#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zpq n ASN 5 N 0.00 0.24 0.14 0.00 4.13 -1.26 -2.46 115.26 116.05 1zpq n ASN 5 Ca 0.00 0.11 0.12 0.00 1.68 0.00 0.00 54.58 56.49 1zpq n ASN 5 Cb 0.00 0.79 0.50 0.00 -1.54 0.00 0.00 39.78 39.53 1zpq n ASN 5 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 1zpq n LYS 6 N -2.79 0.21 -0.09 3.52 4.81 -1.26 -1.31 118.16 121.25 1zpq n LYS 6 Ca -0.26 0.43 -0.12 0.00 -0.87 0.00 0.00 58.31 57.49 1zpq n LYS 6 Cb 1.08 -1.90 -0.10 0.00 0.02 0.00 0.00 35.03 34.14 1zpq n LYS 6 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 1zpq n ARG 7 N -2.29 0.73 -0.00 1.64 0.63 -1.25 -3.37 116.66 112.75 1zpq n ARG 7 Ca 0.02 0.08 -0.06 0.00 -0.92 0.00 0.00 57.85 56.98 1zpq n ARG 7 Cb 0.24 -1.39 0.15 0.00 0.45 0.00 0.00 32.46 31.90 1zpq n ARG 7 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 1zpq h ASN 8 N 0.00 0.55 0.66 6.15 4.21 -1.57 -2.61 115.58 122.98 1zpq h ASN 8 Ca -0.43 -0.22 0.00 0.00 1.21 0.00 0.00 56.30 56.86 1zpq h ASN 8 Cb 1.73 -0.15 0.00 0.00 -1.12 0.00 0.00 38.32 38.78 1zpq h ASN 8 CO -0.05 0.85 -0.32 -0.62 -1.29 0.00 0.00 177.43 176.00 1zpq n GLU 9 N -4.07 0.03 -0.08 0.81 4.71 -0.42 -1.29 120.64 120.32 1zpq n GLU 9 Ca -0.01 -0.01 -0.16 0.00 -0.01 0.00 0.00 57.16 56.97 1zpq n GLU 9 Cb 0.46 -1.50 -0.11 0.00 -1.01 0.00 0.00 31.44 29.28 1zpq n GLU 9 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1zpq h ALA 10 N 3.02 0.12 -0.25 0.62 0.00 -1.55 -3.03 119.26 118.19 1zpq h ALA 10 Ca 0.00 -0.78 0.07 0.00 0.00 0.00 0.00 54.91 54.20 1zpq h ALA 10 Cb 0.50 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1zpq h ALA 10 CO 0.00 0.33 0.26 1.25 0.00 0.00 0.00 179.25 181.10 1zpq h LEU 11 N -1.00 0.00 -1.56 0.00 5.85 -1.50 -0.08 115.31 117.02 1zpq h LEU 11 Ca -0.15 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 1zpq h LEU 11 Cb 1.05 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 1zpq h LEU 11 CO -0.09 0.00 0.09 -0.09 -0.34 0.00 0.00 178.44 178.01 1zpq h ARG 12 N 0.00 0.38 0.08 1.25 2.43 -1.07 -0.30 114.38 117.16 1zpq h ARG 12 Ca 0.12 -0.05 -0.31 0.00 -0.81 0.00 0.00 59.98 58.93 1zpq h ARG 12 Cb 0.65 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.10 1zpq h ARG 12 CO -0.00 0.34 -1.65 0.82 -1.51 0.00 0.00 179.97 177.97 1zpq h ILE 13 N 0.39 0.99 -0.86 1.20 2.04 -1.22 -2.28 117.51 117.77 1zpq h ILE 13 Ca 0.10 -2.70 0.04 0.00 1.00 0.00 0.00 64.86 63.29 1zpq h ILE 13 Cb 0.11 2.63 -0.05 0.00 -0.74 0.00 0.00 36.82 38.76 1zpq h ILE 13 CO -0.01 0.76 0.57 -0.08 0.00 0.00 0.00 178.15 179.39 1zpq h GLU 14 N 0.05 1.02 -0.21 2.37 4.81 -0.43 -0.61 114.58 121.57 1zpq h GLU 14 Ca -0.28 -0.06 -0.19 0.00 -0.13 0.00 0.00 59.36 58.70 1zpq h GLU 14 Cb 2.01 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 31.16 1zpq h GLU 14 CO 0.12 0.67 -0.61 1.03 -0.73 0.00 0.00 179.01 179.50 1zpq h SER 15 N 1.05 0.90 1.04 1.04 0.87 -1.11 -1.14 113.55 116.19 1zpq h SER 15 Ca 0.35 -0.58 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 1zpq h SER 15 Cb 0.07 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.77 1zpq h SER 15 CO -0.11 1.32 0.00 0.00 -0.53 0.00 0.00 176.83 177.51 1zpq h ALA 16 N 0.60 1.00 0.05 6.23 0.00 -0.67 -1.92 119.26 124.55 1zpq h ALA 16 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1zpq h ALA 16 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1zpq h ALA 16 CO 0.13 0.00 -0.02 1.25 0.00 0.00 0.00 179.25 180.61 1zpq h LEU 17 N 0.00 -0.06 -1.11 0.00 5.85 -0.98 -1.96 115.31 117.05 1zpq h LEU 17 Ca 0.00 -0.60 0.02 0.00 0.84 0.00 0.00 57.88 58.13 1zpq h LEU 17 Cb 0.52 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.52 1zpq h LEU 17 CO 0.00 0.65 0.60 -0.07 -0.34 0.00 0.00 178.44 179.28 1zpq h LEU 18 N -0.85 1.02 -0.83 2.25 3.38 -1.20 -1.97 115.31 117.12 1zpq h LEU 18 Ca -0.01 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1zpq h LEU 18 Cb 0.66 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1zpq h LEU 18 CO 0.01 0.73 -0.12 -1.13 0.09 0.00 0.00 178.44 178.02 1zpq h ASN 19 N 1.20 0.74 1.40 -0.43 -0.00 -1.39 -2.15 115.58 114.96 1zpq h ASN 19 Ca 0.34 -0.22 0.00 0.00 -0.00 0.00 0.00 56.30 56.42 1zpq h ASN 19 Cb -0.09 -0.20 0.00 0.00 -0.00 0.00 0.00 38.32 38.03 1zpq h ASN 19 CO -0.08 0.88 0.00 0.11 -0.00 0.00 0.00 177.43 178.34 1zpq h LYS 20 N 0.68 0.00 0.41 6.67 1.57 -0.62 -1.58 116.57 123.71 1zpq h LYS 20 Ca 0.12 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 1zpq h LYS 20 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1zpq h LYS 20 CO 0.04 0.00 -0.20 0.82 -0.57 0.00 0.00 179.45 179.54 1zpq h ILE 21 N 0.00 0.24 -0.77 1.86 1.08 -1.23 -3.06 117.51 115.64 1zpq h ILE 21 Ca 0.00 -0.63 0.07 0.00 -0.39 0.00 0.00 64.86 63.90 1zpq h ILE 21 Cb 0.70 0.38 -0.09 0.00 -3.07 0.00 0.00 36.82 34.74 1zpq h ILE 21 CO 0.00 0.05 -0.45 0.00 -0.69 0.00 0.00 178.15 177.06 1zpq n ALA 22 N -2.67 -0.49 -0.23 1.87 0.00 -0.83 -0.21 120.51 117.95 1zpq n ALA 22 Ca -0.08 0.65 0.01 0.00 0.00 0.00 0.00 53.44 54.02 1zpq n ALA 22 Cb 0.26 -0.03 0.10 0.00 0.00 0.00 0.00 19.45 19.78 1zpq n ALA 22 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 1zpq h MET 23 N 0.00 0.04 0.01 0.00 -1.53 -1.34 -3.19 114.93 108.92 1zpq h MET 23 Ca 0.12 -0.00 -0.08 0.00 -3.44 0.00 0.00 59.70 56.30 1zpq h MET 23 Cb 0.31 -0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 31.35 1zpq h MET 23 CO -0.72 0.02 -0.44 1.25 0.14 0.00 0.00 176.91 177.16 1zpq h LEU 24 N 0.04 0.04 0.00 3.39 6.46 -1.11 -3.49 115.31 120.64 1zpq h LEU 24 Ca 0.34 -0.86 0.00 0.00 -0.12 0.00 0.00 57.88 57.25 1zpq h LEU 24 Cb 0.56 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.47 1zpq h LEU 24 CO -0.66 1.18 0.00 0.61 -0.62 0.00 0.00 178.44 178.94 1zpq n GLY 25 N 1.57 3.92 0.31 3.75 0.00 0.70 -4.65 105.19 110.79 1zpq n GLY 25 Ca -0.17 -0.46 0.14 0.00 0.00 0.00 0.00 46.02 45.53 1zpq n GLY 25 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1zpq h THR 26 N 0.00 0.66 0.25 2.61 2.02 -1.77 0.23 112.91 116.91 1zpq h THR 26 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1zpq h THR 26 Cb 0.00 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 67.33 1zpq h THR 26 CO 0.00 0.00 -0.12 -0.33 0.37 0.00 0.00 175.52 175.44 1zpq h GLU 27 N 0.00 -0.33 -0.35 6.66 4.39 -1.90 -3.36 114.58 119.69 1zpq h GLU 27 Ca 0.06 0.02 -0.13 0.00 0.34 0.00 0.00 59.36 59.65 1zpq h GLU 27 Cb 0.28 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1zpq h GLU 27 CO -0.00 -0.09 -0.32 -0.22 -1.16 0.00 0.00 179.01 177.22 1zpq h LYS 28 N -1.03 0.77 -3.01 2.33 1.63 -1.61 -2.69 116.57 112.96 1zpq h LYS 28 Ca -0.03 -0.36 -0.49 0.00 -0.85 0.00 0.00 60.65 58.91 1zpq h LYS 28 Cb 0.39 -0.01 0.01 0.00 -0.60 0.00 0.00 32.23 32.02 1zpq h LYS 28 CO 0.06 0.98 2.79 2.41 -3.45 0.00 0.00 179.45 182.24 1zpq n THR 29 N -4.07 3.41 0.00 1.00 -1.04 0.74 0.19 114.28 114.51 1zpq n THR 29 Ca -0.01 -1.99 0.00 0.00 -2.04 0.00 0.00 64.05 60.01 1zpq n THR 29 Cb 0.49 -2.35 0.00 0.00 -1.82 0.00 0.00 70.33 66.65 1zpq n THR 29 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1zpq n ALA 30 N 3.62 0.00 0.00 2.41 0.00 -1.12 -4.82 120.51 120.60 1zpq n ALA 30 Ca 0.61 0.00 0.00 0.00 0.00 0.00 0.00 53.44 54.05 1zpq n ALA 30 Cb 0.28 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.73 1zpq n ALA 30 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1zpq n GLU 31 N 0.00 0.56 0.00 0.00 -0.00 -0.99 -3.57 120.64 116.65 1zpq n GLU 31 Ca 0.00 -0.00 0.12 0.00 -0.00 0.00 0.00 57.16 57.28 1zpq n GLU 31 Cb 0.00 -0.97 0.69 0.00 -0.00 0.00 0.00 31.44 31.16 1zpq n GLU 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1zpq n ALA 32 N -1.47 2.34 -2.70 -1.84 0.00 0.13 -4.12 120.51 112.85 1zpq n ALA 32 Ca -0.00 -0.14 -0.07 0.00 0.00 0.00 0.00 53.44 53.23 1zpq n ALA 32 Cb 0.01 -1.41 0.11 0.00 0.00 0.00 0.00 19.45 18.15 1zpq n ALA 32 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1zpq n VAL 33 N -1.16 0.00 -0.11 0.00 0.31 -1.26 -5.02 118.33 111.09 1zpq n VAL 33 Ca 0.15 -1.44 0.01 0.00 -0.01 0.00 0.00 64.34 63.05 1zpq n VAL 33 Cb 0.15 1.10 -0.00 0.00 -0.91 0.00 0.00 33.84 34.17 1zpq n VAL 33 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1zpq n GLY 34 N -0.35 -0.12 1.12 2.92 0.00 -1.23 -4.56 105.19 102.97 1zpq n GLY 34 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1zpq n GLY 34 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1zpq n VAL 35 N -0.71 -2.20 -1.53 1.61 0.31 -1.24 -4.19 118.33 110.38 1zpq n VAL 35 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.91 1zpq n VAL 35 Cb 0.04 -2.64 0.01 0.00 -0.91 0.00 0.00 33.84 30.34 1zpq n VAL 35 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1zpq n ASP 36 N 0.00 0.15 -0.10 4.52 5.75 -1.26 -4.16 116.55 121.45 1zpq n ASP 36 Ca 0.00 0.97 -0.00 0.00 -0.01 0.00 0.00 54.79 55.75 1zpq n ASP 36 Cb 0.00 -1.23 0.01 0.00 -1.03 0.00 0.00 41.12 38.87 1zpq n ASP 36 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 1zpq n LYS 37 N 0.35 -0.06 0.19 0.11 0.00 -1.26 -1.06 118.16 116.42 1zpq n LYS 37 Ca 0.11 0.40 -0.14 0.00 0.00 0.00 0.00 58.31 58.67 1zpq n LYS 37 Cb 0.39 -0.59 -0.08 0.00 0.00 0.00 0.00 35.03 34.75 1zpq n LYS 37 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1zpq h SER 38 N 0.00 -0.39 0.18 3.14 0.87 -1.87 -3.31 113.55 112.17 1zpq h SER 38 Ca 0.09 -0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 60.53 1zpq h SER 38 Cb 0.15 0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 1zpq h SER 38 CO -0.26 -0.11 -0.15 -0.61 -0.53 0.00 0.00 176.83 175.18 1zpq h GLN 39 N -0.67 -0.31 -7.07 2.24 4.15 -1.41 -3.42 115.11 108.62 1zpq h GLN 39 Ca -0.05 0.02 -0.53 0.00 0.77 0.00 0.00 58.65 58.87 1zpq h GLN 39 Cb 0.47 0.07 0.10 0.00 0.21 0.00 0.00 27.48 28.34 1zpq h GLN 39 CO 0.08 -0.21 0.50 -1.50 -1.93 0.00 0.00 178.83 175.77 1zpq s ILE 40 N -3.85 2.66 -0.03 2.39 2.07 -0.62 -3.49 121.20 120.33 1zpq s ILE 40 Ca -0.05 0.44 -0.02 0.00 -1.41 0.00 0.00 60.65 59.60 1zpq s ILE 40 Cb 0.01 -3.20 0.01 0.00 0.13 0.00 0.00 42.46 39.41 1zpq s ILE 40 CO 0.18 -0.06 0.04 -1.20 -1.91 0.00 0.00 174.94 172.00 1zpq n SER 41 N -1.24 -4.29 0.00 4.50 7.64 -1.26 -4.69 113.62 114.27 1zpq n SER 41 Ca 0.12 0.88 0.00 0.00 1.01 0.00 0.00 58.87 60.87 1zpq n SER 41 Cb 0.49 -3.20 0.00 0.00 -1.01 0.00 0.00 64.21 60.49 1zpq n SER 41 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1zpq n ARG 42 N 0.93 0.00 0.00 1.43 3.00 -1.26 -4.81 116.66 115.95 1zpq n ARG 42 Ca -0.08 0.10 0.00 0.00 -0.01 0.00 0.00 57.85 57.86 1zpq n ARG 42 Cb 0.12 -2.67 0.00 0.00 0.00 0.00 0.00 32.46 29.90 1zpq n ARG 42 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.63 179.50 1zpq n TRP 43 N -3.08 0.00 -0.43 -1.55 -0.00 -1.23 -4.54 117.44 106.61 1zpq n TRP 43 Ca 0.00 0.00 0.36 0.00 -0.00 0.00 0.00 57.50 57.86 1zpq n TRP 43 Cb 0.27 0.31 0.64 0.00 -0.00 0.00 0.00 31.31 32.53 1zpq n TRP 43 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 177.69 177.47 1zpq h LYS 44 N 0.00 0.12 0.47 5.87 3.64 -1.88 0.30 116.57 125.09 1zpq h LYS 44 Ca 0.00 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1zpq h LYS 44 Cb 0.20 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1zpq h LYS 44 CO 0.00 0.08 -0.23 -0.09 -2.27 0.00 0.00 179.45 176.94 1zpq h ARG 45 N 0.12 -0.61 0.00 1.90 2.43 -1.94 -3.38 114.38 112.90 1zpq h ARG 45 Ca 0.78 0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.92 1zpq h ARG 45 Cb 2.47 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 32.14 1zpq h ARG 45 CO -0.37 -0.39 -1.77 -0.25 -1.51 0.00 0.00 179.97 175.68 1zpq n ASP 46 N -5.35 1.57 -0.00 -3.80 8.00 -0.71 -4.70 116.55 111.56 1zpq n ASP 46 Ca -0.12 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.39 1zpq n ASP 46 Cb 0.27 1.43 -0.01 0.00 -0.02 0.00 0.00 41.12 42.78 1zpq n ASP 46 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 1zpq n TRP 47 N -2.17 0.00 -0.03 1.24 7.02 0.98 -4.43 117.44 120.04 1zpq n TRP 47 Ca -0.09 0.00 -0.16 0.00 -1.02 0.00 0.00 57.50 56.23 1zpq n TRP 47 Cb 0.56 -0.04 -0.08 0.00 -2.42 0.00 0.00 31.31 29.34 1zpq n TRP 47 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 1zpq h ILE 48 N 0.00 1.33 -0.91 -0.99 2.04 -1.73 -3.13 117.51 114.12 1zpq h ILE 48 Ca 0.00 -1.87 0.12 0.00 1.00 0.00 0.00 64.86 64.11 1zpq h ILE 48 Cb 0.08 2.08 -0.07 0.00 -0.74 0.00 0.00 36.82 38.17 1zpq h ILE 48 CO 0.00 0.58 0.58 -0.65 0.00 0.00 0.00 178.15 178.66 1zpq h PRO 49 N 0.30 0.79 0.19 2.37 0.11 -1.82 -1.37 132.00 132.57 1zpq h PRO 49 Ca -0.04 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 1zpq h PRO 49 Cb 1.24 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1zpq h PRO 49 CO 0.13 0.52 -0.09 0.87 -0.21 0.00 0.00 178.00 179.22 1zpq h LYS 50 N 0.82 -0.25 -1.42 1.05 1.57 -1.77 -2.83 116.57 113.74 1zpq h LYS 50 Ca 0.44 0.02 -0.22 0.00 -1.87 0.00 0.00 60.65 59.02 1zpq h LYS 50 Cb 0.56 0.06 -0.11 0.00 0.08 0.00 0.00 32.23 32.82 1zpq h LYS 50 CO -0.20 -0.16 0.29 1.97 -0.57 0.00 0.00 179.45 180.77 1zpq n PHE 51 N -2.70 1.13 -0.04 -1.35 1.16 -1.17 -0.82 117.46 113.67 1zpq n PHE 51 Ca -0.03 -1.47 -0.02 0.00 -1.87 0.00 0.00 57.45 54.06 1zpq n PHE 51 Cb 0.10 -0.72 -0.10 0.00 -1.61 0.00 0.00 39.48 37.15 1zpq n PHE 51 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1zpq n SER 52 N 0.39 1.91 -0.03 5.98 2.88 -0.53 -4.26 113.62 119.96 1zpq n SER 52 Ca 0.22 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.62 1zpq n SER 52 Cb 0.68 1.08 -0.02 0.00 -0.75 0.00 0.00 64.21 65.20 1zpq n SER 52 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 1zpq h MET 53 N 0.00 0.74 -0.34 -1.46 1.85 -0.73 -3.18 114.93 111.80 1zpq h MET 53 Ca -0.23 -0.52 0.08 0.00 -0.61 0.00 0.00 59.70 58.42 1zpq h MET 53 Cb 1.39 0.08 -0.08 0.00 0.43 0.00 0.00 31.60 33.42 1zpq h MET 53 CO 0.01 1.14 -0.25 1.25 -0.40 0.00 0.00 176.91 178.66 1zpq h LEU 54 N 0.55 -0.82 -1.38 3.39 6.46 -1.72 0.68 115.31 122.47 1zpq h LEU 54 Ca -0.01 0.16 0.08 0.00 -0.12 0.00 0.00 57.88 57.99 1zpq h LEU 54 Cb 1.23 0.40 -0.05 0.00 -0.73 0.00 0.00 40.66 41.51 1zpq h LEU 54 CO 0.13 -0.27 0.49 -0.07 -0.62 0.00 0.00 178.44 178.09 1zpq h LEU 55 N -0.20 0.64 -1.01 2.25 -0.00 -1.73 0.31 115.31 115.57 1zpq h LEU 55 Ca 0.17 0.01 -0.08 0.00 -0.00 0.00 0.00 57.88 57.98 1zpq h LEU 55 Cb 0.47 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 40.99 1zpq h LEU 55 CO -0.46 0.40 -0.16 0.00 -0.00 0.00 0.00 178.44 178.22 1zpq h ALA 56 N 1.61 1.17 -0.62 1.53 0.00 -1.09 -0.57 119.26 121.29 1zpq h ALA 56 Ca 0.33 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1zpq h ALA 56 Cb 0.35 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1zpq h ALA 56 CO -0.12 0.53 0.24 0.28 0.00 0.00 0.00 179.25 180.19 1zpq h VAL 57 N 0.48 1.22 -0.10 0.00 2.07 0.18 -2.80 116.25 117.30 1zpq h VAL 57 Ca 0.08 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1zpq h VAL 57 Cb 0.55 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1zpq h VAL 57 CO 0.04 0.28 0.00 0.18 0.02 0.00 0.00 177.57 178.08 1zpq n LEU 58 N -4.31 1.27 -0.07 2.57 4.77 -0.29 -4.83 117.00 116.11 1zpq n LEU 58 Ca 0.05 -0.50 -0.01 0.00 -0.03 0.00 0.00 56.01 55.52 1zpq n LEU 58 Cb 0.17 -0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1zpq n LEU 58 CO 0.39 0.25 -0.01 -0.62 -1.33 0.00 0.00 177.39 176.07 1zpq n GLU 59 N 0.04 -0.26 -0.09 3.23 -0.58 -0.80 -4.75 120.64 117.43 1zpq n GLU 59 Ca 0.17 0.24 0.26 0.00 -0.42 0.00 0.00 57.16 57.41 1zpq n GLU 59 Cb 0.28 -3.59 0.62 0.00 -0.57 0.00 0.00 31.44 28.18 1zpq n GLU 59 CO 0.00 0.00 0.00 2.35 -0.48 0.00 0.00 177.13 179.00 1zpq h TRP 60 N 0.00 0.00 0.64 -0.32 7.01 -1.71 1.39 115.95 122.96 1zpq h TRP 60 Ca -0.02 0.00 -0.03 0.00 2.11 0.00 0.00 58.89 60.95 1zpq h TRP 60 Cb 0.16 0.00 0.01 0.00 -2.10 0.00 0.00 29.16 27.22 1zpq h TRP 60 CO 0.09 0.00 -0.31 0.78 -2.79 0.00 0.00 178.44 176.21 1zpq h GLY 61 N 0.00 -0.90 0.08 2.65 0.00 -1.85 -1.91 103.07 101.14 1zpq h GLY 61 Ca 0.37 0.33 0.10 0.00 0.00 0.00 0.00 47.33 48.13 1zpq h GLY 61 CO -0.00 -0.33 -0.08 -2.08 0.00 0.00 0.00 176.54 174.05 1zpq h VAL 62 N -0.98 0.55 0.10 4.60 2.07 0.15 2.79 116.25 125.52 1zpq h VAL 62 Ca -0.09 -0.01 0.02 0.00 0.82 0.00 0.00 66.70 67.44 1zpq h VAL 62 Cb 0.66 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1zpq h VAL 62 CO 0.14 0.01 -0.27 1.62 0.02 0.00 0.00 177.57 179.09 1zpq h VAL 63 N 0.04 0.40 0.03 2.57 3.04 -1.48 3.50 116.25 124.34 1zpq h VAL 63 Ca 0.24 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.93 1zpq h VAL 63 Cb 0.37 0.40 -0.01 0.00 -2.01 0.00 0.00 31.29 30.03 1zpq h VAL 63 CO -0.47 0.00 -0.16 0.44 -1.01 0.00 0.00 177.57 176.37 1zpq h ASP 64 N -0.47 -0.47 -0.72 3.17 3.32 0.30 1.40 116.42 122.93 1zpq h ASP 64 Ca 0.04 0.05 0.09 0.00 0.02 0.00 0.00 57.03 57.23 1zpq h ASP 64 Cb 0.51 0.18 -0.07 0.00 0.22 0.00 0.00 39.33 40.17 1zpq h ASP 64 CO -0.17 -0.16 0.37 0.44 -1.72 0.00 0.00 179.24 177.99 1zpq h ASP 65 N -0.22 0.49 -0.26 6.45 3.32 0.51 0.22 116.42 126.93 1zpq h ASP 65 Ca -0.00 0.06 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 1zpq h ASP 65 Cb 0.22 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1zpq h ASP 65 CO -0.09 0.28 -0.08 0.44 -1.72 0.00 0.00 179.24 178.07 1zpq h ASP 66 N 0.63 0.53 0.00 6.45 3.32 0.68 3.24 116.42 131.27 1zpq h ASP 66 Ca 0.35 -0.38 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1zpq h ASP 66 Cb 0.36 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1zpq h ASP 66 CO -0.26 0.79 0.00 0.24 -1.72 0.00 0.00 179.24 178.28 1zpq h MET 67 N 0.26 0.00 0.07 3.56 2.86 0.26 0.23 114.93 122.18 1zpq h MET 67 Ca 0.06 0.00 -0.35 0.00 -2.06 0.00 0.00 59.70 57.35 1zpq h MET 67 Cb 0.57 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.19 1zpq h MET 67 CO 0.03 0.00 -2.01 0.00 1.06 0.00 0.00 176.91 175.99 1zpq n ALA 68 N -2.05 1.00 0.21 6.32 0.00 0.71 -3.31 120.51 123.39 1zpq n ALA 68 Ca -0.03 -0.72 -0.17 0.00 0.00 0.00 0.00 53.44 52.52 1zpq n ALA 68 Cb 0.07 -0.47 -0.09 0.00 0.00 0.00 0.00 19.45 18.95 1zpq n ALA 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1zpq h ARG 69 N -0.23 -0.84 -0.94 0.00 3.08 0.68 -0.53 114.38 115.59 1zpq h ARG 69 Ca -0.47 0.06 0.03 0.00 0.07 0.00 0.00 59.98 59.67 1zpq h ARG 69 Cb 1.84 0.19 -0.05 0.00 0.08 0.00 0.00 29.97 32.02 1zpq h ARG 69 CO -0.05 -0.56 0.62 -0.07 -1.07 0.00 0.00 179.97 178.84 1zpq h LEU 70 N -0.87 1.05 0.72 3.04 3.38 -1.21 -0.45 115.31 120.97 1zpq h LEU 70 Ca -0.03 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1zpq h LEU 70 Cb 0.81 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 1zpq h LEU 70 CO -0.17 0.73 -0.45 0.00 0.09 0.00 0.00 178.44 178.65 1zpq h ALA 71 N 1.37 -1.13 -0.63 1.53 0.00 -1.30 -0.14 119.26 118.96 1zpq h ALA 71 Ca 0.36 -0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.86 1zpq h ALA 71 Cb -0.06 0.55 -0.12 0.00 0.00 0.00 0.00 17.79 18.17 1zpq h ALA 71 CO -0.10 -1.15 0.25 0.54 0.00 0.00 0.00 179.25 178.78 1zpq n ARG 72 N -5.58 3.23 -0.08 0.00 1.74 -0.30 -1.00 116.66 114.66 1zpq n ARG 72 Ca -0.14 -2.54 -0.09 0.00 -0.77 0.00 0.00 57.85 54.31 1zpq n ARG 72 Cb 0.46 -2.06 -0.12 0.00 -1.02 0.00 0.00 32.46 29.73 1zpq n ARG 72 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 1zpq n GLN 73 N -0.11 1.27 0.03 5.56 7.27 -0.18 -4.31 117.38 126.91 1zpq n GLN 73 Ca 0.35 0.02 -0.00 0.00 0.07 0.00 0.00 57.00 57.43 1zpq n GLN 73 Cb 1.23 -1.40 -0.09 0.00 2.41 0.00 0.00 30.24 32.40 1zpq n GLN 73 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1zpq n VAL 74 N -2.67 1.18 0.76 1.69 0.31 -0.11 -1.93 118.33 117.55 1zpq n VAL 74 Ca -0.27 -0.69 0.02 0.00 -0.01 0.00 0.00 64.34 63.39 1zpq n VAL 74 Cb 0.98 -0.73 0.14 0.00 -0.91 0.00 0.00 33.84 33.32 1zpq n VAL 74 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1zpq n ALA 75 N -2.40 1.91 -0.08 3.52 0.00 -0.17 -2.67 120.51 120.62 1zpq n ALA 75 Ca -0.10 -0.03 -0.09 0.00 0.00 0.00 0.00 53.44 53.22 1zpq n ALA 75 Cb 0.84 -1.08 -0.15 0.00 0.00 0.00 0.00 19.45 19.06 1zpq n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1zpq n ALA 76 N -0.69 1.54 0.47 0.00 0.00 -0.81 -2.01 120.51 119.01 1zpq n ALA 76 Ca 0.04 -1.19 0.11 0.00 0.00 0.00 0.00 53.44 52.40 1zpq n ALA 76 Cb 0.02 -0.35 0.43 0.00 0.00 0.00 0.00 19.45 19.55 1zpq n ALA 76 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1zpq n ILE 77 N -2.80 0.83 -0.09 0.00 5.41 -1.09 -2.10 119.36 119.52 1zpq n ILE 77 Ca -0.28 0.19 -0.14 0.00 1.00 0.00 0.00 62.75 63.51 1zpq n ILE 77 Cb 1.12 -1.04 -0.08 0.00 -0.71 0.00 0.00 39.64 38.93 1zpq n ILE 77 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1zpq h LEU 78 N 0.00 0.00 -2.18 1.39 3.38 -1.67 -3.24 115.31 112.99 1zpq h LEU 78 Ca 0.00 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.61 1zpq h LEU 78 Cb 0.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 1zpq h LEU 78 CO 0.00 1.12 0.02 0.74 0.09 0.00 0.00 178.44 180.41 1zpq h THR 79 N -1.00 0.80 0.00 0.22 2.02 -1.36 -3.39 112.91 110.20 1zpq h THR 79 Ca -0.17 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1zpq h THR 79 Cb 0.91 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.31 1zpq h THR 79 CO -0.10 0.00 0.00 -3.20 0.37 0.00 0.00 175.52 172.59 1zpq n ASN 80 N -4.26 0.00 0.00 4.18 2.85 -0.89 -5.07 115.26 112.06 1zpq n ASN 80 Ca -0.02 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.45 1zpq n ASN 80 Cb 0.11 0.01 0.00 0.00 1.24 0.00 0.00 39.78 41.14 1zpq n ASN 80 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32