#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e8p n ASN 13 N 0.00 -0.91 -0.01 4.04 2.85 -1.26 -4.64 115.26 115.32 3e8p n ASN 13 Ca 0.00 0.87 -0.10 0.00 -0.11 0.00 0.00 54.58 55.25 3e8p n ASN 13 Cb 0.00 -1.12 -0.03 0.00 1.24 0.00 0.00 39.78 39.86 3e8p n ASN 13 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3e8p h PRO 14 N 0.71 -0.32 -0.17 1.20 0.11 -2.00 -0.08 132.00 131.44 3e8p h PRO 14 Ca -0.41 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.70 3e8p h PRO 14 Cb 1.40 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.57 3e8p h PRO 14 CO 0.51 -0.21 0.05 0.82 -0.21 0.00 0.00 178.00 178.95 3e8p h ILE 15 N -0.33 1.18 -0.01 4.15 2.04 -1.94 -1.10 117.51 121.51 3e8p h ILE 15 Ca 0.11 -0.57 0.02 0.00 1.00 0.00 0.00 64.86 65.41 3e8p h ILE 15 Cb 0.50 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 3e8p h ILE 15 CO -0.35 0.18 -0.09 1.56 0.00 0.00 0.00 178.15 179.44 3e8p h GLN 16 N 0.09 -0.15 -0.11 2.37 4.20 -1.87 0.39 115.11 120.03 3e8p h GLN 16 Ca 0.05 0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 3e8p h GLN 16 Cb 0.23 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 3e8p h GLN 16 CO -0.00 -0.10 -0.08 0.00 -0.67 0.00 0.00 178.83 177.97 3e8p h ALA 17 N 0.82 1.67 -0.15 3.87 0.00 -1.01 0.24 119.26 124.69 3e8p h ALA 17 Ca 0.04 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 3e8p h ALA 17 Cb 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3e8p h ALA 17 CO -0.10 0.25 -0.35 1.49 0.00 0.00 0.00 179.25 180.54 3e8p h GLU 18 N 0.16 0.50 -0.25 0.00 4.22 -0.24 -2.05 114.58 116.92 3e8p h GLU 18 Ca 0.04 -0.34 -0.05 0.00 0.08 0.00 0.00 59.36 59.09 3e8p h GLU 18 Cb 0.25 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 3e8p h GLU 18 CO 0.01 0.95 -0.03 0.28 -2.18 0.00 0.00 179.01 178.05 3e8p h VAL 19 N 0.13 1.27 -0.86 0.32 2.07 0.17 -2.04 116.25 117.32 3e8p h VAL 19 Ca -0.00 -0.99 0.02 0.00 0.82 0.00 0.00 66.70 66.56 3e8p h VAL 19 Cb 0.95 1.41 -0.05 0.00 -1.52 0.00 0.00 31.29 32.09 3e8p h VAL 19 CO 0.08 0.31 0.56 -0.07 0.02 0.00 0.00 177.57 178.47 3e8p h LEU 20 N 0.22 0.94 0.21 2.57 3.38 -1.01 -0.12 115.31 121.50 3e8p h LEU 20 Ca 0.07 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3e8p h LEU 20 Cb 0.47 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3e8p h LEU 20 CO 0.02 0.66 -0.10 0.50 0.09 0.00 0.00 178.44 179.61 3e8p h LYS 21 N 1.10 -0.28 0.52 1.13 3.64 -1.19 -2.20 116.57 119.29 3e8p h LYS 21 Ca 0.33 0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.71 3e8p h LYS 21 Cb -0.04 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 3e8p h LYS 21 CO -0.09 -0.14 -0.49 -0.09 -2.27 0.00 0.00 179.45 176.37 3e8p h ARG 22 N -0.34 -0.97 -1.06 1.90 9.65 -0.79 -2.59 114.38 120.17 3e8p h ARG 22 Ca -0.03 0.07 0.28 0.00 -1.10 0.00 0.00 59.98 59.20 3e8p h ARG 22 Cb 0.26 0.22 -0.10 0.00 -1.39 0.00 0.00 29.97 28.97 3e8p h ARG 22 CO 0.05 -0.65 0.68 0.28 2.80 0.00 0.00 179.97 183.13 3e8p h VAL 23 N -1.01 0.49 0.26 0.20 2.07 -1.03 -2.37 116.25 114.86 3e8p h VAL 23 Ca -0.07 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 3e8p h VAL 23 Cb 0.86 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 3e8p h VAL 23 CO -0.04 0.07 -0.13 0.00 0.02 0.00 0.00 177.57 177.49 3e8p h ALA 24 N 1.63 -0.35 0.00 1.67 0.00 -0.99 -2.57 119.26 118.64 3e8p h ALA 24 Ca 0.62 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.40 3e8p h ALA 24 Cb 1.59 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.51 3e8p h ALA 24 CO -0.32 -0.66 -0.10 1.05 0.00 0.00 0.00 179.25 179.22 3e8p h GLU 25 N -0.43 0.00 0.90 0.00 4.11 -1.32 0.76 114.58 118.60 3e8p h GLU 25 Ca -0.04 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.35 3e8p h GLU 25 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 3e8p h GLU 25 CO 0.06 0.10 -0.47 0.28 0.07 0.00 0.00 179.01 179.05 3e8p h VAL 26 N 0.00 0.04 -0.51 -1.06 2.07 -1.20 0.14 116.25 115.73 3e8p h VAL 26 Ca -0.00 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.42 3e8p h VAL 26 Cb 0.21 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 3e8p h VAL 26 CO 0.01 0.00 -0.09 -0.26 0.02 0.00 0.00 177.57 177.25 3e8p h PHE 27 N -1.27 1.03 0.00 1.57 -1.00 -1.23 0.47 116.94 116.51 3e8p h PHE 27 Ca -0.12 -0.20 -0.04 0.00 2.81 0.00 0.00 57.97 60.42 3e8p h PHE 27 Cb 0.99 -0.26 -0.01 0.00 3.61 0.00 0.00 35.95 40.28 3e8p h PHE 27 CO -0.04 0.97 -0.18 0.22 -1.61 0.00 0.00 178.31 177.66 3e8p h ASP 28 N 0.84 0.00 0.00 2.17 3.58 -0.73 -3.39 116.42 118.88 3e8p h ASP 28 Ca 0.14 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.59 3e8p h ASP 28 Cb 0.63 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.68 3e8p h ASP 28 CO 0.04 0.18 0.00 0.00 -2.88 0.00 0.00 179.24 176.59 3e8p n GLN 29 N -3.94 1.10 -0.02 0.28 1.13 0.48 -4.82 117.38 111.60 3e8p n GLN 29 Ca -0.02 0.00 0.01 0.00 -1.94 0.00 0.00 57.00 55.05 3e8p n GLN 29 Cb 0.27 -0.46 0.04 0.00 0.11 0.00 0.00 30.24 30.20 3e8p n GLN 29 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 3e8p n HIS 30 N -0.40 0.04 -3.98 1.08 8.25 0.16 -4.70 115.22 115.68 3e8p n HIS 30 Ca 0.00 -0.02 -0.33 0.00 -0.26 0.00 0.00 57.72 57.10 3e8p n HIS 30 Cb 0.00 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 30.97 3e8p n HIS 30 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3e8p s VAL 31 N -1.96 2.61 0.21 1.59 1.01 -1.20 -4.96 120.40 117.71 3e8p s VAL 31 Ca 0.04 -1.60 -0.12 0.00 0.00 0.00 0.00 61.98 60.30 3e8p s VAL 31 Cb 0.02 -2.56 0.23 0.00 0.00 0.00 0.00 36.38 34.06 3e8p s VAL 31 CO 0.03 -0.14 1.64 -0.65 0.00 0.00 0.00 175.10 175.97 3e8p h PRO 32 N 7.88 0.04 -0.04 2.72 0.11 -1.96 -0.90 132.00 139.86 3e8p h PRO 32 Ca -0.19 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.90 3e8p h PRO 32 Cb 1.05 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 3e8p h PRO 32 CO 0.51 0.03 -0.09 0.35 -0.21 0.00 0.00 178.00 178.59 3e8p h PHE 33 N 0.04 0.05 -0.37 0.65 3.57 -1.99 -1.70 116.94 117.20 3e8p h PHE 33 Ca 0.32 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.70 3e8p h PHE 33 Cb 0.51 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 3e8p h PHE 33 CO -0.46 0.15 -0.24 0.45 -2.23 0.00 0.00 178.31 175.98 3e8p h HIS 34 N 0.05 0.86 -0.17 0.41 3.86 -1.52 -2.49 115.15 116.15 3e8p h HIS 34 Ca 0.01 -0.20 -0.14 0.00 -1.16 0.00 0.00 60.37 58.88 3e8p h HIS 34 Cb 0.20 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 3e8p h HIS 34 CO 0.00 0.92 -0.50 -0.97 0.86 0.00 0.00 177.93 178.24 3e8p h ASN 35 N 0.65 0.49 -0.47 2.45 -0.73 -1.03 0.32 115.58 117.26 3e8p h ASN 35 Ca 0.09 -0.24 -0.07 0.00 1.87 0.00 0.00 56.30 57.94 3e8p h ASN 35 Cb 0.75 -0.14 -0.02 0.00 0.27 0.00 0.00 38.32 39.18 3e8p h ASN 35 CO 0.06 0.90 0.05 0.25 -0.37 0.00 0.00 177.43 178.32 3e8p h LEU 36 N 0.36 0.83 0.00 0.34 5.85 -1.15 -3.15 115.31 118.39 3e8p h LEU 36 Ca 0.02 -0.19 -0.15 0.00 0.84 0.00 0.00 57.88 58.39 3e8p h LEU 36 Cb 1.00 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.78 3e8p h LEU 36 CO 0.09 0.86 -1.31 -0.07 -0.34 0.00 0.00 178.44 177.67 3e8p h LEU 37 N 0.81 0.00 0.00 2.25 4.07 -1.33 -3.48 115.31 117.63 3e8p h LEU 37 Ca 0.16 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.12 3e8p h LEU 37 Cb 0.42 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.16 3e8p h LEU 37 CO 0.01 0.55 0.00 0.61 -1.08 0.00 0.00 178.44 178.53 3e8p n GLY 38 N 1.37 0.79 3.69 0.83 0.00 0.93 -4.84 105.19 107.97 3e8p n GLY 38 Ca -0.08 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 3e8p n GLY 38 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3e8p s LEU 39 N 0.00 4.33 0.03 0.99 0.20 -0.03 -4.40 118.68 119.79 3e8p s LEU 39 Ca 0.00 2.20 0.07 0.00 0.69 0.00 0.00 54.13 57.09 3e8p s LEU 39 Cb 0.00 -3.56 -0.02 0.00 -0.43 0.00 0.00 46.19 42.17 3e8p s LEU 39 CO 0.00 -0.74 -0.22 -1.81 -0.29 0.00 0.00 176.35 173.30 3e8p s ASP 40 N 1.88 2.56 -0.92 3.68 1.01 -0.25 -4.72 116.67 119.90 3e8p s ASP 40 Ca 0.65 -0.49 -0.17 0.00 0.71 0.00 0.00 52.55 53.26 3e8p s ASP 40 Cb -0.33 -0.24 0.16 0.00 1.01 0.00 0.00 42.92 43.52 3e8p s ASP 40 CO 0.28 0.20 1.05 -0.63 0.21 0.00 0.00 175.17 176.28 3e8p s ILE 41 N -0.71 5.00 0.26 0.77 -1.09 -1.26 -1.17 121.20 123.00 3e8p s ILE 41 Ca 0.08 -1.90 -0.02 0.00 -2.23 0.00 0.00 60.65 56.58 3e8p s ILE 41 Cb -0.09 -4.70 0.25 0.00 -1.58 0.00 0.00 42.46 36.34 3e8p s ILE 41 CO 0.01 -1.38 1.83 0.50 -1.23 0.00 0.00 174.94 174.67 3e8p h LYS 42 N 8.43 0.90 -1.97 2.79 3.64 -1.56 -3.45 116.57 125.36 3e8p h LYS 42 Ca 0.15 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 3e8p h LYS 42 Cb 1.02 -0.20 -0.19 0.00 -0.41 0.00 0.00 32.23 32.44 3e8p h LYS 42 CO 1.02 0.60 0.22 -0.98 -2.27 0.00 0.00 179.45 178.03 3e8p s ARG 43 N -6.01 1.02 -0.27 1.90 1.70 -1.07 -5.01 118.95 111.21 3e8p s ARG 43 Ca -0.12 0.25 -0.01 0.00 -0.47 0.00 0.00 55.73 55.37 3e8p s ARG 43 Cb 0.20 0.48 0.16 0.00 -0.57 0.00 0.00 34.95 35.22 3e8p s ARG 43 CO 0.80 -0.32 0.44 -0.47 -1.08 0.00 0.00 175.30 174.67 3e8p s TYR 44 N -1.20 -1.09 0.22 5.89 5.04 -1.26 -1.93 117.35 123.02 3e8p s TYR 44 Ca -0.10 0.93 0.02 0.00 -2.44 0.00 0.00 57.07 55.48 3e8p s TYR 44 Cb -0.00 0.12 -0.01 0.00 0.35 0.00 0.00 41.96 42.42 3e8p s TYR 44 CO 0.09 -0.83 0.06 -3.47 -1.34 0.00 0.00 175.55 170.06 3e8p n ASP 45 N 5.38 1.39 0.13 4.32 4.64 -0.78 -4.78 116.55 126.84 3e8p n ASP 45 Ca -0.02 -2.14 0.11 0.00 -1.38 0.00 0.00 54.79 51.36 3e8p n ASP 45 Cb 0.50 0.48 0.49 0.00 -1.04 0.00 0.00 41.12 41.55 3e8p n ASP 45 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3e8p n ILE 46 N -0.51 0.91 0.13 5.18 0.13 -1.26 -2.05 119.36 121.89 3e8p n ILE 46 Ca -0.04 0.34 0.04 0.00 -1.10 0.00 0.00 62.75 61.99 3e8p n ILE 46 Cb 0.32 -1.28 0.02 0.00 -0.84 0.00 0.00 39.64 37.86 3e8p n ILE 46 CO 0.00 0.00 0.00 0.44 2.80 0.00 0.00 176.55 179.79 3e8p h ASP 47 N 0.00 0.00 0.00 9.51 3.45 -1.95 -3.45 116.42 123.99 3e8p h ASP 47 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3e8p h ASP 47 Cb 0.27 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.04 3e8p h ASP 47 CO 0.00 0.43 0.00 0.61 -1.57 0.00 0.00 179.24 178.71 3e8p n GLY 48 N 1.24 -0.13 3.21 2.75 0.00 -0.87 -5.05 105.19 106.34 3e8p n GLY 48 Ca -0.00 -1.03 -0.09 0.00 0.00 0.00 0.00 46.02 44.90 3e8p n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3e8p s VAL 49 N -3.97 0.11 -0.19 1.61 0.11 -1.26 -1.87 120.40 114.95 3e8p s VAL 49 Ca 0.00 -1.60 -0.04 0.00 -2.93 0.00 0.00 61.98 57.41 3e8p s VAL 49 Cb 0.00 -1.78 0.10 0.00 -1.53 0.00 0.00 36.38 33.16 3e8p s VAL 49 CO 0.00 -0.52 0.28 -0.70 -3.33 0.00 0.00 175.10 170.83 3e8p s GLU 50 N -3.97 0.22 0.13 1.54 2.12 -0.81 -4.32 118.70 113.61 3e8p s GLU 50 Ca 0.16 0.47 0.03 0.00 0.36 0.00 0.00 54.97 55.99 3e8p s GLU 50 Cb 0.06 -0.64 -0.04 0.00 0.26 0.00 0.00 34.13 33.77 3e8p s GLU 50 CO -0.03 -0.53 0.18 0.08 -0.54 0.00 0.00 175.26 174.42 3e8p s VAL 51 N 2.42 4.87 0.03 3.70 1.01 0.36 -1.40 120.40 131.40 3e8p s VAL 51 Ca 0.07 -0.81 -0.08 0.00 0.00 0.00 0.00 61.98 61.16 3e8p s VAL 51 Cb -0.14 -3.45 -0.00 0.00 0.00 0.00 0.00 36.38 32.78 3e8p s VAL 51 CO -0.12 -0.03 0.15 0.00 0.00 0.00 0.00 175.10 175.10 3e8p s ALA 52 N -1.65 -0.24 -0.18 5.51 0.00 -0.32 0.14 121.76 125.02 3e8p s ALA 52 Ca 0.32 -0.36 -0.09 0.00 0.00 0.00 0.00 51.96 51.83 3e8p s ALA 52 Cb -0.11 0.24 0.07 0.00 0.00 0.00 0.00 23.12 23.31 3e8p s ALA 52 CO 0.25 -0.32 0.43 -1.50 0.00 0.00 0.00 175.76 174.63 3e8p s ILE 53 N -2.36 -0.21 0.00 0.00 2.07 -0.09 -1.09 121.20 119.51 3e8p s ILE 53 Ca -0.07 0.11 0.00 0.00 -1.41 0.00 0.00 60.65 59.28 3e8p s ILE 53 Cb -0.02 -0.65 0.00 0.00 0.13 0.00 0.00 42.46 41.92 3e8p s ILE 53 CO -0.03 0.05 0.00 0.59 -1.91 0.00 0.00 174.94 173.63 3e8p n ASN 54 N 4.60 0.00 0.00 4.50 3.02 -1.26 -1.24 115.26 124.88 3e8p n ASN 54 Ca -0.19 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.36 3e8p n ASN 54 Cb 0.54 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.71 3e8p n ASN 54 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 3e8p n LYS 56 N 0.00 0.00 -0.31 3.52 2.85 -1.26 -4.95 118.16 118.00 3e8p n LYS 56 Ca 0.00 0.00 0.14 0.00 -1.05 0.00 0.00 58.31 57.40 3e8p n LYS 56 Cb 0.00 0.00 0.38 0.00 -0.65 0.00 0.00 35.03 34.76 3e8p n LYS 56 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 177.40 176.00 3e8p h PRO 57 N 0.00 0.65 0.00 -1.58 0.11 -2.03 -2.43 132.00 126.71 3e8p h PRO 57 Ca 0.00 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.07 3e8p h PRO 57 Cb 0.00 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 30.96 3e8p h PRO 57 CO 0.00 0.43 0.00 0.93 -0.21 0.00 0.00 178.00 179.15 3e8p h GLU 58 N 0.67 0.00 -0.04 1.05 3.07 -2.00 -2.90 114.58 114.42 3e8p h GLU 58 Ca 0.52 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.38 3e8p h GLU 58 Cb 0.94 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.85 3e8p h GLU 58 CO -0.29 0.00 0.00 1.28 -1.40 0.00 0.00 179.01 178.60 3e8p n LEU 59 N -2.30 2.44 -4.76 1.33 4.77 -0.92 -4.96 117.00 112.61 3e8p n LEU 59 Ca 0.01 -0.83 -0.41 0.00 -0.03 0.00 0.00 56.01 54.75 3e8p n LEU 59 Cb 0.17 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.21 3e8p n LEU 59 CO 0.17 0.42 0.84 -0.63 -1.33 0.00 0.00 177.39 176.86 3e8p s ILE 60 N -1.97 3.36 -0.12 -0.08 1.09 -1.10 -1.30 121.20 121.08 3e8p s ILE 60 Ca 0.32 1.33 -0.10 0.00 -1.10 0.00 0.00 60.65 61.11 3e8p s ILE 60 Cb 0.20 -3.85 -0.03 0.00 -1.06 0.00 0.00 42.46 37.72 3e8p s ILE 60 CO 0.31 0.30 -0.19 0.61 -0.10 0.00 0.00 174.94 175.88 3e8p n GLY 61 N 1.29 -0.71 3.30 6.18 0.00 0.10 -4.64 105.19 110.71 3e8p n GLY 61 Ca -0.00 -0.18 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 3e8p n GLY 61 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3e8p s ASN 62 N -5.27 5.44 0.30 1.61 3.84 -1.25 -4.96 114.94 114.65 3e8p s ASN 62 Ca -0.15 -1.10 -0.02 0.00 0.21 0.00 0.00 52.86 51.80 3e8p s ASN 62 Cb 0.02 -1.92 0.44 0.00 -0.55 0.00 0.00 41.25 39.25 3e8p s ASN 62 CO 0.23 -0.34 1.93 0.40 -2.79 0.00 0.00 177.10 176.52 3e8p h ILE 63 N 6.08 1.21 0.00 -5.21 2.04 -1.90 0.95 117.51 120.68 3e8p h ILE 63 Ca -0.24 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.11 3e8p h ILE 63 Cb 1.09 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 3e8p h ILE 63 CO 0.62 0.23 0.00 1.57 0.00 0.00 0.00 178.15 180.57 3e8p n HIS 64 N -4.37 0.00 -0.39 1.37 -0.00 -1.26 -2.06 115.22 108.51 3e8p n HIS 64 Ca 0.07 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.25 3e8p n HIS 64 Cb 0.09 -0.41 0.00 0.00 -0.12 0.00 0.00 29.99 29.55 3e8p n HIS 64 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 3e8p n GLN 65 N -1.41 0.70 -4.07 1.57 6.02 -0.59 -5.03 117.38 114.57 3e8p n GLN 65 Ca 0.01 -0.14 -0.28 0.00 -0.01 0.00 0.00 57.00 56.58 3e8p n GLN 65 Cb 0.03 -0.54 -0.04 0.00 1.02 0.00 0.00 30.24 30.72 3e8p n GLN 65 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3e8p n GLN 66 N -0.14 -2.87 -4.17 -1.09 1.13 0.23 -4.95 117.38 105.52 3e8p n GLN 66 Ca 0.00 0.34 -0.30 0.00 -1.94 0.00 0.00 57.00 55.11 3e8p n GLN 66 Cb 0.10 -4.48 -0.09 0.00 0.11 0.00 0.00 30.24 25.88 3e8p n GLN 66 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 3e8p s ILE 67 N -3.91 3.73 0.31 5.09 1.01 -1.21 -4.84 121.20 121.38 3e8p s ILE 67 Ca 0.14 -1.13 -0.29 0.00 0.00 0.00 0.00 60.65 59.37 3e8p s ILE 67 Cb -0.08 -2.77 -0.11 0.00 0.01 0.00 0.00 42.46 39.52 3e8p s ILE 67 CO 0.91 0.11 1.51 -0.22 0.00 0.00 0.00 174.94 177.25 3e8p s LEU 68 N -2.29 4.35 0.09 2.97 2.96 -0.27 -0.72 118.68 125.77 3e8p s LEU 68 Ca 0.24 2.89 -0.31 0.00 -0.22 0.00 0.00 54.13 56.73 3e8p s LEU 68 Cb -0.11 -3.64 -0.07 0.00 0.50 0.00 0.00 46.19 42.86 3e8p s LEU 68 CO 0.16 -0.83 1.32 -2.28 -1.32 0.00 0.00 176.35 173.41 3e8p s HIS 69 N -0.37 3.30 0.54 5.38 5.65 -0.42 -4.50 115.29 124.87 3e8p s HIS 69 Ca 0.59 1.07 0.34 0.00 0.25 0.00 0.00 55.06 57.30 3e8p s HIS 69 Cb -0.46 -3.59 1.51 0.00 -1.18 0.00 0.00 32.58 28.86 3e8p s HIS 69 CO 0.51 -2.01 1.85 0.78 -0.65 0.00 0.00 174.74 175.22 3e8p h GLY 70 N 6.85 0.00 1.74 1.59 0.00 -1.92 0.17 103.07 111.50 3e8p h GLY 70 Ca -0.42 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 3e8p h GLY 70 CO 0.85 0.00 0.08 -1.33 0.00 0.00 0.00 176.54 176.14 3e8p h GLY 71 N 0.00 0.36 0.64 4.60 0.00 -1.97 -1.39 103.07 105.31 3e8p h GLY 71 Ca 0.48 -0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.62 3e8p h GLY 71 CO -0.01 0.15 -0.05 -2.08 0.00 0.00 0.00 176.54 174.56 3e8p h VAL 72 N 0.34 1.35 -0.24 4.60 2.07 -1.03 -2.11 116.25 121.22 3e8p h VAL 72 Ca 0.08 -1.14 0.06 0.00 0.82 0.00 0.00 66.70 66.53 3e8p h VAL 72 Cb 0.10 1.96 -0.07 0.00 -1.52 0.00 0.00 31.29 31.75 3e8p h VAL 72 CO -0.01 0.32 -0.30 0.74 0.02 0.00 0.00 177.57 178.34 3e8p h THR 73 N -0.25 0.29 -0.92 2.57 2.02 -1.40 -0.35 112.91 114.88 3e8p h THR 73 Ca 0.01 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.22 3e8p h THR 73 Cb 0.53 0.29 -0.05 0.00 -1.74 0.00 0.00 68.15 67.18 3e8p h THR 73 CO 0.01 0.00 0.60 0.00 0.37 0.00 0.00 175.52 176.50 3e8p h ALA 74 N 0.62 1.21 -0.01 6.16 0.00 -1.28 -1.35 119.26 124.61 3e8p h ALA 74 Ca 0.13 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3e8p h ALA 74 Cb 0.52 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3e8p h ALA 74 CO -0.42 0.48 -0.01 1.15 0.00 0.00 0.00 179.25 180.45 3e8p h THR 75 N 1.17 0.97 -0.59 0.00 2.02 -0.57 -2.03 112.91 113.88 3e8p h THR 75 Ca 0.36 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.54 3e8p h THR 75 Cb -0.02 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.33 3e8p h THR 75 CO -0.11 0.00 0.34 0.58 0.37 0.00 0.00 175.52 176.70 3e8p h VAL 76 N -0.02 1.18 -0.41 3.16 2.07 -0.71 -2.22 116.25 119.30 3e8p h VAL 76 Ca 0.01 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 3e8p h VAL 76 Cb 0.02 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 3e8p h VAL 76 CO -0.02 0.19 0.23 -0.07 0.02 0.00 0.00 177.57 177.93 3e8p h LEU 77 N 0.80 0.51 -0.82 2.57 3.38 -1.14 -1.43 115.31 119.18 3e8p h LEU 77 Ca 0.21 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 3e8p h LEU 77 Cb 0.00 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 3e8p h LEU 77 CO -0.04 0.44 0.50 -0.78 0.09 0.00 0.00 178.44 178.65 3e8p h ASP 78 N 0.54 0.98 -0.18 -0.43 3.58 -1.18 0.27 116.42 120.01 3e8p h ASP 78 Ca 0.15 -0.06 -0.04 0.00 0.42 0.00 0.00 57.03 57.49 3e8p h ASP 78 Cb 0.04 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.84 3e8p h ASP 78 CO -0.02 0.76 -0.05 0.58 -2.88 0.00 0.00 179.24 177.62 3e8p h VAL 79 N 1.13 1.29 -0.89 2.25 2.07 -1.25 -1.32 116.25 119.53 3e8p h VAL 79 Ca 0.29 -1.04 0.10 0.00 0.82 0.00 0.00 66.70 66.88 3e8p h VAL 79 Cb -0.05 1.62 -0.08 0.00 -1.52 0.00 0.00 31.29 31.26 3e8p h VAL 79 CO -0.06 0.31 0.52 0.58 0.02 0.00 0.00 177.57 178.95 3e8p h VAL 80 N 0.05 0.91 -0.33 2.57 2.07 -0.99 -1.21 116.25 119.32 3e8p h VAL 80 Ca 0.04 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 3e8p h VAL 80 Cb 0.50 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 3e8p h VAL 80 CO 0.02 0.16 0.13 1.23 0.02 0.00 0.00 177.57 179.12 3e8p h GLY 81 N 0.85 0.53 1.03 2.17 0.00 -0.63 -0.21 103.07 106.81 3e8p h GLY 81 Ca 0.43 -0.29 -0.05 0.00 0.00 0.00 0.00 47.33 47.42 3e8p h GLY 81 CO -0.26 0.28 0.21 -1.33 0.00 0.00 0.00 176.54 175.44 3e8p h GLY 82 N 0.38 1.09 1.11 4.60 0.00 -0.71 -0.33 103.07 109.22 3e8p h GLY 82 Ca 0.11 -0.65 -0.11 0.00 0.00 0.00 0.00 47.33 46.69 3e8p h GLY 82 CO -0.01 0.60 -0.07 1.41 0.00 0.00 0.00 176.54 178.48 3e8p h LEU 83 N 0.95 1.04 -0.39 3.11 3.38 -1.13 -1.09 115.31 121.17 3e8p h LEU 83 Ca 0.21 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 3e8p h LEU 83 Cb 0.29 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3e8p h LEU 83 CO -0.01 1.12 0.16 0.74 0.09 0.00 0.00 178.44 180.54 3e8p h THR 84 N 0.94 1.19 0.20 0.22 2.02 -0.83 -0.51 112.91 116.14 3e8p h THR 84 Ca 0.15 -0.59 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 3e8p h THR 84 Cb 0.63 0.85 -0.00 0.00 -1.74 0.00 0.00 68.15 67.89 3e8p h THR 84 CO 0.04 0.22 -0.11 0.00 0.37 0.00 0.00 175.52 176.04 3e8p h ALA 85 N 1.00 -0.28 -0.81 6.16 0.00 -0.82 -1.22 119.26 123.29 3e8p h ALA 85 Ca 0.13 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3e8p h ALA 85 Cb 0.19 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 3e8p h ALA 85 CO -0.01 -0.66 0.53 0.35 0.00 0.00 0.00 179.25 179.46 3e8p h PHE 86 N -0.29 1.03 -0.40 0.00 3.57 -1.12 -1.84 116.94 117.89 3e8p h PHE 86 Ca -0.02 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.52 3e8p h PHE 86 Cb 0.23 -0.35 -0.03 0.00 2.79 0.00 0.00 35.95 38.60 3e8p h PHE 86 CO -0.08 0.65 0.22 0.00 -2.23 0.00 0.00 178.31 176.88 3e8p h ALA 87 N 1.29 0.50 -0.31 2.41 0.00 -0.84 -0.50 119.26 121.81 3e8p h ALA 87 Ca 0.30 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.24 3e8p h ALA 87 Cb -0.12 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3e8p h ALA 87 CO -0.06 -0.13 0.21 0.78 0.00 0.00 0.00 179.25 180.05 3e8p h GLY 88 N 0.44 0.33 1.44 0.00 0.00 -0.72 -1.42 103.07 103.15 3e8p h GLY 88 Ca 0.16 -0.12 -0.19 0.00 0.00 0.00 0.00 47.33 47.19 3e8p h GLY 88 CO -0.09 0.10 -0.71 -2.00 0.00 0.00 0.00 176.54 173.85 3e8p h LEU 89 N 0.30 0.65 -0.40 3.11 5.85 -0.41 -2.54 115.31 121.87 3e8p h LEU 89 Ca 0.13 -0.41 -0.02 0.00 0.84 0.00 0.00 57.88 58.42 3e8p h LEU 89 Cb 0.14 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 3e8p h LEU 89 CO -0.03 1.16 0.19 0.58 -0.34 0.00 0.00 178.44 180.00 3e8p h VAL 90 N 0.39 1.18 0.00 1.05 2.07 -0.09 -1.46 116.25 119.39 3e8p h VAL 90 Ca -0.03 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 66.97 3e8p h VAL 90 Cb 1.29 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 3e8p h VAL 90 CO 0.13 0.19 0.00 0.00 0.02 0.00 0.00 177.57 177.92 3e8p n ALA 91 N -2.28 2.19 0.05 1.67 0.00 -0.82 -3.62 120.51 117.70 3e8p n ALA 91 Ca 0.00 -0.11 -0.13 0.00 0.00 0.00 0.00 53.44 53.20 3e8p n ALA 91 Cb 0.12 -1.35 -0.09 0.00 0.00 0.00 0.00 19.45 18.14 3e8p n ALA 91 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3e8p h SER 92 N 0.00 -0.10 -2.45 0.00 0.87 -0.82 -3.45 113.55 107.60 3e8p h SER 92 Ca 0.00 -0.25 -0.59 0.00 -1.23 0.00 0.00 61.79 59.72 3e8p h SER 92 Cb 0.11 0.03 -0.12 0.00 -0.44 0.00 0.00 62.40 61.98 3e8p h SER 92 CO 0.00 0.20 -0.70 -0.13 -0.53 0.00 0.00 176.83 175.68 3e8p s ARG 93 N -4.98 2.08 -0.03 2.24 0.52 -1.24 -5.04 118.95 112.50 3e8p s ARG 93 Ca -0.15 -1.45 0.13 0.00 -0.52 0.00 0.00 55.73 53.74 3e8p s ARG 93 Cb 0.03 -2.07 0.38 0.00 0.52 0.00 0.00 34.95 33.81 3e8p s ARG 93 CO 0.64 0.38 1.31 -0.40 0.02 0.00 0.00 175.30 177.25 3e8p n ASP 94 N -0.55 3.22 -1.50 0.23 3.85 -1.26 -4.56 116.55 115.98 3e8p n ASP 94 Ca -0.07 -2.18 0.02 0.00 -0.71 0.00 0.00 54.79 51.84 3e8p n ASP 94 Cb 0.58 -0.31 0.07 0.00 -1.35 0.00 0.00 41.12 40.11 3e8p n ASP 94 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 3e8p n ASP 95 N 0.44 1.48 -4.75 -1.12 5.75 -1.26 -5.10 116.55 111.98 3e8p n ASP 95 Ca 0.14 -2.57 -0.37 0.00 -0.01 0.00 0.00 54.79 51.99 3e8p n ASP 95 Cb 0.53 -0.38 0.03 0.00 -1.03 0.00 0.00 41.12 40.27 3e8p n ASP 95 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 3e8p s TRP 96 N -1.51 2.41 -0.11 2.11 0.52 -1.26 -5.02 118.94 116.07 3e8p s TRP 96 Ca 0.35 1.46 -0.04 0.00 0.02 0.00 0.00 56.10 57.89 3e8p s TRP 96 Cb 0.38 -3.61 -0.04 0.00 -1.15 0.00 0.00 33.47 29.05 3e8p s TRP 96 CO -0.12 -2.42 0.05 0.95 0.02 0.00 0.00 176.95 175.44 3e8p s THR 97 N -1.45 4.73 0.55 2.01 -4.23 -1.26 -4.95 115.64 111.04 3e8p s THR 97 Ca 0.73 -0.08 0.34 0.00 -1.18 0.00 0.00 61.69 61.50 3e8p s THR 97 Cb -0.35 -3.04 0.51 0.00 1.34 0.00 0.00 72.50 70.96 3e8p s THR 97 CO 0.40 0.58 1.82 -0.29 -0.54 0.00 0.00 174.62 176.59 3e8p h ILE 98 N 4.24 0.43 0.02 2.99 2.10 -1.95 0.30 117.51 125.64 3e8p h ILE 98 Ca -0.49 0.00 -0.26 0.00 1.08 0.00 0.00 64.86 65.18 3e8p h ILE 98 Cb 1.20 0.46 0.02 0.00 -1.09 0.00 0.00 36.82 37.40 3e8p h ILE 98 CO 0.58 0.00 -1.05 -0.08 -1.08 0.00 0.00 178.15 176.52 3e8p h GLU 99 N 0.00 0.60 0.21 2.19 4.81 -1.99 -2.71 114.58 117.69 3e8p h GLU 99 Ca 0.48 -0.68 -0.00 0.00 -0.13 0.00 0.00 59.36 59.03 3e8p h GLU 99 Cb 2.01 0.20 -0.01 0.00 0.63 0.00 0.00 28.75 31.58 3e8p h GLU 99 CO -0.01 1.27 -0.17 1.49 -0.73 0.00 0.00 179.01 180.87 3e8p h GLU 100 N 0.33 -0.37 0.00 1.92 4.57 -0.82 -1.40 114.58 118.80 3e8p h GLU 100 Ca -0.13 0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.06 3e8p h GLU 100 Cb 1.71 0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 30.38 3e8p h GLU 100 CO 0.20 -0.25 -0.08 -0.07 -1.18 0.00 0.00 179.01 177.63 3e8p h LEU 101 N -0.39 0.00 -0.38 1.64 3.38 -1.52 -1.78 115.31 116.25 3e8p h LEU 101 Ca -0.01 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 3e8p h LEU 101 Cb 0.35 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 3e8p h LEU 101 CO -0.02 0.08 -0.70 1.56 0.09 0.00 0.00 178.44 179.45 3e8p h GLN 102 N 0.00 0.50 -0.55 1.13 1.08 -1.01 -1.88 115.11 114.38 3e8p h GLN 102 Ca -0.00 -0.39 -0.11 0.00 -1.45 0.00 0.00 58.65 56.70 3e8p h GLN 102 Cb 0.32 0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.81 3e8p h GLN 102 CO 0.01 1.02 -0.09 0.37 -0.95 0.00 0.00 178.83 179.18 3e8p h GLN 103 N 0.35 1.04 -0.27 1.46 5.75 -0.45 -2.96 115.11 120.04 3e8p h GLN 103 Ca -0.03 -0.38 -0.02 0.00 -0.15 0.00 0.00 58.65 58.07 3e8p h GLN 103 Cb 1.28 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.75 3e8p h GLN 103 CO 0.13 1.07 0.09 0.00 -2.65 0.00 0.00 178.83 177.47 3e8p h ARG 104 N 0.92 0.41 -0.32 1.69 2.47 -1.30 -2.59 114.38 115.65 3e8p h ARG 104 Ca 0.14 -0.09 0.09 0.00 -1.26 0.00 0.00 59.98 58.87 3e8p h ARG 104 Cb 0.66 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.91 3e8p h ARG 104 CO 0.05 0.47 0.25 1.25 0.56 0.00 0.00 179.97 182.54 3e8p h LEU 105 N 0.27 0.00 -0.92 3.04 5.85 -1.27 0.24 115.31 122.52 3e8p h LEU 105 Ca 0.09 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 3e8p h LEU 105 Cb 0.23 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 3e8p h LEU 105 CO -0.00 0.00 -0.17 -0.61 -0.34 0.00 0.00 178.44 177.32 3e8p h GLN 106 N 0.00 0.00 0.00 1.25 4.15 -1.29 -3.01 115.11 116.21 3e8p h GLN 106 Ca 0.15 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.57 3e8p h GLN 106 Cb 0.64 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.33 3e8p h GLN 106 CO -0.00 0.17 -0.99 0.25 -1.93 0.00 0.00 178.83 176.33 3e8p n THR 107 N -3.26 0.00 -1.68 2.39 -2.24 0.73 -4.96 114.28 105.26 3e8p n THR 107 Ca 0.01 -0.02 -0.45 0.00 -2.27 0.00 0.00 64.05 61.33 3e8p n THR 107 Cb 0.45 0.91 -0.03 0.00 -2.10 0.00 0.00 70.33 69.55 3e8p n THR 107 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3e8p n LEU 108 N -1.53 3.28 -3.59 3.22 7.94 -0.42 -4.69 117.00 121.22 3e8p n LEU 108 Ca 0.04 1.12 -0.05 0.00 -1.11 0.00 0.00 56.01 56.01 3e8p n LEU 108 Cb 0.34 -1.45 -0.02 0.00 0.53 0.00 0.00 43.42 42.81 3e8p n LEU 108 CO 0.42 -0.32 0.98 -0.83 -1.11 0.00 0.00 177.39 176.54 3e8p s GLY 109 N 0.57 -0.27 -0.03 -3.96 0.00 -1.26 -5.05 107.32 97.32 3e8p s GLY 109 Ca 0.72 1.70 -0.21 0.00 0.00 0.00 0.00 44.72 46.93 3e8p s GLY 109 CO 0.45 0.61 0.60 -1.59 0.00 0.00 0.00 173.10 173.16 3e8p s THR 110 N -2.25 4.97 -0.21 0.90 2.01 -1.26 -4.48 115.64 115.32 3e8p s THR 110 Ca 0.08 1.25 -0.17 0.00 0.31 0.00 0.00 61.69 63.16 3e8p s THR 110 Cb -0.01 -3.94 -0.12 0.00 0.01 0.00 0.00 72.50 68.44 3e8p s THR 110 CO -0.05 0.38 -0.08 -0.38 -0.69 0.00 0.00 174.62 173.80 3e8p n ILE 111 N 3.04 1.50 -3.68 1.82 5.41 0.25 -5.00 119.36 122.69 3e8p n ILE 111 Ca -0.06 -0.04 -0.03 0.00 1.00 0.00 0.00 62.75 63.62 3e8p n ILE 111 Cb 0.51 -2.12 -0.01 0.00 -0.71 0.00 0.00 39.64 37.32 3e8p n ILE 111 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 3e8p n ASP 112 N -4.43 -0.31 -3.66 4.38 5.68 -1.18 -5.02 116.55 112.01 3e8p n ASP 112 Ca -0.30 -1.43 -0.10 0.00 -0.50 0.00 0.00 54.79 52.46 3e8p n ASP 112 Cb 0.62 0.57 -0.08 0.00 -1.14 0.00 0.00 41.12 41.09 3e8p n ASP 112 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 3e8p s ARG 114 N -2.18 0.67 -0.08 0.11 3.52 0.15 -1.55 118.95 119.59 3e8p s ARG 114 Ca 0.07 1.01 0.05 0.00 -0.13 0.00 0.00 55.73 56.72 3e8p s ARG 114 Cb -0.00 0.20 -0.01 0.00 -1.56 0.00 0.00 34.95 33.58 3e8p s ARG 114 CO 0.05 -0.13 -0.24 0.08 -0.81 0.00 0.00 175.30 174.26 3e8p s VAL 115 N 1.06 2.14 -0.23 7.11 1.01 -1.26 -1.23 120.40 129.00 3e8p s VAL 115 Ca -0.06 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 60.90 3e8p s VAL 115 Cb -0.05 -1.80 0.02 0.00 0.00 0.00 0.00 36.38 34.54 3e8p s VAL 115 CO -0.10 0.56 -0.09 -1.81 0.00 0.00 0.00 175.10 173.66 3e8p s ASP 116 N 0.10 4.06 -0.28 3.32 1.01 -0.38 -5.00 116.67 119.50 3e8p s ASP 116 Ca -0.11 -0.74 -0.23 0.00 0.71 0.00 0.00 52.55 52.18 3e8p s ASP 116 Cb -0.16 -1.64 -0.01 0.00 1.01 0.00 0.00 42.92 42.13 3e8p s ASP 116 CO 0.06 -0.08 0.75 -0.31 0.21 0.00 0.00 175.17 175.80 3e8p s TYR 117 N 1.34 3.24 -0.27 4.23 1.51 -1.26 -1.84 117.35 124.30 3e8p s TYR 117 Ca 0.02 0.86 -0.03 0.00 -1.01 0.00 0.00 57.07 56.91 3e8p s TYR 117 Cb -0.15 -3.08 -0.15 0.00 -0.11 0.00 0.00 41.96 38.46 3e8p s TYR 117 CO -0.06 -0.47 -0.27 1.28 -1.11 0.00 0.00 175.55 174.92 3e8p n LEU 118 N 6.03 2.66 -3.91 -1.29 4.77 -0.48 -5.00 117.00 119.77 3e8p n LEU 118 Ca 0.03 0.01 -0.09 0.00 -0.03 0.00 0.00 56.01 55.93 3e8p n LEU 118 Cb 0.48 -0.88 -0.09 0.00 -2.33 0.00 0.00 43.42 40.61 3e8p n LEU 118 CO 0.48 0.83 -0.18 -0.13 -1.33 0.00 0.00 177.39 177.05 3e8p s ARG 119 N -2.52 0.67 0.34 3.23 0.52 -0.93 -5.03 118.95 115.23 3e8p s ARG 119 Ca -0.36 -0.83 -0.28 0.00 -0.52 0.00 0.00 55.73 53.74 3e8p s ARG 119 Cb 0.11 0.27 -0.10 0.00 0.52 0.00 0.00 34.95 35.75 3e8p s ARG 119 CO 0.56 -0.18 1.25 -2.14 0.02 0.00 0.00 175.30 174.81 3e8p s PRO 120 N -3.04 4.31 -0.27 3.54 0.02 -1.26 -4.76 135.00 133.54 3e8p s PRO 120 Ca -0.01 2.07 -0.29 0.00 0.02 0.00 0.00 61.00 62.79 3e8p s PRO 120 Cb 0.01 -2.99 0.01 0.00 0.02 0.00 0.00 34.50 31.56 3e8p s PRO 120 CO -0.07 -0.18 1.13 0.20 -0.33 0.00 0.00 177.00 177.76 3e8p s GLY 121 N -0.70 1.58 0.23 0.52 0.00 -1.26 -4.94 107.32 102.75 3e8p s GLY 121 Ca 0.50 0.12 0.04 0.00 0.00 0.00 0.00 44.72 45.38 3e8p s GLY 121 CO 0.48 2.33 -0.02 0.50 0.00 0.00 0.00 173.10 176.39 3e8p s ARG 122 N 3.58 1.34 0.00 2.90 0.52 -1.26 -1.12 118.95 124.91 3e8p s ARG 122 Ca 0.48 -1.67 0.00 0.00 -0.52 0.00 0.00 55.73 54.02 3e8p s ARG 122 Cb -0.15 -0.68 0.00 0.00 0.52 0.00 0.00 34.95 34.64 3e8p s ARG 122 CO 0.14 -0.07 0.00 0.41 0.02 0.00 0.00 175.30 175.80 3e8p n GLY 123 N -0.42 1.15 0.09 -3.53 0.00 -1.26 -4.64 105.19 96.57 3e8p n GLY 123 Ca -0.06 -2.13 -0.10 0.00 0.00 0.00 0.00 46.02 43.73 3e8p n GLY 123 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3e8p h GLN 124 N 0.00 0.04 -4.59 1.61 4.20 -2.00 -3.48 115.11 110.90 3e8p h GLN 124 Ca 0.00 -0.08 -0.35 0.00 0.06 0.00 0.00 58.65 58.28 3e8p h GLN 124 Cb 0.00 0.03 -0.27 0.00 0.30 0.00 0.00 27.48 27.54 3e8p h GLN 124 CO 0.00 0.66 -0.76 0.42 -0.67 0.00 0.00 178.83 178.48 3e8p s ILE 125 N -2.61 0.60 -0.08 2.54 1.01 -1.26 -4.45 121.20 116.95 3e8p s ILE 125 Ca -0.06 -0.48 0.05 0.00 0.00 0.00 0.00 60.65 60.15 3e8p s ILE 125 Cb 0.08 -0.54 -0.00 0.00 0.01 0.00 0.00 42.46 42.01 3e8p s ILE 125 CO 0.82 0.06 -0.23 -0.36 0.00 0.00 0.00 174.94 175.23 3e8p s PHE 126 N -0.41 2.39 -0.03 3.97 0.08 -0.37 -3.09 117.98 120.52 3e8p s PHE 126 Ca 0.01 -0.86 0.07 0.00 0.12 0.00 0.00 56.93 56.27 3e8p s PHE 126 Cb -0.04 -1.59 -0.02 0.00 -0.57 0.00 0.00 43.02 40.79 3e8p s PHE 126 CO -0.00 -0.32 -0.25 0.99 -0.10 0.00 0.00 175.22 175.54 3e8p s THR 127 N 0.16 2.16 0.00 0.64 2.01 -0.36 -0.91 115.64 119.34 3e8p s THR 127 Ca -0.12 -1.06 0.05 0.00 0.31 0.00 0.00 61.69 60.87 3e8p s THR 127 Cb -0.16 -1.76 -0.02 0.00 0.01 0.00 0.00 72.50 70.58 3e8p s THR 127 CO 0.06 0.58 -0.17 -0.83 -0.69 0.00 0.00 174.62 173.58 3e8p s GLY 128 N -0.58 0.85 0.18 4.40 0.00 0.12 -0.63 107.32 111.67 3e8p s GLY 128 Ca 0.09 -0.78 -0.06 0.00 0.00 0.00 0.00 44.72 43.97 3e8p s GLY 128 CO -0.00 -0.68 0.22 -0.51 0.00 0.00 0.00 173.10 172.13 3e8p s THR 129 N -0.52 0.04 0.29 0.90 -4.23 -0.55 -0.48 115.64 111.08 3e8p s THR 129 Ca 0.06 -1.68 -0.09 0.00 -1.18 0.00 0.00 61.69 58.80 3e8p s THR 129 Cb -0.07 -2.13 0.04 0.00 1.34 0.00 0.00 72.50 71.68 3e8p s THR 129 CO 0.00 -0.20 0.54 0.61 -0.54 0.00 0.00 174.62 175.03 3e8p n GLY 130 N -0.23 1.45 3.44 3.99 0.00 -1.26 -0.20 105.19 112.37 3e8p n GLY 130 Ca -0.03 -1.26 -0.15 0.00 0.00 0.00 0.00 46.02 44.58 3e8p n GLY 130 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3e8p s SER 131 N -2.53 -0.54 -0.06 1.61 1.04 -0.42 -4.75 113.70 108.04 3e8p s SER 131 Ca 0.13 0.32 -0.27 0.00 0.48 0.00 0.00 55.95 56.62 3e8p s SER 131 Cb -0.03 0.53 -0.03 0.00 0.10 0.00 0.00 66.02 66.59 3e8p s SER 131 CO 0.10 -0.74 0.85 -0.69 0.98 0.00 0.00 173.24 173.74 3e8p s VAL 132 N -2.30 4.93 -0.04 5.02 1.01 -1.26 -1.01 120.40 126.75 3e8p s VAL 132 Ca -0.06 1.75 0.17 0.00 0.00 0.00 0.00 61.98 63.84 3e8p s VAL 132 Cb -0.01 -4.18 -0.26 0.00 0.00 0.00 0.00 36.38 31.93 3e8p s VAL 132 CO -0.00 0.16 0.34 2.30 0.00 0.00 0.00 175.10 177.90 3e8p n ILE 133 N 4.04 0.15 -3.50 2.22 -5.35 -0.40 -4.86 119.36 111.66 3e8p n ILE 133 Ca 0.03 -0.43 -0.21 0.00 -0.27 0.00 0.00 62.75 61.87 3e8p n ILE 133 Cb 0.51 0.01 -0.13 0.00 -1.74 0.00 0.00 39.64 38.29 3e8p n ILE 133 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 3e8p s ARG 134 N -3.10 0.20 0.31 6.28 3.52 -1.02 -4.99 118.95 120.15 3e8p s ARG 134 Ca -0.07 -0.03 -0.19 0.00 -0.13 0.00 0.00 55.73 55.31 3e8p s ARG 134 Cb 0.10 -1.18 -0.09 0.00 -1.56 0.00 0.00 34.95 32.22 3e8p s ARG 134 CO 0.71 -0.80 0.80 0.00 -0.81 0.00 0.00 175.30 175.20 3e8p s ALA 135 N 2.27 3.29 0.17 6.12 0.00 -1.26 -1.44 121.76 130.91 3e8p s ALA 135 Ca 0.07 0.21 -0.21 0.00 0.00 0.00 0.00 51.96 52.03 3e8p s ALA 135 Cb -0.15 -2.91 0.06 0.00 0.00 0.00 0.00 23.12 20.11 3e8p s ALA 135 CO -0.20 0.28 0.58 0.20 0.00 0.00 0.00 175.76 176.62 3e8p s GLY 136 N -1.96 -0.47 0.09 0.00 0.00 -1.20 -4.92 107.32 98.87 3e8p s GLY 136 Ca 0.51 0.26 0.06 0.00 0.00 0.00 0.00 44.72 45.55 3e8p s GLY 136 CO 0.19 0.03 1.16 -0.57 0.00 0.00 0.00 173.10 173.92 3e8p h ASN 137 N 2.06 0.08 0.00 1.64 -1.24 -1.96 -3.40 115.58 112.76 3e8p h ASN 137 Ca -0.32 -0.09 -0.23 0.00 0.71 0.00 0.00 56.30 56.38 3e8p h ASN 137 Cb 1.29 -0.03 -0.04 0.00 0.73 0.00 0.00 38.32 40.28 3e8p h ASN 137 CO 0.37 1.07 -1.85 0.54 -1.29 0.00 0.00 177.43 176.28 3e8p n ARG 138 N -3.34 0.37 -4.38 6.67 1.74 -1.26 -3.95 116.66 112.50 3e8p n ARG 138 Ca -0.04 0.09 -0.19 0.00 -0.77 0.00 0.00 57.85 56.94 3e8p n ARG 138 Cb 0.97 -1.28 -0.15 0.00 -1.02 0.00 0.00 32.46 30.98 3e8p n ARG 138 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3e8p s VAL 139 N -2.30 0.74 0.06 1.55 1.01 -1.26 -0.39 120.40 119.81 3e8p s VAL 139 Ca -0.20 -0.39 0.05 0.00 0.00 0.00 0.00 61.98 61.43 3e8p s VAL 139 Cb 0.05 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.78 3e8p s VAL 139 CO 0.34 0.21 -0.13 -0.44 0.00 0.00 0.00 175.10 175.08 3e8p s SER 140 N -0.17 1.55 -0.08 3.32 0.01 -0.14 -3.26 113.70 114.93 3e8p s SER 140 Ca 0.03 -0.58 0.04 0.00 1.31 0.00 0.00 55.95 56.75 3e8p s SER 140 Cb -0.04 -0.04 -0.01 0.00 0.21 0.00 0.00 66.02 66.13 3e8p s SER 140 CO -0.00 -0.08 -0.21 -0.69 0.41 0.00 0.00 173.24 172.67 3e8p s VAL 141 N -1.22 2.41 0.15 3.43 1.01 -0.52 0.24 120.40 125.90 3e8p s VAL 141 Ca -0.03 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 61.08 3e8p s VAL 141 Cb -0.10 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 3e8p s VAL 141 CO 0.02 0.56 -0.11 0.00 0.00 0.00 0.00 175.10 175.57 3e8p s ARG 143 N -3.67 2.23 -0.28 0.00 0.52 -0.18 -0.04 118.95 117.53 3e8p s ARG 143 Ca 0.17 -2.23 -0.26 0.00 -0.52 0.00 0.00 55.73 52.89 3e8p s ARG 143 Cb 0.02 -1.82 0.18 0.00 0.52 0.00 0.00 34.95 33.84 3e8p s ARG 143 CO 0.02 -0.53 1.36 -2.00 0.02 0.00 0.00 175.30 174.16 3e8p s GLU 145 N -4.11 0.13 -0.04 3.54 -6.30 0.72 -1.30 118.70 111.33 3e8p s GLU 145 Ca 0.19 0.11 0.03 0.00 -2.50 0.00 0.00 54.97 52.80 3e8p s GLU 145 Cb -0.01 0.06 0.00 0.00 0.00 0.00 0.00 34.13 34.19 3e8p s GLU 145 CO 0.12 -0.03 -0.13 -1.17 0.02 0.00 0.00 175.26 174.07 3e8p s LEU 146 N -0.32 1.80 0.05 2.70 2.96 -0.61 -1.48 118.68 123.78 3e8p s LEU 146 Ca 0.07 -0.28 -0.01 0.00 -0.22 0.00 0.00 54.13 53.70 3e8p s LEU 146 Cb -0.04 -0.78 -0.04 0.00 0.50 0.00 0.00 46.19 45.84 3e8p s LEU 146 CO -0.12 0.09 -0.03 -1.38 -1.32 0.00 0.00 176.35 173.59 3e8p s HIS 147 N 0.25 0.52 0.92 5.38 -3.43 0.19 -0.22 115.29 118.89 3e8p s HIS 147 Ca -0.06 -0.97 -0.13 0.00 -0.80 0.00 0.00 55.06 53.11 3e8p s HIS 147 Cb -0.11 -0.37 0.19 0.00 -1.43 0.00 0.00 32.58 30.85 3e8p s HIS 147 CO 0.02 -0.33 1.26 0.54 -2.00 0.00 0.00 174.74 174.23 3e8p s ASN 148 N -2.69 3.31 0.21 7.38 2.20 -0.66 -1.22 114.94 123.47 3e8p s ASN 148 Ca 0.04 0.08 0.21 0.00 -0.94 0.00 0.00 52.86 52.25 3e8p s ASN 148 Cb 0.05 -0.17 0.90 0.00 -2.00 0.00 0.00 41.25 40.03 3e8p s ASN 148 CO -0.08 -2.59 1.63 -1.84 -2.94 0.00 0.00 177.10 171.28 3e8p n GLU 149 N -3.58 0.14 -0.31 3.55 0.28 -1.18 -1.89 120.64 117.65 3e8p n GLU 149 Ca 0.16 0.43 0.10 0.00 -0.16 0.00 0.00 57.16 57.68 3e8p n GLU 149 Cb 0.60 -1.80 0.27 0.00 1.43 0.00 0.00 31.44 31.93 3e8p n GLU 149 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 3e8p n GLN 150 N -2.08 2.42 -0.87 3.44 1.13 -1.26 -4.95 117.38 115.21 3e8p n GLN 150 Ca 0.02 -2.21 0.00 0.00 -1.94 0.00 0.00 57.00 52.87 3e8p n GLN 150 Cb 0.18 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.06 3e8p n GLN 150 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3e8p n GLY 151 N 1.48 1.21 3.86 1.08 0.00 -0.79 -5.04 105.19 106.98 3e8p n GLY 151 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 3e8p n GLY 151 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3e8p s THR 152 N -3.85 4.89 -0.08 2.61 -4.23 -1.26 -4.84 115.64 108.87 3e8p s THR 152 Ca 0.00 0.67 -0.30 0.00 -1.18 0.00 0.00 61.69 60.89 3e8p s THR 152 Cb 0.00 -3.68 -0.03 0.00 1.34 0.00 0.00 72.50 70.13 3e8p s THR 152 CO 0.00 0.10 1.21 -1.00 -0.54 0.00 0.00 174.62 174.39 3e8p s HIS 153 N -1.63 3.13 -0.02 3.99 3.76 -1.26 -1.65 115.29 121.60 3e8p s HIS 153 Ca 0.42 1.18 0.01 0.00 -0.15 0.00 0.00 55.06 56.52 3e8p s HIS 153 Cb -0.13 -3.43 -0.26 0.00 1.11 0.00 0.00 32.58 29.87 3e8p s HIS 153 CO 0.20 -1.37 0.74 0.82 -0.85 0.00 0.00 174.74 174.28 3e8p h ILE 154 N 5.11 1.01 -2.48 0.60 5.03 -0.90 -3.37 117.51 122.51 3e8p h ILE 154 Ca -0.32 -2.73 0.04 0.00 -0.12 0.00 0.00 64.86 61.73 3e8p h ILE 154 Cb 1.15 2.63 -0.15 0.00 -3.03 0.00 0.00 36.82 37.42 3e8p h ILE 154 CO 0.90 0.76 0.37 0.00 -0.68 0.00 0.00 178.15 179.49 3e8p s ALA 155 N -2.61 -1.74 0.21 1.87 0.00 -1.16 -1.38 121.76 116.95 3e8p s ALA 155 Ca -0.10 0.88 0.11 0.00 0.00 0.00 0.00 51.96 52.85 3e8p s ALA 155 Cb 0.07 0.49 -0.05 0.00 0.00 0.00 0.00 23.12 23.63 3e8p s ALA 155 CO 0.83 -0.67 -0.22 -0.06 0.00 0.00 0.00 175.76 175.64 3e8p s PHE 156 N -3.07 2.24 0.03 0.00 0.08 -0.77 -1.57 117.98 114.92 3e8p s PHE 156 Ca 0.02 -0.37 -0.02 0.00 0.12 0.00 0.00 56.93 56.68 3e8p s PHE 156 Cb -0.01 -1.08 -0.02 0.00 -0.57 0.00 0.00 43.02 41.34 3e8p s PHE 156 CO -0.08 0.53 0.01 0.20 -0.10 0.00 0.00 175.22 175.78 3e8p s GLY 157 N -2.87 0.27 -0.04 4.36 0.00 -1.26 -1.25 107.32 106.52 3e8p s GLY 157 Ca 0.22 -0.71 0.01 0.00 0.00 0.00 0.00 44.72 44.25 3e8p s GLY 157 CO 0.11 -0.81 -0.03 -1.59 0.00 0.00 0.00 173.10 170.77 3e8p s THR 158 N -2.37 0.44 0.02 0.90 2.01 -0.37 -4.30 115.64 111.98 3e8p s THR 158 Ca -0.07 -0.08 0.01 0.00 0.31 0.00 0.00 61.69 61.86 3e8p s THR 158 Cb -0.03 -0.48 -0.01 0.00 0.01 0.00 0.00 72.50 71.98 3e8p s THR 158 CO -0.04 0.20 -0.05 -0.83 -0.69 0.00 0.00 174.62 173.21 3e8p s GLY 159 N 0.88 0.33 -0.20 4.40 0.00 0.95 -0.67 107.32 113.01 3e8p s GLY 159 Ca -0.11 -0.49 -0.04 0.00 0.00 0.00 0.00 44.72 44.08 3e8p s GLY 159 CO -0.00 -0.51 -0.03 -1.59 0.00 0.00 0.00 173.10 170.97 3e8p s THR 160 N -0.86 3.64 0.00 0.90 2.01 -0.59 0.10 115.64 120.84 3e8p s THR 160 Ca -0.06 -0.42 0.00 0.00 0.31 0.00 0.00 61.69 61.52 3e8p s THR 160 Cb -0.06 -2.64 0.00 0.00 0.01 0.00 0.00 72.50 69.81 3e8p s THR 160 CO -0.00 0.43 0.00 -1.22 -0.69 0.00 0.00 174.62 173.14 3e8p n TYR 161 N 4.40 0.00 0.00 4.92 4.01 0.14 -0.58 117.16 130.04 3e8p n TYR 161 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 3e8p n TYR 161 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.54 3e8p n TYR 161 CO 0.00 0.00 0.00 1.33 -0.46 0.00 0.00 176.86 177.73 3e8p n VAL 163 N 0.00 0.00 0.00 -0.72 0.24 0.48 -0.97 118.33 117.36 3e8p n VAL 163 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 3e8p n VAL 163 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 3e8p n VAL 163 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30