#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dyr n ILE 8 N 0.00 0.00 0.00 -0.18 0.13 -1.26 -4.99 119.36 113.06 2dyr n ILE 8 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 2dyr n ILE 8 Cb 0.00 -0.32 0.00 0.00 -0.84 0.00 0.00 39.64 38.48 2dyr n ILE 8 CO 0.00 0.00 0.00 1.17 2.80 0.00 0.00 176.55 180.52 2dyr n LYS 9 N -2.21 0.00 -2.73 9.51 3.00 -1.26 -4.98 118.16 119.50 2dyr n LYS 9 Ca -0.01 0.00 -0.07 0.00 -0.00 0.00 0.00 58.31 58.23 2dyr n LYS 9 Cb 0.12 0.00 0.02 0.00 0.00 0.00 0.00 35.03 35.17 2dyr n LYS 9 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 2dyr n ASN 10 N 0.00 -3.18 -4.72 3.14 5.15 -1.26 -5.01 115.26 109.38 2dyr n ASN 10 Ca 0.00 -0.14 -0.42 0.00 -0.60 0.00 0.00 54.58 53.42 2dyr n ASN 10 Cb 0.00 -1.83 -0.03 0.00 -0.53 0.00 0.00 39.78 37.39 2dyr n ASN 10 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 2dyr s TYR 11 N -2.99 2.92 -0.03 1.20 6.14 -1.26 -4.98 117.35 118.35 2dyr s TYR 11 Ca 0.15 0.40 -0.03 0.00 0.64 0.00 0.00 57.07 58.22 2dyr s TYR 11 Cb -0.07 -4.11 -0.01 0.00 0.42 0.00 0.00 41.96 38.20 2dyr s TYR 11 CO 0.19 -4.17 -0.06 1.04 0.64 0.00 0.00 175.55 173.18 2dyr n GLN 12 N 3.93 0.11 -3.96 4.97 6.02 -1.26 -5.08 117.38 122.10 2dyr n GLN 12 Ca 0.15 0.14 -0.10 0.00 -0.01 0.00 0.00 57.00 57.19 2dyr n GLN 12 Cb 0.36 -0.79 -0.07 0.00 1.02 0.00 0.00 30.24 30.76 2dyr n GLN 12 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 2dyr s THR 13 N -1.35 0.05 0.02 5.09 -1.32 -1.26 -5.12 115.64 111.75 2dyr s THR 13 Ca -0.05 -1.38 -0.33 0.00 -1.21 0.00 0.00 61.69 58.72 2dyr s THR 13 Cb 0.01 -1.92 -0.11 0.00 -1.51 0.00 0.00 72.50 68.96 2dyr s THR 13 CO 0.07 -0.21 1.85 0.00 -2.21 0.00 0.00 174.62 174.12 2dyr n ALA 14 N -0.26 1.40 -1.59 11.08 0.00 -1.26 -4.97 120.51 124.92 2dyr n ALA 14 Ca -0.06 0.30 -0.29 0.00 0.00 0.00 0.00 53.44 53.39 2dyr n ALA 14 Cb 0.63 -2.54 0.12 0.00 0.00 0.00 0.00 19.45 17.66 2dyr n ALA 14 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2dyr s PRO 15 N 3.41 1.47 0.32 0.00 0.04 -1.26 -4.98 135.00 134.00 2dyr s PRO 15 Ca 0.88 0.34 -0.29 0.00 0.04 0.00 0.00 61.00 61.97 2dyr s PRO 15 Cb -0.59 -1.87 -0.12 0.00 0.04 0.00 0.00 34.50 31.96 2dyr s PRO 15 CO 0.44 -1.98 1.44 0.34 0.04 0.00 0.00 177.00 177.28 2dyr n PHE 16 N -3.63 2.60 -3.99 0.56 -0.00 -1.26 -4.98 117.46 106.76 2dyr n PHE 16 Ca 0.07 0.43 -0.31 0.00 -0.00 0.00 0.00 57.45 57.64 2dyr n PHE 16 Cb 0.59 -2.50 -0.16 0.00 -0.00 0.00 0.00 39.48 37.41 2dyr n PHE 16 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 2dyr s ASP 17 N 0.04 3.81 0.62 -2.13 -1.08 -1.26 -5.00 116.67 111.66 2dyr s ASP 17 Ca 0.59 -1.12 0.29 0.00 -0.52 0.00 0.00 52.55 51.79 2dyr s ASP 17 Cb -0.54 -1.28 1.52 0.00 -1.46 0.00 0.00 42.92 41.16 2dyr s ASP 17 CO 0.57 -0.19 1.90 0.77 0.52 0.00 0.00 175.17 178.74 2dyr h SER 18 N 7.92 0.00 0.74 -0.34 4.64 -2.00 0.72 113.55 125.23 2dyr h SER 18 Ca -0.22 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.05 2dyr h SER 18 Cb 1.07 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 2dyr h SER 18 CO 0.45 0.00 -0.26 0.03 -0.87 0.00 0.00 176.83 176.17 2dyr h ARG 19 N 0.00 0.00 -2.37 4.77 3.08 -2.02 -3.35 114.38 114.49 2dyr h ARG 19 Ca 0.13 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.59 2dyr h ARG 19 Cb 0.96 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.62 2dyr h ARG 19 CO -0.00 0.26 -0.89 1.19 -1.07 0.00 0.00 179.97 179.46 2dyr n PHE 20 N -3.54 0.58 1.42 3.04 3.01 0.24 -4.96 117.46 117.26 2dyr n PHE 20 Ca -0.01 -3.67 0.14 0.00 1.01 0.00 0.00 57.45 54.92 2dyr n PHE 20 Cb 0.41 -0.18 0.48 0.00 -0.01 0.00 0.00 39.48 40.18 2dyr n PHE 20 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2dyr n PRO 21 N 2.02 1.50 -3.39 -1.08 -0.04 -1.23 -4.60 135.00 128.18 2dyr n PRO 21 Ca 0.26 -0.89 -0.22 0.00 -0.04 0.00 0.00 63.50 62.60 2dyr n PRO 21 Cb 0.46 -1.48 0.02 0.00 -0.04 0.00 0.00 33.50 32.46 2dyr n PRO 21 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2dyr s ASN 22 N -2.11 4.98 0.43 3.54 0.01 -1.26 -5.02 114.94 115.50 2dyr s ASN 22 Ca 0.35 -0.93 0.09 0.00 -0.71 0.00 0.00 52.86 51.65 2dyr s ASN 22 Cb 0.21 0.15 0.92 0.00 0.41 0.00 0.00 41.25 42.93 2dyr s ASN 22 CO 0.38 -1.13 2.05 1.56 -1.51 0.00 0.00 177.10 178.46 2dyr h GLN 23 N 0.52 0.40 -6.50 -0.60 4.20 -2.06 -3.38 115.11 107.69 2dyr h GLN 23 Ca -0.34 -0.03 -0.57 0.00 0.06 0.00 0.00 58.65 57.76 2dyr h GLN 23 Cb 1.29 -0.09 -0.08 0.00 0.30 0.00 0.00 27.48 28.91 2dyr h GLN 23 CO 0.49 0.30 0.84 1.21 -0.67 0.00 0.00 178.83 180.99 2dyr s ASN 24 N -6.78 6.67 -0.01 1.46 3.84 -1.26 -4.86 114.94 114.00 2dyr s ASN 24 Ca -0.07 0.53 0.14 0.00 0.21 0.00 0.00 52.86 53.67 2dyr s ASN 24 Cb 0.17 -2.53 0.41 0.00 -0.55 0.00 0.00 41.25 38.75 2dyr s ASN 24 CO 0.72 -1.12 1.34 0.00 -2.79 0.00 0.00 177.10 175.25 2dyr n GLN 25 N 7.48 2.88 -0.23 0.43 1.13 -1.26 -4.72 117.38 123.08 2dyr n GLN 25 Ca 0.11 -2.26 0.02 0.00 -1.94 0.00 0.00 57.00 52.93 2dyr n GLN 25 Cb 0.48 -1.39 0.14 0.00 0.11 0.00 0.00 30.24 29.59 2dyr n GLN 25 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 2dyr h THR 26 N 2.61 0.79 -0.30 5.09 2.02 -1.96 -2.10 112.91 119.06 2dyr h THR 26 Ca 0.00 -0.18 -0.12 0.00 0.77 0.00 0.00 66.41 66.88 2dyr h THR 26 Cb 0.85 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 2dyr h THR 26 CO 0.02 0.09 -0.32 -0.09 0.37 0.00 0.00 175.52 175.59 2dyr h ARG 27 N 0.51 0.64 -0.39 6.66 9.65 -1.99 -2.31 114.38 127.16 2dyr h ARG 27 Ca 0.35 -0.29 0.04 0.00 -1.10 0.00 0.00 59.98 58.98 2dyr h ARG 27 Cb 0.42 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.95 2dyr h ARG 27 CO -0.31 0.88 0.15 -0.97 2.80 0.00 0.00 179.97 182.52 2dyr h ASN 28 N 0.54 0.19 0.34 -3.80 -0.73 -1.72 0.57 115.58 110.97 2dyr h ASN 28 Ca 0.06 0.04 -0.02 0.00 1.87 0.00 0.00 56.30 58.25 2dyr h ASN 28 Cb 0.81 0.01 0.00 0.00 0.27 0.00 0.00 38.32 39.42 2dyr h ASN 28 CO 0.07 0.15 -0.16 0.00 -0.37 0.00 0.00 177.43 177.11 2dyr h TRP 30 N -0.60 -0.38 -0.16 0.00 2.91 -1.01 -1.23 115.95 115.48 2dyr h TRP 30 Ca -0.05 0.03 0.04 0.00 1.13 0.00 0.00 58.89 60.04 2dyr h TRP 30 Cb 0.44 0.20 -0.04 0.00 -0.51 0.00 0.00 29.16 29.25 2dyr h TRP 30 CO -0.02 -0.22 -0.10 0.37 -1.03 0.00 0.00 178.44 177.44 2dyr h GLN 31 N -0.14 -0.09 -0.32 2.65 5.75 0.15 -0.80 115.11 122.30 2dyr h GLN 31 Ca 0.13 0.01 -0.06 0.00 -0.15 0.00 0.00 58.65 58.58 2dyr h GLN 31 Cb 0.33 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.89 2dyr h GLN 31 CO -0.31 -0.06 -0.05 -0.91 -2.65 0.00 0.00 178.83 174.85 2dyr h ASN 32 N -0.10 0.49 -0.22 -0.69 2.35 -1.13 0.76 115.58 117.04 2dyr h ASN 32 Ca 0.10 -0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 2dyr h ASN 32 Cb 0.24 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 2dyr h ASN 32 CO -0.22 0.59 0.04 0.22 -1.65 0.00 0.00 177.43 176.41 2dyr h TYR 33 N 0.49 0.39 0.10 1.19 3.20 -0.80 -1.10 116.97 120.44 2dyr h TYR 33 Ca 0.10 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2dyr h TYR 33 Cb 0.39 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.56 2dyr h TYR 33 CO 0.01 0.49 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.90 2dyr h LEU 34 N 0.17 -0.12 -0.56 2.82 3.38 -0.77 -2.44 115.31 117.79 2dyr h LEU 34 Ca 0.07 -0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.12 2dyr h LEU 34 Cb 0.30 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.01 2dyr h LEU 34 CO 0.00 -0.08 0.18 0.44 0.09 0.00 0.00 178.44 179.08 2dyr h ASP 35 N -0.15 0.15 -0.06 -0.43 3.45 -0.77 0.17 116.42 118.78 2dyr h ASP 35 Ca -0.01 0.08 -0.00 0.00 0.43 0.00 0.00 57.03 57.52 2dyr h ASP 35 Cb 0.12 0.08 -0.00 0.00 -0.56 0.00 0.00 39.33 38.96 2dyr h ASP 35 CO 0.02 0.10 0.03 0.15 -1.57 0.00 0.00 179.24 177.98 2dyr h PHE 36 N 0.35 0.09 0.00 4.55 3.57 -1.06 -1.18 116.94 123.25 2dyr h PHE 36 Ca 0.28 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.77 2dyr h PHE 36 Cb 0.35 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.06 2dyr h PHE 36 CO -0.19 0.15 -0.06 0.45 -2.23 0.00 0.00 178.31 176.43 2dyr h HIS 37 N 0.01 0.00 0.04 0.41 3.86 -0.96 0.19 115.15 118.69 2dyr h HIS 37 Ca 0.02 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.13 2dyr h HIS 37 Cb 0.09 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.57 2dyr h HIS 37 CO -0.04 0.06 -0.41 0.00 0.86 0.00 0.00 177.93 178.40 2dyr h ARG 38 N 0.00 0.21 -0.42 2.45 3.08 -0.77 -2.61 114.38 116.32 2dyr h ARG 38 Ca -0.00 -0.28 -0.03 0.00 0.07 0.00 0.00 59.98 59.74 2dyr h ARG 38 Cb 0.51 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 2dyr h ARG 38 CO 0.01 1.05 0.14 0.00 -1.07 0.00 0.00 179.97 180.10 2dyr h GLU 40 N 0.54 0.68 -0.20 0.00 4.81 -0.71 -0.72 114.58 118.97 2dyr h GLU 40 Ca 0.14 -0.06 -0.21 0.00 -0.13 0.00 0.00 59.36 59.10 2dyr h GLU 40 Cb 0.25 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 29.49 2dyr h GLU 40 CO -0.01 0.50 -0.69 -0.22 -0.73 0.00 0.00 179.01 177.86 2dyr h LYS 41 N 0.69 0.80 -0.42 1.92 3.64 -1.06 -1.81 116.57 120.33 2dyr h LYS 41 Ca 0.18 -0.59 -0.05 0.00 -1.27 0.00 0.00 60.65 58.92 2dyr h LYS 41 Cb 0.01 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 2dyr h LYS 41 CO -0.03 1.21 0.06 0.00 -2.27 0.00 0.00 179.45 178.42 2dyr h ALA 42 N 0.64 0.56 -0.28 5.00 0.00 -0.56 -1.79 119.26 122.82 2dyr h ALA 42 Ca -0.03 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.52 2dyr h ALA 42 Cb 1.31 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2dyr h ALA 42 CO 0.14 0.28 -0.36 0.52 0.00 0.00 0.00 179.25 179.84 2dyr h MET 43 N 0.55 0.74 0.00 0.00 2.86 -1.19 -1.96 114.93 115.93 2dyr h MET 43 Ca 0.13 -0.42 -0.05 0.00 -2.06 0.00 0.00 59.70 57.30 2dyr h MET 43 Cb 0.39 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.07 2dyr h MET 43 CO 0.01 1.04 -0.22 1.15 1.06 0.00 0.00 176.91 179.96 2dyr h THR 44 N 0.49 0.84 0.00 2.22 2.02 -1.32 -1.26 112.91 115.90 2dyr h THR 44 Ca 0.03 -0.85 0.00 0.00 0.77 0.00 0.00 66.41 66.37 2dyr h THR 44 Cb 0.94 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.86 2dyr h THR 44 CO 0.08 0.21 0.00 0.00 0.37 0.00 0.00 175.52 176.19 2dyr n ALA 45 N -2.35 -0.01 0.06 6.16 0.00 -0.68 -4.28 120.51 119.41 2dyr n ALA 45 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2dyr n ALA 45 Cb 0.31 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.77 2dyr n ALA 45 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2dyr n LYS 46 N -1.12 0.03 -2.03 0.00 4.76 -0.75 -4.79 118.16 114.25 2dyr n LYS 46 Ca 0.00 0.00 -0.02 0.00 -2.87 0.00 0.00 58.31 55.42 2dyr n LYS 46 Cb 0.00 -1.12 0.00 0.00 -1.84 0.00 0.00 35.03 32.07 2dyr n LYS 46 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dyr n GLY 47 N -0.58 -0.83 0.15 0.72 0.00 -1.20 -5.07 105.19 98.37 2dyr n GLY 47 Ca 0.00 0.29 -0.01 0.00 0.00 0.00 0.00 46.02 46.30 2dyr n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dyr n GLY 48 N -0.72 2.73 3.42 -0.02 0.00 -0.48 -5.06 105.19 105.06 2dyr n GLY 48 Ca 0.03 -1.27 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 2dyr n GLY 48 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dyr s ASP 49 N -1.09 4.26 0.00 1.61 3.68 -1.26 -4.59 116.67 119.28 2dyr s ASP 49 Ca 0.01 -0.25 0.10 0.00 2.13 0.00 0.00 52.55 54.54 2dyr s ASP 49 Cb -0.00 -1.58 0.43 0.00 -1.45 0.00 0.00 42.92 40.32 2dyr s ASP 49 CO 0.01 0.19 1.29 0.52 0.13 0.00 0.00 175.17 177.30 2dyr n VAL 50 N 3.36 1.21 0.32 1.11 0.31 -1.26 -2.85 118.33 120.54 2dyr n VAL 50 Ca -0.18 0.30 0.21 0.00 -0.01 0.00 0.00 64.34 64.66 2dyr n VAL 50 Cb 0.53 -1.14 1.07 0.00 -0.91 0.00 0.00 33.84 33.39 2dyr n VAL 50 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2dyr h SER 51 N 0.00 0.00 0.85 4.52 4.64 -2.00 0.37 113.55 121.93 2dyr h SER 51 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 2dyr h SER 51 Cb 0.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 2dyr h SER 51 CO 0.00 0.01 -0.38 -0.37 -0.87 0.00 0.00 176.83 175.21 2dyr h VAL 52 N 0.00 0.90 -0.02 0.95 -1.51 -1.96 -2.89 116.25 111.72 2dyr h VAL 52 Ca -0.00 -1.55 0.00 0.00 -1.23 0.00 0.00 66.70 63.92 2dyr h VAL 52 Cb 0.13 1.95 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 2dyr h VAL 52 CO 0.00 0.38 0.00 0.00 -1.23 0.00 0.00 177.57 176.72 2dyr h GLU 54 N 0.50 -0.23 -0.65 0.00 4.57 -1.56 -2.85 114.58 114.35 2dyr h GLU 54 Ca 0.00 0.02 0.14 0.00 -1.18 0.00 0.00 59.36 58.33 2dyr h GLU 54 Cb 0.11 0.05 -0.12 0.00 -0.16 0.00 0.00 28.75 28.64 2dyr h GLU 54 CO 0.00 -0.16 -0.04 2.35 -1.18 0.00 0.00 179.01 179.98 2dyr h TRP 55 N -0.24 -0.12 -0.41 0.92 2.91 -1.85 0.19 115.95 117.35 2dyr h TRP 55 Ca 0.17 0.05 -0.05 0.00 1.13 0.00 0.00 58.89 60.19 2dyr h TRP 55 Cb 0.51 0.16 -0.02 0.00 -0.51 0.00 0.00 29.16 29.30 2dyr h TRP 55 CO -0.49 -0.21 0.04 1.88 -1.03 0.00 0.00 178.44 178.63 2dyr h TYR 56 N 0.08 0.65 -0.41 2.65 0.99 -1.84 -1.28 116.97 117.82 2dyr h TYR 56 Ca 0.34 -0.06 -0.06 0.00 2.00 0.00 0.00 58.73 60.95 2dyr h TYR 56 Cb 0.56 -0.19 -0.02 0.00 1.00 0.00 0.00 36.73 38.08 2dyr h TYR 56 CO -0.42 0.60 0.03 -0.09 -0.00 0.00 0.00 178.16 178.28 2dyr h ARG 57 N 0.61 0.70 -0.27 4.88 2.43 -0.81 -1.50 114.38 120.41 2dyr h ARG 57 Ca 0.13 -0.21 -0.04 0.00 -0.81 0.00 0.00 59.98 59.06 2dyr h ARG 57 Cb 0.32 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 2dyr h ARG 57 CO 0.01 0.77 0.03 0.00 -1.51 0.00 0.00 179.97 179.26 2dyr h ARG 58 N 0.54 0.46 -0.04 0.20 2.47 -0.85 -1.49 114.38 115.67 2dyr h ARG 58 Ca 0.12 -0.13 -0.00 0.00 -1.26 0.00 0.00 59.98 58.70 2dyr h ARG 58 Cb 0.44 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 28.71 2dyr h ARG 58 CO 0.02 0.59 0.02 0.28 0.56 0.00 0.00 179.97 181.44 2dyr h VAL 59 N 0.27 1.10 -0.25 2.04 2.07 -1.18 -1.59 116.25 118.71 2dyr h VAL 59 Ca 0.08 -0.29 -0.08 0.00 0.82 0.00 0.00 66.70 67.24 2dyr h VAL 59 Cb 0.37 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 2dyr h VAL 59 CO 0.01 0.08 -0.18 0.10 0.02 0.00 0.00 177.57 177.60 2dyr h TYR 60 N -0.06 0.48 -0.77 1.57 -0.00 -1.28 -1.34 116.97 115.58 2dyr h TYR 60 Ca 0.01 -0.08 -0.05 0.00 0.00 0.00 0.00 58.73 58.61 2dyr h TYR 60 Cb 0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 36.73 36.68 2dyr h TYR 60 CO -0.04 0.60 0.30 0.87 -0.00 0.00 0.00 178.16 179.90 2dyr h LYS 61 N 0.41 1.16 -0.23 0.10 1.57 -1.11 0.58 116.57 119.05 2dyr h LYS 61 Ca 0.07 -0.21 -0.05 0.00 -1.87 0.00 0.00 60.65 58.59 2dyr h LYS 61 Cb 0.54 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2dyr h LYS 61 CO 0.04 0.95 -0.04 0.77 -0.57 0.00 0.00 179.45 180.59 2dyr h SER 62 N 1.12 0.44 0.21 0.86 0.02 -0.66 -3.37 113.55 112.17 2dyr h SER 62 Ca 0.26 -0.35 -0.35 0.00 -0.84 0.00 0.00 61.79 60.51 2dyr h SER 62 Cb 0.22 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.64 2dyr h SER 62 CO -0.02 0.68 -1.82 -0.07 -1.14 0.00 0.00 176.83 174.47 2dyr h LEU 63 N 0.18 0.49 -9.48 5.07 3.38 -1.19 -3.48 115.31 110.28 2dyr h LEU 63 Ca 0.06 -0.85 -0.53 0.00 0.09 0.00 0.00 57.88 56.64 2dyr h LEU 63 Cb 0.48 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2dyr h LEU 63 CO 0.02 1.74 0.45 0.00 0.09 0.00 0.00 178.44 180.74 2dyr n PRO 65 N 3.64 2.30 -0.36 0.00 -0.02 -1.26 -4.84 135.00 134.46 2dyr n PRO 65 Ca 0.06 0.81 0.08 0.00 -2.02 0.00 0.00 63.50 62.43 2dyr n PRO 65 Cb 0.49 -2.52 0.24 0.00 -0.02 0.00 0.00 33.50 31.69 2dyr n PRO 65 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2dyr h ILE 66 N 2.52 0.89 -0.02 4.25 2.04 -1.94 -2.00 117.51 123.26 2dyr h ILE 66 Ca -0.49 -0.33 -0.06 0.00 1.00 0.00 0.00 64.86 64.99 2dyr h ILE 66 Cb 1.27 -0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 2dyr h ILE 66 CO 0.62 0.17 -0.26 0.77 0.00 0.00 0.00 178.15 179.46 2dyr h SER 67 N 0.95 0.03 0.15 1.72 4.64 -1.98 0.18 113.55 119.23 2dyr h SER 67 Ca 0.50 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.81 2dyr h SER 67 Cb 0.53 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2dyr h SER 67 CO -0.28 0.29 -0.07 -0.50 -0.87 0.00 0.00 176.83 175.39 2dyr h TRP 68 N 0.02 -0.18 -0.59 4.77 4.06 -1.73 -0.77 115.95 121.54 2dyr h TRP 68 Ca 0.00 -0.00 0.03 0.00 2.06 0.00 0.00 58.89 60.97 2dyr h TRP 68 Cb 0.47 0.06 -0.04 0.00 -1.00 0.00 0.00 29.16 28.65 2dyr h TRP 68 CO 0.00 0.24 0.36 0.28 -3.56 0.00 0.00 178.44 175.76 2dyr h VAL 69 N -0.68 1.07 -0.71 1.49 2.07 -1.33 0.02 116.25 118.19 2dyr h VAL 69 Ca -0.02 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 2dyr h VAL 69 Cb 0.50 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 2dyr h VAL 69 CO 0.03 0.13 0.39 -1.28 0.02 0.00 0.00 177.57 176.86 2dyr h SER 70 N 0.71 0.88 -0.32 0.57 0.87 -0.95 0.01 113.55 115.33 2dyr h SER 70 Ca 0.24 -0.10 -0.06 0.00 -1.23 0.00 0.00 61.79 60.63 2dyr h SER 70 Cb 0.02 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.74 2dyr h SER 70 CO -0.10 0.73 -0.05 0.74 -0.53 0.00 0.00 176.83 177.62 2dyr h THR 71 N 0.97 1.27 -0.61 2.23 2.02 -0.67 -1.79 112.91 116.33 2dyr h THR 71 Ca 0.25 -1.07 -0.03 0.00 0.77 0.00 0.00 66.41 66.33 2dyr h THR 71 Cb 0.04 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 2dyr h THR 71 CO -0.04 0.35 0.26 -0.50 0.37 0.00 0.00 175.52 175.96 2dyr h TRP 72 N 0.38 0.92 -0.29 3.16 6.55 -0.81 -1.17 115.95 124.69 2dyr h TRP 72 Ca 0.08 -0.06 -0.01 0.00 0.95 0.00 0.00 58.89 59.85 2dyr h TRP 72 Cb 0.53 -0.28 -0.01 0.00 -0.86 0.00 0.00 29.16 28.54 2dyr h TRP 72 CO 0.05 0.72 0.13 -0.44 -1.05 0.00 0.00 178.44 177.84 2dyr h ASP 73 N 0.85 0.38 -1.01 -3.49 3.45 -0.96 0.29 116.42 115.94 2dyr h ASP 73 Ca 0.21 -0.14 0.03 0.00 0.43 0.00 0.00 57.03 57.55 2dyr h ASP 73 Cb 0.17 -0.10 -0.05 0.00 -0.56 0.00 0.00 39.33 38.79 2dyr h ASP 73 CO -0.02 0.42 0.66 0.44 -1.57 0.00 0.00 179.24 179.17 2dyr h ASP 74 N 0.33 1.13 0.12 6.45 5.19 -1.12 -2.02 116.42 126.49 2dyr h ASP 74 Ca 0.10 -0.02 -0.18 0.00 -0.62 0.00 0.00 57.03 56.31 2dyr h ASP 74 Cb 0.14 -0.27 -0.00 0.00 0.18 0.00 0.00 39.33 39.38 2dyr h ASP 74 CO -0.01 0.79 -0.68 0.03 -3.12 0.00 0.00 179.24 176.25 2dyr h ARG 75 N 1.32 0.51 -0.47 3.56 3.08 -0.86 -1.00 114.38 120.52 2dyr h ARG 75 Ca 0.39 -0.39 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 2dyr h ARG 75 Cb -0.07 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2dyr h ARG 75 CO -0.11 1.01 0.06 0.00 -1.07 0.00 0.00 179.97 179.87 2dyr h ARG 76 N 0.36 0.73 -0.19 0.04 3.08 -0.61 0.17 114.38 117.96 2dyr h ARG 76 Ca -0.02 -0.16 -0.17 0.00 0.07 0.00 0.00 59.98 59.70 2dyr h ARG 76 Cb 1.26 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 31.20 2dyr h ARG 76 CO 0.12 0.70 -0.57 0.00 -1.07 0.00 0.00 179.97 179.15 2dyr h ALA 77 N 1.37 0.63 0.00 0.04 0.00 -1.24 -2.92 119.26 117.13 2dyr h ALA 77 Ca 0.15 -0.52 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 2dyr h ALA 77 Cb 0.34 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2dyr h ALA 77 CO 0.01 0.69 -0.17 1.49 0.00 0.00 0.00 179.25 181.27 2dyr h GLU 78 N 0.47 0.00 0.00 0.00 4.81 -0.74 -3.47 114.58 115.64 2dyr h GLU 78 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2dyr h GLU 78 Cb 1.14 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.52 2dyr h GLU 78 CO 0.11 0.17 0.00 0.41 -0.73 0.00 0.00 179.01 178.97 2dyr n GLY 79 N 0.52 0.77 0.86 1.92 0.00 0.35 -4.97 105.19 104.64 2dyr n GLY 79 Ca 0.01 -0.20 0.07 0.00 0.00 0.00 0.00 46.02 45.91 2dyr n GLY 79 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dyr n THR 80 N -2.41 1.78 -2.18 2.61 -2.24 0.21 -4.97 114.28 107.07 2dyr n THR 80 Ca 0.00 -1.49 -0.43 0.00 -2.27 0.00 0.00 64.05 59.86 2dyr n THR 80 Cb 0.00 0.06 -0.02 0.00 -2.10 0.00 0.00 70.33 68.26 2dyr n THR 80 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2dyr s PHE 81 N -2.07 2.33 0.11 4.78 5.36 -1.05 -4.89 117.98 122.55 2dyr s PHE 81 Ca 0.36 0.55 0.29 0.00 -0.96 0.00 0.00 56.93 57.16 2dyr s PHE 81 Cb 0.26 -3.76 1.14 0.00 -0.34 0.00 0.00 43.02 40.32 2dyr s PHE 81 CO 0.13 -2.91 1.91 -1.00 -1.46 0.00 0.00 175.22 171.88 2dyr h PRO 82 N 9.13 0.00 -7.38 10.12 0.13 -1.93 -3.45 132.00 138.61 2dyr h PRO 82 Ca -0.34 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.29 2dyr h PRO 82 Cb 1.15 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.36 2dyr h PRO 82 CO 0.97 0.10 0.38 0.20 -0.23 0.00 0.00 178.00 179.42 2dyr s GLY 83 N -4.23 1.65 -0.31 1.56 0.00 -1.26 -5.02 107.32 99.71 2dyr s GLY 83 Ca 0.01 -0.08 -0.19 0.00 0.00 0.00 0.00 44.72 44.46 2dyr s GLY 83 CO 0.59 0.25 0.56 1.25 0.00 0.00 0.00 173.10 175.75 2dyr s LYS 84 N -5.15 3.84 0.00 2.90 2.20 -1.26 -5.17 119.74 117.11 2dyr s LYS 84 Ca 0.58 0.14 0.00 0.00 -0.36 0.00 0.00 55.97 56.33 2dyr s LYS 84 Cb -0.13 -3.74 0.00 0.00 -1.51 0.00 0.00 37.83 32.45 2dyr s LYS 84 CO 0.54 -0.55 0.26 -0.89 -0.36 0.00 0.00 175.35 174.35