#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fzp n ILE 3 N 0.00 0.00 0.00 0.00 -0.00 -1.26 -5.09 119.36 113.01 1fzp n ILE 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1fzp n ILE 3 Cb 0.00 -0.23 0.00 0.00 -0.00 0.00 0.00 39.64 39.41 1fzp n ILE 3 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.55 176.96 1fzp n THR 4 N -3.52 0.00 -2.77 1.39 -1.04 -1.26 -5.00 114.28 102.07 1fzp n THR 4 Ca 0.03 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.61 1fzp n THR 4 Cb 0.14 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.65 1fzp n THR 4 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1fzp n LYS 5 N 0.00 3.74 0.00 -2.82 4.81 -1.26 -4.76 118.16 117.87 1fzp n LYS 5 Ca 0.00 -3.96 0.11 0.00 -0.87 0.00 0.00 58.31 53.59 1fzp n LYS 5 Cb 0.00 -2.81 0.07 0.00 0.02 0.00 0.00 35.03 32.31 1fzp n LYS 5 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 1fzp n ILE 6 N 3.12 0.00 -1.99 3.15 -5.35 -1.26 -4.95 119.36 112.08 1fzp n ILE 6 Ca 0.34 -0.44 -0.41 0.00 -0.27 0.00 0.00 62.75 61.97 1fzp n ILE 6 Cb 0.38 1.41 -0.01 0.00 -1.74 0.00 0.00 39.64 39.67 1fzp n ILE 6 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1fzp s ASN 7 N -2.00 6.60 1.01 7.28 -0.87 -1.26 -4.91 114.94 120.79 1fzp s ASN 7 Ca 0.24 2.82 -0.19 0.00 -1.57 0.00 0.00 52.86 54.16 1fzp s ASN 7 Cb 0.18 -2.65 -0.08 0.00 -0.02 0.00 0.00 41.25 38.68 1fzp s ASN 7 CO 0.35 -0.68 -0.58 0.47 -2.57 0.00 0.00 177.10 174.08 1fzp n ASP 8 N 0.92 -3.88 -0.02 -1.22 8.00 -1.26 -4.67 116.55 114.42 1fzp n ASP 8 Ca 0.01 0.13 -0.00 0.00 0.71 0.00 0.00 54.79 55.64 1fzp n ASP 8 Cb 0.41 -0.83 -0.00 0.00 -0.02 0.00 0.00 41.12 40.67 1fzp n ASP 8 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fzp h PHE 10 N 0.01 0.00 0.00 0.00 0.04 -1.97 -0.88 116.94 114.13 1fzp h PHE 10 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1fzp h PHE 10 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1fzp h PHE 10 CO 0.00 0.05 0.10 -0.85 -0.60 0.00 0.00 178.31 177.01 1fzp n GLU 11 N -4.67 0.00 -0.03 1.51 0.28 -1.26 -1.69 120.64 114.77 1fzp n GLU 11 Ca -0.05 0.27 -0.04 0.00 -0.16 0.00 0.00 57.16 57.17 1fzp n GLU 11 Cb 0.18 -1.60 -0.01 0.00 1.43 0.00 0.00 31.44 31.43 1fzp n GLU 11 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 1fzp n LEU 12 N -1.23 1.16 0.19 -1.84 0.00 -1.25 -4.60 117.00 109.44 1fzp n LEU 12 Ca 0.00 0.19 0.17 0.00 0.00 0.00 0.00 56.01 56.36 1fzp n LEU 12 Cb 0.10 -0.54 0.80 0.00 0.00 0.00 0.00 43.42 43.78 1fzp n LEU 12 CO 0.00 -0.44 1.14 0.25 0.00 0.00 0.00 177.39 178.35 1fzp h LEU 13 N -0.49 0.00 0.69 -1.96 7.12 -1.04 -1.90 115.31 117.74 1fzp h LEU 13 Ca 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 57.98 1fzp h LEU 13 Cb 0.49 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.62 1fzp h LEU 13 CO 0.00 0.00 -0.41 -1.28 -0.13 0.00 0.00 178.44 176.62 1fzp h SER 14 N 0.00 -1.03 0.61 1.25 0.87 -1.50 -2.45 113.55 111.29 1fzp h SER 14 Ca 0.09 0.06 -0.12 0.00 -1.23 0.00 0.00 61.79 60.59 1fzp h SER 14 Cb 0.48 0.30 -0.02 0.00 -0.44 0.00 0.00 62.40 62.72 1fzp h SER 14 CO -0.00 -0.65 -0.58 0.24 -0.53 0.00 0.00 176.83 175.32 1fzp h MET 15 N -1.03 0.00 0.00 2.24 2.86 -1.74 -2.45 114.93 114.81 1fzp h MET 15 Ca -0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1fzp h MET 15 Cb 0.83 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.49 1fzp h MET 15 CO 0.10 0.58 0.00 0.28 1.06 0.00 0.00 176.91 178.92 1fzp n VAL 16 N -3.81 0.00 -0.00 -2.22 0.31 -0.74 -0.32 118.33 111.55 1fzp n VAL 16 Ca -0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.30 1fzp n VAL 16 Cb 0.59 -0.24 -0.01 0.00 -0.91 0.00 0.00 33.84 33.27 1fzp n VAL 16 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1fzp n THR 17 N -0.59 0.74 -0.21 2.52 -1.04 -0.94 -4.39 114.28 110.38 1fzp n THR 17 Ca 0.03 0.26 0.02 0.00 -2.04 0.00 0.00 64.05 62.31 1fzp n THR 17 Cb 0.01 -1.57 0.13 0.00 -1.82 0.00 0.00 70.33 67.08 1fzp n THR 17 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 1fzp h TYR 18 N -0.21 0.25 -0.47 -1.42 -0.00 -1.46 0.40 116.97 114.06 1fzp h TYR 18 Ca 0.00 0.04 0.09 0.00 -0.00 0.00 0.00 58.73 58.86 1fzp h TYR 18 Cb 0.21 -0.01 -0.08 0.00 -0.00 0.00 0.00 36.73 36.85 1fzp h TYR 18 CO -0.09 -0.03 -0.01 0.00 -0.00 0.00 0.00 178.16 178.03 1fzp h ALA 19 N 1.51 0.43 -0.30 1.82 0.00 -0.92 -1.54 119.26 120.26 1fzp h ALA 19 Ca 0.34 0.14 0.07 0.00 0.00 0.00 0.00 54.91 55.46 1fzp h ALA 19 Cb 0.52 0.25 -0.08 0.00 0.00 0.00 0.00 17.79 18.48 1fzp h ALA 19 CO -0.42 -0.39 -0.33 -0.44 0.00 0.00 0.00 179.25 177.67 1fzp h ASP 20 N 0.10 -1.07 0.00 0.00 3.32 -1.14 -2.81 116.42 114.83 1fzp h ASP 20 Ca 0.24 0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.46 1fzp h ASP 20 Cb 0.35 0.48 0.00 0.00 0.22 0.00 0.00 39.33 40.39 1fzp h ASP 20 CO -0.40 -0.34 0.00 0.29 -1.72 0.00 0.00 179.24 177.07 1fzp n LYS 21 N -5.41 0.00 -0.39 3.56 5.02 -0.63 -2.66 118.16 117.65 1fzp n LYS 21 Ca -0.01 0.16 0.30 0.00 -2.02 0.00 0.00 58.31 56.74 1fzp n LYS 21 Cb 0.33 -0.78 0.46 0.00 -0.02 0.00 0.00 35.03 35.02 1fzp n LYS 21 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1fzp n LEU 22 N -0.44 0.01 -0.04 -0.35 4.32 -0.92 0.30 117.00 119.88 1fzp n LEU 22 Ca 0.00 0.57 -0.16 0.00 -0.02 0.00 0.00 56.01 56.40 1fzp n LEU 22 Cb 0.00 -0.29 -0.07 0.00 -1.62 0.00 0.00 43.42 41.44 1fzp n LEU 22 CO 0.00 -0.58 0.35 0.11 -1.22 0.00 0.00 177.39 176.05 1fzp h LYS 23 N 0.00 0.69 -0.26 3.23 1.57 -1.26 -3.17 116.57 117.37 1fzp h LYS 23 Ca 0.53 -0.53 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 1fzp h LYS 23 Cb 2.09 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 34.49 1fzp h LYS 23 CO -0.02 1.15 -0.48 1.03 -0.57 0.00 0.00 179.45 180.55 1fzp h SER 24 N 0.38 0.76 -0.73 0.86 0.87 0.46 -2.22 113.55 113.93 1fzp h SER 24 Ca -0.03 -0.38 0.16 0.00 -1.23 0.00 0.00 61.79 60.31 1fzp h SER 24 Cb 1.23 -0.21 -0.11 0.00 -0.44 0.00 0.00 62.40 62.87 1fzp h SER 24 CO 0.13 1.11 0.18 0.25 -0.53 0.00 0.00 176.83 177.97 1fzp h LEU 25 N 0.55 0.02 -0.59 2.23 5.85 -1.49 0.53 115.31 122.41 1fzp h LEU 25 Ca 0.03 0.14 -0.11 0.00 0.84 0.00 0.00 57.88 58.78 1fzp h LEU 25 Cb 1.04 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.24 1fzp h LEU 25 CO 0.10 -0.03 -0.51 0.40 -0.34 0.00 0.00 178.44 178.06 1fzp h ILE 26 N 0.27 1.04 0.71 4.05 2.04 -1.52 -1.95 117.51 122.16 1fzp h ILE 26 Ca 0.41 -1.97 -0.03 0.00 1.00 0.00 0.00 64.86 64.26 1fzp h ILE 26 Cb 0.69 2.18 0.01 0.00 -0.74 0.00 0.00 36.82 38.95 1fzp h ILE 26 CO -0.50 0.49 -0.34 0.11 0.00 0.00 0.00 178.15 177.91 1fzp h LYS 27 N 0.00 -0.92 0.04 2.37 1.57 0.60 -2.32 116.57 117.92 1fzp h LYS 27 Ca -0.01 0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1fzp h LYS 27 Cb 1.13 0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.65 1fzp h LYS 27 CO 0.07 -0.61 -0.02 -0.22 -0.57 0.00 0.00 179.45 178.10 1fzp h LYS 28 N -1.10 -0.05 -0.15 3.15 3.11 -1.06 -3.12 116.57 117.35 1fzp h LYS 28 Ca -0.10 0.00 0.04 0.00 -2.81 0.00 0.00 60.65 57.79 1fzp h LYS 28 Cb 0.73 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.96 1fzp h LYS 28 CO 0.16 0.45 0.28 1.49 -2.81 0.00 0.00 179.45 179.01 1fzp h GLU 29 N -0.57 0.00 0.00 1.90 4.57 -1.49 -3.45 114.58 115.54 1fzp h GLU 29 Ca -0.01 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1fzp h GLU 29 Cb 0.52 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 1fzp h GLU 29 CO 0.01 0.00 0.00 1.97 -1.18 0.00 0.00 179.01 179.81 1fzp n PHE 30 N -3.39 0.00 -0.43 0.92 1.16 -1.02 -5.07 117.46 109.64 1fzp n PHE 30 Ca 0.01 0.00 -0.04 0.00 -1.87 0.00 0.00 57.45 55.55 1fzp n PHE 30 Cb 0.38 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.25 1fzp n PHE 30 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 1fzp n SER 31 N 0.00 -1.19 0.00 5.98 3.41 -0.90 -4.53 113.62 116.39 1fzp n SER 31 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1fzp n SER 31 Cb 0.00 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 1fzp n SER 31 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fzp n ILE 32 N -1.67 0.00 0.00 -1.33 0.13 -1.26 -3.57 119.36 111.66 1fzp n ILE 32 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 1fzp n ILE 32 Cb 0.09 -0.06 0.00 0.00 -0.84 0.00 0.00 39.64 38.82 1fzp n ILE 32 CO 0.00 0.00 0.00 -1.54 2.80 0.00 0.00 176.55 177.81 1fzp n SER 33 N -1.88 0.00 0.12 9.51 3.41 -1.26 0.39 113.62 123.91 1fzp n SER 33 Ca 0.00 0.25 0.06 0.00 -0.26 0.00 0.00 58.87 58.92 1fzp n SER 33 Cb 0.00 -0.25 0.02 0.00 -0.26 0.00 0.00 64.21 63.73 1fzp n SER 33 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1fzp h PHE 34 N 0.00 0.00 0.00 7.33 -0.00 -1.96 1.80 116.94 124.11 1fzp h PHE 34 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1fzp h PHE 34 Cb 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.17 1fzp h PHE 34 CO 0.00 0.30 0.00 1.49 -0.00 0.00 0.00 178.31 180.10 1fzp h GLU 35 N 0.00 0.00 0.00 1.11 4.57 0.70 -3.21 114.58 117.75 1fzp h GLU 35 Ca -0.04 0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 57.92 1fzp h GLU 35 Cb 1.26 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.81 1fzp h GLU 35 CO 0.03 0.00 -1.81 0.39 -1.18 0.00 0.00 179.01 176.44 1fzp n GLU 36 N -3.01 1.77 -0.12 1.92 4.71 -1.12 -4.19 120.64 120.60 1fzp n GLU 36 Ca 0.03 0.01 0.27 0.00 -0.01 0.00 0.00 57.16 57.46 1fzp n GLU 36 Cb 0.44 -1.30 0.72 0.00 -1.01 0.00 0.00 31.44 30.29 1fzp n GLU 36 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 177.13 177.57 1fzp h PHE 37 N 0.00 0.00 0.00 -0.32 3.57 0.28 3.27 116.94 123.74 1fzp h PHE 37 Ca -0.32 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.12 1fzp h PHE 37 Cb 1.69 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.42 1fzp h PHE 37 CO 0.00 0.00 -0.46 0.00 -2.23 0.00 0.00 178.31 175.63 1fzp h ALA 38 N 1.44 0.06 0.00 2.41 0.00 -1.78 -3.32 119.26 118.06 1fzp h ALA 38 Ca 0.38 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1fzp h ALA 38 Cb 1.70 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 19.83 1fzp h ALA 38 CO -0.00 0.33 -0.03 -0.24 0.00 0.00 0.00 179.25 179.30 1fzp h VAL 39 N -1.00 0.41 -0.15 0.00 3.04 -1.50 0.66 116.25 117.71 1fzp h VAL 39 Ca -0.08 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.46 1fzp h VAL 39 Cb 0.65 1.10 -0.01 0.00 -2.01 0.00 0.00 31.29 31.02 1fzp h VAL 39 CO -0.05 0.03 0.10 0.17 -1.01 0.00 0.00 177.57 176.81 1fzp h LEU 40 N 0.00 0.16 -1.57 3.16 8.10 0.59 0.19 115.31 125.94 1fzp h LEU 40 Ca -0.00 -0.00 0.13 0.00 0.11 0.00 0.00 57.88 58.12 1fzp h LEU 40 Cb 0.10 -0.04 -0.05 0.00 -0.44 0.00 0.00 40.66 40.23 1fzp h LEU 40 CO 0.00 0.12 0.48 0.71 -4.11 0.00 0.00 178.44 175.64 1fzp h THR 41 N 0.19 0.83 -0.00 0.15 1.35 -0.96 0.71 112.91 115.18 1fzp h THR 41 Ca 0.06 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 1fzp h THR 41 Cb 0.00 0.35 0.00 0.00 -1.73 0.00 0.00 68.15 66.77 1fzp h THR 41 CO -0.01 0.08 -0.63 0.00 -0.25 0.00 0.00 175.52 174.71 1fzp n TYR 42 N -4.48 0.00 -4.15 4.73 9.36 -0.04 -4.99 117.16 117.60 1fzp n TYR 42 Ca 0.13 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 61.24 1fzp n TYR 42 Cb 0.48 -0.09 -0.09 0.00 -0.63 0.00 0.00 39.34 39.00 1fzp n TYR 42 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1fzp s ILE 43 N -2.82 0.03 -0.10 2.97 1.10 0.24 -5.06 121.20 117.57 1fzp s ILE 43 Ca 0.14 -1.86 0.06 0.00 -0.51 0.00 0.00 60.65 58.47 1fzp s ILE 43 Cb 0.17 -2.30 -0.10 0.00 0.15 0.00 0.00 42.46 40.38 1fzp s ILE 43 CO 0.71 -0.14 -0.01 -1.54 -2.11 0.00 0.00 174.94 171.85 1fzp n SER 44 N -0.23 2.84 -0.00 4.50 3.41 -1.26 -4.54 113.62 118.34 1fzp n SER 44 Ca -0.01 -0.02 0.23 0.00 -0.26 0.00 0.00 58.87 58.81 1fzp n SER 44 Cb 0.65 0.47 0.72 0.00 -0.26 0.00 0.00 64.21 65.79 1fzp n SER 44 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1fzp h GLU 45 N 0.00 0.00 0.00 4.33 4.22 -1.97 1.71 114.58 122.87 1fzp h GLU 45 Ca -0.25 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.19 1fzp h GLU 45 Cb 1.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.77 1fzp h GLU 45 CO -0.00 0.00 0.00 0.09 -2.18 0.00 0.00 179.01 176.92 1fzp n ASN 46 N -3.86 0.00 0.08 1.04 5.03 -1.26 -3.25 115.26 113.04 1fzp n ASN 46 Ca 0.11 -0.80 -0.00 0.00 0.87 0.00 0.00 54.58 54.76 1fzp n ASN 46 Cb 0.76 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 39.48 1fzp n ASN 46 CO 0.00 0.00 0.00 0.11 -1.83 0.00 0.00 177.26 175.54 1fzp h LYS 47 N 0.00 0.00 0.04 3.52 1.79 0.23 -3.32 116.57 118.82 1fzp h LYS 47 Ca 0.00 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 58.13 1fzp h LYS 47 Cb 0.00 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.61 1fzp h LYS 47 CO 0.00 0.46 -1.92 -1.91 -1.08 0.00 0.00 179.45 175.00 1fzp n GLU 48 N -3.08 0.64 0.04 3.15 0.00 -1.20 -3.34 120.64 116.85 1fzp n GLU 48 Ca -0.04 0.36 0.19 0.00 0.00 0.00 0.00 57.16 57.66 1fzp n GLU 48 Cb 0.82 -1.65 0.48 0.00 0.00 0.00 0.00 31.44 31.08 1fzp n GLU 48 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 1fzp h LYS 49 N -0.52 0.00 0.51 5.31 3.64 -1.77 0.26 116.57 124.00 1fzp h LYS 49 Ca -0.48 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 58.88 1fzp h LYS 49 Cb 1.68 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.51 1fzp h LYS 49 CO -0.14 0.00 -0.25 1.49 -2.27 0.00 0.00 179.45 178.28 1fzp h GLU 50 N 0.00 -0.66 0.01 1.90 4.22 -1.66 -3.29 114.58 115.11 1fzp h GLU 50 Ca 0.26 0.05 -0.24 0.00 0.08 0.00 0.00 59.36 59.51 1fzp h GLU 50 Cb 2.00 0.15 -0.03 0.00 0.50 0.00 0.00 28.75 31.37 1fzp h GLU 50 CO -0.00 -0.44 -1.20 1.88 -2.18 0.00 0.00 179.01 177.07 1fzp h TYR 51 N -0.94 0.06 0.00 0.92 0.05 -1.00 0.15 116.97 116.21 1fzp h TYR 51 Ca -0.07 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.67 1fzp h TYR 51 Cb 0.53 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.26 1fzp h TYR 51 CO 0.04 1.04 0.01 0.98 -1.05 0.00 0.00 178.16 179.18 1fzp n TYR 52 N -3.30 0.45 0.00 4.88 -0.00 0.72 -3.38 117.16 116.53 1fzp n TYR 52 Ca -0.05 0.24 0.00 0.00 -0.00 0.00 0.00 57.90 58.09 1fzp n TYR 52 Cb 0.98 -0.87 0.00 0.00 -0.00 0.00 0.00 39.34 39.44 1fzp n TYR 52 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.86 178.14 1fzp n LEU 53 N -1.97 2.00 0.00 2.98 7.99 -1.22 -4.45 117.00 122.33 1fzp n LEU 53 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.99 1fzp n LEU 53 Cb 0.03 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.34 1fzp n LEU 53 CO 0.06 0.33 0.39 1.17 -1.51 0.00 0.00 177.39 177.83 1fzp n LYS 54 N -2.17 0.00 -0.48 3.23 4.81 0.52 0.21 118.16 124.27 1fzp n LYS 54 Ca 0.00 0.21 0.00 0.00 -0.87 0.00 0.00 58.31 57.65 1fzp n LYS 54 Cb 0.34 -1.63 0.00 0.00 0.02 0.00 0.00 35.03 33.76 1fzp n LYS 54 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1fzp n ASP 55 N -1.15 0.00 -2.73 3.14 -0.08 -1.24 -5.04 116.55 109.45 1fzp n ASP 55 Ca 0.00 -1.97 -0.03 0.00 -1.51 0.00 0.00 54.79 51.28 1fzp n ASP 55 Cb 0.13 -0.19 0.09 0.00 2.34 0.00 0.00 41.12 43.49 1fzp n ASP 55 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 1fzp n ILE 56 N -0.00 0.53 0.00 5.18 -0.00 0.13 -5.10 119.36 120.10 1fzp n ILE 56 Ca 0.00 -1.95 0.00 0.00 -0.00 0.00 0.00 62.75 60.80 1fzp n ILE 56 Cb 0.69 1.05 0.00 0.00 -0.00 0.00 0.00 39.64 41.39 1fzp n ILE 56 CO 0.00 0.00 0.00 0.55 -0.00 0.00 0.00 176.55 177.10 1fzp n VAL 67 N -0.91 0.00 0.10 1.39 3.14 -1.26 -4.88 118.33 115.91 1fzp n VAL 67 Ca -0.04 0.00 -0.22 0.00 -2.96 0.00 0.00 64.34 61.12 1fzp n VAL 67 Cb 0.84 0.00 -0.13 0.00 -1.06 0.00 0.00 33.84 33.49 1fzp n VAL 67 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 1fzp h VAL 68 N 0.00 1.31 0.00 1.55 2.07 -2.04 -2.58 116.25 116.55 1fzp h VAL 68 Ca 0.00 -2.58 0.00 0.00 0.82 0.00 0.00 66.70 64.94 1fzp h VAL 68 Cb 0.00 2.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.55 1fzp h VAL 68 CO 0.00 0.78 0.00 2.29 0.02 0.00 0.00 177.57 180.66 1fzp n LYS 69 N -3.74 0.47 -0.11 1.57 -0.00 -1.26 -0.30 118.16 114.78 1fzp n LYS 69 Ca -0.13 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 57.97 1fzp n LYS 69 Cb 1.01 -1.50 -0.08 0.00 -0.00 0.00 0.00 35.03 34.46 1fzp n LYS 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1fzp n ALA 70 N -1.00 0.93 -0.10 0.58 0.00 -1.08 -3.33 120.51 116.52 1fzp n ALA 70 Ca 0.11 -0.79 -0.07 0.00 0.00 0.00 0.00 53.44 52.69 1fzp n ALA 70 Cb 0.05 -0.11 0.10 0.00 0.00 0.00 0.00 19.45 19.49 1fzp n ALA 70 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1fzp h VAL 71 N -1.00 1.27 -0.76 0.00 3.04 -1.11 0.25 116.25 117.94 1fzp h VAL 71 Ca -0.40 -1.27 0.07 0.00 -1.01 0.00 0.00 66.70 64.10 1fzp h VAL 71 Cb 1.28 1.13 -0.06 0.00 -2.01 0.00 0.00 31.29 31.63 1fzp h VAL 71 CO -0.24 0.43 0.43 0.50 -1.01 0.00 0.00 177.57 177.68 1fzp h LYS 72 N 0.70 0.75 -0.04 4.17 1.63 -0.86 0.74 116.57 123.67 1fzp h LYS 72 Ca 0.11 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.82 1fzp h LYS 72 Cb 0.68 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 32.14 1fzp h LYS 72 CO 0.05 0.49 -0.13 0.82 -3.45 0.00 0.00 179.45 177.23 1fzp h ILE 73 N 0.77 1.46 -0.57 2.00 5.03 -1.43 -1.63 117.51 123.14 1fzp h ILE 73 Ca 0.35 -1.56 0.03 0.00 -0.12 0.00 0.00 64.86 63.56 1fzp h ILE 73 Cb 0.25 2.39 -0.04 0.00 -3.03 0.00 0.00 36.82 36.40 1fzp h ILE 73 CO -0.21 0.43 0.34 0.25 -0.68 0.00 0.00 178.15 178.28 1fzp h LEU 74 N -0.40 0.54 0.03 1.44 7.12 -0.04 0.40 115.31 124.40 1fzp h LEU 74 Ca -0.01 0.01 -0.00 0.00 0.13 0.00 0.00 57.88 58.01 1fzp h LEU 74 Cb 0.76 -0.11 0.00 0.00 -0.53 0.00 0.00 40.66 40.78 1fzp h LEU 74 CO 0.03 0.38 -0.01 -1.28 -0.13 0.00 0.00 178.44 177.42 1fzp h SER 75 N 0.67 -0.03 0.39 1.25 0.87 0.43 -1.26 113.55 115.87 1fzp h SER 75 Ca 0.23 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1fzp h SER 75 Cb 0.04 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1fzp h SER 75 CO -0.11 0.08 0.00 0.00 -0.53 0.00 0.00 176.83 176.27 1fzp n GLN 76 N -5.06 0.11 0.03 2.24 -0.00 -0.62 -0.68 117.38 113.41 1fzp n GLN 76 Ca -0.08 0.19 0.11 0.00 -0.00 0.00 0.00 57.00 57.23 1fzp n GLN 76 Cb 0.09 -1.50 0.07 0.00 -0.00 0.00 0.00 30.24 28.90 1fzp n GLN 76 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 1fzp n GLU 77 N -1.39 0.26 -0.02 2.61 0.00 0.14 -3.71 120.64 118.53 1fzp n GLU 77 Ca 0.05 0.02 -0.12 0.00 0.00 0.00 0.00 57.16 57.11 1fzp n GLU 77 Cb 0.14 -1.61 -0.14 0.00 0.00 0.00 0.00 31.44 29.84 1fzp n GLU 77 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1fzp n ASP 78 N -1.96 1.20 -0.26 4.31 -0.08 0.14 -2.83 116.55 117.08 1fzp n ASP 78 Ca 0.03 0.33 0.13 0.00 -1.51 0.00 0.00 54.79 53.76 1fzp n ASP 78 Cb 0.43 -0.24 0.39 0.00 2.34 0.00 0.00 41.12 44.04 1fzp n ASP 78 CO 0.00 0.00 0.00 1.88 0.12 0.00 0.00 177.20 179.20 1fzp h TYR 79 N 0.02 0.78 0.00 -0.67 0.99 -1.31 -1.20 116.97 115.59 1fzp h TYR 79 Ca -0.34 0.02 -0.23 0.00 2.00 0.00 0.00 58.73 60.18 1fzp h TYR 79 Cb 2.03 -0.25 -0.04 0.00 1.00 0.00 0.00 36.73 39.48 1fzp h TYR 79 CO 0.02 0.28 -1.51 0.27 -0.00 0.00 0.00 178.16 177.22 1fzp h PHE 80 N 0.66 0.00 0.00 4.88 -0.00 -1.68 -3.32 116.94 117.48 1fzp h PHE 80 Ca 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.42 1fzp h PHE 80 Cb 0.76 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.71 1fzp h PHE 80 CO -0.00 0.79 0.00 -0.44 -0.00 0.00 0.00 178.31 178.66 1fzp h ASP 81 N 0.00 0.00 0.10 -0.68 5.19 -1.07 -2.90 116.42 117.05 1fzp h ASP 81 Ca -0.21 0.00 -0.37 0.00 -0.62 0.00 0.00 57.03 55.83 1fzp h ASP 81 Cb 1.79 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 41.26 1fzp h ASP 81 CO 0.06 0.00 -2.15 1.17 -3.12 0.00 0.00 179.24 175.21 1fzp n LYS 82 N -3.00 0.72 0.29 3.56 4.81 -0.91 -3.39 118.16 120.24 1fzp n LYS 82 Ca -0.00 0.22 0.15 0.00 -0.87 0.00 0.00 58.31 57.80 1fzp n LYS 82 Cb 0.22 -1.65 0.89 0.00 0.02 0.00 0.00 35.03 34.51 1fzp n LYS 82 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 1fzp h LYS 83 N 0.05 0.00 0.04 1.64 3.64 -1.62 0.25 116.57 120.56 1fzp h LYS 83 Ca -0.47 0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 58.54 1fzp h LYS 83 Cb 2.00 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.77 1fzp h LYS 83 CO 0.03 0.00 -2.22 -2.13 -2.27 0.00 0.00 179.45 172.86 1fzp n ARG 84 N -3.91 0.69 0.02 1.90 0.00 -1.11 -2.16 116.66 112.09 1fzp n ARG 84 Ca -0.03 0.18 0.00 0.00 -0.00 0.00 0.00 57.85 58.01 1fzp n ARG 84 Cb 0.10 -1.61 0.31 0.00 0.00 0.00 0.00 32.46 31.25 1fzp n ARG 84 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.63 176.66 1fzp h ASN 85 N 0.02 0.44 -0.06 6.15 -0.00 -1.54 -0.25 115.58 120.35 1fzp h ASN 85 Ca -0.49 -0.09 -0.03 0.00 -0.00 0.00 0.00 56.30 55.69 1fzp h ASN 85 Cb 2.01 -0.12 -0.00 0.00 -0.00 0.00 0.00 38.32 40.21 1fzp h ASN 85 CO 0.01 0.54 -0.09 1.05 -0.00 0.00 0.00 177.43 178.93 1fzp h GLU 86 N 0.45 0.17 0.00 6.67 4.11 -0.64 -3.03 114.58 122.31 1fzp h GLU 86 Ca 0.10 -0.10 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1fzp h GLU 86 Cb 0.35 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1fzp h GLU 86 CO 0.01 0.66 0.00 -2.39 0.07 0.00 0.00 179.01 177.37 1fzp n HIS 87 N -4.68 0.45 0.34 2.06 1.44 -0.92 -2.38 115.22 111.54 1fzp n HIS 87 Ca -0.08 0.20 0.03 0.00 -2.01 0.00 0.00 57.72 55.87 1fzp n HIS 87 Cb 0.34 -0.83 0.17 0.00 0.12 0.00 0.00 29.99 29.78 1fzp n HIS 87 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1fzp n ASP 88 N -1.94 0.00 -0.01 4.39 9.92 -0.14 0.42 116.55 129.18 1fzp n ASP 88 Ca 0.01 -0.09 0.02 0.00 -0.53 0.00 0.00 54.79 54.20 1fzp n ASP 88 Cb 0.11 -0.07 -0.07 0.00 -0.64 0.00 0.00 41.12 40.45 1fzp n ASP 88 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1fzp n GLU 89 N -1.07 0.90 -0.03 -1.24 -0.58 -1.00 -4.11 120.64 113.52 1fzp n GLU 89 Ca 0.04 -0.07 -0.02 0.00 -0.42 0.00 0.00 57.16 56.70 1fzp n GLU 89 Cb 0.03 -1.23 -0.01 0.00 -0.57 0.00 0.00 31.44 29.66 1fzp n GLU 89 CO 0.00 0.00 0.00 0.07 -0.48 0.00 0.00 177.13 176.72 1fzp h ARG 90 N 0.00 0.00 0.00 3.49 -0.00 -0.18 -3.34 114.38 114.34 1fzp h ARG 90 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.92 1fzp h ARG 90 Cb 0.74 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.71 1fzp h ARG 90 CO 0.00 0.00 0.11 2.41 -0.00 0.00 0.00 179.97 182.50 1fzp n THR 91 N -3.17 0.96 0.00 0.08 -1.04 0.45 -2.05 114.28 109.51 1fzp n THR 91 Ca -0.02 0.71 0.00 0.00 -2.04 0.00 0.00 64.05 62.70 1fzp n THR 91 Cb 0.09 -1.71 0.00 0.00 -1.82 0.00 0.00 70.33 66.89 1fzp n THR 91 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1fzp n VAL 92 N -2.09 0.00 0.11 12.58 0.31 -1.25 0.04 118.33 128.03 1fzp n VAL 92 Ca -0.01 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.12 1fzp n VAL 92 Cb 0.14 -0.70 -0.13 0.00 -0.91 0.00 0.00 33.84 32.24 1fzp n VAL 92 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1fzp h LEU 93 N 0.00 0.72 -0.37 7.52 6.46 -1.67 -3.15 115.31 124.81 1fzp h LEU 93 Ca 0.00 -0.70 -0.02 0.00 -0.12 0.00 0.00 57.88 57.04 1fzp h LEU 93 Cb 0.00 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 39.68 1fzp h LEU 93 CO 0.00 1.53 0.14 -0.29 -0.62 0.00 0.00 178.44 179.19 1fzp h ILE 94 N 0.19 1.20 -0.14 4.05 2.10 -0.66 3.46 117.51 127.71 1fzp h ILE 94 Ca -0.18 -0.62 0.05 0.00 1.08 0.00 0.00 64.86 65.19 1fzp h ILE 94 Cb 1.95 0.91 -0.06 0.00 -1.09 0.00 0.00 36.82 38.53 1fzp h ILE 94 CO 0.23 0.22 -0.25 0.17 -1.08 0.00 0.00 178.15 177.44 1fzp h LEU 95 N 0.45 -0.76 -0.30 2.19 8.10 -1.64 2.31 115.31 125.65 1fzp h LEU 95 Ca 0.12 0.12 -0.20 0.00 0.11 0.00 0.00 57.88 58.03 1fzp h LEU 95 Cb 0.21 0.34 0.00 0.00 -0.44 0.00 0.00 40.66 40.77 1fzp h LEU 95 CO -0.01 -0.30 -0.73 0.58 -4.11 0.00 0.00 178.44 173.88 1fzp h VAL 96 N -0.31 1.32 -0.85 0.15 2.07 -1.49 -2.37 116.25 114.78 1fzp h VAL 96 Ca 0.10 -2.02 0.08 0.00 0.82 0.00 0.00 66.70 65.69 1fzp h VAL 96 Cb 0.46 2.00 -0.07 0.00 -1.52 0.00 0.00 31.29 32.16 1fzp h VAL 96 CO -0.31 0.62 0.51 0.78 0.02 0.00 0.00 177.57 179.19 1fzp h ASN 97 N 0.43 0.76 0.46 0.57 4.21 0.87 4.01 115.58 126.89 1fzp h ASN 97 Ca -0.04 0.03 -0.02 0.00 1.21 0.00 0.00 56.30 57.49 1fzp h ASN 97 Cb 1.33 -0.12 0.00 0.00 -1.12 0.00 0.00 38.32 38.41 1fzp h ASN 97 CO 0.14 0.46 -0.22 0.00 -1.29 0.00 0.00 177.43 176.52 1fzp h ALA 98 N 1.44 -0.89 -0.18 -0.83 0.00 0.38 -3.08 119.26 116.09 1fzp h ALA 98 Ca 0.39 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.22 1fzp h ALA 98 Cb 0.29 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1fzp h ALA 98 CO -0.21 -0.84 0.20 0.37 0.00 0.00 0.00 179.25 178.76 1fzp h GLN 99 N -0.79 0.00 0.00 0.00 4.15 -1.13 -3.26 115.11 114.08 1fzp h GLN 99 Ca -0.06 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.36 1fzp h GLN 99 Cb 0.47 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.16 1fzp h GLN 99 CO 0.10 0.00 0.00 1.04 -1.93 0.00 0.00 178.83 178.04 1fzp n GLN 100 N -3.84 0.00 0.26 1.69 6.02 1.32 -2.44 117.38 120.38 1fzp n GLN 100 Ca 0.02 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.05 1fzp n GLN 100 Cb 0.32 0.00 0.24 0.00 1.02 0.00 0.00 30.24 31.82 1fzp n GLN 100 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fzp h ARG 101 N 0.00 0.00 0.33 -1.09 3.08 -1.79 0.13 114.38 115.05 1fzp h ARG 101 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1fzp h ARG 101 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1fzp h ARG 101 CO 0.00 0.00 -0.16 1.57 -1.07 0.00 0.00 179.97 180.31 1fzp h LYS 102 N 0.00 -0.43 -0.28 0.04 2.10 -1.71 4.25 116.57 120.54 1fzp h LYS 102 Ca 0.00 0.03 -0.10 0.00 -2.00 0.00 0.00 60.65 58.58 1fzp h LYS 102 Cb 1.34 0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 32.75 1fzp h LYS 102 CO 0.00 -0.11 -0.25 -0.22 -2.00 0.00 0.00 179.45 176.88 1fzp h LYS 103 N -0.88 0.55 0.00 0.07 3.64 -0.69 0.40 116.57 119.65 1fzp h LYS 103 Ca -0.05 -0.21 -0.00 0.00 -1.27 0.00 0.00 60.65 59.12 1fzp h LYS 103 Cb 0.53 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1fzp h LYS 103 CO 0.08 0.75 -0.01 0.82 -2.27 0.00 0.00 179.45 178.82 1fzp h ILE 104 N 0.49 0.21 -0.07 2.00 5.03 -0.59 1.41 117.51 125.99 1fzp h ILE 104 Ca 0.07 -0.09 -0.21 0.00 -0.12 0.00 0.00 64.86 64.51 1fzp h ILE 104 Cb 0.69 1.07 0.00 0.00 -3.03 0.00 0.00 36.82 35.55 1fzp h ILE 104 CO 0.05 0.01 -0.81 -0.08 -0.68 0.00 0.00 178.15 176.64 1fzp h GLU 105 N 0.00 0.49 -0.13 2.37 4.57 1.26 -2.70 114.58 120.43 1fzp h GLU 105 Ca -0.00 -0.44 -0.07 0.00 -1.18 0.00 0.00 59.36 57.66 1fzp h GLU 105 Cb 0.07 0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.77 1fzp h GLU 105 CO 0.00 1.08 -0.20 0.77 -1.18 0.00 0.00 179.01 179.48 1fzp h SER 106 N 0.32 0.41 -0.15 1.04 0.02 0.30 -2.61 113.55 112.87 1fzp h SER 106 Ca -0.05 -0.53 0.04 0.00 -0.84 0.00 0.00 61.79 60.41 1fzp h SER 106 Cb 1.42 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.84 1fzp h SER 106 CO 0.15 0.86 0.27 0.25 -1.14 0.00 0.00 176.83 177.22 1fzp h LEU 107 N -0.02 0.00 -1.77 5.07 7.12 0.15 2.64 115.31 128.49 1fzp h LEU 107 Ca 0.01 0.00 0.05 0.00 0.13 0.00 0.00 57.88 58.08 1fzp h LEU 107 Cb 0.77 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.88 1fzp h LEU 107 CO 0.05 0.00 0.26 0.25 -0.13 0.00 0.00 178.44 178.86 1fzp h LEU 108 N 0.00 0.25 -0.59 2.25 5.85 -1.12 1.03 115.31 122.98 1fzp h LEU 108 Ca 0.07 -0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.64 1fzp h LEU 108 Cb 0.62 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 1fzp h LEU 108 CO -0.00 0.17 -0.69 0.28 -0.34 0.00 0.00 178.44 177.85 1fzp h SER 109 N 0.29 0.09 0.11 1.25 0.02 0.46 -3.12 113.55 112.64 1fzp h SER 109 Ca 0.17 -0.06 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1fzp h SER 109 Cb 0.29 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.78 1fzp h SER 109 CO -0.03 0.75 -0.21 -0.09 -1.14 0.00 0.00 176.83 176.11 1fzp h ARG 110 N 0.05 -0.38 0.00 3.45 2.43 0.14 -3.52 114.38 116.55 1fzp h ARG 110 Ca -0.01 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1fzp h ARG 110 Cb 1.23 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 1fzp h ARG 110 CO 0.10 -0.25 0.00 1.33 -1.51 0.00 0.00 179.97 179.63