#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v8p s VAL 3 N 0.00 3.86 0.00 0.00 1.01 -1.24 -4.12 120.40 119.90 1v8p s VAL 3 Ca 0.00 1.57 0.00 0.00 0.00 0.00 0.00 61.98 63.55 1v8p s VAL 3 Cb 0.00 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.38 1v8p s VAL 3 CO 0.00 0.26 0.00 -0.62 0.00 0.00 0.00 175.10 174.74 1v8p n GLU 4 N 2.51 3.33 -5.26 2.72 1.02 -0.21 -5.00 120.64 119.75 1v8p n GLU 4 Ca 0.03 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.87 1v8p n GLU 4 Cb 0.46 -0.95 -0.16 0.00 -0.02 0.00 0.00 31.44 30.77 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 -1.89 2.30 -0.29 -0.32 1.51 0.98 -0.66 117.35 118.97 1v8p s TYR 5 Ca 0.00 -0.51 -0.06 0.00 -1.01 0.00 0.00 57.07 55.49 1v8p s TYR 5 Cb 0.00 -1.49 0.01 0.00 -0.11 0.00 0.00 41.96 40.37 1v8p s TYR 5 CO 0.00 -0.09 0.06 -1.17 -1.11 0.00 0.00 175.55 173.24 1v8p s LEU 6 N -0.46 3.75 -0.18 -1.29 2.96 -0.73 -0.39 118.68 122.35 1v8p s LEU 6 Ca 0.06 -0.71 -0.10 0.00 -0.22 0.00 0.00 54.13 53.16 1v8p s LEU 6 Cb -0.11 -1.86 -0.05 0.00 0.50 0.00 0.00 46.19 44.68 1v8p s LEU 6 CO 0.00 -0.18 0.16 -0.69 -1.32 0.00 0.00 176.35 174.33 1v8p s VAL 7 N 1.48 5.40 0.48 1.68 1.01 0.32 -0.31 120.40 130.46 1v8p s VAL 7 Ca 0.02 0.26 0.02 0.00 0.00 0.00 0.00 61.98 62.29 1v8p s VAL 7 Cb -0.17 -3.50 0.09 0.00 0.00 0.00 0.00 36.38 32.80 1v8p s VAL 7 CO 0.02 0.45 0.66 -0.90 0.00 0.00 0.00 175.10 175.32 1v8p n ASP 8 N 3.39 1.10 -0.17 3.32 5.68 -0.98 -4.44 116.55 124.46 1v8p n ASP 8 Ca -0.16 -1.88 -0.06 0.00 -0.50 0.00 0.00 54.79 52.20 1v8p n ASP 8 Cb 0.52 -0.40 0.12 0.00 -1.14 0.00 0.00 41.12 40.21 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 -0.32 1.04 -0.52 2.12 0.00 -1.91 0.74 119.26 120.42 1v8p h ALA 9 Ca -0.22 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.34 1v8p h ALA 9 Cb 0.86 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1v8p h ALA 9 CO 0.25 0.61 -0.05 0.66 0.00 0.00 0.00 179.25 180.73 1v8p h SER 10 N 0.89 0.94 -0.24 0.00 4.64 -1.95 -1.22 113.55 116.60 1v8p h SER 10 Ca 0.18 -0.33 -0.09 0.00 -0.47 0.00 0.00 61.79 61.08 1v8p h SER 10 Cb 0.41 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1v8p h SER 10 CO 0.01 1.04 -0.20 0.00 -0.87 0.00 0.00 176.83 176.82 1v8p h ALA 11 N 0.93 0.35 -0.65 5.18 0.00 -1.80 -2.53 119.26 120.74 1v8p h ALA 11 Ca 0.14 -0.35 0.06 0.00 0.00 0.00 0.00 54.91 54.75 1v8p h ALA 11 Cb 0.59 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 1v8p h ALA 11 CO 0.04 0.29 0.36 1.25 0.00 0.00 0.00 179.25 181.18 1v8p h LEU 12 N 0.27 0.54 -0.48 0.00 7.12 -0.77 0.45 115.31 122.44 1v8p h LEU 12 Ca 0.04 0.03 0.02 0.00 0.13 0.00 0.00 57.88 58.10 1v8p h LEU 12 Cb 0.74 -0.08 -0.03 0.00 -0.53 0.00 0.00 40.66 40.76 1v8p h LEU 12 CO 0.05 0.35 0.29 0.22 -0.13 0.00 0.00 178.44 179.22 1v8p h TYR 13 N 0.67 0.55 0.17 1.25 3.20 -1.14 -2.34 116.97 119.33 1v8p h TYR 13 Ca 0.29 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.17 1v8p h TYR 13 Cb 0.18 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.26 1v8p h TYR 13 CO -0.08 0.32 -0.10 0.00 -1.64 0.00 0.00 178.16 176.66 1v8p h ALA 14 N 1.21 -0.25 0.00 1.82 0.00 -0.76 -2.84 119.26 118.44 1v8p h ALA 14 Ca 0.19 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1v8p h ALA 14 Cb 0.00 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1v8p h ALA 14 CO -0.08 -0.65 -0.01 -0.07 0.00 0.00 0.00 179.25 178.44 1v8p h LEU 15 N -0.27 0.00 -1.70 0.00 3.38 -0.79 -2.80 115.31 113.13 1v8p h LEU 15 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1v8p h LEU 15 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1v8p h LEU 15 CO 0.02 0.01 0.13 0.00 0.09 0.00 0.00 178.44 178.69 1v8p h ALA 16 N 1.99 1.11 -0.32 1.53 0.00 -1.16 0.18 119.26 122.59 1v8p h ALA 16 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1v8p h ALA 16 Cb 0.08 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 1v8p h ALA 16 CO 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.14 1v8p n ALA 17 N -1.80 3.53 -1.57 0.00 0.00 -1.06 -4.34 120.51 115.27 1v8p n ALA 17 Ca -0.02 -2.62 0.00 0.00 0.00 0.00 0.00 53.44 50.80 1v8p n ALA 17 Cb 0.17 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 18.87 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 -0.76 0.00 -0.00 0.00 -0.00 0.61 -4.98 115.22 110.09 1v8p n HIS 18 Ca 0.27 0.00 -0.00 0.00 -0.00 0.00 0.00 57.72 57.99 1v8p n HIS 18 Cb 0.97 -0.01 -0.00 0.00 -0.00 0.00 0.00 29.99 30.95 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 0.00 -0.00 -0.10 4.41 9.36 -1.09 0.14 117.16 129.88 1v8p n TYR 19 Ca 0.00 0.00 0.27 0.00 3.32 0.00 0.00 57.90 61.49 1v8p n TYR 19 Cb 0.60 -0.18 0.68 0.00 -0.63 0.00 0.00 39.34 39.80 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 0.00 -0.07 2.98 3.32 -1.93 0.77 116.42 121.49 1v8p h ASP 20 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1v8p h ASP 20 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1v8p h ASP 20 CO -0.00 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.81 1v8p n LYS 21 N -3.72 1.36 0.00 3.56 5.02 0.38 -4.48 118.16 120.28 1v8p n LYS 21 Ca 0.16 -0.53 0.00 0.00 -2.02 0.00 0.00 58.31 55.92 1v8p n LYS 21 Cb 1.02 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 34.66 1v8p n LYS 21 CO 0.00 0.00 0.00 -2.67 -0.52 0.00 0.00 177.40 174.21 1v8p n TRP 22 N -0.27 0.00 -0.17 2.13 4.27 0.21 -4.86 117.44 118.75 1v8p n TRP 22 Ca 0.16 0.00 0.16 0.00 -3.89 0.00 0.00 57.50 53.94 1v8p n TRP 22 Cb 0.20 0.00 0.52 0.00 -1.36 0.00 0.00 31.31 30.67 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 0.77 0.00 -1.67 3.07 -1.64 0.48 117.51 118.52 1v8p h ILE 23 Ca 0.00 -0.13 0.00 0.00 1.55 0.00 0.00 64.86 66.28 1v8p h ILE 23 Cb 0.00 0.35 0.00 0.00 -0.27 0.00 0.00 36.82 36.90 1v8p h ILE 23 CO 0.00 0.07 0.00 2.29 -1.05 0.00 0.00 178.15 179.46 1v8p n LYS 24 N -4.47 0.07 -0.02 0.16 2.85 -1.26 -0.95 118.16 114.54 1v8p n LYS 24 Ca 0.15 0.25 0.02 0.00 -1.05 0.00 0.00 58.31 57.69 1v8p n LYS 24 Cb 0.57 -1.50 0.03 0.00 -0.65 0.00 0.00 35.03 33.48 1v8p n LYS 24 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1v8p n HIS 25 N -1.40 0.00 -0.32 5.58 8.25 0.16 -4.77 115.22 122.72 1v8p n HIS 25 Ca 0.04 -0.60 0.25 0.00 -0.26 0.00 0.00 57.72 57.15 1v8p n HIS 25 Cb 0.11 -0.07 0.55 0.00 1.12 0.00 0.00 29.99 31.69 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 0.00 0.32 0.00 -0.41 0.11 -0.43 -0.02 114.38 113.95 1v8p h ARG 26 Ca 0.00 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.06 1v8p h ARG 26 Cb 0.63 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.64 1v8p h ARG 26 CO 0.00 0.21 0.04 0.93 0.10 0.00 0.00 179.97 181.25 1v8p h GLU 27 N 0.33 0.00 -0.02 0.08 4.39 -1.86 -1.38 114.58 116.12 1v8p h GLU 27 Ca 0.60 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.30 1v8p h GLU 27 Cb 1.64 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.29 1v8p h GLU 27 CO -0.26 0.00 -0.39 1.63 -1.16 0.00 0.00 179.01 178.82 1v8p n LYS 28 N -3.00 1.31 -4.39 2.33 5.02 -0.02 -3.65 118.16 115.75 1v8p n LYS 28 Ca -0.03 -1.05 -0.34 0.00 -2.02 0.00 0.00 58.31 54.87 1v8p n LYS 28 Cb 0.10 -1.48 -0.11 0.00 -0.02 0.00 0.00 35.03 33.52 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 -2.42 3.36 0.08 -0.35 1.02 -0.52 -0.01 118.68 119.84 1v8p s LEU 29 Ca 0.21 -0.04 0.00 0.00 0.02 0.00 0.00 54.13 54.32 1v8p s LEU 29 Cb 0.18 -1.79 -0.04 0.00 0.02 0.00 0.00 46.19 44.56 1v8p s LEU 29 CO 0.53 0.24 -0.04 0.00 0.02 0.00 0.00 176.35 177.09 1v8p s ALA 30 N -0.04 0.78 0.43 4.21 0.00 0.48 -1.78 121.76 125.84 1v8p s ALA 30 Ca 0.02 -1.30 0.04 0.00 0.00 0.00 0.00 51.96 50.72 1v8p s ALA 30 Cb -0.13 0.24 -0.02 0.00 0.00 0.00 0.00 23.12 23.22 1v8p s ALA 30 CO 0.02 -0.31 0.15 0.96 0.00 0.00 0.00 175.76 176.59 1v8p s ILE 31 N -3.77 0.49 0.30 0.00 -4.36 0.94 -0.52 121.20 114.27 1v8p s ILE 31 Ca 0.10 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 58.56 1v8p s ILE 31 Cb 0.07 -2.28 -0.02 0.00 1.25 0.00 0.00 42.46 41.47 1v8p s ILE 31 CO -0.07 0.00 0.34 -0.76 0.24 0.00 0.00 174.94 174.70 1v8p s LEU 32 N -3.63 3.91 0.45 0.37 1.43 -1.26 -1.51 118.68 118.44 1v8p s LEU 32 Ca 0.22 -0.23 0.10 0.00 -1.03 0.00 0.00 54.13 53.19 1v8p s LEU 32 Cb 0.01 -2.54 1.01 0.00 0.03 0.00 0.00 46.19 44.70 1v8p s LEU 32 CO 0.15 -0.25 2.09 0.45 0.23 0.00 0.00 176.35 179.02 1v8p h HIS 33 N 1.17 0.31 -0.45 0.29 3.86 -1.93 -2.02 115.15 116.39 1v8p h HIS 33 Ca -0.47 0.01 0.08 0.00 -1.16 0.00 0.00 60.37 58.83 1v8p h HIS 33 Cb 1.25 -0.11 -0.07 0.00 1.06 0.00 0.00 27.41 29.54 1v8p h HIS 33 CO 0.49 0.21 0.01 1.25 0.86 0.00 0.00 177.93 180.75 1v8p h LEU 34 N 0.34 -0.16 -0.95 2.43 6.46 -1.97 -2.72 115.31 118.74 1v8p h LEU 34 Ca 0.09 0.10 0.29 0.00 -0.12 0.00 0.00 57.88 58.24 1v8p h LEU 34 Cb -0.02 0.18 -0.15 0.00 -0.73 0.00 0.00 40.66 39.93 1v8p h LEU 34 CO -0.02 -0.04 0.34 0.74 -0.62 0.00 0.00 178.44 178.84 1v8p h THR 35 N 0.13 0.22 -0.55 1.05 2.02 -1.73 0.73 112.91 114.78 1v8p h THR 35 Ca 0.23 -0.06 0.04 0.00 0.77 0.00 0.00 66.41 67.38 1v8p h THR 35 Cb 0.32 0.02 -0.04 0.00 -1.74 0.00 0.00 68.15 66.72 1v8p h THR 35 CO -0.36 0.03 0.31 0.40 0.37 0.00 0.00 175.52 176.27 1v8p h ILE 36 N 0.18 1.00 -0.19 3.11 2.04 -1.60 -0.50 117.51 121.56 1v8p h ILE 36 Ca 0.65 -0.21 -0.20 0.00 1.00 0.00 0.00 64.86 66.11 1v8p h ILE 36 Cb 1.45 0.35 0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1v8p h ILE 36 CO -0.70 0.11 -0.65 1.88 0.00 0.00 0.00 178.15 178.79 1v8p h TYR 37 N 0.60 1.02 -0.64 1.37 -1.99 -1.02 -1.51 116.97 114.80 1v8p h TYR 37 Ca 0.23 -0.42 -0.03 0.00 2.00 0.00 0.00 58.73 60.52 1v8p h TYR 37 Cb 0.09 -0.17 -0.03 0.00 2.00 0.00 0.00 36.73 38.62 1v8p h TYR 37 CO -0.08 1.24 0.30 0.93 -0.00 0.00 0.00 178.16 180.55 1v8p h GLU 38 N 0.50 0.93 -0.17 4.88 5.08 -1.05 0.26 114.58 125.02 1v8p h GLU 38 Ca -0.03 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.18 1v8p h GLU 38 Cb 1.28 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 1v8p h GLU 38 CO 0.14 0.75 0.08 0.00 -1.00 0.00 0.00 179.01 178.98 1v8p h ALA 39 N 1.13 0.21 -0.70 3.43 0.00 -1.06 -2.23 119.26 120.04 1v8p h ALA 39 Ca 0.22 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.08 1v8p h ALA 39 Cb 0.14 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1v8p h ALA 39 CO -0.03 -0.23 0.44 0.78 0.00 0.00 0.00 179.25 180.22 1v8p h GLY 40 N 0.14 1.01 1.32 0.00 0.00 -0.97 -2.05 103.07 102.53 1v8p h GLY 40 Ca 0.06 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 1v8p h GLY 40 CO -0.01 0.29 0.34 -0.57 0.00 0.00 0.00 176.54 176.59 1v8p h ASN 41 N 0.87 0.79 -0.43 0.19 -0.73 -0.76 -0.63 115.58 114.88 1v8p h ASN 41 Ca 0.28 -0.07 -0.11 0.00 1.87 0.00 0.00 56.30 58.27 1v8p h ASN 41 Cb 0.00 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.38 1v8p h ASN 41 CO -0.10 0.65 -0.16 0.00 -0.37 0.00 0.00 177.43 177.45 1v8p h ALA 42 N 1.48 0.60 -0.13 1.57 0.00 -0.83 -2.20 119.26 119.75 1v8p h ALA 42 Ca 0.23 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 1v8p h ALA 42 Cb 0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1v8p h ALA 42 CO -0.03 0.53 -0.22 1.25 0.00 0.00 0.00 179.25 180.78 1v8p h LEU 43 N 0.70 0.22 -0.69 0.00 6.46 -0.87 -2.20 115.31 118.93 1v8p h LEU 43 Ca 0.10 -0.06 -0.12 0.00 -0.12 0.00 0.00 57.88 57.68 1v8p h LEU 43 Cb 0.71 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.57 1v8p h LEU 43 CO 0.05 0.46 -0.32 -0.25 -0.62 0.00 0.00 178.44 177.76 1v8p h TRP 44 N 0.21 0.77 -0.60 1.25 7.01 -0.87 -1.55 115.95 122.17 1v8p h TRP 44 Ca 0.04 -0.20 -0.08 0.00 2.11 0.00 0.00 58.89 60.75 1v8p h TRP 44 Cb 0.52 -0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 27.38 1v8p h TRP 44 CO 0.01 0.90 0.05 0.87 -2.79 0.00 0.00 178.44 177.47 1v8p h LYS 45 N 0.56 1.02 -0.44 2.65 1.57 -0.79 0.13 116.57 121.27 1v8p h LYS 45 Ca 0.06 -0.29 -0.04 0.00 -1.87 0.00 0.00 60.65 58.52 1v8p h LYS 45 Cb 0.82 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 1v8p h LYS 45 CO 0.07 0.97 0.12 0.93 -0.57 0.00 0.00 179.45 180.97 1v8p h GLU 46 N 0.94 0.69 -0.83 3.15 5.08 -1.25 -1.03 114.58 121.33 1v8p h GLU 46 Ca 0.18 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1v8p h GLU 46 Cb 0.48 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 1v8p h GLU 46 CO 0.02 0.69 0.40 0.00 -1.00 0.00 0.00 179.01 179.11 1v8p h ALA 47 N 0.97 1.13 -0.83 3.43 0.00 -0.91 -1.10 119.26 121.96 1v8p h ALA 47 Ca 0.14 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1v8p h ALA 47 Cb 0.29 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1v8p h ALA 47 CO -0.00 0.66 0.52 0.00 0.00 0.00 0.00 179.25 180.42 1v8p h ARG 48 N 1.19 1.10 -0.58 0.00 2.47 -0.21 -2.62 114.38 115.74 1v8p h ARG 48 Ca 0.29 -0.08 0.00 0.00 -1.26 0.00 0.00 59.98 58.92 1v8p h ARG 48 Cb 0.12 -0.24 0.00 0.00 -1.65 0.00 0.00 29.97 28.20 1v8p h ARG 48 CO -0.04 0.75 0.00 1.28 0.56 0.00 0.00 179.97 182.53 1v8p n LEU 49 N -4.39 2.59 0.00 3.04 4.77 -0.44 -4.92 117.00 117.66 1v8p n LEU 49 Ca 0.09 -1.31 0.00 0.00 -0.03 0.00 0.00 56.01 54.76 1v8p n LEU 49 Cb 0.05 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 1v8p n LEU 49 CO 0.37 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.49 1v8p n GLY 50 N 0.69 2.49 3.63 -0.72 0.00 -0.99 -5.05 105.19 105.25 1v8p n GLY 50 Ca 0.13 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.70 0.97 0.10 1.61 0.63 -0.48 -4.80 116.66 113.99 1v8p n ARG 51 Ca 0.00 0.34 -0.04 0.00 -0.92 0.00 0.00 57.85 57.23 1v8p n ARG 51 Cb 0.00 -2.08 0.14 0.00 0.45 0.00 0.00 32.46 30.97 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 5.68 1.39 -1.57 5.15 -1.51 -1.92 -3.33 116.25 120.14 1v8p h VAL 52 Ca -0.40 -1.99 -0.71 0.00 -1.23 0.00 0.00 66.70 62.37 1v8p h VAL 52 Cb 1.33 2.02 -0.30 0.00 -2.13 0.00 0.00 31.29 32.21 1v8p h VAL 52 CO 0.98 0.58 0.72 -0.90 -1.23 0.00 0.00 177.57 177.73 1v8p n ASP 53 N -3.87 7.17 0.10 4.19 3.85 -1.26 -4.69 116.55 122.03 1v8p n ASP 53 Ca -0.02 -3.81 -0.05 0.00 -0.71 0.00 0.00 54.79 50.20 1v8p n ASP 53 Cb 0.61 -0.94 0.07 0.00 -1.35 0.00 0.00 41.12 39.51 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 2.60 0.19 0.04 2.11 5.08 -1.96 0.06 115.95 124.06 1v8p h TRP 54 Ca 0.54 -0.09 -0.00 0.00 1.08 0.00 0.00 58.89 60.42 1v8p h TRP 54 Cb 0.44 -0.03 0.00 0.00 -3.00 0.00 0.00 29.16 26.58 1v8p h TRP 54 CO 1.21 0.82 -0.02 0.00 -1.28 0.00 0.00 178.44 179.17 1v8p h ALA 55 N 1.16 -0.05 0.48 0.11 0.00 -1.92 0.13 119.26 119.16 1v8p h ALA 55 Ca -0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1v8p h ALA 55 Cb 1.30 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1v8p h ALA 55 CO 0.11 -0.39 -0.23 0.00 0.00 0.00 0.00 179.25 178.74 1v8p h ALA 56 N 0.62 -0.65 -0.96 0.00 0.00 -1.93 -2.50 119.26 113.84 1v8p h ALA 56 Ca -0.01 -0.17 0.29 0.00 0.00 0.00 0.00 54.91 55.03 1v8p h ALA 56 Cb 0.31 0.25 -0.15 0.00 0.00 0.00 0.00 17.79 18.20 1v8p h ALA 56 CO 0.01 -0.81 0.44 0.00 0.00 0.00 0.00 179.25 178.88 1v8p h ALA 57 N -0.28 1.70 -0.20 0.00 0.00 -0.91 0.15 119.26 119.72 1v8p h ALA 57 Ca -0.07 0.21 -0.16 0.00 0.00 0.00 0.00 54.91 54.89 1v8p h ALA 57 Cb 0.55 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1v8p h ALA 57 CO 0.11 -0.54 -0.55 0.66 0.00 0.00 0.00 179.25 178.93 1v8p h SER 58 N 0.27 0.66 -0.66 0.00 4.64 -0.57 -0.72 113.55 117.17 1v8p h SER 58 Ca 0.67 -0.35 -0.01 0.00 -0.47 0.00 0.00 61.79 61.63 1v8p h SER 58 Cb 1.47 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 63.34 1v8p h SER 58 CO -0.64 1.08 0.39 0.03 -0.87 0.00 0.00 176.83 176.82 1v8p h ARG 59 N 0.45 0.93 -0.24 4.77 3.08 -0.29 0.11 114.38 123.19 1v8p h ARG 59 Ca 0.01 -0.09 -0.20 0.00 0.07 0.00 0.00 59.98 59.77 1v8p h ARG 59 Cb 1.10 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.97 1v8p h ARG 59 CO 0.11 0.67 -0.63 1.25 -1.07 0.00 0.00 179.97 180.29 1v8p h HIS 60 N 0.94 1.10 -0.67 3.04 2.76 -1.05 -3.03 115.15 118.23 1v8p h HIS 60 Ca 0.24 -0.43 -0.06 0.00 -2.20 0.00 0.00 60.37 57.93 1v8p h HIS 60 Cb -0.00 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 28.74 1v8p h HIS 60 CO 0.00 1.26 0.18 1.25 -1.30 0.00 0.00 177.93 179.33 1v8p h LEU 61 N 0.63 1.00 -1.24 0.26 6.46 -0.40 -2.47 115.31 119.55 1v8p h LEU 61 Ca -0.01 -0.22 0.06 0.00 -0.12 0.00 0.00 57.88 57.58 1v8p h LEU 61 Cb 1.25 -0.26 -0.05 0.00 -0.73 0.00 0.00 40.66 40.87 1v8p h LEU 61 CO 0.14 0.96 0.54 0.50 -0.62 0.00 0.00 178.44 179.96 1v8p h LYS 62 N 0.99 0.91 -0.12 1.25 3.64 -0.80 -1.27 116.57 121.18 1v8p h LYS 62 Ca 0.21 -0.05 -0.17 0.00 -1.27 0.00 0.00 60.65 59.37 1v8p h LYS 62 Cb 0.34 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1v8p h LYS 62 CO -0.00 0.60 -0.63 -0.22 -2.27 0.00 0.00 179.45 176.93 1v8p h LYS 63 N 0.94 0.43 -0.44 1.90 3.64 -1.35 -2.21 116.57 119.48 1v8p h LYS 63 Ca 0.35 -0.31 -0.14 0.00 -1.27 0.00 0.00 60.65 59.28 1v8p h LYS 63 Cb 0.18 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1v8p h LYS 63 CO -0.12 0.92 -0.28 0.28 -2.27 0.00 0.00 179.45 177.98 1v8p h VAL 64 N 0.32 1.27 -0.33 2.00 2.07 -0.93 -3.19 116.25 117.45 1v8p h VAL 64 Ca -0.01 -1.45 -0.15 0.00 0.82 0.00 0.00 66.70 65.91 1v8p h VAL 64 Cb 1.18 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 32.19 1v8p h VAL 64 CO 0.11 0.49 -0.38 -0.07 0.02 0.00 0.00 177.57 177.74 1v8p h LEU 65 N 0.80 0.90 0.00 2.57 3.38 -1.25 -2.98 115.31 118.73 1v8p h LEU 65 Ca 0.09 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1v8p h LEU 65 Cb 0.87 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1v8p h LEU 65 CO 0.08 1.20 0.00 -1.54 0.09 0.00 0.00 178.44 178.27 1v8p n SER 66 N -4.13 0.00 -0.06 -0.43 3.41 -0.84 -1.33 113.62 110.24 1v8p n SER 66 Ca -0.03 0.26 0.12 0.00 -0.26 0.00 0.00 58.87 58.96 1v8p n SER 66 Cb 0.53 -0.32 0.31 0.00 -0.26 0.00 0.00 64.21 64.47 1v8p n SER 66 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1v8p n SER 67 N -1.32 0.60 -4.80 4.04 7.64 -1.13 -4.93 113.62 113.73 1v8p n SER 67 Ca 0.03 -0.39 -0.28 0.00 1.01 0.00 0.00 58.87 59.23 1v8p n SER 67 Cb 0.05 0.17 -0.06 0.00 -1.01 0.00 0.00 64.21 63.37 1v8p n SER 67 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1v8p s PHE 68 N -2.86 3.20 0.16 1.43 0.40 -0.44 -4.81 117.98 115.06 1v8p s PHE 68 Ca 0.15 0.05 -0.30 0.00 -0.60 0.00 0.00 56.93 56.23 1v8p s PHE 68 Cb 0.18 -1.58 -0.07 0.00 0.51 0.00 0.00 43.02 42.06 1v8p s PHE 68 CO 0.64 0.52 0.99 0.21 0.70 0.00 0.00 175.22 178.28 1v8p s LYS 69 N -2.74 4.71 -0.31 0.44 2.47 -0.73 -4.85 119.74 118.73 1v8p s LYS 69 Ca 0.30 1.52 -0.09 0.00 -1.56 0.00 0.00 55.97 56.15 1v8p s LYS 69 Cb -0.11 -3.33 0.00 0.00 -1.46 0.00 0.00 37.83 32.93 1v8p s LYS 69 CO 0.23 0.26 0.13 0.08 0.16 0.00 0.00 175.35 176.21 1v8p s VAL 70 N -0.33 4.32 1.15 4.02 1.01 -1.26 -0.04 120.40 129.26 1v8p s VAL 70 Ca 0.46 -0.59 -0.19 0.00 0.00 0.00 0.00 61.98 61.66 1v8p s VAL 70 Cb -0.25 -3.24 0.27 0.00 0.00 0.00 0.00 36.38 33.16 1v8p s VAL 70 CO 0.31 0.04 1.16 -0.76 0.00 0.00 0.00 175.10 175.86 1v8p s LEU 71 N 1.56 1.19 0.34 3.92 1.43 -0.57 -4.96 118.68 121.59 1v8p s LEU 71 Ca 0.03 0.52 -0.21 0.00 -1.03 0.00 0.00 54.13 53.44 1v8p s LEU 71 Cb -0.17 -2.32 -0.10 0.00 0.03 0.00 0.00 46.19 43.63 1v8p s LEU 71 CO 0.05 -3.80 0.87 -1.61 0.23 0.00 0.00 176.35 172.09 1v8p s GLU 72 N -5.54 4.30 0.27 1.70 2.02 -1.26 -4.50 118.70 115.69 1v8p s GLU 72 Ca 0.72 1.06 -0.30 0.00 0.02 0.00 0.00 54.97 56.47 1v8p s GLU 72 Cb -0.08 -2.53 -0.10 0.00 0.10 0.00 0.00 34.13 31.52 1v8p s GLU 72 CO 0.55 0.17 1.40 -0.51 0.02 0.00 0.00 175.26 176.89 1v8p s ASP 73 N -1.94 6.68 1.05 -0.19 -0.00 -1.26 -4.95 116.67 116.06 1v8p s ASP 73 Ca 0.54 2.68 -0.15 0.00 -0.00 0.00 0.00 52.55 55.61 1v8p s ASP 73 Cb -0.13 -2.63 0.22 0.00 -0.00 0.00 0.00 42.92 40.37 1v8p s ASP 73 CO 0.18 -0.66 1.14 -2.84 -0.00 0.00 0.00 175.17 172.99 1v8p s PRO 74 N -0.79 -0.00 -0.37 8.23 0.02 -1.26 -4.98 135.00 135.85 1v8p s PRO 74 Ca 0.56 0.11 -0.26 0.00 0.02 0.00 0.00 61.00 61.43 1v8p s PRO 74 Cb -0.41 -1.72 0.02 0.00 0.02 0.00 0.00 34.50 32.40 1v8p s PRO 74 CO 0.46 -2.93 0.94 -2.14 -0.33 0.00 0.00 177.00 173.00 1v8p s PRO 75 N -5.33 3.84 0.33 5.54 0.02 -1.26 -4.89 135.00 133.24 1v8p s PRO 75 Ca 0.68 0.59 0.10 0.00 0.02 0.00 0.00 61.00 62.39 1v8p s PRO 75 Cb -0.12 -3.81 0.98 0.00 0.02 0.00 0.00 34.50 31.57 1v8p s PRO 75 CO 0.55 -0.97 1.62 1.25 -0.33 0.00 0.00 177.00 179.12 1v8p h LEU 76 N 10.12 0.11 -0.44 -5.54 6.46 -2.00 -0.44 115.31 123.58 1v8p h LEU 76 Ca -0.23 0.23 0.04 0.00 -0.12 0.00 0.00 57.88 57.80 1v8p h LEU 76 Cb 1.08 0.28 -0.05 0.00 -0.73 0.00 0.00 40.66 41.24 1v8p h LEU 76 CO 0.99 -0.27 -0.26 -0.67 -0.62 0.00 0.00 178.44 177.61 1v8p n ASP 77 N -5.25 -0.47 -0.03 1.25 4.64 -1.26 -1.38 116.55 114.06 1v8p n ASP 77 Ca 0.29 1.17 -0.13 0.00 -1.38 0.00 0.00 54.79 54.74 1v8p n ASP 77 Cb 0.93 -0.29 -0.09 0.00 -1.04 0.00 0.00 41.12 40.63 1v8p n ASP 77 CO 0.00 0.00 0.00 -0.33 -0.82 0.00 0.00 177.20 176.05 1v8p h GLU 78 N 0.00 0.12 -0.84 -0.67 4.39 -1.49 -3.21 114.58 112.87 1v8p h GLU 78 Ca 0.07 -0.06 0.18 0.00 0.34 0.00 0.00 59.36 59.88 1v8p h GLU 78 Cb 0.18 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 28.73 1v8p h GLU 78 CO -0.41 0.59 0.38 0.28 -1.16 0.00 0.00 179.01 178.68 1v8p h VAL 79 N -0.35 0.60 0.00 3.13 2.07 -1.28 0.56 116.25 120.98 1v8p h VAL 79 Ca 0.01 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1v8p h VAL 79 Cb 0.57 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1v8p h VAL 79 CO 0.01 0.09 -0.11 0.25 0.02 0.00 0.00 177.57 177.83 1v8p h LEU 80 N 0.47 0.00 -0.13 2.57 6.46 -1.24 -1.54 115.31 121.90 1v8p h LEU 80 Ca 0.49 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 58.21 1v8p h LEU 80 Cb 0.82 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.75 1v8p h LEU 80 CO -0.45 0.11 -0.09 -0.09 -0.62 0.00 0.00 178.44 177.30 1v8p h ARG 81 N 0.00 0.30 -0.32 1.25 2.43 0.10 -2.32 114.38 115.82 1v8p h ARG 81 Ca -0.00 -0.14 -0.06 0.00 -0.81 0.00 0.00 59.98 58.97 1v8p h ARG 81 Cb 0.21 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 1v8p h ARG 81 CO 0.01 0.66 -0.06 0.28 -1.51 0.00 0.00 179.97 179.35 1v8p h VAL 82 N -0.07 1.21 -0.11 0.20 2.07 -0.84 -0.96 116.25 117.75 1v8p h VAL 82 Ca 0.03 -0.90 -0.10 0.00 0.82 0.00 0.00 66.70 66.55 1v8p h VAL 82 Cb 0.59 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 1v8p h VAL 82 CO 0.03 0.30 -0.30 0.00 0.02 0.00 0.00 177.57 177.61 1v8p h ALA 83 N 1.45 0.19 -0.47 1.67 0.00 -1.29 -1.20 119.26 119.61 1v8p h ALA 83 Ca 0.10 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1v8p h ALA 83 Cb 0.41 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1v8p h ALA 83 CO 0.02 0.22 0.18 0.28 0.00 0.00 0.00 179.25 179.95 1v8p h VAL 84 N -0.03 1.21 -0.08 0.00 2.07 -1.32 -0.91 116.25 117.18 1v8p h VAL 84 Ca -0.01 -0.65 -0.15 0.00 0.82 0.00 0.00 66.70 66.72 1v8p h VAL 84 Cb 0.92 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1v8p h VAL 84 CO 0.07 0.24 -0.59 -0.33 0.02 0.00 0.00 177.57 176.98 1v8p h GLU 85 N 0.61 0.27 -0.50 1.57 5.08 -1.20 -3.29 114.58 117.13 1v8p h GLU 85 Ca 0.15 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1v8p h GLU 85 Cb 0.20 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1v8p h GLU 85 CO -0.01 0.78 0.00 0.54 -1.00 0.00 0.00 179.01 179.32 1v8p n ARG 86 N -3.89 2.73 -2.80 2.33 1.74 -0.45 -4.98 116.66 111.34 1v8p n ARG 86 Ca -0.02 -2.28 -0.21 0.00 -0.77 0.00 0.00 57.85 54.56 1v8p n ARG 86 Cb 0.61 -1.40 0.02 0.00 -1.02 0.00 0.00 32.46 30.67 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 1.03 -0.46 3.81 -0.13 0.00 -0.44 -4.99 105.19 104.01 1v8p n GLY 87 Ca 0.17 0.04 -0.22 0.00 0.00 0.00 0.00 46.02 46.01 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 -6.17 3.78 0.73 0.99 1.43 -0.68 -5.05 118.68 113.71 1v8p s LEU 88 Ca 0.20 -0.26 -0.11 0.00 -1.03 0.00 0.00 54.13 52.93 1v8p s LEU 88 Cb -0.09 -2.32 0.03 0.00 0.03 0.00 0.00 46.19 43.84 1v8p s LEU 88 CO 0.25 -0.03 1.07 0.42 0.23 0.00 0.00 176.35 178.29 1v8p s THR 89 N -2.11 3.76 0.36 5.49 -4.23 -1.26 -4.51 115.64 113.13 1v8p s THR 89 Ca 0.33 0.57 0.04 0.00 -1.18 0.00 0.00 61.69 61.44 1v8p s THR 89 Cb -0.08 -3.25 0.27 0.00 1.34 0.00 0.00 72.50 70.79 1v8p s THR 89 CO 0.25 -0.75 2.00 0.15 -0.54 0.00 0.00 174.62 175.72 1v8p h PHE 90 N -0.86 0.77 0.01 3.99 3.57 -1.93 0.25 116.94 122.74 1v8p h PHE 90 Ca -0.44 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.08 1v8p h PHE 90 Cb 1.22 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 39.70 1v8p h PHE 90 CO 0.59 0.46 -0.01 1.88 -2.23 0.00 0.00 178.31 179.01 1v8p h TYR 91 N 0.81 -0.02 -0.58 0.41 0.05 -1.97 -2.12 116.97 113.56 1v8p h TYR 91 Ca 0.26 -0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.97 1v8p h TYR 91 Cb 0.03 0.01 -0.02 0.00 1.01 0.00 0.00 36.73 37.75 1v8p h TYR 91 CO -0.00 0.24 0.09 -0.44 -1.05 0.00 0.00 178.16 177.00 1v8p h ASP 92 N -0.27 0.88 0.13 3.88 3.45 -1.83 -2.37 116.42 120.28 1v8p h ASP 92 Ca -0.00 -0.19 -0.03 0.00 0.43 0.00 0.00 57.03 57.23 1v8p h ASP 92 Cb 0.26 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 38.79 1v8p h ASP 92 CO 0.00 0.89 -0.14 0.00 -1.57 0.00 0.00 179.24 178.42 1v8p h ALA 93 N 1.22 1.71 -0.55 3.45 0.00 -0.87 -1.97 119.26 122.25 1v8p h ALA 93 Ca 0.18 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 55.05 1v8p h ALA 93 Cb 0.39 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1v8p h ALA 93 CO 0.01 0.22 0.37 0.77 0.00 0.00 0.00 179.25 180.63 1v8p h SER 94 N 0.04 0.22 0.36 0.00 0.02 -0.82 0.19 113.55 113.57 1v8p h SER 94 Ca 0.01 0.01 -0.32 0.00 -0.84 0.00 0.00 61.79 60.64 1v8p h SER 94 Cb 0.29 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.79 1v8p h SER 94 CO 0.02 0.13 -1.59 1.88 -1.14 0.00 0.00 176.83 176.12 1v8p h TYR 95 N 0.24 0.56 0.17 3.45 -1.99 -1.45 -2.92 116.97 115.03 1v8p h TYR 95 Ca 0.26 -0.41 -0.01 0.00 2.00 0.00 0.00 58.73 60.57 1v8p h TYR 95 Cb 0.69 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 39.40 1v8p h TYR 95 CO -0.00 1.48 -0.08 0.00 -0.00 0.00 0.00 178.16 179.55 1v8p h ALA 96 N 0.36 -0.23 0.64 3.88 0.00 -0.95 -2.24 119.26 120.72 1v8p h ALA 96 Ca -0.27 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1v8p h ALA 96 Cb 2.05 0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.94 1v8p h ALA 96 CO 0.17 -0.58 -0.31 -0.92 0.00 0.00 0.00 179.25 177.62 1v8p h TYR 97 N -0.33 -0.80 -0.36 0.00 3.20 -0.80 -1.98 116.97 115.91 1v8p h TYR 97 Ca -0.02 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.89 1v8p h TYR 97 Cb 0.26 0.26 -0.05 0.00 1.54 0.00 0.00 36.73 38.74 1v8p h TYR 97 CO -0.04 -0.49 0.03 0.28 -1.64 0.00 0.00 178.16 176.30 1v8p h VAL 98 N -0.86 0.77 -0.19 1.81 2.07 -1.55 -0.35 116.25 117.94 1v8p h VAL 98 Ca -0.09 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1v8p h VAL 98 Cb 0.66 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1v8p h VAL 98 CO 0.14 0.02 0.08 0.00 0.02 0.00 0.00 177.57 177.84 1v8p h ALA 99 N 1.29 0.25 0.31 1.67 0.00 -1.42 -1.73 119.26 119.64 1v8p h ALA 99 Ca 0.17 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1v8p h ALA 99 Cb 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1v8p h ALA 99 CO -0.26 -0.16 -0.15 0.93 0.00 0.00 0.00 179.25 179.61 1v8p h GLU 100 N 0.16 -0.40 0.00 0.00 5.08 -1.18 0.28 114.58 118.52 1v8p h GLU 100 Ca 0.06 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1v8p h GLU 100 Cb 0.17 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1v8p h GLU 100 CO -0.01 -0.12 0.00 0.66 -1.00 0.00 0.00 179.01 178.55 1v8p h SER 101 N -0.67 0.00 -0.02 1.42 4.64 -1.09 -1.63 113.55 116.20 1v8p h SER 101 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1v8p h SER 101 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1v8p h SER 101 CO 0.07 0.00 -0.04 -1.20 -0.87 0.00 0.00 176.83 174.79 1v8p n SER 102 N -2.56 2.30 -1.79 4.97 7.64 -0.65 -4.98 113.62 118.56 1v8p n SER 102 Ca -0.02 -1.65 -0.13 0.00 1.01 0.00 0.00 58.87 58.08 1v8p n SER 102 Cb 0.06 0.05 0.02 0.00 -1.01 0.00 0.00 64.21 63.33 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 0.96 -0.05 3.82 0.23 0.00 -0.61 -5.03 105.19 104.51 1v8p n GLY 103 Ca 0.09 -0.27 -0.22 0.00 0.00 0.00 0.00 46.02 45.63 1v8p n GLY 103 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1v8p s LEU 104 N -4.04 3.67 -0.28 0.99 1.43 0.04 -5.02 118.68 115.47 1v8p s LEU 104 Ca 0.15 -0.39 -0.15 0.00 -1.03 0.00 0.00 54.13 52.70 1v8p s LEU 104 Cb -0.06 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 43.89 1v8p s LEU 104 CO 0.18 -0.17 0.38 -0.69 0.23 0.00 0.00 176.35 176.28 1v8p s VAL 105 N -2.22 5.16 -0.30 -1.59 1.01 0.16 -4.51 120.40 118.11 1v8p s VAL 105 Ca 0.36 0.55 -0.29 0.00 0.00 0.00 0.00 61.98 62.60 1v8p s VAL 105 Cb -0.07 -3.72 0.01 0.00 0.00 0.00 0.00 36.38 32.61 1v8p s VAL 105 CO 0.25 0.13 1.13 -0.22 0.00 0.00 0.00 175.10 176.39 1v8p s LEU 106 N 2.09 3.95 -0.45 3.92 0.20 -1.26 -1.76 118.68 125.36 1v8p s LEU 106 Ca 0.15 1.14 -0.18 0.00 0.69 0.00 0.00 54.13 55.94 1v8p s LEU 106 Cb -0.16 -3.54 0.04 0.00 -0.43 0.00 0.00 46.19 42.10 1v8p s LEU 106 CO 0.10 -0.90 0.49 -0.69 -0.29 0.00 0.00 176.35 175.06 1v8p s VAL 107 N 3.75 5.04 0.05 1.68 1.01 0.58 -0.49 120.40 132.03 1v8p s VAL 107 Ca 0.48 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 62.02 1v8p s VAL 107 Cb -0.14 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 1v8p s VAL 107 CO 0.16 -0.56 -0.09 0.28 0.00 0.00 0.00 175.10 174.89 1v8p s THR 108 N 2.24 0.69 -2.38 3.92 -1.32 -0.11 -2.32 115.64 116.36 1v8p s THR 108 Ca 0.12 -1.19 0.22 0.00 -1.21 0.00 0.00 61.69 59.63 1v8p s THR 108 Cb -0.18 -0.79 0.37 0.00 -1.51 0.00 0.00 72.50 70.38 1v8p s THR 108 CO 0.12 -0.38 1.34 1.67 -2.21 0.00 0.00 174.62 175.17 1v8p n GLN 109 N 1.31 2.38 -3.56 7.08 -0.06 -1.26 -3.87 117.38 119.40 1v8p n GLN 109 Ca -0.22 -2.17 -0.38 0.00 -2.00 0.00 0.00 57.00 52.24 1v8p n GLN 109 Cb 0.55 -1.48 -0.10 0.00 -4.06 0.00 0.00 30.24 25.15 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 -1.48 6.09 0.63 1.69 -1.08 -1.26 -4.97 116.67 116.29 1v8p s ASP 110 Ca 0.35 0.08 0.41 0.00 -0.52 0.00 0.00 52.55 52.87 1v8p s ASP 110 Cb 0.21 -2.14 2.06 0.00 -1.46 0.00 0.00 42.92 41.59 1v8p s ASP 110 CO 0.29 -0.05 2.24 0.03 0.52 0.00 0.00 175.17 178.21 1v8p h ARG 111 N 8.12 0.00 0.05 4.34 -0.00 -1.99 0.38 114.38 125.28 1v8p h ARG 111 Ca -0.35 0.00 -0.14 0.00 -0.50 0.00 0.00 59.98 58.98 1v8p h ARG 111 Cb 1.18 0.00 0.01 0.00 0.00 0.00 0.00 29.97 31.16 1v8p h ARG 111 CO 0.59 0.00 -0.59 1.49 0.00 0.00 0.00 179.97 181.46 1v8p h GLU 112 N 0.00 0.32 0.24 0.04 4.57 -1.98 -2.72 114.58 115.05 1v8p h GLU 112 Ca -0.00 -0.41 -0.01 0.00 -1.18 0.00 0.00 59.36 57.76 1v8p h GLU 112 Cb 0.18 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1v8p h GLU 112 CO 0.00 1.12 -0.11 -0.07 -1.18 0.00 0.00 179.01 178.76 1v8p h LEU 113 N -0.29 -0.27 -0.83 1.64 3.38 -1.81 -1.06 115.31 116.07 1v8p h LEU 113 Ca -0.09 -0.22 0.21 0.00 0.09 0.00 0.00 57.88 57.87 1v8p h LEU 113 Cb 1.36 0.07 -0.14 0.00 0.09 0.00 0.00 40.66 42.04 1v8p h LEU 113 CO 0.11 0.10 0.11 -0.07 0.09 0.00 0.00 178.44 178.79 1v8p h LEU 114 N -0.69 -0.21 -1.16 1.67 3.38 -1.06 0.35 115.31 117.60 1v8p h LEU 114 Ca -0.03 0.20 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 1v8p h LEU 114 Cb 0.48 0.32 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1v8p h LEU 114 CO 0.05 -0.18 -0.28 0.00 0.09 0.00 0.00 178.44 178.12 1v8p h ALA 115 N 1.76 1.06 -0.32 1.53 0.00 -1.34 -3.24 119.26 118.72 1v8p h ALA 115 Ca 0.49 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1v8p h ALA 115 Cb 0.93 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1v8p h ALA 115 CO -0.68 0.35 0.00 1.63 0.00 0.00 0.00 179.25 180.54 1v8p n LYS 116 N -3.52 2.46 -4.07 0.00 5.02 0.99 -4.91 118.16 114.14 1v8p n LYS 116 Ca -0.00 -1.95 -0.32 0.00 -2.02 0.00 0.00 58.31 54.02 1v8p n LYS 116 Cb 0.43 -1.29 -0.16 0.00 -0.02 0.00 0.00 35.03 34.00 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 -1.01 1.87 -0.10 -0.18 2.01 0.22 -5.03 115.64 113.43 1v8p s THR 117 Ca 0.24 -0.94 -0.35 0.00 0.31 0.00 0.00 61.69 60.94 1v8p s THR 117 Cb 0.13 -1.77 -0.13 0.00 0.01 0.00 0.00 72.50 70.74 1v8p s THR 117 CO 0.17 0.40 1.81 0.29 -0.69 0.00 0.00 174.62 176.60 1v8p n LYS 118 N 4.65 1.95 -1.56 4.92 5.02 -1.26 -1.96 118.16 129.92 1v8p n LYS 118 Ca -0.18 0.71 -0.10 0.00 -2.02 0.00 0.00 58.31 56.72 1v8p n LYS 118 Cb 0.49 -2.52 -0.03 0.00 -0.02 0.00 0.00 35.03 32.95 1v8p n LYS 118 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1v8p n GLY 119 N 4.22 0.81 3.80 0.72 0.00 -1.26 -4.77 105.19 108.72 1v8p n GLY 119 Ca 0.23 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1v8p n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v8p s ALA 120 N -2.42 3.12 0.10 4.61 0.00 -0.83 -4.24 121.76 122.10 1v8p s ALA 120 Ca 0.00 0.47 0.02 0.00 0.00 0.00 0.00 51.96 52.45 1v8p s ALA 120 Cb 0.00 -3.17 -0.04 0.00 0.00 0.00 0.00 23.12 19.91 1v8p s ALA 120 CO 0.00 0.13 -0.07 0.96 0.00 0.00 0.00 175.76 176.78 1v8p s ILE 121 N -1.90 0.75 0.64 0.00 -4.36 0.36 -4.94 121.20 111.75 1v8p s ILE 121 Ca 0.56 -1.88 -0.02 0.00 -0.26 0.00 0.00 60.65 59.06 1v8p s ILE 121 Cb -0.14 -1.61 0.06 0.00 1.25 0.00 0.00 42.46 42.02 1v8p s ILE 121 CO 0.19 -0.81 0.90 1.51 0.24 0.00 0.00 174.94 176.97 1v8p s ASP 122 N -2.92 4.93 0.37 4.36 1.47 -1.25 -0.93 116.67 122.68 1v8p s ASP 122 Ca 0.11 0.08 0.11 0.00 1.18 0.00 0.00 52.55 54.02 1v8p s ASP 122 Cb 0.03 -0.78 0.87 0.00 -0.34 0.00 0.00 42.92 42.70 1v8p s ASP 122 CO -0.04 -1.44 1.86 0.58 0.68 0.00 0.00 175.17 176.82 1v8p h VAL 123 N -0.28 0.80 0.82 2.11 2.07 -1.93 -1.70 116.25 118.14 1v8p h VAL 123 Ca -0.42 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 66.85 1v8p h VAL 123 Cb 1.30 0.11 0.01 0.00 -1.52 0.00 0.00 31.29 31.18 1v8p h VAL 123 CO 0.52 0.12 -0.39 -0.08 0.02 0.00 0.00 177.57 177.76 1v8p h GLU 124 N 0.63 -1.06 -0.96 1.57 4.81 -1.95 -0.49 114.58 117.13 1v8p h GLU 124 Ca 0.46 0.07 0.20 0.00 -0.13 0.00 0.00 59.36 59.96 1v8p h GLU 124 Cb 0.82 0.24 -0.08 0.00 0.63 0.00 0.00 28.75 30.35 1v8p h GLU 124 CO -0.21 -0.70 0.61 1.15 -0.73 0.00 0.00 179.01 179.14 1v8p h THR 125 N -1.18 0.69 -0.15 0.32 2.02 -1.81 0.22 112.91 113.02 1v8p h THR 125 Ca -0.11 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 66.85 1v8p h THR 125 Cb 0.85 0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1v8p h THR 125 CO 0.18 0.10 0.02 0.25 0.37 0.00 0.00 175.52 176.45 1v8p h LEU 126 N 0.57 0.24 -1.14 2.58 5.85 -1.04 -2.58 115.31 119.79 1v8p h LEU 126 Ca 0.52 -0.27 0.08 0.00 0.84 0.00 0.00 57.88 59.05 1v8p h LEU 126 Cb 1.06 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.96 1v8p h LEU 126 CO -0.26 0.46 0.59 -0.07 -0.34 0.00 0.00 178.44 178.82 1v8p h LEU 127 N 0.02 0.88 -0.19 2.25 3.38 0.71 -1.51 115.31 120.86 1v8p h LEU 127 Ca 0.04 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1v8p h LEU 127 Cb 0.32 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1v8p h LEU 127 CO 0.00 0.54 -0.27 -0.37 0.09 0.00 0.00 178.44 178.44 1v8p h VAL 128 N 0.99 1.34 -0.77 1.22 -1.51 -1.27 -2.70 116.25 113.54 1v8p h VAL 128 Ca 0.41 -1.47 0.06 0.00 -1.23 0.00 0.00 66.70 64.47 1v8p h VAL 128 Cb 0.30 1.85 -0.06 0.00 -2.13 0.00 0.00 31.29 31.25 1v8p h VAL 128 CO -0.17 0.45 0.46 0.03 -1.23 0.00 0.00 177.57 177.10 1v8p h ARG 129 N 0.17 0.81 -0.51 5.19 3.08 -1.00 -0.48 114.38 121.64 1v8p h ARG 129 Ca 0.02 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1v8p h ARG 129 Cb 0.84 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.68 1v8p h ARG 129 CO 0.06 0.53 0.22 -0.07 -1.07 0.00 0.00 179.97 179.65 1v8p h LEU 130 N 0.83 0.68 -1.23 3.04 3.38 -1.28 -1.16 115.31 119.56 1v8p h LEU 130 Ca 0.35 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 58.10 1v8p h LEU 130 Cb 0.20 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1v8p h LEU 130 CO -0.18 0.65 -0.12 0.00 0.09 0.00 0.00 178.44 178.87 1v8p h ALA 131 N 1.06 1.37 0.00 1.53 0.00 -1.06 -1.90 119.26 120.26 1v8p h ALA 131 Ca 0.17 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1v8p h ALA 131 Cb 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1v8p h ALA 131 CO -0.02 0.43 0.00 0.00 0.00 0.00 0.00 179.25 179.66 1v8p h ALA 132 N 1.52 1.00 -0.01 0.00 0.00 -0.63 -3.52 119.26 117.63 1v8p h ALA 132 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1v8p h ALA 132 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1v8p h ALA 132 CO 0.02 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.31