#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 -2.03 -1.88 3.17 0.00 -1.26 -4.87 120.51 113.64 1v8p n ALA 2 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 1v8p n ALA 2 Cb 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 19.45 19.16 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 0.00 2.85 0.00 0.00 1.01 -1.25 -4.27 120.40 118.74 1v8p s VAL 3 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 61.98 62.73 1v8p s VAL 3 Cb 0.00 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.90 1v8p s VAL 3 CO 0.00 0.14 0.00 -0.62 0.00 0.00 0.00 175.10 174.62 1v8p n GLU 4 N 1.92 2.21 -4.94 2.72 1.02 0.22 -5.01 120.64 118.79 1v8p n GLU 4 Ca 0.04 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.90 1v8p n GLU 4 Cb 0.41 -0.93 -0.15 0.00 -0.02 0.00 0.00 31.44 30.76 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 2.03 -0.25 -0.32 1.51 0.55 -1.41 117.35 117.60 1v8p s TYR 5 Ca 0.00 -0.39 -0.06 0.00 -1.01 0.00 0.00 57.07 55.61 1v8p s TYR 5 Cb 0.00 -1.26 -0.01 0.00 -0.11 0.00 0.00 41.96 40.58 1v8p s TYR 5 CO 0.00 0.04 0.04 -1.17 -1.11 0.00 0.00 175.55 173.34 1v8p s LEU 6 N -0.87 3.39 -0.21 -1.29 2.96 -0.58 -1.01 118.68 121.07 1v8p s LEU 6 Ca 0.09 -0.42 -0.10 0.00 -0.22 0.00 0.00 54.13 53.49 1v8p s LEU 6 Cb -0.09 -1.85 -0.05 0.00 0.50 0.00 0.00 46.19 44.70 1v8p s LEU 6 CO 0.01 -0.08 0.13 -0.69 -1.32 0.00 0.00 176.35 174.40 1v8p s VAL 7 N 1.54 5.30 0.72 1.68 1.01 0.12 -1.00 120.40 129.76 1v8p s VAL 7 Ca 0.05 0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.19 1v8p s VAL 7 Cb -0.15 -3.43 0.14 0.00 0.00 0.00 0.00 36.38 32.93 1v8p s VAL 7 CO 0.01 0.41 0.99 -0.90 0.00 0.00 0.00 175.10 175.61 1v8p n ASP 8 N 3.80 1.42 -0.32 3.32 5.75 -0.94 -4.54 116.55 125.05 1v8p n ASP 8 Ca -0.16 -2.18 -0.02 0.00 -0.01 0.00 0.00 54.79 52.42 1v8p n ASP 8 Cb 0.52 -0.63 0.10 0.00 -1.03 0.00 0.00 41.12 40.08 1v8p n ASP 8 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1v8p h ALA 9 N -0.55 1.12 0.00 2.12 0.00 -1.90 0.33 119.26 120.38 1v8p h ALA 9 Ca -0.33 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.46 1v8p h ALA 9 Cb 1.23 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1v8p h ALA 9 CO 0.36 0.43 -0.38 0.66 0.00 0.00 0.00 179.25 180.32 1v8p h SER 10 N 1.11 0.00 0.02 0.00 4.64 -1.95 -0.71 113.55 116.67 1v8p h SER 10 Ca 0.33 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.44 1v8p h SER 10 Cb -0.04 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.06 1v8p h SER 10 CO -0.10 0.38 -0.86 0.00 -0.87 0.00 0.00 176.83 175.38 1v8p h ALA 11 N 1.62 0.07 -0.41 5.18 0.00 -1.71 -2.23 119.26 121.78 1v8p h ALA 11 Ca -0.00 -0.65 -0.00 0.00 0.00 0.00 0.00 54.91 54.25 1v8p h ALA 11 Cb 1.00 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1v8p h ALA 11 CO 0.05 0.52 0.24 1.25 0.00 0.00 0.00 179.25 181.31 1v8p h LEU 12 N 0.12 0.50 -0.44 0.00 7.12 -0.80 0.29 115.31 122.09 1v8p h LEU 12 Ca -0.11 -0.07 0.04 0.00 0.13 0.00 0.00 57.88 57.87 1v8p h LEU 12 Cb 1.56 -0.13 -0.04 0.00 -0.53 0.00 0.00 40.66 41.52 1v8p h LEU 12 CO 0.17 0.42 0.20 0.22 -0.13 0.00 0.00 178.44 179.33 1v8p h TYR 13 N 0.53 0.37 -0.10 1.25 3.20 -1.13 0.60 116.97 121.70 1v8p h TYR 13 Ca 0.15 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 1v8p h TYR 13 Cb 0.02 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.19 1v8p h TYR 13 CO -0.03 0.18 0.04 0.00 -1.64 0.00 0.00 178.16 176.71 1v8p h ALA 14 N 1.25 0.13 -0.37 1.82 0.00 -0.91 -3.07 119.26 118.11 1v8p h ALA 14 Ca 0.20 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.08 1v8p h ALA 14 Cb 0.13 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1v8p h ALA 14 CO -0.15 -0.28 0.25 -0.07 0.00 0.00 0.00 179.25 179.00 1v8p h LEU 15 N 0.00 0.17 -1.39 0.00 3.38 0.34 -2.55 115.31 115.27 1v8p h LEU 15 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1v8p h LEU 15 Cb 0.17 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1v8p h LEU 15 CO -0.00 0.11 0.18 0.00 0.09 0.00 0.00 178.44 178.82 1v8p h ALA 16 N 1.81 1.14 -0.47 1.53 0.00 -0.81 0.11 119.26 122.57 1v8p h ALA 16 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1v8p h ALA 16 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1v8p h ALA 16 CO -0.03 -0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.09 1v8p n ALA 17 N -1.72 2.42 -1.72 0.00 0.00 -0.96 -4.18 120.51 114.34 1v8p n ALA 17 Ca -0.01 -1.03 0.04 0.00 0.00 0.00 0.00 53.44 52.44 1v8p n ALA 17 Cb 0.22 -0.91 0.06 0.00 0.00 0.00 0.00 19.45 18.81 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 1.42 0.00 -0.01 0.00 -0.00 0.37 -4.96 115.22 112.04 1v8p n HIS 18 Ca 0.20 -0.47 -0.00 0.00 -0.00 0.00 0.00 57.72 57.44 1v8p n HIS 18 Cb 0.58 -0.11 -0.00 0.00 -0.00 0.00 0.00 29.99 30.46 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 -0.49 -0.02 -0.31 4.41 9.36 -1.19 0.39 117.16 129.32 1v8p n TYR 19 Ca 0.07 0.04 0.15 0.00 3.32 0.00 0.00 57.90 61.48 1v8p n TYR 19 Cb 0.73 -0.18 0.33 0.00 -0.63 0.00 0.00 39.34 39.59 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 0.30 0.30 2.98 3.32 -1.93 -0.83 116.42 120.56 1v8p h ASP 20 Ca 0.01 0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1v8p h ASP 20 Cb 0.01 0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1v8p h ASP 20 CO -0.03 -0.05 0.00 0.11 -1.72 0.00 0.00 179.24 177.55 1v8p h LYS 21 N 0.36 0.00 0.00 3.56 1.57 -0.48 -3.36 116.57 118.22 1v8p h LYS 21 Ca 0.58 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.36 1v8p h LYS 21 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 1v8p h LYS 21 CO -0.56 0.00 -0.39 -2.67 -0.57 0.00 0.00 179.45 175.26 1v8p n TRP 22 N -2.75 0.00 -0.34 -1.35 4.27 -0.41 -4.84 117.44 112.02 1v8p n TRP 22 Ca -0.01 0.00 0.19 0.00 -3.89 0.00 0.00 57.50 53.79 1v8p n TRP 22 Cb 0.13 0.00 0.41 0.00 -1.36 0.00 0.00 31.31 30.49 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 0.50 0.00 -1.67 3.07 -1.45 1.04 117.51 119.00 1v8p h ILE 23 Ca 0.00 -0.18 0.00 0.00 1.55 0.00 0.00 64.86 66.23 1v8p h ILE 23 Cb 0.00 -0.07 0.00 0.00 -0.27 0.00 0.00 36.82 36.48 1v8p h ILE 23 CO 0.00 0.10 0.00 0.07 -1.05 0.00 0.00 178.15 177.27 1v8p h LYS 24 N 0.53 0.00 -0.38 0.16 2.10 -1.86 -0.31 116.57 116.80 1v8p h LYS 24 Ca 0.65 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.30 1v8p h LYS 24 Cb 1.33 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.66 1v8p h LYS 24 CO -0.47 0.00 0.00 0.72 -2.00 0.00 0.00 179.45 177.70 1v8p n HIS 25 N -2.64 0.50 0.18 0.07 8.25 0.36 -4.68 115.22 117.26 1v8p n HIS 25 Ca -0.01 -0.33 0.15 0.00 -0.26 0.00 0.00 57.72 57.27 1v8p n HIS 25 Cb 0.12 -0.01 0.52 0.00 1.12 0.00 0.00 29.99 31.74 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 3.41 0.00 0.00 -0.41 0.11 -0.55 -0.32 114.38 116.62 1v8p h ARG 26 Ca 0.00 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.05 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 0.00 -0.15 0.93 0.10 0.00 0.00 179.97 180.85 1v8p h GLU 27 N 0.00 0.00 -0.01 0.08 4.39 -1.83 -2.69 114.58 114.52 1v8p h GLU 27 Ca 0.13 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.83 1v8p h GLU 27 Cb 1.51 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.16 1v8p h GLU 27 CO -0.00 0.15 -0.18 1.63 -1.16 0.00 0.00 179.01 179.45 1v8p n LYS 28 N -3.34 1.10 -4.13 2.33 5.02 -0.13 -3.80 118.16 115.21 1v8p n LYS 28 Ca -0.00 -0.65 -0.33 0.00 -2.02 0.00 0.00 58.31 55.31 1v8p n LYS 28 Cb 0.36 -1.49 -0.07 0.00 -0.02 0.00 0.00 35.03 33.82 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 -2.35 3.86 0.20 -0.35 2.01 -1.02 -0.33 118.68 120.71 1v8p s LEU 29 Ca 0.28 0.15 -0.10 0.00 0.01 0.00 0.00 54.13 54.47 1v8p s LEU 29 Cb 0.20 -2.21 -0.01 0.00 0.01 0.00 0.00 46.19 44.18 1v8p s LEU 29 CO 0.46 0.29 0.36 0.00 1.01 0.00 0.00 176.35 178.47 1v8p s ALA 30 N -1.15 -0.02 0.29 4.21 0.00 -0.18 -2.48 121.76 122.42 1v8p s ALA 30 Ca 0.21 -0.93 0.05 0.00 0.00 0.00 0.00 51.96 51.30 1v8p s ALA 30 Cb -0.12 1.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.98 1v8p s ALA 30 CO 0.12 -0.73 0.28 0.44 0.00 0.00 0.00 175.76 175.87 1v8p n ILE 31 N -0.29 0.00 -4.04 0.00 -5.35 0.46 0.12 119.36 110.26 1v8p n ILE 31 Ca -0.04 -2.00 -0.23 0.00 -0.27 0.00 0.00 62.75 60.20 1v8p n ILE 31 Cb 0.63 1.03 -0.06 0.00 -1.74 0.00 0.00 39.64 39.50 1v8p n ILE 31 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1v8p s LEU 32 N 0.00 3.26 0.37 7.28 1.43 -1.26 -1.00 118.68 128.76 1v8p s LEU 32 Ca 0.33 -0.81 0.05 0.00 -1.03 0.00 0.00 54.13 52.66 1v8p s LEU 32 Cb 0.01 -1.73 0.73 0.00 0.03 0.00 0.00 46.19 45.23 1v8p s LEU 32 CO 0.23 -0.38 2.02 0.45 0.23 0.00 0.00 176.35 178.90 1v8p h HIS 33 N 1.46 0.70 -0.82 0.29 3.86 -1.92 -2.66 115.15 116.06 1v8p h HIS 33 Ca -0.43 0.02 0.13 0.00 -1.16 0.00 0.00 60.37 58.92 1v8p h HIS 33 Cb 1.25 -0.24 -0.09 0.00 1.06 0.00 0.00 27.41 29.40 1v8p h HIS 33 CO 0.61 0.43 0.42 1.25 0.86 0.00 0.00 177.93 181.50 1v8p h LEU 34 N 0.74 0.52 -0.88 2.43 6.46 -1.96 -2.86 115.31 119.76 1v8p h LEU 34 Ca 0.22 0.08 0.16 0.00 -0.12 0.00 0.00 57.88 58.22 1v8p h LEU 34 Cb -0.01 -0.00 -0.10 0.00 -0.73 0.00 0.00 40.66 39.82 1v8p h LEU 34 CO -0.05 0.24 0.47 0.74 -0.62 0.00 0.00 178.44 179.22 1v8p h THR 35 N 0.63 0.72 -0.24 1.05 2.02 -1.85 -1.57 112.91 113.68 1v8p h THR 35 Ca 0.43 -0.22 0.06 0.00 0.77 0.00 0.00 66.41 67.45 1v8p h THR 35 Cb 0.57 0.01 -0.07 0.00 -1.74 0.00 0.00 68.15 66.93 1v8p h THR 35 CO -0.34 0.12 -0.20 0.40 0.37 0.00 0.00 175.52 175.87 1v8p h ILE 36 N 0.65 0.47 -0.41 3.11 2.04 -1.66 0.23 117.51 121.94 1v8p h ILE 36 Ca 0.49 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.31 1v8p h ILE 36 Cb 0.71 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 1v8p h ILE 36 CO -0.37 0.00 0.10 1.88 0.00 0.00 0.00 178.15 179.76 1v8p h TYR 37 N -0.20 0.69 -0.61 1.37 -1.99 -1.44 -1.04 116.97 113.74 1v8p h TYR 37 Ca 0.14 -0.08 -0.05 0.00 2.00 0.00 0.00 58.73 60.74 1v8p h TYR 37 Cb 0.41 -0.19 -0.03 0.00 2.00 0.00 0.00 36.73 38.92 1v8p h TYR 37 CO -0.36 0.65 0.18 0.93 -0.00 0.00 0.00 178.16 179.57 1v8p h GLU 38 N 0.52 0.93 -0.42 4.88 5.08 -0.93 0.34 114.58 124.98 1v8p h GLU 38 Ca 0.13 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.21 1v8p h GLU 38 Cb 0.31 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1v8p h GLU 38 CO 0.00 0.80 -0.11 0.00 -1.00 0.00 0.00 179.01 178.70 1v8p h ALA 39 N 1.30 0.58 -0.13 3.43 0.00 -0.42 -1.87 119.26 122.15 1v8p h ALA 39 Ca 0.20 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1v8p h ALA 39 Cb 0.27 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1v8p h ALA 39 CO -0.01 0.47 0.08 0.78 0.00 0.00 0.00 179.25 180.57 1v8p h GLY 40 N 0.64 0.19 1.64 0.00 0.00 -0.45 -0.81 103.07 104.27 1v8p h GLY 40 Ca 0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 1v8p h GLY 40 CO 0.04 0.08 0.17 -0.57 0.00 0.00 0.00 176.54 176.27 1v8p h ASN 41 N 0.13 0.43 -0.31 0.19 -0.73 -0.25 0.17 115.58 115.21 1v8p h ASN 41 Ca 0.05 -0.03 -0.16 0.00 1.87 0.00 0.00 56.30 58.02 1v8p h ASN 41 Cb 0.04 -0.11 -0.00 0.00 0.27 0.00 0.00 38.32 38.52 1v8p h ASN 41 CO -0.01 0.36 -0.45 0.00 -0.37 0.00 0.00 177.43 176.97 1v8p h ALA 42 N 1.71 0.47 -0.40 1.57 0.00 -1.01 -1.34 119.26 120.25 1v8p h ALA 42 Ca 0.13 -0.48 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 1v8p h ALA 42 Cb 0.04 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1v8p h ALA 42 CO -0.02 0.61 -0.11 1.25 0.00 0.00 0.00 179.25 180.98 1v8p h LEU 43 N 0.63 0.70 -0.29 0.00 6.46 -0.35 -2.86 115.31 119.60 1v8p h LEU 43 Ca 0.03 -0.20 0.01 0.00 -0.12 0.00 0.00 57.88 57.59 1v8p h LEU 43 Cb 1.05 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.77 1v8p h LEU 43 CO 0.10 0.84 0.18 -0.25 -0.62 0.00 0.00 178.44 178.70 1v8p h TRP 44 N 0.65 0.35 -0.30 1.25 7.01 -0.48 -1.99 115.95 122.44 1v8p h TRP 44 Ca 0.11 0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.13 1v8p h TRP 44 Cb 0.57 -0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.50 1v8p h TRP 44 CO 0.03 0.21 0.20 0.87 -2.79 0.00 0.00 178.44 176.96 1v8p h LYS 45 N 0.38 0.38 -0.24 2.65 1.57 -1.05 -1.26 116.57 118.99 1v8p h LYS 45 Ca 0.11 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.80 1v8p h LYS 45 Cb -0.03 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1v8p h LYS 45 CO -0.04 0.25 -0.12 0.93 -0.57 0.00 0.00 179.45 179.91 1v8p h GLU 46 N 0.39 0.51 0.00 3.15 5.08 -1.19 -2.33 114.58 120.19 1v8p h GLU 46 Ca 0.11 -0.22 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 1v8p h GLU 46 Cb -0.03 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1v8p h GLU 46 CO -0.02 0.77 -0.17 0.00 -1.00 0.00 0.00 179.01 178.59 1v8p h ALA 47 N 0.72 1.47 -0.07 3.43 0.00 -0.79 -0.93 119.26 123.10 1v8p h ALA 47 Ca 0.05 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 1v8p h ALA 47 Cb 0.62 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1v8p h ALA 47 CO 0.04 0.21 -0.60 0.00 0.00 0.00 0.00 179.25 178.90 1v8p h ARG 48 N 0.00 0.24 -0.64 0.00 2.47 -1.03 -3.09 114.38 112.33 1v8p h ARG 48 Ca -0.00 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 58.56 1v8p h ARG 48 Cb 0.36 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.70 1v8p h ARG 48 CO 0.02 0.77 0.00 1.28 0.56 0.00 0.00 179.97 182.60 1v8p n LEU 49 N -3.87 4.47 0.00 3.04 4.77 -0.70 -4.92 117.00 119.79 1v8p n LEU 49 Ca -0.02 -2.26 0.00 0.00 -0.03 0.00 0.00 56.01 53.70 1v8p n LEU 49 Cb 0.61 -0.57 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1v8p n LEU 49 CO 0.44 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.79 1v8p n GLY 50 N 0.91 0.90 3.66 -0.72 0.00 -1.04 -5.05 105.19 103.84 1v8p n GLY 50 Ca 0.23 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.75 2.10 -0.02 1.61 0.63 -0.44 -4.87 116.66 114.93 1v8p n ARG 51 Ca 0.00 0.75 -0.13 0.00 -0.92 0.00 0.00 57.85 57.55 1v8p n ARG 51 Cb 0.00 -2.69 -0.10 0.00 0.45 0.00 0.00 32.46 30.12 1v8p n ARG 51 CO 0.00 0.00 0.00 -0.39 -2.51 0.00 0.00 177.63 174.73 1v8p h VAL 52 N 5.73 1.44 -0.18 5.15 -1.51 -1.93 -3.30 116.25 121.64 1v8p h VAL 52 Ca -0.46 -1.39 -0.10 0.00 -1.23 0.00 0.00 66.70 63.52 1v8p h VAL 52 Cb 1.27 2.37 -0.06 0.00 -2.13 0.00 0.00 31.29 32.75 1v8p h VAL 52 CO 0.96 0.36 0.13 -0.90 -1.23 0.00 0.00 177.57 176.88 1v8p n ASP 53 N -4.81 3.87 -0.36 4.19 3.85 -1.26 -4.51 116.55 117.53 1v8p n ASP 53 Ca -0.09 -2.39 0.08 0.00 -0.71 0.00 0.00 54.79 51.67 1v8p n ASP 53 Cb 0.30 -0.71 0.25 0.00 -1.35 0.00 0.00 41.12 39.61 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 0.46 1.12 0.35 2.11 5.08 -1.97 0.29 115.95 123.40 1v8p h TRP 54 Ca 0.11 0.03 -0.02 0.00 1.08 0.00 0.00 58.89 60.10 1v8p h TRP 54 Cb 1.24 -0.36 0.00 0.00 -3.00 0.00 0.00 29.16 27.04 1v8p h TRP 54 CO 0.33 0.44 -0.17 0.00 -1.28 0.00 0.00 178.44 177.76 1v8p h ALA 55 N 1.55 -0.47 -0.42 0.11 0.00 -1.91 0.54 119.26 118.65 1v8p h ALA 55 Ca 0.50 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1v8p h ALA 55 Cb 0.52 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1v8p h ALA 55 CO -0.26 -0.72 0.26 0.00 0.00 0.00 0.00 179.25 178.52 1v8p h ALA 56 N 0.07 0.53 -0.70 0.00 0.00 -1.82 -1.41 119.26 115.92 1v8p h ALA 56 Ca -0.05 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1v8p h ALA 56 Cb 0.41 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1v8p h ALA 56 CO 0.08 0.01 0.46 0.00 0.00 0.00 0.00 179.25 179.80 1v8p h ALA 57 N 1.13 1.57 -0.30 0.00 0.00 -0.81 -1.47 119.26 119.38 1v8p h ALA 57 Ca 0.15 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1v8p h ALA 57 Cb -0.03 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1v8p h ALA 57 CO -0.03 0.37 -0.04 0.66 0.00 0.00 0.00 179.25 180.21 1v8p h SER 58 N 0.88 0.45 -0.23 0.00 4.64 0.11 -0.78 113.55 118.62 1v8p h SER 58 Ca 0.27 -0.09 -0.16 0.00 -0.47 0.00 0.00 61.79 61.35 1v8p h SER 58 Cb 0.01 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 1v8p h SER 58 CO -0.07 0.55 -0.47 0.03 -0.87 0.00 0.00 176.83 176.00 1v8p h ARG 59 N 0.45 0.73 -0.56 4.77 3.08 -0.58 -2.76 114.38 119.51 1v8p h ARG 59 Ca 0.09 -0.47 -0.08 0.00 0.07 0.00 0.00 59.98 59.60 1v8p h ARG 59 Cb 0.36 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 1v8p h ARG 59 CO 0.02 1.09 0.05 1.25 -1.07 0.00 0.00 179.97 181.31 1v8p h HIS 60 N 0.45 0.98 -0.59 3.04 2.76 -0.98 -1.70 115.15 119.11 1v8p h HIS 60 Ca 0.01 -0.13 -0.08 0.00 -2.20 0.00 0.00 60.37 57.96 1v8p h HIS 60 Cb 1.07 -0.27 -0.02 0.00 1.55 0.00 0.00 27.41 29.74 1v8p h HIS 60 CO 0.08 0.86 0.04 1.25 -1.30 0.00 0.00 177.93 178.87 1v8p h LEU 61 N 0.86 0.96 -0.67 0.26 6.46 -1.17 -0.59 115.31 121.42 1v8p h LEU 61 Ca 0.17 -0.24 0.00 0.00 -0.12 0.00 0.00 57.88 57.69 1v8p h LEU 61 Cb 0.44 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 40.09 1v8p h LEU 61 CO 0.02 0.99 0.42 0.50 -0.62 0.00 0.00 178.44 179.75 1v8p h LYS 62 N 0.92 0.89 -0.52 1.25 3.64 -1.15 0.10 116.57 121.71 1v8p h LYS 62 Ca 0.18 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.41 1v8p h LYS 62 Cb 0.48 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 1v8p h LYS 62 CO 0.02 0.62 0.03 -0.22 -2.27 0.00 0.00 179.45 177.63 1v8p h LYS 63 N 0.91 0.89 -0.22 1.90 3.64 -0.86 -1.67 116.57 121.16 1v8p h LYS 63 Ca 0.24 -0.27 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1v8p h LYS 63 Cb -0.06 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1v8p h LYS 63 CO -0.05 0.90 0.10 0.28 -2.27 0.00 0.00 179.45 178.41 1v8p h VAL 64 N 0.76 1.15 0.00 2.00 2.07 -0.66 -2.77 116.25 118.80 1v8p h VAL 64 Ca 0.15 -0.43 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 1v8p h VAL 64 Cb 0.48 1.02 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 1v8p h VAL 64 CO 0.02 0.15 -0.13 -0.07 0.02 0.00 0.00 177.57 177.55 1v8p h LEU 65 N 0.23 0.00 -0.77 2.57 3.38 -0.91 -2.31 115.31 117.50 1v8p h LEU 65 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1v8p h LEU 65 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1v8p h LEU 65 CO -0.01 0.13 0.00 0.77 0.09 0.00 0.00 178.44 179.42 1v8p h SER 66 N 0.00 0.00 1.31 -0.43 4.64 -1.01 -3.03 113.55 115.03 1v8p h SER 66 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1v8p h SER 66 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1v8p h SER 66 CO 0.02 0.00 0.00 0.28 -0.87 0.00 0.00 176.83 176.26 1v8p h SER 67 N 0.00 0.00 -3.17 4.97 0.02 -1.34 -3.46 113.55 110.57 1v8p h SER 67 Ca 0.00 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.37 1v8p h SER 67 Cb 0.66 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.16 1v8p h SER 67 CO 0.00 0.00 -0.30 -0.36 -1.14 0.00 0.00 176.83 175.03 1v8p s PHE 68 N -3.52 3.47 0.36 3.45 0.40 -1.15 -4.87 117.98 116.13 1v8p s PHE 68 Ca 0.03 0.57 -0.25 0.00 -0.60 0.00 0.00 56.93 56.68 1v8p s PHE 68 Cb 0.08 -2.02 -0.10 0.00 0.51 0.00 0.00 43.02 41.49 1v8p s PHE 68 CO 0.58 0.43 0.98 0.21 0.70 0.00 0.00 175.22 178.12 1v8p s LYS 69 N -2.65 4.40 -0.21 0.44 2.47 -1.03 -4.87 119.74 118.29 1v8p s LYS 69 Ca 0.41 1.36 -0.03 0.00 -1.56 0.00 0.00 55.97 56.15 1v8p s LYS 69 Cb -0.12 -2.63 -0.01 0.00 -1.46 0.00 0.00 37.83 33.61 1v8p s LYS 69 CO 0.24 0.10 -0.06 0.08 0.16 0.00 0.00 175.35 175.87 1v8p s VAL 70 N -1.71 3.22 0.62 4.02 1.01 -1.26 -0.40 120.40 125.90 1v8p s VAL 70 Ca 0.54 -0.55 -0.09 0.00 0.00 0.00 0.00 61.98 61.88 1v8p s VAL 70 Cb -0.18 -2.45 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 1v8p s VAL 70 CO 0.23 0.44 0.99 -0.76 0.00 0.00 0.00 175.10 176.00 1v8p s LEU 71 N 1.39 3.20 0.77 3.92 1.43 -0.17 -4.95 118.68 124.26 1v8p s LEU 71 Ca 0.05 1.13 -0.12 0.00 -1.03 0.00 0.00 54.13 54.15 1v8p s LEU 71 Cb -0.14 -4.04 0.06 0.00 0.03 0.00 0.00 46.19 42.09 1v8p s LEU 71 CO -0.04 -1.00 1.12 -1.61 0.23 0.00 0.00 176.35 175.06 1v8p s GLU 72 N -5.13 2.13 0.30 1.70 2.02 -1.26 -4.34 118.70 114.12 1v8p s GLU 72 Ca 0.54 1.38 -0.28 0.00 0.02 0.00 0.00 54.97 56.63 1v8p s GLU 72 Cb -0.11 -1.87 -0.09 0.00 0.10 0.00 0.00 34.13 32.16 1v8p s GLU 72 CO 0.50 -1.77 1.11 -0.51 0.02 0.00 0.00 175.26 174.61 1v8p s ASP 73 N -2.86 7.13 0.71 -0.19 -0.00 -1.26 -4.92 116.67 115.28 1v8p s ASP 73 Ca 0.66 2.28 -0.11 0.00 -0.00 0.00 0.00 52.55 55.37 1v8p s ASP 73 Cb -0.21 -2.62 0.01 0.00 -0.00 0.00 0.00 42.92 40.10 1v8p s ASP 73 CO 0.51 -0.24 1.06 -2.84 -0.00 0.00 0.00 175.17 173.66 1v8p s PRO 74 N -1.64 2.85 0.07 8.23 0.02 -1.26 -4.96 135.00 138.29 1v8p s PRO 74 Ca 0.47 0.88 -0.31 0.00 0.02 0.00 0.00 61.00 62.06 1v8p s PRO 74 Cb -0.31 -1.99 -0.06 0.00 0.02 0.00 0.00 34.50 32.16 1v8p s PRO 74 CO 0.40 -1.14 1.21 -2.14 -0.33 0.00 0.00 177.00 175.00 1v8p s PRO 75 N -5.08 4.43 0.37 5.54 0.02 -1.26 -4.85 135.00 134.16 1v8p s PRO 75 Ca 0.58 1.79 0.14 0.00 0.02 0.00 0.00 61.00 63.53 1v8p s PRO 75 Cb -0.14 -3.34 0.99 0.00 0.02 0.00 0.00 34.50 32.04 1v8p s PRO 75 CO 0.55 -0.26 1.77 1.25 -0.33 0.00 0.00 177.00 179.97 1v8p h LEU 76 N 6.77 0.55 -0.25 -5.54 6.46 -2.00 -2.24 115.31 119.07 1v8p h LEU 76 Ca -0.42 0.09 0.02 0.00 -0.12 0.00 0.00 57.88 57.46 1v8p h LEU 76 Cb 1.21 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 41.11 1v8p h LEU 76 CO 0.81 0.13 -0.18 -0.78 -0.62 0.00 0.00 178.44 177.80 1v8p h ASP 77 N 0.50 -0.65 -0.12 1.25 -0.00 -2.01 -2.22 116.42 113.16 1v8p h ASP 77 Ca 0.59 0.09 -0.01 0.00 -0.00 0.00 0.00 57.03 57.70 1v8p h ASP 77 Cb 1.31 0.28 -0.00 0.00 -0.00 0.00 0.00 39.33 40.92 1v8p h ASP 77 CO -0.34 -0.09 0.02 -0.33 -0.00 0.00 0.00 179.24 178.50 1v8p h GLU 78 N -0.05 0.20 -0.76 0.28 4.39 -1.81 -3.20 114.58 113.63 1v8p h GLU 78 Ca 0.04 -0.05 0.14 0.00 0.34 0.00 0.00 59.36 59.83 1v8p h GLU 78 Cb 0.15 -0.02 -0.10 0.00 -0.10 0.00 0.00 28.75 28.68 1v8p h GLU 78 CO -0.26 0.39 0.30 0.28 -1.16 0.00 0.00 179.01 178.57 1v8p h VAL 79 N -0.02 0.65 -0.70 3.13 2.07 -1.40 -0.17 116.25 119.81 1v8p h VAL 79 Ca 0.04 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.44 1v8p h VAL 79 Cb 0.29 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.18 1v8p h VAL 79 CO 0.00 0.08 0.44 0.25 0.02 0.00 0.00 177.57 178.36 1v8p h LEU 80 N 0.44 0.72 -0.21 2.57 6.46 -1.40 0.55 115.31 124.44 1v8p h LEU 80 Ca 0.42 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 58.21 1v8p h LEU 80 Cb 0.64 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.39 1v8p h LEU 80 CO -0.41 0.49 0.02 -0.09 -0.62 0.00 0.00 178.44 177.83 1v8p h ARG 81 N 0.85 0.09 -0.62 1.25 2.43 -1.07 0.50 114.38 117.81 1v8p h ARG 81 Ca 0.28 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.42 1v8p h ARG 81 Cb 0.03 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 1v8p h ARG 81 CO -0.11 0.06 0.28 0.28 -1.51 0.00 0.00 179.97 178.96 1v8p h VAL 82 N 0.09 1.21 -0.30 0.20 2.07 -0.63 0.21 116.25 119.10 1v8p h VAL 82 Ca 0.10 -0.62 -0.06 0.00 0.82 0.00 0.00 66.70 66.94 1v8p h VAL 82 Cb 0.11 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1v8p h VAL 82 CO -0.15 0.25 -0.04 0.00 0.02 0.00 0.00 177.57 177.66 1v8p h ALA 83 N 1.42 0.41 -0.43 1.67 0.00 -0.20 -1.43 119.26 120.71 1v8p h ALA 83 Ca 0.21 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1v8p h ALA 83 Cb 0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1v8p h ALA 83 CO -0.02 0.21 -0.15 0.28 0.00 0.00 0.00 179.25 179.56 1v8p h VAL 84 N 0.34 1.26 0.00 0.00 2.07 -0.65 -2.16 116.25 117.12 1v8p h VAL 84 Ca 0.08 -1.24 -0.16 0.00 0.82 0.00 0.00 66.70 66.20 1v8p h VAL 84 Cb 0.51 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1v8p h VAL 84 CO 0.02 0.42 -0.76 -0.33 0.02 0.00 0.00 177.57 176.95 1v8p h GLU 85 N 0.72 0.00 -0.26 1.57 5.08 -0.88 -3.34 114.58 117.47 1v8p h GLU 85 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1v8p h GLU 85 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1v8p h GLU 85 CO 0.05 0.76 0.00 0.54 -1.00 0.00 0.00 179.01 179.36 1v8p n ARG 86 N -3.47 2.44 -1.85 2.33 1.74 -0.55 -4.99 116.66 112.31 1v8p n ARG 86 Ca -0.00 -1.84 -0.13 0.00 -0.77 0.00 0.00 57.85 55.11 1v8p n ARG 86 Cb 0.78 -1.23 -0.03 0.00 -1.02 0.00 0.00 32.46 30.96 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 0.44 0.53 3.96 -0.13 0.00 -0.86 -5.02 105.19 104.11 1v8p n GLY 87 Ca 0.10 -0.38 -0.20 0.00 0.00 0.00 0.00 46.02 45.54 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 -3.35 3.95 0.75 0.99 1.43 -0.94 -5.06 118.68 116.45 1v8p s LEU 88 Ca 0.00 -0.21 -0.12 0.00 -1.03 0.00 0.00 54.13 52.78 1v8p s LEU 88 Cb 0.00 -2.67 0.04 0.00 0.03 0.00 0.00 46.19 43.59 1v8p s LEU 88 CO 0.00 -0.36 1.11 0.42 0.23 0.00 0.00 176.35 177.75 1v8p s THR 89 N -2.17 3.16 0.34 5.49 -4.23 -1.26 -4.57 115.64 112.40 1v8p s THR 89 Ca 0.42 0.38 0.04 0.00 -1.18 0.00 0.00 61.69 61.35 1v8p s THR 89 Cb -0.09 -3.31 0.17 0.00 1.34 0.00 0.00 72.50 70.62 1v8p s THR 89 CO 0.30 -0.49 1.89 0.15 -0.54 0.00 0.00 174.62 175.93 1v8p h PHE 90 N -0.83 0.58 0.79 3.99 3.57 -1.94 -0.64 116.94 122.46 1v8p h PHE 90 Ca -0.46 -0.05 -0.04 0.00 3.53 0.00 0.00 57.97 60.96 1v8p h PHE 90 Cb 1.27 -0.17 0.01 0.00 2.79 0.00 0.00 35.95 39.84 1v8p h PHE 90 CO 0.46 0.53 -0.38 1.88 -2.23 0.00 0.00 178.31 178.57 1v8p h TYR 91 N 0.55 -0.98 -0.77 0.41 0.05 -1.98 -2.16 116.97 112.09 1v8p h TYR 91 Ca 0.12 -0.02 0.03 0.00 0.05 0.00 0.00 58.73 58.91 1v8p h TYR 91 Cb 0.27 0.32 -0.05 0.00 1.01 0.00 0.00 36.73 38.29 1v8p h TYR 91 CO 0.01 -0.60 0.49 -0.44 -1.05 0.00 0.00 178.16 176.57 1v8p h ASP 92 N -1.14 0.81 -0.40 3.88 3.45 -1.93 -2.43 116.42 118.67 1v8p h ASP 92 Ca -0.11 -0.00 0.07 0.00 0.43 0.00 0.00 57.03 57.42 1v8p h ASP 92 Cb 0.83 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 39.40 1v8p h ASP 92 CO 0.18 0.56 0.27 0.00 -1.57 0.00 0.00 179.24 178.68 1v8p h ALA 93 N 1.32 2.06 -0.90 3.45 0.00 -1.02 -1.42 119.26 122.74 1v8p h ALA 93 Ca 0.31 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1v8p h ALA 93 Cb 0.01 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1v8p h ALA 93 CO -0.11 -0.14 0.51 0.77 0.00 0.00 0.00 179.25 180.28 1v8p h SER 94 N 0.24 1.11 -0.18 0.00 0.02 -0.87 -0.05 113.55 113.83 1v8p h SER 94 Ca 0.18 -0.09 -0.07 0.00 -0.84 0.00 0.00 61.79 60.96 1v8p h SER 94 Cb 0.39 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 1v8p h SER 94 CO -0.03 0.88 -0.17 1.88 -1.14 0.00 0.00 176.83 178.25 1v8p h TYR 95 N 1.26 0.52 0.06 3.45 -1.99 -1.33 -2.27 116.97 116.67 1v8p h TYR 95 Ca 0.32 -0.15 0.01 0.00 2.00 0.00 0.00 58.73 60.91 1v8p h TYR 95 Cb 0.00 -0.11 -0.02 0.00 2.00 0.00 0.00 36.73 38.61 1v8p h TYR 95 CO 0.01 0.79 -0.11 0.00 -0.00 0.00 0.00 178.16 178.85 1v8p h ALA 96 N 0.64 -0.18 0.01 3.88 0.00 -1.26 -0.81 119.26 121.54 1v8p h ALA 96 Ca 0.03 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1v8p h ALA 96 Cb 0.70 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1v8p h ALA 96 CO 0.04 -0.62 -0.17 -0.92 0.00 0.00 0.00 179.25 177.58 1v8p h TYR 97 N -0.22 -0.43 -0.78 0.00 3.20 -1.02 -1.33 116.97 116.39 1v8p h TYR 97 Ca 0.02 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.85 1v8p h TYR 97 Cb 0.24 0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.66 1v8p h TYR 97 CO -0.14 -0.24 0.30 0.28 -1.64 0.00 0.00 178.16 176.71 1v8p h VAL 98 N -0.28 1.26 0.50 1.81 2.07 -1.34 -1.23 116.25 119.04 1v8p h VAL 98 Ca 0.05 -0.84 -0.02 0.00 0.82 0.00 0.00 66.70 66.70 1v8p h VAL 98 Cb 0.34 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1v8p h VAL 98 CO -0.15 0.34 -0.24 0.00 0.02 0.00 0.00 177.57 177.54 1v8p h ALA 99 N 1.16 -0.67 0.09 1.67 0.00 -0.93 -1.05 119.26 119.54 1v8p h ALA 99 Ca 0.26 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1v8p h ALA 99 Cb 0.24 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1v8p h ALA 99 CO -0.02 -0.80 -0.04 0.93 0.00 0.00 0.00 179.25 179.32 1v8p h GLU 100 N -0.81 -0.12 0.00 0.00 5.08 -1.23 0.29 114.58 117.79 1v8p h GLU 100 Ca -0.07 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1v8p h GLU 100 Cb 0.57 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 1v8p h GLU 100 CO 0.11 0.06 -0.01 0.66 -1.00 0.00 0.00 179.01 178.83 1v8p h SER 101 N -0.28 0.00 -0.49 1.42 4.64 -1.30 -1.81 113.55 115.74 1v8p h SER 101 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1v8p h SER 101 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1v8p h SER 101 CO 0.02 0.01 0.00 -1.20 -0.87 0.00 0.00 176.83 174.79 1v8p n SER 102 N -3.12 3.50 -3.73 4.97 7.64 -0.40 -4.96 113.62 117.52 1v8p n SER 102 Ca -0.01 -1.97 -0.23 0.00 1.01 0.00 0.00 58.87 57.67 1v8p n SER 102 Cb 0.22 -0.32 0.04 0.00 -1.01 0.00 0.00 64.21 63.13 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 1.38 -0.34 3.53 0.23 0.00 -0.61 -4.99 105.19 104.38 1v8p n GLY 103 Ca 0.19 0.14 -0.24 0.00 0.00 0.00 0.00 46.02 46.12 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 -6.81 2.77 -0.29 0.99 1.43 0.92 -5.03 118.68 112.67 1v8p s LEU 104 Ca 0.16 -0.97 -0.19 0.00 -1.03 0.00 0.00 54.13 52.09 1v8p s LEU 104 Cb -0.08 -1.24 -0.02 0.00 0.03 0.00 0.00 46.19 44.89 1v8p s LEU 104 CO 0.81 -0.03 0.58 -0.69 0.23 0.00 0.00 176.35 177.25 1v8p s VAL 105 N -2.49 4.99 -0.50 -1.59 1.01 -0.50 -4.45 120.40 116.87 1v8p s VAL 105 Ca 0.31 0.87 -0.27 0.00 0.00 0.00 0.00 61.98 62.88 1v8p s VAL 105 Cb -0.04 -3.93 0.03 0.00 0.00 0.00 0.00 36.38 32.44 1v8p s VAL 105 CO 0.17 -0.05 1.08 -0.22 0.00 0.00 0.00 175.10 176.08 1v8p s LEU 106 N 2.48 3.73 -0.35 3.92 0.20 -1.26 -1.52 118.68 125.88 1v8p s LEU 106 Ca 0.23 0.22 -0.21 0.00 0.69 0.00 0.00 54.13 55.07 1v8p s LEU 106 Cb -0.15 -3.31 0.00 0.00 -0.43 0.00 0.00 46.19 42.30 1v8p s LEU 106 CO 0.10 -1.25 0.66 -0.69 -0.29 0.00 0.00 176.35 174.88 1v8p s VAL 107 N 4.35 4.88 0.16 1.68 1.01 -0.17 -1.89 120.40 130.41 1v8p s VAL 107 Ca 0.43 0.68 -0.00 0.00 0.00 0.00 0.00 61.98 63.08 1v8p s VAL 107 Cb -0.08 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 1v8p s VAL 107 CO 0.28 -0.30 0.05 0.28 0.00 0.00 0.00 175.10 175.41 1v8p s THR 108 N 2.75 0.28 -0.62 3.92 -1.32 -0.76 -2.21 115.64 117.68 1v8p s THR 108 Ca 0.26 -1.95 0.06 0.00 -1.21 0.00 0.00 61.69 58.85 1v8p s THR 108 Cb -0.14 -2.17 0.00 0.00 -1.51 0.00 0.00 72.50 68.68 1v8p s THR 108 CO 0.15 -0.37 0.53 1.67 -2.21 0.00 0.00 174.62 174.38 1v8p n GLN 109 N -0.19 2.03 -2.63 7.08 -0.06 -1.26 -4.06 117.38 118.29 1v8p n GLN 109 Ca -0.04 -0.53 -0.38 0.00 -2.00 0.00 0.00 57.00 54.04 1v8p n GLN 109 Cb 0.64 -0.99 -0.05 0.00 -4.06 0.00 0.00 30.24 25.78 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 -0.98 7.22 0.09 1.69 -1.08 -1.26 -4.96 116.67 117.38 1v8p s ASP 110 Ca 0.06 2.03 0.11 0.00 -0.52 0.00 0.00 52.55 54.22 1v8p s ASP 110 Cb 0.05 -2.60 -0.17 0.00 -1.46 0.00 0.00 42.92 38.74 1v8p s ASP 110 CO 0.15 -0.16 1.07 0.03 0.52 0.00 0.00 175.17 176.78 1v8p h ARG 111 N 3.34 0.00 -0.13 4.34 -0.00 -2.00 -2.98 114.38 116.96 1v8p h ARG 111 Ca -0.47 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 58.98 1v8p h ARG 111 Cb 1.20 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 31.17 1v8p h ARG 111 CO 0.65 0.71 -0.05 1.49 0.00 0.00 0.00 179.97 182.77 1v8p h GLU 112 N 0.00 0.26 0.03 0.04 4.57 -1.99 -2.83 114.58 114.66 1v8p h GLU 112 Ca -0.11 -0.11 -0.00 0.00 -1.18 0.00 0.00 59.36 57.96 1v8p h GLU 112 Cb 1.77 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 30.36 1v8p h GLU 112 CO 0.10 0.59 -0.01 -0.07 -1.18 0.00 0.00 179.01 178.43 1v8p h LEU 113 N -0.08 -0.03 -1.08 1.64 3.38 -1.96 -0.58 115.31 116.59 1v8p h LEU 113 Ca 0.03 -0.16 0.20 0.00 0.09 0.00 0.00 57.88 58.04 1v8p h LEU 113 Cb 0.51 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.16 1v8p h LEU 113 CO 0.02 0.14 0.61 -0.07 0.09 0.00 0.00 178.44 179.23 1v8p h LEU 114 N -0.21 0.72 -0.01 1.67 3.38 -1.57 0.15 115.31 119.44 1v8p h LEU 114 Ca -0.00 0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 1v8p h LEU 114 Cb 0.19 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1v8p h LEU 114 CO 0.01 0.24 -0.44 0.00 0.09 0.00 0.00 178.44 178.34 1v8p h ALA 115 N 1.65 0.72 -0.27 1.53 0.00 -1.22 -3.32 119.26 118.35 1v8p h ALA 115 Ca 0.58 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1v8p h ALA 115 Cb 0.99 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1v8p h ALA 115 CO -0.36 0.55 0.00 1.63 0.00 0.00 0.00 179.25 181.06 1v8p n LYS 116 N -3.21 2.06 -4.08 0.00 5.02 -0.25 -4.89 118.16 112.81 1v8p n LYS 116 Ca 0.02 -1.91 -0.32 0.00 -2.02 0.00 0.00 58.31 54.08 1v8p n LYS 116 Cb 0.71 -1.36 -0.16 0.00 -0.02 0.00 0.00 35.03 34.20 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 -1.20 1.95 -0.24 -0.18 2.01 0.38 -5.03 115.64 113.32 1v8p s THR 117 Ca 0.27 -1.05 -0.29 0.00 0.31 0.00 0.00 61.69 60.93 1v8p s THR 117 Cb 0.16 -1.87 -0.04 0.00 0.01 0.00 0.00 72.50 70.76 1v8p s THR 117 CO 0.22 0.35 1.92 -0.54 -0.69 0.00 0.00 174.62 175.89 1v8p s LYS 118 N 1.30 3.42 0.00 4.92 1.02 -1.26 -1.94 119.74 127.19 1v8p s LYS 118 Ca 0.01 1.77 0.00 0.00 0.02 0.00 0.00 55.97 57.78 1v8p s LYS 118 Cb -0.15 -4.22 0.00 0.00 -0.52 0.00 0.00 37.83 32.94 1v8p s LYS 118 CO -0.10 -1.76 0.00 0.41 -0.92 0.00 0.00 175.35 172.97 1v8p n GLY 119 N 5.33 0.47 3.75 -3.33 0.00 -1.26 -4.85 105.19 105.30 1v8p n GLY 119 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.00 3.53 0.39 4.61 0.00 -0.82 -4.35 121.76 123.12 1v8p s ALA 120 Ca 0.00 1.21 0.04 0.00 0.00 0.00 0.00 51.96 53.21 1v8p s ALA 120 Cb 0.00 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 1v8p s ALA 120 CO 0.00 -0.61 0.08 0.96 0.00 0.00 0.00 175.76 176.19 1v8p s ILE 121 N -0.49 0.99 0.43 0.00 -4.36 -0.79 -4.91 121.20 112.07 1v8p s ILE 121 Ca 0.53 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 59.00 1v8p s ILE 121 Cb -0.39 -2.54 -0.01 0.00 1.25 0.00 0.00 42.46 40.77 1v8p s ILE 121 CO 0.45 0.00 0.39 1.51 0.24 0.00 0.00 174.94 177.53 1v8p s ASP 122 N -3.60 5.00 0.21 4.36 1.47 -1.26 -1.83 116.67 121.03 1v8p s ASP 122 Ca 0.27 -0.80 -0.10 0.00 1.18 0.00 0.00 52.55 53.10 1v8p s ASP 122 Cb 0.05 -0.47 0.30 0.00 -0.34 0.00 0.00 42.92 42.46 1v8p s ASP 122 CO 0.13 -0.71 1.68 0.58 0.68 0.00 0.00 175.17 177.53 1v8p h VAL 123 N 0.99 0.54 -0.06 2.11 2.07 -1.93 -0.12 116.25 119.85 1v8p h VAL 123 Ca -0.41 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.08 1v8p h VAL 123 Cb 1.27 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 1v8p h VAL 123 CO 0.57 0.03 -0.10 -0.08 0.02 0.00 0.00 177.57 178.01 1v8p h GLU 124 N 0.16 -0.14 -0.66 1.57 4.81 -1.95 0.36 114.58 118.72 1v8p h GLU 124 Ca 0.32 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.63 1v8p h GLU 124 Cb 0.51 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.86 1v8p h GLU 124 CO -0.49 -0.10 0.35 1.15 -0.73 0.00 0.00 179.01 179.20 1v8p h THR 125 N -0.15 0.93 -0.92 0.32 2.02 -1.76 -0.41 112.91 112.96 1v8p h THR 125 Ca 0.06 -0.22 0.05 0.00 0.77 0.00 0.00 66.41 67.07 1v8p h THR 125 Cb 0.23 0.24 -0.06 0.00 -1.74 0.00 0.00 68.15 66.82 1v8p h THR 125 CO -0.14 0.12 0.59 0.25 0.37 0.00 0.00 175.52 176.70 1v8p h LEU 126 N 0.64 0.95 -0.16 2.58 5.85 -0.25 -2.19 115.31 122.74 1v8p h LEU 126 Ca 0.30 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.02 1v8p h LEU 126 Cb 0.23 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1v8p h LEU 126 CO -0.20 0.63 0.08 -0.07 -0.34 0.00 0.00 178.44 178.54 1v8p h LEU 127 N 1.10 0.21 -0.54 2.25 3.38 0.72 -0.91 115.31 121.52 1v8p h LEU 127 Ca 0.38 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.27 1v8p h LEU 127 Cb 0.09 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1v8p h LEU 127 CO -0.15 0.25 0.34 -0.37 0.09 0.00 0.00 178.44 178.60 1v8p h VAL 128 N 0.15 1.09 -0.97 1.22 -1.51 -1.11 0.55 116.25 115.67 1v8p h VAL 128 Ca 0.06 -0.23 0.03 0.00 -1.23 0.00 0.00 66.70 65.33 1v8p h VAL 128 Cb 0.09 0.35 -0.05 0.00 -2.13 0.00 0.00 31.29 29.55 1v8p h VAL 128 CO -0.01 0.12 0.64 0.03 -1.23 0.00 0.00 177.57 177.12 1v8p h ARG 129 N 0.67 1.21 -0.16 5.19 3.08 -1.17 -1.75 114.38 121.45 1v8p h ARG 129 Ca 0.21 -0.07 -0.20 0.00 0.07 0.00 0.00 59.98 59.99 1v8p h ARG 129 Cb -0.01 -0.27 0.01 0.00 0.08 0.00 0.00 29.97 29.77 1v8p h ARG 129 CO -0.08 0.80 -0.69 -0.07 -1.07 0.00 0.00 179.97 178.86 1v8p h LEU 130 N 1.24 0.88 -2.10 3.04 3.38 -0.48 -3.10 115.31 118.17 1v8p h LEU 130 Ca 0.38 -0.62 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 1v8p h LEU 130 Cb -0.03 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 1v8p h LEU 130 CO -0.11 1.35 -0.07 0.00 0.09 0.00 0.00 178.44 179.71 1v8p h ALA 131 N 0.54 1.20 -0.23 1.53 0.00 -0.59 -2.44 119.26 119.28 1v8p h ALA 131 Ca -0.04 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1v8p h ALA 131 Cb 1.32 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 19.03 1v8p h ALA 131 CO 0.14 0.09 0.16 0.00 0.00 0.00 0.00 179.25 179.64 1v8p n ALA 132 N -2.22 3.27 -1.22 0.00 0.00 -0.69 -5.09 120.51 114.57 1v8p n ALA 132 Ca -0.02 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 52.74 1v8p n ALA 132 Cb 0.20 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.55 1v8p n ALA 132 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54