#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 2.77 -0.00 0.00 1.01 -1.25 -4.31 120.40 118.62 1v8p s VAL 3 Ca 0.00 0.65 0.00 0.00 0.00 0.00 0.00 61.98 62.63 1v8p s VAL 3 Cb 0.00 -3.41 -0.00 0.00 0.00 0.00 0.00 36.38 32.97 1v8p s VAL 3 CO 0.00 0.10 0.00 -0.62 0.00 0.00 0.00 175.10 174.59 1v8p n GLU 4 N 2.31 2.69 -4.76 2.72 1.02 0.14 -5.00 120.64 119.76 1v8p n GLU 4 Ca 0.06 -0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.95 1v8p n GLU 4 Cb 0.41 -1.00 -0.16 0.00 -0.02 0.00 0.00 31.44 30.67 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 -2.00 1.60 -0.25 -0.32 1.51 -0.64 -2.02 117.35 115.22 1v8p s TYR 5 Ca -0.00 -0.46 -0.10 0.00 -1.01 0.00 0.00 57.07 55.50 1v8p s TYR 5 Cb 0.00 -1.08 -0.05 0.00 -0.11 0.00 0.00 41.96 40.72 1v8p s TYR 5 CO 0.00 -0.16 0.16 -1.17 -1.11 0.00 0.00 175.55 173.27 1v8p s LEU 6 N 0.08 3.99 -0.07 -1.29 2.96 -0.51 -0.12 118.68 123.72 1v8p s LEU 6 Ca -0.04 0.03 -0.03 0.00 -0.22 0.00 0.00 54.13 53.86 1v8p s LEU 6 Cb -0.11 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 1v8p s LEU 6 CO 0.02 0.01 0.07 -0.69 -1.32 0.00 0.00 176.35 174.45 1v8p s VAL 7 N 1.36 4.83 0.52 1.68 1.01 0.15 0.15 120.40 130.10 1v8p s VAL 7 Ca 0.07 -0.15 0.07 0.00 0.00 0.00 0.00 61.98 61.97 1v8p s VAL 7 Cb -0.15 -3.11 0.07 0.00 0.00 0.00 0.00 36.38 33.19 1v8p s VAL 7 CO 0.07 0.53 0.59 -0.90 0.00 0.00 0.00 175.10 175.39 1v8p n ASP 8 N 1.79 2.21 -0.28 3.32 5.68 -0.91 -4.39 116.55 123.97 1v8p n ASP 8 Ca -0.17 -2.54 -0.06 0.00 -0.50 0.00 0.00 54.79 51.51 1v8p n ASP 8 Cb 0.54 -0.25 0.06 0.00 -1.14 0.00 0.00 41.12 40.33 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 0.37 1.00 -0.16 2.12 0.00 -1.90 -1.18 119.26 119.51 1v8p h ALA 9 Ca -0.28 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.33 1v8p h ALA 9 Cb 1.15 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1v8p h ALA 9 CO 0.41 0.67 -0.25 0.66 0.00 0.00 0.00 179.25 180.74 1v8p h SER 10 N 1.13 0.29 -0.13 0.00 4.64 -1.96 -1.08 113.55 116.45 1v8p h SER 10 Ca 0.25 -0.09 -0.08 0.00 -0.47 0.00 0.00 61.79 61.40 1v8p h SER 10 Cb 0.29 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1v8p h SER 10 CO -0.01 0.55 -0.25 0.00 -0.87 0.00 0.00 176.83 176.25 1v8p h ALA 11 N 1.48 0.21 -0.32 5.18 0.00 -1.74 -2.89 119.26 121.18 1v8p h ALA 11 Ca 0.04 -0.39 0.06 0.00 0.00 0.00 0.00 54.91 54.63 1v8p h ALA 11 Cb 0.59 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 1v8p h ALA 11 CO 0.04 0.19 -0.06 1.25 0.00 0.00 0.00 179.25 180.66 1v8p h LEU 12 N -0.00 -0.26 -0.69 0.00 7.12 -1.01 0.38 115.31 120.85 1v8p h LEU 12 Ca 0.01 0.09 0.09 0.00 0.13 0.00 0.00 57.88 58.20 1v8p h LEU 12 Cb 0.83 0.18 -0.07 0.00 -0.53 0.00 0.00 40.66 41.08 1v8p h LEU 12 CO 0.06 -0.09 0.34 0.22 -0.13 0.00 0.00 178.44 178.83 1v8p h TYR 13 N 0.02 0.60 -0.10 1.25 3.20 -1.19 -0.43 116.97 120.32 1v8p h TYR 13 Ca 0.15 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.91 1v8p h TYR 13 Cb 0.23 -0.17 0.01 0.00 1.54 0.00 0.00 36.73 38.34 1v8p h TYR 13 CO -0.29 0.22 -0.47 0.00 -1.64 0.00 0.00 178.16 175.98 1v8p h ALA 14 N 1.41 0.20 -0.75 1.82 0.00 -1.16 -3.21 119.26 117.56 1v8p h ALA 14 Ca 0.33 -0.49 0.11 0.00 0.00 0.00 0.00 54.91 54.86 1v8p h ALA 14 Cb 0.34 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1v8p h ALA 14 CO -0.26 0.36 0.50 -0.07 0.00 0.00 0.00 179.25 179.77 1v8p h LEU 15 N 0.09 0.54 -1.35 0.00 3.38 0.25 -2.01 115.31 116.21 1v8p h LEU 15 Ca -0.03 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1v8p h LEU 15 Cb 1.12 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1v8p h LEU 15 CO 0.10 0.31 0.26 0.00 0.09 0.00 0.00 178.44 179.20 1v8p h ALA 16 N 1.63 1.21 -0.52 1.53 0.00 -1.09 0.30 119.26 122.32 1v8p h ALA 16 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1v8p h ALA 16 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1v8p h ALA 16 CO -0.13 -0.21 0.00 0.00 0.00 0.00 0.00 179.25 178.91 1v8p n ALA 17 N -1.71 3.62 -2.27 0.00 0.00 -0.75 -4.18 120.51 115.22 1v8p n ALA 17 Ca -0.01 -1.97 0.01 0.00 0.00 0.00 0.00 53.44 51.47 1v8p n ALA 17 Cb 0.29 -1.03 -0.00 0.00 0.00 0.00 0.00 19.45 18.72 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 0.45 0.00 -0.15 0.00 -0.00 0.11 -5.00 115.22 110.63 1v8p n HIS 18 Ca 0.26 -0.36 -0.04 0.00 -0.00 0.00 0.00 57.72 57.58 1v8p n HIS 18 Cb 1.10 0.02 -0.04 0.00 -0.00 0.00 0.00 29.99 31.08 1v8p n HIS 18 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.34 177.32 1v8p n TYR 19 N 0.27 -0.16 -0.28 4.41 9.36 -1.20 -1.29 117.16 128.29 1v8p n TYR 19 Ca -0.02 0.44 0.09 0.00 3.32 0.00 0.00 57.90 61.73 1v8p n TYR 19 Cb 0.93 -0.45 0.22 0.00 -0.63 0.00 0.00 39.34 39.41 1v8p n TYR 19 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 1v8p h ASP 20 N 0.00 -0.18 -0.01 2.98 3.32 -1.94 -1.12 116.42 119.47 1v8p h ASP 20 Ca 0.06 0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1v8p h ASP 20 Cb 0.14 0.31 -0.00 0.00 0.22 0.00 0.00 39.33 40.00 1v8p h ASP 20 CO -0.33 -0.16 0.02 0.11 -1.72 0.00 0.00 179.24 177.16 1v8p h LYS 21 N 0.16 0.00 0.00 3.56 1.57 -1.60 -3.32 116.57 116.93 1v8p h LYS 21 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1v8p h LYS 21 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.20 1v8p h LYS 21 CO -0.66 0.00 -0.19 -2.67 -0.57 0.00 0.00 179.45 175.36 1v8p n TRP 22 N -3.45 0.00 -0.31 -1.35 4.27 -0.51 -4.83 117.44 111.25 1v8p n TRP 22 Ca -0.03 0.00 0.09 0.00 -3.89 0.00 0.00 57.50 53.68 1v8p n TRP 22 Cb 0.10 0.00 0.26 0.00 -1.36 0.00 0.00 31.31 30.31 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 0.67 0.00 -1.67 3.07 -1.42 0.14 117.51 118.30 1v8p h ILE 23 Ca 0.00 -0.21 -0.01 0.00 1.55 0.00 0.00 64.86 66.20 1v8p h ILE 23 Cb 0.00 0.02 -0.00 0.00 -0.27 0.00 0.00 36.82 36.56 1v8p h ILE 23 CO 0.00 0.11 -0.03 0.07 -1.05 0.00 0.00 178.15 177.25 1v8p h LYS 24 N 0.60 0.00 -0.12 0.16 2.10 -1.87 -1.11 116.57 116.33 1v8p h LYS 24 Ca 0.51 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.16 1v8p h LYS 24 Cb 0.79 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.12 1v8p h LYS 24 CO -0.40 0.03 0.00 0.72 -2.00 0.00 0.00 179.45 177.80 1v8p n HIS 25 N -3.46 0.14 -0.54 0.07 8.25 0.46 -4.62 115.22 115.51 1v8p n HIS 25 Ca -0.02 -0.07 0.44 0.00 -0.26 0.00 0.00 57.72 57.81 1v8p n HIS 25 Cb 0.14 0.00 0.72 0.00 1.12 0.00 0.00 29.99 31.97 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 3.89 0.01 0.00 -0.41 0.11 -0.74 0.24 114.38 117.47 1v8p h ARG 26 Ca 0.00 -0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 1v8p h ARG 26 Cb 0.84 -0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.91 1v8p h ARG 26 CO 0.00 0.01 -0.03 0.93 0.10 0.00 0.00 179.97 180.98 1v8p h GLU 27 N 0.01 0.00 0.00 0.08 4.39 -1.83 -2.17 114.58 115.05 1v8p h GLU 27 Ca 0.90 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 60.42 1v8p h GLU 27 Cb 3.11 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 31.73 1v8p h GLU 27 CO -0.33 0.03 -0.91 0.87 -1.16 0.00 0.00 179.01 177.51 1v8p h LYS 28 N 0.00 0.00 -6.18 2.33 1.57 -0.71 -3.31 116.57 110.27 1v8p h LYS 28 Ca -0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 1v8p h LYS 28 Cb 0.06 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.33 1v8p h LYS 28 CO 0.00 0.75 0.18 -0.51 -0.57 0.00 0.00 179.45 179.30 1v8p s LEU 29 N -6.52 4.35 0.07 2.94 1.02 -0.82 0.29 118.68 120.01 1v8p s LEU 29 Ca 0.01 1.37 0.03 0.00 0.02 0.00 0.00 54.13 55.56 1v8p s LEU 29 Cb 0.09 -3.25 -0.03 0.00 0.02 0.00 0.00 46.19 43.01 1v8p s LEU 29 CO 0.79 -0.15 -0.09 0.00 0.02 0.00 0.00 176.35 176.93 1v8p s ALA 30 N 0.78 0.85 0.32 4.21 0.00 0.83 -2.41 121.76 126.33 1v8p s ALA 30 Ca 0.42 -1.02 0.03 0.00 0.00 0.00 0.00 51.96 51.39 1v8p s ALA 30 Cb -0.19 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 1v8p s ALA 30 CO 0.22 -0.06 0.11 0.96 0.00 0.00 0.00 175.76 176.99 1v8p s ILE 31 N -2.15 0.64 0.36 0.00 -4.36 0.56 0.32 121.20 116.58 1v8p s ILE 31 Ca -0.01 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 58.46 1v8p s ILE 31 Cb -0.05 -2.58 -0.01 0.00 1.25 0.00 0.00 42.46 41.08 1v8p s ILE 31 CO -0.01 0.00 0.46 -0.76 0.24 0.00 0.00 174.94 174.88 1v8p s LEU 32 N -3.43 3.80 0.20 0.37 1.43 -1.26 -1.41 118.68 118.37 1v8p s LEU 32 Ca 0.34 -0.33 -0.09 0.00 -1.03 0.00 0.00 54.13 53.02 1v8p s LEU 32 Cb 0.06 -2.61 0.12 0.00 0.03 0.00 0.00 46.19 43.80 1v8p s LEU 32 CO 0.15 -0.52 1.73 0.45 0.23 0.00 0.00 176.35 178.40 1v8p h HIS 33 N 0.89 1.16 -0.80 0.29 3.86 -1.91 -2.61 115.15 116.03 1v8p h HIS 33 Ca -0.44 -0.12 0.19 0.00 -1.16 0.00 0.00 60.37 58.84 1v8p h HIS 33 Cb 1.26 -0.34 -0.12 0.00 1.06 0.00 0.00 27.41 29.28 1v8p h HIS 33 CO 0.44 0.92 0.21 1.25 0.86 0.00 0.00 177.93 181.61 1v8p h LEU 34 N 1.06 0.03 -0.96 2.43 6.46 -1.97 -2.00 115.31 120.36 1v8p h LEU 34 Ca 0.23 0.16 0.29 0.00 -0.12 0.00 0.00 57.88 58.45 1v8p h LEU 34 Cb 0.31 0.22 -0.15 0.00 -0.73 0.00 0.00 40.66 40.31 1v8p h LEU 34 CO -0.01 -0.07 0.46 0.74 -0.62 0.00 0.00 178.44 178.94 1v8p h THR 35 N 0.26 0.31 -0.80 1.05 2.02 -1.85 -0.53 112.91 113.37 1v8p h THR 35 Ca 0.47 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.56 1v8p h THR 35 Cb 0.86 -0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 67.22 1v8p h THR 35 CO -0.56 0.05 0.53 0.40 0.37 0.00 0.00 175.52 176.31 1v8p h ILE 36 N 0.30 1.21 -0.10 3.11 2.04 -1.51 -0.19 117.51 122.37 1v8p h ILE 36 Ca 0.67 -0.39 -0.08 0.00 1.00 0.00 0.00 64.86 66.07 1v8p h ILE 36 Cb 1.46 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 1v8p h ILE 36 CO -0.62 0.20 -0.23 1.88 0.00 0.00 0.00 178.15 179.38 1v8p h TYR 37 N 1.09 0.42 -0.96 1.37 -1.99 -1.24 -1.45 116.97 114.21 1v8p h TYR 37 Ca 0.29 -0.16 0.09 0.00 2.00 0.00 0.00 58.73 60.95 1v8p h TYR 37 Cb -0.12 -0.07 -0.07 0.00 2.00 0.00 0.00 36.73 38.46 1v8p h TYR 37 CO -0.02 0.85 0.61 0.93 -0.00 0.00 0.00 178.16 180.53 1v8p h GLU 38 N -0.13 1.01 -0.35 4.88 5.08 -1.24 0.49 114.58 124.32 1v8p h GLU 38 Ca -0.00 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1v8p h GLU 38 Cb 0.84 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 1v8p h GLU 38 CO 0.05 0.67 -0.04 0.00 -1.00 0.00 0.00 179.01 178.69 1v8p h ALA 39 N 1.48 0.48 0.36 3.43 0.00 -0.99 -2.02 119.26 122.00 1v8p h ALA 39 Ca 0.44 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1v8p h ALA 39 Cb 0.30 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1v8p h ALA 39 CO -0.21 0.29 -0.27 0.78 0.00 0.00 0.00 179.25 179.84 1v8p h GLY 40 N 0.45 -0.66 0.07 0.00 0.00 -0.09 -1.85 103.07 100.99 1v8p h GLY 40 Ca 0.09 0.30 0.19 0.00 0.00 0.00 0.00 47.33 47.91 1v8p h GLY 40 CO 0.03 -0.26 0.50 -0.57 0.00 0.00 0.00 176.54 176.24 1v8p h ASN 41 N -0.63 0.59 -0.43 0.19 -0.73 -0.01 0.41 115.58 114.98 1v8p h ASN 41 Ca -0.03 0.11 -0.08 0.00 1.87 0.00 0.00 56.30 58.17 1v8p h ASN 41 Cb 0.54 0.02 -0.02 0.00 0.27 0.00 0.00 38.32 39.13 1v8p h ASN 41 CO -0.00 0.19 -0.00 0.00 -0.37 0.00 0.00 177.43 177.24 1v8p h ALA 42 N 1.63 1.06 -0.01 1.57 0.00 -1.01 -1.16 119.26 121.34 1v8p h ALA 42 Ca 0.54 -0.27 -0.20 0.00 0.00 0.00 0.00 54.91 54.97 1v8p h ALA 42 Cb 0.87 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1v8p h ALA 42 CO -0.41 0.59 -0.87 1.25 0.00 0.00 0.00 179.25 179.81 1v8p h LEU 43 N 0.78 0.35 -0.39 0.00 6.46 -0.01 -3.12 115.31 119.38 1v8p h LEU 43 Ca 0.15 -0.28 0.04 0.00 -0.12 0.00 0.00 57.88 57.67 1v8p h LEU 43 Cb 0.47 -0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 40.26 1v8p h LEU 43 CO 0.02 1.06 0.16 -0.25 -0.62 0.00 0.00 178.44 178.82 1v8p h TRP 44 N 0.16 0.29 -0.52 1.25 7.01 0.20 -1.73 115.95 122.61 1v8p h TRP 44 Ca -0.05 0.02 0.06 0.00 2.11 0.00 0.00 58.89 61.02 1v8p h TRP 44 Cb 1.48 -0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 28.44 1v8p h TRP 44 CO 0.04 0.14 0.35 0.87 -2.79 0.00 0.00 178.44 177.04 1v8p h LYS 45 N 0.34 0.47 -0.01 2.65 1.57 -1.17 0.45 116.57 120.88 1v8p h LYS 45 Ca 0.17 -0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 58.76 1v8p h LYS 45 Cb 0.12 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 1v8p h LYS 45 CO -0.15 0.31 -0.76 0.93 -0.57 0.00 0.00 179.45 179.21 1v8p h GLU 46 N 0.48 0.06 0.76 3.15 5.08 -1.40 -1.88 114.58 120.84 1v8p h GLU 46 Ca 0.22 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 1v8p h GLU 46 Cb 0.27 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.54 1v8p h GLU 46 CO -0.06 0.79 -0.37 0.00 -1.00 0.00 0.00 179.01 178.38 1v8p h ALA 47 N 1.19 -1.09 -1.09 3.43 0.00 -0.12 -0.64 119.26 120.94 1v8p h ALA 47 Ca -0.02 -0.22 0.37 0.00 0.00 0.00 0.00 54.91 55.04 1v8p h ALA 47 Cb 1.34 0.40 -0.15 0.00 0.00 0.00 0.00 17.79 19.39 1v8p h ALA 47 CO 0.10 -1.01 0.64 0.00 0.00 0.00 0.00 179.25 178.99 1v8p h ARG 48 N -1.20 0.20 -0.15 0.00 2.47 -1.02 0.19 114.38 114.87 1v8p h ARG 48 Ca -0.10 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.60 1v8p h ARG 48 Cb 0.79 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 29.06 1v8p h ARG 48 CO 0.17 0.13 0.00 1.28 0.56 0.00 0.00 179.97 182.11 1v8p n LEU 49 N -4.97 0.84 0.00 3.04 4.77 -0.71 -4.88 117.00 115.09 1v8p n LEU 49 Ca 0.34 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1v8p n LEU 49 Cb 1.15 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 42.15 1v8p n LEU 49 CO 0.12 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 1v8p n GLY 50 N 0.79 0.86 3.63 -0.72 0.00 0.66 -5.05 105.19 105.36 1v8p n GLY 50 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 1v8p n GLY 50 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1v8p s ARG 51 N -0.59 3.71 0.12 1.61 3.52 -0.27 -4.89 118.95 122.16 1v8p s ARG 51 Ca 0.00 1.77 -0.17 0.00 -0.13 0.00 0.00 55.73 57.20 1v8p s ARG 51 Cb 0.00 -4.10 -0.03 0.00 -1.56 0.00 0.00 34.95 29.26 1v8p s ARG 51 CO 0.00 -1.41 1.69 -0.39 -0.81 0.00 0.00 175.30 174.37 1v8p h VAL 52 N 6.28 1.17 -0.47 7.11 -1.51 -1.91 -3.23 116.25 123.70 1v8p h VAL 52 Ca -0.36 -0.51 -0.24 0.00 -1.23 0.00 0.00 66.70 64.36 1v8p h VAL 52 Cb 1.17 0.88 -0.14 0.00 -2.13 0.00 0.00 31.29 31.07 1v8p h VAL 52 CO 0.99 0.18 0.30 -0.90 -1.23 0.00 0.00 177.57 176.92 1v8p n ASP 53 N -4.72 3.35 -0.19 4.19 3.85 -1.26 -4.52 116.55 117.26 1v8p n ASP 53 Ca -0.01 -2.75 0.14 0.00 -0.71 0.00 0.00 54.79 51.45 1v8p n ASP 53 Cb 0.12 -0.66 0.46 0.00 -1.35 0.00 0.00 41.12 39.69 1v8p n ASP 53 CO 0.00 0.00 0.00 4.11 -1.01 0.00 0.00 177.20 180.30 1v8p h TRP 54 N 0.53 0.59 0.29 2.11 5.08 -1.96 -0.57 115.95 122.01 1v8p h TRP 54 Ca 0.29 0.02 -0.01 0.00 1.08 0.00 0.00 58.89 60.27 1v8p h TRP 54 Cb 1.87 -0.19 0.00 0.00 -3.00 0.00 0.00 29.16 27.85 1v8p h TRP 54 CO 0.75 0.23 -0.14 0.00 -1.28 0.00 0.00 178.44 178.01 1v8p h ALA 55 N 1.63 -0.38 0.40 0.11 0.00 -1.90 -0.66 119.26 118.47 1v8p h ALA 55 Ca 0.38 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1v8p h ALA 55 Cb 0.75 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1v8p h ALA 55 CO -0.14 -0.65 -0.21 0.00 0.00 0.00 0.00 179.25 178.24 1v8p h ALA 56 N 0.17 -0.57 -0.76 0.00 0.00 -1.76 -2.93 119.26 113.42 1v8p h ALA 56 Ca -0.04 -0.12 0.17 0.00 0.00 0.00 0.00 54.91 54.92 1v8p h ALA 56 Cb 0.38 0.25 -0.11 0.00 0.00 0.00 0.00 17.79 18.30 1v8p h ALA 56 CO 0.06 -0.83 0.18 0.00 0.00 0.00 0.00 179.25 178.67 1v8p h ALA 57 N 0.02 1.00 -0.72 0.00 0.00 -1.11 0.06 119.26 118.50 1v8p h ALA 57 Ca -0.05 0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.09 1v8p h ALA 57 Cb 0.45 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 1v8p h ALA 57 CO 0.07 -0.35 0.48 0.66 0.00 0.00 0.00 179.25 180.10 1v8p h SER 58 N 0.26 0.71 -0.05 0.00 4.64 -0.93 0.93 113.55 119.11 1v8p h SER 58 Ca 0.44 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.74 1v8p h SER 58 Cb 0.77 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1v8p h SER 58 CO -0.53 0.47 -0.01 0.03 -0.87 0.00 0.00 176.83 175.92 1v8p h ARG 59 N 0.81 0.09 -0.64 4.77 3.08 -0.89 -0.50 114.38 121.10 1v8p h ARG 59 Ca 0.30 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.34 1v8p h ARG 59 Cb 0.16 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.17 1v8p h ARG 59 CO -0.09 0.42 0.42 1.25 -1.07 0.00 0.00 179.97 180.90 1v8p h HIS 60 N -0.25 0.75 -0.14 3.04 2.76 -0.84 -0.15 115.15 120.33 1v8p h HIS 60 Ca 0.01 0.02 -0.14 0.00 -2.20 0.00 0.00 60.37 58.07 1v8p h HIS 60 Cb 0.39 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.09 1v8p h HIS 60 CO 0.05 0.44 -0.50 1.25 -1.30 0.00 0.00 177.93 177.87 1v8p h LEU 61 N 0.78 0.40 -0.60 0.26 6.46 -0.63 -1.44 115.31 120.53 1v8p h LEU 61 Ca 0.25 -0.20 -0.12 0.00 -0.12 0.00 0.00 57.88 57.69 1v8p h LEU 61 Cb 0.04 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 39.85 1v8p h LEU 61 CO -0.07 0.83 -0.23 0.50 -0.62 0.00 0.00 178.44 178.86 1v8p h LYS 62 N 0.29 0.87 0.85 1.25 3.64 0.33 0.37 116.57 124.17 1v8p h LYS 62 Ca 0.01 -0.36 -0.04 0.00 -1.27 0.00 0.00 60.65 58.99 1v8p h LYS 62 Cb 0.98 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 32.78 1v8p h LYS 62 CO 0.08 1.00 -0.41 -0.22 -2.27 0.00 0.00 179.45 177.64 1v8p h LYS 63 N 0.75 -1.11 -0.51 1.90 3.64 -0.87 -1.65 116.57 118.72 1v8p h LYS 63 Ca 0.10 0.08 0.10 0.00 -1.27 0.00 0.00 60.65 59.65 1v8p h LYS 63 Cb 0.77 0.25 -0.10 0.00 -0.41 0.00 0.00 32.23 32.73 1v8p h LYS 63 CO 0.06 -0.74 -0.28 0.28 -2.27 0.00 0.00 179.45 176.51 1v8p h VAL 64 N -1.27 0.26 -0.88 2.00 2.07 -1.22 -0.49 116.25 116.72 1v8p h VAL 64 Ca -0.12 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.55 1v8p h VAL 64 Cb 0.88 0.26 -0.07 0.00 -1.52 0.00 0.00 31.29 30.84 1v8p h VAL 64 CO 0.19 0.00 0.57 -0.07 0.02 0.00 0.00 177.57 178.28 1v8p h LEU 65 N -0.15 0.62 -1.42 2.57 3.38 -0.85 -2.26 115.31 117.20 1v8p h LEU 65 Ca 0.23 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 1v8p h LEU 65 Cb 0.52 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1v8p h LEU 65 CO -0.60 0.31 -0.25 0.77 0.09 0.00 0.00 178.44 178.76 1v8p h SER 66 N 0.65 0.00 0.48 -0.43 4.64 -0.09 -3.07 113.55 115.74 1v8p h SER 66 Ca 0.44 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.75 1v8p h SER 66 Cb 0.76 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1v8p h SER 66 CO -0.20 0.25 -0.07 0.28 -0.87 0.00 0.00 176.83 176.22 1v8p h SER 67 N 0.00 0.00 -3.53 4.97 0.02 -1.29 -3.44 113.55 110.28 1v8p h SER 67 Ca -0.00 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.42 1v8p h SER 67 Cb 0.60 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.11 1v8p h SER 67 CO 0.03 0.07 -0.04 -0.36 -1.14 0.00 0.00 176.83 175.39 1v8p s PHE 68 N -4.02 3.42 0.59 3.45 0.40 -1.16 -4.84 117.98 115.81 1v8p s PHE 68 Ca -0.02 1.00 -0.15 0.00 -0.60 0.00 0.00 56.93 57.16 1v8p s PHE 68 Cb 0.12 -2.36 -0.04 0.00 0.51 0.00 0.00 43.02 41.25 1v8p s PHE 68 CO 0.54 0.22 1.04 0.21 0.70 0.00 0.00 175.22 177.93 1v8p s LYS 69 N -2.82 3.43 -0.29 0.44 2.47 -1.01 -4.84 119.74 117.12 1v8p s LYS 69 Ca 0.49 1.12 0.02 0.00 -1.56 0.00 0.00 55.97 56.04 1v8p s LYS 69 Cb -0.11 -2.05 0.08 0.00 -1.46 0.00 0.00 37.83 34.29 1v8p s LYS 69 CO 0.20 -0.71 0.01 0.08 0.16 0.00 0.00 175.35 175.08 1v8p s VAL 70 N -2.55 1.68 1.16 4.02 1.01 -1.26 -0.32 120.40 124.13 1v8p s VAL 70 Ca 0.62 -1.66 -0.15 0.00 0.00 0.00 0.00 61.98 60.80 1v8p s VAL 70 Cb -0.14 -2.09 0.27 0.00 0.00 0.00 0.00 36.38 34.41 1v8p s VAL 70 CO 0.37 -0.38 1.05 -0.76 0.00 0.00 0.00 175.10 175.38 1v8p s LEU 71 N 1.26 0.75 0.69 3.92 1.43 -0.50 -4.97 118.68 121.26 1v8p s LEU 71 Ca 0.03 1.17 -0.11 0.00 -1.03 0.00 0.00 54.13 54.18 1v8p s LEU 71 Cb -0.19 -3.07 0.01 0.00 0.03 0.00 0.00 46.19 42.97 1v8p s LEU 71 CO -0.11 -4.03 1.06 -1.61 0.23 0.00 0.00 176.35 171.90 1v8p s GLU 72 N -4.84 2.91 0.17 1.70 2.02 -1.26 -4.50 118.70 114.91 1v8p s GLU 72 Ca 0.68 1.01 -0.30 0.00 0.02 0.00 0.00 54.97 56.38 1v8p s GLU 72 Cb -0.19 -1.99 -0.07 0.00 0.10 0.00 0.00 34.13 31.98 1v8p s GLU 72 CO 0.60 -1.12 1.03 -0.51 0.02 0.00 0.00 175.26 175.29 1v8p s ASP 73 N -3.62 7.39 1.13 -0.19 -0.00 -1.26 -4.91 116.67 115.21 1v8p s ASP 73 Ca 0.59 1.99 -0.09 0.00 -0.00 0.00 0.00 52.55 55.04 1v8p s ASP 73 Cb -0.15 -2.60 0.13 0.00 -0.00 0.00 0.00 42.92 40.31 1v8p s ASP 73 CO 0.53 -0.11 0.43 -2.65 -0.00 0.00 0.00 175.17 173.37 1v8p n PRO 74 N 2.30 -2.19 -3.15 8.23 -0.02 -1.26 -4.97 135.00 133.94 1v8p n PRO 74 Ca 0.02 -0.70 -0.44 0.00 -2.02 0.00 0.00 63.50 60.36 1v8p n PRO 74 Cb 0.47 -0.70 -0.06 0.00 -0.02 0.00 0.00 33.50 33.19 1v8p n PRO 74 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1v8p s PRO 75 N -3.99 3.11 0.21 0.52 0.02 -1.26 -4.90 135.00 128.71 1v8p s PRO 75 Ca 0.29 -0.96 0.11 0.00 0.02 0.00 0.00 61.00 60.46 1v8p s PRO 75 Cb -0.03 -4.12 0.75 0.00 0.02 0.00 0.00 34.50 31.11 1v8p s PRO 75 CO 0.23 -1.27 0.93 -0.11 -0.33 0.00 0.00 177.00 176.45 1v8p n LEU 76 N 6.18 0.17 -0.35 -5.54 0.00 -1.26 0.47 117.00 116.67 1v8p n LEU 76 Ca -0.07 0.98 -0.11 0.00 0.00 0.00 0.00 56.01 56.81 1v8p n LEU 76 Cb 0.45 -0.46 -0.10 0.00 0.00 0.00 0.00 43.42 43.31 1v8p n LEU 76 CO 0.55 -1.08 0.48 -0.78 0.00 0.00 0.00 177.39 176.56 1v8p h ASP 77 N 0.00 -2.07 0.03 1.96 -0.00 -2.01 -2.66 116.42 111.67 1v8p h ASP 77 Ca 0.48 0.31 -0.24 0.00 -0.00 0.00 0.00 57.03 57.58 1v8p h ASP 77 Cb 1.24 0.90 0.02 0.00 -0.00 0.00 0.00 39.33 41.50 1v8p h ASP 77 CO -0.47 -0.27 -0.94 -0.33 -0.00 0.00 0.00 179.24 177.24 1v8p h GLU 78 N -0.09 0.57 -0.85 0.28 4.39 -0.40 -3.29 114.58 115.20 1v8p h GLU 78 Ca 0.14 -0.67 0.15 0.00 0.34 0.00 0.00 59.36 59.33 1v8p h GLU 78 Cb 0.45 0.20 -0.10 0.00 -0.10 0.00 0.00 28.75 29.20 1v8p h GLU 78 CO -0.85 1.27 0.43 0.28 -1.16 0.00 0.00 179.01 178.98 1v8p h VAL 79 N 0.17 0.71 0.00 3.13 2.07 -1.45 -0.08 116.25 120.79 1v8p h VAL 79 Ca -0.13 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 1v8p h VAL 79 Cb 1.63 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1v8p h VAL 79 CO 0.18 0.11 -0.25 0.25 0.02 0.00 0.00 177.57 177.88 1v8p h LEU 80 N 0.60 0.00 -0.53 2.57 7.12 -1.56 -1.64 115.31 121.87 1v8p h LEU 80 Ca 0.47 0.00 -0.16 0.00 0.13 0.00 0.00 57.88 58.32 1v8p h LEU 80 Cb 0.69 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.80 1v8p h LEU 80 CO -0.38 0.25 -0.72 -0.09 -0.13 0.00 0.00 178.44 177.37 1v8p h ARG 81 N 0.00 0.10 0.05 1.25 2.43 -1.09 -2.11 114.38 115.01 1v8p h ARG 81 Ca -0.00 -0.09 -0.21 0.00 -0.81 0.00 0.00 59.98 58.87 1v8p h ARG 81 Cb 0.47 0.02 0.02 0.00 -0.42 0.00 0.00 29.97 30.06 1v8p h ARG 81 CO 0.03 0.78 -0.84 0.28 -1.51 0.00 0.00 179.97 178.71 1v8p h VAL 82 N 0.07 1.39 -0.24 0.20 2.07 -1.07 -0.95 116.25 117.73 1v8p h VAL 82 Ca -0.02 -2.26 0.06 0.00 0.82 0.00 0.00 66.70 65.30 1v8p h VAL 82 Cb 1.28 2.70 -0.06 0.00 -1.52 0.00 0.00 31.29 33.68 1v8p h VAL 82 CO 0.10 0.67 -0.19 0.00 0.02 0.00 0.00 177.57 178.17 1v8p h ALA 83 N 0.28 -0.04 0.06 1.67 0.00 -1.29 0.67 119.26 120.61 1v8p h ALA 83 Ca -0.12 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1v8p h ALA 83 Cb 1.55 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.76 1v8p h ALA 83 CO 0.16 -0.61 -0.03 0.28 0.00 0.00 0.00 179.25 179.06 1v8p h VAL 84 N -0.19 1.03 -0.16 0.00 2.07 -1.42 0.68 116.25 118.26 1v8p h VAL 84 Ca 0.13 -0.26 -0.10 0.00 0.82 0.00 0.00 66.70 67.29 1v8p h VAL 84 Cb 0.39 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 1v8p h VAL 84 CO -0.35 0.07 -0.34 -0.33 0.02 0.00 0.00 177.57 176.64 1v8p h GLU 85 N -0.19 0.33 -0.01 1.57 5.08 -0.74 -3.24 114.58 117.37 1v8p h GLU 85 Ca -0.01 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1v8p h GLU 85 Cb 0.17 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1v8p h GLU 85 CO 0.01 0.64 -0.36 0.54 -1.00 0.00 0.00 179.01 178.84 1v8p n ARG 86 N -4.07 1.56 -2.53 2.33 1.74 0.23 -5.01 116.66 110.91 1v8p n ARG 86 Ca -0.01 -0.88 -0.08 0.00 -0.77 0.00 0.00 57.85 56.11 1v8p n ARG 86 Cb 0.44 -1.33 0.04 0.00 -1.02 0.00 0.00 32.46 30.59 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 1.21 0.01 3.19 -0.13 0.00 0.22 -5.02 105.19 104.68 1v8p n GLY 87 Ca 0.07 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 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 -4.08 2.13 1.15 0.99 1.43 -0.19 -5.04 118.68 115.07 1v8p s LEU 88 Ca 0.09 -0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 52.62 1v8p s LEU 88 Cb -0.01 -0.84 0.27 0.00 0.03 0.00 0.00 46.19 45.64 1v8p s LEU 88 CO 0.35 0.14 1.04 0.42 0.23 0.00 0.00 176.35 178.52 1v8p s THR 89 N -0.70 2.02 0.13 5.49 -4.23 -1.26 -4.42 115.64 112.67 1v8p s THR 89 Ca 0.06 0.01 -0.17 0.00 -1.18 0.00 0.00 61.69 60.40 1v8p s THR 89 Cb -0.08 -2.12 -0.01 0.00 1.34 0.00 0.00 72.50 71.63 1v8p s THR 89 CO 0.01 -0.01 1.73 0.15 -0.54 0.00 0.00 174.62 175.96 1v8p h PHE 90 N -2.55 0.52 -0.17 3.99 3.57 -1.95 -1.94 116.94 118.41 1v8p h PHE 90 Ca -0.61 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 60.92 1v8p h PHE 90 Cb 1.33 -0.16 -0.06 0.00 2.79 0.00 0.00 35.95 39.85 1v8p h PHE 90 CO 0.26 0.42 -0.26 1.88 -2.23 0.00 0.00 178.31 178.38 1v8p h TYR 91 N 0.46 -0.70 -0.05 0.41 0.05 -1.98 -1.01 116.97 114.15 1v8p h TYR 91 Ca 0.13 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.86 1v8p h TYR 91 Cb 0.09 0.34 -0.01 0.00 1.01 0.00 0.00 36.73 38.15 1v8p h TYR 91 CO -0.02 -0.34 -0.34 -0.44 -1.05 0.00 0.00 178.16 175.97 1v8p h ASP 92 N -0.31 0.10 1.16 3.88 3.45 -1.89 -2.10 116.42 120.72 1v8p h ASP 92 Ca 0.11 -0.03 -0.02 0.00 0.43 0.00 0.00 57.03 57.51 1v8p h ASP 92 Cb 0.48 -0.03 -0.00 0.00 -0.56 0.00 0.00 39.33 39.22 1v8p h ASP 92 CO -0.34 0.44 -0.12 0.00 -1.57 0.00 0.00 179.24 177.65 1v8p h ALA 93 N 1.57 0.99 0.94 3.45 0.00 -0.78 -2.94 119.26 122.49 1v8p h ALA 93 Ca 0.01 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1v8p h ALA 93 Cb 0.65 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.43 1v8p h ALA 93 CO 0.05 0.15 -0.47 0.77 0.00 0.00 0.00 179.25 179.75 1v8p h SER 94 N 0.00 -1.12 -0.57 0.00 0.02 -0.47 -0.68 113.55 110.74 1v8p h SER 94 Ca -0.00 0.04 0.07 0.00 -0.84 0.00 0.00 61.79 61.07 1v8p h SER 94 Cb 0.73 0.29 -0.06 0.00 0.14 0.00 0.00 62.40 63.50 1v8p h SER 94 CO 0.02 -0.78 0.24 1.88 -1.14 0.00 0.00 176.83 177.04 1v8p h TYR 95 N -1.28 0.43 -0.47 3.45 -1.99 -1.61 -1.82 116.97 113.67 1v8p h TYR 95 Ca -0.13 0.03 0.06 0.00 2.00 0.00 0.00 58.73 60.68 1v8p h TYR 95 Cb 0.99 -0.11 -0.05 0.00 2.00 0.00 0.00 36.73 39.56 1v8p h TYR 95 CO -0.00 0.15 0.18 0.00 -0.00 0.00 0.00 178.16 178.49 1v8p h ALA 96 N 1.36 0.57 0.60 3.88 0.00 -1.39 -0.77 119.26 123.51 1v8p h ALA 96 Ca 0.27 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1v8p h ALA 96 Cb 0.28 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1v8p h ALA 96 CO -0.25 -0.21 -0.33 -0.92 0.00 0.00 0.00 179.25 177.55 1v8p h TYR 97 N 0.36 -0.85 -0.43 0.00 3.20 -0.35 -1.77 116.97 117.12 1v8p h TYR 97 Ca 0.22 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.10 1v8p h TYR 97 Cb 0.20 0.29 -0.03 0.00 1.54 0.00 0.00 36.73 38.73 1v8p h TYR 97 CO -0.15 -0.51 0.24 0.28 -1.64 0.00 0.00 178.16 176.38 1v8p h VAL 98 N -0.86 1.01 -0.57 1.81 2.07 -1.24 0.41 116.25 118.89 1v8p h VAL 98 Ca -0.08 -0.17 0.04 0.00 0.82 0.00 0.00 66.70 67.32 1v8p h VAL 98 Cb 0.68 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 1v8p h VAL 98 CO 0.11 0.09 0.32 0.00 0.02 0.00 0.00 177.57 178.10 1v8p h ALA 99 N 1.21 0.73 0.00 1.67 0.00 -1.12 0.78 119.26 122.54 1v8p h ALA 99 Ca 0.18 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1v8p h ALA 99 Cb 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1v8p h ALA 99 CO -0.10 0.01 -0.00 0.93 0.00 0.00 0.00 179.25 180.09 1v8p h GLU 100 N 0.62 -0.00 0.00 0.00 5.08 -1.01 0.58 114.58 119.85 1v8p h GLU 100 Ca 0.24 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 1v8p h GLU 100 Cb 0.10 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1v8p h GLU 100 CO -0.14 0.79 -0.11 0.66 -1.00 0.00 0.00 179.01 179.21 1v8p h SER 101 N -0.80 0.00 -0.49 1.42 4.64 -0.15 -2.08 113.55 116.08 1v8p h SER 101 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1v8p h SER 101 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1v8p h SER 101 CO 0.00 0.11 0.00 -1.20 -0.87 0.00 0.00 176.83 174.87 1v8p n SER 102 N -3.71 3.61 -3.65 4.97 7.64 0.26 -4.97 113.62 117.77 1v8p n SER 102 Ca -0.02 -1.99 -0.24 0.00 1.01 0.00 0.00 58.87 57.63 1v8p n SER 102 Cb 0.23 -0.32 0.06 0.00 -1.01 0.00 0.00 64.21 63.17 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 1.53 -0.47 3.67 0.23 0.00 -0.78 -5.00 105.19 104.35 1v8p n GLY 103 Ca 0.21 0.20 -0.23 0.00 0.00 0.00 0.00 46.02 46.20 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 -7.07 3.19 -0.27 0.99 1.43 0.20 -5.03 118.68 112.13 1v8p s LEU 104 Ca 0.44 -0.72 -0.13 0.00 -1.03 0.00 0.00 54.13 52.68 1v8p s LEU 104 Cb -0.20 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 1v8p s LEU 104 CO 0.76 -0.11 0.27 -0.69 0.23 0.00 0.00 176.35 176.81 1v8p s VAL 105 N -2.38 5.25 0.24 -1.59 1.01 -0.85 -4.41 120.40 117.67 1v8p s VAL 105 Ca 0.34 0.36 -0.30 0.00 0.00 0.00 0.00 61.98 62.38 1v8p s VAL 105 Cb -0.04 -3.61 -0.09 0.00 0.00 0.00 0.00 36.38 32.64 1v8p s VAL 105 CO 0.21 0.21 1.05 -0.22 0.00 0.00 0.00 175.10 176.35 1v8p s LEU 106 N 1.86 4.56 -0.29 3.92 0.20 -1.26 -1.42 118.68 126.26 1v8p s LEU 106 Ca 0.11 2.13 -0.01 0.00 0.69 0.00 0.00 54.13 57.05 1v8p s LEU 106 Cb -0.16 -3.62 0.05 0.00 -0.43 0.00 0.00 46.19 42.03 1v8p s LEU 106 CO 0.10 -0.08 -0.03 -0.69 -0.29 0.00 0.00 176.35 175.37 1v8p s VAL 107 N -0.93 2.83 0.10 1.68 1.01 0.12 -0.99 120.40 124.22 1v8p s VAL 107 Ca 0.45 -1.39 0.02 0.00 0.00 0.00 0.00 61.98 61.06 1v8p s VAL 107 Cb -0.30 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 1v8p s VAL 107 CO 0.37 -0.06 -0.07 0.28 0.00 0.00 0.00 175.10 175.63 1v8p s THR 108 N 1.23 0.69 -0.65 3.92 -1.32 -0.22 -2.15 115.64 117.15 1v8p s THR 108 Ca -0.05 -1.88 0.14 0.00 -1.21 0.00 0.00 61.69 58.69 1v8p s THR 108 Cb -0.19 -1.62 -0.16 0.00 -1.51 0.00 0.00 72.50 69.02 1v8p s THR 108 CO -0.02 -0.84 0.60 1.67 -2.21 0.00 0.00 174.62 173.82 1v8p n GLN 109 N 0.05 2.10 -2.61 7.08 -0.06 -1.26 -3.77 117.38 118.92 1v8p n GLN 109 Ca -0.13 -0.01 -0.43 0.00 -2.00 0.00 0.00 57.00 54.43 1v8p n GLN 109 Cb 0.60 -1.20 -0.02 0.00 -4.06 0.00 0.00 30.24 25.57 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 -2.45 6.89 0.46 1.69 -1.08 -1.26 -4.92 116.67 116.01 1v8p s ASP 110 Ca 0.05 1.05 0.14 0.00 -0.52 0.00 0.00 52.55 53.27 1v8p s ASP 110 Cb 0.11 -2.54 1.10 0.00 -1.46 0.00 0.00 42.92 40.12 1v8p s ASP 110 CO 0.60 -0.92 2.04 0.03 0.52 0.00 0.00 175.17 177.44 1v8p h ARG 111 N 8.27 0.28 0.45 4.34 -0.00 -1.99 -0.44 114.38 125.29 1v8p h ARG 111 Ca -0.21 -0.02 -0.02 0.00 -0.50 0.00 0.00 59.98 59.23 1v8p h ARG 111 Cb 1.06 -0.06 0.00 0.00 0.00 0.00 0.00 29.97 30.98 1v8p h ARG 111 CO 1.04 0.19 -0.22 1.49 0.00 0.00 0.00 179.97 182.47 1v8p h GLU 112 N 0.29 -0.58 -0.96 0.04 4.57 -1.99 -2.22 114.58 113.73 1v8p h GLU 112 Ca 0.18 0.04 0.01 0.00 -1.18 0.00 0.00 59.36 58.41 1v8p h GLU 112 Cb 0.34 0.13 -0.05 0.00 -0.16 0.00 0.00 28.75 29.01 1v8p h GLU 112 CO -0.04 -0.28 0.64 -0.07 -1.18 0.00 0.00 179.01 178.08 1v8p h LEU 113 N -0.88 1.10 -0.04 1.64 3.38 -1.88 -1.71 115.31 116.92 1v8p h LEU 113 Ca -0.06 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 57.92 1v8p h LEU 113 Cb 0.57 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 1v8p h LEU 113 CO 0.10 0.79 -0.36 -0.07 0.09 0.00 0.00 178.44 178.99 1v8p h LEU 114 N 1.29 -1.10 -0.77 1.67 3.38 -1.02 0.43 115.31 119.18 1v8p h LEU 114 Ca 0.36 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.47 1v8p h LEU 114 Cb -0.13 0.44 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1v8p h LEU 114 CO -0.08 -0.41 0.00 0.00 0.09 0.00 0.00 178.44 178.04 1v8p n ALA 115 N -2.84 1.62 0.30 1.53 0.00 -0.84 -3.23 120.51 117.05 1v8p n ALA 115 Ca -0.05 0.10 0.04 0.00 0.00 0.00 0.00 53.44 53.53 1v8p n ALA 115 Cb 0.35 -1.39 0.03 0.00 0.00 0.00 0.00 19.45 18.44 1v8p n ALA 115 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1v8p n LYS 116 N -2.26 0.07 -4.39 0.00 5.02 -0.68 -4.93 118.16 110.99 1v8p n LYS 116 Ca 0.02 -0.95 -0.34 0.00 -2.02 0.00 0.00 58.31 55.02 1v8p n LYS 116 Cb 0.22 -1.14 -0.14 0.00 -0.02 0.00 0.00 35.03 33.95 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 -0.62 3.22 0.02 -0.18 2.01 0.06 -5.05 115.64 115.10 1v8p s THR 117 Ca 0.09 -0.58 -0.30 0.00 0.31 0.00 0.00 61.69 61.21 1v8p s THR 117 Cb 0.06 -2.40 -0.08 0.00 0.01 0.00 0.00 72.50 70.09 1v8p s THR 117 CO 0.09 0.49 1.83 -0.54 -0.69 0.00 0.00 174.62 175.80 1v8p s LYS 118 N 0.80 4.16 -0.14 4.92 1.02 -1.26 -2.64 119.74 126.60 1v8p s LYS 118 Ca -0.03 2.46 0.00 0.00 0.02 0.00 0.00 55.97 58.42 1v8p s LYS 118 Cb -0.15 -4.01 0.00 0.00 -0.52 0.00 0.00 37.83 33.15 1v8p s LYS 118 CO 0.01 -0.89 0.00 0.41 -0.92 0.00 0.00 175.35 173.96 1v8p n GLY 119 N 4.34 0.46 3.76 -3.33 0.00 -1.26 -4.79 105.19 104.37 1v8p n GLY 119 Ca 0.19 -0.17 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.82 2.68 0.12 4.61 0.00 -1.08 -4.53 121.76 121.73 1v8p s ALA 120 Ca 0.00 0.95 0.01 0.00 0.00 0.00 0.00 51.96 52.91 1v8p s ALA 120 Cb 0.00 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 1v8p s ALA 120 CO 0.00 -0.95 -0.01 0.96 0.00 0.00 0.00 175.76 175.76 1v8p s ILE 121 N -1.64 0.46 0.59 0.00 -4.36 -0.16 -4.96 121.20 111.12 1v8p s ILE 121 Ca 0.73 -1.92 -0.03 0.00 -0.26 0.00 0.00 60.65 59.18 1v8p s ILE 121 Cb -0.28 -1.85 0.12 0.00 1.25 0.00 0.00 42.46 41.70 1v8p s ILE 121 CO 0.32 -0.70 0.80 -0.90 0.24 0.00 0.00 174.94 174.70 1v8p n ASP 122 N -0.08 0.81 -0.03 4.36 5.68 -1.25 -1.05 116.55 124.99 1v8p n ASP 122 Ca -0.09 -1.75 -0.07 0.00 -0.50 0.00 0.00 54.79 52.38 1v8p n ASP 122 Cb 0.62 -0.54 0.11 0.00 -1.14 0.00 0.00 41.12 40.16 1v8p n ASP 122 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1v8p h VAL 123 N -0.77 1.28 -0.09 2.12 2.07 -1.94 -2.77 116.25 116.15 1v8p h VAL 123 Ca -0.26 -1.46 -0.02 0.00 0.82 0.00 0.00 66.70 65.78 1v8p h VAL 123 Cb 0.91 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 1v8p h VAL 123 CO 0.26 0.47 -0.03 -0.08 0.02 0.00 0.00 177.57 178.20 1v8p h GLU 124 N 0.54 0.13 0.00 1.57 4.81 -1.95 -2.05 114.58 117.62 1v8p h GLU 124 Ca 0.06 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1v8p h GLU 124 Cb 0.83 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.18 1v8p h GLU 124 CO 0.07 0.17 -0.20 1.15 -0.73 0.00 0.00 179.01 179.47 1v8p h THR 125 N 0.13 0.05 0.00 0.32 2.02 -1.88 -3.06 112.91 110.50 1v8p h THR 125 Ca 0.03 -1.08 -0.04 0.00 0.77 0.00 0.00 66.41 66.10 1v8p h THR 125 Cb 0.15 1.94 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 1v8p h THR 125 CO 0.01 0.03 -0.14 0.25 0.37 0.00 0.00 175.52 176.03 1v8p h LEU 126 N 0.00 0.12 -0.72 2.58 5.85 -1.17 -2.87 115.31 119.09 1v8p h LEU 126 Ca -0.00 -0.82 0.12 0.00 0.84 0.00 0.00 57.88 58.02 1v8p h LEU 126 Cb 1.03 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.94 1v8p h LEU 126 CO 0.00 0.92 0.32 -0.07 -0.34 0.00 0.00 178.44 179.27 1v8p h LEU 127 N -0.67 0.36 -0.41 2.25 3.38 -1.49 0.53 115.31 119.25 1v8p h LEU 127 Ca -0.02 0.08 -0.16 0.00 0.09 0.00 0.00 57.88 57.88 1v8p h LEU 127 Cb 0.95 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 1v8p h LEU 127 CO 0.03 0.18 -0.39 -0.37 0.09 0.00 0.00 178.44 177.98 1v8p h VAL 128 N 0.51 1.27 -0.14 1.22 -1.51 -1.62 -0.86 116.25 115.12 1v8p h VAL 128 Ca 0.38 -1.56 -0.04 0.00 -1.23 0.00 0.00 66.70 64.24 1v8p h VAL 128 Cb 0.49 1.39 -0.01 0.00 -2.13 0.00 0.00 31.29 31.03 1v8p h VAL 128 CO -0.33 0.52 -0.09 0.03 -1.23 0.00 0.00 177.57 176.46 1v8p h ARG 129 N 0.75 0.22 0.04 5.19 3.08 -1.04 -2.75 114.38 119.87 1v8p h ARG 129 Ca 0.06 -0.04 -0.22 0.00 0.07 0.00 0.00 59.98 59.85 1v8p h ARG 129 Cb 0.98 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.98 1v8p h ARG 129 CO 0.09 0.33 -1.02 -0.07 -1.07 0.00 0.00 179.97 178.24 1v8p h LEU 130 N 0.21 0.18 0.00 3.04 3.38 -0.69 -3.24 115.31 118.19 1v8p h LEU 130 Ca 0.05 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1v8p h LEU 130 Cb 0.31 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1v8p h LEU 130 CO 0.02 1.08 0.00 0.00 0.09 0.00 0.00 178.44 179.63 1v8p n ALA 131 N -2.43 2.47 -0.04 1.53 0.00 -0.35 -2.90 120.51 118.79 1v8p n ALA 131 Ca -0.03 -0.15 0.01 0.00 0.00 0.00 0.00 53.44 53.27 1v8p n ALA 131 Cb 0.91 -1.47 -0.15 0.00 0.00 0.00 0.00 19.45 18.74 1v8p n ALA 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v8p n ALA 132 N -1.22 2.17 0.94 0.00 0.00 -1.11 -5.08 120.51 116.21 1v8p n ALA 132 Ca 0.16 -0.83 0.08 0.00 0.00 0.00 0.00 53.44 52.84 1v8p n ALA 132 Cb 0.20 -0.57 0.45 0.00 0.00 0.00 0.00 19.45 19.53 1v8p n ALA 132 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54