#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wpw s PHE 2 N 0.00 2.93 -0.28 1.61 0.08 -0.98 -5.06 117.98 116.29 1wpw s PHE 2 Ca 0.00 -0.03 0.00 0.00 0.12 0.00 0.00 56.93 57.02 1wpw s PHE 2 Cb 0.00 -1.58 0.05 0.00 -0.57 0.00 0.00 43.02 40.92 1wpw s PHE 2 CO 0.00 0.42 -0.05 0.99 -0.10 0.00 0.00 175.22 176.48 1wpw s THR 3 N -1.12 2.66 -0.22 0.64 2.01 -1.26 -1.60 115.64 116.74 1wpw s THR 3 Ca 0.20 -1.43 -0.07 0.00 0.31 0.00 0.00 61.69 60.70 1wpw s THR 3 Cb -0.11 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 69.85 1wpw s THR 3 CO 0.12 -0.03 0.06 -0.69 -0.69 0.00 0.00 174.62 173.39 1wpw s VAL 4 N 1.21 4.52 -0.39 3.82 1.01 -0.45 -0.18 120.40 129.95 1wpw s VAL 4 Ca -0.06 -0.12 -0.24 0.00 0.00 0.00 0.00 61.98 61.56 1wpw s VAL 4 Cb -0.19 -3.07 0.01 0.00 0.00 0.00 0.00 36.38 33.13 1wpw s VAL 4 CO -0.03 0.40 0.85 0.00 0.00 0.00 0.00 175.10 176.32 1wpw s ALA 5 N 1.01 3.38 -0.22 5.51 0.00 -0.65 -2.37 121.76 128.43 1wpw s ALA 5 Ca 0.04 -0.62 -0.16 0.00 0.00 0.00 0.00 51.96 51.21 1wpw s ALA 5 Cb -0.14 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.47 1wpw s ALA 5 CO 0.03 -1.64 0.43 -1.17 0.00 0.00 0.00 175.76 173.41 1wpw s LEU 6 N 3.34 4.12 -0.17 0.00 2.96 -1.16 -1.08 118.68 126.69 1wpw s LEU 6 Ca 0.34 0.51 0.00 0.00 -0.22 0.00 0.00 54.13 54.77 1wpw s LEU 6 Cb -0.12 -2.56 0.01 0.00 0.50 0.00 0.00 46.19 44.02 1wpw s LEU 6 CO 0.19 -0.14 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.29 1wpw s ILE 7 N 1.62 2.49 -0.01 6.68 1.01 0.09 -1.43 121.20 131.65 1wpw s ILE 7 Ca 0.20 -0.81 -0.21 0.00 0.00 0.00 0.00 60.65 59.82 1wpw s ILE 7 Cb -0.15 -2.06 -0.23 0.00 0.01 0.00 0.00 42.46 40.03 1wpw s ILE 7 CO 0.09 0.51 1.10 1.56 0.00 0.00 0.00 174.94 178.20 1wpw h GLN 8 N 7.61 0.35 0.00 2.79 4.20 -1.88 -2.15 115.11 126.03 1wpw h GLN 8 Ca -0.38 -0.35 0.00 0.00 0.06 0.00 0.00 58.65 57.98 1wpw h GLN 8 Cb 1.17 0.10 0.00 0.00 0.30 0.00 0.00 27.48 29.05 1wpw h GLN 8 CO 0.59 1.03 0.00 0.41 -0.67 0.00 0.00 178.83 180.19 1wpw n GLY 9 N 1.00 -0.32 2.35 3.46 0.00 -1.26 -3.45 105.19 106.97 1wpw n GLY 9 Ca -0.10 -1.15 -0.21 0.00 0.00 0.00 0.00 46.02 44.56 1wpw n GLY 9 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wpw n ASP 10 N 1.20 2.90 0.00 1.61 8.00 -0.79 -4.42 116.55 125.05 1wpw n ASP 10 Ca 0.00 -2.44 0.00 0.00 0.71 0.00 0.00 54.79 53.06 1wpw n ASP 10 Cb 0.00 0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 1wpw n ASP 10 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wpw n GLY 11 N 1.08 1.97 0.73 0.44 0.00 -1.26 0.57 105.19 108.72 1wpw n GLY 11 Ca -0.14 0.45 0.11 0.00 0.00 0.00 0.00 46.02 46.44 1wpw n GLY 11 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1wpw n ILE 12 N 0.00 0.31 0.43 -0.61 -5.35 -0.59 -4.31 119.36 109.24 1wpw n ILE 12 Ca 0.00 -0.46 -0.19 0.00 -0.27 0.00 0.00 62.75 61.82 1wpw n ILE 12 Cb 0.00 0.53 -0.09 0.00 -1.74 0.00 0.00 39.64 38.34 1wpw n ILE 12 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1wpw h GLY 13 N 4.90 -1.14 0.21 3.28 0.00 -0.07 -0.95 103.07 109.30 1wpw h GLY 13 Ca 0.00 0.43 0.12 0.00 0.00 0.00 0.00 47.33 47.88 1wpw h GLY 13 CO 0.00 -0.41 0.22 -2.55 0.00 0.00 0.00 176.54 173.80 1wpw h PRO 14 N -1.09 0.36 -0.27 4.80 0.11 -1.72 0.12 132.00 134.31 1wpw h PRO 14 Ca -0.11 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.97 1wpw h PRO 14 Cb 0.84 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.85 1wpw h PRO 14 CO 0.17 0.24 0.11 0.93 -0.21 0.00 0.00 178.00 179.25 1wpw h GLU 15 N 0.37 0.39 0.16 1.05 5.08 -1.79 -2.07 114.58 117.77 1wpw h GLU 15 Ca 0.36 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.64 1wpw h GLU 15 Cb 0.52 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1wpw h GLU 15 CO -0.38 0.41 -0.08 0.82 -1.00 0.00 0.00 179.01 178.78 1wpw h ILE 16 N 0.29 0.96 0.33 3.13 1.08 -0.32 -2.94 117.51 120.03 1wpw h ILE 16 Ca 0.09 -0.60 -0.02 0.00 -0.39 0.00 0.00 64.86 63.95 1wpw h ILE 16 Cb 0.16 1.32 0.00 0.00 -3.07 0.00 0.00 36.82 35.24 1wpw h ILE 16 CO -0.01 0.14 -0.16 0.58 -0.69 0.00 0.00 178.15 178.01 1wpw h VAL 17 N -0.51 0.62 -0.83 1.67 2.07 -0.86 -2.78 116.25 115.65 1wpw h VAL 17 Ca -0.02 -0.63 0.09 0.00 0.82 0.00 0.00 66.70 66.96 1wpw h VAL 17 Cb 0.39 0.91 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 1wpw h VAL 17 CO 0.04 0.11 0.54 0.77 0.02 0.00 0.00 177.57 179.04 1wpw h SER 18 N -0.83 0.72 1.26 0.57 4.64 -1.50 0.58 113.55 119.00 1wpw h SER 18 Ca -0.05 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1wpw h SER 18 Cb 0.52 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1wpw h SER 18 CO 0.07 0.43 0.00 0.29 -0.87 0.00 0.00 176.83 176.76 1wpw n LYS 19 N -4.51 0.17 0.02 4.77 5.02 -1.11 -3.25 118.16 119.27 1wpw n LYS 19 Ca 0.14 0.17 0.12 0.00 -2.02 0.00 0.00 58.31 56.71 1wpw n LYS 19 Cb 0.30 -1.71 0.26 0.00 -0.02 0.00 0.00 35.03 33.86 1wpw n LYS 19 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1wpw n SER 20 N -2.01 0.52 0.31 4.39 7.64 0.17 -3.97 113.62 120.68 1wpw n SER 20 Ca 0.06 -0.05 0.18 0.00 1.01 0.00 0.00 58.87 60.07 1wpw n SER 20 Cb 0.38 0.15 1.04 0.00 -1.01 0.00 0.00 64.21 64.77 1wpw n SER 20 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1wpw h LYS 21 N 0.00 0.00 -0.72 1.43 1.57 -1.48 -1.22 116.57 116.15 1wpw h LYS 21 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1wpw h LYS 21 Cb 0.58 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.86 1wpw h LYS 21 CO 0.00 0.00 0.26 0.00 -0.57 0.00 0.00 179.45 179.15 1wpw h ARG 22 N 0.00 1.09 0.22 3.15 3.08 -1.82 -1.70 114.38 118.39 1wpw h ARG 22 Ca -0.00 -0.20 -0.33 0.00 0.07 0.00 0.00 59.98 59.52 1wpw h ARG 22 Cb 0.01 -0.17 0.03 0.00 0.08 0.00 0.00 29.97 29.92 1wpw h ARG 22 CO 0.00 0.90 -1.49 0.82 -1.07 0.00 0.00 179.97 179.13 1wpw h ILE 23 N 1.05 1.26 0.00 2.04 2.04 -1.53 -1.95 117.51 120.43 1wpw h ILE 23 Ca 0.24 -2.74 -0.00 0.00 1.00 0.00 0.00 64.86 63.35 1wpw h ILE 23 Cb 0.24 2.97 -0.00 0.00 -0.74 0.00 0.00 36.82 39.29 1wpw h ILE 23 CO -0.02 0.83 -0.01 -0.07 0.00 0.00 0.00 178.15 178.88 1wpw h LEU 24 N 0.13 0.00 0.07 1.44 4.07 -1.24 -2.60 115.31 117.18 1wpw h LEU 24 Ca -0.25 0.00 -0.35 0.00 0.08 0.00 0.00 57.88 57.36 1wpw h LEU 24 Cb 2.12 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 43.83 1wpw h LEU 24 CO 0.24 0.01 -2.04 0.00 -1.08 0.00 0.00 178.44 175.58 1wpw n ALA 25 N -2.28 1.14 0.29 1.53 0.00 -0.65 -3.38 120.51 117.16 1wpw n ALA 25 Ca -0.03 -0.76 0.16 0.00 0.00 0.00 0.00 53.44 52.81 1wpw n ALA 25 Cb 0.10 -0.59 0.87 0.00 0.00 0.00 0.00 19.45 19.83 1wpw n ALA 25 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1wpw h LYS 26 N 0.04 0.00 0.09 0.00 1.63 -1.07 -2.65 116.57 114.62 1wpw h LYS 26 Ca -0.43 0.00 -0.34 0.00 -0.85 0.00 0.00 60.65 59.03 1wpw h LYS 26 Cb 2.02 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 33.63 1wpw h LYS 26 CO 0.05 0.06 -1.89 0.82 -3.45 0.00 0.00 179.45 175.04 1wpw h ILE 27 N 0.00 0.72 0.00 2.00 2.04 -1.61 -1.63 117.51 119.03 1wpw h ILE 27 Ca -0.00 -2.47 -0.01 0.00 1.00 0.00 0.00 64.86 63.38 1wpw h ILE 27 Cb 0.20 2.50 -0.00 0.00 -0.74 0.00 0.00 36.82 38.78 1wpw h ILE 27 CO 0.01 0.77 -0.04 0.78 0.00 0.00 0.00 178.15 179.67 1wpw h ASN 28 N 0.05 0.00 0.00 1.72 -0.26 -1.52 -1.74 115.58 113.83 1wpw h ASN 28 Ca -0.37 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.37 1wpw h ASN 28 Cb 2.03 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 39.29 1wpw h ASN 28 CO 0.09 0.04 -0.12 -0.08 -1.06 0.00 0.00 177.43 176.31 1wpw h GLU 29 N 0.00 0.00 -0.80 0.81 4.81 -1.53 -0.60 114.58 117.27 1wpw h GLU 29 Ca -0.00 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.28 1wpw h GLU 29 Cb 0.09 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.42 1wpw h GLU 29 CO 0.01 0.00 0.53 1.25 -0.73 0.00 0.00 179.01 180.06 1wpw h LEU 30 N -0.93 0.80 -2.75 1.64 5.85 -1.25 -2.44 115.31 116.22 1wpw h LEU 30 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1wpw h LEU 30 Cb 0.12 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 40.98 1wpw h LEU 30 CO 0.00 0.53 0.00 -1.22 -0.34 0.00 0.00 178.44 177.41 1wpw n TYR 31 N -4.47 0.36 -3.61 1.25 4.01 -0.66 -5.01 117.16 109.02 1wpw n TYR 31 Ca 0.11 -0.45 -0.22 0.00 -0.16 0.00 0.00 57.90 57.18 1wpw n TYR 31 Cb 0.18 -0.03 0.04 0.00 -0.31 0.00 0.00 39.34 39.23 1wpw n TYR 31 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1wpw n SER 32 N 0.39 -2.97 -4.74 7.72 7.64 -0.42 -4.94 113.62 116.29 1wpw n SER 32 Ca 0.10 -0.84 -0.39 0.00 1.01 0.00 0.00 58.87 58.75 1wpw n SER 32 Cb 0.39 -4.13 -0.05 0.00 -1.01 0.00 0.00 64.21 59.40 1wpw n SER 32 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1wpw s LEU 33 N -6.41 4.37 -1.36 -3.43 1.02 -0.37 -4.98 118.68 107.52 1wpw s LEU 33 Ca 0.18 1.16 -0.09 0.00 0.02 0.00 0.00 54.13 55.40 1wpw s LEU 33 Cb -0.05 -2.98 0.10 0.00 0.02 0.00 0.00 46.19 43.29 1wpw s LEU 33 CO 0.81 0.01 2.23 -0.81 0.02 0.00 0.00 176.35 178.60 1wpw n PRO 34 N 3.20 3.87 -4.52 1.29 -0.04 -1.26 -4.79 135.00 132.76 1wpw n PRO 34 Ca -0.05 -3.23 -0.34 0.00 -0.04 0.00 0.00 63.50 59.85 1wpw n PRO 34 Cb 0.51 -2.85 -0.12 0.00 -0.04 0.00 0.00 33.50 30.99 1wpw n PRO 34 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1wpw s ILE 35 N 0.41 3.70 -0.31 0.52 1.01 -1.26 -2.31 121.20 122.96 1wpw s ILE 35 Ca 0.49 -0.44 -0.11 0.00 0.00 0.00 0.00 60.65 60.59 1wpw s ILE 35 Cb 0.14 -2.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.00 1wpw s ILE 35 CO -0.05 0.52 0.19 -0.70 0.00 0.00 0.00 174.94 174.90 1wpw s GLU 36 N 0.15 3.61 -0.50 2.79 2.56 -0.63 -5.01 118.70 121.67 1wpw s GLU 36 Ca -0.03 -0.55 -0.15 0.00 0.00 0.00 0.00 54.97 54.24 1wpw s GLU 36 Cb -0.14 -3.66 0.10 0.00 2.00 0.00 0.00 34.13 32.43 1wpw s GLU 36 CO 0.03 -0.33 0.44 0.71 -0.56 0.00 0.00 175.26 175.55 1wpw s TYR 37 N 1.70 3.26 -0.35 5.30 2.02 -1.26 -1.34 117.35 126.68 1wpw s TYR 37 Ca 0.06 -1.19 -0.06 0.00 -0.37 0.00 0.00 57.07 55.51 1wpw s TYR 37 Cb -0.17 -3.48 0.05 0.00 -0.40 0.00 0.00 41.96 37.96 1wpw s TYR 37 CO 0.09 -0.92 0.13 -1.50 -1.57 0.00 0.00 175.55 171.78 1wpw s ILE 38 N 1.59 3.76 0.24 2.71 1.10 -1.00 -4.96 121.20 124.64 1wpw s ILE 38 Ca 0.04 -1.25 -0.23 0.00 -0.51 0.00 0.00 60.65 58.69 1wpw s ILE 38 Cb -0.27 -3.19 -0.09 0.00 0.15 0.00 0.00 42.46 39.07 1wpw s ILE 38 CO 0.04 -0.26 0.80 -1.83 -2.11 0.00 0.00 174.94 171.59 1wpw s GLU 39 N 1.38 4.44 0.21 3.50 -1.05 -1.26 -2.96 118.70 122.95 1wpw s GLU 39 Ca -0.01 1.08 0.04 0.00 -0.15 0.00 0.00 54.97 55.93 1wpw s GLU 39 Cb -0.20 -2.96 -0.05 0.00 -0.44 0.00 0.00 34.13 30.48 1wpw s GLU 39 CO 0.02 0.41 -0.02 0.14 0.95 0.00 0.00 175.26 176.76 1wpw s VAL 40 N -1.45 1.06 -0.11 1.83 -7.23 -0.51 -4.90 120.40 109.10 1wpw s VAL 40 Ca 0.43 -2.04 -0.04 0.00 -1.81 0.00 0.00 61.98 58.52 1wpw s VAL 40 Cb -0.19 -2.25 -0.04 0.00 0.56 0.00 0.00 36.38 34.47 1wpw s VAL 40 CO 0.23 -0.41 0.05 -1.61 -0.31 0.00 0.00 175.10 173.05 1wpw s GLU 41 N -3.84 3.23 -0.28 4.82 2.02 -1.26 -4.32 118.70 119.06 1wpw s GLU 41 Ca 0.26 -0.32 -0.23 0.00 0.02 0.00 0.00 54.97 54.70 1wpw s GLU 41 Cb 0.05 -2.95 0.12 0.00 0.10 0.00 0.00 34.13 31.45 1wpw s GLU 41 CO 0.07 0.67 0.95 0.00 0.02 0.00 0.00 175.26 176.98 1wpw s ALA 42 N -0.78 -1.99 0.00 5.21 0.00 -1.26 -4.59 121.76 118.35 1wpw s ALA 42 Ca 0.12 2.00 0.00 0.00 0.00 0.00 0.00 51.96 54.08 1wpw s ALA 42 Cb -0.12 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.55 1wpw s ALA 42 CO 0.03 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 175.91 1wpw n GLY 43 N 2.70 0.45 0.06 0.00 0.00 -1.00 -4.17 105.19 103.24 1wpw n GLY 43 Ca -0.14 -1.63 -0.07 0.00 0.00 0.00 0.00 46.02 44.17 1wpw n GLY 43 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1wpw h ASP 44 N 0.00 0.00 1.09 1.61 3.32 -1.90 -3.03 116.42 117.51 1wpw h ASP 44 Ca 0.00 -0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 1wpw h ASP 44 Cb 0.00 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1wpw h ASP 44 CO 0.00 1.00 -0.53 0.03 -1.72 0.00 0.00 179.24 178.03 1wpw h ARG 45 N 0.00 0.00 0.00 3.56 3.08 -1.90 -3.03 114.38 116.10 1wpw h ARG 45 Ca -0.06 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.84 1wpw h ARG 45 Cb 1.81 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.84 1wpw h ARG 45 CO 0.12 0.53 -0.71 0.00 -1.07 0.00 0.00 179.97 178.84 1wpw h ALA 46 N 1.47 0.57 0.00 0.04 0.00 -1.87 -2.63 119.26 116.84 1wpw h ALA 46 Ca -0.01 -0.64 -0.06 0.00 0.00 0.00 0.00 54.91 54.20 1wpw h ALA 46 Cb 1.22 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1wpw h ALA 46 CO 0.07 0.88 -0.30 1.25 0.00 0.00 0.00 179.25 181.15 1wpw h LEU 47 N 0.00 0.00 0.16 0.00 6.46 -1.50 -1.68 115.31 118.75 1wpw h LEU 47 Ca -0.01 0.00 -0.34 0.00 -0.12 0.00 0.00 57.88 57.41 1wpw h LEU 47 Cb 1.50 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.43 1wpw h LEU 47 CO 0.09 0.30 -1.71 0.00 -0.62 0.00 0.00 178.44 176.50 1wpw h ALA 48 N 1.70 0.22 0.04 1.25 0.00 -1.48 -3.39 119.26 117.61 1wpw h ALA 48 Ca -0.00 -1.16 -0.00 0.00 0.00 0.00 0.00 54.91 53.74 1wpw h ALA 48 Cb 0.98 0.43 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1wpw h ALA 48 CO 0.04 1.09 -0.02 0.00 0.00 0.00 0.00 179.25 180.36 1wpw h ARG 49 N 0.09 -0.05 0.00 0.00 3.08 -1.53 -3.47 114.38 112.50 1wpw h ARG 49 Ca -0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.73 1wpw h ARG 49 Cb 2.07 0.01 0.00 0.00 0.08 0.00 0.00 29.97 32.13 1wpw h ARG 49 CO 0.17 0.61 0.00 0.66 -1.07 0.00 0.00 179.97 180.34 1wpw n TYR 50 N -4.75 0.00 0.07 3.04 4.01 -0.63 -5.07 117.16 113.83 1wpw n TYR 50 Ca -0.08 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.67 1wpw n TYR 50 Cb 0.34 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.35 1wpw n TYR 50 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wpw n GLY 51 N 5.00 0.53 3.55 2.72 0.00 -1.26 -4.55 105.19 111.19 1wpw n GLY 51 Ca 0.00 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 1wpw n GLY 51 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wpw s GLU 52 N -1.48 2.03 0.24 1.61 2.02 -1.26 -4.93 118.70 116.93 1wpw s GLU 52 Ca 0.00 -1.11 -0.01 0.00 0.02 0.00 0.00 54.97 53.88 1wpw s GLU 52 Cb 0.02 -2.23 0.28 0.00 0.10 0.00 0.00 34.13 32.30 1wpw s GLU 52 CO 0.09 0.49 1.65 0.00 0.02 0.00 0.00 175.26 177.50 1wpw h ALA 53 N 3.50 0.95 -3.01 5.21 0.00 -1.84 -3.29 119.26 120.77 1wpw h ALA 53 Ca -0.49 -0.39 -0.64 0.00 0.00 0.00 0.00 54.91 53.40 1wpw h ALA 53 Cb 1.17 -0.12 -0.41 0.00 0.00 0.00 0.00 17.79 18.43 1wpw h ALA 53 CO 0.51 0.61 -0.46 1.28 0.00 0.00 0.00 179.25 181.19 1wpw n LEU 54 N -4.08 3.32 -4.42 0.00 4.77 -1.26 -2.38 117.00 112.94 1wpw n LEU 54 Ca -0.01 -5.20 -0.41 0.00 -0.03 0.00 0.00 56.01 50.36 1wpw n LEU 54 Cb 0.46 -0.83 0.01 0.00 -2.33 0.00 0.00 43.42 40.72 1wpw n LEU 54 CO 0.44 1.72 -0.05 -2.65 -1.33 0.00 0.00 177.39 175.52 1wpw n PRO 55 N 2.00 0.44 -0.18 3.23 -0.02 -1.26 -4.70 135.00 134.51 1wpw n PRO 55 Ca 0.21 0.16 -0.01 0.00 -2.02 0.00 0.00 63.50 61.84 1wpw n PRO 55 Cb 0.35 -1.43 0.08 0.00 -0.02 0.00 0.00 33.50 32.49 1wpw n PRO 55 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1wpw h LYS 56 N 0.59 0.20 -0.73 -0.52 1.57 -1.98 -1.97 116.57 113.72 1wpw h LYS 56 Ca -0.41 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.33 1wpw h LYS 56 Cb 1.41 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.64 1wpw h LYS 56 CO 0.49 0.13 0.34 -0.44 -0.57 0.00 0.00 179.45 179.41 1wpw h ASP 57 N 0.21 0.95 0.03 0.86 3.32 -2.00 -2.75 116.42 117.03 1wpw h ASP 57 Ca 0.28 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 1wpw h ASP 57 Cb 0.42 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1wpw h ASP 57 CO -0.39 0.81 -0.01 0.28 -1.72 0.00 0.00 179.24 178.20 1wpw h SER 58 N 1.03 -0.03 -0.84 6.45 0.02 -1.70 -2.98 113.55 115.50 1wpw h SER 58 Ca 0.25 -0.22 0.18 0.00 -0.84 0.00 0.00 61.79 61.16 1wpw h SER 58 Cb 0.12 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.61 1wpw h SER 58 CO -0.03 0.20 0.56 -0.07 -1.14 0.00 0.00 176.83 176.35 1wpw h LEU 59 N -0.26 0.41 -0.65 5.07 3.38 -1.26 -1.12 115.31 120.87 1wpw h LEU 59 Ca -0.00 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1wpw h LEU 59 Cb 0.25 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1wpw h LEU 59 CO 0.01 0.19 -0.42 0.50 0.09 0.00 0.00 178.44 178.80 1wpw h LYS 60 N 0.42 0.00 0.00 1.13 1.63 -1.35 -2.46 116.57 115.94 1wpw h LYS 60 Ca 0.43 0.00 -0.09 0.00 -0.85 0.00 0.00 60.65 60.13 1wpw h LYS 60 Cb 1.02 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.63 1wpw h LYS 60 CO -0.15 0.42 -0.79 0.82 -3.45 0.00 0.00 179.45 176.30 1wpw h ILE 61 N 0.00 0.50 0.04 2.00 2.04 -1.09 -3.32 117.51 117.68 1wpw h ILE 61 Ca -0.00 -1.80 -0.22 0.00 1.00 0.00 0.00 64.86 63.84 1wpw h ILE 61 Cb 1.06 2.10 -0.01 0.00 -0.74 0.00 0.00 36.82 39.23 1wpw h ILE 61 CO 0.05 0.29 -1.00 0.40 0.00 0.00 0.00 178.15 177.89 1wpw h ILE 62 N 0.00 1.56 -0.22 -0.67 2.04 -1.23 -3.20 117.51 115.78 1wpw h ILE 62 Ca -0.05 -2.95 -0.06 0.00 1.00 0.00 0.00 64.86 62.79 1wpw h ILE 62 Cb 1.34 2.69 -0.01 0.00 -0.74 0.00 0.00 36.82 40.10 1wpw h ILE 62 CO 0.04 0.86 -0.14 -0.78 0.00 0.00 0.00 178.15 178.13 1wpw h ASP 63 N 0.07 0.36 -0.09 1.72 1.82 -1.54 -1.61 116.42 117.15 1wpw h ASP 63 Ca -0.06 -0.09 0.00 0.00 -0.39 0.00 0.00 57.03 56.50 1wpw h ASP 63 Cb 1.70 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 41.61 1wpw h ASP 63 CO 0.15 0.52 0.00 0.29 -1.61 0.00 0.00 179.24 178.59 1wpw n LYS 64 N -4.23 1.70 -3.90 0.28 4.01 -1.24 -4.90 118.16 109.89 1wpw n LYS 64 Ca -0.00 -1.04 -0.31 0.00 -0.51 0.00 0.00 58.31 56.45 1wpw n LYS 64 Cb 0.30 -1.44 -0.04 0.00 -0.51 0.00 0.00 35.03 33.34 1wpw n LYS 64 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1wpw s ALA 65 N -1.90 3.99 -0.12 7.82 0.00 -0.61 -4.91 121.76 126.04 1wpw s ALA 65 Ca 0.35 -0.81 -0.22 0.00 0.00 0.00 0.00 51.96 51.28 1wpw s ALA 65 Cb 0.19 -1.85 -0.20 0.00 0.00 0.00 0.00 23.12 21.26 1wpw s ALA 65 CO 0.30 0.81 0.65 -0.44 0.00 0.00 0.00 175.76 177.08 1wpw h ASP 66 N 3.14 -0.02 -4.12 0.00 3.32 -0.83 -3.48 116.42 114.43 1wpw h ASP 66 Ca -0.45 -0.71 -0.59 0.00 0.02 0.00 0.00 57.03 55.29 1wpw h ASP 66 Cb 1.16 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.50 1wpw h ASP 66 CO 0.75 0.82 -0.84 -0.63 -1.72 0.00 0.00 179.24 177.62 1wpw s ILE 67 N -2.29 1.85 -0.21 0.35 1.01 -1.19 -3.28 121.20 117.43 1wpw s ILE 67 Ca -0.14 -1.59 -0.03 0.00 0.00 0.00 0.00 60.65 58.89 1wpw s ILE 67 Cb -0.02 -1.66 -0.00 0.00 0.01 0.00 0.00 42.46 40.79 1wpw s ILE 67 CO 0.53 -0.02 -0.08 -0.63 0.00 0.00 0.00 174.94 174.74 1wpw s ILE 68 N -1.13 3.03 -0.29 2.92 1.01 -0.14 -1.63 121.20 124.97 1wpw s ILE 68 Ca 0.08 -0.61 -0.03 0.00 0.00 0.00 0.00 60.65 60.10 1wpw s ILE 68 Cb -0.10 -2.36 0.04 0.00 0.01 0.00 0.00 42.46 40.05 1wpw s ILE 68 CO 0.05 0.45 0.00 -0.22 0.00 0.00 0.00 174.94 175.22 1wpw s LEU 69 N 1.42 3.79 0.16 2.97 0.20 -0.25 -1.11 118.68 125.85 1wpw s LEU 69 Ca 0.05 -1.14 0.08 0.00 0.69 0.00 0.00 54.13 53.81 1wpw s LEU 69 Cb -0.14 -1.73 -0.04 0.00 -0.43 0.00 0.00 46.19 43.85 1wpw s LEU 69 CO -0.06 -0.24 -0.17 -1.59 -0.29 0.00 0.00 176.35 174.01 1wpw s LYS 70 N 1.30 1.22 0.00 1.98 -2.85 -0.89 -0.73 119.74 119.77 1wpw s LYS 70 Ca -0.03 -1.39 0.00 0.00 -1.00 0.00 0.00 55.97 53.55 1wpw s LYS 70 Cb -0.19 -1.20 0.00 0.00 -2.06 0.00 0.00 37.83 34.38 1wpw s LYS 70 CO -0.01 0.24 0.00 0.41 0.10 0.00 0.00 175.35 176.09 1wpw n GLY 71 N 0.28 1.90 3.77 0.59 0.00 -0.81 -4.24 105.19 106.69 1wpw n GLY 71 Ca -0.13 -2.11 -0.37 0.00 0.00 0.00 0.00 46.02 43.41 1wpw n GLY 71 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wpw s PRO 72 N -1.37 3.84 0.23 1.61 0.04 -1.26 -4.78 135.00 133.31 1wpw s PRO 72 Ca 0.00 1.69 0.09 0.00 0.04 0.00 0.00 61.00 62.81 1wpw s PRO 72 Cb 0.00 -2.41 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 1wpw s PRO 72 CO 0.00 -0.46 -0.00 0.08 0.04 0.00 0.00 177.00 176.65 1wpw s VAL 73 N -1.60 3.56 0.00 -0.36 1.01 -1.26 -1.89 120.40 119.86 1wpw s VAL 73 Ca 0.63 -1.70 0.00 0.00 0.00 0.00 0.00 61.98 60.91 1wpw s VAL 73 Cb -0.26 -2.85 0.00 0.00 0.00 0.00 0.00 36.38 33.27 1wpw s VAL 73 CO 0.32 -0.26 0.00 0.61 0.00 0.00 0.00 175.10 175.77 1wpw n GLY 74 N -0.56 0.76 0.25 4.51 0.00 -1.26 -3.85 105.19 105.04 1wpw n GLY 74 Ca -0.08 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.03 1wpw n GLY 74 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1wpw h GLU 75 N 0.00 0.00 -0.76 1.61 4.39 -2.00 -2.69 114.58 115.12 1wpw h GLU 75 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1wpw h GLU 75 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1wpw h GLU 75 CO 0.00 0.09 0.00 -1.13 -1.16 0.00 0.00 179.01 176.81 1wpw n SER 76 N -4.20 3.26 0.08 1.42 3.41 -1.26 -4.41 113.62 111.92 1wpw n SER 76 Ca -0.03 -2.43 0.06 0.00 -0.26 0.00 0.00 58.87 56.22 1wpw n SER 76 Cb 0.18 -0.57 0.51 0.00 -0.26 0.00 0.00 64.21 64.07 1wpw n SER 76 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wpw h ALA 77 N 3.05 1.84 0.00 7.33 0.00 -1.75 -2.28 119.26 127.45 1wpw h ALA 77 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1wpw h ALA 77 Cb 1.18 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1wpw h ALA 77 CO 0.23 0.14 -0.30 0.00 0.00 0.00 0.00 179.25 179.32 1wpw h ALA 78 N 1.83 0.92 0.00 0.00 0.00 -1.87 -2.14 119.26 118.01 1wpw h ALA 78 Ca 0.11 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1wpw h ALA 78 Cb 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1wpw h ALA 78 CO -0.02 0.37 -0.79 -0.25 0.00 0.00 0.00 179.25 178.56 1wpw n ASP 79 N -3.34 0.65 -0.13 0.00 8.00 -0.88 -3.57 116.55 117.27 1wpw n ASP 79 Ca 0.01 -0.38 -0.27 0.00 0.71 0.00 0.00 54.79 54.86 1wpw n ASP 79 Cb 0.52 0.59 -0.11 0.00 -0.02 0.00 0.00 41.12 42.11 1wpw n ASP 79 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1wpw n VAL 80 N -1.68 1.53 0.02 2.53 0.31 -1.07 -4.28 118.33 115.69 1wpw n VAL 80 Ca 0.04 -0.38 -0.20 0.00 -0.01 0.00 0.00 64.34 63.79 1wpw n VAL 80 Cb 0.37 -1.84 -0.14 0.00 -0.91 0.00 0.00 33.84 31.32 1wpw n VAL 80 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1wpw h VAL 81 N -0.85 1.31 -0.06 2.52 2.07 -1.58 -3.14 116.25 116.52 1wpw h VAL 81 Ca -0.65 -2.47 -0.01 0.00 0.82 0.00 0.00 66.70 64.39 1wpw h VAL 81 Cb 1.63 2.99 -0.00 0.00 -1.52 0.00 0.00 31.29 34.38 1wpw h VAL 81 CO -0.35 0.69 -0.01 0.58 0.02 0.00 0.00 177.57 178.50 1wpw h VAL 82 N -0.39 1.29 0.00 2.57 2.07 -1.74 -2.15 116.25 117.90 1wpw h VAL 82 Ca -0.21 -0.92 -0.05 0.00 0.82 0.00 0.00 66.70 66.34 1wpw h VAL 82 Cb 1.66 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 33.20 1wpw h VAL 82 CO 0.10 0.25 -0.25 0.11 0.02 0.00 0.00 177.57 177.80 1wpw h LYS 83 N -0.22 0.00 0.00 1.57 1.57 -1.74 -1.58 116.57 116.17 1wpw h LYS 83 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1wpw h LYS 83 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1wpw h LYS 83 CO 0.01 0.25 -0.01 1.25 -0.57 0.00 0.00 179.45 180.37 1wpw h LEU 84 N 0.00 0.00 0.11 2.94 5.85 -1.47 -3.23 115.31 119.51 1wpw h LEU 84 Ca -0.00 -0.00 -0.32 0.00 0.84 0.00 0.00 57.88 58.40 1wpw h LEU 84 Cb 0.60 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1wpw h LEU 84 CO 0.03 0.00 -1.68 -0.09 -0.34 0.00 0.00 178.44 176.36 1wpw h ARG 85 N 0.00 0.24 0.00 1.25 2.43 -0.62 -3.30 114.38 114.38 1wpw h ARG 85 Ca 0.00 -0.41 0.00 0.00 -0.81 0.00 0.00 59.98 58.76 1wpw h ARG 85 Cb 0.82 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1wpw h ARG 85 CO 0.00 1.20 0.00 -0.56 -1.51 0.00 0.00 179.97 179.10 1wpw h GLN 86 N -0.19 0.00 0.00 0.20 3.07 -1.55 -0.86 115.11 115.78 1wpw h GLN 86 Ca -0.37 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.35 1wpw h GLN 86 Cb 1.86 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 29.42 1wpw h GLN 86 CO 0.05 0.00 -1.03 -0.84 0.09 0.00 0.00 178.83 177.10 1wpw h ILE 87 N 0.00 0.06 -0.44 1.86 3.07 -1.72 -3.29 117.51 117.05 1wpw h ILE 87 Ca 0.00 -1.12 0.00 0.00 1.55 0.00 0.00 64.86 65.29 1wpw h ILE 87 Cb 0.88 1.58 0.00 0.00 -0.27 0.00 0.00 36.82 39.01 1wpw h ILE 87 CO 0.00 0.04 0.00 -1.22 -1.05 0.00 0.00 178.15 175.92 1wpw n TYR 88 N -2.72 0.70 -3.80 0.16 4.01 -1.22 -5.02 117.16 109.27 1wpw n TYR 88 Ca -0.01 -0.55 -0.25 0.00 -0.16 0.00 0.00 57.90 56.93 1wpw n TYR 88 Cb 0.58 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.54 1wpw n TYR 88 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1wpw n ASP 89 N 0.67 -4.82 -4.25 7.72 2.03 -0.40 -4.68 116.55 112.82 1wpw n ASP 89 Ca 0.16 -0.98 -0.42 0.00 0.52 0.00 0.00 54.79 54.07 1wpw n ASP 89 Cb 0.55 -1.66 -0.02 0.00 -0.72 0.00 0.00 41.12 39.28 1wpw n ASP 89 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 1wpw n MET 90 N -2.71 3.33 -0.01 -0.67 2.81 -0.76 -4.33 117.12 114.79 1wpw n MET 90 Ca -0.32 -4.47 -0.11 0.00 -1.81 0.00 0.00 57.70 50.99 1wpw n MET 90 Cb 0.69 -2.51 0.03 0.00 -0.71 0.00 0.00 33.22 30.73 1wpw n MET 90 CO 0.00 0.00 0.00 0.10 1.51 0.00 0.00 175.97 177.58 1wpw h TYR 91 N 6.38 0.77 -3.42 2.03 -0.00 -1.86 -3.43 116.97 117.44 1wpw h TYR 91 Ca 0.18 -0.28 -0.59 0.00 -0.00 0.00 0.00 58.73 58.04 1wpw h TYR 91 Cb 0.84 -0.14 -0.09 0.00 -0.00 0.00 0.00 36.73 37.33 1wpw h TYR 91 CO 0.75 1.04 0.06 0.00 -0.00 0.00 0.00 178.16 180.01 1wpw s ALA 92 N -3.97 3.52 -0.30 0.10 0.00 -1.05 -0.95 121.76 119.11 1wpw s ALA 92 Ca -0.08 -0.27 -0.06 0.00 0.00 0.00 0.00 51.96 51.56 1wpw s ALA 92 Cb 0.11 -2.90 0.02 0.00 0.00 0.00 0.00 23.12 20.34 1wpw s ALA 92 CO 0.85 -0.45 0.07 1.21 0.00 0.00 0.00 175.76 177.44 1wpw s ASN 93 N 1.11 5.06 -0.17 0.00 2.47 -0.60 -0.21 114.94 122.60 1wpw s ASN 93 Ca 0.28 -0.80 -0.09 0.00 0.42 0.00 0.00 52.86 52.67 1wpw s ASN 93 Cb -0.16 -1.85 -0.05 0.00 -1.45 0.00 0.00 41.25 37.74 1wpw s ASN 93 CO 0.11 -0.21 0.13 -0.63 -3.72 0.00 0.00 177.10 172.78 1wpw s ILE 94 N 1.46 5.43 -0.31 -5.21 -1.09 -0.14 -1.26 121.20 120.07 1wpw s ILE 94 Ca 0.02 0.19 -0.02 0.00 -2.23 0.00 0.00 60.65 58.60 1wpw s ILE 94 Cb -0.18 -3.44 0.11 0.00 -1.58 0.00 0.00 42.46 37.38 1wpw s ILE 94 CO 0.02 0.50 0.14 -0.13 -1.23 0.00 0.00 174.94 174.24 1wpw s ARG 95 N -0.11 0.47 0.28 2.79 1.81 -0.31 -2.36 118.95 121.52 1wpw s ARG 95 Ca 0.10 -0.90 -0.16 0.00 -1.72 0.00 0.00 55.73 53.05 1wpw s ARG 95 Cb -0.11 -1.51 -0.09 0.00 -0.45 0.00 0.00 34.95 32.79 1wpw s ARG 95 CO 0.00 -1.04 0.72 -1.25 -0.68 0.00 0.00 175.30 173.05 1wpw s PRO 96 N 1.70 4.08 -0.30 3.54 0.04 -1.26 -0.87 135.00 141.93 1wpw s PRO 96 Ca 0.11 0.72 -0.02 0.00 0.04 0.00 0.00 61.00 61.85 1wpw s PRO 96 Cb -0.18 -2.62 0.10 0.00 0.04 0.00 0.00 34.50 31.84 1wpw s PRO 96 CO -0.26 0.26 0.10 0.00 0.04 0.00 0.00 177.00 177.14 1wpw s ALA 97 N -1.80 1.26 -0.08 8.56 0.00 0.40 -4.75 121.76 125.37 1wpw s ALA 97 Ca 0.49 -1.46 0.05 0.00 0.00 0.00 0.00 51.96 51.04 1wpw s ALA 97 Cb -0.13 -1.54 -0.00 0.00 0.00 0.00 0.00 23.12 21.45 1wpw s ALA 97 CO 0.19 -1.63 -0.23 0.21 0.00 0.00 0.00 175.76 174.29 1wpw s LYS 98 N 1.76 2.71 0.16 0.00 2.20 -1.26 -0.63 119.74 124.67 1wpw s LYS 98 Ca 0.09 -0.85 -0.33 0.00 -0.36 0.00 0.00 55.97 54.51 1wpw s LYS 98 Cb -0.17 -2.16 -0.13 0.00 -1.51 0.00 0.00 37.83 33.86 1wpw s LYS 98 CO -0.27 0.26 1.64 0.43 -0.36 0.00 0.00 175.35 177.05 1wpw n SER 99 N 3.28 3.38 -4.58 1.43 7.64 -0.43 -4.81 113.62 119.54 1wpw n SER 99 Ca -0.18 1.07 -0.36 0.00 1.01 0.00 0.00 58.87 60.41 1wpw n SER 99 Cb 0.53 -1.47 -0.11 0.00 -1.01 0.00 0.00 64.21 62.15 1wpw n SER 99 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1wpw s ILE 100 N 1.24 4.78 0.22 0.44 -1.09 -1.20 -4.95 121.20 120.63 1wpw s ILE 100 Ca 0.79 -0.03 -0.32 0.00 -2.23 0.00 0.00 60.65 58.86 1wpw s ILE 100 Cb -0.63 -3.20 -0.14 0.00 -1.58 0.00 0.00 42.46 36.92 1wpw s ILE 100 CO 0.37 0.39 1.35 -0.81 -1.23 0.00 0.00 174.94 175.01 1wpw n PRO 101 N 4.17 1.81 0.00 2.79 -0.04 -1.26 -2.00 135.00 140.47 1wpw n PRO 101 Ca -0.16 0.64 0.00 0.00 -0.04 0.00 0.00 63.50 63.95 1wpw n PRO 101 Cb 0.52 -2.26 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 1wpw n PRO 101 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wpw n GLY 102 N 2.15 2.24 0.11 0.55 0.00 -1.26 -4.49 105.19 104.49 1wpw n GLY 102 Ca 0.13 -0.51 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 1wpw n GLY 102 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1wpw h ILE 103 N 0.00 0.92 -2.69 -0.61 2.04 -1.76 -3.41 117.51 111.99 1wpw h ILE 103 Ca 0.00 -2.65 -0.69 0.00 1.00 0.00 0.00 64.86 62.52 1wpw h ILE 103 Cb 0.00 2.59 -0.18 0.00 -0.74 0.00 0.00 36.82 38.49 1wpw h ILE 103 CO 0.00 0.75 0.57 -0.62 0.00 0.00 0.00 178.15 178.85 1wpw s ASP 104 N -6.74 6.47 -0.38 1.72 2.15 -1.00 -4.77 116.67 114.12 1wpw s ASP 104 Ca -0.11 -1.78 0.07 0.00 0.43 0.00 0.00 52.55 51.16 1wpw s ASP 104 Cb 0.07 -2.37 0.68 0.00 -0.30 0.00 0.00 42.92 41.00 1wpw s ASP 104 CO 0.82 -1.10 1.81 0.35 -0.17 0.00 0.00 175.17 176.88 1wpw n THR 105 N 5.44 3.01 0.00 1.71 -2.24 -1.26 -4.27 114.28 116.67 1wpw n THR 105 Ca 0.11 -1.92 0.00 0.00 -2.27 0.00 0.00 64.05 59.97 1wpw n THR 105 Cb 0.47 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 1wpw n THR 105 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1wpw n LYS 106 N -0.77 1.28 0.05 -0.78 5.02 -1.26 -5.00 118.16 116.70 1wpw n LYS 106 Ca 0.49 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.78 1wpw n LYS 106 Cb 1.48 -0.82 0.00 0.00 -0.02 0.00 0.00 35.03 35.67 1wpw n LYS 106 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1wpw n TYR 107 N -1.79 -0.16 0.00 2.13 4.02 -1.26 -5.05 117.16 115.04 1wpw n TYR 107 Ca 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 1wpw n TYR 107 Cb 0.32 0.04 0.00 0.00 -0.02 0.00 0.00 39.34 39.68 1wpw n TYR 107 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1wpw n GLY 108 N 3.35 2.27 1.25 2.72 0.00 -1.26 -4.83 105.19 108.68 1wpw n GLY 108 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1wpw n GLY 108 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1wpw n ASN 109 N 0.00 1.55 -4.71 1.61 2.04 -1.26 -4.89 115.26 109.59 1wpw n ASN 109 Ca 0.00 -2.88 -0.42 0.00 -0.44 0.00 0.00 54.58 50.84 1wpw n ASN 109 Cb 0.00 -0.41 -0.03 0.00 -2.53 0.00 0.00 39.78 36.81 1wpw n ASN 109 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1wpw s VAL 110 N -1.83 4.71 -0.45 3.53 1.01 -1.26 -4.68 120.40 121.41 1wpw s VAL 110 Ca 0.36 1.99 0.06 0.00 0.00 0.00 0.00 61.98 64.39 1wpw s VAL 110 Cb 0.38 -4.27 0.20 0.00 0.00 0.00 0.00 36.38 32.68 1wpw s VAL 110 CO -0.11 0.18 0.57 -0.67 0.00 0.00 0.00 175.10 175.08 1wpw n ASP 111 N 3.70 -1.72 -4.77 3.32 2.03 -1.25 -1.31 116.55 116.56 1wpw n ASP 111 Ca 0.06 -2.73 -0.30 0.00 0.52 0.00 0.00 54.79 52.33 1wpw n ASP 111 Cb 0.50 0.54 -0.07 0.00 -0.72 0.00 0.00 41.12 41.37 1wpw n ASP 111 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1wpw s ILE 112 N 0.22 4.51 -0.12 5.18 1.01 0.20 -4.49 121.20 127.71 1wpw s ILE 112 Ca 0.32 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 60.19 1wpw s ILE 112 Cb 0.07 -3.17 0.03 0.00 0.01 0.00 0.00 42.46 39.41 1wpw s ILE 112 CO -0.14 0.13 -0.03 -0.22 0.00 0.00 0.00 174.94 174.68 1wpw s LEU 113 N -2.36 1.06 -0.27 2.97 1.98 -0.01 -0.45 118.68 121.59 1wpw s LEU 113 Ca 0.29 -0.37 -0.09 0.00 -2.89 0.00 0.00 54.13 51.07 1wpw s LEU 113 Cb -0.12 -0.68 -0.03 0.00 0.66 0.00 0.00 46.19 46.02 1wpw s LEU 113 CO 0.22 -0.18 0.13 -0.63 -1.89 0.00 0.00 176.35 173.99 1wpw s ILE 114 N 1.81 4.71 -0.36 6.68 1.01 -0.05 -1.07 121.20 133.93 1wpw s ILE 114 Ca 0.03 -0.12 -0.13 0.00 0.00 0.00 0.00 60.65 60.44 1wpw s ILE 114 Cb -0.14 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 39.07 1wpw s ILE 114 CO -0.07 0.24 0.24 -0.69 0.00 0.00 0.00 174.94 174.66 1wpw s VAL 115 N 1.66 5.05 -0.19 2.92 1.01 0.70 -1.16 120.40 130.39 1wpw s VAL 115 Ca 0.06 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.56 1wpw s VAL 115 Cb -0.16 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.55 1wpw s VAL 115 CO 0.07 -0.11 -0.15 -0.60 0.00 0.00 0.00 175.10 174.31 1wpw s ARG 116 N 1.67 3.12 0.14 2.72 3.52 -0.39 -2.07 118.95 127.66 1wpw s ARG 116 Ca 0.05 -0.76 -0.32 0.00 -0.13 0.00 0.00 55.73 54.57 1wpw s ARG 116 Cb -0.18 -2.72 -0.11 0.00 -1.56 0.00 0.00 34.95 30.38 1wpw s ARG 116 CO 0.09 -0.20 1.80 -1.91 -0.81 0.00 0.00 175.30 174.27 1wpw n GLU 117 N 4.67 2.72 -0.63 5.12 0.00 -0.98 -1.55 120.64 129.99 1wpw n GLU 117 Ca -0.20 0.99 0.06 0.00 0.00 0.00 0.00 57.16 58.01 1wpw n GLU 117 Cb 0.50 -2.86 0.20 0.00 0.00 0.00 0.00 31.44 29.28 1wpw n GLU 117 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1wpw n ASN 118 N 5.14 1.69 0.00 4.31 5.15 -0.13 -1.98 115.26 129.45 1wpw n ASN 118 Ca 0.18 -3.78 0.00 0.00 -0.60 0.00 0.00 54.58 50.38 1wpw n ASN 118 Cb 0.36 -0.51 0.00 0.00 -0.53 0.00 0.00 39.78 39.09 1wpw n ASN 118 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1wpw n THR 119 N -1.05 0.00 0.00 -0.44 -2.24 -1.26 -4.88 114.28 104.41 1wpw n THR 119 Ca 0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 1wpw n THR 119 Cb 0.71 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 1wpw n THR 119 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1wpw n GLU 120 N -1.06 2.21 0.00 -0.78 0.28 -1.26 -4.68 120.64 115.35 1wpw n GLU 120 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1wpw n GLU 120 Cb 0.17 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.04 1wpw n GLU 120 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1wpw n ASP 121 N 0.00 0.00 -0.31 -1.84 -0.08 -0.39 -3.17 116.55 110.76 1wpw n ASP 121 Ca 0.00 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.38 1wpw n ASP 121 Cb 0.00 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 43.42 1wpw n ASP 121 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1wpw n LEU 122 N 0.00 1.60 -0.41 -2.67 4.77 -1.26 -2.58 117.00 116.45 1wpw n LEU 122 Ca 0.00 -0.68 0.03 0.00 -0.03 0.00 0.00 56.01 55.33 1wpw n LEU 122 Cb 0.00 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.17 1wpw n LEU 122 CO 0.00 0.32 0.54 -1.22 -1.33 0.00 0.00 177.39 175.70 1wpw n TYR 123 N -0.50 0.28 1.10 -1.77 4.02 -1.19 -3.39 117.16 115.71 1wpw n TYR 123 Ca 0.07 -0.13 0.12 0.00 -0.01 0.00 0.00 57.90 57.95 1wpw n TYR 123 Cb 0.39 -0.03 0.14 0.00 -0.02 0.00 0.00 39.34 39.82 1wpw n TYR 123 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 1wpw n LYS 124 N 0.04 1.27 -0.91 -0.72 2.85 -1.26 -4.97 118.16 114.46 1wpw n LYS 124 Ca 0.06 -0.97 0.00 0.00 -1.05 0.00 0.00 58.31 56.35 1wpw n LYS 124 Cb 0.20 -1.48 0.00 0.00 -0.65 0.00 0.00 35.03 33.11 1wpw n LYS 124 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1wpw n GLY 125 N 1.38 0.63 3.31 2.58 0.00 -1.22 -4.97 105.19 106.89 1wpw n GLY 125 Ca 0.11 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.95 1wpw n GLY 125 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1wpw n PHE 126 N -2.83 4.41 -4.07 1.61 3.72 -1.26 -4.95 117.46 114.09 1wpw n PHE 126 Ca 0.00 -3.17 -0.13 0.00 -0.05 0.00 0.00 57.45 54.10 1wpw n PHE 126 Cb 0.09 -2.18 -0.11 0.00 -0.94 0.00 0.00 39.48 36.34 1wpw n PHE 126 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 176.76 174.88 1wpw s GLU 127 N 1.54 0.55 0.06 -1.08 -1.05 -1.26 -1.86 118.70 115.60 1wpw s GLU 127 Ca 0.43 -0.77 -0.04 0.00 -0.15 0.00 0.00 54.97 54.44 1wpw s GLU 127 Cb 0.01 -0.33 -0.02 0.00 -0.44 0.00 0.00 34.13 33.35 1wpw s GLU 127 CO 0.01 0.06 0.07 -1.01 0.95 0.00 0.00 175.26 175.34 1wpw s HIS 128 N -1.36 0.33 -0.54 4.83 3.76 -0.55 -4.99 115.29 116.76 1wpw s HIS 128 Ca -0.09 -0.78 -0.22 0.00 -0.15 0.00 0.00 55.06 53.81 1wpw s HIS 128 Cb -0.10 -0.22 0.05 0.00 1.11 0.00 0.00 32.58 33.42 1wpw s HIS 128 CO 0.01 -0.43 0.84 0.42 -0.85 0.00 0.00 174.74 174.73 1wpw s ILE 129 N -3.58 4.55 0.04 0.60 1.01 -1.26 -1.02 121.20 121.54 1wpw s ILE 129 Ca 0.03 -0.01 0.11 0.00 0.00 0.00 0.00 60.65 60.79 1wpw s ILE 129 Cb 0.05 -4.47 -0.06 0.00 0.01 0.00 0.00 42.46 37.98 1wpw s ILE 129 CO -0.09 -1.03 1.41 -0.37 0.00 0.00 0.00 174.94 174.86 1wpw h VAL 130 N 5.97 1.31 -3.46 2.92 -1.51 -1.74 -3.48 116.25 116.26 1wpw h VAL 130 Ca -0.27 -2.71 -0.09 0.00 -1.23 0.00 0.00 66.70 62.40 1wpw h VAL 130 Cb 1.08 2.56 -0.05 0.00 -2.13 0.00 0.00 31.29 32.75 1wpw h VAL 130 CO 1.05 0.72 0.06 -0.55 -1.23 0.00 0.00 177.57 177.62 1wpw s SER 131 N -6.61 0.24 0.14 4.19 0.15 -1.22 -5.05 113.70 105.54 1wpw s SER 131 Ca 0.02 -1.15 -0.31 0.00 0.70 0.00 0.00 55.95 55.21 1wpw s SER 131 Cb 0.09 0.73 -0.11 0.00 -1.71 0.00 0.00 66.02 65.03 1wpw s SER 131 CO 0.78 -1.43 1.82 -0.62 1.20 0.00 0.00 173.24 174.98 1wpw s ASP 132 N -3.09 6.41 -0.21 5.45 2.15 -1.26 -2.15 116.67 123.96 1wpw s ASP 132 Ca 0.21 2.79 0.00 0.00 0.43 0.00 0.00 52.55 55.98 1wpw s ASP 132 Cb -0.03 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 1wpw s ASP 132 CO 0.13 -1.00 0.00 0.61 -0.17 0.00 0.00 175.17 174.74 1wpw n GLY 133 N 4.20 0.37 2.96 2.66 0.00 -1.26 -4.98 105.19 109.13 1wpw n GLY 133 Ca 0.17 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 1wpw n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wpw s VAL 134 N -1.55 1.23 -0.07 1.61 1.01 -0.92 -5.12 120.40 116.61 1wpw s VAL 134 Ca 0.00 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.60 1wpw s VAL 134 Cb 0.00 -1.20 -0.01 0.00 0.00 0.00 0.00 36.38 35.17 1wpw s VAL 134 CO 0.00 0.40 -0.24 0.00 0.00 0.00 0.00 175.10 175.26 1wpw s ALA 135 N 1.54 2.13 -0.05 5.51 0.00 -1.26 -1.85 121.76 127.77 1wpw s ALA 135 Ca 0.03 -1.00 0.05 0.00 0.00 0.00 0.00 51.96 51.04 1wpw s ALA 135 Cb -0.13 -0.70 -0.01 0.00 0.00 0.00 0.00 23.12 22.28 1wpw s ALA 135 CO -0.08 0.37 -0.21 0.08 0.00 0.00 0.00 175.76 175.92 1wpw s VAL 136 N -0.01 1.75 0.01 0.00 1.01 -0.18 -4.96 120.40 118.01 1wpw s VAL 136 Ca -0.08 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.07 1wpw s VAL 136 Cb -0.15 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 1wpw s VAL 136 CO 0.05 0.49 -0.19 -0.83 0.00 0.00 0.00 175.10 174.62 1wpw s GLY 137 N -0.02 0.98 -0.22 4.51 0.00 -1.26 -1.48 107.32 109.83 1wpw s GLY 137 Ca -0.05 -0.90 -0.09 0.00 0.00 0.00 0.00 44.72 43.68 1wpw s GLY 137 CO 0.03 -0.79 0.12 1.06 0.00 0.00 0.00 173.10 173.52 1wpw s MET 138 N -0.75 4.05 -0.34 2.90 -1.94 -0.78 -5.02 119.30 117.42 1wpw s MET 138 Ca 0.07 -0.29 -0.12 0.00 -1.71 0.00 0.00 55.69 53.64 1wpw s MET 138 Cb -0.08 -3.41 -0.01 0.00 2.01 0.00 0.00 34.83 33.35 1wpw s MET 138 CO 0.00 0.16 0.22 0.21 -0.01 0.00 0.00 175.02 175.60 1wpw s LYS 139 N 0.74 3.32 -0.18 2.03 2.20 -1.26 -4.55 119.74 122.05 1wpw s LYS 139 Ca 0.06 -0.75 0.00 0.00 -0.36 0.00 0.00 55.97 54.92 1wpw s LYS 139 Cb -0.13 -3.76 0.01 0.00 -1.51 0.00 0.00 37.83 32.45 1wpw s LYS 139 CO 0.02 -0.50 -0.17 -1.50 -0.36 0.00 0.00 175.35 172.84 1wpw s ILE 140 N 1.67 2.35 -0.07 5.43 1.10 -1.06 -4.97 121.20 125.64 1wpw s ILE 140 Ca 0.05 -0.85 -0.01 0.00 -0.51 0.00 0.00 60.65 59.33 1wpw s ILE 140 Cb -0.18 -1.99 0.03 0.00 0.15 0.00 0.00 42.46 40.47 1wpw s ILE 140 CO 0.09 0.52 -0.01 -0.51 -2.11 0.00 0.00 174.94 172.92 1wpw s ILE 141 N 1.18 0.46 0.18 2.00 -1.16 -1.26 -1.26 121.20 121.34 1wpw s ILE 141 Ca 0.02 0.06 0.06 0.00 -0.51 0.00 0.00 60.65 60.28 1wpw s ILE 141 Cb -0.14 -0.59 -0.04 0.00 0.61 0.00 0.00 42.46 42.30 1wpw s ILE 141 CO -0.08 0.27 0.07 0.42 -2.81 0.00 0.00 174.94 172.81 1wpw s THR 142 N 1.85 4.07 0.12 4.00 -4.23 -1.26 -4.96 115.64 115.23 1wpw s THR 142 Ca 0.04 -1.31 0.23 0.00 -1.18 0.00 0.00 61.69 59.47 1wpw s THR 142 Cb -0.12 -3.08 0.21 0.00 1.34 0.00 0.00 72.50 70.85 1wpw s THR 142 CO -0.05 -0.14 1.79 0.08 -0.54 0.00 0.00 174.62 175.76 1wpw h ARG 143 N 2.46 0.00 0.65 3.99 0.11 -1.98 -2.24 114.38 117.38 1wpw h ARG 143 Ca -0.47 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.58 1wpw h ARG 143 Cb 1.21 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.29 1wpw h ARG 143 CO 0.60 0.26 -0.34 0.35 0.10 0.00 0.00 179.97 180.95 1wpw h PHE 144 N 0.00 -0.88 -0.60 4.08 3.57 -2.00 -1.08 116.94 120.04 1wpw h PHE 144 Ca -0.00 -0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.40 1wpw h PHE 144 Cb 0.81 0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.82 1wpw h PHE 144 CO 0.00 -0.53 0.07 0.00 -2.23 0.00 0.00 178.31 175.61 1wpw h ALA 145 N -0.57 1.00 -0.65 2.41 0.00 -1.99 -2.60 119.26 116.86 1wpw h ALA 145 Ca -0.09 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.58 1wpw h ALA 145 Cb 0.71 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1wpw h ALA 145 CO 0.13 0.63 0.43 0.77 0.00 0.00 0.00 179.25 181.21 1wpw h SER 146 N 0.92 0.69 0.36 0.00 0.02 -1.29 -1.50 113.55 112.76 1wpw h SER 146 Ca 0.18 -0.01 -0.27 0.00 -0.84 0.00 0.00 61.79 60.85 1wpw h SER 146 Cb 0.44 -0.17 0.01 0.00 0.14 0.00 0.00 62.40 62.83 1wpw h SER 146 CO 0.02 0.49 -1.17 -0.33 -1.14 0.00 0.00 176.83 174.69 1wpw h GLU 147 N 0.81 0.44 -0.46 3.45 5.08 -1.05 -2.91 114.58 119.94 1wpw h GLU 147 Ca 0.25 -0.60 -0.03 0.00 -1.00 0.00 0.00 59.36 57.98 1wpw h GLU 147 Cb 0.01 0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1wpw h GLU 147 CO -0.07 1.25 0.17 0.00 -1.00 0.00 0.00 179.01 179.36 1wpw h ARG 148 N 0.19 0.70 -0.45 2.33 3.08 -1.25 -1.52 114.38 117.45 1wpw h ARG 148 Ca -0.14 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 59.70 1wpw h ARG 148 Cb 1.85 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 31.77 1wpw h ARG 148 CO 0.21 0.65 0.02 0.97 -1.07 0.00 0.00 179.97 180.75 1wpw h ILE 149 N 0.61 1.23 -0.49 2.04 6.09 -1.37 -2.93 117.51 122.69 1wpw h ILE 149 Ca 0.15 -0.92 -0.06 0.00 -1.37 0.00 0.00 64.86 62.66 1wpw h ILE 149 Cb 0.23 0.86 -0.02 0.00 0.47 0.00 0.00 36.82 38.36 1wpw h ILE 149 CO -0.01 0.33 0.07 0.00 -3.07 0.00 0.00 178.15 175.47 1wpw h ALA 150 N 1.33 0.65 -0.87 0.18 0.00 -1.28 -2.01 119.26 117.27 1wpw h ALA 150 Ca 0.14 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1wpw h ALA 150 Cb 0.40 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1wpw h ALA 150 CO 0.01 0.39 0.57 0.87 0.00 0.00 0.00 179.25 181.09 1wpw h LYS 151 N 0.69 1.09 -0.83 0.00 1.57 -1.18 0.26 116.57 118.17 1wpw h LYS 151 Ca 0.15 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 1wpw h LYS 151 Cb 0.41 -0.25 -0.04 0.00 0.08 0.00 0.00 32.23 32.43 1wpw h LYS 151 CO 0.01 0.72 0.39 0.28 -0.57 0.00 0.00 179.45 180.28 1wpw h VAL 152 N 1.13 1.26 -0.95 0.50 2.07 -1.33 -1.80 116.25 117.13 1wpw h VAL 152 Ca 0.33 -0.75 0.04 0.00 0.82 0.00 0.00 66.70 67.15 1wpw h VAL 152 Cb -0.05 0.21 -0.06 0.00 -1.52 0.00 0.00 31.29 29.87 1wpw h VAL 152 CO -0.10 0.32 0.62 1.23 0.02 0.00 0.00 177.57 179.66 1wpw h GLY 153 N 1.19 1.37 0.92 2.17 0.00 -0.27 -2.20 103.07 106.26 1wpw h GLY 153 Ca 0.28 -0.47 -0.08 0.00 0.00 0.00 0.00 47.33 47.07 1wpw h GLY 153 CO -0.03 0.40 -0.10 -2.00 0.00 0.00 0.00 176.54 174.80 1wpw h LEU 154 N 1.18 0.65 -0.94 3.11 5.85 -0.54 -1.61 115.31 123.02 1wpw h LEU 154 Ca 0.38 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1wpw h LEU 154 Cb 0.03 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.83 1wpw h LEU 154 CO -0.12 0.88 0.55 0.78 -0.34 0.00 0.00 178.44 180.20 1wpw h ASN 155 N 0.42 1.14 0.45 1.25 -0.26 -0.94 -1.52 115.58 116.11 1wpw h ASN 155 Ca 0.08 -0.08 -0.19 0.00 -0.56 0.00 0.00 56.30 55.55 1wpw h ASN 155 Cb 0.61 -0.29 -0.01 0.00 -1.06 0.00 0.00 38.32 37.57 1wpw h ASN 155 CO 0.04 0.88 -0.83 -0.26 -1.06 0.00 0.00 177.43 176.20 1wpw h PHE 156 N 1.30 0.40 -0.49 1.19 0.04 -1.34 -3.24 116.94 114.81 1wpw h PHE 156 Ca 0.34 -0.20 -0.10 0.00 2.80 0.00 0.00 57.97 60.80 1wpw h PHE 156 Cb -0.04 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.04 1wpw h PHE 156 CO 0.01 0.99 -0.08 0.00 -0.60 0.00 0.00 178.31 178.62 1wpw h ALA 157 N 0.95 0.94 0.00 2.45 0.00 -1.12 -2.80 119.26 119.68 1wpw h ALA 157 Ca -0.04 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1wpw h ALA 157 Cb 1.43 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1wpw h ALA 157 CO 0.13 0.62 -0.16 -0.07 0.00 0.00 0.00 179.25 179.77 1wpw h LEU 158 N 0.79 0.00 -2.95 0.00 4.07 -1.30 -0.05 115.31 115.87 1wpw h LEU 158 Ca 0.13 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.09 1wpw h LEU 158 Cb 0.59 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.33 1wpw h LEU 158 CO 0.04 0.16 0.00 -2.11 -1.08 0.00 0.00 178.44 175.45 1wpw n ARG 159 N -3.58 2.93 0.00 1.13 1.85 -1.15 -4.80 116.66 113.04 1wpw n ARG 159 Ca -0.01 -2.29 0.00 0.00 -1.00 0.00 0.00 57.85 54.54 1wpw n ARG 159 Cb 0.30 -1.43 0.00 0.00 -1.05 0.00 0.00 32.46 30.28 1wpw n ARG 159 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1wpw n ARG 160 N 0.49 0.00 -0.80 2.89 1.74 -0.68 -5.01 116.66 115.27 1wpw n ARG 160 Ca 0.15 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.19 1wpw n ARG 160 Cb 0.55 0.00 0.25 0.00 -1.02 0.00 0.00 32.46 32.24 1wpw n ARG 160 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1wpw n ARG 161 N 0.00 3.27 -3.15 5.56 1.74 -1.23 -4.93 116.66 117.91 1wpw n ARG 161 Ca 0.00 -2.43 -0.20 0.00 -0.77 0.00 0.00 57.85 54.45 1wpw n ARG 161 Cb 0.00 -2.03 -0.00 0.00 -1.02 0.00 0.00 32.46 29.40 1wpw n ARG 161 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1wpw n LYS 162 N -0.00 -3.13 -3.93 5.56 4.01 -0.12 -4.96 118.16 115.60 1wpw n LYS 162 Ca 0.31 0.48 -0.28 0.00 -0.51 0.00 0.00 58.31 58.31 1wpw n LYS 162 Cb 1.16 -5.15 -0.17 0.00 -0.51 0.00 0.00 35.03 30.36 1wpw n LYS 162 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 1wpw s LYS 163 N -5.78 1.68 0.00 1.97 2.20 -1.26 -1.28 119.74 117.27 1wpw s LYS 163 Ca 0.31 -0.32 0.07 0.00 -0.36 0.00 0.00 55.97 55.66 1wpw s LYS 163 Cb -0.16 -1.71 -0.02 0.00 -1.51 0.00 0.00 37.83 34.43 1wpw s LYS 163 CO 0.38 -0.27 -0.22 0.08 -0.36 0.00 0.00 175.35 174.96 1wpw s VAL 164 N 1.66 1.77 -0.18 4.02 1.01 -0.38 -1.85 120.40 126.46 1wpw s VAL 164 Ca 0.05 -1.05 0.00 0.00 0.00 0.00 0.00 61.98 60.98 1wpw s VAL 164 Cb -0.13 -1.49 0.04 0.00 0.00 0.00 0.00 36.38 34.80 1wpw s VAL 164 CO -0.09 0.41 -0.08 -0.89 0.00 0.00 0.00 175.10 174.45 1wpw s THR 165 N -0.62 1.41 -0.30 3.92 2.01 -0.48 -2.48 115.64 119.11 1wpw s THR 165 Ca 0.09 -0.82 -0.26 0.00 0.31 0.00 0.00 61.69 61.00 1wpw s THR 165 Cb -0.09 -1.52 0.01 0.00 0.01 0.00 0.00 72.50 70.91 1wpw s THR 165 CO 0.00 0.17 0.94 0.00 -0.69 0.00 0.00 174.62 175.04 1wpw s VAL 167 N 3.27 5.26 0.00 0.00 1.01 -0.48 -2.49 120.40 126.97 1wpw s VAL 167 Ca 0.39 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.51 1wpw s VAL 167 Cb -0.13 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.86 1wpw s VAL 167 CO 0.13 0.46 0.00 0.00 0.00 0.00 0.00 175.10 175.69 1wpw n HIS 168 N 3.39 -0.29 -2.68 5.22 1.44 -0.94 -4.42 115.22 116.94 1wpw n HIS 168 Ca -0.16 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.46 1wpw n HIS 168 Cb 0.52 0.00 0.06 0.00 0.12 0.00 0.00 29.99 30.69 1wpw n HIS 168 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 1wpw n LYS 169 N 0.00 1.17 0.00 -1.40 3.00 -1.26 0.19 118.16 119.86 1wpw n LYS 169 Ca 0.00 -2.81 0.10 0.00 -0.00 0.00 0.00 58.31 55.60 1wpw n LYS 169 Cb 0.00 -0.88 0.54 0.00 0.00 0.00 0.00 35.03 34.69 1wpw n LYS 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1wpw n ALA 170 N -0.24 2.12 0.18 3.14 0.00 -1.26 -2.20 120.51 122.24 1wpw n ALA 170 Ca 0.05 -0.11 0.07 0.00 0.00 0.00 0.00 53.44 53.45 1wpw n ALA 170 Cb 0.83 -1.33 0.15 0.00 0.00 0.00 0.00 19.45 19.10 1wpw n ALA 170 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 1wpw h ASN 171 N 0.00 0.00 0.00 0.00 -0.00 -1.95 -3.20 115.58 110.43 1wpw h ASN 171 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 56.30 56.05 1wpw h ASN 171 Cb 0.13 0.00 -0.04 0.00 -0.00 0.00 0.00 38.32 38.41 1wpw h ASN 171 CO 0.00 0.30 -1.89 0.52 -0.00 0.00 0.00 177.43 176.36 1wpw n VAL 172 N -3.21 0.88 -2.93 6.14 0.31 -1.12 -4.70 118.33 113.70 1wpw n VAL 172 Ca 0.02 -0.29 -0.42 0.00 -0.01 0.00 0.00 64.34 63.64 1wpw n VAL 172 Cb 0.62 -1.33 0.01 0.00 -0.91 0.00 0.00 33.84 32.23 1wpw n VAL 172 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 1wpw n MET 173 N -3.28 4.66 -0.25 5.55 2.81 -0.94 -4.88 117.12 120.80 1wpw n MET 173 Ca -0.29 -4.59 0.02 0.00 -1.81 0.00 0.00 57.70 51.03 1wpw n MET 173 Cb 0.76 -2.50 0.10 0.00 -0.71 0.00 0.00 33.22 30.88 1wpw n MET 173 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1wpw h ARG 174 N 5.14 0.03 0.24 0.03 2.47 -1.83 -2.69 114.38 117.76 1wpw h ARG 174 Ca 0.27 -0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.98 1wpw h ARG 174 Cb 0.55 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.87 1wpw h ARG 174 CO 1.30 0.02 -0.11 0.82 0.56 0.00 0.00 179.97 182.55 1wpw h ILE 175 N 0.03 0.00 0.71 2.04 5.03 -1.90 -2.44 117.51 120.99 1wpw h ILE 175 Ca 0.36 -0.58 -0.03 0.00 -0.12 0.00 0.00 64.86 64.49 1wpw h ILE 175 Cb 0.59 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.38 1wpw h ILE 175 CO -0.71 0.00 -0.41 0.71 -0.68 0.00 0.00 178.15 177.07 1wpw h THR 176 N -0.90 0.00 0.00 -0.27 1.35 -1.95 -1.25 112.91 109.89 1wpw h THR 176 Ca -0.03 0.00 -0.10 0.00 -0.55 0.00 0.00 66.41 65.73 1wpw h THR 176 Cb 0.24 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 66.65 1wpw h THR 176 CO 0.05 0.00 -0.46 0.44 -0.25 0.00 0.00 175.52 175.31 1wpw h ASP 177 N -1.04 0.00 -0.65 5.36 3.32 -1.70 -2.30 116.42 119.41 1wpw h ASP 177 Ca -0.10 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.91 1wpw h ASP 177 Cb 0.82 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.34 1wpw h ASP 177 CO 0.12 0.46 0.24 1.23 -1.72 0.00 0.00 179.24 179.57 1wpw h GLY 178 N 1.95 1.09 0.97 2.75 0.00 -1.39 0.23 103.07 108.66 1wpw h GLY 178 Ca -0.00 -0.60 -0.10 0.00 0.00 0.00 0.00 47.33 46.62 1wpw h GLY 178 CO 0.06 0.56 -0.19 -2.00 0.00 0.00 0.00 176.54 174.97 1wpw h LEU 179 N 0.99 0.75 -0.59 3.11 5.85 -0.89 -1.99 115.31 122.53 1wpw h LEU 179 Ca 0.22 -0.42 -0.00 0.00 0.84 0.00 0.00 57.88 58.52 1wpw h LEU 179 Cb 0.24 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1wpw h LEU 179 CO -0.01 1.01 0.37 0.15 -0.34 0.00 0.00 178.44 179.61 1wpw h PHE 180 N 0.50 0.77 0.00 1.25 3.57 -0.85 -2.18 116.94 119.99 1wpw h PHE 180 Ca 0.07 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 1wpw h PHE 180 Cb 0.74 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1wpw h PHE 180 CO 0.06 0.51 -0.27 0.00 -2.23 0.00 0.00 178.31 176.39 1wpw h ALA 181 N 1.19 1.18 -0.01 2.41 0.00 -0.52 -2.14 119.26 121.37 1wpw h ALA 181 Ca 0.21 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1wpw h ALA 181 Cb -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1wpw h ALA 181 CO -0.04 0.33 -0.11 1.49 0.00 0.00 0.00 179.25 180.92 1wpw h GLU 182 N 0.00 0.09 0.00 0.00 4.81 -0.86 -2.74 114.58 115.88 1wpw h GLU 182 Ca -0.00 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1wpw h GLU 182 Cb 0.63 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.04 1wpw h GLU 182 CO 0.03 0.81 -0.00 0.00 -0.73 0.00 0.00 179.01 179.12 1wpw h ALA 183 N 0.29 1.27 -0.05 2.92 0.00 -1.41 -2.06 119.26 120.22 1wpw h ALA 183 Ca -0.01 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1wpw h ALA 183 Cb 0.84 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1wpw h ALA 183 CO 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 179.25 179.15 1wpw h ARG 185 N -0.35 0.92 -0.77 0.00 2.43 -1.12 -1.89 114.38 113.60 1wpw h ARG 185 Ca -0.00 -0.13 0.21 0.00 -0.81 0.00 0.00 59.98 59.25 1wpw h ARG 185 Cb 0.72 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.07 1wpw h ARG 185 CO 0.03 0.73 0.55 0.77 -1.51 0.00 0.00 179.97 180.53 1wpw h SER 186 N 0.88 0.06 0.00 -3.80 0.02 -1.48 -2.33 113.55 106.89 1wpw h SER 186 Ca 0.22 0.01 -0.45 0.00 -0.84 0.00 0.00 61.79 60.73 1wpw h SER 186 Cb 0.11 -0.01 -0.07 0.00 0.14 0.00 0.00 62.40 62.58 1wpw h SER 186 CO -0.03 0.02 -2.51 0.52 -1.14 0.00 0.00 176.83 173.70 1wpw n VAL 187 N -4.34 1.49 0.06 2.27 0.31 -1.04 -4.75 118.33 112.32 1wpw n VAL 187 Ca 0.15 -0.41 -0.21 0.00 -0.01 0.00 0.00 64.34 63.86 1wpw n VAL 187 Cb 0.80 -1.79 -0.15 0.00 -0.91 0.00 0.00 33.84 31.79 1wpw n VAL 187 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1wpw h LEU 188 N -0.81 0.52 -9.60 7.52 -0.00 -1.36 -3.44 115.31 108.14 1wpw h LEU 188 Ca -0.67 -0.93 -0.58 0.00 -0.00 0.00 0.00 57.88 55.70 1wpw h LEU 188 Cb 1.65 -0.17 0.09 0.00 -0.00 0.00 0.00 40.66 42.23 1wpw h LEU 188 CO -0.36 1.50 0.59 1.17 -0.00 0.00 0.00 178.44 181.35 1wpw n LYS 189 N -4.00 2.03 -0.76 1.13 4.81 -0.88 -1.75 118.16 118.73 1wpw n LYS 189 Ca -0.17 0.72 0.00 0.00 -0.87 0.00 0.00 58.31 57.99 1wpw n LYS 189 Cb 0.89 -2.36 0.00 0.00 0.02 0.00 0.00 35.03 33.58 1wpw n LYS 189 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wpw n GLY 190 N 2.01 1.42 0.00 3.14 0.00 -1.26 -4.79 105.19 105.71 1wpw n GLY 190 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1wpw n GLY 190 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wpw n LYS 191 N -2.00 0.66 -4.13 1.61 5.02 -0.72 -5.06 118.16 113.53 1wpw n LYS 191 Ca 0.00 -0.01 -0.11 0.00 -2.02 0.00 0.00 58.31 56.17 1wpw n LYS 191 Cb 0.00 -1.03 -0.08 0.00 -0.02 0.00 0.00 35.03 33.90 1wpw n LYS 191 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1wpw s VAL 192 N -2.07 0.00 -0.30 -0.18 -7.23 -1.17 -5.07 120.40 104.38 1wpw s VAL 192 Ca -0.00 -1.80 -0.29 0.00 -1.81 0.00 0.00 61.98 58.08 1wpw s VAL 192 Cb 0.01 -2.40 -0.02 0.00 0.56 0.00 0.00 36.38 34.52 1wpw s VAL 192 CO 0.04 0.00 1.76 -0.70 -0.31 0.00 0.00 175.10 175.89 1wpw s GLU 193 N -4.09 3.45 -0.03 4.82 2.12 -0.40 -4.81 118.70 119.76 1wpw s GLU 193 Ca 0.33 1.50 0.02 0.00 0.36 0.00 0.00 54.97 57.19 1wpw s GLU 193 Cb 0.04 -4.16 -0.03 0.00 0.26 0.00 0.00 34.13 30.24 1wpw s GLU 193 CO 0.11 -1.71 -0.07 -0.47 -0.54 0.00 0.00 175.26 172.58 1wpw s TYR 194 N 6.45 2.90 0.14 5.30 5.04 -1.26 -1.25 117.35 134.68 1wpw s TYR 194 Ca 0.78 -0.02 -0.18 0.00 -2.44 0.00 0.00 57.07 55.22 1wpw s TYR 194 Cb -0.23 -1.65 0.04 0.00 0.35 0.00 0.00 41.96 40.47 1wpw s TYR 194 CO 0.33 0.35 0.46 -1.54 -1.34 0.00 0.00 175.55 173.81 1wpw s SER 195 N -1.13 -0.31 -0.01 4.32 1.04 -1.03 -5.01 113.70 111.55 1wpw s SER 195 Ca 0.15 -0.27 0.08 0.00 0.48 0.00 0.00 55.95 56.39 1wpw s SER 195 Cb -0.11 0.52 -0.02 0.00 0.10 0.00 0.00 66.02 66.51 1wpw s SER 195 CO 0.05 -0.91 -0.25 -1.61 0.98 0.00 0.00 173.24 171.50 1wpw s GLU 196 N -3.80 2.04 0.05 4.02 2.02 -1.26 -1.41 118.70 120.35 1wpw s GLU 196 Ca 0.03 -0.92 0.03 0.00 0.02 0.00 0.00 54.97 54.13 1wpw s GLU 196 Cb 0.01 -1.99 -0.02 0.00 0.10 0.00 0.00 34.13 32.23 1wpw s GLU 196 CO -0.11 0.54 -0.10 1.41 0.02 0.00 0.00 175.26 177.02 1wpw s MET 197 N -0.65 0.64 0.24 1.61 1.75 -1.04 -4.98 119.30 116.88 1wpw s MET 197 Ca 0.10 -0.76 -0.20 0.00 -1.25 0.00 0.00 55.69 53.58 1wpw s MET 197 Cb -0.10 -0.51 -0.08 0.00 2.84 0.00 0.00 34.83 36.98 1wpw s MET 197 CO -0.01 0.11 0.75 0.71 -0.65 0.00 0.00 175.02 175.93 1wpw s TYR 198 N -1.20 3.63 0.21 4.11 2.02 -1.26 -2.20 117.35 122.66 1wpw s TYR 198 Ca -0.06 1.42 -0.09 0.00 -0.37 0.00 0.00 57.07 57.96 1wpw s TYR 198 Cb -0.09 -2.64 0.28 0.00 -0.40 0.00 0.00 41.96 39.10 1wpw s TYR 198 CO 0.01 0.30 1.75 -0.24 -1.57 0.00 0.00 175.55 175.80 1wpw h VAL 199 N 2.66 0.78 -0.62 0.71 3.04 -0.61 -0.56 116.25 121.66 1wpw h VAL 199 Ca -0.48 -0.14 -0.04 0.00 -1.01 0.00 0.00 66.70 65.03 1wpw h VAL 199 Cb 1.19 0.32 -0.03 0.00 -2.01 0.00 0.00 31.29 30.76 1wpw h VAL 199 CO 0.65 0.08 0.24 -2.24 -1.01 0.00 0.00 177.57 175.29 1wpw h ASP 200 N 0.42 0.83 -0.26 3.17 2.03 -1.94 -1.91 116.42 118.76 1wpw h ASP 200 Ca 0.31 -0.11 -0.06 0.00 -0.73 0.00 0.00 57.03 56.44 1wpw h ASP 200 Cb 0.37 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.65 1wpw h ASP 200 CO -0.30 0.75 -0.06 0.00 -1.03 0.00 0.00 179.24 178.59 1wpw h ALA 201 N 1.37 0.35 -0.57 4.15 0.00 -1.61 -2.72 119.26 120.24 1wpw h ALA 201 Ca 0.21 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.89 1wpw h ALA 201 Cb 0.18 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1wpw h ALA 201 CO -0.02 0.16 0.38 0.00 0.00 0.00 0.00 179.25 179.76 1wpw h ALA 202 N 0.77 1.77 -0.39 0.00 0.00 -1.01 0.47 119.26 120.86 1wpw h ALA 202 Ca 0.07 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1wpw h ALA 202 Cb 0.53 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1wpw h ALA 202 CO 0.03 0.15 -0.10 0.00 0.00 0.00 0.00 179.25 179.33 1wpw h ALA 203 N 1.68 1.09 0.11 0.00 0.00 -1.12 -1.51 119.26 119.52 1wpw h ALA 203 Ca 0.23 -0.30 -0.27 0.00 0.00 0.00 0.00 54.91 54.58 1wpw h ALA 203 Cb 0.18 -0.16 0.03 0.00 0.00 0.00 0.00 17.79 17.83 1wpw h ALA 203 CO -0.07 0.56 -1.11 0.00 0.00 0.00 0.00 179.25 178.63 1wpw h ALA 204 N 1.27 -0.01 -0.21 0.00 0.00 -1.04 -3.34 119.26 115.93 1wpw h ALA 204 Ca 0.11 -0.74 -0.06 0.00 0.00 0.00 0.00 54.91 54.22 1wpw h ALA 204 Cb 0.54 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1wpw h ALA 204 CO 0.03 0.60 -0.15 -0.91 0.00 0.00 0.00 179.25 178.82 1wpw h ASN 205 N 0.15 0.34 -0.25 0.00 2.35 -0.00 -1.97 115.58 116.19 1wpw h ASN 205 Ca -0.17 -0.08 0.06 0.00 -0.55 0.00 0.00 56.30 55.56 1wpw h ASN 205 Cb 1.81 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 40.08 1wpw h ASN 205 CO 0.21 0.52 0.17 -0.07 -1.65 0.00 0.00 177.43 176.62 1wpw h LEU 206 N 0.33 0.05 0.18 1.61 3.38 -1.39 -0.50 115.31 118.97 1wpw h LEU 206 Ca 0.06 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.69 1wpw h LEU 206 Cb 0.47 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.22 1wpw h LEU 206 CO 0.03 0.03 -1.69 0.58 0.09 0.00 0.00 178.44 177.48 1wpw h VAL 207 N 0.05 0.97 0.14 1.22 2.07 -1.53 -3.22 116.25 115.94 1wpw h VAL 207 Ca 0.11 -2.50 -0.01 0.00 0.82 0.00 0.00 66.70 65.12 1wpw h VAL 207 Cb 0.39 2.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.94 1wpw h VAL 207 CO -0.01 0.84 -0.07 -0.09 0.02 0.00 0.00 177.57 178.26 1wpw h ARG 208 N 0.05 -0.18 -1.09 1.57 2.43 -1.04 -3.43 114.38 112.69 1wpw h ARG 208 Ca -0.34 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 58.77 1wpw h ARG 208 Cb 2.06 0.04 -0.20 0.00 -0.42 0.00 0.00 29.97 31.44 1wpw h ARG 208 CO 0.17 0.27 -0.46 0.54 -1.51 0.00 0.00 179.97 178.98 1wpw s ASN 209 N -5.49 -1.30 0.00 -3.80 4.22 -0.22 -5.01 114.94 103.34 1wpw s ASN 209 Ca -0.14 -0.68 0.11 0.00 -2.14 0.00 0.00 52.86 50.00 1wpw s ASN 209 Cb 0.01 1.85 0.46 0.00 1.28 0.00 0.00 41.25 44.85 1wpw s ASN 209 CO 0.56 -0.20 1.34 -0.81 -2.04 0.00 0.00 177.10 175.94 1wpw n PRO 210 N 4.58 0.01 0.00 3.55 -0.04 -1.20 -2.66 135.00 139.24 1wpw n PRO 210 Ca 0.10 0.31 0.12 0.00 -0.04 0.00 0.00 63.50 63.98 1wpw n PRO 210 Cb 0.55 -1.50 0.58 0.00 -0.04 0.00 0.00 33.50 33.09 1wpw n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wpw n GLN 211 N -1.49 0.26 0.14 0.54 0.00 -1.26 -2.54 117.38 113.03 1wpw n GLN 211 Ca 0.03 0.07 0.13 0.00 0.00 0.00 0.00 57.00 57.23 1wpw n GLN 211 Cb 0.12 -1.50 0.39 0.00 0.00 0.00 0.00 30.24 29.25 1wpw n GLN 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1wpw h MET 212 N 0.00 0.00 -5.83 2.61 -0.00 -1.89 -3.45 114.93 106.37 1wpw h MET 212 Ca 0.00 0.00 -0.63 0.00 -0.00 0.00 0.00 59.70 59.07 1wpw h MET 212 Cb 0.26 0.00 -0.05 0.00 -0.00 0.00 0.00 31.60 31.81 1wpw h MET 212 CO 0.00 0.00 -0.49 -0.06 -0.00 0.00 0.00 176.91 176.36 1wpw s PHE 213 N -3.18 3.54 0.00 -0.10 0.08 -1.05 -5.04 117.98 112.24 1wpw s PHE 213 Ca 0.09 0.34 0.00 0.00 0.12 0.00 0.00 56.93 57.48 1wpw s PHE 213 Cb 0.10 -1.82 0.00 0.00 -0.57 0.00 0.00 43.02 40.73 1wpw s PHE 213 CO 0.58 0.63 0.00 -3.47 -0.10 0.00 0.00 175.22 172.86 1wpw n ASP 214 N 0.81 0.00 -4.69 1.36 2.03 -1.26 -4.57 116.55 110.23 1wpw n ASP 214 Ca -0.10 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 54.88 1wpw n ASP 214 Cb 0.52 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.83 1wpw n ASP 214 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1wpw s VAL 215 N 0.00 4.23 -0.10 5.18 1.01 -0.77 -0.83 120.40 129.13 1wpw s VAL 215 Ca 0.00 -0.49 0.02 0.00 0.00 0.00 0.00 61.98 61.51 1wpw s VAL 215 Cb 0.00 -2.86 0.01 0.00 0.00 0.00 0.00 36.38 33.53 1wpw s VAL 215 CO 0.00 0.44 -0.16 -0.63 0.00 0.00 0.00 175.10 174.75 1wpw s ILE 216 N -1.04 1.53 -0.19 2.22 1.01 -0.24 -1.38 121.20 123.12 1wpw s ILE 216 Ca 0.18 -0.68 -0.03 0.00 0.00 0.00 0.00 60.65 60.12 1wpw s ILE 216 Cb -0.11 -1.38 -0.01 0.00 0.01 0.00 0.00 42.46 40.97 1wpw s ILE 216 CO 0.08 0.44 -0.07 -0.69 0.00 0.00 0.00 174.94 174.71 1wpw s VAL 217 N 0.78 3.35 0.36 2.92 1.01 -0.75 -0.22 120.40 127.85 1wpw s VAL 217 Ca -0.11 -0.52 -0.00 0.00 0.00 0.00 0.00 61.98 61.34 1wpw s VAL 217 Cb -0.16 -2.49 0.00 0.00 0.00 0.00 0.00 36.38 33.74 1wpw s VAL 217 CO 0.02 0.46 0.48 0.28 0.00 0.00 0.00 175.10 176.33 1wpw s THR 218 N 1.05 0.00 0.66 3.92 -1.32 -0.88 -1.38 115.64 117.69 1wpw s THR 218 Ca 0.00 -1.63 -0.06 0.00 -1.21 0.00 0.00 61.69 58.79 1wpw s THR 218 Cb -0.15 -2.68 0.04 0.00 -1.51 0.00 0.00 72.50 68.20 1wpw s THR 218 CO -0.00 0.00 0.97 -1.61 -2.21 0.00 0.00 174.62 171.77 1wpw s GLU 219 N -2.92 2.50 0.18 7.08 2.02 -1.26 -2.31 118.70 123.99 1wpw s GLU 219 Ca 0.32 -0.14 -0.27 0.00 0.02 0.00 0.00 54.97 54.91 1wpw s GLU 219 Cb -0.01 -2.20 0.03 0.00 0.10 0.00 0.00 34.13 32.05 1wpw s GLU 219 CO 0.23 -1.02 1.55 -0.97 0.02 0.00 0.00 175.26 175.06 1wpw h ASN 220 N -0.44 -1.80 0.27 -0.19 -0.73 -1.71 -0.97 115.58 110.01 1wpw h ASN 220 Ca -0.45 0.30 -0.01 0.00 1.87 0.00 0.00 56.30 58.01 1wpw h ASN 220 Cb 1.29 0.82 0.00 0.00 0.27 0.00 0.00 38.32 40.71 1wpw h ASN 220 CO 0.60 -0.29 -0.13 0.58 -0.37 0.00 0.00 177.43 177.83 1wpw h VAL 221 N -0.10 0.33 -0.98 2.57 2.07 -1.91 -2.42 116.25 115.82 1wpw h VAL 221 Ca 0.20 -0.85 0.23 0.00 0.82 0.00 0.00 66.70 67.10 1wpw h VAL 221 Cb 0.51 0.56 -0.08 0.00 -1.52 0.00 0.00 31.29 30.76 1wpw h VAL 221 CO -0.86 0.09 0.64 1.88 0.02 0.00 0.00 177.57 179.34 1wpw h TYR 222 N -1.02 0.63 0.00 1.57 0.05 -1.96 0.31 116.97 116.54 1wpw h TYR 222 Ca -0.04 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.69 1wpw h TYR 222 Cb 0.42 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.97 1wpw h TYR 222 CO 0.03 0.11 -0.36 0.78 -1.05 0.00 0.00 178.16 177.68 1wpw h GLY 223 N 0.43 0.00 1.04 3.88 0.00 -1.19 -1.48 103.07 105.75 1wpw h GLY 223 Ca 0.54 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.73 1wpw h GLY 223 CO -0.24 0.00 -0.36 -1.80 0.00 0.00 0.00 176.54 174.14 1wpw h ASP 224 N 0.00 0.86 0.14 0.19 3.58 0.13 -2.40 116.42 118.92 1wpw h ASP 224 Ca -0.00 -0.48 -0.01 0.00 0.42 0.00 0.00 57.03 56.96 1wpw h ASP 224 Cb 0.93 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.73 1wpw h ASP 224 CO 0.05 1.17 -0.07 0.40 -2.88 0.00 0.00 179.24 177.91 1wpw h ILE 225 N 0.57 0.73 -0.65 2.25 2.04 -1.40 -3.33 117.51 117.72 1wpw h ILE 225 Ca 0.04 -1.21 0.07 0.00 1.00 0.00 0.00 64.86 64.76 1wpw h ILE 225 Cb 0.95 1.27 -0.04 0.00 -0.74 0.00 0.00 36.82 38.26 1wpw h ILE 225 CO 0.09 0.21 0.43 -0.07 0.00 0.00 0.00 178.15 178.81 1wpw h LEU 226 N -0.94 0.56 0.25 1.44 3.38 -1.36 -2.92 115.31 115.72 1wpw h LEU 226 Ca -0.02 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1wpw h LEU 226 Cb 0.48 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1wpw h LEU 226 CO 0.03 0.36 -0.33 0.28 0.09 0.00 0.00 178.44 178.87 1wpw h SER 227 N 0.63 -0.92 -0.89 -0.43 0.02 -1.56 -1.19 113.55 109.22 1wpw h SER 227 Ca 0.29 0.09 0.02 0.00 -0.84 0.00 0.00 61.79 61.35 1wpw h SER 227 Cb 0.31 0.32 -0.05 0.00 0.14 0.00 0.00 62.40 63.13 1wpw h SER 227 CO -0.09 -0.45 0.58 0.44 -1.14 0.00 0.00 176.83 176.17 1wpw h ASP 228 N -0.64 0.99 -0.06 3.07 5.19 -1.62 -1.13 116.42 122.22 1wpw h ASP 228 Ca -0.00 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.39 1wpw h ASP 228 Cb 0.61 -0.24 -0.00 0.00 0.18 0.00 0.00 39.33 39.88 1wpw h ASP 228 CO -0.11 0.70 0.03 -0.08 -3.12 0.00 0.00 179.24 176.66 1wpw h GLU 229 N 1.16 0.08 -0.57 3.56 4.81 -1.44 -2.17 114.58 120.01 1wpw h GLU 229 Ca 0.34 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.58 1wpw h GLU 229 Cb -0.07 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 1wpw h GLU 229 CO -0.09 0.08 0.35 0.00 -0.73 0.00 0.00 179.01 178.62 1wpw h ALA 230 N 0.99 0.73 -0.54 2.92 0.00 -0.68 -2.01 119.26 120.67 1wpw h ALA 230 Ca 0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1wpw h ALA 230 Cb 0.02 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1wpw h ALA 230 CO -0.00 0.09 0.28 0.77 0.00 0.00 0.00 179.25 180.38 1wpw h SER 231 N 0.70 0.70 -0.42 0.00 0.02 -1.10 -2.04 113.55 111.40 1wpw h SER 231 Ca 0.22 -0.11 -0.07 0.00 -0.84 0.00 0.00 61.79 60.99 1wpw h SER 231 Cb -0.01 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.33 1wpw h SER 231 CO -0.08 0.61 0.02 -0.61 -1.14 0.00 0.00 176.83 175.63 1wpw h GLN 232 N 0.73 0.81 -0.13 3.45 5.75 -1.07 -2.58 115.11 122.07 1wpw h GLN 232 Ca 0.19 -0.21 -0.01 0.00 -0.15 0.00 0.00 58.65 58.46 1wpw h GLN 232 Cb 0.09 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 1wpw h GLN 232 CO -0.03 0.80 0.03 0.82 -2.65 0.00 0.00 178.83 177.80 1wpw h ILE 233 N 0.76 1.21 0.00 2.39 2.04 -1.15 -2.30 117.51 120.46 1wpw h ILE 233 Ca 0.15 -0.65 0.00 0.00 1.00 0.00 0.00 64.86 65.36 1wpw h ILE 233 Cb 0.43 1.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 1wpw h ILE 233 CO 0.02 0.19 0.11 0.00 0.00 0.00 0.00 178.15 178.47 1wpw h ALA 234 N 0.82 1.10 0.00 1.87 0.00 -1.20 -3.46 119.26 118.39 1wpw h ALA 234 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1wpw h ALA 234 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1wpw h ALA 234 CO 0.00 -0.10 0.00 0.41 0.00 0.00 0.00 179.25 179.56 1wpw n GLY 235 N -1.19 0.25 3.36 0.00 0.00 -0.87 -3.27 105.19 103.47 1wpw n GLY 235 Ca -0.02 0.13 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 1wpw n GLY 235 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wpw s SER 236 N 0.00 -0.46 0.33 1.61 0.15 -1.16 -4.85 113.70 109.32 1wpw s SER 236 Ca 0.00 0.83 0.17 0.00 0.70 0.00 0.00 55.95 57.65 1wpw s SER 236 Cb 0.00 0.86 0.42 0.00 -1.71 0.00 0.00 66.02 65.59 1wpw s SER 236 CO 0.00 -0.22 1.61 0.25 1.20 0.00 0.00 173.24 176.08 1wpw h LEU 237 N 5.10 0.00 0.00 3.45 5.85 -1.88 -3.07 115.31 124.76 1wpw h LEU 237 Ca -0.27 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.45 1wpw h LEU 237 Cb 1.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1wpw h LEU 237 CO 0.24 0.46 0.00 0.61 -0.34 0.00 0.00 178.44 179.41 1wpw n GLY 238 N 0.64 -1.02 0.41 3.75 0.00 -1.26 -2.70 105.19 105.01 1wpw n GLY 238 Ca 0.01 -0.19 0.05 0.00 0.00 0.00 0.00 46.02 45.89 1wpw n GLY 238 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wpw n ILE 239 N -1.05 0.02 -2.86 -0.61 -0.00 -1.16 -4.54 119.36 109.17 1wpw n ILE 239 Ca 0.22 -0.51 -0.41 0.00 -0.00 0.00 0.00 62.75 62.04 1wpw n ILE 239 Cb 0.13 1.19 -0.04 0.00 -0.00 0.00 0.00 39.64 40.93 1wpw n ILE 239 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1wpw s ALA 240 N -0.85 3.34 0.47 -1.39 0.00 -1.10 -4.01 121.76 118.22 1wpw s ALA 240 Ca 0.12 0.26 -0.07 0.00 0.00 0.00 0.00 51.96 52.27 1wpw s ALA 240 Cb 0.09 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.96 1wpw s ALA 240 CO 0.13 -0.35 0.81 -1.25 0.00 0.00 0.00 175.76 175.10 1wpw s PRO 241 N 1.36 3.61 0.02 0.00 0.04 -1.26 -1.78 135.00 136.99 1wpw s PRO 241 Ca 0.43 0.33 -0.10 0.00 0.04 0.00 0.00 61.00 61.70 1wpw s PRO 241 Cb -0.18 -2.35 0.01 0.00 0.04 0.00 0.00 34.50 32.01 1wpw s PRO 241 CO 0.20 -0.20 0.21 0.45 0.04 0.00 0.00 177.00 177.70 1wpw s SER 242 N -3.85 -0.02 0.02 6.66 0.15 -0.04 -4.50 113.70 112.12 1wpw s SER 242 Ca 0.49 -0.21 -0.06 0.00 0.70 0.00 0.00 55.95 56.87 1wpw s SER 242 Cb -0.10 0.27 -0.01 0.00 -1.71 0.00 0.00 66.02 64.47 1wpw s SER 242 CO 0.42 -0.48 0.10 0.00 1.20 0.00 0.00 173.24 174.49 1wpw s ALA 243 N -1.92 -0.15 -0.27 5.45 0.00 -1.00 -1.57 121.76 122.30 1wpw s ALA 243 Ca -0.10 -0.39 -0.01 0.00 0.00 0.00 0.00 51.96 51.46 1wpw s ALA 243 Cb -0.04 0.19 0.08 0.00 0.00 0.00 0.00 23.12 23.35 1wpw s ALA 243 CO -0.00 -0.26 0.05 -0.80 0.00 0.00 0.00 175.76 174.75 1wpw s ASN 244 N -1.78 3.79 -0.18 0.00 0.01 0.33 -0.97 114.94 116.14 1wpw s ASN 244 Ca -0.10 -1.41 -0.09 0.00 -0.71 0.00 0.00 52.86 50.56 1wpw s ASN 244 Cb -0.04 -0.91 -0.05 0.00 0.41 0.00 0.00 41.25 40.66 1wpw s ASN 244 CO -0.02 -0.36 0.12 -0.63 -1.51 0.00 0.00 177.10 174.71 1wpw s ILE 245 N 1.59 5.33 0.46 0.60 1.01 0.70 -0.50 121.20 130.38 1wpw s ILE 245 Ca 0.05 0.16 0.00 0.00 0.00 0.00 0.00 60.65 60.85 1wpw s ILE 245 Cb -0.18 -3.40 0.00 0.00 0.01 0.00 0.00 42.46 38.89 1wpw s ILE 245 CO -0.17 0.48 0.01 0.61 0.00 0.00 0.00 174.94 175.88 1wpw n GLY 246 N 3.18 3.60 0.18 6.18 0.00 -0.36 -2.53 105.19 115.44 1wpw n GLY 246 Ca -0.17 -2.35 -0.11 0.00 0.00 0.00 0.00 46.02 43.38 1wpw n GLY 246 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1wpw h ASP 247 N 1.07 0.56 -0.00 1.61 3.32 -1.87 -3.36 116.42 117.75 1wpw h ASP 247 Ca -0.37 -0.35 0.00 0.00 0.02 0.00 0.00 57.03 56.32 1wpw h ASP 247 Cb 1.14 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.54 1wpw h ASP 247 CO 0.62 0.78 -0.30 0.29 -1.72 0.00 0.00 179.24 178.91 1wpw n LYS 248 N -4.51 3.75 -3.80 3.56 5.02 -1.26 -5.01 118.16 115.91 1wpw n LYS 248 Ca -0.03 -0.17 -0.13 0.00 -2.02 0.00 0.00 58.31 55.96 1wpw n LYS 248 Cb 0.30 -0.91 -0.13 0.00 -0.02 0.00 0.00 35.03 34.27 1wpw n LYS 248 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1wpw s LYS 249 N -1.55 0.17 0.21 1.97 2.20 -1.26 -4.89 119.74 116.58 1wpw s LYS 249 Ca 0.04 0.26 0.09 0.00 -0.36 0.00 0.00 55.97 56.00 1wpw s LYS 249 Cb 0.06 0.04 -0.05 0.00 -1.51 0.00 0.00 37.83 36.37 1wpw s LYS 249 CO 0.28 -0.05 -0.18 0.00 -0.36 0.00 0.00 175.35 175.04 1wpw s ALA 250 N 0.31 2.20 -0.05 3.13 0.00 -1.21 -1.22 121.76 124.93 1wpw s ALA 250 Ca -0.02 -1.65 0.01 0.00 0.00 0.00 0.00 51.96 50.31 1wpw s ALA 250 Cb -0.03 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.94 1wpw s ALA 250 CO -0.01 0.19 -0.07 -1.17 0.00 0.00 0.00 175.76 174.71 1wpw s LEU 251 N -3.09 1.39 -0.09 0.00 0.20 0.34 -0.96 118.68 116.46 1wpw s LEU 251 Ca 0.22 -0.18 0.04 0.00 0.69 0.00 0.00 54.13 54.90 1wpw s LEU 251 Cb -0.04 -0.56 -0.00 0.00 -0.43 0.00 0.00 46.19 45.15 1wpw s LEU 251 CO 0.09 -0.04 -0.23 -0.36 -0.29 0.00 0.00 176.35 175.52 1wpw s PHE 252 N 0.90 2.55 0.21 5.38 0.08 -0.27 -0.52 117.98 126.31 1wpw s PHE 252 Ca -0.11 -0.90 -0.19 0.00 0.12 0.00 0.00 56.93 55.85 1wpw s PHE 252 Cb -0.15 -1.69 0.03 0.00 -0.57 0.00 0.00 43.02 40.65 1wpw s PHE 252 CO 0.01 -0.33 0.57 -1.83 -0.10 0.00 0.00 175.22 173.53 1wpw s GLU 253 N 0.17 1.45 0.51 0.44 -1.05 -0.61 -2.08 118.70 117.52 1wpw s GLU 253 Ca -0.13 -0.85 -0.08 0.00 -0.15 0.00 0.00 54.97 53.75 1wpw s GLU 253 Cb -0.16 0.54 -0.04 0.00 -0.44 0.00 0.00 34.13 34.03 1wpw s GLU 253 CO 0.07 -0.63 0.86 -1.25 0.95 0.00 0.00 175.26 175.26 1wpw s PRO 254 N -3.87 3.61 0.13 -4.83 0.04 -1.26 -0.86 135.00 127.96 1wpw s PRO 254 Ca 0.09 0.43 0.06 0.00 0.04 0.00 0.00 61.00 61.62 1wpw s PRO 254 Cb -0.02 -2.28 -0.17 0.00 0.04 0.00 0.00 34.50 32.07 1wpw s PRO 254 CO -0.02 -0.29 1.30 0.28 0.04 0.00 0.00 177.00 178.31 1wpw h VAL 255 N 0.23 1.68 -4.14 -0.36 2.07 -1.65 -3.45 116.25 110.63 1wpw h VAL 255 Ca -0.46 -3.29 -0.51 0.00 0.82 0.00 0.00 66.70 63.26 1wpw h VAL 255 Cb 1.20 2.80 0.10 0.00 -1.52 0.00 0.00 31.29 33.86 1wpw h VAL 255 CO 0.62 0.94 0.41 -1.38 0.02 0.00 0.00 177.57 178.18 1wpw s HIS 256 N -2.78 2.54 0.06 1.57 -3.43 -1.26 -5.04 115.29 106.94 1wpw s HIS 256 Ca 0.00 1.55 -0.01 0.00 -0.80 0.00 0.00 55.06 55.80 1wpw s HIS 256 Cb 0.10 -3.29 0.01 0.00 -1.43 0.00 0.00 32.58 27.97 1wpw s HIS 256 CO 0.82 -1.83 0.08 0.41 -2.00 0.00 0.00 174.74 172.22 1wpw n GLY 257 N -0.03 -1.29 0.24 -1.38 0.00 -1.26 -4.70 105.19 96.76 1wpw n GLY 257 Ca 0.12 -1.65 0.10 0.00 0.00 0.00 0.00 46.02 44.59 1wpw n GLY 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wpw h ALA 258 N -1.99 1.24 -6.05 4.61 0.00 -1.86 -3.45 119.26 111.75 1wpw h ALA 258 Ca -0.03 -0.18 -0.28 0.00 0.00 0.00 0.00 54.91 54.42 1wpw h ALA 258 Cb 0.07 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 17.86 1wpw h ALA 258 CO 0.02 0.25 -0.63 0.00 0.00 0.00 0.00 179.25 178.89 1wpw n ALA 259 N -2.31 -2.62 0.26 0.00 0.00 -1.26 -1.54 120.51 113.05 1wpw n ALA 259 Ca -0.01 -0.15 0.14 0.00 0.00 0.00 0.00 53.44 53.41 1wpw n ALA 259 Cb 0.32 -2.02 0.68 0.00 0.00 0.00 0.00 19.45 18.43 1wpw n ALA 259 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1wpw h PHE 260 N -0.42 0.00 -0.04 0.00 0.04 -1.94 -2.74 116.94 111.83 1wpw h PHE 260 Ca -0.40 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.31 1wpw h PHE 260 Cb 1.23 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.37 1wpw h PHE 260 CO 0.25 0.12 -0.29 0.38 -0.60 0.00 0.00 178.31 178.17 1wpw h ASP 261 N 0.00 0.08 -0.01 2.17 2.03 -2.01 -3.14 116.42 115.53 1wpw h ASP 261 Ca -0.00 -0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.28 1wpw h ASP 261 Cb 0.46 -0.02 0.00 0.00 -0.83 0.00 0.00 39.33 38.94 1wpw h ASP 261 CO 0.02 0.37 -0.17 2.30 -1.03 0.00 0.00 179.24 180.73 1wpw n ILE 262 N -4.17 0.00 -1.69 4.15 -5.35 -1.14 -4.99 119.36 106.17 1wpw n ILE 262 Ca -0.02 -0.42 -0.44 0.00 -0.27 0.00 0.00 62.75 61.60 1wpw n ILE 262 Cb 0.35 1.17 -0.03 0.00 -1.74 0.00 0.00 39.64 39.39 1wpw n ILE 262 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1wpw n ALA 263 N 0.06 1.87 0.00 -1.28 0.00 -1.05 -2.05 120.51 118.06 1wpw n ALA 263 Ca 0.06 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1wpw n ALA 263 Cb 0.26 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.31 1wpw n ALA 263 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wpw n GLY 264 N 3.31 2.14 0.06 0.00 0.00 -1.26 -4.89 105.19 104.55 1wpw n GLY 264 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.28 1wpw n GLY 264 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wpw n LYS 265 N -2.00 1.08 -3.90 1.61 5.02 -0.87 -4.93 118.16 114.17 1wpw n LYS 265 Ca 0.00 -0.12 -0.29 0.00 -2.02 0.00 0.00 58.31 55.87 1wpw n LYS 265 Cb 0.00 -1.35 0.02 0.00 -0.02 0.00 0.00 35.03 33.69 1wpw n LYS 265 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1wpw n ASN 266 N -0.71 -4.30 0.00 4.39 5.15 -1.26 -4.87 115.26 113.66 1wpw n ASN 266 Ca 0.16 -0.79 0.00 0.00 -0.60 0.00 0.00 54.58 53.35 1wpw n ASN 266 Cb 0.11 -3.86 0.00 0.00 -0.53 0.00 0.00 39.78 35.49 1wpw n ASN 266 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1wpw n ILE 267 N -4.63 0.14 -1.92 -1.44 -5.35 -1.26 -2.16 119.36 102.73 1wpw n ILE 267 Ca -0.00 -0.25 -0.40 0.00 -0.27 0.00 0.00 62.75 61.83 1wpw n ILE 267 Cb 0.54 1.32 -0.00 0.00 -1.74 0.00 0.00 39.64 39.76 1wpw n ILE 267 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1wpw s GLY 268 N -0.14 2.95 -0.40 3.28 0.00 -1.26 -4.56 107.32 107.18 1wpw s GLY 268 Ca 0.00 1.41 -0.25 0.00 0.00 0.00 0.00 44.72 45.88 1wpw s GLY 268 CO 0.00 2.05 0.88 0.21 0.00 0.00 0.00 173.10 176.23 1wpw s ASN 269 N -0.43 6.57 0.00 1.64 3.04 -1.26 -4.48 114.94 120.01 1wpw s ASN 269 Ca 0.55 0.32 0.13 0.00 0.04 0.00 0.00 52.86 53.89 1wpw s ASN 269 Cb -0.43 -2.44 0.75 0.00 -1.54 0.00 0.00 41.25 37.60 1wpw s ASN 269 CO 0.56 -0.89 1.33 -0.81 -3.04 0.00 0.00 177.10 174.26 1wpw n PRO 270 N 6.80 0.81 -0.04 0.43 -0.04 -1.26 -4.24 135.00 137.45 1wpw n PRO 270 Ca 0.05 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.40 1wpw n PRO 270 Cb 0.48 -1.24 -0.06 0.00 -0.04 0.00 0.00 33.50 32.64 1wpw n PRO 270 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1wpw h THR 271 N 0.00 1.22 -0.34 0.52 2.02 -1.92 -2.10 112.91 112.31 1wpw h THR 271 Ca 0.00 -0.70 0.05 0.00 0.77 0.00 0.00 66.41 66.53 1wpw h THR 271 Cb 0.00 1.43 -0.05 0.00 -1.74 0.00 0.00 68.15 67.79 1wpw h THR 271 CO 0.00 0.21 0.05 0.00 0.37 0.00 0.00 175.52 176.15 1wpw h ALA 272 N 0.80 0.35 -0.28 6.16 0.00 -1.74 -0.77 119.26 123.79 1wpw h ALA 272 Ca 0.04 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1wpw h ALA 272 Cb 0.30 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1wpw h ALA 272 CO 0.00 -0.35 0.03 0.35 0.00 0.00 0.00 179.25 179.28 1wpw h PHE 273 N 0.17 0.04 -0.10 0.00 3.57 -1.82 -2.30 116.94 116.50 1wpw h PHE 273 Ca 0.16 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.60 1wpw h PHE 273 Cb 0.19 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1wpw h PHE 273 CO -0.20 -0.01 -0.32 -0.07 -2.23 0.00 0.00 178.31 175.48 1wpw h LEU 274 N 0.12 0.20 -0.59 0.59 4.07 -0.90 -1.73 115.31 117.07 1wpw h LEU 274 Ca 0.13 -0.07 -0.07 0.00 0.08 0.00 0.00 57.88 57.95 1wpw h LEU 274 Cb 0.16 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 41.83 1wpw h LEU 274 CO -0.20 0.52 -0.36 -0.07 -1.08 0.00 0.00 178.44 177.26 1wpw h LEU 275 N 0.18 0.00 -0.82 1.67 3.38 -0.96 -2.65 115.31 116.11 1wpw h LEU 275 Ca 0.02 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1wpw h LEU 275 Cb 0.66 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1wpw h LEU 275 CO 0.05 0.36 -0.30 0.77 0.09 0.00 0.00 178.44 179.41 1wpw h SER 276 N 0.00 0.00 0.43 -0.43 4.64 -0.75 -2.76 113.55 114.68 1wpw h SER 276 Ca -0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.14 1wpw h SER 276 Cb 1.04 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.12 1wpw h SER 276 CO 0.05 0.30 -0.74 0.58 -0.87 0.00 0.00 176.83 176.15 1wpw h VAL 277 N 0.00 1.43 -0.26 0.95 2.07 -1.16 -1.54 116.25 117.74 1wpw h VAL 277 Ca -0.00 -2.27 -0.05 0.00 0.82 0.00 0.00 66.70 65.20 1wpw h VAL 277 Cb 0.91 2.21 -0.01 0.00 -1.52 0.00 0.00 31.29 32.88 1wpw h VAL 277 CO 0.04 0.67 -0.06 -1.28 0.02 0.00 0.00 177.57 176.96 1wpw h SER 278 N 0.17 0.38 0.00 0.57 0.87 -1.23 -1.00 113.55 113.30 1wpw h SER 278 Ca -0.03 -0.07 -0.16 0.00 -1.23 0.00 0.00 61.79 60.30 1wpw h SER 278 Cb 1.31 -0.10 0.01 0.00 -0.44 0.00 0.00 62.40 63.18 1wpw h SER 278 CO 0.12 0.48 -0.64 0.24 -0.53 0.00 0.00 176.83 176.50 1wpw h MET 279 N 0.38 0.43 -0.90 2.24 2.86 -1.28 -2.92 114.93 115.74 1wpw h MET 279 Ca 0.08 -0.47 0.15 0.00 -2.06 0.00 0.00 59.70 57.41 1wpw h MET 279 Cb 0.35 0.13 -0.10 0.00 0.06 0.00 0.00 31.60 32.04 1wpw h MET 279 CO 0.02 1.13 0.49 1.98 1.06 0.00 0.00 176.91 181.58 1wpw h MET 280 N -0.08 0.67 -0.45 1.72 -1.53 -0.97 -0.19 114.93 114.11 1wpw h MET 280 Ca -0.08 -0.04 -0.03 0.00 -3.44 0.00 0.00 59.70 56.11 1wpw h MET 280 Cb 1.35 -0.15 -0.02 0.00 -0.55 0.00 0.00 31.60 32.23 1wpw h MET 280 CO 0.13 0.44 0.16 1.88 0.14 0.00 0.00 176.91 179.66 1wpw h TYR 281 N 0.69 0.70 -0.37 1.39 0.05 -1.19 -2.22 116.97 116.02 1wpw h TYR 281 Ca 0.49 -0.06 0.08 0.00 0.05 0.00 0.00 58.73 59.29 1wpw h TYR 281 Cb 0.70 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 38.21 1wpw h TYR 281 CO -0.06 0.62 0.25 1.49 -1.05 0.00 0.00 178.16 179.41 1wpw h GLU 282 N 0.58 0.15 0.00 4.88 4.81 -0.91 -0.71 114.58 123.38 1wpw h GLU 282 Ca 0.15 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.28 1wpw h GLU 282 Cb 0.23 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1wpw h GLU 282 CO -0.01 0.10 -0.40 -0.09 -0.73 0.00 0.00 179.01 177.88 1wpw h ARG 283 N 0.16 0.00 0.00 1.92 9.65 -0.53 -2.68 114.38 122.89 1wpw h ARG 283 Ca 0.17 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.05 1wpw h ARG 283 Cb 0.46 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.04 1wpw h ARG 283 CO -0.02 0.40 0.00 -1.33 2.80 0.00 0.00 179.97 181.82 1wpw n MET 284 N -3.25 0.22 0.03 0.20 2.81 -0.31 -2.93 117.12 113.90 1wpw n MET 284 Ca 0.02 0.22 -0.03 0.00 -1.81 0.00 0.00 57.70 56.10 1wpw n MET 284 Cb 0.66 -1.78 -0.09 0.00 -0.71 0.00 0.00 33.22 31.30 1wpw n MET 284 CO 0.00 0.00 0.00 -0.92 1.51 0.00 0.00 175.97 176.56 1wpw h TYR 285 N 0.00 0.00 0.00 2.03 3.20 -1.12 -3.03 116.97 118.05 1wpw h TYR 285 Ca 0.00 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1wpw h TYR 285 Cb 0.65 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.92 1wpw h TYR 285 CO 0.00 0.75 -0.10 0.93 -1.64 0.00 0.00 178.16 178.10 1wpw h GLU 286 N 0.00 0.00 0.00 1.82 5.08 -1.49 0.16 114.58 120.15 1wpw h GLU 286 Ca -0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1wpw h GLU 286 Cb 1.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.97 1wpw h GLU 286 CO 0.07 0.10 -1.02 1.28 -1.00 0.00 0.00 179.01 178.45 1wpw n LEU 287 N -3.14 0.85 0.00 1.33 4.77 -1.15 -4.53 117.00 115.14 1wpw n LEU 287 Ca 0.03 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.55 1wpw n LEU 287 Cb 0.54 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1wpw n LEU 287 CO 0.34 0.21 -0.30 -0.24 -1.33 0.00 0.00 177.39 176.08 1wpw n SER 288 N -1.53 2.96 0.00 -1.43 2.88 -1.14 -5.00 113.62 110.36 1wpw n SER 288 Ca 0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1wpw n SER 288 Cb 0.33 0.32 0.00 0.00 -0.75 0.00 0.00 64.21 64.11 1wpw n SER 288 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1wpw n ASN 289 N -1.34 -2.16 -4.59 -3.46 5.15 0.04 -4.92 115.26 103.97 1wpw n ASN 289 Ca 0.00 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.55 1wpw n ASN 289 Cb 0.27 -2.65 -0.02 0.00 -0.53 0.00 0.00 39.78 36.84 1wpw n ASN 289 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1wpw s ASP 290 N -2.05 6.55 0.00 1.20 2.15 -1.26 -4.87 116.67 118.39 1wpw s ASP 290 Ca 0.00 0.32 0.04 0.00 0.43 0.00 0.00 52.55 53.34 1wpw s ASP 290 Cb 0.00 -2.55 0.22 0.00 -0.30 0.00 0.00 42.92 40.28 1wpw s ASP 290 CO 0.00 -1.35 0.56 -0.90 -0.17 0.00 0.00 175.17 173.31 1wpw n ASP 291 N 8.12 0.00 -0.11 -0.34 5.68 -1.26 -2.87 116.55 125.76 1wpw n ASP 291 Ca 0.11 -0.45 0.00 0.00 -0.50 0.00 0.00 54.79 53.95 1wpw n ASP 291 Cb 0.49 0.00 0.27 0.00 -1.14 0.00 0.00 41.12 40.74 1wpw n ASP 291 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1wpw h ARG 292 N 0.00 0.78 0.11 0.11 2.43 -1.95 -2.55 114.38 113.30 1wpw h ARG 292 Ca 0.00 -0.09 -0.28 0.00 -0.81 0.00 0.00 59.98 58.80 1wpw h ARG 292 Cb 0.00 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 1wpw h ARG 292 CO 0.00 0.60 -1.33 1.88 -1.51 0.00 0.00 179.97 179.62 1wpw h TYR 293 N 0.78 0.41 -0.66 2.20 0.05 -1.85 -3.20 116.97 114.70 1wpw h TYR 293 Ca 0.19 -0.30 -0.00 0.00 0.05 0.00 0.00 58.73 58.67 1wpw h TYR 293 Cb 0.08 -0.02 -0.03 0.00 1.01 0.00 0.00 36.73 37.77 1wpw h TYR 293 CO 0.01 1.27 0.39 0.97 -1.05 0.00 0.00 178.16 179.75 1wpw h ILE 294 N 0.06 1.19 -0.64 -2.88 -0.00 -1.73 -1.89 117.51 111.61 1wpw h ILE 294 Ca -0.16 -0.41 -0.07 0.00 -0.00 0.00 0.00 64.86 64.22 1wpw h ILE 294 Cb 1.97 0.26 -0.03 0.00 -0.00 0.00 0.00 36.82 39.02 1wpw h ILE 294 CO 0.18 0.20 0.13 0.11 -0.00 0.00 0.00 178.15 178.76 1wpw h LYS 295 N 0.90 1.05 -0.15 2.19 1.57 -1.47 -2.30 116.57 118.36 1wpw h LYS 295 Ca 0.24 -0.27 -0.07 0.00 -1.87 0.00 0.00 60.65 58.67 1wpw h LYS 295 Cb -0.03 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 1wpw h LYS 295 CO -0.04 0.96 -0.24 0.00 -0.57 0.00 0.00 179.45 179.55 1wpw h ALA 296 N 1.04 1.32 -0.12 3.86 0.00 -1.45 -2.12 119.26 121.79 1wpw h ALA 296 Ca 0.20 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1wpw h ALA 296 Cb 0.40 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1wpw h ALA 296 CO 0.01 0.46 -0.06 1.03 0.00 0.00 0.00 179.25 180.69 1wpw h SER 297 N 0.24 0.27 -0.07 0.00 0.87 -1.04 -2.32 113.55 111.49 1wpw h SER 297 Ca 0.04 -0.42 -0.07 0.00 -1.23 0.00 0.00 61.79 60.11 1wpw h SER 297 Cb 0.56 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.44 1wpw h SER 297 CO 0.04 0.62 -0.15 0.03 -0.53 0.00 0.00 176.83 176.84 1wpw h ARG 298 N -0.09 0.41 -0.12 2.24 2.47 -1.33 -1.51 114.38 116.45 1wpw h ARG 298 Ca 0.03 -0.12 -0.19 0.00 -1.26 0.00 0.00 59.98 58.44 1wpw h ARG 298 Cb 0.52 -0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 28.80 1wpw h ARG 298 CO 0.02 0.56 -0.70 0.00 0.56 0.00 0.00 179.97 180.41 1wpw h ALA 299 N 1.46 0.56 -0.01 0.04 0.00 -1.36 -1.85 119.26 118.10 1wpw h ALA 299 Ca 0.07 -0.58 -0.26 0.00 0.00 0.00 0.00 54.91 54.14 1wpw h ALA 299 Cb 0.49 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.24 1wpw h ALA 299 CO 0.03 0.73 -1.00 1.25 0.00 0.00 0.00 179.25 180.26 1wpw h LEU 300 N 0.36 0.84 -0.84 0.00 7.12 -1.26 -2.48 115.31 119.06 1wpw h LEU 300 Ca -0.03 -0.67 -0.11 0.00 0.13 0.00 0.00 57.88 57.21 1wpw h LEU 300 Cb 1.28 -0.26 -0.01 0.00 -0.53 0.00 0.00 40.66 41.13 1wpw h LEU 300 CO 0.13 1.47 -0.27 -0.08 -0.13 0.00 0.00 178.44 179.56 1wpw h GLU 301 N 0.38 0.56 0.00 1.25 4.81 -1.26 -2.57 114.58 117.75 1wpw h GLU 301 Ca -0.11 -0.22 -0.14 0.00 -0.13 0.00 0.00 59.36 58.75 1wpw h GLU 301 Cb 1.65 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.98 1wpw h GLU 301 CO 0.19 0.77 -0.68 -0.91 -0.73 0.00 0.00 179.01 177.65 1wpw h ASN 302 N 0.49 0.00 -0.62 1.04 2.35 -1.37 -2.74 115.58 114.73 1wpw h ASN 302 Ca 0.07 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.78 1wpw h ASN 302 Cb 0.72 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.06 1wpw h ASN 302 CO 0.06 0.68 0.23 0.00 -1.65 0.00 0.00 177.43 176.75 1wpw h ALA 303 N 1.32 0.81 -0.28 -0.83 0.00 -1.30 -2.19 119.26 116.78 1wpw h ALA 303 Ca -0.01 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 1wpw h ALA 303 Cb 1.47 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1wpw h ALA 303 CO 0.09 0.44 0.01 0.82 0.00 0.00 0.00 179.25 180.60 1wpw h ILE 304 N 0.87 1.25 -0.02 0.00 2.04 -1.42 -2.90 117.51 117.33 1wpw h ILE 304 Ca 0.20 -0.91 -0.06 0.00 1.00 0.00 0.00 64.86 65.09 1wpw h ILE 304 Cb 0.23 1.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1wpw h ILE 304 CO -0.01 0.29 -0.28 1.88 0.00 0.00 0.00 178.15 180.02 1wpw h TYR 305 N 0.27 0.05 -0.33 1.37 -1.99 -1.44 -2.72 116.97 112.18 1wpw h TYR 305 Ca 0.08 -0.01 -0.13 0.00 2.00 0.00 0.00 58.73 60.68 1wpw h TYR 305 Cb 0.41 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 39.12 1wpw h TYR 305 CO 0.03 0.32 -0.31 -0.07 -0.00 0.00 0.00 178.16 178.14 1wpw h LEU 306 N 0.04 0.73 -0.46 3.88 4.07 -1.30 -2.01 115.31 120.26 1wpw h LEU 306 Ca 0.00 -0.29 -0.17 0.00 0.08 0.00 0.00 57.88 57.50 1wpw h LEU 306 Cb 0.52 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.05 1wpw h LEU 306 CO 0.04 0.99 -0.74 -0.37 -1.08 0.00 0.00 178.44 177.28 1wpw h VAL 307 N 0.60 1.43 0.00 1.22 -1.51 -1.28 -2.85 116.25 113.85 1wpw h VAL 307 Ca 0.07 -2.27 -0.09 0.00 -1.23 0.00 0.00 66.70 63.17 1wpw h VAL 307 Cb 0.82 2.21 -0.01 0.00 -2.13 0.00 0.00 31.29 32.18 1wpw h VAL 307 CO 0.07 0.67 -0.44 1.88 -1.23 0.00 0.00 177.57 178.52 1wpw h TYR 308 N 0.16 0.00 0.00 5.19 -1.99 -1.42 -2.60 116.97 116.32 1wpw h TYR 308 Ca -0.03 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.61 1wpw h TYR 308 Cb 1.31 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 40.02 1wpw h TYR 308 CO 0.03 0.44 -0.52 -0.22 -0.00 0.00 0.00 178.16 177.88 1wpw h LYS 309 N 0.00 0.00 0.05 4.88 3.64 -1.18 -3.31 116.57 120.65 1wpw h LYS 309 Ca -0.00 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 59.08 1wpw h LYS 309 Cb 0.98 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.76 1wpw h LYS 309 CO 0.06 0.43 -1.64 0.93 -2.27 0.00 0.00 179.45 176.95 1wpw h GLU 310 N 0.00 0.11 -0.46 1.90 5.08 -1.43 -3.49 114.58 116.30 1wpw h GLU 310 Ca -0.02 -0.19 -0.20 0.00 -1.00 0.00 0.00 59.36 57.96 1wpw h GLU 310 Cb 1.35 0.07 -0.08 0.00 0.50 0.00 0.00 28.75 30.60 1wpw h GLU 310 CO 0.06 0.84 -0.18 0.54 -1.00 0.00 0.00 179.01 179.26 1wpw n ARG 311 N -3.26 -0.75 0.07 2.33 5.12 -0.99 -4.92 116.66 114.26 1wpw n ARG 311 Ca -0.18 0.82 0.05 0.00 -1.93 0.00 0.00 57.85 56.61 1wpw n ARG 311 Cb 1.04 -4.74 -0.04 0.00 -1.16 0.00 0.00 32.46 27.55 1wpw n ARG 311 CO 0.00 0.00 0.00 1.57 -1.93 0.00 0.00 177.63 177.27 1wpw h LYS 312 N 0.04 0.00 -1.87 5.56 2.10 -1.93 -3.42 116.57 117.05 1wpw h LYS 312 Ca -0.20 0.00 -0.50 0.00 -2.00 0.00 0.00 60.65 57.95 1wpw h LYS 312 Cb 0.67 0.00 -0.38 0.00 -0.90 0.00 0.00 32.23 31.62 1wpw h LYS 312 CO 0.29 0.17 -1.11 0.00 -2.00 0.00 0.00 179.45 176.80 1wpw n ALA 313 N -2.29 1.99 -2.82 0.07 0.00 -1.26 -4.91 120.51 111.28 1wpw n ALA 313 Ca -0.05 -3.27 -0.23 0.00 0.00 0.00 0.00 53.44 49.89 1wpw n ALA 313 Cb 0.71 -0.90 -0.04 0.00 0.00 0.00 0.00 19.45 19.22 1wpw n ALA 313 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1wpw s LEU 314 N -1.82 3.83 0.56 0.00 1.43 -1.26 -4.17 118.68 117.26 1wpw s LEU 314 Ca 0.37 -0.22 -0.07 0.00 -1.03 0.00 0.00 54.13 53.18 1wpw s LEU 314 Cb 0.26 -2.38 -0.02 0.00 0.03 0.00 0.00 46.19 44.08 1wpw s LEU 314 CO -0.10 -0.02 0.90 0.42 0.23 0.00 0.00 176.35 177.79 1wpw s THR 315 N -2.06 4.44 0.53 5.49 -4.23 -1.26 -1.47 115.64 117.08 1wpw s THR 315 Ca 0.33 0.35 0.31 0.00 -1.18 0.00 0.00 61.69 61.49 1wpw s THR 315 Cb -0.08 -3.74 0.48 0.00 1.34 0.00 0.00 72.50 70.50 1wpw s THR 315 CO 0.25 -0.82 1.88 -0.65 -0.54 0.00 0.00 174.62 174.74 1wpw h PRO 316 N -0.09 0.03 0.00 3.99 0.11 -1.75 -1.85 132.00 132.44 1wpw h PRO 316 Ca -0.46 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 1wpw h PRO 316 Cb 1.22 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1wpw h PRO 316 CO 0.62 0.02 -0.16 0.38 -0.21 0.00 0.00 178.00 178.65 1wpw h ASP 317 N 0.04 0.00 -0.18 -2.05 2.03 -1.87 -2.55 116.42 111.83 1wpw h ASP 317 Ca 0.44 0.00 -0.08 0.00 -0.73 0.00 0.00 57.03 56.65 1wpw h ASP 317 Cb 1.69 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 40.14 1wpw h ASP 317 CO -0.02 0.16 -0.22 1.33 -1.03 0.00 0.00 179.24 179.45 1wpw n VAL 318 N -3.90 2.34 -0.69 4.15 0.24 -0.76 -4.97 118.33 114.75 1wpw n VAL 318 Ca -0.02 -2.82 0.00 0.00 -2.04 0.00 0.00 64.34 59.46 1wpw n VAL 318 Cb 0.25 -0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.34 1wpw n VAL 318 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wpw n GLY 319 N -1.11 0.73 1.33 7.63 0.00 -0.96 -4.93 105.19 107.89 1wpw n GLY 319 Ca 0.25 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.19 1wpw n GLY 319 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wpw n GLY 320 N -2.40 0.24 0.34 -0.02 0.00 -0.85 -4.95 105.19 97.55 1wpw n GLY 320 Ca 0.00 -1.91 0.01 0.00 0.00 0.00 0.00 46.02 44.12 1wpw n GLY 320 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1wpw n ASN 321 N -3.05 0.19 -4.95 1.61 0.23 -1.00 -3.56 115.26 104.73 1wpw n ASN 321 Ca 0.06 -1.81 -0.23 0.00 -0.53 0.00 0.00 54.58 52.06 1wpw n ASN 321 Cb 0.20 -0.16 0.01 0.00 -2.08 0.00 0.00 39.78 37.75 1wpw n ASN 321 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1wpw s ALA 322 N -0.20 3.71 0.72 -2.53 0.00 -0.54 -4.95 121.76 117.97 1wpw s ALA 322 Ca 0.02 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 50.98 1wpw s ALA 322 Cb 0.02 -2.17 0.12 0.00 0.00 0.00 0.00 23.12 21.09 1wpw s ALA 322 CO 0.00 -0.30 0.99 0.95 0.00 0.00 0.00 175.76 177.40 1wpw s THR 323 N -2.52 2.18 0.36 0.00 -4.23 -1.26 -4.19 115.64 105.98 1wpw s THR 323 Ca 0.46 -0.56 0.05 0.00 -1.18 0.00 0.00 61.69 60.47 1wpw s THR 323 Cb -0.10 -2.61 0.19 0.00 1.34 0.00 0.00 72.50 71.32 1wpw s THR 323 CO 0.38 0.00 1.94 0.00 -0.54 0.00 0.00 174.62 176.40 1wpw h THR 324 N -0.53 1.17 -0.45 3.99 1.03 -1.66 -2.50 112.91 113.96 1wpw h THR 324 Ca -0.37 -0.59 -0.05 0.00 -0.01 0.00 0.00 66.41 65.39 1wpw h THR 324 Cb 1.27 0.81 -0.02 0.00 -1.07 0.00 0.00 68.15 69.14 1wpw h THR 324 CO 0.42 0.21 0.07 0.44 -0.01 0.00 0.00 175.52 176.65 1wpw h ASP 325 N 0.51 0.71 -0.63 0.00 3.32 -1.93 -2.17 116.42 116.22 1wpw h ASP 325 Ca 0.12 -0.26 -0.08 0.00 0.02 0.00 0.00 57.03 56.83 1wpw h ASP 325 Cb 0.20 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 1wpw h ASP 325 CO -0.00 0.79 0.09 0.44 -1.72 0.00 0.00 179.24 178.84 1wpw h ASP 326 N 0.60 1.02 -0.33 6.45 3.32 -1.88 -1.69 116.42 123.93 1wpw h ASP 326 Ca 0.14 -0.25 -0.05 0.00 0.02 0.00 0.00 57.03 56.89 1wpw h ASP 326 Cb 0.38 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1wpw h ASP 326 CO 0.01 1.02 -0.00 0.25 -1.72 0.00 0.00 179.24 178.80 1wpw h LEU 327 N 1.00 0.57 -1.02 1.55 5.85 -1.41 -1.98 115.31 119.87 1wpw h LEU 327 Ca 0.20 -0.31 -0.05 0.00 0.84 0.00 0.00 57.88 58.56 1wpw h LEU 327 Cb 0.44 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 1wpw h LEU 327 CO 0.01 0.74 0.15 0.40 -0.34 0.00 0.00 178.44 179.40 1wpw h ILE 328 N 0.38 1.23 -0.76 4.05 2.04 -1.30 -2.57 117.51 120.59 1wpw h ILE 328 Ca 0.09 -0.81 -0.05 0.00 1.00 0.00 0.00 64.86 65.09 1wpw h ILE 328 Cb 0.45 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 1wpw h ILE 328 CO 0.02 0.30 0.26 0.78 0.00 0.00 0.00 178.15 179.51 1wpw h ASN 329 N 0.82 1.08 0.17 1.72 2.35 -1.11 -0.75 115.58 119.87 1wpw h ASN 329 Ca 0.18 -0.19 -0.08 0.00 -0.55 0.00 0.00 56.30 55.66 1wpw h ASN 329 Cb 0.28 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1wpw h ASN 329 CO -0.00 0.98 -0.30 -0.33 -1.65 0.00 0.00 177.43 176.13 1wpw h GLU 330 N 1.12 0.21 0.01 0.81 4.39 -1.00 -1.49 114.58 118.62 1wpw h GLU 330 Ca 0.25 -0.07 -0.19 0.00 0.34 0.00 0.00 59.36 59.68 1wpw h GLU 330 Cb 0.27 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 1wpw h GLU 330 CO -0.01 0.49 -0.88 0.82 -1.16 0.00 0.00 179.01 178.27 1wpw h ILE 331 N 0.18 1.57 0.00 3.13 2.04 -1.10 -2.89 117.51 120.45 1wpw h ILE 331 Ca 0.03 -2.83 -0.08 0.00 1.00 0.00 0.00 64.86 62.97 1wpw h ILE 331 Cb 0.63 2.56 -0.01 0.00 -0.74 0.00 0.00 36.82 39.26 1wpw h ILE 331 CO 0.05 0.82 -0.38 0.22 0.00 0.00 0.00 178.15 178.85 1wpw h TYR 332 N 0.04 0.00 0.12 1.37 3.20 -0.67 -2.55 116.97 118.48 1wpw h TYR 332 Ca -0.03 0.00 -0.31 0.00 3.14 0.00 0.00 58.73 61.53 1wpw h TYR 332 Cb 1.53 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.80 1wpw h TYR 332 CO 0.01 0.38 -1.59 -0.91 -1.64 0.00 0.00 178.16 174.42 1wpw h ASN 333 N 0.00 0.41 -0.12 -2.11 2.35 -1.28 -3.29 115.58 111.53 1wpw h ASN 333 Ca -0.00 -0.60 0.00 0.00 -0.55 0.00 0.00 56.30 55.15 1wpw h ASN 333 Cb 0.89 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.12 1wpw h ASN 333 CO 0.05 1.50 0.00 0.29 -1.65 0.00 0.00 177.43 177.62 1wpw n LYS 334 N -3.46 1.42 0.09 0.81 5.02 -1.09 -3.69 118.16 117.26 1wpw n LYS 334 Ca -0.18 -0.64 -0.17 0.00 -2.02 0.00 0.00 58.31 55.29 1wpw n LYS 334 Cb 1.05 -1.29 -0.14 0.00 -0.02 0.00 0.00 35.03 34.63 1wpw n LYS 334 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1wpw h LEU 335 N 1.21 0.46 0.00 -0.35 5.85 -1.53 -3.44 115.31 117.52 1wpw h LEU 335 Ca 0.00 -0.54 0.00 0.00 0.84 0.00 0.00 57.88 58.18 1wpw h LEU 335 Cb 0.27 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.15 1wpw h LEU 335 CO 0.00 1.44 0.00 0.61 -0.34 0.00 0.00 178.44 180.15