#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v8p n ALA 2 N 0.00 4.83 -2.20 3.17 0.00 -1.26 -5.01 120.51 120.04 1v8p n ALA 2 Ca 0.00 -3.19 -0.41 0.00 0.00 0.00 0.00 53.44 49.84 1v8p n ALA 2 Cb 0.00 -0.93 -0.05 0.00 0.00 0.00 0.00 19.45 18.47 1v8p n ALA 2 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1v8p s VAL 3 N -3.51 4.42 0.00 0.00 1.01 -1.25 -4.09 120.40 116.98 1v8p s VAL 3 Ca 0.49 2.05 0.00 0.00 0.00 0.00 0.00 61.98 64.52 1v8p s VAL 3 Cb 0.43 -4.31 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1v8p s VAL 3 CO 0.02 0.34 0.00 -0.62 0.00 0.00 0.00 175.10 174.84 1v8p n GLU 4 N 2.62 2.55 -4.77 2.72 1.02 -0.11 -4.98 120.64 119.68 1v8p n GLU 4 Ca 0.02 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.88 1v8p n GLU 4 Cb 0.49 -0.94 -0.14 0.00 -0.02 0.00 0.00 31.44 30.82 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 -1.85 2.01 -0.21 -0.32 1.51 -0.44 -0.49 117.35 117.56 1v8p s TYR 5 Ca 0.00 -0.39 -0.03 0.00 -1.01 0.00 0.00 57.07 55.64 1v8p s TYR 5 Cb 0.00 -1.21 -0.00 0.00 -0.11 0.00 0.00 41.96 40.64 1v8p s TYR 5 CO 0.00 0.10 -0.06 -1.17 -1.11 0.00 0.00 175.55 173.30 1v8p s LEU 6 N -1.15 2.80 -0.23 -1.29 2.96 -0.10 -0.77 118.68 120.89 1v8p s LEU 6 Ca 0.09 -0.42 -0.09 0.00 -0.22 0.00 0.00 54.13 53.49 1v8p s LEU 6 Cb -0.09 -1.70 -0.04 0.00 0.50 0.00 0.00 46.19 44.85 1v8p s LEU 6 CO 0.02 -0.01 0.11 -0.69 -1.32 0.00 0.00 176.35 174.45 1v8p s VAL 7 N 1.43 4.85 0.69 1.68 1.01 0.12 0.31 120.40 130.50 1v8p s VAL 7 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.02 1v8p s VAL 7 Cb -0.14 -3.25 0.10 0.00 0.00 0.00 0.00 36.38 33.09 1v8p s VAL 7 CO -0.04 0.37 0.96 1.51 0.00 0.00 0.00 175.10 177.90 1v8p s ASP 8 N 1.11 4.56 0.28 3.32 1.47 -0.90 -4.52 116.67 121.98 1v8p s ASP 8 Ca 0.05 -0.13 0.01 0.00 1.18 0.00 0.00 52.55 53.67 1v8p s ASP 8 Cb -0.14 -0.39 0.59 0.00 -0.34 0.00 0.00 42.92 42.65 1v8p s ASP 8 CO 0.04 -1.71 1.79 0.00 0.68 0.00 0.00 175.17 175.97 1v8p h ALA 9 N -0.46 1.45 -0.23 2.11 0.00 -1.90 0.51 119.26 120.73 1v8p h ALA 9 Ca -0.39 0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.44 1v8p h ALA 9 Cb 1.28 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1v8p h ALA 9 CO 0.46 0.00 -0.44 0.66 0.00 0.00 0.00 179.25 179.93 1v8p h SER 10 N 0.76 0.60 -0.13 0.00 4.64 -1.94 -2.10 113.55 115.38 1v8p h SER 10 Ca 0.50 -0.28 -0.06 0.00 -0.47 0.00 0.00 61.79 61.49 1v8p h SER 10 Cb 0.68 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1v8p h SER 10 CO -0.34 0.96 -0.14 0.00 -0.87 0.00 0.00 176.83 176.43 1v8p h ALA 11 N 1.07 0.19 -0.85 5.18 0.00 -1.63 -2.45 119.26 120.78 1v8p h ALA 11 Ca 0.03 -0.33 0.10 0.00 0.00 0.00 0.00 54.91 54.72 1v8p h ALA 11 Cb 0.95 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.62 1v8p h ALA 11 CO 0.08 0.08 0.49 1.25 0.00 0.00 0.00 179.25 181.15 1v8p h LEU 12 N -0.06 0.70 -0.78 0.00 7.12 -0.91 0.17 115.31 121.56 1v8p h LEU 12 Ca 0.02 0.05 -0.04 0.00 0.13 0.00 0.00 57.88 58.04 1v8p h LEU 12 Cb 0.68 -0.09 -0.03 0.00 -0.53 0.00 0.00 40.66 40.69 1v8p h LEU 12 CO 0.04 0.39 0.33 0.22 -0.13 0.00 0.00 178.44 179.29 1v8p h TYR 13 N 0.81 1.16 -0.07 1.25 3.20 -1.26 -0.89 116.97 121.17 1v8p h TYR 13 Ca 0.41 -0.08 -0.17 0.00 3.14 0.00 0.00 58.73 62.04 1v8p h TYR 13 Cb 0.39 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 1v8p h TYR 13 CO -0.06 0.87 -0.68 0.00 -1.64 0.00 0.00 178.16 176.65 1v8p h ALA 14 N 1.17 0.72 -0.09 1.82 0.00 -0.80 -3.20 119.26 118.88 1v8p h ALA 14 Ca 0.26 -0.59 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 1v8p h ALA 14 Cb 0.18 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1v8p h ALA 14 CO -0.03 0.76 -0.42 -0.07 0.00 0.00 0.00 179.25 179.50 1v8p h LEU 15 N 0.21 0.21 -1.70 0.00 3.38 -0.21 -3.14 115.31 114.06 1v8p h LEU 15 Ca -0.02 -0.09 0.13 0.00 0.09 0.00 0.00 57.88 57.99 1v8p h LEU 15 Cb 1.22 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 1v8p h LEU 15 CO 0.11 0.62 0.60 0.00 0.09 0.00 0.00 178.44 179.86 1v8p h ALA 16 N 1.40 2.13 -0.61 1.53 0.00 -1.16 0.38 119.26 122.92 1v8p h ALA 16 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1v8p h ALA 16 Cb 0.82 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1v8p h ALA 16 CO 0.06 -0.82 0.00 0.00 0.00 0.00 0.00 179.25 178.49 1v8p n ALA 17 N -2.19 3.27 -2.59 0.00 0.00 -1.19 -4.18 120.51 113.63 1v8p n ALA 17 Ca 0.08 -1.59 0.02 0.00 0.00 0.00 0.00 53.44 51.96 1v8p n ALA 17 Cb 0.77 -1.05 0.03 0.00 0.00 0.00 0.00 19.45 19.20 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 0.97 0.45 -0.40 0.00 -0.00 0.13 -4.97 115.22 111.39 1v8p n HIS 18 Ca 0.25 -1.08 -0.06 0.00 -0.00 0.00 0.00 57.72 56.83 1v8p n HIS 18 Cb 0.94 -0.18 -0.03 0.00 -0.00 0.00 0.00 29.99 30.72 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 0.09 -0.20 -0.19 4.41 9.36 -1.22 -1.66 117.16 127.76 1v8p n TYR 19 Ca 0.07 1.24 -0.00 0.00 3.32 0.00 0.00 57.90 62.53 1v8p n TYR 19 Cb 1.02 -0.73 0.09 0.00 -0.63 0.00 0.00 39.34 39.10 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 -0.03 -0.08 2.98 3.32 -1.93 -1.47 116.42 119.21 1v8p h ASP 20 Ca 0.26 0.11 0.02 0.00 0.02 0.00 0.00 57.03 57.44 1v8p h ASP 20 Cb 0.51 0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.21 1v8p h ASP 20 CO -0.97 0.00 0.09 0.11 -1.72 0.00 0.00 179.24 176.76 1v8p h LYS 21 N 0.23 0.00 0.00 3.56 1.57 -1.73 -3.33 116.57 116.87 1v8p h LYS 21 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1v8p h LYS 21 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1v8p h LYS 21 CO -0.39 0.00 -0.75 -2.67 -0.57 0.00 0.00 179.45 175.07 1v8p n TRP 22 N -3.77 0.00 -0.37 -1.35 4.27 -1.03 -4.80 117.44 110.39 1v8p n TRP 22 Ca -0.01 0.00 0.37 0.00 -3.89 0.00 0.00 57.50 53.97 1v8p n TRP 22 Cb 0.19 0.00 0.75 0.00 -1.36 0.00 0.00 31.31 30.89 1v8p n TRP 22 CO 0.00 0.00 0.00 0.97 -2.29 0.00 0.00 177.69 176.37 1v8p h ILE 23 N 0.00 0.36 0.00 -1.67 6.09 -1.39 0.34 117.51 121.24 1v8p h ILE 23 Ca 0.00 -0.01 -0.10 0.00 -1.37 0.00 0.00 64.86 63.38 1v8p h ILE 23 Cb 0.01 0.34 -0.01 0.00 0.47 0.00 0.00 36.82 37.63 1v8p h ILE 23 CO 0.00 0.00 -0.48 0.50 -3.07 0.00 0.00 178.15 175.11 1v8p h LYS 24 N 0.02 0.00 -0.56 2.19 3.64 -1.85 -3.08 116.57 116.92 1v8p h LYS 24 Ca 0.62 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.00 1v8p h LYS 24 Cb 2.43 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 34.25 1v8p h LYS 24 CO -0.02 0.48 0.00 0.72 -2.27 0.00 0.00 179.45 178.35 1v8p n HIS 25 N -3.58 1.96 -0.30 1.91 -0.00 0.12 -4.70 115.22 110.63 1v8p n HIS 25 Ca -0.00 -0.73 0.10 0.00 -0.00 0.00 0.00 57.72 57.08 1v8p n HIS 25 Cb 0.57 -0.48 0.32 0.00 -0.00 0.00 0.00 29.99 30.40 1v8p n HIS 25 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.34 176.41 1v8p h ARG 26 N 3.86 0.80 0.00 -0.41 -0.00 -1.42 -2.41 114.38 114.79 1v8p h ARG 26 Ca 0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 59.98 59.93 1v8p h ARG 26 Cb 1.91 -0.18 0.00 0.00 -0.00 0.00 0.00 29.97 31.70 1v8p h ARG 26 CO 0.45 0.53 0.00 -0.85 -0.00 0.00 0.00 179.97 180.10 1v8p n GLU 27 N -4.58 0.33 0.00 0.08 0.00 -1.26 -0.86 120.64 114.34 1v8p n GLU 27 Ca 0.18 0.00 0.07 0.00 0.00 0.00 0.00 57.16 57.41 1v8p n GLU 27 Cb 0.41 -1.46 -0.07 0.00 0.00 0.00 0.00 31.44 30.32 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 -0.96 2.01 -4.05 3.44 5.02 -0.91 -3.77 118.16 118.93 1v8p n LYS 28 Ca 0.07 -0.12 -0.35 0.00 -2.02 0.00 0.00 58.31 55.90 1v8p n LYS 28 Cb 0.03 -1.21 -0.10 0.00 -0.02 0.00 0.00 35.03 33.73 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 -2.61 3.79 0.16 -0.35 1.02 -0.04 -0.93 118.68 119.72 1v8p s LEU 29 Ca 0.07 0.09 0.05 0.00 0.02 0.00 0.00 54.13 54.36 1v8p s LEU 29 Cb 0.12 -1.95 -0.05 0.00 0.02 0.00 0.00 46.19 44.33 1v8p s LEU 29 CO 0.58 0.20 -0.10 0.00 0.02 0.00 0.00 176.35 177.06 1v8p s ALA 30 N 0.20 1.52 0.30 4.21 0.00 0.05 -2.35 121.76 125.70 1v8p s ALA 30 Ca 0.04 -1.53 0.04 0.00 0.00 0.00 0.00 51.96 50.52 1v8p s ALA 30 Cb -0.12 0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.03 1v8p s ALA 30 CO 0.01 -0.10 0.21 0.96 0.00 0.00 0.00 175.76 176.84 1v8p s ILE 31 N -3.31 0.09 0.31 0.00 -4.36 0.21 0.12 121.20 114.26 1v8p s ILE 31 Ca 0.18 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 58.64 1v8p s ILE 31 Cb 0.03 -2.49 -0.03 0.00 1.25 0.00 0.00 42.46 41.21 1v8p s ILE 31 CO 0.02 0.00 0.28 -0.76 0.24 0.00 0.00 174.94 174.72 1v8p s LEU 32 N -3.34 3.70 0.46 0.37 1.43 -1.26 -1.29 118.68 118.76 1v8p s LEU 32 Ca 0.38 -0.39 0.11 0.00 -1.03 0.00 0.00 54.13 53.20 1v8p s LEU 32 Cb 0.04 -2.30 1.05 0.00 0.03 0.00 0.00 46.19 45.01 1v8p s LEU 32 CO 0.21 -0.26 2.10 0.45 0.23 0.00 0.00 176.35 179.08 1v8p h HIS 33 N 1.29 0.27 -0.87 0.29 3.86 -1.92 -1.13 115.15 116.94 1v8p h HIS 33 Ca -0.46 0.01 0.09 0.00 -1.16 0.00 0.00 60.37 58.84 1v8p h HIS 33 Cb 1.25 -0.09 -0.07 0.00 1.06 0.00 0.00 27.41 29.55 1v8p h HIS 33 CO 0.53 0.17 0.52 1.25 0.86 0.00 0.00 177.93 181.27 1v8p h LEU 34 N 0.30 0.78 -1.15 2.43 6.46 -1.96 -2.28 115.31 119.89 1v8p h LEU 34 Ca 0.08 0.04 0.18 0.00 -0.12 0.00 0.00 57.88 58.06 1v8p h LEU 34 Cb -0.03 -0.12 -0.09 0.00 -0.73 0.00 0.00 40.66 39.69 1v8p h LEU 34 CO -0.02 0.46 0.61 0.74 -0.62 0.00 0.00 178.44 179.61 1v8p h THR 35 N 0.90 0.74 -0.32 1.05 2.02 -1.58 -1.47 112.91 114.25 1v8p h THR 35 Ca 0.41 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 67.34 1v8p h THR 35 Cb 0.32 -0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 66.68 1v8p h THR 35 CO -0.23 0.13 0.18 0.40 0.37 0.00 0.00 175.52 176.37 1v8p h ILE 36 N 0.71 1.13 -0.20 3.11 2.04 -1.50 -1.75 117.51 121.05 1v8p h ILE 36 Ca 0.53 -0.35 -0.15 0.00 1.00 0.00 0.00 64.86 65.89 1v8p h ILE 36 Cb 0.90 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 1v8p h ILE 36 CO -0.30 0.14 -0.50 1.88 0.00 0.00 0.00 178.15 179.36 1v8p h TYR 37 N 0.40 0.68 -0.48 1.37 -1.99 -1.44 -2.08 116.97 113.44 1v8p h TYR 37 Ca 0.11 -0.23 -0.12 0.00 2.00 0.00 0.00 58.73 60.50 1v8p h TYR 37 Cb 0.06 -0.13 -0.02 0.00 2.00 0.00 0.00 36.73 38.64 1v8p h TYR 37 CO -0.03 0.94 -0.17 0.93 -0.00 0.00 0.00 178.16 179.83 1v8p h GLU 38 N 0.44 0.94 -0.41 4.88 5.08 -1.21 0.42 114.58 124.71 1v8p h GLU 38 Ca 0.02 -0.37 -0.12 0.00 -1.00 0.00 0.00 59.36 57.88 1v8p h GLU 38 Cb 1.03 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 1v8p h GLU 38 CO 0.10 1.03 -0.24 0.00 -1.00 0.00 0.00 179.01 178.90 1v8p h ALA 39 N 0.97 0.80 -0.41 3.43 0.00 -1.30 -2.30 119.26 120.44 1v8p h ALA 39 Ca 0.12 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1v8p h ALA 39 Cb 0.73 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1v8p h ALA 39 CO 0.06 0.65 0.11 0.78 0.00 0.00 0.00 179.25 180.85 1v8p h GLY 40 N 0.93 0.70 1.60 0.00 0.00 -1.03 -2.41 103.07 102.85 1v8p h GLY 40 Ca 0.10 -0.43 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 1v8p h GLY 40 CO 0.06 0.40 0.01 -0.57 0.00 0.00 0.00 176.54 176.44 1v8p h ASN 41 N 0.52 0.47 -0.57 0.19 -0.73 -0.80 -1.09 115.58 113.57 1v8p h ASN 41 Ca 0.13 -0.08 -0.07 0.00 1.87 0.00 0.00 56.30 58.14 1v8p h ASN 41 Cb 0.29 -0.12 -0.02 0.00 0.27 0.00 0.00 38.32 38.74 1v8p h ASN 41 CO -0.00 0.53 0.07 0.00 -0.37 0.00 0.00 177.43 177.66 1v8p h ALA 42 N 1.53 0.76 -0.13 1.57 0.00 -1.15 -1.05 119.26 120.79 1v8p h ALA 42 Ca 0.11 -0.26 -0.19 0.00 0.00 0.00 0.00 54.91 54.56 1v8p h ALA 42 Cb 0.30 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1v8p h ALA 42 CO 0.01 0.53 -0.71 1.25 0.00 0.00 0.00 179.25 180.33 1v8p h LEU 43 N 0.85 0.66 -0.87 0.00 6.46 -1.13 -3.02 115.31 118.27 1v8p h LEU 43 Ca 0.17 -0.42 0.03 0.00 -0.12 0.00 0.00 57.88 57.54 1v8p h LEU 43 Cb 0.45 -0.19 -0.05 0.00 -0.73 0.00 0.00 40.66 40.13 1v8p h LEU 43 CO 0.02 1.17 0.56 -0.25 -0.62 0.00 0.00 178.44 179.32 1v8p h TRP 44 N 0.40 1.06 0.00 1.25 7.01 -0.99 -0.47 115.95 124.20 1v8p h TRP 44 Ca -0.03 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 60.97 1v8p h TRP 44 Cb 1.30 -0.35 -0.00 0.00 -2.10 0.00 0.00 29.16 28.00 1v8p h TRP 44 CO 0.06 0.62 -0.13 0.87 -2.79 0.00 0.00 178.44 177.06 1v8p h LYS 45 N 1.10 0.00 0.16 2.65 1.57 -1.07 0.51 116.57 121.49 1v8p h LYS 45 Ca 0.34 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.83 1v8p h LYS 45 Cb -0.01 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.32 1v8p h LYS 45 CO -0.11 0.13 -1.29 0.93 -0.57 0.00 0.00 179.45 178.54 1v8p h GLU 46 N 0.00 0.42 -0.68 3.15 5.08 -1.24 -2.71 114.58 118.60 1v8p h GLU 46 Ca -0.00 -0.66 -0.02 0.00 -1.00 0.00 0.00 59.36 57.67 1v8p h GLU 46 Cb 0.24 0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1v8p h GLU 46 CO 0.02 1.30 0.33 0.00 -1.00 0.00 0.00 179.01 179.67 1v8p h ALA 47 N 0.42 0.87 -0.34 3.43 0.00 -0.45 -0.94 119.26 122.26 1v8p h ALA 47 Ca -0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1v8p h ALA 47 Cb 1.99 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 19.49 1v8p h ALA 47 CO 0.23 0.42 0.17 0.00 0.00 0.00 0.00 179.25 180.07 1v8p h ARG 48 N 0.94 0.46 -0.73 0.00 2.47 -0.91 -2.68 114.38 113.92 1v8p h ARG 48 Ca 0.23 -0.04 -0.07 0.00 -1.26 0.00 0.00 59.98 58.84 1v8p h ARG 48 Cb 0.10 -0.10 -0.04 0.00 -1.65 0.00 0.00 29.97 28.29 1v8p h ARG 48 CO -0.03 0.36 0.09 1.28 0.56 0.00 0.00 179.97 182.22 1v8p n LEU 49 N -4.43 4.91 0.00 3.04 4.77 -0.84 -4.91 117.00 119.53 1v8p n LEU 49 Ca 0.02 -2.51 0.00 0.00 -0.03 0.00 0.00 56.01 53.49 1v8p n LEU 49 Cb 0.11 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.53 1v8p n LEU 49 CO 0.36 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 1v8p n GLY 50 N 0.28 1.12 3.68 -0.72 0.00 -1.01 -5.03 105.19 103.51 1v8p n GLY 50 Ca 0.26 -0.20 -0.42 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 -0.74 4.36 -0.05 1.61 3.52 -0.42 -4.95 118.95 122.28 1v8p s ARG 51 Ca 0.00 1.23 -0.25 0.00 -0.13 0.00 0.00 55.73 56.58 1v8p s ARG 51 Cb 0.00 -3.56 -0.22 0.00 -1.56 0.00 0.00 34.95 29.60 1v8p s ARG 51 CO 0.00 -0.34 1.07 0.28 -0.81 0.00 0.00 175.30 175.49 1v8p h VAL 52 N 5.16 1.53 -0.21 7.11 2.07 -1.92 -3.33 116.25 126.66 1v8p h VAL 52 Ca -0.29 -1.77 -0.12 0.00 0.82 0.00 0.00 66.70 65.33 1v8p h VAL 52 Cb 1.13 2.65 -0.06 0.00 -1.52 0.00 0.00 31.29 33.49 1v8p h VAL 52 CO 0.86 0.48 0.16 -0.90 0.02 0.00 0.00 177.57 178.18 1v8p n ASP 53 N -4.61 4.44 0.17 0.57 5.68 -1.26 -4.53 116.55 117.01 1v8p n ASP 53 Ca -0.09 -2.51 0.04 0.00 -0.50 0.00 0.00 54.79 51.73 1v8p n ASP 53 Cb 0.43 -0.82 0.44 0.00 -1.14 0.00 0.00 41.12 40.03 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 0.68 0.12 -0.13 2.11 5.08 -1.99 -0.97 115.95 120.86 1v8p h TRP 54 Ca 0.13 -0.01 -0.09 0.00 1.08 0.00 0.00 58.89 59.99 1v8p h TRP 54 Cb 1.18 -0.03 0.00 0.00 -3.00 0.00 0.00 29.16 27.31 1v8p h TRP 54 CO 0.40 0.28 -0.29 0.00 -1.28 0.00 0.00 178.44 177.55 1v8p h ALA 55 N 1.73 0.21 -0.41 0.11 0.00 -1.92 -1.29 119.26 117.69 1v8p h ALA 55 Ca 0.02 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 1v8p h ALA 55 Cb 0.35 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1v8p h ALA 55 CO 0.02 0.22 0.10 0.00 0.00 0.00 0.00 179.25 179.60 1v8p h ALA 56 N 0.53 0.54 -0.60 0.00 0.00 -1.89 -2.73 119.26 115.11 1v8p h ALA 56 Ca 0.00 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.76 1v8p h ALA 56 Cb 0.89 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1v8p h ALA 56 CO 0.06 0.21 0.35 0.00 0.00 0.00 0.00 179.25 179.87 1v8p h ALA 57 N 0.96 0.78 -0.91 0.00 0.00 -1.18 -1.70 119.26 117.21 1v8p h ALA 57 Ca 0.13 -0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.18 1v8p h ALA 57 Cb 0.30 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.87 1v8p h ALA 57 CO 0.00 0.05 0.59 0.66 0.00 0.00 0.00 179.25 180.55 1v8p h SER 58 N 0.67 0.71 -0.26 0.00 4.64 -0.93 0.12 113.55 118.50 1v8p h SER 58 Ca 0.25 0.04 -0.16 0.00 -0.47 0.00 0.00 61.79 61.45 1v8p h SER 58 Cb 0.08 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1v8p h SER 58 CO -0.13 0.37 -0.46 0.03 -0.87 0.00 0.00 176.83 175.77 1v8p h ARG 59 N 0.76 0.78 -0.64 4.77 3.08 -1.13 -0.67 114.38 121.32 1v8p h ARG 59 Ca 0.46 -0.48 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 1v8p h ARG 59 Cb 0.67 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.74 1v8p h ARG 59 CO -0.22 1.11 0.20 1.25 -1.07 0.00 0.00 179.97 181.24 1v8p h HIS 60 N 0.53 1.03 -0.31 3.04 2.76 -0.40 -2.16 115.15 119.63 1v8p h HIS 60 Ca 0.02 -0.10 -0.12 0.00 -2.20 0.00 0.00 60.37 57.97 1v8p h HIS 60 Cb 1.06 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.71 1v8p h HIS 60 CO 0.08 0.84 -0.28 1.25 -1.30 0.00 0.00 177.93 178.51 1v8p h LEU 61 N 0.92 0.66 -1.39 0.26 6.46 -0.75 -1.75 115.31 119.72 1v8p h LEU 61 Ca 0.21 -0.25 -0.05 0.00 -0.12 0.00 0.00 57.88 57.67 1v8p h LEU 61 Cb 0.29 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.02 1v8p h LEU 61 CO -0.01 0.91 -0.08 0.50 -0.62 0.00 0.00 178.44 179.14 1v8p h LYS 62 N 0.56 0.30 -0.05 1.25 3.64 -0.79 -1.68 116.57 119.79 1v8p h LYS 62 Ca 0.07 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 1v8p h LYS 62 Cb 0.77 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1v8p h LYS 62 CO 0.06 0.40 -0.30 -0.22 -2.27 0.00 0.00 179.45 177.12 1v8p h LYS 63 N 0.29 0.30 -0.92 1.90 3.64 -0.88 -2.56 116.57 118.33 1v8p h LYS 63 Ca 0.06 -0.25 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 1v8p h LYS 63 Cb 0.34 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.16 1v8p h LYS 63 CO 0.02 0.90 0.58 0.28 -2.27 0.00 0.00 179.45 178.96 1v8p h VAL 64 N -0.22 1.25 -0.37 2.00 2.07 -1.18 -2.59 116.25 117.20 1v8p h VAL 64 Ca -0.02 -0.50 -0.10 0.00 0.82 0.00 0.00 66.70 66.91 1v8p h VAL 64 Cb 0.96 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 1v8p h VAL 64 CO 0.06 0.25 -0.17 -0.07 0.02 0.00 0.00 177.57 177.66 1v8p h LEU 65 N 1.26 0.68 -0.93 2.57 3.38 -1.33 -2.84 115.31 118.10 1v8p h LEU 65 Ca 0.33 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1v8p h LEU 65 Cb -0.10 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.47 1v8p h LEU 65 CO -0.07 0.86 0.00 0.77 0.09 0.00 0.00 178.44 180.09 1v8p h SER 66 N 0.61 0.00 1.25 -0.43 4.64 -1.05 -2.65 113.55 115.92 1v8p h SER 66 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1v8p h SER 66 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1v8p h SER 66 CO 0.04 0.00 0.00 0.28 -0.87 0.00 0.00 176.83 176.28 1v8p h SER 67 N 0.00 0.00 -2.77 4.97 0.02 -1.39 -3.45 113.55 110.93 1v8p h SER 67 Ca 0.00 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.41 1v8p h SER 67 Cb 0.29 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 1v8p h SER 67 CO 0.00 0.00 -0.37 -0.36 -1.14 0.00 0.00 176.83 174.96 1v8p s PHE 68 N -3.47 3.48 0.36 3.45 0.40 -1.00 -4.76 117.98 116.44 1v8p s PHE 68 Ca 0.04 0.28 -0.15 0.00 -0.60 0.00 0.00 56.93 56.50 1v8p s PHE 68 Cb 0.08 -1.80 -0.09 0.00 0.51 0.00 0.00 43.02 41.72 1v8p s PHE 68 CO 0.56 0.42 0.78 0.15 0.70 0.00 0.00 175.22 177.82 1v8p s LYS 69 N -3.30 3.98 -0.22 0.44 1.02 -0.99 -4.89 119.74 115.78 1v8p s LYS 69 Ca 0.37 0.69 -0.02 0.00 0.02 0.00 0.00 55.97 57.04 1v8p s LYS 69 Cb -0.11 -2.38 0.02 0.00 -0.52 0.00 0.00 37.83 34.83 1v8p s LYS 69 CO 0.29 0.08 -0.09 0.08 -0.92 0.00 0.00 175.35 174.79 1v8p s VAL 70 N -2.11 2.82 0.82 3.17 1.01 -1.26 -0.62 120.40 124.24 1v8p s VAL 70 Ca 0.55 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 61.55 1v8p s VAL 70 Cb -0.10 -2.34 0.09 0.00 0.00 0.00 0.00 36.38 34.02 1v8p s VAL 70 CO 0.20 0.34 1.12 -0.76 0.00 0.00 0.00 175.10 176.00 1v8p s LEU 71 N 1.36 2.43 0.71 3.92 1.43 -0.41 -4.96 118.68 123.16 1v8p s LEU 71 Ca 0.03 1.11 -0.11 0.00 -1.03 0.00 0.00 54.13 54.13 1v8p s LEU 71 Cb -0.15 -3.64 0.02 0.00 0.03 0.00 0.00 46.19 42.45 1v8p s LEU 71 CO -0.06 -2.08 1.07 -1.61 0.23 0.00 0.00 176.35 173.91 1v8p s GLU 72 N -5.27 2.76 0.29 1.70 2.02 -1.26 -4.43 118.70 114.51 1v8p s GLU 72 Ca 0.62 1.06 -0.29 0.00 0.02 0.00 0.00 54.97 56.38 1v8p s GLU 72 Cb -0.14 -1.96 -0.10 0.00 0.10 0.00 0.00 34.13 32.03 1v8p s GLU 72 CO 0.53 -1.25 1.25 -0.51 0.02 0.00 0.00 175.26 175.30 1v8p s ASP 73 N -3.52 6.93 0.85 -0.19 -0.00 -1.26 -4.93 116.67 114.55 1v8p s ASP 73 Ca 0.60 2.52 -0.12 0.00 -0.00 0.00 0.00 52.55 55.55 1v8p s ASP 73 Cb -0.15 -2.64 0.10 0.00 -0.00 0.00 0.00 42.92 40.23 1v8p s ASP 73 CO 0.53 -0.42 1.15 -2.84 -0.00 0.00 0.00 175.17 173.58 1v8p s PRO 74 N -1.40 1.65 -0.01 8.23 0.02 -1.26 -5.00 135.00 137.23 1v8p s PRO 74 Ca 0.49 0.26 -0.30 0.00 0.02 0.00 0.00 61.00 61.47 1v8p s PRO 74 Cb -0.37 -1.90 -0.05 0.00 0.02 0.00 0.00 34.50 32.20 1v8p s PRO 74 CO 0.47 -1.84 1.33 -2.14 -0.33 0.00 0.00 177.00 174.48 1v8p s PRO 75 N -5.39 4.31 0.39 5.54 0.02 -1.26 -4.91 135.00 133.70 1v8p s PRO 75 Ca 0.62 1.87 0.08 0.00 0.02 0.00 0.00 61.00 63.59 1v8p s PRO 75 Cb -0.13 -3.55 0.83 0.00 0.02 0.00 0.00 34.50 31.67 1v8p s PRO 75 CO 0.52 -0.52 1.97 1.25 -0.33 0.00 0.00 177.00 179.89 1v8p h LEU 76 N 8.21 0.57 -0.59 -5.54 6.46 -2.00 -2.38 115.31 120.04 1v8p h LEU 76 Ca -0.37 0.00 -0.11 0.00 -0.12 0.00 0.00 57.88 57.28 1v8p h LEU 76 Cb 1.17 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 40.97 1v8p h LEU 76 CO 0.89 0.36 -0.13 -2.24 -0.62 0.00 0.00 178.44 176.71 1v8p h ASP 77 N 0.64 0.99 -0.28 1.25 2.03 -2.00 -2.29 116.42 116.77 1v8p h ASP 77 Ca 0.29 -0.33 -0.06 0.00 -0.73 0.00 0.00 57.03 56.20 1v8p h ASP 77 Cb 0.32 -0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 38.54 1v8p h ASP 77 CO -0.09 1.12 -0.05 -0.33 -1.03 0.00 0.00 179.24 178.85 1v8p h GLU 78 N 0.88 0.53 -0.76 4.15 4.39 -1.84 -2.56 114.58 119.37 1v8p h GLU 78 Ca 0.13 -0.20 -0.03 0.00 0.34 0.00 0.00 59.36 59.60 1v8p h GLU 78 Cb 0.69 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.27 1v8p h GLU 78 CO 0.05 0.73 0.35 0.28 -1.16 0.00 0.00 179.01 179.25 1v8p h VAL 79 N 0.29 1.25 -0.67 3.13 2.07 -1.46 -2.80 116.25 118.06 1v8p h VAL 79 Ca 0.07 -0.72 -0.05 0.00 0.82 0.00 0.00 66.70 66.82 1v8p h VAL 79 Cb 0.52 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 1v8p h VAL 79 CO 0.02 0.30 0.22 0.25 0.02 0.00 0.00 177.57 178.38 1v8p h LEU 80 N 1.07 0.96 -0.16 2.57 6.46 -1.36 -1.62 115.31 123.23 1v8p h LEU 80 Ca 0.26 -0.20 0.04 0.00 -0.12 0.00 0.00 57.88 57.85 1v8p h LEU 80 Cb 0.15 -0.25 -0.04 0.00 -0.73 0.00 0.00 40.66 39.79 1v8p h LEU 80 CO -0.03 0.91 -0.08 -0.09 -0.62 0.00 0.00 178.44 178.52 1v8p h ARG 81 N 0.96 -0.07 -0.38 1.25 2.43 -1.24 -0.73 114.38 116.60 1v8p h ARG 81 Ca 0.22 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.43 1v8p h ARG 81 Cb 0.28 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.81 1v8p h ARG 81 CO -0.01 -0.05 0.16 0.28 -1.51 0.00 0.00 179.97 178.85 1v8p h VAL 82 N -0.08 0.94 -0.68 0.20 2.07 -1.24 0.10 116.25 117.56 1v8p h VAL 82 Ca 0.09 -0.12 0.04 0.00 0.82 0.00 0.00 66.70 67.53 1v8p h VAL 82 Cb 0.21 0.56 -0.05 0.00 -1.52 0.00 0.00 31.29 30.49 1v8p h VAL 82 CO -0.20 0.06 0.41 0.00 0.02 0.00 0.00 177.57 177.86 1v8p h ALA 83 N 1.22 0.90 -0.03 1.67 0.00 -0.82 0.21 119.26 122.41 1v8p h ALA 83 Ca 0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1v8p h ALA 83 Cb 0.11 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1v8p h ALA 83 CO -0.14 0.15 -0.02 0.28 0.00 0.00 0.00 179.25 179.52 1v8p h VAL 84 N 0.79 1.34 -0.24 0.00 2.07 -0.72 -1.29 116.25 118.20 1v8p h VAL 84 Ca 0.28 -1.06 -0.08 0.00 0.82 0.00 0.00 66.70 66.66 1v8p h VAL 84 Cb 0.08 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 1v8p h VAL 84 CO -0.13 0.28 -0.21 -0.33 0.02 0.00 0.00 177.57 177.20 1v8p h GLU 85 N -0.34 0.44 -0.02 1.57 5.08 -0.81 -3.27 114.58 117.23 1v8p h GLU 85 Ca 0.01 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1v8p h GLU 85 Cb 0.47 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1v8p h GLU 85 CO 0.01 0.63 -0.19 0.54 -1.00 0.00 0.00 179.01 179.00 1v8p n ARG 86 N -4.15 1.79 -2.75 2.33 1.74 0.72 -5.00 116.66 111.33 1v8p n ARG 86 Ca -0.00 -1.48 -0.09 0.00 -0.77 0.00 0.00 57.85 55.51 1v8p n ARG 86 Cb 0.37 -1.43 0.02 0.00 -1.02 0.00 0.00 32.46 30.40 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 1.31 0.28 3.59 -0.13 0.00 -0.54 -5.03 105.19 104.67 1v8p n GLY 87 Ca 0.11 -0.36 -0.24 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.24 2.94 0.91 0.99 1.43 -0.87 -5.07 118.68 115.77 1v8p s LEU 88 Ca 0.18 -0.91 -0.12 0.00 -1.03 0.00 0.00 54.13 52.25 1v8p s LEU 88 Cb -0.08 -1.39 0.14 0.00 0.03 0.00 0.00 46.19 44.89 1v8p s LEU 88 CO 0.22 -0.10 1.11 0.42 0.23 0.00 0.00 176.35 178.23 1v8p s THR 89 N -2.46 2.31 0.34 5.49 -4.23 -1.26 -4.59 115.64 111.23 1v8p s THR 89 Ca 0.33 0.10 0.08 0.00 -1.18 0.00 0.00 61.69 61.02 1v8p s THR 89 Cb -0.03 -2.76 0.09 0.00 1.34 0.00 0.00 72.50 71.14 1v8p s THR 89 CO 0.18 -0.13 1.80 0.15 -0.54 0.00 0.00 174.62 176.09 1v8p h PHE 90 N -1.51 0.25 -0.15 3.99 3.57 -1.94 -1.43 116.94 119.72 1v8p h PHE 90 Ca -0.51 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 60.91 1v8p h PHE 90 Cb 1.31 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.99 1v8p h PHE 90 CO 0.34 0.49 -0.02 1.88 -2.23 0.00 0.00 178.31 178.77 1v8p h TYR 91 N 0.20 0.32 -0.27 0.41 0.05 -1.98 -2.05 116.97 113.66 1v8p h TYR 91 Ca 0.03 -0.06 -0.12 0.00 0.05 0.00 0.00 58.73 58.62 1v8p h TYR 91 Cb 0.61 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 38.26 1v8p h TYR 91 CO 0.01 0.54 -0.34 -0.44 -1.05 0.00 0.00 178.16 176.88 1v8p h ASP 92 N 0.00 0.61 -0.20 3.88 3.45 -1.91 -2.53 116.42 119.72 1v8p h ASP 92 Ca 0.04 -0.25 -0.02 0.00 0.43 0.00 0.00 57.03 57.23 1v8p h ASP 92 Cb 0.43 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.02 1v8p h ASP 92 CO 0.01 0.90 0.08 0.00 -1.57 0.00 0.00 179.24 178.67 1v8p h ALA 93 N 1.13 1.65 -0.64 3.45 0.00 -1.22 -2.30 119.26 121.33 1v8p h ALA 93 Ca 0.05 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 54.95 1v8p h ALA 93 Cb 0.83 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.44 1v8p h ALA 93 CO 0.07 0.27 0.30 0.77 0.00 0.00 0.00 179.25 180.67 1v8p h SER 94 N 0.37 0.38 0.38 0.00 0.02 -0.91 0.15 113.55 113.95 1v8p h SER 94 Ca 0.09 0.06 -0.20 0.00 -0.84 0.00 0.00 61.79 60.90 1v8p h SER 94 Cb 0.12 -0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 1v8p h SER 94 CO -0.01 0.23 -0.85 1.88 -1.14 0.00 0.00 176.83 176.94 1v8p h TYR 95 N 0.54 0.49 -0.22 3.45 -1.99 -1.49 -2.41 116.97 115.34 1v8p h TYR 95 Ca 0.31 -0.25 -0.06 0.00 2.00 0.00 0.00 58.73 60.73 1v8p h TYR 95 Cb 0.32 -0.06 -0.01 0.00 2.00 0.00 0.00 36.73 38.98 1v8p h TYR 95 CO -0.12 1.05 -0.11 0.00 -0.00 0.00 0.00 178.16 178.97 1v8p h ALA 96 N 0.87 0.31 -0.41 3.88 0.00 -1.06 -1.87 119.26 120.98 1v8p h ALA 96 Ca -0.05 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 1v8p h ALA 96 Cb 1.46 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 1v8p h ALA 96 CO 0.14 0.16 0.12 -0.92 0.00 0.00 0.00 179.25 178.75 1v8p h TYR 97 N 0.17 0.68 -0.35 0.00 3.20 -0.76 -2.47 116.97 117.45 1v8p h TYR 97 Ca 0.05 -0.07 -0.09 0.00 3.14 0.00 0.00 58.73 61.76 1v8p h TYR 97 Cb 0.61 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 1v8p h TYR 97 CO 0.06 0.64 -0.13 0.28 -1.64 0.00 0.00 178.16 177.37 1v8p h VAL 98 N 0.53 1.28 -0.14 1.81 2.07 -1.46 0.13 116.25 120.47 1v8p h VAL 98 Ca 0.13 -1.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.42 1v8p h VAL 98 Cb 0.29 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1v8p h VAL 98 CO -0.00 0.40 0.08 0.00 0.02 0.00 0.00 177.57 178.07 1v8p h ALA 99 N 0.80 0.18 -0.13 1.67 0.00 -1.33 -1.38 119.26 119.06 1v8p h ALA 99 Ca 0.08 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1v8p h ALA 99 Cb 0.66 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1v8p h ALA 99 CO 0.04 -0.29 -0.20 0.93 0.00 0.00 0.00 179.25 179.73 1v8p h GLU 100 N 0.14 0.37 -0.17 0.00 5.08 -1.47 0.88 114.58 119.41 1v8p h GLU 100 Ca 0.05 -0.22 0.05 0.00 -1.00 0.00 0.00 59.36 58.23 1v8p h GLU 100 Cb 0.06 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1v8p h GLU 100 CO -0.01 0.81 0.12 1.03 -1.00 0.00 0.00 179.01 179.96 1v8p h SER 101 N -0.03 0.00 -0.30 1.42 0.87 -0.69 -1.85 113.55 112.98 1v8p h SER 101 Ca 0.01 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1v8p h SER 101 Cb 0.77 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.73 1v8p h SER 101 CO 0.05 0.00 0.00 -1.20 -0.53 0.00 0.00 176.83 175.15 1v8p n SER 102 N -4.49 2.88 -2.93 6.23 7.64 -0.53 -4.98 113.62 117.44 1v8p n SER 102 Ca 0.01 -1.86 -0.20 0.00 1.01 0.00 0.00 58.87 57.83 1v8p n SER 102 Cb 0.25 -0.19 0.05 0.00 -1.01 0.00 0.00 64.21 63.31 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 0.86 -0.38 3.97 0.23 0.00 -0.46 -5.01 105.19 104.41 1v8p n GLY 103 Ca 0.13 0.08 -0.18 0.00 0.00 0.00 0.00 46.02 46.05 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 -6.23 3.55 -0.22 0.99 1.43 0.29 -5.00 118.68 113.49 1v8p s LEU 104 Ca 0.38 -0.54 -0.07 0.00 -1.03 0.00 0.00 54.13 52.87 1v8p s LEU 104 Cb -0.17 -2.43 -0.03 0.00 0.03 0.00 0.00 46.19 43.59 1v8p s LEU 104 CO 0.47 -0.77 0.06 -0.69 0.23 0.00 0.00 176.35 175.66 1v8p s VAL 105 N -2.40 4.48 -0.08 -1.59 1.01 0.36 -4.46 120.40 117.72 1v8p s VAL 105 Ca 0.53 -0.13 -0.29 0.00 0.00 0.00 0.00 61.98 62.10 1v8p s VAL 105 Cb -0.08 -3.06 -0.02 0.00 0.00 0.00 0.00 36.38 33.22 1v8p s VAL 105 CO 0.32 0.39 0.95 -0.22 0.00 0.00 0.00 175.10 176.54 1v8p s LEU 106 N 1.09 4.28 -0.30 3.92 0.20 -1.26 -0.92 118.68 125.69 1v8p s LEU 106 Ca 0.04 1.50 -0.09 0.00 0.69 0.00 0.00 54.13 56.27 1v8p s LEU 106 Cb -0.14 -3.48 -0.01 0.00 -0.43 0.00 0.00 46.19 42.13 1v8p s LEU 106 CO 0.03 -0.35 0.12 -0.69 -0.29 0.00 0.00 176.35 175.17 1v8p s VAL 107 N 1.60 4.40 0.02 1.68 1.01 0.15 -0.92 120.40 128.34 1v8p s VAL 107 Ca 0.47 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 61.95 1v8p s VAL 107 Cb -0.19 -3.22 -0.00 0.00 0.00 0.00 0.00 36.38 32.97 1v8p s VAL 107 CO 0.20 0.12 0.12 0.28 0.00 0.00 0.00 175.10 175.82 1v8p s THR 108 N 1.59 0.10 -2.67 3.92 -1.32 -0.74 -2.12 115.64 114.39 1v8p s THR 108 Ca 0.04 -0.85 0.22 0.00 -1.21 0.00 0.00 61.69 59.89 1v8p s THR 108 Cb -0.17 -0.62 0.21 0.00 -1.51 0.00 0.00 72.50 70.41 1v8p s THR 108 CO 0.05 -0.47 1.22 1.67 -2.21 0.00 0.00 174.62 174.88 1v8p n GLN 109 N 1.15 2.11 -2.84 7.08 -0.06 -1.26 -4.06 117.38 119.50 1v8p n GLN 109 Ca -0.21 -1.87 -0.43 0.00 -2.00 0.00 0.00 57.00 52.48 1v8p n GLN 109 Cb 0.57 -1.43 -0.04 0.00 -4.06 0.00 0.00 30.24 25.28 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 -1.76 6.53 0.52 1.69 -1.08 -1.26 -4.92 116.67 116.38 1v8p s ASP 110 Ca 0.27 0.22 0.22 0.00 -0.52 0.00 0.00 52.55 52.74 1v8p s ASP 110 Cb 0.19 -2.44 1.33 0.00 -1.46 0.00 0.00 42.92 40.53 1v8p s ASP 110 CO 0.28 -0.98 2.03 0.03 0.52 0.00 0.00 175.17 177.05 1v8p h ARG 111 N 8.90 0.05 0.00 4.34 2.47 -1.99 -0.68 114.38 127.46 1v8p h ARG 111 Ca -0.24 -0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.48 1v8p h ARG 111 Cb 1.08 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.39 1v8p h ARG 111 CO 1.00 0.03 -0.00 1.49 0.56 0.00 0.00 179.97 183.05 1v8p h GLU 112 N 0.05 -0.00 -0.44 0.04 4.57 -1.99 -2.32 114.58 114.48 1v8p h GLU 112 Ca 0.20 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.31 1v8p h GLU 112 Cb 0.74 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.31 1v8p h GLU 112 CO -0.01 0.42 -0.01 -0.07 -1.18 0.00 0.00 179.01 178.17 1v8p h LEU 113 N -0.43 0.70 -0.02 1.64 3.38 -1.77 -0.80 115.31 118.02 1v8p h LEU 113 Ca -0.00 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.83 1v8p h LEU 113 Cb 0.43 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1v8p h LEU 113 CO 0.00 0.77 -0.11 -0.07 0.09 0.00 0.00 178.44 179.12 1v8p h LEU 114 N 0.68 -0.31 -1.29 1.67 3.38 -1.13 -0.75 115.31 117.57 1v8p h LEU 114 Ca 0.14 0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 1v8p h LEU 114 Cb 0.43 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1v8p h LEU 114 CO 0.02 -0.15 -0.33 0.00 0.09 0.00 0.00 178.44 178.06 1v8p h ALA 115 N 0.82 1.26 -0.44 1.53 0.00 -1.14 -3.15 119.26 118.12 1v8p h ALA 115 Ca 0.05 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1v8p h ALA 115 Cb 0.23 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1v8p h ALA 115 CO -0.12 0.42 0.00 1.63 0.00 0.00 0.00 179.25 181.17 1v8p n LYS 116 N -3.86 2.52 -4.74 0.00 5.02 -0.33 -4.90 118.16 111.87 1v8p n LYS 116 Ca -0.01 -2.33 -0.29 0.00 -2.02 0.00 0.00 58.31 53.66 1v8p n LYS 116 Cb 0.41 -1.51 -0.17 0.00 -0.02 0.00 0.00 35.03 33.74 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 -1.36 1.65 0.08 -0.18 2.01 -0.32 -5.03 115.64 112.49 1v8p s THR 117 Ca 0.39 -0.76 -0.31 0.00 0.31 0.00 0.00 61.69 61.33 1v8p s THR 117 Cb 0.23 -1.47 -0.08 0.00 0.01 0.00 0.00 72.50 71.19 1v8p s THR 117 CO 0.31 0.47 1.46 -0.75 -0.69 0.00 0.00 174.62 175.42 1v8p s LYS 118 N 0.70 4.28 0.00 4.92 2.20 -1.26 -2.85 119.74 127.72 1v8p s LYS 118 Ca -0.12 2.12 0.00 0.00 -0.36 0.00 0.00 55.97 57.61 1v8p s LYS 118 Cb -0.16 -3.38 0.00 0.00 -1.51 0.00 0.00 37.83 32.78 1v8p s LYS 118 CO 0.03 -0.54 0.00 0.41 -0.36 0.00 0.00 175.35 174.89 1v8p n GLY 119 N 3.65 2.09 3.77 5.54 0.00 -1.26 -4.77 105.19 114.21 1v8p n GLY 119 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.99 3.40 0.27 4.61 0.00 -1.13 -4.39 121.76 121.52 1v8p s ALA 120 Ca 0.00 1.45 0.02 0.00 0.00 0.00 0.00 51.96 53.43 1v8p s ALA 120 Cb 0.00 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.51 1v8p s ALA 120 CO 0.00 -1.03 0.15 0.96 0.00 0.00 0.00 175.76 175.84 1v8p s ILE 121 N -1.17 0.28 0.62 0.00 -0.00 -0.09 -4.94 121.20 115.88 1v8p s ILE 121 Ca 0.56 -2.00 0.06 0.00 -0.00 0.00 0.00 60.65 59.27 1v8p s ILE 121 Cb -0.43 -2.54 0.10 0.00 -0.00 0.00 0.00 42.46 39.58 1v8p s ILE 121 CO 0.57 0.00 0.85 1.51 -0.00 0.00 0.00 174.94 177.87 1v8p s ASP 122 N -3.31 4.87 0.10 4.36 1.47 -1.26 -1.79 116.67 121.12 1v8p s ASP 122 Ca 0.37 -0.64 -0.22 0.00 1.18 0.00 0.00 52.55 53.24 1v8p s ASP 122 Cb 0.06 0.11 -0.11 0.00 -0.34 0.00 0.00 42.92 42.64 1v8p s ASP 122 CO 0.16 -1.49 1.72 0.58 0.68 0.00 0.00 175.17 176.83 1v8p h VAL 123 N -0.04 0.90 -0.54 2.11 2.07 -1.94 -1.07 116.25 117.74 1v8p h VAL 123 Ca -0.33 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.30 1v8p h VAL 123 Cb 1.28 0.90 -0.09 0.00 -1.52 0.00 0.00 31.29 31.86 1v8p h VAL 123 CO 0.41 0.00 -0.01 -0.08 0.02 0.00 0.00 177.57 177.91 1v8p h GLU 124 N -0.04 0.11 -0.25 1.57 4.81 -1.96 0.71 114.58 119.53 1v8p h GLU 124 Ca 0.03 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1v8p h GLU 124 Cb 0.08 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1v8p h GLU 124 CO -0.07 0.07 0.16 1.15 -0.73 0.00 0.00 179.01 179.60 1v8p h THR 125 N 0.11 1.07 -0.39 0.32 2.02 -1.87 -1.84 112.91 112.33 1v8p h THR 125 Ca 0.28 -0.12 0.05 0.00 0.77 0.00 0.00 66.41 67.38 1v8p h THR 125 Cb 0.43 0.71 -0.05 0.00 -1.74 0.00 0.00 68.15 67.50 1v8p h THR 125 CO -0.46 0.06 0.11 0.25 0.37 0.00 0.00 175.52 175.86 1v8p h LEU 126 N 0.33 0.09 -0.86 2.58 5.85 -0.10 -1.41 115.31 121.80 1v8p h LEU 126 Ca 0.09 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1v8p h LEU 126 Cb -0.03 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 1v8p h LEU 126 CO -0.02 0.09 0.55 -0.07 -0.34 0.00 0.00 178.44 178.64 1v8p h LEU 127 N 0.26 1.01 -1.24 2.25 3.38 -0.61 0.36 115.31 120.73 1v8p h LEU 127 Ca 0.18 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 1v8p h LEU 127 Cb 0.19 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1v8p h LEU 127 CO -0.21 0.76 -0.29 -0.37 0.09 0.00 0.00 178.44 178.42 1v8p h VAL 128 N 1.18 0.81 -0.19 1.22 -1.51 -1.00 -1.41 116.25 115.36 1v8p h VAL 128 Ca 0.31 -1.19 -0.19 0.00 -1.23 0.00 0.00 66.70 64.40 1v8p h VAL 128 Cb -0.09 1.73 0.00 0.00 -2.13 0.00 0.00 31.29 30.80 1v8p h VAL 128 CO -0.06 0.29 -0.65 0.03 -1.23 0.00 0.00 177.57 175.94 1v8p h ARG 129 N 0.00 0.72 0.00 5.19 3.08 -0.04 -3.12 114.38 120.20 1v8p h ARG 129 Ca -0.00 -0.51 -0.11 0.00 0.07 0.00 0.00 59.98 59.43 1v8p h ARG 129 Cb 0.71 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.83 1v8p h ARG 129 CO 0.04 1.13 -0.51 -0.07 -1.07 0.00 0.00 179.97 179.50 1v8p h LEU 130 N 0.52 0.00 -0.29 3.04 3.38 -0.64 -3.24 115.31 118.07 1v8p h LEU 130 Ca -0.02 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.00 1v8p h LEU 130 Cb 1.25 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.96 1v8p h LEU 130 CO 0.13 0.51 -0.00 0.00 0.09 0.00 0.00 178.44 179.17 1v8p h ALA 131 N 1.49 0.26 0.00 1.53 0.00 -1.20 -2.83 119.26 118.51 1v8p h ALA 131 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1v8p h ALA 131 Cb 1.11 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1v8p h ALA 131 CO 0.07 -0.41 0.00 0.00 0.00 0.00 0.00 179.25 178.90 1v8p n ALA 132 N -2.44 2.91 -0.13 0.00 0.00 -1.22 -5.12 120.51 114.50 1v8p n ALA 132 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1v8p n ALA 132 Cb 0.15 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1v8p n ALA 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50