#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d5b n TYR 7 N 0.00 0.00 0.00 2.03 4.02 -1.26 -3.60 117.16 118.35 3d5b n TYR 7 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 3d5b n TYR 7 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 3d5b n TYR 7 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3d5b n GLN 8 N 0.00 0.00 -4.85 -0.72 -0.00 -1.26 -3.62 117.38 106.93 3d5b n GLN 8 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 57.00 56.69 3d5b n GLN 8 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 30.24 30.10 3d5b n GLN 8 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.06 178.02 3d5b s ILE 9 N 0.00 2.62 -0.66 -0.39 -0.00 0.24 -4.82 121.20 118.18 3d5b s ILE 9 Ca 0.00 -1.12 -0.27 0.00 -0.00 0.00 0.00 60.65 59.26 3d5b s ILE 9 Cb 0.00 -2.05 0.02 0.00 -0.00 0.00 0.00 42.46 40.43 3d5b s ILE 9 CO 0.00 0.43 1.35 -2.16 -0.00 0.00 0.00 174.94 174.56 3d5b s PRO 10 N -1.14 3.22 -0.06 0.37 0.04 -1.26 -0.71 135.00 135.44 3d5b s PRO 10 Ca 0.13 0.08 -0.18 0.00 0.04 0.00 0.00 61.00 61.07 3d5b s PRO 10 Cb -0.10 -4.16 -0.05 0.00 0.04 0.00 0.00 34.50 30.23 3d5b s PRO 10 CO 0.03 -2.08 0.49 0.08 0.04 0.00 0.00 177.00 175.56 3d5b s VAL 11 N 6.00 5.08 -0.11 -0.36 1.01 -0.84 -2.63 120.40 128.55 3d5b s VAL 11 Ca 0.43 1.01 -0.02 0.00 0.00 0.00 0.00 61.98 63.40 3d5b s VAL 11 Cb -0.09 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 3d5b s VAL 11 CO 0.20 0.40 -0.03 -0.22 0.00 0.00 0.00 175.10 175.45 3d5b s LEU 12 N 0.08 3.38 0.26 3.92 2.96 0.13 -2.49 118.68 126.92 3d5b s LEU 12 Ca 0.27 0.01 -0.09 0.00 -0.22 0.00 0.00 54.13 54.09 3d5b s LEU 12 Cb -0.16 -1.78 -0.01 0.00 0.50 0.00 0.00 46.19 44.74 3d5b s LEU 12 CO 0.13 0.29 0.43 -0.44 -1.32 0.00 0.00 176.35 175.44 3d5b s SER 13 N -0.37 0.15 0.28 3.68 0.01 -0.96 -3.09 113.70 113.39 3d5b s SER 13 Ca 0.06 -1.11 0.22 0.00 1.31 0.00 0.00 55.95 56.43 3d5b s SER 13 Cb -0.12 0.58 1.05 0.00 0.21 0.00 0.00 66.02 67.73 3d5b s SER 13 CO 0.02 -1.14 1.66 -2.65 0.41 0.00 0.00 173.24 171.54 3d5b n PRO 14 N -0.41 0.16 -0.54 12.44 -0.02 -1.26 -2.19 135.00 143.18 3d5b n PRO 14 Ca -0.01 0.53 0.09 0.00 -2.02 0.00 0.00 63.50 62.10 3d5b n PRO 14 Cb 0.62 -1.90 0.34 0.00 -0.02 0.00 0.00 33.50 32.54 3d5b n PRO 14 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3d5b n SER 15 N -2.22 4.40 0.00 2.55 3.41 -1.26 -5.05 113.62 115.44 3d5b n SER 15 Ca 0.00 -2.33 0.00 0.00 -0.26 0.00 0.00 58.87 56.28 3d5b n SER 15 Cb 0.12 -0.55 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 3d5b n SER 15 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d5b n GLY 16 N 1.23 -1.18 2.91 5.00 0.00 -0.93 -4.82 105.19 107.40 3d5b n GLY 16 Ca 0.24 -2.20 -0.43 0.00 0.00 0.00 0.00 46.02 43.63 3d5b n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d5b n ARG 17 N -0.23 3.99 -2.42 1.61 1.74 -1.26 -2.27 116.66 117.81 3d5b n ARG 17 Ca 0.00 -3.93 -0.43 0.00 -0.77 0.00 0.00 57.85 52.72 3d5b n ARG 17 Cb 0.00 -2.76 -0.02 0.00 -1.02 0.00 0.00 32.46 28.66 3d5b n ARG 17 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 3d5b s ARG 18 N -0.91 4.18 -0.65 5.56 1.70 -1.04 -4.83 118.95 122.97 3d5b s ARG 18 Ca 0.36 1.61 -0.18 0.00 -0.47 0.00 0.00 55.73 57.05 3d5b s ARG 18 Cb 0.08 -3.78 0.12 0.00 -0.57 0.00 0.00 34.95 30.80 3d5b s ARG 18 CO 0.04 -0.77 0.75 -1.21 -1.08 0.00 0.00 175.30 173.03 3d5b s GLU 19 N 3.61 3.16 0.00 3.89 2.02 -1.26 -1.99 118.70 128.13 3d5b s GLU 19 Ca 0.55 -1.51 0.00 0.00 0.02 0.00 0.00 54.97 54.04 3d5b s GLU 19 Cb -0.21 -4.35 0.00 0.00 0.10 0.00 0.00 34.13 29.67 3d5b s GLU 19 CO 0.16 -1.53 0.00 1.28 0.02 0.00 0.00 175.26 175.19 3d5b n LEU 20 N 6.06 0.00 -4.38 1.80 4.77 0.11 -4.71 117.00 120.64 3d5b n LEU 20 Ca -0.04 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.75 3d5b n LEU 20 Cb 0.43 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.42 3d5b n LEU 20 CO 0.55 -0.45 -0.36 0.00 -1.33 0.00 0.00 177.39 175.80 3d5b s ALA 21 N -3.24 2.12 0.00 -1.18 0.00 -1.26 -0.59 121.76 117.61 3d5b s ALA 21 Ca 0.00 -1.83 0.00 0.00 0.00 0.00 0.00 51.96 50.13 3d5b s ALA 21 Cb 0.00 0.25 0.00 0.00 0.00 0.00 0.00 23.12 23.37 3d5b s ALA 21 CO 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 175.76 175.64 3d5b n ALA 22 N -0.50 0.00 -0.04 0.00 0.00 -1.24 -4.64 120.51 114.09 3d5b n ALA 22 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3d5b n ALA 22 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 3d5b n ALA 22 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3d5b n ASP 23 N -1.06 0.00 -4.47 0.00 2.03 -1.26 -4.69 116.55 107.09 3d5b n ASP 23 Ca 0.00 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.88 3d5b n ASP 23 Cb 0.00 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 3d5b n ASP 23 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3d5b n LEU 24 N 0.00 0.11 0.00 -2.67 4.32 -1.24 -4.96 117.00 112.57 3d5b n LEU 24 Ca 0.00 1.01 -0.12 0.00 -0.02 0.00 0.00 56.01 56.88 3d5b n LEU 24 Cb 0.00 -1.12 0.11 0.00 -1.62 0.00 0.00 43.42 40.79 3d5b n LEU 24 CO 0.00 -2.58 0.15 -2.65 -1.22 0.00 0.00 177.39 171.09 3d5b n PRO 25 N 0.72 -2.96 0.00 3.23 -0.02 -1.26 -4.14 135.00 130.56 3d5b n PRO 25 Ca 0.12 -0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.01 3d5b n PRO 25 Cb 0.35 -0.74 0.00 0.00 -0.02 0.00 0.00 33.50 33.10 3d5b n PRO 25 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d5b n ALA 26 N -4.07 2.92 -1.61 3.55 0.00 -1.26 -3.08 120.51 116.96 3d5b n ALA 26 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.99 3d5b n ALA 26 Cb 0.24 0.37 -0.03 0.00 0.00 0.00 0.00 19.45 20.03 3d5b n ALA 26 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3d5b s GLU 27 N -1.98 2.24 -0.52 0.00 0.41 -1.26 -4.91 118.70 112.68 3d5b s GLU 27 Ca 0.00 1.39 -0.21 0.00 -0.41 0.00 0.00 54.97 55.74 3d5b s GLU 27 Cb 0.00 -4.55 0.05 0.00 -1.78 0.00 0.00 34.13 27.86 3d5b s GLU 27 CO 0.00 -3.12 0.72 0.96 -0.49 0.00 0.00 175.26 173.33 3d5b s ILE 28 N 11.55 4.72 -0.63 -1.63 -4.36 -1.26 -4.99 121.20 124.61 3d5b s ILE 28 Ca 0.95 -0.25 -0.21 0.00 -0.26 0.00 0.00 60.65 60.88 3d5b s ILE 28 Cb -0.18 -4.37 0.08 0.00 1.25 0.00 0.00 42.46 39.24 3d5b s ILE 28 CO 0.26 -0.90 0.85 0.21 0.24 0.00 0.00 174.94 175.61 3d5b s ASN 29 N 2.73 6.18 0.16 4.36 3.84 -1.26 -4.95 114.94 126.00 3d5b s ASN 29 Ca 0.20 -1.15 -0.23 0.00 0.21 0.00 0.00 52.86 51.89 3d5b s ASN 29 Cb -0.17 -2.37 0.05 0.00 -0.55 0.00 0.00 41.25 38.21 3d5b s ASN 29 CO 0.14 -1.29 1.60 -0.65 -2.79 0.00 0.00 177.10 174.11 3d5b h PRO 30 N 9.40 -0.25 -0.29 0.43 0.11 -1.99 -2.50 132.00 136.91 3d5b h PRO 30 Ca -0.29 0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.89 3d5b h PRO 30 Cb 1.08 0.06 -0.08 0.00 0.11 0.00 0.00 31.00 32.17 3d5b h PRO 30 CO 1.14 -0.17 -0.46 1.25 -0.21 0.00 0.00 178.00 179.55 3d5b h HIS 31 N -0.26 -1.35 -0.37 0.65 -0.00 -1.99 0.25 115.15 112.08 3d5b h HIS 31 Ca 0.16 0.06 0.07 0.00 -0.00 0.00 0.00 60.37 60.67 3d5b h HIS 31 Cb 0.53 0.63 -0.09 0.00 -0.00 0.00 0.00 27.41 28.48 3d5b h HIS 31 CO -0.51 -0.47 -0.40 1.25 -0.00 0.00 0.00 177.93 177.80 3d5b h LEU 32 N -0.42 -1.32 -0.82 0.26 6.46 -1.92 0.11 115.31 117.66 3d5b h LEU 32 Ca 0.10 0.20 0.18 0.00 -0.12 0.00 0.00 57.88 58.24 3d5b h LEU 32 Cb 0.61 0.58 -0.11 0.00 -0.73 0.00 0.00 40.66 41.01 3d5b h LEU 32 CO -0.51 -0.36 0.31 0.25 -0.62 0.00 0.00 178.44 177.51 3d5b h LEU 33 N -0.33 0.23 0.78 2.25 5.85 -0.75 -1.90 115.31 121.44 3d5b h LEU 33 Ca 0.14 0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.96 3d5b h LEU 33 Cb 0.58 0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.75 3d5b h LEU 33 CO -0.54 0.02 -0.42 -0.25 -0.34 0.00 0.00 178.44 176.91 3d5b h TRP 34 N 0.38 -1.11 -0.93 1.25 7.01 0.18 -2.30 115.95 120.43 3d5b h TRP 34 Ca 0.48 -0.02 0.22 0.00 2.11 0.00 0.00 58.89 61.69 3d5b h TRP 34 Cb 0.84 0.38 -0.17 0.00 -2.10 0.00 0.00 29.16 28.11 3d5b h TRP 34 CO -0.18 -0.66 -0.07 0.93 -2.79 0.00 0.00 178.44 175.67 3d5b h GLU 35 N -1.11 0.02 0.44 2.65 5.08 -0.21 0.14 114.58 121.59 3d5b h GLU 35 Ca -0.10 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 3d5b h GLU 35 Cb 0.87 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.12 3d5b h GLU 35 CO 0.14 0.02 -0.23 0.28 -1.00 0.00 0.00 179.01 178.22 3d5b h VAL 36 N 0.02 0.53 -0.54 3.13 2.07 -1.28 -0.38 116.25 119.80 3d5b h VAL 36 Ca 0.52 0.00 0.11 0.00 0.82 0.00 0.00 66.70 68.14 3d5b h VAL 36 Cb 0.95 0.53 -0.09 0.00 -1.52 0.00 0.00 31.29 31.16 3d5b h VAL 36 CO -0.89 0.00 -0.02 0.58 0.02 0.00 0.00 177.57 177.25 3d5b h VAL 37 N -0.61 0.55 0.08 2.57 2.07 -0.27 -1.09 116.25 119.53 3d5b h VAL 37 Ca -0.06 -0.03 0.02 0.00 0.82 0.00 0.00 66.70 67.45 3d5b h VAL 37 Cb 0.48 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 3d5b h VAL 37 CO 0.08 0.02 -0.28 -0.09 0.02 0.00 0.00 177.57 177.32 3d5b h ARG 38 N 0.10 -0.45 -1.05 1.57 2.43 -0.58 -1.12 114.38 115.27 3d5b h ARG 38 Ca 0.28 0.03 0.32 0.00 -0.81 0.00 0.00 59.98 59.80 3d5b h ARG 38 Cb 0.43 0.10 -0.14 0.00 -0.42 0.00 0.00 29.97 29.94 3d5b h ARG 38 CO -0.48 -0.30 0.62 2.35 -1.51 0.00 0.00 179.97 180.66 3d5b h TRP 39 N -0.47 0.85 0.59 2.20 7.01 0.13 0.55 115.95 126.81 3d5b h TRP 39 Ca 0.04 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.05 3d5b h TRP 39 Cb 0.52 -0.23 0.01 0.00 -2.10 0.00 0.00 29.16 27.36 3d5b h TRP 39 CO -0.28 -0.13 -0.28 1.96 -2.79 0.00 0.00 178.44 176.93 3d5b h GLN 40 N 0.32 -0.76 0.00 2.65 4.20 -0.26 -0.57 115.11 120.69 3d5b h GLN 40 Ca 0.72 0.05 0.00 0.00 0.06 0.00 0.00 58.65 59.48 3d5b h GLN 40 Cb 1.74 0.17 0.00 0.00 0.30 0.00 0.00 27.48 29.69 3d5b h GLN 40 CO -0.53 -0.48 0.00 1.28 -0.67 0.00 0.00 178.83 178.43 3d5b n LEU 41 N -5.31 0.00 -0.11 1.46 4.77 -0.40 -2.39 117.00 115.02 3d5b n LEU 41 Ca -0.10 0.23 -0.24 0.00 -0.03 0.00 0.00 56.01 55.86 3d5b n LEU 41 Cb 0.33 -0.23 -0.11 0.00 -2.33 0.00 0.00 43.42 41.07 3d5b n LEU 41 CO 0.26 -0.20 -1.12 0.00 -1.33 0.00 0.00 177.39 175.01 3d5b n ALA 42 N -1.23 1.11 0.22 -1.18 0.00 0.18 -3.93 120.51 115.67 3d5b n ALA 42 Ca 0.02 -0.88 0.08 0.00 0.00 0.00 0.00 53.44 52.66 3d5b n ALA 42 Cb 0.03 -0.20 0.48 0.00 0.00 0.00 0.00 19.45 19.76 3d5b n ALA 42 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 3d5b h LYS 43 N -0.62 0.00 0.00 0.00 2.10 -0.74 -2.48 116.57 114.83 3d5b h LYS 43 Ca -0.55 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 57.92 3d5b h LYS 43 Cb 1.67 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.97 3d5b h LYS 43 CO -0.23 0.26 -0.84 0.07 -2.00 0.00 0.00 179.45 176.71 3d5b h ARG 44 N 0.00 0.01 -5.68 0.07 0.11 -1.73 -3.44 114.38 103.73 3d5b h ARG 44 Ca -0.00 -0.02 -0.59 0.00 0.10 0.00 0.00 59.98 59.47 3d5b h ARG 44 Cb 0.68 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.73 3d5b h ARG 44 CO 0.03 0.85 1.54 0.54 0.10 0.00 0.00 179.97 183.03 3d5b n ARG 45 N -3.55 0.77 -3.41 0.08 1.74 -0.93 -4.90 116.66 106.46 3d5b n ARG 45 Ca -0.01 0.14 -0.38 0.00 -0.77 0.00 0.00 57.85 56.84 3d5b n ARG 45 Cb 0.80 -2.42 -0.08 0.00 -1.02 0.00 0.00 32.46 29.75 3d5b n ARG 45 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 3d5b s ARG 46 N 7.30 4.17 -0.35 5.56 3.52 -1.26 -4.10 118.95 133.79 3d5b s ARG 46 Ca 1.13 0.17 -0.29 0.00 -0.13 0.00 0.00 55.73 56.61 3d5b s ARG 46 Cb -0.83 -3.53 0.00 0.00 -1.56 0.00 0.00 34.95 29.04 3d5b s ARG 46 CO 0.45 -0.02 1.39 0.20 -0.81 0.00 0.00 175.30 176.51 3d5b s GLY 47 N 1.01 1.21 0.00 8.12 0.00 -1.23 -4.74 107.32 111.69 3d5b s GLY 47 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 44.72 44.90 3d5b s GLY 47 CO 0.08 2.72 0.00 -0.37 0.00 0.00 0.00 173.10 175.53 3d5b n THR 48 N 6.69 0.00 -2.06 0.90 5.66 -1.26 -4.30 114.28 119.91 3d5b n THR 48 Ca 0.16 -0.08 -0.42 0.00 -3.05 0.00 0.00 64.05 60.66 3d5b n THR 48 Cb 0.47 0.78 -0.03 0.00 -1.55 0.00 0.00 70.33 70.01 3d5b n THR 48 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3d5b s ALA 49 N -0.26 3.63 0.02 1.79 0.00 -1.26 -4.84 121.76 120.83 3d5b s ALA 49 Ca 0.00 0.92 0.04 0.00 0.00 0.00 0.00 51.96 52.92 3d5b s ALA 49 Cb 0.00 -3.71 -0.02 0.00 0.00 0.00 0.00 23.12 19.39 3d5b s ALA 49 CO 0.00 -1.28 -0.12 0.45 0.00 0.00 0.00 175.76 174.81 3d5b s SER 50 N 2.94 1.35 -0.26 0.00 0.15 -1.25 -2.46 113.70 114.16 3d5b s SER 50 Ca 0.71 -0.34 -0.03 0.00 0.70 0.00 0.00 55.95 56.99 3d5b s SER 50 Cb -0.33 -0.10 0.11 0.00 -1.71 0.00 0.00 66.02 63.99 3d5b s SER 50 CO 0.28 0.05 0.21 0.42 1.20 0.00 0.00 173.24 175.40 3d5b s THR 51 N -0.63 -0.25 -0.24 6.45 -4.23 -1.21 -5.00 115.64 110.52 3d5b s THR 51 Ca 0.01 -0.48 -0.33 0.00 -1.18 0.00 0.00 61.69 59.72 3d5b s THR 51 Cb -0.06 -0.89 -0.10 0.00 1.34 0.00 0.00 72.50 72.79 3d5b s THR 51 CO 0.00 -0.49 2.12 0.29 -0.54 0.00 0.00 174.62 176.01 3d5b n LYS 52 N 5.29 1.62 -0.89 3.99 5.02 -1.26 -4.72 118.16 127.21 3d5b n LYS 52 Ca -0.04 0.49 -0.30 0.00 -2.02 0.00 0.00 58.31 56.44 3d5b n LYS 52 Cb 0.46 -2.74 0.25 0.00 -0.02 0.00 0.00 35.03 32.97 3d5b n LYS 52 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3d5b s THR 53 N 6.77 1.58 0.65 -0.18 -1.32 -1.26 -2.79 115.64 119.09 3d5b s THR 53 Ca 1.03 0.00 0.19 0.00 -1.21 0.00 0.00 61.69 61.69 3d5b s THR 53 Cb -0.66 -2.37 0.21 0.00 -1.51 0.00 0.00 72.50 68.17 3d5b s THR 53 CO 0.46 0.00 1.54 -0.09 -2.21 0.00 0.00 174.62 174.32 3d5b h ARG 54 N -2.71 0.00 0.12 7.08 2.43 -1.76 -2.49 114.38 117.05 3d5b h ARG 54 Ca -0.47 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.70 3d5b h ARG 54 Cb 1.31 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.86 3d5b h ARG 54 CO 0.36 0.00 -0.06 0.78 -1.51 0.00 0.00 179.97 179.55 3d5b h GLY 55 N 0.00 -0.17 -5.82 2.80 0.00 -1.90 -3.39 103.07 94.59 3d5b h GLY 55 Ca 0.05 0.06 -0.70 0.00 0.00 0.00 0.00 47.33 46.74 3d5b h GLY 55 CO -0.00 -0.06 3.27 1.18 0.00 0.00 0.00 176.54 180.93 3d5b n GLU 56 N -3.19 3.01 -4.07 4.80 4.71 -0.94 -4.86 120.64 120.09 3d5b n GLU 56 Ca -0.02 -2.53 -0.16 0.00 -0.01 0.00 0.00 57.16 54.44 3d5b n GLU 56 Cb 0.06 -3.20 -0.15 0.00 -1.01 0.00 0.00 31.44 27.14 3d5b n GLU 56 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 3d5b s VAL 57 N 3.01 0.32 0.52 2.62 0.11 -1.26 -4.65 120.40 121.07 3d5b s VAL 57 Ca 0.51 -0.11 0.27 0.00 -2.93 0.00 0.00 61.98 59.71 3d5b s VAL 57 Cb 0.15 -0.32 0.42 0.00 -1.53 0.00 0.00 36.38 35.11 3d5b s VAL 57 CO -0.08 0.12 1.95 0.00 -3.33 0.00 0.00 175.10 173.76 3d5b h ALA 58 N 6.46 2.59 -2.27 1.54 0.00 -1.96 -3.44 119.26 122.16 3d5b h ALA 58 Ca -0.32 -0.02 -0.57 0.00 0.00 0.00 0.00 54.91 53.99 3d5b h ALA 58 Cb 1.18 0.04 0.19 0.00 0.00 0.00 0.00 17.79 19.20 3d5b h ALA 58 CO 0.49 -0.78 -0.80 0.66 0.00 0.00 0.00 179.25 178.82 3d5b n TYR 59 N -4.35 -1.96 -0.45 0.00 0.53 -1.26 -4.97 117.16 104.70 3d5b n TYR 59 Ca 0.14 0.34 -0.04 0.00 -1.02 0.00 0.00 57.90 57.31 3d5b n TYR 59 Cb 0.73 -1.79 0.04 0.00 -1.03 0.00 0.00 39.34 37.29 3d5b n TYR 59 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 3d5b n SER 60 N 1.06 -1.44 0.00 7.72 2.88 -1.26 -4.94 113.62 117.64 3d5b n SER 60 Ca 0.08 -0.48 0.00 0.00 -1.33 0.00 0.00 58.87 57.14 3d5b n SER 60 Cb 0.50 -0.14 0.00 0.00 -0.75 0.00 0.00 64.21 63.81 3d5b n SER 60 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3d5b n GLY 61 N 0.90 0.78 3.79 0.46 0.00 -1.26 -4.69 105.19 105.17 3d5b n GLY 61 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 3d5b n GLY 61 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3d5b s ARG 62 N -0.50 2.93 -0.00 1.61 3.52 -1.26 -4.72 118.95 120.52 3d5b s ARG 62 Ca 0.00 1.24 -0.21 0.00 -0.13 0.00 0.00 55.73 56.63 3d5b s ARG 62 Cb 0.00 -1.98 -0.05 0.00 -1.56 0.00 0.00 34.95 31.36 3d5b s ARG 62 CO 0.00 -1.13 0.61 0.21 -0.81 0.00 0.00 175.30 174.18 3d5b s LYS 63 N -4.32 4.33 -0.04 5.12 2.20 -1.26 -3.56 119.74 122.22 3d5b s LYS 63 Ca 0.64 0.75 -0.22 0.00 -0.36 0.00 0.00 55.97 56.78 3d5b s LYS 63 Cb -0.18 -3.35 -0.17 0.00 -1.51 0.00 0.00 37.83 32.63 3d5b s LYS 63 CO 0.44 0.35 0.98 0.97 -0.36 0.00 0.00 175.35 177.72 3d5b h ILE 64 N 4.16 0.91 -3.29 5.43 6.09 -1.27 -3.46 117.51 126.08 3d5b h ILE 64 Ca -0.45 -1.07 -0.56 0.00 -1.37 0.00 0.00 64.86 61.41 3d5b h ILE 64 Cb 1.20 1.49 -0.18 0.00 0.47 0.00 0.00 36.82 39.80 3d5b h ILE 64 CO 0.70 0.22 -0.79 0.26 -3.07 0.00 0.00 178.15 175.47 3d5b s TRP 65 N -3.70 1.95 -1.47 2.19 0.51 -1.26 -5.03 118.94 112.13 3d5b s TRP 65 Ca -0.13 -0.43 0.05 0.00 -2.12 0.00 0.00 56.10 53.46 3d5b s TRP 65 Cb 0.01 -0.97 0.25 0.00 -0.81 0.00 0.00 33.47 31.94 3d5b s TRP 65 CO 0.52 0.37 0.97 -0.35 -0.51 0.00 0.00 176.95 177.95 3d5b n PRO 66 N 0.32 0.07 -3.85 4.98 -0.04 -1.26 -4.76 135.00 130.46 3d5b n PRO 66 Ca -0.13 0.22 -0.24 0.00 -0.04 0.00 0.00 63.50 63.31 3d5b n PRO 66 Cb 0.57 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 3d5b n PRO 66 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3d5b n GLN 67 N -1.26 -4.09 -3.64 0.54 10.64 -1.26 -4.98 117.38 113.33 3d5b n GLN 67 Ca 0.02 0.51 -0.04 0.00 -1.83 0.00 0.00 57.00 55.66 3d5b n GLN 67 Cb 0.04 -4.87 -0.07 0.00 -0.86 0.00 0.00 30.24 24.48 3d5b n GLN 67 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.06 173.64 3d5b s LYS 68 N -6.32 0.33 -1.58 2.61 -2.85 -1.26 -4.95 119.74 105.72 3d5b s LYS 68 Ca 0.05 0.48 -0.19 0.00 -1.00 0.00 0.00 55.97 55.31 3d5b s LYS 68 Cb -0.03 0.12 0.18 0.00 -2.06 0.00 0.00 37.83 36.04 3d5b s LYS 68 CO 0.85 -0.05 0.55 0.72 0.10 0.00 0.00 175.35 177.52 3d5b n HIS 69 N 2.82 -1.42 -0.08 1.78 8.25 -1.26 -4.76 115.22 120.56 3d5b n HIS 69 Ca -0.15 0.61 -0.10 0.00 -0.26 0.00 0.00 57.72 57.82 3d5b n HIS 69 Cb 0.57 -2.02 -0.11 0.00 1.12 0.00 0.00 29.99 29.54 3d5b n HIS 69 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 3d5b n THR 70 N -3.91 1.08 0.00 1.59 5.66 -1.26 -4.98 114.28 112.45 3d5b n THR 70 Ca 0.09 -0.58 0.00 0.00 -3.05 0.00 0.00 64.05 60.51 3d5b n THR 70 Cb 0.47 -0.79 0.00 0.00 -1.55 0.00 0.00 70.33 68.46 3d5b n THR 70 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3d5b n GLY 71 N 2.22 2.37 3.94 1.09 0.00 -1.26 -5.02 105.19 108.53 3d5b n GLY 71 Ca -0.28 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.47 3d5b n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d5b s ARG 72 N -0.27 1.66 0.00 1.61 1.81 -1.26 -5.08 118.95 117.42 3d5b s ARG 72 Ca 0.00 -0.45 0.00 0.00 -1.72 0.00 0.00 55.73 53.56 3d5b s ARG 72 Cb 0.00 -2.10 0.00 0.00 -0.45 0.00 0.00 34.95 32.40 3d5b s ARG 72 CO 0.00 -1.62 0.00 0.00 -0.68 0.00 0.00 175.30 173.00 3d5b n ALA 73 N -3.15 0.00 0.00 2.13 0.00 -1.26 -4.98 120.51 113.24 3d5b n ALA 73 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 3d5b n ALA 73 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 3d5b n ALA 73 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3d5b n ARG 74 N 0.00 0.00 -3.99 0.00 0.63 -1.26 -4.94 116.66 107.10 3d5b n ARG 74 Ca 0.00 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.82 3d5b n ARG 74 Cb 0.00 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 32.88 3d5b n ARG 74 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 3d5b s HIS 75 N 0.00 0.54 0.00 -0.14 0.09 -1.26 -5.12 115.29 109.39 3d5b s HIS 75 Ca 0.00 -0.91 0.00 0.00 -0.00 0.00 0.00 55.06 54.15 3d5b s HIS 75 Cb 0.00 0.23 0.00 0.00 -0.00 0.00 0.00 32.58 32.81 3d5b s HIS 75 CO 0.00 -1.15 0.00 0.41 -0.00 0.00 0.00 174.74 174.00 3d5b n GLY 76 N -0.47 0.42 4.02 -2.22 0.00 -1.26 -4.50 105.19 101.18 3d5b n GLY 76 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 3d5b n GLY 76 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3d5b s ASP 77 N -0.23 5.08 0.06 1.61 -4.77 -1.23 -0.95 116.67 116.23 3d5b s ASP 77 Ca 0.00 -0.67 0.28 0.00 -3.30 0.00 0.00 52.55 48.86 3d5b s ASP 77 Cb 0.00 0.05 1.09 0.00 -1.09 0.00 0.00 42.92 42.97 3d5b s ASP 77 CO 0.00 -1.32 1.87 -0.38 0.70 0.00 0.00 175.17 176.03 3d5b n ILE 78 N -2.28 0.17 0.41 2.11 -0.00 -1.26 -3.50 119.36 115.02 3d5b n ILE 78 Ca 0.14 -0.09 0.05 0.00 -0.00 0.00 0.00 62.75 62.85 3d5b n ILE 78 Cb 0.61 -0.50 0.23 0.00 -0.00 0.00 0.00 39.64 39.97 3d5b n ILE 78 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 3d5b n GLY 79 N 1.44 -0.64 3.73 7.39 0.00 -1.26 -4.29 105.19 111.57 3d5b n GLY 79 Ca 0.07 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3d5b n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d5b s ALA 80 N -2.66 3.54 0.38 4.61 0.00 -1.23 -2.14 121.76 124.26 3d5b s ALA 80 Ca 0.08 1.12 0.16 0.00 0.00 0.00 0.00 51.96 53.31 3d5b s ALA 80 Cb 0.06 -3.49 1.04 0.00 0.00 0.00 0.00 23.12 20.72 3d5b s ALA 80 CO 0.15 -0.56 1.77 -1.35 0.00 0.00 0.00 175.76 175.77 3d5b h PRO 81 N 5.62 0.44 -1.22 0.00 0.11 -1.85 0.85 132.00 135.96 3d5b h PRO 81 Ca -0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3d5b h PRO 81 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3d5b h PRO 81 CO 0.79 0.29 0.00 0.44 -0.21 0.00 0.00 178.00 179.31 3d5b n ILE 82 N -4.67 0.86 -3.26 4.15 -5.35 -1.26 -4.09 119.36 105.76 3d5b n ILE 82 Ca 0.25 -0.02 -0.25 0.00 -0.27 0.00 0.00 62.75 62.46 3d5b n ILE 82 Cb 0.81 -0.94 -0.07 0.00 -1.74 0.00 0.00 39.64 37.71 3d5b n ILE 82 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3d5b n PHE 83 N 0.64 1.84 0.00 4.28 3.01 0.29 -5.05 117.46 122.47 3d5b n PHE 83 Ca 0.00 -3.88 0.00 0.00 1.01 0.00 0.00 57.45 54.58 3d5b n PHE 83 Cb 0.41 -0.46 0.00 0.00 -0.01 0.00 0.00 39.48 39.42 3d5b n PHE 83 CO 0.00 0.00 0.00 1.55 1.01 0.00 0.00 176.76 179.32 3d5b n VAL 84 N 0.87 0.00 0.00 -4.37 3.14 -1.26 0.56 118.33 117.27 3d5b n VAL 84 Ca 0.26 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.64 3d5b n VAL 84 Cb 0.48 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.26 3d5b n VAL 84 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3d5b n GLY 85 N 0.00 2.37 2.86 7.55 0.00 -1.26 -5.09 105.19 111.62 3d5b n GLY 85 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 3d5b n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d5b n GLY 86 N -0.55 -3.58 3.76 -0.02 0.00 0.19 -4.92 105.19 100.07 3d5b n GLY 86 Ca 0.00 -1.34 -0.41 0.00 0.00 0.00 0.00 46.02 44.26 3d5b n GLY 86 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d5b s GLY 87 N -3.34 2.56 0.47 -0.02 0.00 -0.91 -4.85 107.32 101.23 3d5b s GLY 87 Ca 0.60 1.42 -0.23 0.00 0.00 0.00 0.00 44.72 46.51 3d5b s GLY 87 CO 0.49 2.26 1.18 1.55 0.00 0.00 0.00 173.10 178.58 3d5b n VAL 88 N 1.54 2.93 0.05 1.40 3.14 -1.12 -4.00 118.33 122.28 3d5b n VAL 88 Ca 0.04 -0.50 -0.02 0.00 -2.96 0.00 0.00 64.34 60.90 3d5b n VAL 88 Cb 0.40 -1.43 -0.01 0.00 -1.06 0.00 0.00 33.84 31.73 3d5b n VAL 88 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 3d5b h VAL 89 N 1.61 0.00 -0.69 1.55 2.07 -1.92 -3.25 116.25 115.61 3d5b h VAL 89 Ca -0.48 -0.14 -0.41 0.00 0.82 0.00 0.00 66.70 66.49 3d5b h VAL 89 Cb 1.32 0.00 -0.41 0.00 -1.52 0.00 0.00 31.29 30.67 3d5b h VAL 89 CO 0.57 0.00 -0.97 0.49 0.02 0.00 0.00 177.57 177.68 3d5b n PHE 90 N -2.82 2.05 -1.68 1.57 3.72 -1.26 -4.86 117.46 114.18 3d5b n PHE 90 Ca -0.02 -2.30 -0.44 0.00 -0.05 0.00 0.00 57.45 54.64 3d5b n PHE 90 Cb 0.06 -0.28 -0.03 0.00 -0.94 0.00 0.00 39.48 38.30 3d5b n PHE 90 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3d5b n GLY 91 N -0.60 0.83 3.68 1.37 0.00 -1.26 -4.89 105.19 104.33 3d5b n GLY 91 Ca 0.25 0.49 -0.43 0.00 0.00 0.00 0.00 46.02 46.33 3d5b n GLY 91 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3d5b n PRO 92 N 2.06 2.68 -3.62 1.61 -0.04 -1.26 -4.71 135.00 131.71 3d5b n PRO 92 Ca 0.11 0.98 -0.20 0.00 -0.04 0.00 0.00 63.50 64.35 3d5b n PRO 92 Cb 0.32 -2.86 -0.01 0.00 -0.04 0.00 0.00 33.50 30.91 3d5b n PRO 92 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3d5b s LYS 93 N 2.98 3.24 0.43 0.54 -0.14 -1.26 -3.36 119.74 122.17 3d5b s LYS 93 Ca 0.84 -0.89 -0.25 0.00 -1.36 0.00 0.00 55.97 54.30 3d5b s LYS 93 Cb -0.52 -2.83 -0.09 0.00 -1.68 0.00 0.00 37.83 32.70 3d5b s LYS 93 CO 0.40 0.18 1.26 -0.35 -0.76 0.00 0.00 175.35 176.08 3d5b n PRO 94 N -1.58 1.88 -3.59 -1.68 -0.04 -1.03 -4.86 135.00 124.11 3d5b n PRO 94 Ca -0.03 0.67 -0.06 0.00 -0.04 0.00 0.00 63.50 64.04 3d5b n PRO 94 Cb 0.58 -2.38 -0.03 0.00 -0.04 0.00 0.00 33.50 31.62 3d5b n PRO 94 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 3d5b s ARG 95 N -2.25 0.38 0.49 0.54 1.04 -1.26 -5.01 118.95 112.88 3d5b s ARG 95 Ca 0.62 -0.02 -0.21 0.00 -1.04 0.00 0.00 55.73 55.08 3d5b s ARG 95 Cb -0.50 0.18 -0.08 0.00 -2.04 0.00 0.00 34.95 32.51 3d5b s ARG 95 CO 0.57 -0.14 1.07 0.34 -0.04 0.00 0.00 175.30 177.10 3d5b s ASP 96 N -1.60 6.23 0.00 -2.89 2.15 -1.26 -3.49 116.67 115.82 3d5b s ASP 96 Ca 0.05 2.02 0.08 0.00 0.43 0.00 0.00 52.55 55.13 3d5b s ASP 96 Cb -0.01 -2.57 0.21 0.00 -0.30 0.00 0.00 42.92 40.25 3d5b s ASP 96 CO -0.04 -0.86 1.13 -1.22 -0.17 0.00 0.00 175.17 174.01 3d5b n TYR 97 N -0.92 0.30 -2.71 -5.34 4.01 -1.26 -4.99 117.16 106.25 3d5b n TYR 97 Ca 0.09 -0.42 -0.21 0.00 -0.16 0.00 0.00 57.90 57.20 3d5b n TYR 97 Cb 0.52 -0.03 0.05 0.00 -0.31 0.00 0.00 39.34 39.57 3d5b n TYR 97 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3d5b s SER 98 N -0.96 5.15 0.00 7.72 1.04 -1.26 -4.56 113.70 120.84 3d5b s SER 98 Ca 0.17 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.41 3d5b s SER 98 Cb 0.09 -0.61 0.00 0.00 0.10 0.00 0.00 66.02 65.60 3d5b s SER 98 CO 0.12 -1.23 0.00 0.00 0.98 0.00 0.00 173.24 173.11 3d5b n TYR 99 N -2.36 0.00 -3.67 5.02 4.11 -1.26 -5.01 117.16 113.99 3d5b n TYR 99 Ca 0.10 0.00 -0.28 0.00 -0.00 0.00 0.00 57.90 57.72 3d5b n TYR 99 Cb 0.60 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.83 3d5b n TYR 99 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.86 177.85 3d5b s THR 100 N -1.43 1.74 0.18 -3.48 2.01 -1.26 -5.04 115.64 108.36 3d5b s THR 100 Ca 0.00 -3.54 -0.31 0.00 0.31 0.00 0.00 61.69 58.15 3d5b s THR 100 Cb 0.00 -2.16 -0.10 0.00 0.01 0.00 0.00 72.50 70.25 3d5b s THR 100 CO 0.00 -1.11 1.54 -0.22 -0.69 0.00 0.00 174.62 174.14 3d5b s LEU 101 N -0.77 4.37 0.15 4.42 2.96 -1.26 -4.89 118.68 123.67 3d5b s LEU 101 Ca 0.28 2.62 -0.34 0.00 -0.22 0.00 0.00 54.13 56.48 3d5b s LEU 101 Cb -0.01 -3.60 -0.16 0.00 0.50 0.00 0.00 46.19 42.92 3d5b s LEU 101 CO -0.18 -0.80 1.15 -2.65 -1.32 0.00 0.00 176.35 172.55 3d5b n PRO 102 N 3.61 1.03 -0.17 0.98 -0.02 -1.26 -4.79 135.00 134.38 3d5b n PRO 102 Ca 0.12 0.37 -0.04 0.00 -2.02 0.00 0.00 63.50 61.93 3d5b n PRO 102 Cb 0.39 -1.86 0.06 0.00 -0.02 0.00 0.00 33.50 32.07 3d5b n PRO 102 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3d5b h LYS 103 N 3.38 0.42 -0.71 -0.52 1.57 -2.00 -2.02 116.57 116.69 3d5b h LYS 103 Ca -0.44 -0.03 0.12 0.00 -1.87 0.00 0.00 60.65 58.44 3d5b h LYS 103 Cb 1.35 -0.10 -0.13 0.00 0.08 0.00 0.00 32.23 33.44 3d5b h LYS 103 CO 0.70 0.28 -0.34 0.87 -0.57 0.00 0.00 179.45 180.39 3d5b h LYS 104 N 0.43 -0.11 -0.77 3.15 6.56 -2.00 0.98 116.57 124.82 3d5b h LYS 104 Ca 0.24 0.01 0.01 0.00 -1.06 0.00 0.00 60.65 59.85 3d5b h LYS 104 Cb 0.20 0.02 -0.04 0.00 -0.57 0.00 0.00 32.23 31.84 3d5b h LYS 104 CO -0.20 -0.07 0.50 0.28 -2.06 0.00 0.00 179.45 177.90 3d5b h VAL 105 N -0.11 1.18 -0.57 0.50 2.07 -1.75 0.26 116.25 117.83 3d5b h VAL 105 Ca 0.27 -0.35 0.12 0.00 0.82 0.00 0.00 66.70 67.56 3d5b h VAL 105 Cb 0.56 0.07 -0.10 0.00 -1.52 0.00 0.00 31.29 30.30 3d5b h VAL 105 CO -0.77 0.19 -0.05 0.03 0.02 0.00 0.00 177.57 176.99 3d5b h ARG 106 N 1.02 0.07 -0.00 1.57 2.47 -0.22 0.64 114.38 119.92 3d5b h ARG 106 Ca 0.29 -0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.96 3d5b h ARG 106 Cb -0.09 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.22 3d5b h ARG 106 CO -0.07 0.05 -0.15 0.87 0.56 0.00 0.00 179.97 181.22 3d5b h LYS 107 N 0.07 0.11 -0.91 0.04 1.57 -0.82 -2.98 116.57 113.65 3d5b h LYS 107 Ca 0.29 -0.11 0.25 0.00 -1.87 0.00 0.00 60.65 59.21 3d5b h LYS 107 Cb 0.46 0.03 -0.14 0.00 0.08 0.00 0.00 32.23 32.66 3d5b h LYS 107 CO -0.52 0.86 0.35 0.87 -0.57 0.00 0.00 179.45 180.44 3d5b h LYS 108 N -0.60 0.27 0.57 3.15 1.79 -0.03 0.16 116.57 121.88 3d5b h LYS 108 Ca -0.02 -0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.41 3d5b h LYS 108 Cb 0.91 -0.06 0.01 0.00 -1.58 0.00 0.00 32.23 31.51 3d5b h LYS 108 CO 0.03 0.18 -0.28 0.78 -1.08 0.00 0.00 179.45 179.08 3d5b h GLY 109 N 0.27 -0.80 -0.19 3.86 0.00 -0.94 -1.61 103.07 103.67 3d5b h GLY 109 Ca 0.60 0.30 0.30 0.00 0.00 0.00 0.00 47.33 48.52 3d5b h GLY 109 CO -0.62 -0.29 0.74 -2.00 0.00 0.00 0.00 176.54 174.37 3d5b h LEU 110 N -0.99 0.19 0.35 3.11 5.85 -1.00 0.71 115.31 123.53 3d5b h LEU 110 Ca -0.08 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 3d5b h LEU 110 Cb 0.65 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.69 3d5b h LEU 110 CO 0.13 0.04 -0.17 0.00 -0.34 0.00 0.00 178.44 178.10 3d5b h ALA 111 N 1.52 -0.53 -0.52 1.25 0.00 -0.86 -2.58 119.26 117.54 3d5b h ALA 111 Ca 0.56 -0.10 0.14 0.00 0.00 0.00 0.00 54.91 55.50 3d5b h ALA 111 Cb 1.86 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.81 3d5b h ALA 111 CO -0.13 -0.50 0.37 0.52 0.00 0.00 0.00 179.25 179.51 3d5b h MET 112 N -0.99 0.07 0.20 0.00 2.86 -0.26 0.15 114.93 116.96 3d5b h MET 112 Ca -0.05 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 3d5b h MET 112 Cb 0.36 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.01 3d5b h MET 112 CO 0.08 0.04 -0.10 0.00 1.06 0.00 0.00 176.91 178.00 3d5b h ALA 113 N 1.74 -0.81 -0.85 6.32 0.00 0.36 0.11 119.26 126.13 3d5b h ALA 113 Ca 0.25 -0.06 0.16 0.00 0.00 0.00 0.00 54.91 55.25 3d5b h ALA 113 Cb 0.89 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 3d5b h ALA 113 CO -0.02 -0.79 0.56 0.28 0.00 0.00 0.00 179.25 179.28 3d5b h VAL 114 N -0.34 0.79 -0.33 0.00 2.07 -1.26 -0.44 116.25 116.74 3d5b h VAL 114 Ca -0.03 -0.19 -0.09 0.00 0.82 0.00 0.00 66.70 67.20 3d5b h VAL 114 Cb 0.21 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 3d5b h VAL 114 CO 0.05 0.10 -0.19 0.00 0.02 0.00 0.00 177.57 177.55 3d5b h ALA 115 N 1.62 1.06 0.45 1.67 0.00 -0.66 -2.02 119.26 121.37 3d5b h ALA 115 Ca 0.43 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3d5b h ALA 115 Cb 0.84 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3d5b h ALA 115 CO -0.18 0.57 -0.22 0.22 0.00 0.00 0.00 179.25 179.65 3d5b h ASP 116 N 0.54 -0.51 -0.41 0.00 3.58 0.96 0.32 116.42 120.90 3d5b h ASP 116 Ca 0.09 0.02 0.12 0.00 0.42 0.00 0.00 57.03 57.67 3d5b h ASP 116 Cb 0.63 0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.79 3d5b h ASP 116 CO 0.04 -0.31 0.33 -0.09 -2.88 0.00 0.00 179.24 176.33 3d5b h ARG 117 N -0.71 0.00 -0.06 0.28 9.65 -1.56 0.24 114.38 122.21 3d5b h ARG 117 Ca -0.06 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.78 3d5b h ARG 117 Cb 0.46 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.04 3d5b h ARG 117 CO 0.10 0.00 -0.11 0.00 2.80 0.00 0.00 179.97 182.76 3d5b h ALA 118 N 1.72 0.09 -0.86 2.80 0.00 -1.24 0.37 119.26 122.14 3d5b h ALA 118 Ca 0.20 -0.33 0.06 0.00 0.00 0.00 0.00 54.91 54.84 3d5b h ALA 118 Cb 0.86 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.57 3d5b h ALA 118 CO -0.00 -0.04 0.53 -0.09 0.00 0.00 0.00 179.25 179.64 3d5b h ARG 119 N -0.32 0.93 -0.61 0.00 2.43 0.28 0.11 114.38 117.19 3d5b h ARG 119 Ca 0.00 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 3d5b h ARG 119 Cb 0.68 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 29.99 3d5b h ARG 119 CO 0.02 0.61 0.22 0.93 -1.51 0.00 0.00 179.97 180.24 3d5b h GLU 120 N 0.96 0.91 0.00 0.20 5.08 -0.99 -3.47 114.58 117.26 3d5b h GLU 120 Ca 0.38 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 3d5b h GLU 120 Cb 0.19 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.29 3d5b h GLU 120 CO -0.18 0.77 0.00 0.41 -1.00 0.00 0.00 179.01 179.01 3d5b n GLY 121 N -0.95 0.68 0.00 -3.84 0.00 0.40 -5.05 105.19 96.42 3d5b n GLY 121 Ca 0.05 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.60 3d5b n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d5b n LYS 122 N 0.00 0.74 -2.51 1.61 4.76 0.07 -4.97 118.16 117.86 3d5b n LYS 122 Ca 0.00 -0.03 -0.41 0.00 -2.87 0.00 0.00 58.31 55.00 3d5b n LYS 122 Cb 0.00 -0.26 -0.01 0.00 -1.84 0.00 0.00 35.03 32.91 3d5b n LYS 122 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3d5b s LEU 123 N -0.23 3.66 -0.46 -0.35 2.96 -1.22 -2.95 118.68 120.09 3d5b s LEU 123 Ca 0.00 -2.08 -0.21 0.00 -0.22 0.00 0.00 54.13 51.63 3d5b s LEU 123 Cb 0.00 -2.58 0.03 0.00 0.50 0.00 0.00 46.19 44.14 3d5b s LEU 123 CO 0.00 -1.48 0.66 -0.22 -1.32 0.00 0.00 176.35 173.99 3d5b s LEU 124 N 5.24 4.56 0.16 -0.68 2.96 -0.74 -4.35 118.68 125.83 3d5b s LEU 124 Ca 0.54 -0.45 -0.30 0.00 -0.22 0.00 0.00 54.13 53.70 3d5b s LEU 124 Cb 0.02 -2.68 -0.07 0.00 0.50 0.00 0.00 46.19 43.96 3d5b s LEU 124 CO 0.04 -0.83 1.05 -0.76 -1.32 0.00 0.00 176.35 174.53 3d5b s LEU 125 N 2.87 4.50 0.38 -0.68 1.43 -1.08 -3.27 118.68 122.83 3d5b s LEU 125 Ca 0.22 2.00 0.04 0.00 -1.03 0.00 0.00 54.13 55.35 3d5b s LEU 125 Cb -0.15 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.43 3d5b s LEU 125 CO 0.18 -0.16 0.07 0.68 0.23 0.00 0.00 176.35 177.35 3d5b s VAL 126 N -0.19 1.05 0.19 -1.59 -7.23 -0.89 0.20 120.40 111.95 3d5b s VAL 126 Ca 0.48 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.65 3d5b s VAL 126 Cb -0.27 -2.59 0.00 0.00 0.56 0.00 0.00 36.38 34.08 3d5b s VAL 126 CO 0.33 0.00 0.00 1.21 -0.31 0.00 0.00 175.10 176.33 3d5b n GLU 127 N -0.85 0.00 -1.81 4.82 4.07 -1.18 -1.42 120.64 124.27 3d5b n GLU 127 Ca -0.06 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 56.66 3d5b n GLU 127 Cb 0.66 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 32.01 3d5b n GLU 127 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3d5b s ALA 128 N -2.00 2.14 -0.58 4.31 0.00 -1.26 -4.92 121.76 119.45 3d5b s ALA 128 Ca 0.00 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 51.86 3d5b s ALA 128 Cb 0.00 -4.25 0.15 0.00 0.00 0.00 0.00 23.12 19.02 3d5b s ALA 128 CO 0.00 -3.79 0.36 -0.06 0.00 0.00 0.00 175.76 172.27 3d5b s PHE 129 N 9.80 3.30 -1.93 0.00 0.08 -1.26 -4.92 117.98 123.06 3d5b s PHE 129 Ca 0.84 -2.97 0.18 0.00 0.12 0.00 0.00 56.93 55.10 3d5b s PHE 129 Cb -0.18 -3.00 1.08 0.00 -0.57 0.00 0.00 43.02 40.34 3d5b s PHE 129 CO 0.26 -0.78 1.50 0.00 -0.10 0.00 0.00 175.22 176.10 3d5b n ALA 130 N 3.22 2.16 -2.01 5.36 0.00 -1.26 -4.55 120.51 123.43 3d5b n ALA 130 Ca 0.07 -0.11 -0.26 0.00 0.00 0.00 0.00 53.44 53.14 3d5b n ALA 130 Cb 0.35 -1.30 -0.07 0.00 0.00 0.00 0.00 19.45 18.43 3d5b n ALA 130 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3d5b s GLY 131 N -2.07 0.02 0.37 0.00 0.00 -1.26 -4.79 107.32 99.59 3d5b s GLY 131 Ca 0.26 -1.98 0.15 0.00 0.00 0.00 0.00 44.72 43.15 3d5b s GLY 131 CO 0.22 3.64 1.79 -0.39 0.00 0.00 0.00 173.10 178.35 3d5b h VAL 132 N 6.39 0.60 -2.08 1.40 -1.51 -1.96 -3.45 116.25 115.64 3d5b h VAL 132 Ca 0.18 -0.17 -0.01 0.00 -1.23 0.00 0.00 66.70 65.46 3d5b h VAL 132 Cb 0.95 0.05 -0.00 0.00 -2.13 0.00 0.00 31.29 30.17 3d5b h VAL 132 CO 1.20 0.09 -0.01 0.59 -1.23 0.00 0.00 177.57 178.21 3d5b n ASN 133 N -4.66 -0.04 -3.65 4.19 3.02 -1.26 -5.05 115.26 107.81 3d5b n ASN 133 Ca 0.24 -1.07 -0.41 0.00 -0.03 0.00 0.00 54.58 53.31 3d5b n ASN 133 Cb 0.76 0.08 -0.01 0.00 -0.61 0.00 0.00 39.78 40.01 3d5b n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d5b n GLY 134 N -0.02 4.39 2.81 7.41 0.00 -1.26 -4.74 105.19 113.78 3d5b n GLY 134 Ca 0.00 -1.58 -0.30 0.00 0.00 0.00 0.00 46.02 44.14 3d5b n GLY 134 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3d5b s LYS 135 N 2.97 0.97 0.24 1.61 2.47 -1.26 -4.80 119.74 121.94 3d5b s LYS 135 Ca 0.51 -1.37 -0.03 0.00 -1.56 0.00 0.00 55.97 53.53 3d5b s LYS 135 Cb 0.15 -2.36 0.49 0.00 -1.46 0.00 0.00 37.83 34.65 3d5b s LYS 135 CO -0.08 -0.99 1.27 0.25 0.16 0.00 0.00 175.35 175.96 3d5b n THR 136 N 4.58 -0.34 -0.32 3.43 -2.24 -1.26 0.30 114.28 118.43 3d5b n THR 136 Ca 0.00 1.83 0.03 0.00 -2.27 0.00 0.00 64.05 63.64 3d5b n THR 136 Cb 0.41 -2.59 0.10 0.00 -2.10 0.00 0.00 70.33 66.15 3d5b n THR 136 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3d5b h LYS 137 N 0.00 -0.01 -0.31 -0.78 1.57 -1.95 0.97 116.57 116.07 3d5b h LYS 137 Ca 0.44 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 59.28 3d5b h LYS 137 Cb 0.79 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.04 3d5b h LYS 137 CO -0.80 -0.01 -0.10 0.93 -0.57 0.00 0.00 179.45 178.90 3d5b h GLU 138 N -0.01 -0.03 0.35 3.15 5.08 -0.53 0.08 114.58 122.66 3d5b h GLU 138 Ca 0.40 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.75 3d5b h GLU 138 Cb 0.64 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 3d5b h GLU 138 CO -0.91 -0.02 -0.22 0.35 -1.00 0.00 0.00 179.01 177.21 3d5b h PHE 139 N -0.03 -0.57 -0.07 4.33 3.57 -0.87 0.13 116.94 123.42 3d5b h PHE 139 Ca 0.15 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.67 3d5b h PHE 139 Cb 0.27 0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 3d5b h PHE 139 CO -0.31 -0.34 0.05 1.25 -2.23 0.00 0.00 178.31 176.73 3d5b h LEU 140 N -0.55 0.00 -0.52 0.59 5.85 -1.10 0.62 115.31 120.20 3d5b h LEU 140 Ca -0.04 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.52 3d5b h LEU 140 Cb 0.46 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 3d5b h LEU 140 CO 0.03 0.00 -0.65 0.00 -0.34 0.00 0.00 178.44 177.49 3d5b h ALA 141 N 1.96 0.71 0.11 1.25 0.00 -0.10 -1.42 119.26 121.77 3d5b h ALA 141 Ca 0.03 -0.56 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 3d5b h ALA 141 Cb 0.14 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3d5b h ALA 141 CO -0.00 0.74 -0.05 2.35 0.00 0.00 0.00 179.25 182.28 3d5b h TRP 142 N 0.27 -0.14 -0.96 0.00 7.01 0.19 -3.03 115.95 119.29 3d5b h TRP 142 Ca -0.01 -0.00 0.17 0.00 2.11 0.00 0.00 58.89 61.15 3d5b h TRP 142 Cb 1.19 0.05 -0.10 0.00 -2.10 0.00 0.00 29.16 28.19 3d5b h TRP 142 CO 0.04 0.35 0.56 0.00 -2.79 0.00 0.00 178.44 176.60 3d5b h ALA 143 N -0.26 1.54 -0.08 2.65 0.00 0.02 0.70 119.26 123.83 3d5b h ALA 143 Ca -0.02 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.01 3d5b h ALA 143 Cb 0.55 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 3d5b h ALA 143 CO 0.03 -0.03 -0.16 -0.22 0.00 0.00 0.00 179.25 178.87 3d5b h LYS 144 N 0.75 -0.21 -0.15 0.00 3.64 -1.32 0.14 116.57 119.42 3d5b h LYS 144 Ca 0.54 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.93 3d5b h LYS 144 Cb 0.79 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 3d5b h LYS 144 CO -0.37 -0.14 0.00 0.39 -2.27 0.00 0.00 179.45 177.06 3d5b n GLU 145 N -5.29 1.10 -0.03 1.90 1.02 -0.16 -3.13 120.64 116.04 3d5b n GLU 145 Ca -0.04 -0.14 -0.00 0.00 -0.02 0.00 0.00 57.16 56.96 3d5b n GLU 145 Cb 0.21 -1.09 -0.08 0.00 -0.02 0.00 0.00 31.44 30.46 3d5b n GLU 145 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3d5b n ALA 146 N -0.34 2.04 0.00 0.62 0.00 0.06 -5.01 120.51 117.87 3d5b n ALA 146 Ca 0.01 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.98 3d5b n ALA 146 Cb 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.38 3d5b n ALA 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d5b n GLY 147 N 2.18 1.51 2.35 0.00 0.00 -0.01 -5.05 105.19 106.16 3d5b n GLY 147 Ca -0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 3d5b n GLY 147 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d5b n LEU 148 N 0.00 2.33 0.00 0.99 4.77 0.27 -4.92 117.00 120.44 3d5b n LEU 148 Ca 0.00 -5.14 0.08 0.00 -0.03 0.00 0.00 56.01 50.92 3d5b n LEU 148 Cb 0.00 -0.16 0.45 0.00 -2.33 0.00 0.00 43.42 41.38 3d5b n LEU 148 CO 0.00 2.05 0.69 -0.90 -1.33 0.00 0.00 177.39 177.91 3d5b n ASP 149 N 1.12 0.00 0.00 -1.43 5.75 -1.26 -4.28 116.55 116.45 3d5b n ASP 149 Ca 0.26 -0.31 0.00 0.00 -0.01 0.00 0.00 54.79 54.74 3d5b n ASP 149 Cb 0.45 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.45 3d5b n ASP 149 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3d5b n GLY 150 N 0.01 0.72 0.12 6.12 0.00 -1.26 -4.94 105.19 105.96 3d5b n GLY 150 Ca 0.10 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.26 3d5b n GLY 150 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d5b n SER 151 N 0.00 0.36 -3.70 1.61 7.64 -1.26 -4.72 113.62 113.54 3d5b n SER 151 Ca 0.00 -1.26 -0.13 0.00 1.01 0.00 0.00 58.87 58.49 3d5b n SER 151 Cb 0.00 -0.01 -0.14 0.00 -1.01 0.00 0.00 64.21 63.06 3d5b n SER 151 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 3d5b s GLU 152 N -1.98 0.15 0.22 1.43 2.02 -1.26 -5.11 118.70 114.16 3d5b s GLU 152 Ca 0.39 0.59 -0.31 0.00 0.02 0.00 0.00 54.97 55.66 3d5b s GLU 152 Cb 0.19 -0.12 -0.11 0.00 0.10 0.00 0.00 34.13 34.19 3d5b s GLU 152 CO 0.31 -0.22 1.57 -1.54 0.02 0.00 0.00 175.26 175.40 3d5b s SER 153 N 1.75 6.52 -0.03 -0.19 1.04 -1.26 -4.70 113.70 116.84 3d5b s SER 153 Ca -0.04 2.74 0.06 0.00 0.48 0.00 0.00 55.95 59.18 3d5b s SER 153 Cb -0.11 -2.61 -0.02 0.00 0.10 0.00 0.00 66.02 63.37 3d5b s SER 153 CO -0.08 -0.84 -0.19 -0.69 0.98 0.00 0.00 173.24 172.42 3d5b s VAL 154 N 0.67 2.63 -0.37 5.02 1.01 -0.93 0.86 120.40 129.30 3d5b s VAL 154 Ca 0.67 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 61.61 3d5b s VAL 154 Cb -0.45 -2.00 0.03 0.00 0.00 0.00 0.00 36.38 33.96 3d5b s VAL 154 CO 0.37 0.55 0.21 -0.22 0.00 0.00 0.00 175.10 176.01 3d5b s LEU 155 N -0.78 4.71 -0.45 3.92 2.96 0.02 -0.95 118.68 128.12 3d5b s LEU 155 Ca 0.11 -1.00 -0.17 0.00 -0.22 0.00 0.00 54.13 52.85 3d5b s LEU 155 Cb -0.10 -2.02 0.04 0.00 0.50 0.00 0.00 46.19 44.61 3d5b s LEU 155 CO 0.00 -0.38 0.46 -0.22 -1.32 0.00 0.00 176.35 174.89 3d5b s LEU 156 N 1.55 5.05 -0.39 -0.68 2.96 0.40 -2.18 118.68 125.39 3d5b s LEU 156 Ca 0.02 -0.87 -0.06 0.00 -0.22 0.00 0.00 54.13 53.00 3d5b s LEU 156 Cb -0.19 -2.35 0.08 0.00 0.50 0.00 0.00 46.19 44.23 3d5b s LEU 156 CO 0.07 -0.65 0.19 -0.69 -1.32 0.00 0.00 176.35 173.94 3d5b s VAL 157 N 2.12 3.73 0.04 1.68 1.01 -1.00 -1.11 120.40 126.86 3d5b s VAL 157 Ca 0.11 -1.58 -0.02 0.00 0.00 0.00 0.00 61.98 60.48 3d5b s VAL 157 Cb -0.19 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 3d5b s VAL 157 CO 0.12 -0.48 0.01 0.28 0.00 0.00 0.00 175.10 175.03 3d5b s THR 158 N 1.31 0.17 0.07 3.92 -1.32 -1.17 -0.26 115.64 118.37 3d5b s THR 158 Ca 0.03 -1.39 -0.12 0.00 -1.21 0.00 0.00 61.69 59.00 3d5b s THR 158 Cb -0.22 -1.06 -0.26 0.00 -1.51 0.00 0.00 72.50 69.44 3d5b s THR 158 CO -0.00 -0.77 1.15 1.23 -2.21 0.00 0.00 174.62 174.02 3d5b h GLY 159 N 3.61 0.64 -4.88 6.08 0.00 -1.94 -3.38 103.07 103.19 3d5b h GLY 159 Ca -0.33 -1.29 -0.53 0.00 0.00 0.00 0.00 47.33 45.18 3d5b h GLY 159 CO 0.56 1.14 1.03 0.21 0.00 0.00 0.00 176.54 179.47 3d5b s ASN 160 N -7.33 6.51 0.07 0.19 3.04 -1.26 -4.88 114.94 111.28 3d5b s ASN 160 Ca -0.08 2.65 0.25 0.00 0.04 0.00 0.00 52.86 55.72 3d5b s ASN 160 Cb 0.06 -2.57 1.01 0.00 -1.54 0.00 0.00 41.25 38.21 3d5b s ASN 160 CO 0.92 -0.93 1.80 -0.62 -3.04 0.00 0.00 177.10 175.22 3d5b n GLU 161 N 5.22 0.08 0.12 0.43 1.02 -1.26 -3.05 120.64 123.20 3d5b n GLU 161 Ca 0.16 0.13 -0.20 0.00 -0.02 0.00 0.00 57.16 57.23 3d5b n GLU 161 Cb 0.39 -1.60 -0.15 0.00 -0.02 0.00 0.00 31.44 30.06 3d5b n GLU 161 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3d5b h LEU 162 N 0.00 0.62 -1.37 -4.62 4.07 -1.96 -3.19 115.31 108.86 3d5b h LEU 162 Ca 0.00 -0.66 -0.03 0.00 0.08 0.00 0.00 57.88 57.27 3d5b h LEU 162 Cb 0.50 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 42.02 3d5b h LEU 162 CO 0.00 1.51 0.08 0.58 -1.08 0.00 0.00 178.44 179.54 3d5b h VAL 163 N 0.11 1.16 -0.00 1.22 2.07 -1.86 -2.45 116.25 116.49 3d5b h VAL 163 Ca -0.19 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.76 3d5b h VAL 163 Cb 2.05 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 32.63 3d5b h VAL 163 CO 0.24 0.21 -0.01 0.03 0.02 0.00 0.00 177.57 178.06 3d5b h ARG 164 N 0.50 -0.01 -0.54 1.57 -0.00 -1.57 -2.22 114.38 112.11 3d5b h ARG 164 Ca 0.12 0.00 0.11 0.00 -0.50 0.00 0.00 59.98 59.71 3d5b h ARG 164 Cb 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 29.97 30.06 3d5b h ARG 164 CO -0.00 -0.00 -0.11 0.54 0.00 0.00 0.00 179.97 180.39 3d5b n ARG 165 N -2.65 -0.05 0.00 0.04 5.12 -0.94 0.46 116.66 118.64 3d5b n ARG 165 Ca -0.00 0.84 0.00 0.00 -1.93 0.00 0.00 57.85 56.76 3d5b n ARG 165 Cb 0.01 -1.27 0.00 0.00 -1.16 0.00 0.00 32.46 30.04 3d5b n ARG 165 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3d5b n ALA 166 N -3.74 0.00 1.35 7.54 0.00 -0.84 -2.83 120.51 121.99 3d5b n ALA 166 Ca 0.09 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.61 3d5b n ALA 166 Cb 0.29 0.07 0.43 0.00 0.00 0.00 0.00 19.45 20.24 3d5b n ALA 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d5b n ALA 167 N -1.78 2.26 -0.20 0.00 0.00 -0.95 -3.67 120.51 116.16 3d5b n ALA 167 Ca 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 53.44 53.32 3d5b n ALA 167 Cb 0.00 -1.24 0.08 0.00 0.00 0.00 0.00 19.45 18.29 3d5b n ALA 167 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3d5b h ARG 168 N 0.00 0.57 0.00 0.00 2.43 0.17 -2.98 114.38 114.57 3d5b h ARG 168 Ca 0.00 -0.03 -0.31 0.00 -0.81 0.00 0.00 59.98 58.83 3d5b h ARG 168 Cb 0.00 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 29.37 3d5b h ARG 168 CO 0.00 0.38 -1.83 -1.71 -1.51 0.00 0.00 179.97 175.29 3d5b n ASN 169 N -4.85 0.74 -4.65 -3.80 2.85 -1.24 -4.89 115.26 99.42 3d5b n ASN 169 Ca 0.07 0.34 -0.55 0.00 -0.11 0.00 0.00 54.58 54.33 3d5b n ASN 169 Cb 0.17 0.11 -0.07 0.00 1.24 0.00 0.00 39.78 41.23 3d5b n ASN 169 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 3d5b n LEU 170 N -3.00 2.54 -0.19 1.20 7.94 -1.13 -4.86 117.00 119.50 3d5b n LEU 170 Ca -0.20 0.94 -0.07 0.00 -1.11 0.00 0.00 56.01 55.56 3d5b n LEU 170 Cb 1.07 -1.20 0.02 0.00 0.53 0.00 0.00 43.42 43.84 3d5b n LEU 170 CO 0.45 -0.40 1.04 1.55 -1.11 0.00 0.00 177.39 178.91 3d5b h PRO 171 N 8.55 0.74 -0.73 1.96 0.13 -1.90 -2.94 132.00 137.81 3d5b h PRO 171 Ca -0.43 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3d5b h PRO 171 Cb 1.31 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3d5b h PRO 171 CO 0.97 0.57 0.00 -2.67 -0.23 0.00 0.00 178.00 176.64 3d5b n TRP 172 N -4.63 0.41 -3.95 1.56 4.27 -1.26 -4.81 117.44 109.03 3d5b n TRP 172 Ca 0.03 -0.15 -0.09 0.00 -3.89 0.00 0.00 57.50 53.40 3d5b n TRP 172 Cb 0.08 -0.15 -0.10 0.00 -1.36 0.00 0.00 31.31 29.79 3d5b n TRP 172 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 3d5b s VAL 173 N -1.49 0.14 -0.08 -1.67 1.01 -1.11 -2.19 120.40 115.01 3d5b s VAL 173 Ca 0.12 -1.13 -0.01 0.00 0.00 0.00 0.00 61.98 60.95 3d5b s VAL 173 Cb 0.08 -0.88 0.03 0.00 0.00 0.00 0.00 36.38 35.61 3d5b s VAL 173 CO 0.05 -0.63 -0.01 0.68 0.00 0.00 0.00 175.10 175.19 3d5b s VAL 174 N -2.59 0.48 0.59 2.92 -7.23 -0.13 -4.79 120.40 109.65 3d5b s VAL 174 Ca -0.05 0.03 -0.13 0.00 -1.81 0.00 0.00 61.98 60.02 3d5b s VAL 174 Cb -0.01 -0.63 -0.05 0.00 0.56 0.00 0.00 36.38 36.25 3d5b s VAL 174 CO -0.05 0.26 1.02 0.28 -0.31 0.00 0.00 175.10 176.30 3d5b s THR 175 N 1.93 4.48 -0.21 5.32 -1.32 -1.26 -0.45 115.64 124.12 3d5b s THR 175 Ca 0.05 0.97 -0.28 0.00 -1.21 0.00 0.00 61.69 61.22 3d5b s THR 175 Cb -0.12 -3.71 0.13 0.00 -1.51 0.00 0.00 72.50 67.28 3d5b s THR 175 CO -0.06 -0.89 1.03 -0.22 -2.21 0.00 0.00 174.62 172.27 3d5b s LEU 176 N -4.76 -0.39 0.69 9.08 2.96 -0.27 -4.85 118.68 121.14 3d5b s LEU 176 Ca 0.58 0.58 -0.14 0.00 -0.22 0.00 0.00 54.13 54.93 3d5b s LEU 176 Cb -0.11 1.84 0.02 0.00 0.50 0.00 0.00 46.19 48.44 3d5b s LEU 176 CO 0.44 -0.25 1.10 0.00 -1.32 0.00 0.00 176.35 176.32 3d5b s ALA 177 N -0.53 2.41 0.17 5.97 0.00 -1.26 -3.02 121.76 125.50 3d5b s ALA 177 Ca 0.01 0.46 -0.15 0.00 0.00 0.00 0.00 51.96 52.28 3d5b s ALA 177 Cb -0.02 -3.30 0.13 0.00 0.00 0.00 0.00 23.12 19.92 3d5b s ALA 177 CO -0.02 -1.41 1.70 -1.00 0.00 0.00 0.00 175.76 175.03 3d5b h PRO 178 N -0.30 0.11 0.00 0.00 0.13 -1.90 0.17 132.00 130.22 3d5b h PRO 178 Ca -0.46 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3d5b h PRO 178 Cb 1.24 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3d5b h PRO 178 CO 0.53 0.07 0.00 0.93 -0.23 0.00 0.00 178.00 179.31 3d5b h GLU 179 N 0.12 0.00 0.00 0.86 3.07 -1.93 -3.14 114.58 113.55 3d5b h GLU 179 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 3d5b h GLU 179 Cb 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.21 3d5b h GLU 179 CO -0.35 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 177.67 3d5b n GLY 180 N 0.45 -0.52 3.48 -3.84 0.00 0.60 -4.71 105.19 100.65 3d5b n GLY 180 Ca 0.03 -0.02 -0.45 0.00 0.00 0.00 0.00 46.02 45.58 3d5b n GLY 180 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d5b n LEU 181 N -1.38 1.69 -4.16 0.99 4.77 -1.19 -4.86 117.00 112.87 3d5b n LEU 181 Ca 0.02 0.13 -0.26 0.00 -0.03 0.00 0.00 56.01 55.87 3d5b n LEU 181 Cb 0.04 -1.25 -0.16 0.00 -2.33 0.00 0.00 43.42 39.72 3d5b n LEU 181 CO 0.03 -0.95 -0.51 0.54 -1.33 0.00 0.00 177.39 175.18 3d5b s ASN 182 N 8.95 2.15 0.63 -1.43 2.20 -1.26 -5.03 114.94 121.14 3d5b s ASN 182 Ca 1.13 -0.34 0.33 0.00 -0.94 0.00 0.00 52.86 53.04 3d5b s ASN 182 Cb -0.80 -0.39 1.85 0.00 -2.00 0.00 0.00 41.25 39.91 3d5b s ASN 182 CO 0.44 0.19 2.13 -0.37 -2.94 0.00 0.00 177.10 176.55 3d5b h VAL 183 N 4.93 0.25 0.04 3.54 -1.51 -1.94 -2.41 116.25 119.15 3d5b h VAL 183 Ca -0.35 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.12 3d5b h VAL 183 Cb 1.16 0.85 0.00 0.00 -2.13 0.00 0.00 31.29 31.16 3d5b h VAL 183 CO 0.48 0.00 -0.02 0.22 -1.23 0.00 0.00 177.57 177.02 3d5b h TYR 184 N 0.00 -0.05 -0.84 5.19 3.20 -1.94 -2.52 116.97 120.01 3d5b h TYR 184 Ca 0.04 -0.00 0.18 0.00 3.14 0.00 0.00 58.73 62.09 3d5b h TYR 184 Cb 0.39 0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.62 3d5b h TYR 184 CO 0.00 -0.03 0.56 -0.44 -1.64 0.00 0.00 178.16 176.61 3d5b h ASP 185 N -0.09 0.42 0.34 -2.11 5.19 -1.93 -1.18 116.42 117.05 3d5b h ASP 185 Ca -0.01 0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.42 3d5b h ASP 185 Cb 0.04 -0.05 -0.00 0.00 0.18 0.00 0.00 39.33 39.50 3d5b h ASP 185 CO 0.01 0.19 -0.22 0.40 -3.12 0.00 0.00 179.24 176.50 3d5b h ILE 186 N 0.43 0.00 0.00 0.35 1.08 -1.52 -2.34 117.51 115.52 3d5b h ILE 186 Ca 0.43 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.90 3d5b h ILE 186 Cb 1.01 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.76 3d5b h ILE 186 CO -0.15 0.00 0.00 0.52 -0.69 0.00 0.00 178.15 177.83 3d5b n VAL 187 N -3.68 0.75 0.13 1.67 0.31 -0.86 -2.52 118.33 114.13 3d5b n VAL 187 Ca -0.06 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.28 3d5b n VAL 187 Cb 0.22 -0.87 -0.01 0.00 -0.91 0.00 0.00 33.84 32.27 3d5b n VAL 187 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 3d5b n ARG 188 N 0.47 5.40 -4.64 5.55 0.63 -0.50 -5.00 116.66 118.57 3d5b n ARG 188 Ca 0.00 -0.07 -0.29 0.00 -0.92 0.00 0.00 57.85 56.57 3d5b n ARG 188 Cb 0.41 -0.67 -0.09 0.00 0.45 0.00 0.00 32.46 32.56 3d5b n ARG 188 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3d5b s THR 189 N -1.15 1.30 -0.16 5.15 -4.23 -1.05 -5.03 115.64 110.49 3d5b s THR 189 Ca 0.01 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.54 3d5b s THR 189 Cb 0.02 -2.51 -0.23 0.00 1.34 0.00 0.00 72.50 71.12 3d5b s THR 189 CO 0.10 0.00 0.21 -0.62 -0.54 0.00 0.00 174.62 173.77 3d5b n GLU 190 N -1.04 0.70 -4.94 3.99 1.02 -0.65 -4.96 120.64 114.76 3d5b n GLU 190 Ca -0.11 0.20 -0.28 0.00 -0.02 0.00 0.00 57.16 56.95 3d5b n GLU 190 Cb 0.67 -1.65 -0.15 0.00 -0.02 0.00 0.00 31.44 30.29 3d5b n GLU 190 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3d5b s ARG 191 N -2.55 1.72 -0.15 3.49 0.52 0.25 -4.90 118.95 117.33 3d5b s ARG 191 Ca -0.21 -0.94 0.02 0.00 -0.52 0.00 0.00 55.73 54.07 3d5b s ARG 191 Cb 0.07 -1.77 0.02 0.00 0.52 0.00 0.00 34.95 33.79 3d5b s ARG 191 CO 0.74 0.47 -0.19 -1.17 0.02 0.00 0.00 175.30 175.16 3d5b s LEU 192 N -0.92 2.00 -0.07 2.53 0.20 -1.15 -0.80 118.68 120.47 3d5b s LEU 192 Ca 0.09 -0.58 -0.02 0.00 0.69 0.00 0.00 54.13 54.32 3d5b s LEU 192 Cb -0.09 -1.37 0.03 0.00 -0.43 0.00 0.00 46.19 44.33 3d5b s LEU 192 CO 0.01 0.02 0.03 -0.69 -0.29 0.00 0.00 176.35 175.43 3d5b s VAL 193 N 1.09 0.17 0.05 1.68 1.01 -0.93 -1.79 120.40 121.68 3d5b s VAL 193 Ca -0.01 0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.21 3d5b s VAL 193 Cb -0.14 -0.39 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 3d5b s VAL 193 CO -0.07 0.20 -0.08 0.00 0.00 0.00 0.00 175.10 175.15 3d5b s MET 194 N 2.06 0.56 0.28 2.72 0.23 -1.20 -2.38 119.30 121.56 3d5b s MET 194 Ca 0.05 -0.81 -0.30 0.00 -1.03 0.00 0.00 55.69 53.60 3d5b s MET 194 Cb -0.12 -0.29 -0.12 0.00 -1.53 0.00 0.00 34.83 32.76 3d5b s MET 194 CO -0.05 0.05 1.47 -3.47 -2.03 0.00 0.00 175.02 170.99 3d5b n ASP 195 N 1.34 3.22 -0.28 -1.18 2.03 0.64 -2.09 116.55 120.23 3d5b n ASP 195 Ca -0.22 1.16 0.05 0.00 0.52 0.00 0.00 54.79 56.30 3d5b n ASP 195 Cb 0.55 -1.51 0.20 0.00 -0.72 0.00 0.00 41.12 39.64 3d5b n ASP 195 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 3d5b h LEU 196 N 4.14 0.51 -1.18 -2.67 3.38 -1.59 0.12 115.31 118.02 3d5b h LEU 196 Ca -0.46 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 3d5b h LEU 196 Cb 1.26 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.98 3d5b h LEU 196 CO 0.75 0.24 0.30 -0.78 0.09 0.00 0.00 178.44 179.04 3d5b h ASP 197 N 0.63 0.78 0.62 -0.43 1.82 -1.90 -0.10 116.42 117.84 3d5b h ASP 197 Ca 0.43 -0.08 -0.07 0.00 -0.39 0.00 0.00 57.03 56.93 3d5b h ASP 197 Cb 0.57 -0.20 -0.01 0.00 0.68 0.00 0.00 39.33 40.37 3d5b h ASP 197 CO -0.34 0.67 -0.32 0.00 -1.61 0.00 0.00 179.24 177.64 3d5b h ALA 198 N 1.46 1.15 0.00 -0.78 0.00 -1.23 -1.65 119.26 118.21 3d5b h ALA 198 Ca 0.22 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3d5b h ALA 198 Cb 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3d5b h ALA 198 CO -0.03 0.40 0.00 2.35 0.00 0.00 0.00 179.25 181.97 3d5b h TRP 199 N 0.00 0.00 0.05 0.00 7.01 0.97 -2.06 115.95 121.92 3d5b h TRP 199 Ca -0.00 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 60.99 3d5b h TRP 199 Cb 0.71 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.77 3d5b h TRP 199 CO 0.00 0.00 -0.02 1.49 -2.79 0.00 0.00 178.44 177.12 3d5b h GLU 200 N 0.00 -0.06 0.00 2.65 4.81 -0.51 -1.98 114.58 119.49 3d5b h GLU 200 Ca 0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 3d5b h GLU 200 Cb 0.62 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.01 3d5b h GLU 200 CO 0.00 0.56 -0.13 -0.24 -0.73 0.00 0.00 179.01 178.47 3d5b h VAL 201 N -0.81 0.75 -0.43 0.32 3.04 -1.48 -0.63 116.25 117.00 3d5b h VAL 201 Ca -0.01 -0.53 -0.13 0.00 -1.01 0.00 0.00 66.70 65.03 3d5b h VAL 201 Cb 0.66 1.32 -0.01 0.00 -2.01 0.00 0.00 31.29 31.24 3d5b h VAL 201 CO 0.01 0.13 -0.23 0.15 -1.01 0.00 0.00 177.57 176.62 3d5b h PHE 202 N 0.00 1.02 0.00 3.17 3.57 -1.38 -2.19 116.94 121.13 3d5b h PHE 202 Ca -0.00 -0.25 -0.02 0.00 3.53 0.00 0.00 57.97 61.24 3d5b h PHE 202 Cb 0.31 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 38.81 3d5b h PHE 202 CO 0.00 1.03 -0.08 1.96 -2.23 0.00 0.00 178.31 178.99 3d5b h GLN 203 N 0.77 0.00 0.21 1.11 1.08 -0.35 -1.21 115.11 116.72 3d5b h GLN 203 Ca 0.10 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.29 3d5b h GLN 203 Cb 0.78 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.22 3d5b h GLN 203 CO 0.07 0.08 -0.10 -0.97 -0.95 0.00 0.00 178.83 176.95 3d5b h ASN 204 N 0.00 -0.23 -0.62 1.46 -0.73 -0.67 -1.89 115.58 112.90 3d5b h ASN 204 Ca -0.00 -0.26 -0.05 0.00 1.87 0.00 0.00 56.30 57.85 3d5b h ASN 204 Cb 0.37 0.06 -0.03 0.00 0.27 0.00 0.00 38.32 39.00 3d5b h ASN 204 CO 0.01 0.17 0.18 0.03 -0.37 0.00 0.00 177.43 177.45 3d5b h ARG 205 N -0.68 0.97 -2.41 6.67 3.08 -1.43 -3.43 114.38 117.15 3d5b h ARG 205 Ca -0.03 -0.22 -0.06 0.00 0.07 0.00 0.00 59.98 59.74 3d5b h ARG 205 Cb 0.48 -0.14 -0.25 0.00 0.08 0.00 0.00 29.97 30.14 3d5b h ARG 205 CO 0.05 0.87 -0.28 0.96 -1.07 0.00 0.00 179.97 180.50 3d5b s ILE 206 N -5.37 -0.50 0.00 2.04 -4.36 -0.47 -5.04 121.20 107.50 3d5b s ILE 206 Ca -0.12 0.11 0.00 0.00 -0.26 0.00 0.00 60.65 60.37 3d5b s ILE 206 Cb 0.13 -0.74 0.00 0.00 1.25 0.00 0.00 42.46 43.10 3d5b s ILE 206 CO 0.82 0.05 0.21 0.61 0.24 0.00 0.00 174.94 176.86