#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v8p s VAL 3 N 0.00 3.08 -0.03 0.00 1.01 -1.22 -4.31 120.40 118.92 1v8p s VAL 3 Ca 0.00 0.91 -0.00 0.00 0.00 0.00 0.00 61.98 62.89 1v8p s VAL 3 Cb 0.00 -3.58 -0.02 0.00 0.00 0.00 0.00 36.38 32.78 1v8p s VAL 3 CO 0.00 0.15 -0.03 -0.62 0.00 0.00 0.00 175.10 174.60 1v8p n GLU 4 N 2.37 0.07 -4.98 2.72 1.02 0.23 -5.00 120.64 117.07 1v8p n GLU 4 Ca 0.05 0.02 -0.32 0.00 -0.02 0.00 0.00 57.16 56.89 1v8p n GLU 4 Cb 0.42 -0.98 -0.14 0.00 -0.02 0.00 0.00 31.44 30.72 1v8p n GLU 4 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1v8p s TYR 5 N -2.05 2.65 -0.27 -0.32 1.51 0.38 -1.80 117.35 117.44 1v8p s TYR 5 Ca -0.04 -0.47 -0.10 0.00 -1.01 0.00 0.00 57.07 55.46 1v8p s TYR 5 Cb 0.01 -1.68 -0.04 0.00 -0.11 0.00 0.00 41.96 40.14 1v8p s TYR 5 CO 0.06 -0.05 0.15 -1.17 -1.11 0.00 0.00 175.55 173.43 1v8p s LEU 6 N -0.26 3.84 -0.15 -1.29 2.96 -0.77 -0.89 118.68 122.12 1v8p s LEU 6 Ca 0.01 -0.13 -0.07 0.00 -0.22 0.00 0.00 54.13 53.71 1v8p s LEU 6 Cb -0.13 -2.04 -0.04 0.00 0.50 0.00 0.00 46.19 44.48 1v8p s LEU 6 CO 0.03 -0.06 0.11 -0.69 -1.32 0.00 0.00 176.35 174.42 1v8p s VAL 7 N 1.70 5.23 0.22 1.68 1.01 0.02 -0.59 120.40 129.67 1v8p s VAL 7 Ca 0.07 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.17 1v8p s VAL 7 Cb -0.16 -3.31 0.04 0.00 0.00 0.00 0.00 36.38 32.95 1v8p s VAL 7 CO 0.08 0.55 0.31 -0.90 0.00 0.00 0.00 175.10 175.13 1v8p n ASP 8 N 2.64 0.58 -0.10 3.32 5.68 -0.91 -4.46 116.55 123.31 1v8p n ASP 8 Ca -0.18 -1.45 -0.12 0.00 -0.50 0.00 0.00 54.79 52.53 1v8p n ASP 8 Cb 0.54 -0.18 -0.04 0.00 -1.14 0.00 0.00 41.12 40.29 1v8p n ASP 8 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1v8p h ALA 9 N -0.09 0.42 -0.63 2.12 0.00 -1.89 -0.89 119.26 118.30 1v8p h ALA 9 Ca -0.10 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1v8p h ALA 9 Cb 0.42 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1v8p h ALA 9 CO 0.13 0.36 0.40 0.66 0.00 0.00 0.00 179.25 180.79 1v8p h SER 10 N 0.40 0.74 0.57 0.00 4.64 -1.96 0.10 113.55 118.03 1v8p h SER 10 Ca 0.06 -0.04 -0.03 0.00 -0.47 0.00 0.00 61.79 61.31 1v8p h SER 10 Cb 0.74 -0.18 0.01 0.00 -0.31 0.00 0.00 62.40 62.65 1v8p h SER 10 CO 0.05 0.55 -0.27 0.00 -0.87 0.00 0.00 176.83 176.29 1v8p h ALA 11 N 1.21 -0.77 -0.85 5.18 0.00 -1.80 -2.62 119.26 119.61 1v8p h ALA 11 Ca 0.23 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 55.16 1v8p h ALA 11 Cb -0.06 0.30 -0.13 0.00 0.00 0.00 0.00 17.79 17.89 1v8p h ALA 11 CO -0.05 -0.83 0.22 1.25 0.00 0.00 0.00 179.25 179.85 1v8p h LEU 12 N -0.97 0.00 -0.69 0.00 7.12 -1.00 0.14 115.31 119.90 1v8p h LEU 12 Ca -0.08 0.19 -0.06 0.00 0.13 0.00 0.00 57.88 58.06 1v8p h LEU 12 Cb 0.65 0.25 -0.03 0.00 -0.53 0.00 0.00 40.66 41.00 1v8p h LEU 12 CO 0.13 -0.13 0.20 0.22 -0.13 0.00 0.00 178.44 178.73 1v8p h TYR 13 N 0.23 1.12 -0.21 1.25 3.20 -0.91 -2.29 116.97 119.36 1v8p h TYR 13 Ca 0.52 -0.12 -0.05 0.00 3.14 0.00 0.00 58.73 62.22 1v8p h TYR 13 Cb 1.01 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 1v8p h TYR 13 CO -0.27 0.91 -0.07 0.00 -1.64 0.00 0.00 178.16 177.09 1v8p h ALA 14 N 1.09 0.30 0.00 1.82 0.00 -0.48 -2.96 119.26 119.03 1v8p h ALA 14 Ca 0.22 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1v8p h ALA 14 Cb 0.32 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1v8p h ALA 14 CO -0.00 0.10 0.00 1.28 0.00 0.00 0.00 179.25 180.62 1v8p n LEU 15 N -4.59 0.59 0.00 0.00 4.77 0.24 -1.35 117.00 116.66 1v8p n LEU 15 Ca -0.04 0.74 0.12 0.00 -0.03 0.00 0.00 56.01 56.80 1v8p n LEU 15 Cb 0.30 -0.78 0.58 0.00 -2.33 0.00 0.00 43.42 41.19 1v8p n LEU 15 CO 0.39 -0.87 0.89 0.00 -1.33 0.00 0.00 177.39 176.47 1v8p n ALA 16 N -1.78 2.19 0.82 -1.18 0.00 -0.87 -2.36 120.51 117.32 1v8p n ALA 16 Ca -0.01 -0.11 0.09 0.00 0.00 0.00 0.00 53.44 53.42 1v8p n ALA 16 Cb 0.08 -1.39 0.04 0.00 0.00 0.00 0.00 19.45 18.18 1v8p n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v8p n ALA 17 N -1.34 2.89 -2.86 0.00 0.00 -0.46 -4.51 120.51 114.23 1v8p n ALA 17 Ca 0.10 -0.62 -0.17 0.00 0.00 0.00 0.00 53.44 52.76 1v8p n ALA 17 Cb 0.21 -0.65 -0.00 0.00 0.00 0.00 0.00 19.45 19.00 1v8p n ALA 17 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1v8p n HIS 18 N 0.52 1.46 0.11 0.00 8.25 -1.00 -4.96 115.22 119.59 1v8p n HIS 18 Ca 0.10 -3.35 -0.14 0.00 -0.26 0.00 0.00 57.72 54.07 1v8p n HIS 18 Cb 0.44 -0.37 -0.08 0.00 1.12 0.00 0.00 29.99 31.10 1v8p n HIS 18 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1v8p h TYR 19 N 2.94 -1.26 -0.83 4.41 3.20 -1.79 -3.08 116.97 120.57 1v8p h TYR 19 Ca 0.05 0.03 0.21 0.00 3.14 0.00 0.00 58.73 62.16 1v8p h TYR 19 Cb 0.99 0.53 -0.15 0.00 1.54 0.00 0.00 36.73 39.64 1v8p h TYR 19 CO 0.57 -0.50 -0.05 -0.25 -1.64 0.00 0.00 178.16 176.29 1v8p n ASP 20 N -4.94 -0.16 0.26 -2.11 8.00 -1.26 -1.13 116.55 115.21 1v8p n ASP 20 Ca -0.07 1.41 0.13 0.00 0.71 0.00 0.00 54.79 56.97 1v8p n ASP 20 Cb 0.34 -0.49 0.68 0.00 -0.02 0.00 0.00 41.12 41.64 1v8p n ASP 20 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1v8p h LYS 21 N 0.00 0.00 0.00 -1.24 1.57 -1.95 -3.39 116.57 111.56 1v8p h LYS 21 Ca 0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.25 1v8p h LYS 21 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.21 1v8p h LYS 21 CO -0.80 0.12 -0.90 -2.67 -0.57 0.00 0.00 179.45 174.64 1v8p n TRP 22 N -3.44 0.00 -0.21 -1.35 4.27 -0.28 -4.69 117.44 111.74 1v8p n TRP 22 Ca -0.01 0.00 0.31 0.00 -3.89 0.00 0.00 57.50 53.91 1v8p n TRP 22 Cb 0.29 0.00 0.69 0.00 -1.36 0.00 0.00 31.31 30.93 1v8p n TRP 22 CO 0.00 0.00 0.00 -0.84 -2.29 0.00 0.00 177.69 174.56 1v8p h ILE 23 N 0.00 0.27 -0.50 -1.67 -0.00 -1.66 1.41 117.51 115.37 1v8p h ILE 23 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 64.86 64.89 1v8p h ILE 23 Cb 0.55 0.35 -0.03 0.00 -0.00 0.00 0.00 36.82 37.70 1v8p h ILE 23 CO 0.00 0.00 0.33 0.50 -0.00 0.00 0.00 178.15 178.98 1v8p h LYS 24 N 0.00 0.56 -0.60 0.16 3.64 -1.84 -2.67 116.57 115.83 1v8p h LYS 24 Ca 0.47 -0.03 -0.30 0.00 -1.27 0.00 0.00 60.65 59.51 1v8p h LYS 24 Cb 2.19 -0.13 -0.18 0.00 -0.41 0.00 0.00 32.23 33.71 1v8p h LYS 24 CO -0.00 0.37 0.20 0.72 -2.27 0.00 0.00 179.45 178.46 1v8p n HIS 25 N -4.47 1.85 -0.31 1.91 8.25 0.48 -4.77 115.22 118.15 1v8p n HIS 25 Ca 0.05 -1.67 0.00 0.00 -0.26 0.00 0.00 57.72 55.84 1v8p n HIS 25 Cb 0.13 -0.66 0.14 0.00 1.12 0.00 0.00 29.99 30.71 1v8p n HIS 25 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1v8p h ARG 26 N 1.07 0.97 0.00 -0.41 0.11 -1.32 -2.61 114.38 112.19 1v8p h ARG 26 Ca 0.37 -0.06 0.00 0.00 0.10 0.00 0.00 59.98 60.39 1v8p h ARG 26 Cb 2.12 -0.22 0.00 0.00 1.11 0.00 0.00 29.97 32.98 1v8p h ARG 26 CO 0.66 0.64 0.00 -0.85 0.10 0.00 0.00 179.97 180.52 1v8p n GLU 27 N -4.60 0.19 -0.01 0.08 0.00 -1.26 -0.26 120.64 114.78 1v8p n GLU 27 Ca 0.12 0.05 0.08 0.00 0.00 0.00 0.00 57.16 57.41 1v8p n GLU 27 Cb 0.16 -1.50 -0.11 0.00 0.00 0.00 0.00 31.44 29.99 1v8p n GLU 27 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1v8p n LYS 28 N -1.07 0.92 -3.52 3.44 5.02 -0.98 -3.44 118.16 118.52 1v8p n LYS 28 Ca 0.05 -0.10 -0.37 0.00 -2.02 0.00 0.00 58.31 55.87 1v8p n LYS 28 Cb 0.03 -1.33 -0.07 0.00 -0.02 0.00 0.00 35.03 33.64 1v8p n LYS 28 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1v8p s LEU 29 N -3.68 4.22 0.24 -0.35 1.02 0.64 0.76 118.68 121.54 1v8p s LEU 29 Ca -0.02 0.48 0.03 0.00 0.02 0.00 0.00 54.13 54.64 1v8p s LEU 29 Cb 0.11 -2.37 -0.05 0.00 0.02 0.00 0.00 46.19 43.89 1v8p s LEU 29 CO 0.66 0.07 0.02 0.00 0.02 0.00 0.00 176.35 177.12 1v8p s ALA 30 N 0.61 1.81 0.36 4.21 0.00 -0.07 -2.52 121.76 126.14 1v8p s ALA 30 Ca 0.16 -1.80 -0.00 0.00 0.00 0.00 0.00 51.96 50.32 1v8p s ALA 30 Cb -0.13 0.61 0.00 0.00 0.00 0.00 0.00 23.12 23.60 1v8p s ALA 30 CO 0.04 -0.30 0.46 0.96 0.00 0.00 0.00 175.76 176.93 1v8p s ILE 31 N -3.49 0.00 0.21 0.00 -4.36 -0.39 -0.80 121.20 112.37 1v8p s ILE 31 Ca 0.30 -1.65 0.07 0.00 -0.26 0.00 0.00 60.65 59.11 1v8p s ILE 31 Cb 0.06 -2.66 -0.04 0.00 1.25 0.00 0.00 42.46 41.08 1v8p s ILE 31 CO 0.10 0.00 0.09 -0.76 0.24 0.00 0.00 174.94 174.61 1v8p s LEU 32 N -3.28 3.57 0.51 0.37 1.43 -1.26 -0.62 118.68 119.41 1v8p s LEU 32 Ca 0.32 -0.33 0.27 0.00 -1.03 0.00 0.00 54.13 53.36 1v8p s LEU 32 Cb -0.00 -2.15 1.38 0.00 0.03 0.00 0.00 46.19 45.45 1v8p s LEU 32 CO 0.23 0.03 1.92 0.45 0.23 0.00 0.00 176.35 179.21 1v8p h HIS 33 N 2.12 0.09 -0.60 0.29 3.86 -1.94 -0.08 115.15 118.90 1v8p h HIS 33 Ca -0.47 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 58.71 1v8p h HIS 33 Cb 1.22 -0.03 -0.03 0.00 1.06 0.00 0.00 27.41 29.63 1v8p h HIS 33 CO 0.60 0.03 0.26 1.25 0.86 0.00 0.00 177.93 180.93 1v8p h LEU 34 N 0.07 0.78 -1.92 2.43 6.46 -1.95 -3.07 115.31 118.11 1v8p h LEU 34 Ca 0.37 -0.09 0.02 0.00 -0.12 0.00 0.00 57.88 58.05 1v8p h LEU 34 Cb 1.35 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 41.08 1v8p h LEU 34 CO -0.03 0.68 0.09 0.74 -0.62 0.00 0.00 178.44 179.30 1v8p h THR 35 N 0.85 1.00 -0.11 1.05 2.02 -1.38 -1.19 112.91 115.14 1v8p h THR 35 Ca 0.20 -0.04 -0.03 0.00 0.77 0.00 0.00 66.41 67.32 1v8p h THR 35 Cb 0.14 0.88 -0.00 0.00 -1.74 0.00 0.00 68.15 67.42 1v8p h THR 35 CO -0.02 0.02 -0.05 0.40 0.37 0.00 0.00 175.52 176.24 1v8p h ILE 36 N 0.11 1.32 -0.41 3.11 2.04 -1.63 -0.52 117.51 121.52 1v8p h ILE 36 Ca 0.05 -1.08 -0.14 0.00 1.00 0.00 0.00 64.86 64.70 1v8p h ILE 36 Cb 0.08 1.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 1v8p h ILE 36 CO -0.01 0.31 -0.30 1.88 0.00 0.00 0.00 178.15 180.03 1v8p h TYR 37 N -0.12 1.09 -0.16 1.37 -1.99 -1.59 -1.51 116.97 114.06 1v8p h TYR 37 Ca 0.02 -0.30 0.01 0.00 2.00 0.00 0.00 58.73 60.46 1v8p h TYR 37 Cb 0.51 -0.24 -0.01 0.00 2.00 0.00 0.00 36.73 38.99 1v8p h TYR 37 CO 0.07 1.12 0.09 0.93 -0.00 0.00 0.00 178.16 180.36 1v8p h GLU 38 N 0.75 0.18 -0.10 4.88 5.08 -1.21 0.08 114.58 124.23 1v8p h GLU 38 Ca 0.08 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.46 1v8p h GLU 38 Cb 0.89 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.06 1v8p h GLU 38 CO 0.08 0.12 -0.09 0.00 -1.00 0.00 0.00 179.01 178.12 1v8p h ALA 39 N 1.07 -0.01 -0.51 3.43 0.00 -1.00 -1.76 119.26 120.47 1v8p h ALA 39 Ca 0.06 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1v8p h ALA 39 Cb -0.00 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1v8p h ALA 39 CO -0.03 -0.55 0.22 0.78 0.00 0.00 0.00 179.25 179.67 1v8p h GLY 40 N -0.11 0.77 1.40 0.00 0.00 -1.08 -2.26 103.07 101.79 1v8p h GLY 40 Ca 0.07 -0.36 -0.12 0.00 0.00 0.00 0.00 47.33 46.92 1v8p h GLY 40 CO -0.16 0.35 -0.28 -0.57 0.00 0.00 0.00 176.54 175.87 1v8p h ASN 41 N 0.72 0.70 -0.47 0.19 -0.73 -0.51 0.29 115.58 115.78 1v8p h ASN 41 Ca 0.18 -0.27 0.00 0.00 1.87 0.00 0.00 56.30 58.08 1v8p h ASN 41 Cb 0.11 -0.19 -0.02 0.00 0.27 0.00 0.00 38.32 38.48 1v8p h ASN 41 CO -0.02 0.94 0.31 0.00 -0.37 0.00 0.00 177.43 178.29 1v8p h ALA 42 N 1.10 0.59 -0.42 1.57 0.00 -0.94 0.44 119.26 121.61 1v8p h ALA 42 Ca 0.07 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1v8p h ALA 42 Cb 0.78 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1v8p h ALA 42 CO 0.06 0.04 -0.23 1.25 0.00 0.00 0.00 179.25 180.38 1v8p h LEU 43 N 0.63 0.92 -1.65 0.00 6.46 -1.19 -2.04 115.31 118.45 1v8p h LEU 43 Ca 0.17 -0.41 0.12 0.00 -0.12 0.00 0.00 57.88 57.64 1v8p h LEU 43 Cb -0.07 -0.25 -0.04 0.00 -0.73 0.00 0.00 40.66 39.56 1v8p h LEU 43 CO -0.04 1.13 0.44 -0.25 -0.62 0.00 0.00 178.44 179.10 1v8p h TRP 44 N 0.71 0.42 0.35 1.25 7.01 0.14 0.20 115.95 126.03 1v8p h TRP 44 Ca 0.09 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.08 1v8p h TRP 44 Cb 0.80 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 27.73 1v8p h TRP 44 CO 0.06 0.18 -0.17 0.87 -2.79 0.00 0.00 178.44 176.59 1v8p h LYS 45 N 0.38 -0.46 -0.80 2.65 1.57 -0.26 -1.71 116.57 117.95 1v8p h LYS 45 Ca 0.31 0.03 0.18 0.00 -1.87 0.00 0.00 60.65 59.30 1v8p h LYS 45 Cb 0.70 0.10 -0.11 0.00 0.08 0.00 0.00 32.23 33.00 1v8p h LYS 45 CO -0.09 -0.14 0.26 0.93 -0.57 0.00 0.00 179.45 179.85 1v8p h GLU 46 N -0.84 0.33 -0.87 3.15 5.08 -0.65 0.59 114.58 121.38 1v8p h GLU 46 Ca -0.05 -0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.34 1v8p h GLU 46 Cb 0.53 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.65 1v8p h GLU 46 CO 0.08 0.22 0.55 0.00 -1.00 0.00 0.00 179.01 178.85 1v8p h ALA 47 N 1.64 1.18 -0.58 3.43 0.00 -0.56 -1.10 119.26 123.27 1v8p h ALA 47 Ca 0.46 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.26 1v8p h ALA 47 Cb 0.81 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1v8p h ALA 47 CO -0.51 0.33 0.00 0.00 0.00 0.00 0.00 179.25 179.08 1v8p h ARG 48 N 1.02 1.00 -0.93 0.00 2.47 0.10 -2.96 114.38 115.09 1v8p h ARG 48 Ca 0.37 -0.30 -0.12 0.00 -1.26 0.00 0.00 59.98 58.66 1v8p h ARG 48 Cb 0.11 -0.10 -0.07 0.00 -1.65 0.00 0.00 29.97 28.25 1v8p h ARG 48 CO -0.15 0.98 0.16 1.28 0.56 0.00 0.00 179.97 182.80 1v8p n LEU 49 N -4.19 3.86 0.00 3.04 4.77 0.16 -4.89 117.00 119.75 1v8p n LEU 49 Ca 0.03 -1.99 0.00 0.00 -0.03 0.00 0.00 56.01 54.02 1v8p n LEU 49 Cb 0.33 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 1v8p n LEU 49 CO 0.44 0.59 0.00 0.61 -1.33 0.00 0.00 177.39 177.70 1v8p n GLY 50 N 0.01 3.16 3.62 -0.72 0.00 -1.07 -5.02 105.19 105.18 1v8p n GLY 50 Ca 0.19 0.00 -0.61 0.00 0.00 0.00 0.00 46.02 45.60 1v8p n GLY 50 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1v8p n ARG 51 N -1.29 0.56 0.08 1.61 0.63 -0.49 -4.81 116.66 112.95 1v8p n ARG 51 Ca 0.00 0.20 -0.03 0.00 -0.92 0.00 0.00 57.85 57.10 1v8p n ARG 51 Cb 0.00 -1.84 -0.06 0.00 0.45 0.00 0.00 32.46 31.01 1v8p n ARG 51 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1v8p h VAL 52 N 5.63 1.26 -1.61 5.15 2.07 -1.92 -3.34 116.25 123.50 1v8p h VAL 52 Ca -0.38 -2.83 -0.68 0.00 0.82 0.00 0.00 66.70 63.63 1v8p h VAL 52 Cb 1.35 2.61 -0.25 0.00 -1.52 0.00 0.00 31.29 33.48 1v8p h VAL 52 CO 1.00 0.72 0.88 -0.90 0.02 0.00 0.00 177.57 179.28 1v8p n ASP 53 N -3.25 7.30 -0.03 0.57 5.68 -1.26 -4.64 116.55 120.90 1v8p n ASP 53 Ca -0.01 -3.67 -0.15 0.00 -0.50 0.00 0.00 54.79 50.46 1v8p n ASP 53 Cb 0.86 -1.09 -0.09 0.00 -1.14 0.00 0.00 41.12 39.66 1v8p n ASP 53 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 1v8p h TRP 54 N 2.81 0.46 -0.50 2.11 5.08 -1.97 -1.86 115.95 122.08 1v8p h TRP 54 Ca 0.53 -0.19 0.10 0.00 1.08 0.00 0.00 58.89 60.41 1v8p h TRP 54 Cb 0.31 -0.08 -0.10 0.00 -3.00 0.00 0.00 29.16 26.29 1v8p h TRP 54 CO 1.26 0.91 -0.19 0.00 -1.28 0.00 0.00 178.44 179.14 1v8p h ALA 55 N 0.45 0.20 -0.23 0.11 0.00 -1.93 0.67 119.26 118.54 1v8p h ALA 55 Ca -0.01 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1v8p h ALA 55 Cb 0.93 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 1v8p h ALA 55 CO 0.06 -0.52 0.14 0.00 0.00 0.00 0.00 179.25 178.93 1v8p h ALA 56 N 1.31 0.29 -0.02 0.00 0.00 -1.92 -2.89 119.26 116.02 1v8p h ALA 56 Ca 0.24 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.15 1v8p h ALA 56 Cb 0.45 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1v8p h ALA 56 CO -0.56 -0.22 -0.20 0.00 0.00 0.00 0.00 179.25 178.28 1v8p h ALA 57 N 1.06 -0.23 -1.00 0.00 0.00 -0.16 -1.80 119.26 117.13 1v8p h ALA 57 Ca 0.08 0.01 0.28 0.00 0.00 0.00 0.00 54.91 55.28 1v8p h ALA 57 Cb -0.00 0.35 -0.14 0.00 0.00 0.00 0.00 17.79 18.01 1v8p h ALA 57 CO -0.02 -0.69 0.58 0.66 0.00 0.00 0.00 179.25 179.79 1v8p h SER 58 N -0.31 0.60 -0.21 0.00 4.64 0.44 0.49 113.55 119.21 1v8p h SER 58 Ca 0.06 0.16 -0.17 0.00 -0.47 0.00 0.00 61.79 61.37 1v8p h SER 58 Cb 0.39 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1v8p h SER 58 CO -0.20 -0.00 -0.54 0.03 -0.87 0.00 0.00 176.83 175.25 1v8p h ARG 59 N 0.47 0.73 -0.17 4.77 3.08 -1.17 0.11 114.38 122.20 1v8p h ARG 59 Ca 0.68 -0.51 0.01 0.00 0.07 0.00 0.00 59.98 60.23 1v8p h ARG 59 Cb 1.42 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.54 1v8p h ARG 59 CO -0.53 1.13 0.09 1.25 -1.07 0.00 0.00 179.97 180.84 1v8p h HIS 60 N 0.45 0.17 -0.55 3.04 2.76 -0.41 -1.63 115.15 118.98 1v8p h HIS 60 Ca -0.01 0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.21 1v8p h HIS 60 Cb 1.15 -0.05 -0.05 0.00 1.55 0.00 0.00 27.41 30.02 1v8p h HIS 60 CO 0.09 0.10 0.29 1.25 -1.30 0.00 0.00 177.93 178.36 1v8p h LEU 61 N 0.20 0.43 -1.44 0.26 6.46 -0.92 -1.51 115.31 118.79 1v8p h LEU 61 Ca 0.07 0.03 0.05 0.00 -0.12 0.00 0.00 57.88 57.90 1v8p h LEU 61 Cb 0.00 -0.06 -0.04 0.00 -0.73 0.00 0.00 40.66 39.84 1v8p h LEU 61 CO -0.04 0.29 0.42 0.50 -0.62 0.00 0.00 178.44 179.00 1v8p h LYS 62 N 0.56 0.68 -0.15 1.25 3.64 -0.38 -1.85 116.57 120.32 1v8p h LYS 62 Ca 0.24 -0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.44 1v8p h LYS 62 Cb 0.13 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1v8p h LYS 62 CO -0.16 0.45 -0.47 -0.22 -2.27 0.00 0.00 179.45 176.79 1v8p h LYS 63 N 0.70 0.58 -0.54 1.90 3.64 -0.40 -3.04 116.57 119.42 1v8p h LYS 63 Ca 0.27 -0.42 -0.02 0.00 -1.27 0.00 0.00 60.65 59.20 1v8p h LYS 63 Cb 0.17 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1v8p h LYS 63 CO -0.08 1.04 0.26 0.28 -2.27 0.00 0.00 179.45 178.69 1v8p h VAL 64 N 0.22 1.20 -0.57 2.00 2.07 -0.85 -2.74 116.25 117.59 1v8p h VAL 64 Ca -0.02 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 66.96 1v8p h VAL 64 Cb 1.09 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 1v8p h VAL 64 CO 0.10 0.22 0.38 -0.07 0.02 0.00 0.00 177.57 178.22 1v8p h LEU 65 N 0.73 0.62 -1.96 2.57 3.38 -1.40 -1.71 115.31 117.54 1v8p h LEU 65 Ca 0.19 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 1v8p h LEU 65 Cb 0.12 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1v8p h LEU 65 CO -0.02 0.44 -0.01 0.77 0.09 0.00 0.00 178.44 179.71 1v8p h SER 66 N 0.73 0.00 0.66 -0.43 4.64 -1.36 -2.88 113.55 114.91 1v8p h SER 66 Ca 0.21 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.44 1v8p h SER 66 Cb -0.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.05 1v8p h SER 66 CO -0.05 0.01 -0.44 0.28 -0.87 0.00 0.00 176.83 175.75 1v8p h SER 67 N 0.00 0.00 -2.75 4.97 0.02 -1.25 -3.45 113.55 111.08 1v8p h SER 67 Ca -0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 1v8p h SER 67 Cb 0.35 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 1v8p h SER 67 CO 0.00 0.44 -0.41 -0.36 -1.14 0.00 0.00 176.83 175.37 1v8p s PHE 68 N -3.74 3.49 0.92 3.45 0.40 -1.09 -4.73 117.98 116.68 1v8p s PHE 68 Ca -0.01 0.25 -0.13 0.00 -0.60 0.00 0.00 56.93 56.44 1v8p s PHE 68 Cb 0.12 -1.77 0.15 0.00 0.51 0.00 0.00 43.02 42.03 1v8p s PHE 68 CO 0.71 0.47 1.17 0.15 0.70 0.00 0.00 175.22 178.42 1v8p s LYS 69 N -3.13 1.03 -0.14 0.44 1.02 -1.05 -4.84 119.74 113.07 1v8p s LYS 69 Ca 0.37 0.13 0.00 0.00 0.02 0.00 0.00 55.97 56.48 1v8p s LYS 69 Cb -0.11 -1.84 0.03 0.00 -0.52 0.00 0.00 37.83 35.38 1v8p s LYS 69 CO 0.28 -2.24 -0.11 0.08 -0.92 0.00 0.00 175.35 172.44 1v8p s VAL 70 N -3.40 1.36 0.47 3.17 1.01 -1.26 -1.26 120.40 120.49 1v8p s VAL 70 Ca 0.65 -0.54 -0.18 0.00 0.00 0.00 0.00 61.98 61.92 1v8p s VAL 70 Cb -0.12 -1.34 -0.09 0.00 0.00 0.00 0.00 36.38 34.83 1v8p s VAL 70 CO 0.53 0.39 0.95 -0.76 0.00 0.00 0.00 175.10 176.20 1v8p s LEU 71 N 1.56 3.77 0.67 3.92 1.43 0.21 -4.95 118.68 125.30 1v8p s LEU 71 Ca 0.04 1.57 -0.17 0.00 -1.03 0.00 0.00 54.13 54.54 1v8p s LEU 71 Cb -0.13 -4.46 0.00 0.00 0.03 0.00 0.00 46.19 41.63 1v8p s LEU 71 CO -0.10 -0.48 1.23 -1.61 0.23 0.00 0.00 176.35 175.63 1v8p s GLU 72 N -3.69 2.49 0.38 1.70 2.02 -1.26 -4.32 118.70 116.02 1v8p s GLU 72 Ca 0.59 1.84 -0.26 0.00 0.02 0.00 0.00 54.97 57.16 1v8p s GLU 72 Cb -0.10 -1.87 -0.09 0.00 0.10 0.00 0.00 34.13 32.18 1v8p s GLU 72 CO 0.24 -1.59 1.23 -0.51 0.02 0.00 0.00 175.26 174.65 1v8p s ASP 73 N -1.77 6.57 0.87 -0.19 -0.00 -1.26 -4.98 116.67 115.91 1v8p s ASP 73 Ca 0.77 2.49 -0.13 0.00 -0.00 0.00 0.00 52.55 55.68 1v8p s ASP 73 Cb -0.31 -2.63 0.12 0.00 -0.00 0.00 0.00 42.92 40.10 1v8p s ASP 73 CO 0.40 -0.65 1.20 -2.84 -0.00 0.00 0.00 175.17 173.28 1v8p s PRO 74 N -2.11 1.49 -0.13 8.23 0.02 -1.26 -4.98 135.00 136.27 1v8p s PRO 74 Ca 0.54 0.04 -0.29 0.00 0.02 0.00 0.00 61.00 61.31 1v8p s PRO 74 Cb -0.35 -1.90 -0.02 0.00 0.02 0.00 0.00 34.50 32.25 1v8p s PRO 74 CO 0.44 -1.91 1.22 -2.14 -0.33 0.00 0.00 177.00 174.28 1v8p s PRO 75 N -5.58 4.28 0.44 5.54 0.02 -1.26 -4.83 135.00 133.61 1v8p s PRO 75 Ca 0.65 1.64 0.24 0.00 0.02 0.00 0.00 61.00 63.55 1v8p s PRO 75 Cb -0.10 -3.67 1.25 0.00 0.02 0.00 0.00 34.50 31.99 1v8p s PRO 75 CO 0.51 -0.60 1.78 1.25 -0.33 0.00 0.00 177.00 179.62 1v8p h LEU 76 N 9.10 0.30 -0.70 -5.54 6.46 -2.00 -0.54 115.31 122.40 1v8p h LEU 76 Ca -0.29 0.06 0.07 0.00 -0.12 0.00 0.00 57.88 57.60 1v8p h LEU 76 Cb 1.12 0.01 -0.10 0.00 -0.73 0.00 0.00 40.66 40.97 1v8p h LEU 76 CO 0.93 0.05 -0.55 -0.78 -0.62 0.00 0.00 178.44 177.47 1v8p h ASP 77 N 0.26 -1.95 0.18 1.25 -0.00 -2.01 -1.63 116.42 112.52 1v8p h ASP 77 Ca 0.58 0.28 -0.01 0.00 -0.00 0.00 0.00 57.03 57.88 1v8p h ASP 77 Cb 1.73 0.83 0.00 0.00 -0.00 0.00 0.00 39.33 41.90 1v8p h ASP 77 CO -0.21 -0.30 -0.09 -0.33 -0.00 0.00 0.00 179.24 178.32 1v8p h GLU 78 N -0.18 -0.24 -0.85 0.28 4.39 -1.49 -3.26 114.58 113.24 1v8p h GLU 78 Ca 0.11 0.02 0.21 0.00 0.34 0.00 0.00 59.36 60.04 1v8p h GLU 78 Cb 0.48 0.05 -0.13 0.00 -0.10 0.00 0.00 28.75 29.05 1v8p h GLU 78 CO -0.75 0.17 0.28 0.28 -1.16 0.00 0.00 179.01 177.83 1v8p h VAL 79 N -0.78 0.43 0.11 3.13 2.07 -1.43 -1.19 116.25 118.59 1v8p h VAL 79 Ca -0.02 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1v8p h VAL 79 Cb 0.52 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1v8p h VAL 79 CO 0.04 0.05 -0.10 0.25 0.02 0.00 0.00 177.57 177.83 1v8p h LEU 80 N 0.30 -0.27 -0.41 2.57 6.46 -1.39 -1.26 115.31 121.30 1v8p h LEU 80 Ca 0.52 0.03 0.09 0.00 -0.12 0.00 0.00 57.88 58.39 1v8p h LEU 80 Cb 0.98 0.10 -0.09 0.00 -0.73 0.00 0.00 40.66 40.92 1v8p h LEU 80 CO -0.57 -0.16 -0.21 -0.09 -0.62 0.00 0.00 178.44 176.80 1v8p h ARG 81 N -0.23 -0.13 -0.79 1.25 2.43 -1.28 -0.01 114.38 115.62 1v8p h ARG 81 Ca 0.00 0.01 0.11 0.00 -0.81 0.00 0.00 59.98 59.29 1v8p h ARG 81 Cb 0.22 0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 29.72 1v8p h ARG 81 CO -0.03 -0.08 0.42 0.28 -1.51 0.00 0.00 179.97 179.04 1v8p h VAL 82 N -0.13 0.84 -0.07 0.20 2.07 -0.97 -2.05 116.25 116.13 1v8p h VAL 82 Ca 0.20 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.51 1v8p h VAL 82 Cb 0.44 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 1v8p h VAL 82 CO -0.49 0.12 -0.06 0.00 0.02 0.00 0.00 177.57 177.17 1v8p h ALA 83 N 1.47 0.01 0.77 1.67 0.00 0.17 -1.65 119.26 121.69 1v8p h ALA 83 Ca 0.40 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.30 1v8p h ALA 83 Cb 0.44 0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.36 1v8p h ALA 83 CO -0.29 -0.53 -0.37 0.28 0.00 0.00 0.00 179.25 178.35 1v8p h VAL 84 N -0.07 0.24 -0.44 0.00 2.07 -0.93 -0.03 116.25 117.10 1v8p h VAL 84 Ca 0.05 -0.02 0.02 0.00 0.82 0.00 0.00 66.70 67.57 1v8p h VAL 84 Cb 0.14 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.13 1v8p h VAL 84 CO -0.12 0.00 0.29 -0.33 0.02 0.00 0.00 177.57 177.44 1v8p h GLU 85 N -1.05 0.50 -0.01 1.57 5.08 -1.37 -3.10 114.58 116.20 1v8p h GLU 85 Ca -0.11 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1v8p h GLU 85 Cb 0.80 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.93 1v8p h GLU 85 CO 0.17 0.33 -0.67 0.54 -1.00 0.00 0.00 179.01 178.38 1v8p n ARG 86 N -4.48 1.04 -2.59 2.33 1.74 -0.62 -5.00 116.66 109.08 1v8p n ARG 86 Ca 0.04 -0.44 -0.06 0.00 -0.77 0.00 0.00 57.85 56.62 1v8p n ARG 86 Cb 0.12 -1.40 0.03 0.00 -1.02 0.00 0.00 32.46 30.19 1v8p n ARG 86 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1v8p n GLY 87 N 1.39 0.24 3.38 -0.13 0.00 -0.14 -5.06 105.19 104.87 1v8p n GLY 87 Ca 0.06 -0.30 -0.22 0.00 0.00 0.00 0.00 46.02 45.55 1v8p n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1v8p s LEU 88 N -3.41 2.49 0.78 0.99 1.43 -0.54 -5.06 118.68 115.36 1v8p s LEU 88 Ca 0.05 -0.93 -0.11 0.00 -1.03 0.00 0.00 54.13 52.11 1v8p s LEU 88 Cb -0.02 -0.90 0.06 0.00 0.03 0.00 0.00 46.19 45.35 1v8p s LEU 88 CO 0.25 -0.02 1.08 0.42 0.23 0.00 0.00 176.35 178.31 1v8p s THR 89 N -2.28 3.37 0.41 5.49 -4.23 -1.26 -4.56 115.64 112.58 1v8p s THR 89 Ca 0.21 0.45 0.09 0.00 -1.18 0.00 0.00 61.69 61.25 1v8p s THR 89 Cb -0.05 -3.05 0.22 0.00 1.34 0.00 0.00 72.50 70.96 1v8p s THR 89 CO 0.09 -0.58 2.01 0.15 -0.54 0.00 0.00 174.62 175.74 1v8p h PHE 90 N -1.08 0.35 0.66 3.99 3.57 -1.94 -0.28 116.94 122.21 1v8p h PHE 90 Ca -0.45 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.00 1v8p h PHE 90 Cb 1.24 -0.11 0.01 0.00 2.79 0.00 0.00 35.95 39.88 1v8p h PHE 90 CO 0.54 0.31 -0.32 1.88 -2.23 0.00 0.00 178.31 178.50 1v8p h TYR 91 N 0.35 -0.82 -0.64 0.41 0.05 -1.97 -1.51 116.97 112.85 1v8p h TYR 91 Ca 0.09 -0.02 0.13 0.00 0.05 0.00 0.00 58.73 58.97 1v8p h TYR 91 Cb 0.14 0.27 -0.09 0.00 1.01 0.00 0.00 36.73 38.05 1v8p h TYR 91 CO 0.00 -0.51 0.12 -0.44 -1.05 0.00 0.00 178.16 176.28 1v8p h ASP 92 N -0.97 -0.04 0.09 3.88 3.45 -1.87 0.13 116.42 121.10 1v8p h ASP 92 Ca -0.09 0.13 -0.00 0.00 0.43 0.00 0.00 57.03 57.50 1v8p h ASP 92 Cb 0.68 0.18 -0.00 0.00 -0.56 0.00 0.00 39.33 39.63 1v8p h ASP 92 CO 0.15 -0.02 -0.00 0.00 -1.57 0.00 0.00 179.24 177.79 1v8p h ALA 93 N 1.53 1.06 -0.41 3.45 0.00 -0.97 -1.53 119.26 122.38 1v8p h ALA 93 Ca 0.34 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.16 1v8p h ALA 93 Cb 0.54 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1v8p h ALA 93 CO -0.45 0.00 -0.08 0.77 0.00 0.00 0.00 179.25 179.49 1v8p h SER 94 N 0.00 0.79 0.30 0.00 0.02 0.36 -1.57 113.55 113.45 1v8p h SER 94 Ca -0.00 -0.35 -0.01 0.00 -0.84 0.00 0.00 61.79 60.58 1v8p h SER 94 Cb 0.05 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.38 1v8p h SER 94 CO 0.00 0.96 -0.14 1.88 -1.14 0.00 0.00 176.83 178.39 1v8p h TYR 95 N 0.61 -0.37 -0.84 3.45 -1.99 -1.29 -2.47 116.97 114.06 1v8p h TYR 95 Ca 0.11 -0.01 0.13 0.00 2.00 0.00 0.00 58.73 60.96 1v8p h TYR 95 Cb 0.61 0.12 -0.09 0.00 2.00 0.00 0.00 36.73 39.37 1v8p h TYR 95 CO 0.05 -0.05 0.45 0.00 -0.00 0.00 0.00 178.16 178.61 1v8p h ALA 96 N -0.17 1.24 -0.43 3.88 0.00 -1.52 0.40 119.26 122.67 1v8p h ALA 96 Ca -0.04 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1v8p h ALA 96 Cb 0.49 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1v8p h ALA 96 CO 0.07 -0.03 -0.03 -0.92 0.00 0.00 0.00 179.25 178.34 1v8p h TYR 97 N 0.67 0.86 0.04 0.00 3.20 -1.28 -2.74 116.97 117.72 1v8p h TYR 97 Ca 0.44 -0.16 -0.00 0.00 3.14 0.00 0.00 58.73 62.15 1v8p h TYR 97 Cb 0.56 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.61 1v8p h TYR 97 CO -0.08 0.85 -0.02 0.28 -1.64 0.00 0.00 178.16 177.55 1v8p h VAL 98 N 0.61 1.29 -0.20 1.81 2.07 -0.93 -1.86 116.25 119.04 1v8p h VAL 98 Ca 0.12 -1.10 0.03 0.00 0.82 0.00 0.00 66.70 66.56 1v8p h VAL 98 Cb 0.53 2.01 -0.05 0.00 -1.52 0.00 0.00 31.29 32.27 1v8p h VAL 98 CO 0.03 0.28 -0.33 0.00 0.02 0.00 0.00 177.57 177.56 1v8p h ALA 99 N 0.38 -0.62 0.26 1.67 0.00 -1.00 -0.19 119.26 119.77 1v8p h ALA 99 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1v8p h ALA 99 Cb 0.49 0.93 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 1v8p h ALA 99 CO 0.01 -0.76 -0.34 0.93 0.00 0.00 0.00 179.25 179.09 1v8p h GLU 100 N -0.26 -0.60 -0.11 0.00 5.08 -1.57 0.27 114.58 117.39 1v8p h GLU 100 Ca 0.04 0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.47 1v8p h GLU 100 Cb 0.37 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 1v8p h GLU 100 CO -0.33 -0.40 0.21 0.66 -1.00 0.00 0.00 179.01 178.15 1v8p h SER 101 N -0.62 0.00 0.17 1.42 4.64 -1.27 0.58 113.55 118.47 1v8p h SER 101 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1v8p h SER 101 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1v8p h SER 101 CO -0.08 0.00 -0.69 -1.20 -0.87 0.00 0.00 176.83 173.99 1v8p n SER 102 N -3.41 1.01 -2.56 4.97 7.64 -0.09 -4.98 113.62 116.20 1v8p n SER 102 Ca 0.00 -0.85 -0.11 0.00 1.01 0.00 0.00 58.87 58.92 1v8p n SER 102 Cb 0.31 0.61 0.06 0.00 -1.01 0.00 0.00 64.21 64.17 1v8p n SER 102 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v8p n GLY 103 N 1.47 -0.08 3.37 0.23 0.00 0.20 -5.05 105.19 105.34 1v8p n GLY 103 Ca 0.06 -0.10 -0.19 0.00 0.00 0.00 0.00 46.02 45.79 1v8p n GLY 103 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1v8p s LEU 104 N -4.79 2.50 -0.26 0.99 1.43 0.72 -5.01 118.68 114.26 1v8p s LEU 104 Ca 0.01 -1.10 -0.20 0.00 -1.03 0.00 0.00 54.13 51.81 1v8p s LEU 104 Cb -0.00 -0.61 -0.02 0.00 0.03 0.00 0.00 46.19 45.58 1v8p s LEU 104 CO 0.47 -0.27 0.59 -0.69 0.23 0.00 0.00 176.35 176.68 1v8p s VAL 105 N -3.04 5.01 0.16 -1.59 1.01 -0.74 -4.27 120.40 116.95 1v8p s VAL 105 Ca 0.25 1.05 -0.30 0.00 0.00 0.00 0.00 61.98 62.98 1v8p s VAL 105 Cb 0.02 -3.90 -0.07 0.00 0.00 0.00 0.00 36.38 32.43 1v8p s VAL 105 CO 0.09 0.05 1.03 -0.22 0.00 0.00 0.00 175.10 176.04 1v8p s LEU 106 N 2.43 4.52 -0.26 3.92 0.20 -1.26 -1.85 118.68 126.37 1v8p s LEU 106 Ca 0.25 1.96 -0.01 0.00 0.69 0.00 0.00 54.13 57.02 1v8p s LEU 106 Cb -0.16 -3.60 0.03 0.00 -0.43 0.00 0.00 46.19 42.04 1v8p s LEU 106 CO 0.09 -0.11 -0.06 -0.69 -0.29 0.00 0.00 176.35 175.29 1v8p s VAL 107 N -0.30 2.83 0.07 1.68 1.01 0.25 -0.92 120.40 125.02 1v8p s VAL 107 Ca 0.47 -1.12 -0.02 0.00 0.00 0.00 0.00 61.98 61.31 1v8p s VAL 107 Cb -0.27 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 1v8p s VAL 107 CO 0.33 0.14 0.02 0.28 0.00 0.00 0.00 175.10 175.87 1v8p s THR 108 N 1.30 0.18 -0.80 3.92 -1.32 -0.64 -2.15 115.64 116.13 1v8p s THR 108 Ca -0.01 -1.74 0.14 0.00 -1.21 0.00 0.00 61.69 58.86 1v8p s THR 108 Cb -0.17 -1.61 0.42 0.00 -1.51 0.00 0.00 72.50 69.63 1v8p s THR 108 CO -0.04 -0.84 1.35 1.67 -2.21 0.00 0.00 174.62 174.55 1v8p n GLN 109 N 0.04 2.98 -3.25 7.08 -0.06 -1.26 -3.97 117.38 118.94 1v8p n GLN 109 Ca -0.12 -2.38 -0.44 0.00 -2.00 0.00 0.00 57.00 52.06 1v8p n GLN 109 Cb 0.62 -1.50 -0.06 0.00 -4.06 0.00 0.00 30.24 25.23 1v8p n GLN 109 CO 0.00 0.00 0.00 0.34 -0.20 0.00 0.00 177.06 177.20 1v8p s ASP 110 N -1.23 6.19 0.29 1.69 -1.08 -1.26 -4.94 116.67 116.32 1v8p s ASP 110 Ca 0.32 -1.22 0.01 0.00 -0.52 0.00 0.00 52.55 51.14 1v8p s ASP 110 Cb 0.21 -2.25 0.68 0.00 -1.46 0.00 0.00 42.92 40.10 1v8p s ASP 110 CO 0.16 -0.83 1.63 0.03 0.52 0.00 0.00 175.17 176.67 1v8p h ARG 111 N 8.93 0.14 0.77 4.34 -0.00 -1.99 0.32 114.38 126.90 1v8p h ARG 111 Ca -0.28 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.98 59.15 1v8p h ARG 111 Cb 1.10 -0.03 -0.00 0.00 0.00 0.00 0.00 29.97 31.04 1v8p h ARG 111 CO 0.96 0.09 -0.46 1.49 0.00 0.00 0.00 179.97 182.05 1v8p h GLU 112 N 0.15 -1.11 -0.72 0.04 4.57 -1.99 -1.76 114.58 113.75 1v8p h GLU 112 Ca 0.54 0.08 0.06 0.00 -1.18 0.00 0.00 59.36 58.86 1v8p h GLU 112 Cb 1.09 0.25 -0.04 0.00 -0.16 0.00 0.00 28.75 29.89 1v8p h GLU 112 CO -0.71 -0.74 0.48 -0.07 -1.18 0.00 0.00 179.01 176.79 1v8p h LEU 113 N -1.15 0.67 0.16 1.64 3.38 -1.63 -1.31 115.31 117.06 1v8p h LEU 113 Ca -0.10 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.88 1v8p h LEU 113 Cb 0.92 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 1v8p h LEU 113 CO 0.11 0.43 -0.38 -0.07 0.09 0.00 0.00 178.44 178.63 1v8p h LEU 114 N 0.76 -1.09 -1.29 1.67 3.38 -0.20 -1.94 115.31 116.60 1v8p h LEU 114 Ca 0.31 0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.35 1v8p h LEU 114 Cb 0.25 0.40 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1v8p h LEU 114 CO -0.10 -0.47 -0.24 0.00 0.09 0.00 0.00 178.44 177.72 1v8p h ALA 115 N -0.10 1.10 -0.65 1.53 0.00 -0.78 -3.21 119.26 117.15 1v8p h ALA 115 Ca 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1v8p h ALA 115 Cb 0.65 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1v8p h ALA 115 CO -0.20 0.30 0.00 1.63 0.00 0.00 0.00 179.25 180.99 1v8p n LYS 116 N -3.53 2.73 -4.13 0.00 5.02 -0.54 -4.88 118.16 112.81 1v8p n LYS 116 Ca -0.01 -2.54 -0.29 0.00 -2.02 0.00 0.00 58.31 53.45 1v8p n LYS 116 Cb 0.40 -1.52 -0.17 0.00 -0.02 0.00 0.00 35.03 33.72 1v8p n LYS 116 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1v8p s THR 117 N -1.03 1.46 -0.06 -0.18 2.01 -0.75 -5.03 115.64 112.06 1v8p s THR 117 Ca 0.44 -0.58 -0.31 0.00 0.31 0.00 0.00 61.69 61.55 1v8p s THR 117 Cb 0.23 -1.37 -0.09 0.00 0.01 0.00 0.00 72.50 71.28 1v8p s THR 117 CO 0.30 0.44 2.00 0.29 -0.69 0.00 0.00 174.62 176.96 1v8p n LYS 118 N 4.62 2.46 -0.95 4.92 5.02 -1.26 -2.12 118.16 130.85 1v8p n LYS 118 Ca -0.17 0.87 0.00 0.00 -2.02 0.00 0.00 58.31 56.99 1v8p n LYS 118 Cb 0.50 -2.93 0.00 0.00 -0.02 0.00 0.00 35.03 32.59 1v8p n LYS 118 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1v8p n GLY 119 N 4.80 0.62 3.77 0.72 0.00 -1.26 -4.81 105.19 109.04 1v8p n GLY 119 Ca 0.23 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.89 1v8p n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v8p s ALA 120 N -2.42 2.81 0.09 4.61 0.00 -0.90 -4.38 121.76 121.57 1v8p s ALA 120 Ca 0.00 0.88 0.00 0.00 0.00 0.00 0.00 51.96 52.84 1v8p s ALA 120 Cb 0.00 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 1v8p s ALA 120 CO 0.00 -0.74 -0.02 0.96 0.00 0.00 0.00 175.76 175.97 1v8p s ILE 121 N -1.67 0.37 0.73 0.00 -4.36 -0.09 -4.96 121.20 111.21 1v8p s ILE 121 Ca 0.69 -1.88 -0.01 0.00 -0.26 0.00 0.00 60.65 59.19 1v8p s ILE 121 Cb -0.26 -1.75 0.13 0.00 1.25 0.00 0.00 42.46 41.84 1v8p s ILE 121 CO 0.30 -0.79 1.00 1.51 0.24 0.00 0.00 174.94 177.21 1v8p s ASP 122 N -3.01 4.30 0.07 4.36 1.47 -1.25 -1.63 116.67 120.97 1v8p s ASP 122 Ca 0.14 -0.37 -0.24 0.00 1.18 0.00 0.00 52.55 53.25 1v8p s ASP 122 Cb 0.07 0.02 -0.16 0.00 -0.34 0.00 0.00 42.92 42.50 1v8p s ASP 122 CO -0.04 -1.90 1.63 0.58 0.68 0.00 0.00 175.17 176.12 1v8p h VAL 123 N -0.56 1.01 -0.53 2.11 2.07 -1.93 -1.27 116.25 117.16 1v8p h VAL 123 Ca -0.36 -0.22 0.10 0.00 0.82 0.00 0.00 66.70 67.03 1v8p h VAL 123 Cb 1.27 1.16 -0.08 0.00 -1.52 0.00 0.00 31.29 32.12 1v8p h VAL 123 CO 0.40 0.06 0.08 -0.08 0.02 0.00 0.00 177.57 178.04 1v8p h GLU 124 N -0.17 0.20 -0.06 1.57 4.81 -1.96 0.47 114.58 119.45 1v8p h GLU 124 Ca -0.01 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1v8p h GLU 124 Cb 0.15 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1v8p h GLU 124 CO 0.01 0.13 -0.15 1.15 -0.73 0.00 0.00 179.01 179.43 1v8p h THR 125 N 0.21 1.14 -0.07 0.32 2.02 -1.93 -2.44 112.91 112.16 1v8p h THR 125 Ca 0.27 -0.65 -0.19 0.00 0.77 0.00 0.00 66.41 66.61 1v8p h THR 125 Cb 0.39 1.27 -0.00 0.00 -1.74 0.00 0.00 68.15 68.06 1v8p h THR 125 CO -0.37 0.19 -0.76 0.25 0.37 0.00 0.00 175.52 175.20 1v8p h LEU 126 N 0.09 0.51 -0.15 2.58 5.85 0.24 -3.07 115.31 121.36 1v8p h LEU 126 Ca 0.02 -0.35 -0.06 0.00 0.84 0.00 0.00 57.88 58.34 1v8p h LEU 126 Cb 0.32 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.20 1v8p h LEU 126 CO 0.02 1.10 -0.13 -0.07 -0.34 0.00 0.00 178.44 179.02 1v8p h LEU 127 N 0.29 0.37 -2.17 2.25 3.38 -0.61 -2.64 115.31 116.18 1v8p h LEU 127 Ca -0.04 -0.46 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 1v8p h LEU 127 Cb 1.34 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 1v8p h LEU 127 CO 0.13 0.76 -0.03 -0.37 0.09 0.00 0.00 178.44 179.02 1v8p h VAL 128 N -0.00 0.12 0.01 1.22 -1.51 -1.54 -0.46 116.25 114.10 1v8p h VAL 128 Ca 0.03 -0.31 -0.24 0.00 -1.23 0.00 0.00 66.70 64.94 1v8p h VAL 128 Cb 0.64 1.27 0.02 0.00 -2.13 0.00 0.00 31.29 31.09 1v8p h VAL 128 CO 0.03 0.03 -0.94 0.03 -1.23 0.00 0.00 177.57 175.49 1v8p h ARG 129 N 0.00 0.61 0.00 5.19 3.08 -1.42 -3.24 114.38 118.60 1v8p h ARG 129 Ca -0.00 -0.68 -0.08 0.00 0.07 0.00 0.00 59.98 59.29 1v8p h ARG 129 Cb 0.27 0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 1v8p h ARG 129 CO 0.00 1.27 -0.38 -0.07 -1.07 0.00 0.00 179.97 179.73 1v8p h LEU 130 N 0.23 0.00 -0.02 3.04 3.38 -0.97 -2.72 115.31 118.26 1v8p h LEU 130 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1v8p h LEU 130 Cb 1.61 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.36 1v8p h LEU 130 CO 0.18 0.38 -0.01 0.00 0.09 0.00 0.00 178.44 179.08 1v8p h ALA 131 N 1.62 0.01 0.00 1.53 0.00 -1.14 -1.98 119.26 119.30 1v8p h ALA 131 Ca -0.00 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1v8p h ALA 131 Cb 0.83 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1v8p h ALA 131 CO 0.05 -0.50 -0.18 0.00 0.00 0.00 0.00 179.25 178.62 1v8p h ALA 132 N 1.01 1.03 0.00 0.00 0.00 -1.59 -3.52 119.26 116.19 1v8p h ALA 132 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1v8p h ALA 132 Cb 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1v8p h ALA 132 CO -0.02 0.22 0.00 1.04 0.00 0.00 0.00 179.25 180.49