#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xbl s LYS 3 N 0.00 0.60 0.15 0.00 0.00 -1.26 -5.12 119.74 114.11 1xbl s LYS 3 Ca 0.00 0.86 -0.29 0.00 0.00 0.00 0.00 55.97 56.53 1xbl s LYS 3 Cb 0.00 0.20 -0.07 0.00 0.00 0.00 0.00 37.83 37.96 1xbl s LYS 3 CO 0.00 -0.11 0.93 -1.14 0.00 0.00 0.00 175.35 175.03 1xbl s GLN 4 N 0.79 4.73 0.19 1.78 -0.44 -1.26 -5.00 119.66 120.45 1xbl s GLN 4 Ca -0.04 1.42 0.02 0.00 -2.50 0.00 0.00 55.36 54.26 1xbl s GLN 4 Cb -0.05 -3.34 -0.05 0.00 -1.64 0.00 0.00 33.01 27.94 1xbl s GLN 4 CO -0.06 0.35 0.02 0.34 0.50 0.00 0.00 175.29 176.43 1xbl s ASP 5 N -0.48 1.22 0.00 6.67 2.15 -1.26 -4.84 116.67 120.13 1xbl s ASP 5 Ca 0.44 -1.21 0.00 0.00 0.43 0.00 0.00 52.55 52.20 1xbl s ASP 5 Cb -0.24 0.12 0.00 0.00 -0.30 0.00 0.00 42.92 42.50 1xbl s ASP 5 CO 0.30 -0.60 0.00 -1.22 -0.17 0.00 0.00 175.17 173.48 1xbl n TYR 6 N -0.29 0.00 -0.32 -5.34 4.01 -1.26 -4.42 117.16 109.54 1xbl n TYR 6 Ca -0.05 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.74 1xbl n TYR 6 Cb 0.64 0.00 0.21 0.00 -0.31 0.00 0.00 39.34 39.88 1xbl n TYR 6 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 1xbl h TYR 7 N 0.00 0.96 0.00 -0.72 -1.99 -1.92 -1.80 116.97 111.50 1xbl h TYR 7 Ca 0.00 0.03 -0.13 0.00 2.00 0.00 0.00 58.73 60.63 1xbl h TYR 7 Cb 0.00 -0.29 -0.02 0.00 2.00 0.00 0.00 36.73 38.42 1xbl h TYR 7 CO 0.00 0.35 -0.92 1.49 -0.00 0.00 0.00 178.16 179.09 1xbl h GLU 8 N 0.84 0.00 -0.46 4.88 4.81 -1.83 0.38 114.58 123.20 1xbl h GLU 8 Ca 0.45 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.76 1xbl h GLU 8 Cb 0.48 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.79 1xbl h GLU 8 CO -0.28 0.42 0.07 0.82 -0.73 0.00 0.00 179.01 179.32 1xbl h ILE 9 N 0.00 0.73 0.26 2.32 2.04 -1.69 -1.18 117.51 120.00 1xbl h ILE 9 Ca -0.07 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 1xbl h ILE 9 Cb 1.48 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 38.07 1xbl h ILE 9 CO 0.06 0.04 -0.13 -0.07 0.00 0.00 0.00 178.15 178.05 1xbl h LEU 10 N 0.20 -0.30 -0.78 1.44 3.38 -1.34 -3.48 115.31 114.44 1xbl h LEU 10 Ca 0.23 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1xbl h LEU 10 Cb 0.30 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1xbl h LEU 10 CO -0.31 0.01 0.00 0.61 0.09 0.00 0.00 178.44 178.84 1xbl n GLY 11 N -0.50 -0.87 3.70 0.83 0.00 0.12 -5.02 105.19 103.45 1xbl n GLY 11 Ca -0.09 -0.63 -0.02 0.00 0.00 0.00 0.00 46.02 45.28 1xbl n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xbl s VAL 12 N 0.00 0.00 0.29 1.61 0.11 -1.23 -5.00 120.40 116.17 1xbl s VAL 12 Ca 0.00 -0.48 -0.30 0.00 -2.93 0.00 0.00 61.98 58.27 1xbl s VAL 12 Cb 0.00 -1.91 -0.12 0.00 -1.53 0.00 0.00 36.38 32.82 1xbl s VAL 12 CO 0.00 0.00 1.46 -1.20 -3.33 0.00 0.00 175.10 172.03 1xbl n SER 13 N -0.45 3.23 0.23 3.54 7.64 -1.26 -4.67 113.62 121.86 1xbl n SER 13 Ca -0.07 1.16 0.16 0.00 1.01 0.00 0.00 58.87 61.13 1xbl n SER 13 Cb 0.61 -1.51 0.71 0.00 -1.01 0.00 0.00 64.21 63.01 1xbl n SER 13 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1xbl h LYS 14 N 4.04 0.00 -0.16 1.43 1.57 -2.01 -0.41 116.57 121.03 1xbl h LYS 14 Ca -0.46 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.14 1xbl h LYS 14 Cb 1.26 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 33.29 1xbl h LYS 14 CO 0.74 0.00 -0.86 0.25 -0.57 0.00 0.00 179.45 179.01 1xbl n THR 15 N -2.69 1.20 -1.75 -0.16 -2.24 -1.26 -4.92 114.28 102.45 1xbl n THR 15 Ca 0.00 -2.39 -0.39 0.00 -2.27 0.00 0.00 64.05 59.00 1xbl n THR 15 Cb 0.20 0.40 0.04 0.00 -2.10 0.00 0.00 70.33 68.87 1xbl n THR 15 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xbl n ALA 16 N -0.33 1.75 -1.77 6.98 0.00 -0.17 -4.96 120.51 122.02 1xbl n ALA 16 Ca 0.15 0.17 -0.40 0.00 0.00 0.00 0.00 53.44 53.36 1xbl n ALA 16 Cb 0.93 -2.37 0.01 0.00 0.00 0.00 0.00 19.45 18.01 1xbl n ALA 16 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1xbl s GLU 17 N -2.75 3.86 0.48 0.00 -6.30 -1.26 -4.78 118.70 107.95 1xbl s GLU 17 Ca 0.68 2.32 0.33 0.00 -2.50 0.00 0.00 54.97 55.80 1xbl s GLU 17 Cb -0.43 -2.74 1.68 0.00 0.00 0.00 0.00 34.13 32.65 1xbl s GLU 17 CO 0.52 -0.64 2.00 0.93 0.02 0.00 0.00 175.26 178.08 1xbl h GLU 18 N 2.56 0.00 -0.71 4.30 4.39 -1.93 0.21 114.58 123.39 1xbl h GLU 18 Ca -0.50 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.24 1xbl h GLU 18 Cb 1.25 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.85 1xbl h GLU 18 CO 0.62 0.00 0.43 -0.09 -1.16 0.00 0.00 179.01 178.81 1xbl h ARG 19 N 0.00 0.79 -0.32 2.33 2.43 -1.95 0.15 114.38 117.80 1xbl h ARG 19 Ca 0.00 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.01 1xbl h ARG 19 Cb 0.11 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1xbl h ARG 19 CO 0.00 0.52 -0.26 1.49 -1.51 0.00 0.00 179.97 180.21 1xbl h GLU 20 N 0.81 0.65 -0.53 0.20 4.81 -0.93 -0.60 114.58 118.99 1xbl h GLU 20 Ca 0.30 -0.27 0.03 0.00 -0.13 0.00 0.00 59.36 59.30 1xbl h GLU 20 Cb 0.11 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 1xbl h GLU 20 CO -0.15 0.85 0.30 0.82 -0.73 0.00 0.00 179.01 180.09 1xbl h ILE 21 N 0.56 1.01 -0.72 2.32 1.08 -1.23 0.18 117.51 120.71 1xbl h ILE 21 Ca 0.08 -0.20 0.08 0.00 -0.39 0.00 0.00 64.86 64.43 1xbl h ILE 21 Cb 0.74 0.38 -0.07 0.00 -3.07 0.00 0.00 36.82 34.80 1xbl h ILE 21 CO 0.06 0.11 0.39 -0.09 -0.69 0.00 0.00 178.15 177.92 1xbl h ARG 22 N 0.58 0.66 -0.06 2.37 9.65 0.07 0.88 114.38 128.53 1xbl h ARG 22 Ca 0.22 -0.04 0.03 0.00 -1.10 0.00 0.00 59.98 59.09 1xbl h ARG 22 Cb 0.07 -0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 28.47 1xbl h ARG 22 CO -0.12 0.44 -0.15 0.87 2.80 0.00 0.00 179.97 183.80 1xbl h LYS 23 N 0.68 -0.22 -0.19 0.20 6.56 -0.46 -2.03 116.57 121.11 1xbl h LYS 23 Ca 0.34 0.01 0.05 0.00 -1.06 0.00 0.00 60.65 60.00 1xbl h LYS 23 Cb 0.30 0.05 -0.05 0.00 -0.57 0.00 0.00 32.23 31.96 1xbl h LYS 23 CO -0.23 -0.14 -0.13 0.00 -2.06 0.00 0.00 179.45 176.88 1xbl h ALA 24 N 0.77 0.02 -0.50 3.86 0.00 0.12 0.44 119.26 123.96 1xbl h ALA 24 Ca 0.07 0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.14 1xbl h ALA 24 Cb 0.33 0.29 -0.07 0.00 0.00 0.00 0.00 17.79 18.33 1xbl h ALA 24 CO -0.20 -0.56 0.10 -0.92 0.00 0.00 0.00 179.25 177.67 1xbl h TYR 25 N -0.13 0.16 0.06 0.00 3.20 -0.91 -0.00 116.97 119.35 1xbl h TYR 25 Ca 0.11 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.04 1xbl h TYR 25 Cb 0.29 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.53 1xbl h TYR 25 CO -0.28 -0.01 -0.28 -0.22 -1.64 0.00 0.00 178.16 175.74 1xbl h LYS 26 N 0.23 -0.44 -0.46 1.82 1.63 -0.30 0.79 116.57 119.84 1xbl h LYS 26 Ca 0.25 0.03 -0.08 0.00 -0.85 0.00 0.00 60.65 60.00 1xbl h LYS 26 Cb 0.34 0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.05 1xbl h LYS 26 CO -0.33 -0.29 -0.04 0.07 -3.45 0.00 0.00 179.45 175.41 1xbl h ARG 27 N -0.46 0.79 -0.23 1.90 0.11 -0.48 -3.08 114.38 112.93 1xbl h ARG 27 Ca 0.05 -0.23 -0.09 0.00 0.10 0.00 0.00 59.98 59.81 1xbl h ARG 27 Cb 0.51 -0.08 -0.00 0.00 1.11 0.00 0.00 29.97 31.51 1xbl h ARG 27 CO -0.20 0.82 -0.20 -0.07 0.10 0.00 0.00 179.97 180.42 1xbl h LEU 28 N 0.73 0.57 -0.60 0.08 3.38 -0.74 -3.14 115.31 115.59 1xbl h LEU 28 Ca 0.14 -0.46 0.09 0.00 0.09 0.00 0.00 57.88 57.74 1xbl h LEU 28 Cb 0.50 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 41.02 1xbl h LEU 28 CO 0.03 0.91 0.21 0.00 0.09 0.00 0.00 178.44 179.68 1xbl h ALA 29 N 0.67 0.76 -0.26 1.53 0.00 -0.75 0.25 119.26 121.47 1xbl h ALA 29 Ca 0.04 0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1xbl h ALA 29 Cb 0.74 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1xbl h ALA 29 CO 0.05 -0.21 -0.25 0.00 0.00 0.00 0.00 179.25 178.84 1xbl h MET 30 N 0.38 0.49 -0.84 0.00 -0.00 -1.65 -2.98 114.93 110.33 1xbl h MET 30 Ca 0.30 -0.19 0.11 0.00 -0.00 0.00 0.00 59.70 59.93 1xbl h MET 30 Cb 0.38 -0.03 -0.08 0.00 -0.00 0.00 0.00 31.60 31.87 1xbl h MET 30 CO -0.31 0.71 0.47 -0.22 -0.00 0.00 0.00 176.91 177.56 1xbl h LYS 31 N 0.43 0.74 -0.14 -0.10 3.64 -0.43 -1.38 116.57 119.33 1xbl h LYS 31 Ca 0.06 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.33 1xbl h LYS 31 Cb 0.67 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.29 1xbl h LYS 31 CO 0.05 0.49 -0.33 2.48 -2.27 0.00 0.00 179.45 179.87 1xbl n TYR 32 N -4.77 0.42 -0.71 1.91 0.18 -1.21 -5.07 117.16 107.91 1xbl n TYR 32 Ca 0.15 -1.53 -0.18 0.00 1.88 0.00 0.00 57.90 58.23 1xbl n TYR 32 Cb 0.33 -0.34 -0.08 0.00 -0.38 0.00 0.00 39.34 38.87 1xbl n TYR 32 CO 0.00 0.00 0.00 1.58 -2.08 0.00 0.00 176.86 176.36 1xbl n HIS 33 N -1.13 0.21 -0.35 -3.48 -0.00 -0.52 -4.69 115.22 105.26 1xbl n HIS 33 Ca 0.24 0.14 -0.06 0.00 0.46 0.00 0.00 57.72 58.50 1xbl n HIS 33 Cb 0.82 -0.94 0.02 0.00 -0.12 0.00 0.00 29.99 29.77 1xbl n HIS 33 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1xbl n PRO 34 N 3.74 1.31 0.01 1.57 -0.04 -1.26 -4.24 135.00 136.08 1xbl n PRO 34 Ca 0.32 -0.64 -0.01 0.00 -0.04 0.00 0.00 63.50 63.13 1xbl n PRO 34 Cb 0.03 -1.25 -0.00 0.00 -0.04 0.00 0.00 33.50 32.23 1xbl n PRO 34 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 1xbl h ASP 35 N 0.94 -0.04 -0.53 3.54 2.03 -1.99 -3.35 116.42 117.01 1xbl h ASP 35 Ca 0.12 0.00 -0.32 0.00 -0.73 0.00 0.00 57.03 56.10 1xbl h ASP 35 Cb 1.07 0.01 -0.12 0.00 -0.83 0.00 0.00 39.33 39.46 1xbl h ASP 35 CO 0.29 0.08 0.23 -2.11 -1.03 0.00 0.00 179.24 176.70 1xbl n ARG 36 N -2.73 1.93 -0.19 4.15 1.85 -1.26 -3.72 116.66 116.69 1xbl n ARG 36 Ca -0.01 -1.53 0.11 0.00 -1.00 0.00 0.00 57.85 55.42 1xbl n ARG 36 Cb 0.02 -1.77 0.20 0.00 -1.05 0.00 0.00 32.46 29.86 1xbl n ARG 36 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 1xbl n ASN 37 N 1.00 3.37 -4.54 2.89 0.23 -1.26 -4.99 115.26 111.96 1xbl n ASN 37 Ca 0.34 -1.96 -0.35 0.00 -0.53 0.00 0.00 54.58 52.08 1xbl n ASN 37 Cb 0.61 -0.24 -0.05 0.00 -2.08 0.00 0.00 39.78 38.02 1xbl n ASN 37 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1xbl n GLN 38 N 1.38 0.87 0.00 -3.83 1.13 -1.24 -0.17 117.38 115.52 1xbl n GLN 38 Ca 0.18 -0.05 0.00 0.00 -1.94 0.00 0.00 57.00 55.19 1xbl n GLN 38 Cb 0.58 -3.19 0.00 0.00 0.11 0.00 0.00 30.24 27.74 1xbl n GLN 38 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1xbl n GLY 39 N 6.11 3.53 0.46 1.08 0.00 -1.26 -4.95 105.19 110.17 1xbl n GLY 39 Ca 0.42 -0.80 -0.17 0.00 0.00 0.00 0.00 46.02 45.47 1xbl n GLY 39 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1xbl h ASP 40 N 0.00 -1.35 0.00 1.61 3.58 -0.95 -3.45 116.42 115.87 1xbl h ASP 40 Ca 0.00 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.58 1xbl h ASP 40 Cb 0.00 0.47 0.00 0.00 1.72 0.00 0.00 39.33 41.52 1xbl h ASP 40 CO 0.00 -0.59 0.00 1.17 -2.88 0.00 0.00 179.24 176.94 1xbl n LYS 41 N -5.52 0.00 0.02 0.28 4.81 -1.18 -4.74 118.16 111.83 1xbl n LYS 41 Ca -0.10 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.24 1xbl n LYS 41 Cb 0.42 -1.36 -0.05 0.00 0.02 0.00 0.00 35.03 34.07 1xbl n LYS 41 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1xbl h GLU 42 N 0.55 -0.09 -0.74 1.64 5.08 -1.89 0.15 114.58 119.27 1xbl h GLU 42 Ca 0.00 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.45 1xbl h GLU 42 Cb 0.00 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.20 1xbl h GLU 42 CO 0.00 -0.06 0.40 0.00 -1.00 0.00 0.00 179.01 178.35 1xbl h ALA 43 N 0.95 1.04 0.38 3.43 0.00 -1.88 0.54 119.26 123.71 1xbl h ALA 43 Ca 0.05 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1xbl h ALA 43 Cb 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1xbl h ALA 43 CO -0.12 0.02 -0.18 1.49 0.00 0.00 0.00 179.25 180.45 1xbl h GLU 44 N 0.68 -0.49 -0.09 0.00 4.81 -1.81 0.10 114.58 117.78 1xbl h GLU 44 Ca 0.36 0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.57 1xbl h GLU 44 Cb 0.34 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1xbl h GLU 44 CO -0.25 -0.25 -0.17 0.00 -0.73 0.00 0.00 179.01 177.61 1xbl h ALA 45 N -0.09 1.55 -0.08 2.92 0.00 -0.08 0.13 119.26 123.62 1xbl h ALA 45 Ca -0.05 -0.21 -0.19 0.00 0.00 0.00 0.00 54.91 54.46 1xbl h ALA 45 Cb 0.47 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.21 1xbl h ALA 45 CO 0.09 0.33 -0.68 -0.22 0.00 0.00 0.00 179.25 178.76 1xbl h LYS 46 N 0.13 0.60 -1.00 0.00 3.64 0.14 0.29 116.57 120.36 1xbl h LYS 46 Ca 0.03 -0.54 0.13 0.00 -1.27 0.00 0.00 60.65 59.00 1xbl h LYS 46 Cb 0.39 0.13 -0.09 0.00 -0.41 0.00 0.00 32.23 32.25 1xbl h LYS 46 CO 0.03 1.16 0.63 0.35 -2.27 0.00 0.00 179.45 179.34 1xbl h PHE 47 N 0.23 1.12 0.25 1.91 3.04 -0.26 -0.53 116.94 122.70 1xbl h PHE 47 Ca -0.06 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.91 1xbl h PHE 47 Cb 1.34 -0.35 0.00 0.00 2.56 0.00 0.00 35.95 39.50 1xbl h PHE 47 CO 0.11 0.42 -0.12 0.87 -2.02 0.00 0.00 178.31 177.57 1xbl h LYS 48 N 0.95 -0.32 -0.81 1.11 1.57 0.02 0.15 116.57 119.24 1xbl h LYS 48 Ca 0.51 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.29 1xbl h LYS 48 Cb 0.56 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.90 1xbl h LYS 48 CO -0.28 -0.05 0.44 1.05 -0.57 0.00 0.00 179.45 180.04 1xbl h GLU 49 N -0.58 1.13 -0.26 3.15 4.11 -0.69 0.24 114.58 121.67 1xbl h GLU 49 Ca -0.03 -0.14 -0.02 0.00 0.07 0.00 0.00 59.36 59.24 1xbl h GLU 49 Cb 0.42 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1xbl h GLU 49 CO 0.06 0.84 0.09 0.82 0.07 0.00 0.00 179.01 180.89 1xbl h ILE 50 N 1.12 1.18 -0.29 -1.06 2.04 -1.06 0.43 117.51 119.87 1xbl h ILE 50 Ca 0.28 -0.57 -0.09 0.00 1.00 0.00 0.00 64.86 65.48 1xbl h ILE 50 Cb 0.04 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 1xbl h ILE 50 CO -0.04 0.19 -0.18 0.50 0.00 0.00 0.00 178.15 178.62 1xbl h LYS 51 N 0.27 0.64 -0.27 2.37 3.64 0.09 0.84 116.57 124.16 1xbl h LYS 51 Ca 0.09 -0.29 -0.05 0.00 -1.27 0.00 0.00 60.65 59.12 1xbl h LYS 51 Cb 0.21 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 1xbl h LYS 51 CO -0.01 0.88 -0.02 1.49 -2.27 0.00 0.00 179.45 179.53 1xbl h GLU 52 N 0.38 0.48 -0.28 1.90 4.81 -0.55 0.23 114.58 121.55 1xbl h GLU 52 Ca 0.06 -0.17 0.06 0.00 -0.13 0.00 0.00 59.36 59.18 1xbl h GLU 52 Cb 0.71 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 30.00 1xbl h GLU 52 CO 0.05 0.67 -0.09 0.00 -0.73 0.00 0.00 179.01 178.90 1xbl h ALA 53 N 0.80 0.16 -0.54 2.92 0.00 -0.83 0.11 119.26 121.89 1xbl h ALA 53 Ca 0.07 0.11 0.09 0.00 0.00 0.00 0.00 54.91 55.18 1xbl h ALA 53 Cb 0.46 0.26 -0.07 0.00 0.00 0.00 0.00 17.79 18.44 1xbl h ALA 53 CO 0.02 -0.49 0.15 -0.92 0.00 0.00 0.00 179.25 178.01 1xbl h TYR 54 N -0.04 0.26 -0.46 0.00 5.03 -0.54 -0.50 116.97 120.72 1xbl h TYR 54 Ca 0.14 0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.51 1xbl h TYR 54 Cb 0.25 -0.04 -0.04 0.00 1.55 0.00 0.00 36.73 38.46 1xbl h TYR 54 CO -0.29 0.04 0.25 1.49 -1.32 0.00 0.00 178.16 178.33 1xbl h GLU 55 N 0.31 0.48 -0.24 1.82 4.81 0.62 -2.65 114.58 119.73 1xbl h GLU 55 Ca 0.27 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 1xbl h GLU 55 Cb 0.34 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1xbl h GLU 55 CO -0.31 0.32 0.09 0.28 -0.73 0.00 0.00 179.01 178.65 1xbl h VAL 56 N 0.49 1.18 0.00 0.32 2.07 -0.18 -3.22 116.25 116.91 1xbl h VAL 56 Ca 0.19 -0.56 -0.35 0.00 0.82 0.00 0.00 66.70 66.81 1xbl h VAL 56 Cb 0.07 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1xbl h VAL 56 CO -0.12 0.18 1.56 0.18 0.02 0.00 0.00 177.57 179.39 1xbl n LEU 57 N -4.78 5.65 0.00 2.57 4.77 -0.26 -3.12 117.00 121.83 1xbl n LEU 57 Ca -0.03 -3.18 0.00 0.00 -0.03 0.00 0.00 56.01 52.76 1xbl n LEU 57 Cb 0.14 -1.25 0.00 0.00 -2.33 0.00 0.00 43.42 39.98 1xbl n LEU 57 CO 0.36 1.35 0.00 0.35 -1.33 0.00 0.00 177.39 178.11 1xbl n THR 58 N 3.23 0.00 -1.11 -5.08 -2.24 -1.22 -4.85 114.28 103.01 1xbl n THR 58 Ca 0.49 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 62.07 1xbl n THR 58 Cb 0.46 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.77 1xbl n THR 58 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1xbl n ASP 59 N 0.00 6.49 0.00 3.42 2.03 -1.18 -4.76 116.55 122.54 1xbl n ASP 59 Ca 0.00 -3.12 0.00 0.00 0.52 0.00 0.00 54.79 52.19 1xbl n ASP 59 Cb 0.04 -1.12 0.00 0.00 -0.72 0.00 0.00 41.12 39.31 1xbl n ASP 59 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1xbl n SER 60 N 0.53 0.00 0.00 1.67 2.88 -1.26 -4.21 113.62 113.23 1xbl n SER 60 Ca 0.38 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.92 1xbl n SER 60 Cb 0.58 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 1xbl n SER 60 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1xbl n GLN 61 N 0.00 0.00 -3.39 -1.46 7.27 -1.26 -5.02 117.38 113.51 1xbl n GLN 61 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 57.00 56.90 1xbl n GLN 61 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1xbl n GLN 61 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1xbl n LYS 62 N -0.25 -1.03 0.00 3.69 5.02 -1.26 -4.13 118.16 120.20 1xbl n LYS 62 Ca 0.00 0.49 0.00 0.00 -2.02 0.00 0.00 58.31 56.78 1xbl n LYS 62 Cb 0.00 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 1xbl n LYS 62 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1xbl n ARG 63 N -1.98 0.00 0.26 1.97 0.00 -1.26 -3.84 116.66 111.81 1xbl n ARG 63 Ca -0.22 0.00 0.14 0.00 -0.00 0.00 0.00 57.85 57.77 1xbl n ARG 63 Cb 0.47 0.00 0.66 0.00 0.00 0.00 0.00 32.46 33.59 1xbl n ARG 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1xbl h ALA 64 N 0.00 1.07 -0.23 5.13 0.00 -1.96 -0.05 119.26 123.22 1xbl h ALA 64 Ca 0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1xbl h ALA 64 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1xbl h ALA 64 CO 0.00 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.38 1xbl h ALA 65 N 1.90 0.31 -0.96 0.00 0.00 -1.89 -0.54 119.26 118.08 1xbl h ALA 65 Ca -0.00 -0.21 0.29 0.00 0.00 0.00 0.00 54.91 54.98 1xbl h ALA 65 Cb 0.51 -0.08 -0.14 0.00 0.00 0.00 0.00 17.79 18.07 1xbl h ALA 65 CO 0.01 0.03 0.45 -0.92 0.00 0.00 0.00 179.25 178.82 1xbl h TYR 66 N 0.17 0.73 0.10 0.00 5.03 -1.17 0.90 116.97 122.74 1xbl h TYR 66 Ca 0.07 0.04 -0.01 0.00 2.58 0.00 0.00 58.73 61.41 1xbl h TYR 66 Cb 0.39 -0.17 0.00 0.00 1.55 0.00 0.00 36.73 38.51 1xbl h TYR 66 CO 0.03 -0.17 -0.05 0.22 -1.32 0.00 0.00 178.16 176.87 1xbl h ASP 67 N 0.30 -0.12 0.00 -2.11 3.58 -1.42 -3.40 116.42 113.25 1xbl h ASP 67 Ca 0.66 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.12 1xbl h ASP 67 Cb 1.44 0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.52 1xbl h ASP 67 CO -0.61 -0.08 0.00 0.00 -2.88 0.00 0.00 179.24 175.66 1xbl n GLN 68 N -2.38 0.00 -1.42 0.28 6.02 0.18 -4.73 117.38 115.33 1xbl n GLN 68 Ca -0.02 0.14 -0.18 0.00 -0.01 0.00 0.00 57.00 56.93 1xbl n GLN 68 Cb 0.06 -0.56 0.10 0.00 1.02 0.00 0.00 30.24 30.86 1xbl n GLN 68 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 177.06 178.53 1xbl n TYR 69 N -1.26 2.16 0.00 1.08 0.18 0.12 -4.57 117.16 114.86 1xbl n TYR 69 Ca 0.00 -2.14 0.00 0.00 1.88 0.00 0.00 57.90 57.64 1xbl n TYR 69 Cb 0.00 -0.60 0.00 0.00 -0.38 0.00 0.00 39.34 38.36 1xbl n TYR 69 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1xbl n GLY 70 N -0.91 0.15 2.36 -7.48 0.00 0.26 -0.48 105.19 99.09 1xbl n GLY 70 Ca 0.43 0.14 -0.26 0.00 0.00 0.00 0.00 46.02 46.33 1xbl n GLY 70 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1xbl n HIS 71 N 0.00 1.88 -2.90 1.61 1.44 -1.26 -4.14 115.22 111.85 1xbl n HIS 71 Ca 0.00 -3.90 -0.10 0.00 -2.01 0.00 0.00 57.72 51.71 1xbl n HIS 71 Cb 0.00 -0.45 0.04 0.00 0.12 0.00 0.00 29.99 29.70 1xbl n HIS 71 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1xbl n ALA 72 N 1.21 -0.62 0.03 1.59 0.00 0.37 -4.97 120.51 118.13 1xbl n ALA 72 Ca 0.26 0.13 0.04 0.00 0.00 0.00 0.00 53.44 53.87 1xbl n ALA 72 Cb 0.46 -2.39 0.43 0.00 0.00 0.00 0.00 19.45 17.94 1xbl n ALA 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xbl h ALA 73 N 0.43 1.69 0.00 0.00 0.00 -1.40 0.78 119.26 120.76 1xbl h ALA 73 Ca -0.25 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1xbl h ALA 73 Cb 1.16 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1xbl h ALA 73 CO 0.23 0.27 0.00 1.97 0.00 0.00 0.00 179.25 181.72 1xbl n PHE 74 N -4.45 0.00 -0.83 0.00 -1.74 -1.26 -3.60 117.46 105.58 1xbl n PHE 74 Ca 0.02 0.00 0.05 0.00 -0.56 0.00 0.00 57.45 56.97 1xbl n PHE 74 Cb 0.09 0.00 0.08 0.00 1.52 0.00 0.00 39.48 41.17 1xbl n PHE 74 CO 0.00 0.00 0.00 0.39 -0.56 0.00 0.00 176.76 176.59 1xbl n GLU 75 N -0.90 1.62 0.00 3.97 1.02 0.26 -5.15 120.64 121.46 1xbl n GLU 75 Ca 0.17 -1.98 0.00 0.00 -0.02 0.00 0.00 57.16 55.33 1xbl n GLU 75 Cb 0.08 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.30 1xbl n GLU 75 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35