 1wva h LEU 193 CO 0.00 0.00 -0.24 0.61 -1.08 0.00 0.00 178.44 177.74 1wva n GLY 194 N 0.68 0.29 3.74 0.83 0.00 0.15 -4.88 105.19 106.01 1wva n GLY 194 Ca 0.03 -0.32 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 1wva n GLY 194 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wva s ILE 195 N -3.11 4.48 0.08 -0.61 -1.09 -0.69 -4.81 121.20 115.46 1wva s ILE 195 Ca 0.07 1.93 -0.31 0.00 -2.23 0.00 0.00 60.65 60.12 1wva s ILE 195 Cb -0.03 -4.25 -0.06 0.00 -1.58 0.00 0.00 42.46 36.53 1wva s ILE 195 CO 0.24 0.38 1.24 -0.75 -1.23 0.00 0.00 174.94 174.82 1wva s LYS 196 N -0.32 4.41 -0.05 2.79 2.47 -1.25 -4.87 119.74 122.93 1wva s LYS 196 Ca 0.43 1.84 -0.12 0.00 -1.56 0.00 0.00 55.97 56.56 1wva s LYS 196 Cb -0.23 -3.32 0.02 0.00 -1.46 0.00 0.00 37.83 32.84 1wva s LYS 196 CO 0.28 -0.29 0.27 1.52 0.16 0.00 0.00 175.35 177.30 1wva s TYR 197 N 1.00 -0.19 -0.47 4.03 -0.85 -1.26 -1.80 117.35 117.81 1wva s TYR 197 Ca 0.60 0.39 0.03 0.00 -0.52 0.00 0.00 57.07 57.57 1wva s TYR 197 Cb -0.31 0.08 0.13 0.00 0.38 0.00 0.00 41.96 42.23 1wva s TYR 197 CO 0.30 -0.28 0.23 -0.06 -1.52 0.00 0.00 175.55 174.21 1wva s PHE 198 N -0.77 2.71 1.11 -3.49 0.40 0.16 -4.91 117.98 113.18 1wva s PHE 198 Ca -0.09 -2.82 -0.18 0.00 -0.60 0.00 0.00 56.93 53.25 1wva s PHE 198 Cb -0.04 -2.43 0.25 0.00 0.51 0.00 0.00 43.02 41.31 1wva s PHE 198 CO 0.02 -0.78 1.17 -1.54 0.70 0.00 0.00 175.22 174.80 1wva s SER 199 N 0.12 1.73 0.47 1.36 1.04 -1.26 -0.79 113.70 116.37 1wva s SER 199 Ca 0.16 0.57 0.15 0.00 0.48 0.00 0.00 55.95 57.31 1wva s SER 199 Cb -0.25 -0.79 1.12 0.00 0.10 0.00 0.00 66.02 66.21 1wva s SER 199 CO -0.01 -3.61 2.05 0.24 0.98 0.00 0.00 173.24 172.88 1wva h MET 200 N -2.24 0.25 -0.76 4.02 2.86 -1.20 -1.09 114.93 116.78 1wva h MET 200 Ca -0.45 -0.01 0.06 0.00 -2.06 0.00 0.00 59.70 57.23 1wva h MET 200 Cb 1.28 -0.06 -0.06 0.00 0.06 0.00 0.00 31.60 32.83 1wva h MET 200 CO 0.38 0.16 0.45 1.15 1.06 0.00 0.00 176.91 180.11 1wva h THR 201 N 0.26 0.99 -0.22 2.22 2.02 -1.91 0.11 112.91 116.39 1wva h THR 201 Ca 0.16 -0.28 -0.19 0.00 0.77 0.00 0.00 66.41 66.87 1wva h THR 201 Cb 0.31 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.84 1wva h THR 201 CO -0.03 0.15 -0.61 -0.33 0.37 0.00 0.00 175.52 175.07 1wva h GLU 202 N 0.81 0.79 -0.50 6.66 3.07 -1.55 -1.13 114.58 122.73 1wva h GLU 202 Ca 0.34 -0.56 -0.01 0.00 -0.50 0.00 0.00 59.36 58.62 1wva h GLU 202 Cb 0.20 0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.17 1wva h GLU 202 CO -0.18 1.19 0.25 0.28 -1.40 0.00 0.00 179.01 179.14 1wva h VAL 203 N 0.54 1.16 -0.28 3.13 2.07 -0.85 0.45 116.25 122.47 1wva h VAL 203 Ca -0.01 -0.44 -0.13 0.00 0.82 0.00 0.00 66.70 66.93 1wva h VAL 203 Cb 1.23 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1wva h VAL 203 CO 0.13 0.19 -0.35 0.44 0.02 0.00 0.00 177.57 178.00 1wva h ASP 204 N 0.69 0.78 0.04 0.57 3.32 -0.60 -0.21 116.42 121.02 1wva h ASP 204 Ca 0.18 -0.50 -0.22 0.00 0.02 0.00 0.00 57.03 56.51 1wva h ASP 204 Cb 0.06 -0.22 0.02 0.00 0.22 0.00 0.00 39.33 39.40 1wva h ASP 204 CO -0.03 1.13 -0.88 0.08 -1.72 0.00 0.00 179.24 177.82 1wva h ARG 205 N 0.46 0.52 0.00 3.56 0.11 -0.40 -3.36 114.38 115.27 1wva h ARG 205 Ca 0.03 -0.62 -0.21 0.00 0.10 0.00 0.00 59.98 59.29 1wva h ARG 205 Cb 0.93 0.19 -0.04 0.00 1.11 0.00 0.00 29.97 32.17 1wva h ARG 205 CO 0.08 1.24 -1.38 -0.07 0.10 0.00 0.00 179.97 179.94 1wva h LEU 206 N 0.07 0.00 0.00 0.08 3.38 -0.24 -3.51 115.31 115.10 1wva h LEU 206 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1wva h LEU 206 Cb 1.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.33 1wva h LEU 206 CO 0.17 0.77 0.00 0.61 0.09 0.00 0.00 178.44 180.08 1wva n GLY 207 N 1.43 -1.04 0.31 0.83 0.00 -0.09 -4.00 105.19 102.63 1wva n GLY 207 Ca -0.10 -1.44 0.17 0.00 0.00 0.00 0.00 46.02 44.65 1wva n GLY 207 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1wva h ILE 208 N 0.00 0.43 -0.14 -0.61 6.09 -1.93 -2.44 117.51 118.91 1wva h ILE 208 Ca 0.00 0.00 -0.02 0.00 -1.37 0.00 0.00 64.86 63.47 1wva h ILE 208 Cb 0.00 0.95 -0.01 0.00 0.47 0.00 0.00 36.82 38.23 1wva h ILE 208 CO 0.00 0.00 0.02 1.23 -3.07 0.00 0.00 178.15 176.33 1wva h GLY 209 N 0.00 0.26 1.93 8.18 0.00 -1.95 -1.94 103.07 109.56 1wva h GLY 209 Ca 0.02 -0.18 -0.14 0.00 0.00 0.00 0.00 47.33 47.03 1wva h GLY 209 CO -0.00 0.17 -0.67 1.70 0.00 0.00 0.00 176.54 177.74 1wva h LYS 210 N 0.01 0.07 -0.15 4.80 1.63 -1.63 -2.81 116.57 118.49 1wva h LYS 210 Ca 0.04 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1wva h LYS 210 Cb 0.32 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.96 1wva h LYS 210 CO 0.00 0.71 0.08 0.28 -3.45 0.00 0.00 179.45 177.07 1wva h VAL 211 N 0.05 1.10 -0.21 2.00 2.07 -1.33 -0.51 116.25 119.41 1wva h VAL 211 Ca -0.01 -0.27 -0.10 0.00 0.82 0.00 0.00 66.70 67.14 1wva h VAL 211 Cb 1.18 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1wva h VAL 211 CO 0.09 0.09 -0.29 0.24 0.02 0.00 0.00 177.57 177.72 1wva h MET 212 N 0.15 0.41 -0.44 1.57 2.86 -1.36 -0.54 114.93 117.58 1wva h MET 212 Ca 0.05 -0.16 -0.14 0.00 -2.06 0.00 0.00 59.70 57.39 1wva h MET 212 Cb 0.07 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1wva h MET 212 CO -0.01 0.67 -0.29 1.49 1.06 0.00 0.00 176.91 179.83 1wva h GLU 213 N 0.36 0.98 -0.12 1.72 4.81 -1.30 -2.46 114.58 118.57 1wva h GLU 213 Ca 0.05 -0.46 -0.21 0.00 -0.13 0.00 0.00 59.36 58.61 1wva h GLU 213 Cb 0.70 -0.01 0.01 0.00 0.63 0.00 0.00 28.75 30.07 1wva h GLU 213 CO 0.05 1.13 -0.78 0.93 -0.73 0.00 0.00 179.01 179.61 1wva h GLU 214 N 0.82 0.65 -0.09 1.92 5.08 -0.88 -1.59 114.58 120.50 1wva h GLU 214 Ca 0.09 -0.54 -0.15 0.00 -1.00 0.00 0.00 59.36 57.76 1wva h GLU 214 Cb 0.88 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 1wva h GLU 214 CO 0.08 1.16 -0.58 1.79 -1.00 0.00 0.00 179.01 180.45 1wva h THR 215 N 0.44 1.37 -0.01 1.13 1.35 -1.12 -0.94 112.91 115.12 1wva h THR 215 Ca -0.05 -1.92 -0.24 0.00 -0.55 0.00 0.00 66.41 63.65 1wva h THR 215 Cb 1.39 1.95 0.01 0.00 -1.73 0.00 0.00 68.15 69.77 1wva h THR 215 CO 0.15 0.57 -0.97 -0.07 -0.25 0.00 0.00 175.52 174.96 1wva h LEU 216 N 0.21 0.68 -0.72 3.87 3.38 -1.47 -2.26 115.31 119.00 1wva h LEU 216 Ca -0.00 -0.54 -0.13 0.00 0.09 0.00 0.00 57.88 57.30 1wva h LEU 216 Cb 1.09 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 1wva h LEU 216 CO 0.09 1.34 -0.44 0.77 0.09 0.00 0.00 178.44 180.29 1wva h SER 217 N 0.30 0.48 -0.22 -0.43 4.64 -1.25 0.65 113.55 117.72 1wva h SER 217 Ca -0.09 -0.22 -0.09 0.00 -0.47 0.00 0.00 61.79 60.91 1wva h SER 217 Cb 1.61 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.54 1wva h SER 217 CO 0.18 0.86 -0.16 0.22 -0.87 0.00 0.00 176.83 177.06 1wva h TYR 218 N 0.37 0.70 0.05 4.77 3.20 -1.11 0.02 116.97 124.96 1wva h TYR 218 Ca 0.03 -0.13 -0.36 0.00 3.14 0.00 0.00 58.73 61.41 1wva h TYR 218 Cb 0.92 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.97 1wva h TYR 218 CO 0.03 0.75 -2.12 1.28 -1.64 0.00 0.00 178.16 176.47 1wva n LEU 219 N -4.16 1.98 -1.37 2.82 4.77 -0.86 -4.42 117.00 115.76 1wva n LEU 219 Ca 0.01 0.13 0.09 0.00 -0.03 0.00 0.00 56.01 56.20 1wva n LEU 219 Cb 0.37 -0.56 0.32 0.00 -2.33 0.00 0.00 43.42 41.22 1wva n LEU 219 CO 0.42 0.73 0.78 0.18 -1.33 0.00 0.00 177.39 178.17 1wva n LEU 220 N -3.23 4.48 0.00 2.23 4.77 0.23 -4.70 117.00 120.77 1wva n LEU 220 Ca -0.33 -2.55 0.00 0.00 -0.03 0.00 0.00 56.01 53.11 1wva n LEU 220 Cb 1.05 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 1wva n LEU 220 CO 0.39 0.76 0.21 0.61 -1.33 0.00 0.00 177.39 178.03 1wva n GLY 221 N 0.69 -1.49 0.36 -0.72 0.00 -0.01 -4.29 105.19 99.74 1wva n GLY 221 Ca 0.23 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.12 1wva n GLY 221 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1wva h ARG 222 N 0.00 -0.53 -4.16 1.61 3.08 -1.85 -3.44 114.38 109.10 1wva h ARG 222 Ca 0.00 0.04 -0.22 0.00 0.07 0.00 0.00 59.98 59.87 1wva h ARG 222 Cb 0.00 0.12 -0.22 0.00 0.08 0.00 0.00 29.97 29.95 1wva h ARG 222 CO 0.00 -0.35 -0.72 0.15 -1.07 0.00 0.00 179.97 177.98 1wva s LYS 223 N -5.98 0.35 0.61 0.04 -0.14 -1.26 -5.14 119.74 108.22 1wva s LYS 223 Ca -0.16 -0.57 -0.14 0.00 -1.36 0.00 0.00 55.97 53.73 1wva s LYS 223 Cb 0.08 -0.05 -0.03 0.00 -1.68 0.00 0.00 37.83 36.15 1wva s LYS 223 CO 0.64 -0.01 1.05 0.15 -0.76 0.00 0.00 175.35 176.42 1wva s LYS 224 N -1.28 3.33 -0.22 1.68 3.01 -1.26 -4.46 119.74 120.54 1wva s LYS 224 Ca -0.12 1.09 -0.35 0.00 -1.01 0.00 0.00 55.97 55.59 1wva s LYS 224 Cb -0.09 -2.04 0.15 0.00 -1.01 0.00 0.00 37.83 34.84 1wva s LYS 224 CO -0.00 -0.79 1.25 -0.98 0.51 0.00 0.00 175.35 175.33 1wva s ARG 225 N -4.35 0.24 0.27 1.68 1.70 -1.26 -5.09 118.95 112.14 1wva s ARG 225 Ca 0.61 -0.07 -0.29 0.00 -0.47 0.00 0.00 55.73 55.51 1wva s ARG 225 Cb -0.14 0.11 -0.14 0.00 -0.57 0.00 0.00 34.95 34.21 1wva s ARG 225 CO 0.41 -0.10 1.15 -2.30 -1.08 0.00 0.00 175.30 173.38 1wva n PRO 226 N 0.04 1.58 -4.66 3.89 -0.02 -1.26 -4.75 135.00 129.83 1wva n PRO 226 Ca 0.01 0.56 -0.33 0.00 -2.02 0.00 0.00 63.50 61.71 1wva n PRO 226 Cb 0.58 -2.03 -0.14 0.00 -0.02 0.00 0.00 33.50 31.88 1wva n PRO 226 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1wva s ILE 227 N -0.77 3.02 -0.31 4.25 -1.09 -0.25 -0.62 121.20 125.43 1wva s ILE 227 Ca 0.62 -0.66 -0.04 0.00 -2.23 0.00 0.00 60.65 58.33 1wva s ILE 227 Cb -0.69 -2.28 0.04 0.00 -1.58 0.00 0.00 42.46 37.95 1wva s ILE 227 CO 0.58 0.51 0.04 -2.28 -1.23 0.00 0.00 174.94 172.56 1wva s HIS 228 N 0.52 3.22 -0.33 3.97 5.65 -0.44 -1.18 115.29 126.70 1wva s HIS 228 Ca -0.08 -1.53 -0.16 0.00 0.25 0.00 0.00 55.06 53.53 1wva s HIS 228 Cb -0.16 -2.19 -0.01 0.00 -1.18 0.00 0.00 32.58 29.04 1wva s HIS 228 CO 0.04 -0.73 0.40 -1.17 -0.65 0.00 0.00 174.74 172.63 1wva s LEU 229 N 1.35 4.34 -0.36 8.88 2.96 -0.47 -1.90 118.68 133.48 1wva s LEU 229 Ca -0.02 -0.08 -0.11 0.00 -0.22 0.00 0.00 54.13 53.70 1wva s LEU 229 Cb -0.19 -2.42 0.01 0.00 0.50 0.00 0.00 46.19 44.10 1wva s LEU 229 CO 0.01 -0.34 0.20 -0.55 -1.32 0.00 0.00 176.35 174.34 1wva s SER 230 N 1.72 5.72 -0.31 3.68 0.15 -0.71 -1.26 113.70 122.69 1wva s SER 230 Ca 0.14 -0.82 -0.06 0.00 0.70 0.00 0.00 55.95 55.91 1wva s SER 230 Cb -0.16 -2.03 0.03 0.00 -1.71 0.00 0.00 66.02 62.14 1wva s SER 230 CO 0.12 -0.33 0.07 0.12 1.20 0.00 0.00 173.24 174.42 1wva s PHE 231 N 1.59 3.20 -0.26 3.44 2.19 0.09 -1.96 117.98 126.27 1wva s PHE 231 Ca 0.03 -1.29 -0.20 0.00 0.33 0.00 0.00 56.93 55.80 1wva s PHE 231 Cb -0.18 -2.24 -0.02 0.00 -1.31 0.00 0.00 43.02 39.27 1wva s PHE 231 CO 0.07 -0.68 0.60 0.34 1.83 0.00 0.00 175.22 177.38 1wva s ASP 232 N 1.42 6.54 0.56 6.13 -1.08 -0.04 -1.04 116.67 129.16 1wva s ASP 232 Ca -0.00 0.66 0.29 0.00 -0.52 0.00 0.00 52.55 52.98 1wva s ASP 232 Cb -0.18 -2.32 1.46 0.00 -1.46 0.00 0.00 42.92 40.42 1wva s ASP 232 CO 0.02 -0.35 1.91 0.58 0.52 0.00 0.00 175.17 177.85 1wva h VAL 233 N 5.41 0.51 0.00 1.11 2.07 -1.62 0.20 116.25 123.94 1wva h VAL 233 Ca -0.27 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1wva h VAL 233 Cb 1.13 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1wva h VAL 233 CO 0.76 0.00 0.00 -0.90 0.02 0.00 0.00 177.57 177.45 1wva n ASP 234 N -4.06 0.00 0.21 0.57 5.68 -1.26 -2.35 116.55 115.34 1wva n ASP 234 Ca 0.13 -0.81 0.08 0.00 -0.50 0.00 0.00 54.79 53.68 1wva n ASP 234 Cb 0.77 0.00 0.45 0.00 -1.14 0.00 0.00 41.12 41.20 1wva n ASP 234 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1wva h GLY 235 N 3.62 0.00 -3.15 6.12 0.00 -0.83 -3.36 103.07 105.47 1wva h GLY 235 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 1wva h GLY 235 CO 0.00 0.00 -0.13 1.08 0.00 0.00 0.00 176.54 177.49 1wva s LEU 236 N -7.12 4.05 0.48 3.11 1.43 -0.99 -2.54 118.68 117.10 1wva s LEU 236 Ca -0.01 0.72 -0.24 0.00 -1.03 0.00 0.00 54.13 53.58 1wva s LEU 236 Cb 0.11 -3.54 -0.08 0.00 0.03 0.00 0.00 46.19 42.71 1wva s LEU 236 CO 0.65 -0.21 1.30 -0.67 0.23 0.00 0.00 176.35 177.66 1wva n ASP 237 N -0.97 2.60 0.19 2.29 -0.08 -0.45 -4.67 116.55 115.46 1wva n ASP 237 Ca -0.02 1.05 0.10 0.00 -1.51 0.00 0.00 54.79 54.42 1wva n ASP 237 Cb 0.54 -1.53 0.55 0.00 2.34 0.00 0.00 41.12 43.02 1wva n ASP 237 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1wva h PRO 238 N 1.82 0.00 0.00 -0.67 0.11 -1.83 0.61 132.00 132.04 1wva h PRO 238 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1wva h PRO 238 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1wva h PRO 238 CO 0.59 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.25 1wva n SER 239 N -2.28 0.00 -0.01 -2.05 3.41 -1.26 -2.21 113.62 109.22 1wva n SER 239 Ca -0.01 0.43 -0.01 0.00 -0.26 0.00 0.00 58.87 59.01 1wva n SER 239 Cb 0.18 -0.48 -0.02 0.00 -0.26 0.00 0.00 64.21 63.64 1wva n SER 239 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1wva n PHE 240 N -1.48 0.00 -3.18 7.33 3.72 0.16 -4.84 117.46 119.18 1wva n PHE 240 Ca 0.07 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.28 1wva n PHE 240 Cb 0.31 -0.14 -0.04 0.00 -0.94 0.00 0.00 39.48 38.67 1wva n PHE 240 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1wva n THR 241 N -2.11 -0.07 0.23 4.37 -2.24 -0.94 -3.86 114.28 109.66 1wva n THR 241 Ca -0.05 -4.54 0.08 0.00 -2.27 0.00 0.00 64.05 57.27 1wva n THR 241 Cb 0.59 -0.63 0.54 0.00 -2.10 0.00 0.00 70.33 68.72 1wva n THR 241 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1wva h PRO 242 N 3.19 0.00 -3.26 -0.78 0.13 -1.69 -3.35 132.00 126.23 1wva h PRO 242 Ca 0.10 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.52 1wva h PRO 242 Cb 0.93 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.01 1wva h PRO 242 CO 0.51 0.23 3.08 0.00 -0.23 0.00 0.00 178.00 181.59 1wva n ALA 243 N -2.37 6.54 -2.51 -0.56 0.00 -1.26 -4.71 120.51 115.64 1wva n ALA 243 Ca -0.02 -3.87 -0.11 0.00 0.00 0.00 0.00 53.44 49.45 1wva n ALA 243 Cb 0.32 -3.23 -0.11 0.00 0.00 0.00 0.00 19.45 16.43 1wva n ALA 243 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1wva s THR 244 N 1.45 0.51 0.22 0.00 -4.23 -1.26 -0.40 115.64 111.94 1wva s THR 244 Ca 0.56 -1.49 0.26 0.00 -1.18 0.00 0.00 61.69 59.84 1wva s THR 244 Cb 0.16 -1.10 0.26 0.00 1.34 0.00 0.00 72.50 73.15 1wva s THR 244 CO -0.06 -0.67 1.91 1.23 -0.54 0.00 0.00 174.62 176.49 1wva h GLY 245 N 3.75 0.00 -6.01 3.99 0.00 -1.89 -3.38 103.07 99.52 1wva h GLY 245 Ca -0.35 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.44 1wva h GLY 245 CO 0.53 0.00 -1.02 2.41 0.00 0.00 0.00 176.54 178.46 1wva n THR 246 N -3.44 -0.79 -2.70 4.70 -1.04 -1.26 -5.10 114.28 104.65 1wva n THR 246 Ca -0.00 -3.62 -0.37 0.00 -2.04 0.00 0.00 64.05 58.02 1wva n THR 246 Cb 0.36 -1.59 -0.06 0.00 -1.82 0.00 0.00 70.33 67.22 1wva n THR 246 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1wva s PRO 247 N -0.67 4.46 -0.02 -2.82 0.04 -1.26 -4.93 135.00 129.80 1wva s PRO 247 Ca 0.34 1.40 0.01 0.00 0.04 0.00 0.00 61.00 62.79 1wva s PRO 247 Cb 0.13 -2.72 0.01 0.00 0.04 0.00 0.00 34.50 31.96 1wva s PRO 247 CO -0.14 0.15 -0.02 0.08 0.04 0.00 0.00 177.00 177.10 1wva s VAL 248 N -1.63 0.29 0.86 -0.36 1.01 -1.26 -5.05 120.40 114.26 1wva s VAL 248 Ca 0.52 -0.06 -0.11 0.00 0.00 0.00 0.00 61.98 62.34 1wva s VAL 248 Cb -0.20 -0.31 0.11 0.00 0.00 0.00 0.00 36.38 35.98 1wva s VAL 248 CO 0.25 0.13 1.10 0.68 0.00 0.00 0.00 175.10 177.27 1wva s VAL 249 N 0.50 2.75 -0.24 2.92 -7.23 -1.26 -4.02 120.40 113.82 1wva s VAL 249 Ca -0.05 0.24 0.00 0.00 -1.81 0.00 0.00 61.98 60.36 1wva s VAL 249 Cb -0.08 -2.58 0.00 0.00 0.56 0.00 0.00 36.38 34.28 1wva s VAL 249 CO -0.01 -0.32 0.00 0.61 -0.31 0.00 0.00 175.10 175.07 1wva n GLY 250 N -0.68 0.40 3.71 2.32 0.00 -1.26 -5.04 105.19 104.63 1wva n GLY 250 Ca 0.09 -0.86 -0.25 0.00 0.00 0.00 0.00 46.02 44.99 1wva n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wva n GLY 251 N -1.73 -0.47 3.76 -0.02 0.00 -1.26 -4.94 105.19 100.54 1wva n GLY 251 Ca -0.03 -1.86 -0.41 0.00 0.00 0.00 0.00 46.02 43.72 1wva n GLY 251 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wva n LEU 252 N 0.00 4.51 -4.77 0.99 4.77 -1.05 -4.18 117.00 117.27 1wva n LEU 252 Ca 0.16 1.19 -0.30 0.00 -0.03 0.00 0.00 56.01 57.03 1wva n LEU 252 Cb 0.56 -1.60 0.11 0.00 -2.33 0.00 0.00 43.42 40.16 1wva n LEU 252 CO 0.39 0.13 0.70 -0.89 -1.33 0.00 0.00 177.39 176.39 1wva s THR 253 N -0.54 2.86 0.13 -5.08 2.01 -1.26 -1.34 115.64 112.42 1wva s THR 253 Ca 0.59 0.28 -0.24 0.00 0.31 0.00 0.00 61.69 62.63 1wva s THR 253 Cb -0.49 -2.94 -0.02 0.00 0.01 0.00 0.00 72.50 69.06 1wva s THR 253 CO 0.56 -0.37 1.64 0.22 -0.69 0.00 0.00 174.62 175.98 1wva h TYR 254 N -1.27 -0.61 -0.88 4.92 3.20 -1.96 -1.97 116.97 118.41 1wva h TYR 254 Ca -0.48 0.03 0.07 0.00 3.14 0.00 0.00 58.73 61.49 1wva h TYR 254 Cb 1.28 0.29 -0.06 0.00 1.54 0.00 0.00 36.73 39.77 1wva h TYR 254 CO 0.44 -0.31 0.54 0.00 -1.64 0.00 0.00 178.16 177.19 1wva h ARG 255 N -0.30 0.95 -0.10 1.82 3.08 -2.00 -2.40 114.38 115.42 1wva h ARG 255 Ca 0.09 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 60.01 1wva h ARG 255 Cb 0.44 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1wva h ARG 255 CO -0.28 0.63 -0.28 0.93 -1.07 0.00 0.00 179.97 179.90 1wva h GLU 256 N 0.98 0.17 -0.50 0.04 5.08 -1.78 -1.44 114.58 117.14 1wva h GLU 256 Ca 0.39 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.62 1wva h GLU 256 Cb 0.21 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1wva h GLU 256 CO -0.19 0.44 0.02 0.78 -1.00 0.00 0.00 179.01 179.07 1wva h GLY 257 N 0.98 0.93 1.35 -3.84 0.00 -0.87 -2.45 103.07 99.17 1wva h GLY 257 Ca 0.02 -0.67 -0.12 0.00 0.00 0.00 0.00 47.33 46.56 1wva h GLY 257 CO 0.04 0.62 -0.28 1.41 0.00 0.00 0.00 176.54 178.33 1wva h LEU 258 N 0.73 0.76 0.36 3.11 3.38 -1.22 -2.70 115.31 119.73 1wva h LEU 258 Ca 0.14 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1wva h LEU 258 Cb 0.49 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1wva h LEU 258 CO 0.02 1.00 -0.17 0.22 0.09 0.00 0.00 178.44 179.60 1wva h TYR 259 N 0.63 -0.44 -0.57 1.13 3.20 -1.15 0.21 116.97 119.98 1wva h TYR 259 Ca 0.08 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.02 1wva h TYR 259 Cb 0.80 0.15 -0.11 0.00 1.54 0.00 0.00 36.73 39.11 1wva h TYR 259 CO 0.04 -0.23 -0.42 0.82 -1.64 0.00 0.00 178.16 176.73 1wva h ILE 260 N -0.55 0.10 -0.15 1.81 2.04 -1.43 0.21 117.51 119.53 1wva h ILE 260 Ca -0.05 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.72 1wva h ILE 260 Cb 0.41 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 1wva h ILE 260 CO 0.08 0.00 -0.33 0.71 0.00 0.00 0.00 178.15 178.61 1wva h THR 261 N -0.23 1.28 -0.10 -0.27 1.35 -1.36 -1.31 112.91 112.27 1wva h THR 261 Ca 0.18 -1.34 -0.15 0.00 -0.55 0.00 0.00 66.41 64.55 1wva h THR 261 Cb 0.56 1.53 -0.01 0.00 -1.73 0.00 0.00 68.15 68.50 1wva h THR 261 CO -0.68 0.41 -0.57 -0.33 -0.25 0.00 0.00 175.52 174.10 1wva h GLU 262 N 0.26 0.32 -0.04 4.72 5.08 0.56 -1.89 114.58 123.58 1wva h GLU 262 Ca 0.03 -0.20 -0.20 0.00 -1.00 0.00 0.00 59.36 57.99 1wva h GLU 262 Cb 0.71 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 1wva h GLU 262 CO 0.05 0.80 -0.81 0.93 -1.00 0.00 0.00 179.01 178.99 1wva h GLU 263 N 0.24 0.37 -0.40 2.33 4.39 -0.39 -2.69 114.58 118.43 1wva h GLU 263 Ca -0.00 -0.34 -0.13 0.00 0.34 0.00 0.00 59.36 59.23 1wva h GLU 263 Cb 1.07 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 1wva h GLU 263 CO 0.09 1.00 -0.27 0.82 -1.16 0.00 0.00 179.01 179.49 1wva h ILE 264 N 0.23 1.27 -0.10 3.13 1.08 -1.15 -3.03 117.51 118.95 1wva h ILE 264 Ca -0.04 -1.42 -0.00 0.00 -0.39 0.00 0.00 64.86 63.01 1wva h ILE 264 Cb 1.40 1.25 -0.00 0.00 -3.07 0.00 0.00 36.82 36.39 1wva h ILE 264 CO 0.14 0.48 0.06 0.22 -0.69 0.00 0.00 178.15 178.35 1wva h TYR 265 N 0.73 0.13 -0.12 1.37 3.20 -1.31 -2.86 116.97 118.10 1wva h TYR 265 Ca 0.09 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.99 1wva h TYR 265 Cb 0.82 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 39.04 1wva h TYR 265 CO 0.05 0.13 0.19 0.87 -1.64 0.00 0.00 178.16 177.76 1wva h LYS 266 N 0.09 0.00 0.00 1.82 1.57 -1.36 0.57 116.57 119.26 1wva h LYS 266 Ca 0.03 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 1wva h LYS 266 Cb 0.04 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 1wva h LYS 266 CO -0.01 0.00 -0.16 1.79 -0.57 0.00 0.00 179.45 180.50 1wva h THR 267 N 0.00 0.60 -0.23 -0.16 1.35 -1.42 -3.45 112.91 109.59 1wva h THR 267 Ca 0.06 -0.74 -0.10 0.00 -0.55 0.00 0.00 66.41 65.08 1wva h THR 267 Cb 0.43 1.48 -0.04 0.00 -1.73 0.00 0.00 68.15 68.30 1wva h THR 267 CO -0.00 0.16 -0.09 0.61 -0.25 0.00 0.00 175.52 175.95 1wva n GLY 268 N -0.43 0.70 0.57 5.82 0.00 0.19 -4.87 105.19 107.16 1wva n GLY 268 Ca -0.01 -0.29 0.05 0.00 0.00 0.00 0.00 46.02 45.77 1wva n GLY 268 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wva n LEU 269 N -0.55 2.90 -4.74 0.99 4.77 -1.26 -5.00 117.00 114.10 1wva n LEU 269 Ca -0.05 -2.13 -0.42 0.00 -0.03 0.00 0.00 56.01 53.39 1wva n LEU 269 Cb 0.28 -0.24 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1wva n LEU 269 CO 0.07 0.69 1.19 -0.22 -1.33 0.00 0.00 177.39 177.80 1wva s LEU 270 N -1.23 4.37 0.00 2.23 2.96 -1.26 -1.09 118.68 124.65 1wva s LEU 270 Ca 0.22 2.79 0.00 0.00 -0.22 0.00 0.00 54.13 56.92 1wva s LEU 270 Cb 0.13 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 43.20 1wva s LEU 270 CO 0.13 -0.82 0.00 -1.20 -1.32 0.00 0.00 176.35 173.14 1wva n SER 271 N 2.57 2.21 -3.72 3.68 7.64 -0.32 -4.80 113.62 120.88 1wva n SER 271 Ca 0.09 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.83 1wva n SER 271 Cb 0.39 0.35 -0.09 0.00 -1.01 0.00 0.00 64.21 63.84 1wva n SER 271 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wva s GLY 272 N -1.33 -0.29 0.00 0.23 0.00 -1.09 -1.66 107.32 103.18 1wva s GLY 272 Ca 0.00 0.99 0.00 0.00 0.00 0.00 0.00 44.72 45.72 1wva s GLY 272 CO 0.00 0.81 -0.01 -2.27 0.00 0.00 0.00 173.10 171.63 1wva s LEU 273 N -0.22 2.01 -0.07 0.66 0.20 0.13 -1.37 118.68 120.02 1wva s LEU 273 Ca -0.04 -0.02 0.03 0.00 0.69 0.00 0.00 54.13 54.79 1wva s LEU 273 Cb -0.03 -0.03 0.01 0.00 -0.43 0.00 0.00 46.19 45.71 1wva s LEU 273 CO 0.02 -0.00 -0.17 -1.81 -0.29 0.00 0.00 176.35 174.10 1wva s ASP 274 N -0.05 2.29 -0.50 3.68 1.01 -0.39 -0.91 116.67 121.79 1wva s ASP 274 Ca -0.00 -0.40 0.01 0.00 0.71 0.00 0.00 52.55 52.87 1wva s ASP 274 Cb -0.00 -0.99 0.13 0.00 1.01 0.00 0.00 42.92 43.06 1wva s ASP 274 CO -0.00 0.10 0.26 -0.63 0.21 0.00 0.00 175.17 175.11 1wva s ILE 275 N 0.46 2.94 0.43 0.77 -1.09 -0.13 -0.73 121.20 123.85 1wva s ILE 275 Ca -0.14 -2.87 0.08 0.00 -2.23 0.00 0.00 60.65 55.48 1wva s ILE 275 Cb -0.16 -3.02 -0.02 0.00 -1.58 0.00 0.00 42.46 37.69 1wva s ILE 275 CO 0.05 -0.77 0.38 -0.04 -1.23 0.00 0.00 174.94 173.33 1wva s MET 276 N 0.19 2.49 -1.71 2.79 -1.94 -0.20 -2.87 119.30 118.05 1wva s MET 276 Ca 0.15 -1.59 0.00 0.00 -1.71 0.00 0.00 55.69 52.54 1wva s MET 276 Cb -0.23 -2.34 0.00 0.00 2.01 0.00 0.00 34.83 34.27 1wva s MET 276 CO -0.03 -0.23 0.00 0.39 -0.01 0.00 0.00 175.02 175.14 1wva n GLU 277 N -1.56 -1.64 -3.04 2.03 -0.58 -0.10 -1.69 120.64 114.07 1wva n GLU 277 Ca 0.03 0.96 -0.40 0.00 -0.42 0.00 0.00 57.16 57.33 1wva n GLU 277 Cb 0.62 -5.45 -0.05 0.00 -0.57 0.00 0.00 31.44 25.99 1wva n GLU 277 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1wva s VAL 278 N -2.71 5.02 -0.34 2.62 1.01 -1.26 -4.13 120.40 120.61 1wva s VAL 278 Ca 0.00 1.43 -0.01 0.00 0.00 0.00 0.00 61.98 63.40 1wva s VAL 278 Cb 0.00 -4.04 0.12 0.00 0.00 0.00 0.00 36.38 32.46 1wva s VAL 278 CO 0.00 0.20 0.18 0.21 0.00 0.00 0.00 175.10 175.69 1wva s ASN 279 N 0.91 3.31 0.49 3.32 3.04 0.47 -4.21 114.94 122.27 1wva s ASN 279 Ca 0.36 -1.91 0.16 0.00 0.04 0.00 0.00 52.86 51.52 1wva s ASN 279 Cb -0.17 -0.49 1.20 0.00 -1.54 0.00 0.00 41.25 40.25 1wva s ASN 279 CO 0.16 -0.35 2.08 1.55 -3.04 0.00 0.00 177.10 177.49 1wva h PRO 280 N 7.51 0.14 0.00 0.43 0.13 -1.80 -1.40 132.00 137.00 1wva h PRO 280 Ca -0.04 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1wva h PRO 280 Cb 0.98 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1wva h PRO 280 CO 0.36 0.09 0.00 -1.13 -0.23 0.00 0.00 178.00 177.09 1wva n SER 281 N -4.48 0.00 -0.81 1.44 3.41 -1.26 -1.85 113.62 110.07 1wva n SER 281 Ca 0.03 0.03 0.10 0.00 -0.26 0.00 0.00 58.87 58.77 1wva n SER 281 Cb 0.24 -0.23 0.10 0.00 -0.26 0.00 0.00 64.21 64.07 1wva n SER 281 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1wva n LEU 282 N -1.23 2.71 -4.74 1.04 4.77 -0.53 -4.95 117.00 114.07 1wva n LEU 282 Ca 0.06 -1.11 -0.41 0.00 -0.03 0.00 0.00 56.01 54.52 1wva n LEU 282 Cb 0.07 -0.05 -0.05 0.00 -2.33 0.00 0.00 43.42 41.07 1wva n LEU 282 CO 0.08 0.50 0.71 -0.83 -1.33 0.00 0.00 177.39 176.52 1wva s GLY 283 N -1.53 3.02 0.08 -0.72 0.00 -0.77 -4.60 107.32 102.80 1wva s GLY 283 Ca 0.24 0.70 -0.25 0.00 0.00 0.00 0.00 44.72 45.41 1wva s GLY 283 CO 0.24 1.41 1.68 1.70 0.00 0.00 0.00 173.10 178.14 1wva h LYS 284 N 4.62 -0.20 -5.59 2.90 3.64 -1.90 -3.45 116.57 116.58 1wva h LYS 284 Ca -0.45 0.01 -0.60 0.00 -1.27 0.00 0.00 60.65 58.35 1wva h LYS 284 Cb 1.21 0.05 -0.13 0.00 -0.41 0.00 0.00 32.23 32.94 1wva h LYS 284 CO 0.70 -0.11 -0.61 0.95 -2.27 0.00 0.00 179.45 178.11 1wva s THR 285 N -6.04 1.85 0.57 1.00 -4.23 -1.26 -5.00 115.64 102.53 1wva s THR 285 Ca -0.14 -2.01 0.34 0.00 -1.18 0.00 0.00 61.69 58.69 1wva s THR 285 Cb 0.05 -2.93 0.37 0.00 1.34 0.00 0.00 72.50 71.33 1wva s THR 285 CO 0.65 -0.02 2.26 -0.65 -0.54 0.00 0.00 174.62 176.32 1wva h PRO 286 N 1.86 0.00 0.00 3.99 0.11 -1.98 -0.53 132.00 135.45 1wva h PRO 286 Ca -0.43 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.54 1wva h PRO 286 Cb 1.24 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 1wva h PRO 286 CO 0.78 0.02 -0.96 1.05 -0.21 0.00 0.00 178.00 178.68 1wva h GLU 287 N 0.00 0.00 -0.02 1.05 -0.00 -1.97 -2.58 114.58 111.06 1wva h GLU 287 Ca -0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 59.36 59.28 1wva h GLU 287 Cb 0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.81 1wva h GLU 287 CO 0.00 0.43 -0.37 0.93 -0.00 0.00 0.00 179.01 180.00 1wva h GLU 288 N 0.00 0.03 0.04 1.06 5.08 -1.48 0.22 114.58 119.54 1wva h GLU 288 Ca -0.08 -0.01 -0.21 0.00 -1.00 0.00 0.00 59.36 58.06 1wva h GLU 288 Cb 1.50 -0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.77 1wva h GLU 288 CO 0.06 0.40 -0.84 0.28 -1.00 0.00 0.00 179.01 177.91 1wva h VAL 289 N 0.03 1.38 -0.18 3.13 2.07 -1.49 -2.80 116.25 118.40 1wva h VAL 289 Ca 0.00 -2.25 -0.09 0.00 0.82 0.00 0.00 66.70 65.18 1wva h VAL 289 Cb 0.67 2.66 -0.01 0.00 -1.52 0.00 0.00 31.29 33.09 1wva h VAL 289 CO 0.05 0.67 -0.28 0.74 0.02 0.00 0.00 177.57 178.76 1wva h THR 290 N 0.03 1.26 -0.28 2.57 2.02 -1.13 -1.47 112.91 115.92 1wva h THR 290 Ca -0.12 -1.26 -0.11 0.00 0.77 0.00 0.00 66.41 65.69 1wva h THR 290 Cb 1.55 1.44 -0.00 0.00 -1.74 0.00 0.00 68.15 69.40 1wva h THR 290 CO 0.16 0.39 -0.26 -0.09 0.37 0.00 0.00 175.52 176.09 1wva h ARG 291 N 0.30 0.67 -0.47 6.66 2.43 -0.62 -1.81 114.38 121.53 1wva h ARG 291 Ca 0.04 -0.35 -0.13 0.00 -0.81 0.00 0.00 59.98 58.74 1wva h ARG 291 Cb 0.66 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 1wva h ARG 291 CO 0.05 0.96 -0.21 1.15 -1.51 0.00 0.00 179.97 180.40 1wva h THR 292 N 0.40 1.27 -0.17 0.20 2.02 -1.35 -2.59 112.91 112.70 1wva h THR 292 Ca 0.05 -1.37 -0.15 0.00 0.77 0.00 0.00 66.41 65.71 1wva h THR 292 Cb 0.83 1.13 0.00 0.00 -1.74 0.00 0.00 68.15 68.37 1wva h THR 292 CO 0.07 0.47 -0.48 0.58 0.37 0.00 0.00 175.52 176.53 1wva h VAL 293 N 0.82 1.33 -0.27 3.16 2.07 -1.28 -2.65 116.25 119.43 1wva h VAL 293 Ca 0.11 -1.73 -0.10 0.00 0.82 0.00 0.00 66.70 65.80 1wva h VAL 293 Cb 0.78 1.95 -0.01 0.00 -1.52 0.00 0.00 31.29 32.49 1wva h VAL 293 CO 0.06 0.53 -0.27 0.78 0.02 0.00 0.00 177.57 178.70 1wva h ASN 294 N 0.30 0.53 0.35 0.57 2.35 -1.38 -0.81 115.58 117.50 1wva h ASN 294 Ca -0.01 -0.19 -0.10 0.00 -0.55 0.00 0.00 56.30 55.45 1wva h ASN 294 Cb 1.10 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.31 1wva h ASN 294 CO 0.10 0.79 -0.44 0.74 -1.65 0.00 0.00 177.43 176.97 1wva h THR 295 N 0.46 1.32 -0.18 2.81 2.02 -1.50 0.14 112.91 117.98 1wva h THR 295 Ca 0.06 -1.56 -0.20 0.00 0.77 0.00 0.00 66.41 65.49 1wva h THR 295 Cb 0.71 1.78 0.00 0.00 -1.74 0.00 0.00 68.15 68.90 1wva h THR 295 CO 0.05 0.45 -0.68 0.00 0.37 0.00 0.00 175.52 175.72 1wva h ALA 296 N 1.46 0.46 -0.20 6.16 0.00 -1.04 -1.72 119.26 124.38 1wva h ALA 296 Ca 0.01 -0.57 -0.16 0.00 0.00 0.00 0.00 54.91 54.19 1wva h ALA 296 Cb 0.82 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1wva h ALA 296 CO 0.06 0.70 -0.50 0.28 0.00 0.00 0.00 179.25 179.79 1wva h VAL 297 N 0.51 1.31 -0.87 0.00 2.07 -0.87 -1.65 116.25 116.74 1wva h VAL 297 Ca -0.02 -1.73 0.04 0.00 0.82 0.00 0.00 66.70 65.81 1wva h VAL 297 Cb 1.28 1.88 -0.05 0.00 -1.52 0.00 0.00 31.29 32.88 1wva h VAL 297 CO 0.14 0.54 0.56 0.00 0.02 0.00 0.00 177.57 178.83 1wva h ALA 298 N 0.59 1.16 0.26 1.67 0.00 -0.72 0.12 119.26 122.34 1wva h ALA 298 Ca -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1wva h ALA 298 Cb 1.11 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1wva h ALA 298 CO 0.11 0.38 -0.13 0.82 0.00 0.00 0.00 179.25 180.43 1wva h ILE 299 N 1.07 0.76 -0.95 0.00 1.08 -1.20 -2.62 117.51 115.65 1wva h ILE 299 Ca 0.35 -0.12 0.05 0.00 -0.39 0.00 0.00 64.86 64.76 1wva h ILE 299 Cb 0.04 0.83 -0.06 0.00 -3.07 0.00 0.00 36.82 34.56 1wva h ILE 299 CO -0.13 0.03 0.61 0.74 -0.69 0.00 0.00 178.15 178.71 1wva h THR 300 N -0.41 1.12 -0.28 -0.27 2.02 -0.86 -2.61 112.91 111.61 1wva h THR 300 Ca -0.04 -0.39 -0.05 0.00 0.77 0.00 0.00 66.41 66.70 1wva h THR 300 Cb 0.31 -0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.57 1wva h THR 300 CO 0.06 0.21 -0.04 -0.07 0.37 0.00 0.00 175.52 176.05 1wva h LEU 301 N 1.15 0.41 -0.89 2.58 3.38 -0.83 -2.12 115.31 118.99 1wva h LEU 301 Ca 0.39 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 58.20 1wva h LEU 301 Cb 0.08 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1wva h LEU 301 CO -0.15 0.51 -0.42 0.00 0.09 0.00 0.00 178.44 178.47 1wva h ALA 302 N 1.55 0.99 0.00 1.53 0.00 -1.09 -1.49 119.26 120.74 1wva h ALA 302 Ca 0.09 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 1wva h ALA 302 Cb 0.34 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1wva h ALA 302 CO 0.01 0.52 -0.17 0.00 0.00 0.00 0.00 179.25 179.62 1wva n PHE 304 N -3.62 1.25 0.00 0.00 3.72 -0.88 -4.45 117.46 113.49 1wva n PHE 304 Ca -0.01 -1.42 0.00 0.00 -0.05 0.00 0.00 57.45 55.96 1wva n PHE 304 Cb 0.30 -0.49 0.00 0.00 -0.94 0.00 0.00 39.48 38.35 1wva n PHE 304 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wva n GLY 305 N -0.95 2.38 3.63 1.37 0.00 -1.13 -4.70 105.19 105.80 1wva n GLY 305 Ca 0.33 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.92 1wva n GLY 305 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wva s LEU 306 N 0.00 3.99 0.02 0.99 0.20 -0.62 -4.95 118.68 118.31 1wva s LEU 306 Ca 0.00 2.01 0.08 0.00 0.69 0.00 0.00 54.13 56.90 1wva s LEU 306 Cb 0.00 -3.53 -0.03 0.00 -0.43 0.00 0.00 46.19 42.21 1wva s LEU 306 CO 0.00 -1.31 -0.23 0.00 -0.29 0.00 0.00 176.35 174.52 1wva s ALA 307 N 5.52 2.38 0.09 5.97 0.00 -1.26 -4.23 121.76 130.23 1wva s ALA 307 Ca 0.82 -1.18 0.33 0.00 0.00 0.00 0.00 51.96 51.93 1wva s ALA 307 Cb -0.32 -0.62 1.45 0.00 0.00 0.00 0.00 23.12 23.63 1wva s ALA 307 CO 0.33 0.55 1.99 0.00 0.00 0.00 0.00 175.76 178.63 1wva h ARG 308 N 4.93 0.00 0.00 0.00 3.08 -1.98 -1.71 114.38 118.69 1wva h ARG 308 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1wva h ARG 308 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1wva h ARG 308 CO 0.46 0.00 0.00 1.05 -1.07 0.00 0.00 179.97 180.41 1wva h GLU 309 N 0.00 0.00 0.00 0.04 4.11 -2.00 -3.49 114.58 113.24 1wva h GLU 309 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1wva h GLU 309 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1wva h GLU 309 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.49 1wva n GLY 310 N 0.99 2.46 3.28 1.06 0.00 -0.64 -5.13 105.19 107.20 1wva n GLY 310 Ca 0.04 -2.16 -0.11 0.00 0.00 0.00 0.00 46.02 43.80 1wva n GLY 310 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wva s ASN 311 N 0.00 0.12 -0.25 1.61 -0.87 -1.26 -4.56 114.94 109.73 1wva s ASN 311 Ca 0.00 -1.17 -0.30 0.00 -1.57 0.00 0.00 52.86 49.81 1wva s ASN 311 Cb 0.00 0.41 0.17 0.00 -0.02 0.00 0.00 41.25 41.81 1wva s ASN 311 CO 0.00 -0.88 1.27 -1.38 -2.57 0.00 0.00 177.10 173.54 1wva s HIS 312 N -4.08 -0.12 -2.69 2.20 -3.43 -1.26 -5.14 115.29 100.77 1wva s HIS 312 Ca 0.29 0.19 0.26 0.00 -0.80 0.00 0.00 55.06 55.00 1wva s HIS 312 Cb 0.05 0.49 0.72 0.00 -1.43 0.00 0.00 32.58 32.41 1wva s HIS 312 CO 0.07 -0.12 1.56 1.63 -2.00 0.00 0.00 174.74 175.88