#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c0v h GLU 2 N 0.00 0.24 0.00 0.03 4.11 -2.07 0.42 114.58 117.31 1c0v h GLU 2 Ca 0.00 -0.01 -0.15 0.00 0.07 0.00 0.00 59.36 59.26 1c0v h GLU 2 Cb 0.00 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 1c0v h GLU 2 CO 0.00 0.16 -1.58 0.09 0.07 0.00 0.00 179.01 177.75 1c0v n ASN 3 N -4.66 3.02 0.00 3.06 3.02 -1.26 -4.50 115.26 113.94 1c0v n ASN 3 Ca 0.31 -0.02 0.09 0.00 -0.03 0.00 0.00 54.58 54.93 1c0v n ASN 3 Cb 1.13 0.44 0.43 0.00 -0.61 0.00 0.00 39.78 41.18 1c0v n ASN 3 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1c0v n LEU 4 N -2.46 0.00 0.24 3.41 4.32 -1.01 -3.43 117.00 118.07 1c0v n LEU 4 Ca -0.15 0.42 -0.10 0.00 -0.02 0.00 0.00 56.01 56.16 1c0v n LEU 4 Cb 0.75 -0.42 -0.05 0.00 -1.62 0.00 0.00 43.42 42.08 1c0v n LEU 4 CO 0.16 -0.15 0.33 -1.13 -1.22 0.00 0.00 177.39 175.37 1c0v h ASN 5 N 0.00 -0.55 -0.91 -1.43 -1.24 -0.40 0.14 115.58 111.19 1c0v h ASN 5 Ca 0.00 0.02 0.26 0.00 0.71 0.00 0.00 56.30 57.29 1c0v h ASN 5 Cb 0.27 0.14 -0.04 0.00 0.73 0.00 0.00 38.32 39.43 1c0v h ASN 5 CO 0.00 -0.24 0.65 0.00 -1.29 0.00 0.00 177.43 176.55 1c0v h MET 6 N -0.95 0.03 -0.27 6.67 -0.00 -1.80 1.06 114.93 119.66 1c0v h MET 6 Ca -0.07 -0.00 -0.18 0.00 -0.00 0.00 0.00 59.70 59.46 1c0v h MET 6 Cb 0.50 -0.01 -0.00 0.00 -0.00 0.00 0.00 31.60 32.09 1c0v h MET 6 CO 0.11 0.02 -0.53 0.22 -0.00 0.00 0.00 176.91 176.73 1c0v h ASP 7 N 0.03 0.89 -0.36 -0.10 1.82 -1.55 -2.10 116.42 115.04 1c0v h ASP 7 Ca 0.44 -0.46 -0.09 0.00 -0.39 0.00 0.00 57.03 56.52 1c0v h ASP 7 Cb 1.71 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 41.45 1c0v h ASP 7 CO -0.02 1.24 -0.12 -0.07 -1.61 0.00 0.00 179.24 178.66 1c0v h LEU 8 N 0.62 0.74 0.30 2.28 3.38 0.38 -1.94 115.31 121.07 1c0v h LEU 8 Ca 0.02 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 1c0v h LEU 8 Cb 1.12 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1c0v h LEU 8 CO 0.11 0.95 -0.22 0.25 0.09 0.00 0.00 178.44 179.62 1c0v h LEU 9 N 0.52 -0.58 0.27 1.67 5.85 -0.42 0.24 115.31 122.85 1c0v h LEU 9 Ca 0.09 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.86 1c0v h LEU 9 Cb 0.64 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.82 1c0v h LEU 9 CO 0.04 -0.35 -0.40 1.88 -0.34 0.00 0.00 178.44 179.28 1c0v h TYR 10 N -0.53 -1.11 -0.09 1.25 -1.99 -1.39 0.28 116.97 113.39 1c0v h TYR 10 Ca -0.02 0.02 0.03 0.00 2.00 0.00 0.00 58.73 60.75 1c0v h TYR 10 Cb 0.46 0.45 -0.00 0.00 2.00 0.00 0.00 36.73 39.63 1c0v h TYR 10 CO -0.12 -0.53 0.27 0.52 -0.00 0.00 0.00 178.16 178.30 1c0v h MET 11 N -0.73 0.00 -0.04 4.88 2.86 -1.23 0.78 114.93 121.45 1c0v h MET 11 Ca -0.01 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1c0v h MET 11 Cb 0.70 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.36 1c0v h MET 11 CO -0.14 0.00 -0.03 0.00 1.06 0.00 0.00 176.91 177.80 1c0v h ALA 12 N 1.54 0.06 0.00 6.32 0.00 0.30 0.17 119.26 127.65 1c0v h ALA 12 Ca 0.04 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1c0v h ALA 12 Cb 0.59 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1c0v h ALA 12 CO -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.07 1c0v h ALA 13 N 0.58 1.00 0.13 0.00 0.00 0.06 0.38 119.26 121.41 1c0v h ALA 13 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.57 1c0v h ALA 13 Cb 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1c0v h ALA 13 CO 0.01 0.00 -1.84 0.00 0.00 0.00 0.00 179.25 177.42 1c0v h ALA 14 N 2.28 0.38 0.04 0.00 0.00 -1.01 -1.50 119.26 119.46 1c0v h ALA 14 Ca 0.00 -1.30 -0.27 0.00 0.00 0.00 0.00 54.91 53.34 1c0v h ALA 14 Cb 0.63 0.56 0.02 0.00 0.00 0.00 0.00 17.79 19.00 1c0v h ALA 14 CO 0.00 1.25 -1.11 0.28 0.00 0.00 0.00 179.25 179.67 1c0v h VAL 15 N 0.07 1.30 0.31 0.00 2.07 -0.62 0.15 116.25 119.54 1c0v h VAL 15 Ca -0.36 -2.37 -0.02 0.00 0.82 0.00 0.00 66.70 64.77 1c0v h VAL 15 Cb 2.05 2.51 0.00 0.00 -1.52 0.00 0.00 31.29 34.33 1c0v h VAL 15 CO 0.12 0.73 -0.15 0.24 0.02 0.00 0.00 177.57 178.53 1c0v h MET 16 N 0.32 -0.40 -0.16 1.57 2.86 -0.37 -1.48 114.93 117.28 1c0v h MET 16 Ca -0.14 0.03 -0.20 0.00 -2.06 0.00 0.00 59.70 57.33 1c0v h MET 16 Cb 1.76 0.09 0.00 0.00 0.06 0.00 0.00 31.60 33.52 1c0v h MET 16 CO 0.21 -0.07 -0.69 0.52 1.06 0.00 0.00 176.91 177.94 1c0v h MET 17 N -0.94 0.67 -0.05 1.72 2.86 -1.40 0.15 114.93 117.94 1c0v h MET 17 Ca -0.04 -0.50 -0.00 0.00 -2.06 0.00 0.00 59.70 57.10 1c0v h MET 17 Cb 0.51 0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.26 1c0v h MET 17 CO 0.07 1.12 0.03 0.78 1.06 0.00 0.00 176.91 179.96 1c0v h GLY 18 N 0.86 0.08 2.00 8.32 0.00 -0.80 0.25 103.07 113.77 1c0v h GLY 18 Ca -0.02 -0.04 -0.12 0.00 0.00 0.00 0.00 47.33 47.15 1c0v h GLY 18 CO 0.13 0.03 -0.57 1.41 0.00 0.00 0.00 176.54 177.55 1c0v h LEU 19 N -0.01 0.00 0.00 3.11 3.38 -1.27 -1.83 115.31 118.68 1c0v h LEU 19 Ca 0.02 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1c0v h LEU 19 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1c0v h LEU 19 CO -0.00 0.57 -0.27 0.00 0.09 0.00 0.00 178.44 178.82 1c0v h ALA 20 N 1.43 0.04 -0.95 1.53 0.00 -0.51 -1.51 119.26 119.29 1c0v h ALA 20 Ca -0.01 -0.47 0.09 0.00 0.00 0.00 0.00 54.91 54.53 1c0v h ALA 20 Cb 1.08 0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 1c0v h ALA 20 CO 0.07 0.18 0.59 0.00 0.00 0.00 0.00 179.25 180.10 1c0v h ALA 21 N -0.51 1.36 -0.34 0.00 0.00 -0.63 0.31 119.26 119.45 1c0v h ALA 21 Ca -0.06 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1c0v h ALA 21 Cb 0.68 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1c0v h ALA 21 CO -0.04 0.28 0.03 0.97 0.00 0.00 0.00 179.25 180.49 1c0v h ILE 22 N 1.01 1.25 -0.47 0.00 6.09 -1.45 0.18 117.51 124.12 1c0v h ILE 22 Ca 0.44 -0.89 0.11 0.00 -1.37 0.00 0.00 64.86 63.15 1c0v h ILE 22 Cb 0.32 1.17 -0.02 0.00 0.47 0.00 0.00 36.82 38.75 1c0v h ILE 22 CO -0.22 0.29 0.33 1.23 -3.07 0.00 0.00 178.15 176.71 1c0v h GLY 23 N 0.39 0.19 0.50 8.18 0.00 0.02 0.25 103.07 112.61 1c0v h GLY 23 Ca 0.10 -0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 1c0v h GLY 23 CO 0.01 0.03 -0.13 0.00 0.00 0.00 0.00 176.54 176.46 1c0v h ALA 24 N 1.77 -0.35 0.06 3.60 0.00 0.64 -0.09 119.26 124.89 1c0v h ALA 24 Ca 0.22 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1c0v h ALA 24 Cb 0.69 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1c0v h ALA 24 CO -0.03 -0.45 -0.03 0.00 0.00 0.00 0.00 179.25 178.75 1c0v h ALA 25 N -0.37 -1.01 -0.84 0.00 0.00 0.34 -1.56 119.26 115.82 1c0v h ALA 25 Ca -0.04 -0.02 0.20 0.00 0.00 0.00 0.00 54.91 55.06 1c0v h ALA 25 Cb 0.51 0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.22 1c0v h ALA 25 CO 0.06 -1.01 0.30 0.82 0.00 0.00 0.00 179.25 179.42 1c0v h ILE 26 N -0.08 0.47 0.22 0.00 1.08 -0.71 -1.68 117.51 116.81 1c0v h ILE 26 Ca -0.01 -0.11 -0.00 0.00 -0.39 0.00 0.00 64.86 64.34 1c0v h ILE 26 Cb 0.06 0.11 -0.02 0.00 -3.07 0.00 0.00 36.82 33.90 1c0v h ILE 26 CO 0.01 0.06 -0.29 1.23 -0.69 0.00 0.00 178.15 178.47 1c0v h GLY 27 N 0.33 -1.08 -0.95 5.37 0.00 -0.94 0.57 103.07 106.39 1c0v h GLY 27 Ca 0.51 0.51 0.42 0.00 0.00 0.00 0.00 47.33 48.76 1c0v h GLY 27 CO -0.54 -0.34 0.96 -2.22 0.00 0.00 0.00 176.54 174.41 1c0v h ILE 28 N -0.53 0.24 -0.14 2.60 2.04 -0.61 1.31 117.51 122.42 1c0v h ILE 28 Ca -0.03 -0.03 -0.19 0.00 1.00 0.00 0.00 64.86 65.62 1c0v h ILE 28 Cb 0.48 0.15 0.01 0.00 -0.74 0.00 0.00 36.82 36.71 1c0v h ILE 28 CO -0.08 0.02 -0.64 1.23 0.00 0.00 0.00 178.15 178.68 1c0v h GLY 29 N 0.09 0.75 0.11 5.37 0.00 -0.08 0.13 103.07 109.44 1c0v h GLY 29 Ca 0.74 -1.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 1c0v h GLY 29 CO -0.18 0.94 -0.06 -2.22 0.00 0.00 0.00 176.54 175.02 1c0v h ILE 30 N 0.36 0.00 -0.74 2.60 1.08 0.66 -0.84 117.51 120.63 1c0v h ILE 30 Ca -0.04 -0.70 0.02 0.00 -0.39 0.00 0.00 64.86 63.75 1c0v h ILE 30 Cb 1.28 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.99 1c0v h ILE 30 CO 0.13 0.00 0.48 -0.07 -0.69 0.00 0.00 178.15 178.01 1c0v h LEU 31 N -0.85 0.82 -0.29 1.44 3.38 -0.02 -1.36 115.31 118.43 1c0v h LEU 31 Ca -0.02 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 1c0v h LEU 31 Cb 0.12 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1c0v h LEU 31 CO 0.03 0.58 -0.29 1.23 0.09 0.00 0.00 178.44 180.08 1c0v h GLY 32 N 0.96 0.77 1.73 0.83 0.00 -0.77 0.22 103.07 106.81 1c0v h GLY 32 Ca 0.29 -0.78 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 1c0v h GLY 32 CO -0.08 0.71 0.05 -1.33 0.00 0.00 0.00 176.54 175.88 1c0v h GLY 33 N 0.45 0.37 0.82 4.60 0.00 -0.86 -2.63 103.07 105.82 1c0v h GLY 33 Ca 0.05 -0.18 -0.16 0.00 0.00 0.00 0.00 47.33 47.04 1c0v h GLY 33 CO 0.07 0.17 -1.51 0.28 0.00 0.00 0.00 176.54 175.55 1c0v n LYS 34 N -4.39 0.63 -0.01 4.80 5.02 -0.54 -4.23 118.16 119.44 1c0v n LYS 34 Ca 0.01 0.16 -0.12 0.00 -2.02 0.00 0.00 58.31 56.34 1c0v n LYS 34 Cb 0.16 -1.76 -0.07 0.00 -0.02 0.00 0.00 35.03 33.34 1c0v n LYS 34 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 1c0v h PHE 35 N 0.00 0.10 -0.99 2.13 3.57 -0.25 -2.92 116.94 118.58 1c0v h PHE 35 Ca -0.17 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 61.50 1c0v h PHE 35 Cb 1.55 -0.03 -0.10 0.00 2.79 0.00 0.00 35.95 40.16 1c0v h PHE 35 CO 0.00 0.26 0.62 1.25 -2.23 0.00 0.00 178.31 178.20 1c0v h LEU 36 N -0.08 0.77 -0.49 0.59 5.85 -1.66 -1.22 115.31 119.07 1c0v h LEU 36 Ca 0.02 0.08 0.10 0.00 0.84 0.00 0.00 57.88 58.92 1c0v h LEU 36 Cb 0.20 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.08 1c0v h LEU 36 CO -0.00 0.31 -0.10 -0.33 -0.34 0.00 0.00 178.44 177.98 1c0v h GLU 37 N 0.77 0.02 -0.87 1.25 5.08 -1.69 0.10 114.58 119.24 1c0v h GLU 37 Ca 0.55 -0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.99 1c0v h GLU 37 Cb 0.85 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.03 1c0v h GLU 37 CO -0.33 0.01 0.52 0.78 -1.00 0.00 0.00 179.01 179.00 1c0v h GLY 38 N 0.02 1.33 2.00 -3.84 0.00 -1.27 0.20 103.07 101.52 1c0v h GLY 38 Ca 0.24 -0.37 -0.02 0.00 0.00 0.00 0.00 47.33 47.18 1c0v h GLY 38 CO -0.48 0.21 -0.12 0.00 0.00 0.00 0.00 176.54 176.15 1c0v h ALA 39 N 1.44 1.19 -0.38 3.60 0.00 -0.93 -2.70 119.26 121.47 1c0v h ALA 39 Ca 0.40 -0.11 0.11 0.00 0.00 0.00 0.00 54.91 55.31 1c0v h ALA 39 Cb 0.27 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1c0v h ALA 39 CO -0.21 0.15 0.43 0.00 0.00 0.00 0.00 179.25 179.62 1c0v h ALA 40 N 1.88 2.07 -0.73 0.00 0.00 0.41 -0.54 119.26 122.36 1c0v h ALA 40 Ca -0.00 -0.01 -0.45 0.00 0.00 0.00 0.00 54.91 54.44 1c0v h ALA 40 Cb 0.40 0.03 -0.42 0.00 0.00 0.00 0.00 17.79 17.80 1c0v h ALA 40 CO 0.02 -0.63 -0.92 2.89 0.00 0.00 0.00 179.25 180.61 1c0v n ARG 41 N -3.67 2.94 -3.57 0.00 0.00 -1.02 -5.05 116.66 106.29 1c0v n ARG 41 Ca 0.07 -3.96 -0.12 0.00 -0.00 0.00 0.00 57.85 53.83 1c0v n ARG 41 Cb 0.60 -2.03 -0.04 0.00 -0.00 0.00 0.00 32.46 30.98 1c0v n ARG 41 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 1c0v s GLN 42 N -3.64 1.09 0.44 2.89 -0.21 -0.21 -5.10 119.66 114.93 1c0v s GLN 42 Ca 0.43 -0.46 -0.23 0.00 0.02 0.00 0.00 55.36 55.12 1c0v s GLN 42 Cb 0.38 0.49 -0.08 0.00 1.00 0.00 0.00 33.01 34.81 1c0v s GLN 42 CO -0.00 -0.43 1.14 -1.25 -2.12 0.00 0.00 175.29 172.63 1c0v s PRO 43 N -3.20 3.86 0.00 2.91 0.04 -1.26 -4.84 135.00 132.51 1c0v s PRO 43 Ca -0.01 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.74 1c0v s PRO 43 Cb 0.00 -2.44 0.00 0.00 0.04 0.00 0.00 34.50 32.10 1c0v s PRO 43 CO -0.08 -0.45 1.94 -0.25 0.04 0.00 0.00 177.00 178.21 1c0v n ASP 44 N -0.38 5.21 -0.04 6.66 8.00 -1.26 -4.01 116.55 130.73 1c0v n ASP 44 Ca 0.07 -2.38 -0.04 0.00 0.71 0.00 0.00 54.79 53.15 1c0v n ASP 44 Cb 0.48 -1.10 -0.01 0.00 -0.02 0.00 0.00 41.12 40.47 1c0v n ASP 44 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1c0v n LEU 45 N 1.49 1.13 -0.03 0.64 7.94 -1.26 -4.41 117.00 122.51 1c0v n LEU 45 Ca 0.00 0.18 -0.18 0.00 -1.11 0.00 0.00 56.01 54.90 1c0v n LEU 45 Cb 0.49 -0.55 -0.13 0.00 0.53 0.00 0.00 43.42 43.76 1c0v n LEU 45 CO 0.00 -0.43 0.01 0.40 -1.11 0.00 0.00 177.39 176.26 1c0v h ILE 46 N -0.49 1.45 0.00 1.96 2.04 -2.00 -3.31 117.51 117.16 1c0v h ILE 46 Ca 0.00 -2.39 -0.08 0.00 1.00 0.00 0.00 64.86 63.40 1c0v h ILE 46 Cb 0.49 3.04 -0.01 0.00 -0.74 0.00 0.00 36.82 39.60 1c0v h ILE 46 CO 0.00 0.61 -0.38 1.55 0.00 0.00 0.00 178.15 179.94 1c0v h PRO 47 N -0.70 0.00 -0.67 2.37 0.13 -1.89 -2.34 132.00 128.90 1c0v h PRO 47 Ca -0.15 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.95 1c0v h PRO 47 Cb 1.36 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.46 1c0v h PRO 47 CO 0.02 0.38 0.30 1.25 -0.23 0.00 0.00 178.00 179.71 1c0v h LEU 48 N 0.00 0.90 -0.28 1.56 6.46 -1.77 1.26 115.31 123.43 1c0v h LEU 48 Ca -0.00 -0.15 -0.05 0.00 -0.12 0.00 0.00 57.88 57.56 1c0v h LEU 48 Cb 0.78 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.47 1c0v h LEU 48 CO 0.05 0.81 -0.01 0.25 -0.62 0.00 0.00 178.44 178.92 1c0v h LEU 49 N 0.94 0.50 0.11 2.25 5.85 -1.59 -1.97 115.31 121.41 1c0v h LEU 49 Ca 0.23 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1c0v h LEU 49 Cb 0.16 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1c0v h LEU 49 CO -0.02 0.70 -0.06 -0.09 -0.34 0.00 0.00 178.44 178.63 1c0v h ARG 50 N 0.29 -0.15 -0.73 1.25 2.43 -1.07 -2.05 114.38 114.36 1c0v h ARG 50 Ca 0.08 0.01 0.16 0.00 -0.81 0.00 0.00 59.98 59.42 1c0v h ARG 50 Cb 0.44 0.03 -0.12 0.00 -0.42 0.00 0.00 29.97 29.91 1c0v h ARG 50 CO 0.02 0.15 0.06 1.15 -1.51 0.00 0.00 179.97 179.84 1c0v h THR 51 N -0.45 0.41 -0.32 0.20 2.02 0.16 0.58 112.91 115.51 1c0v h THR 51 Ca -0.02 -0.05 -0.04 0.00 0.77 0.00 0.00 66.41 67.07 1c0v h THR 51 Cb 0.36 0.25 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 1c0v h THR 51 CO 0.03 0.03 0.06 0.06 0.37 0.00 0.00 175.52 176.06 1c0v h GLN 52 N 0.15 0.53 -1.02 6.66 3.07 -1.29 -1.01 115.11 122.20 1c0v h GLN 52 Ca 0.40 -0.14 0.25 0.00 0.09 0.00 0.00 58.65 59.25 1c0v h GLN 52 Cb 0.70 -0.06 -0.09 0.00 0.08 0.00 0.00 27.48 28.11 1c0v h GLN 52 CO -0.60 0.61 0.65 0.35 0.09 0.00 0.00 178.83 179.94 1c0v h PHE 53 N 0.36 0.72 0.16 0.06 3.04 -0.19 0.26 116.94 121.35 1c0v h PHE 53 Ca 0.10 0.02 -0.31 0.00 3.98 0.00 0.00 57.97 61.76 1c0v h PHE 53 Cb 0.34 -0.21 0.03 0.00 2.56 0.00 0.00 35.95 38.67 1c0v h PHE 53 CO 0.02 0.09 -1.31 0.74 -2.02 0.00 0.00 178.31 175.83 1c0v h PHE 54 N 0.45 0.96 -0.91 0.41 -1.00 -0.77 0.12 116.94 116.21 1c0v h PHE 54 Ca 0.58 -0.64 0.03 0.00 2.81 0.00 0.00 57.97 60.76 1c0v h PHE 54 Cb 1.38 -0.06 -0.05 0.00 3.61 0.00 0.00 35.95 40.82 1c0v h PHE 54 CO -0.00 1.48 0.59 0.82 -1.61 0.00 0.00 178.31 179.59 1c0v h ILE 55 N 0.22 1.16 0.08 -0.55 1.08 0.57 -0.00 117.51 120.07 1c0v h ILE 55 Ca -0.20 -0.40 -0.19 0.00 -0.39 0.00 0.00 64.86 63.68 1c0v h ILE 55 Cb 1.99 -0.10 0.02 0.00 -3.07 0.00 0.00 36.82 35.66 1c0v h ILE 55 CO 0.25 0.21 -0.80 0.58 -0.69 0.00 0.00 178.15 177.70 1c0v h VAL 56 N 1.16 1.44 -0.60 1.67 2.07 -0.68 0.75 116.25 122.06 1c0v h VAL 56 Ca 0.36 -2.32 0.17 0.00 0.82 0.00 0.00 66.70 65.73 1c0v h VAL 56 Cb -0.01 2.85 -0.02 0.00 -1.52 0.00 0.00 31.29 32.59 1c0v h VAL 56 CO -0.11 0.67 0.54 -0.03 0.02 0.00 0.00 177.57 178.66 1c0v h MET 57 N -0.14 0.00 0.00 1.57 1.85 -0.32 0.36 114.93 118.24 1c0v h MET 57 Ca -0.12 0.00 -0.23 0.00 -0.61 0.00 0.00 59.70 58.74 1c0v h MET 57 Cb 1.55 0.00 -0.04 0.00 0.43 0.00 0.00 31.60 33.54 1c0v h MET 57 CO 0.15 0.00 -2.03 0.41 -0.40 0.00 0.00 176.91 175.04 1c0v n GLY 58 N -1.58 -1.05 0.04 1.39 0.00 -0.05 -3.19 105.19 100.75 1c0v n GLY 58 Ca 0.12 -0.32 0.15 0.00 0.00 0.00 0.00 46.02 45.97 1c0v n GLY 58 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1c0v n LEU 59 N -2.68 0.18 0.00 0.99 -0.00 0.67 -3.27 117.00 112.89 1c0v n LEU 59 Ca -0.20 0.16 0.00 0.00 -0.00 0.00 0.00 56.01 55.97 1c0v n LEU 59 Cb 0.93 -0.23 0.00 0.00 -0.00 0.00 0.00 43.42 44.13 1c0v n LEU 59 CO 0.44 0.03 0.40 0.52 -0.00 0.00 0.00 177.39 178.78 1c0v n VAL 60 N -1.14 0.61 0.23 1.96 0.31 0.93 -4.68 118.33 116.55 1c0v n VAL 60 Ca 0.15 -0.64 0.12 0.00 -0.01 0.00 0.00 64.34 63.97 1c0v n VAL 60 Cb 0.25 0.72 0.38 0.00 -0.91 0.00 0.00 33.84 34.28 1c0v n VAL 60 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1c0v h ASP 61 N 0.00 0.00 0.01 4.52 1.82 -1.53 -3.25 116.42 117.99 1c0v h ASP 61 Ca 0.00 0.00 -0.13 0.00 -0.39 0.00 0.00 57.03 56.51 1c0v h ASP 61 Cb 0.63 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.62 1c0v h ASP 61 CO 0.00 0.10 -0.73 0.00 -1.61 0.00 0.00 179.24 177.00 1c0v h ALA 62 N 1.90 0.15 -1.00 -0.78 0.00 -1.79 -3.35 119.26 114.40 1c0v h ALA 62 Ca -0.00 -0.90 0.36 0.00 0.00 0.00 0.00 54.91 54.37 1c0v h ALA 62 Cb 0.83 0.41 -0.12 0.00 0.00 0.00 0.00 17.79 18.92 1c0v h ALA 62 CO 0.01 0.41 0.62 -0.89 0.00 0.00 0.00 179.25 179.40 1c0v n ILE 63 N -4.48 -0.24 -0.06 0.00 2.08 -1.23 0.15 119.36 115.59 1c0v n ILE 63 Ca -0.22 1.47 -0.02 0.00 0.56 0.00 0.00 62.75 64.54 1c0v n ILE 63 Cb 0.61 -2.40 -0.01 0.00 -0.75 0.00 0.00 39.64 37.08 1c0v n ILE 63 CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 1c0v h PRO 64 N 0.00 0.00 -0.06 0.38 0.11 -1.72 -1.71 132.00 129.00 1c0v h PRO 64 Ca 0.69 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.81 1c0v h PRO 64 Cb 2.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 33.20 1c0v h PRO 64 CO -0.44 0.09 0.05 1.98 -0.21 0.00 0.00 178.00 179.48 1c0v h MET 65 N -1.00 0.00 0.09 1.05 4.05 -1.39 0.18 114.93 117.91 1c0v h MET 65 Ca -0.00 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.41 1c0v h MET 65 Cb 0.17 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.97 1c0v h MET 65 CO -0.00 0.00 -0.04 0.82 0.23 0.00 0.00 176.91 177.91 1c0v h ILE 66 N 0.00 1.15 -0.46 1.77 1.08 0.13 0.22 117.51 121.40 1c0v h ILE 66 Ca 0.03 -1.27 0.04 0.00 -0.39 0.00 0.00 64.86 63.27 1c0v h ILE 66 Cb 0.14 1.91 -0.03 0.00 -3.07 0.00 0.00 36.82 35.78 1c0v h ILE 66 CO -0.00 0.29 0.31 0.00 -0.69 0.00 0.00 178.15 178.06 1c0v h ALA 67 N 0.03 1.85 -0.28 1.87 0.00 -0.50 0.48 119.26 122.72 1c0v h ALA 67 Ca -0.01 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 1c0v h ALA 67 Cb 0.57 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1c0v h ALA 67 CO 0.02 0.09 -0.35 0.28 0.00 0.00 0.00 179.25 179.29 1c0v h VAL 68 N 0.46 1.30 0.00 0.00 2.07 -0.59 0.48 116.25 119.97 1c0v h VAL 68 Ca 0.19 -1.53 -0.08 0.00 0.82 0.00 0.00 66.70 66.10 1c0v h VAL 68 Cb 0.18 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1c0v h VAL 68 CO -0.05 0.49 -0.37 1.23 0.02 0.00 0.00 177.57 178.90 1c0v h GLY 69 N 0.47 0.00 1.87 2.17 0.00 0.88 -0.97 103.07 107.49 1c0v h GLY 69 Ca 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.21 1c0v h GLY 69 CO 0.08 0.00 -0.71 -2.00 0.00 0.00 0.00 176.54 173.92 1c0v h LEU 70 N 0.00 0.15 -0.01 3.11 6.46 0.15 0.15 115.31 125.32 1c0v h LEU 70 Ca -0.00 -0.10 -0.04 0.00 -0.12 0.00 0.00 57.88 57.61 1c0v h LEU 70 Cb 0.74 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 40.63 1c0v h LEU 70 CO 0.05 0.81 -0.16 1.23 -0.62 0.00 0.00 178.44 179.74 1c0v h GLY 71 N 1.81 0.15 1.16 3.75 0.00 -0.29 0.19 103.07 109.84 1c0v h GLY 71 Ca -0.02 -0.23 -0.13 0.00 0.00 0.00 0.00 47.33 46.95 1c0v h GLY 71 CO 0.10 0.21 -0.21 1.41 0.00 0.00 0.00 176.54 178.04 1c0v h LEU 72 N -0.52 0.98 0.34 3.11 3.38 -1.23 0.15 115.31 121.51 1c0v h LEU 72 Ca -0.02 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1c0v h LEU 72 Cb 0.88 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1c0v h LEU 72 CO 0.03 1.15 -0.16 0.22 0.09 0.00 0.00 178.44 179.77 1c0v h TYR 73 N 0.83 -0.42 -0.18 1.13 5.03 -0.76 -2.17 116.97 120.42 1c0v h TYR 73 Ca 0.11 -0.01 0.05 0.00 2.58 0.00 0.00 58.73 61.46 1c0v h TYR 73 Cb 0.78 0.14 -0.01 0.00 1.55 0.00 0.00 36.73 39.19 1c0v h TYR 73 CO 0.05 -0.09 0.17 0.28 -1.32 0.00 0.00 178.16 177.25 1c0v h VAL 74 N -0.92 0.59 0.17 1.81 2.07 -0.65 -0.02 116.25 119.30 1c0v h VAL 74 Ca -0.05 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1c0v h VAL 74 Cb 0.53 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1c0v h VAL 74 CO 0.08 0.00 -0.08 -0.03 0.02 0.00 0.00 177.57 177.56 1c0v h MET 75 N 0.00 -0.22 -0.95 1.57 1.85 -0.45 -1.02 114.93 115.71 1c0v h MET 75 Ca 0.08 0.01 0.19 0.00 -0.61 0.00 0.00 59.70 59.38 1c0v h MET 75 Cb 0.42 0.05 -0.08 0.00 0.43 0.00 0.00 31.60 32.41 1c0v h MET 75 CO -0.00 -0.04 0.61 0.35 -0.40 0.00 0.00 176.91 177.42 1c0v h PHE 76 N -0.35 0.78 0.00 1.39 3.04 -0.37 0.72 116.94 122.15 1c0v h PHE 76 Ca -0.02 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.93 1c0v h PHE 76 Cb 0.27 -0.24 -0.00 0.00 2.56 0.00 0.00 35.95 38.54 1c0v h PHE 76 CO -0.03 0.20 -0.11 0.00 -2.02 0.00 0.00 178.31 176.35 1c0v h ALA 77 N 1.62 1.81 0.00 2.41 0.00 -0.53 -3.18 119.26 121.39 1c0v h ALA 77 Ca 0.51 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.32 1c0v h ALA 77 Cb 1.03 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1c0v h ALA 77 CO -0.26 0.14 -0.03 0.28 0.00 0.00 0.00 179.25 179.38 1c0v h VAL 78 N 0.00 0.13 0.00 0.00 2.07 0.14 -3.51 116.25 115.09 1c0v h VAL 78 Ca -0.00 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.42 1c0v h VAL 78 Cb 0.19 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1c0v h VAL 78 CO 0.01 0.05 0.00 0.00 0.02 0.00 0.00 177.57 177.65