#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p5l h LYS 3 N 0.00 0.03 -0.27 1.20 3.64 -2.05 -2.67 116.57 116.45 2p5l h LYS 3 Ca 0.00 -0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.43 2p5l h LYS 3 Cb 0.00 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 31.74 2p5l h LYS 3 CO 0.00 0.06 -0.45 0.78 -2.27 0.00 0.00 179.45 177.58 2p5l h GLY 4 N -0.01 -0.70 0.24 5.01 0.00 -2.05 0.22 103.07 105.77 2p5l h GLY 4 Ca 0.01 0.56 0.14 0.00 0.00 0.00 0.00 47.33 48.04 2p5l h GLY 4 CO -0.00 -0.19 0.41 1.46 0.00 0.00 0.00 176.54 178.21 2p5l h GLN 5 N -0.42 0.58 -0.58 4.80 4.20 -1.98 -0.54 115.11 121.16 2p5l h GLN 5 Ca 0.10 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 2p5l h GLN 5 Cb 0.61 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.23 2p5l h GLN 5 CO -0.49 0.38 0.24 -0.09 -0.67 0.00 0.00 178.83 178.20 2p5l h ARG 6 N 0.59 0.84 -0.02 1.46 2.43 -0.35 -2.03 114.38 117.31 2p5l h ARG 6 Ca 0.44 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.48 2p5l h ARG 6 Cb 0.61 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2p5l h ARG 6 CO -0.36 0.68 -0.02 0.45 -1.51 0.00 0.00 179.97 179.21 2p5l h HIS 7 N 0.83 0.06 -1.01 2.20 3.86 0.39 0.29 115.15 121.77 2p5l h HIS 7 Ca 0.20 -0.02 0.29 0.00 -1.16 0.00 0.00 60.37 59.68 2p5l h HIS 7 Cb 0.15 -0.01 -0.04 0.00 1.06 0.00 0.00 27.41 28.57 2p5l h HIS 7 CO 0.01 0.55 0.80 0.82 0.86 0.00 0.00 177.93 180.97 2p5l h ILE 8 N -0.45 0.37 0.14 2.45 2.04 -0.91 0.20 117.51 121.36 2p5l h ILE 8 Ca 0.00 0.00 -0.35 0.00 1.00 0.00 0.00 64.86 65.51 2p5l h ILE 8 Cb 0.54 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 2p5l h ILE 8 CO 0.01 0.00 -1.87 0.50 0.00 0.00 0.00 178.15 176.79 2p5l h LYS 9 N 0.00 0.31 0.01 2.37 1.63 -0.66 -2.95 116.57 117.27 2p5l h LYS 9 Ca 0.48 -0.52 0.02 0.00 -0.85 0.00 0.00 60.65 59.78 2p5l h LYS 9 Cb 2.08 0.19 -0.03 0.00 -0.60 0.00 0.00 32.23 33.87 2p5l h LYS 9 CO -0.01 1.22 -0.14 0.82 -3.45 0.00 0.00 179.45 177.89 2p5l h ILE 10 N 0.08 0.65 -0.77 2.00 2.04 0.24 0.20 117.51 121.95 2p5l h ILE 10 Ca -0.38 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.62 2p5l h ILE 10 Cb 2.06 0.65 -0.14 0.00 -0.74 0.00 0.00 36.82 38.65 2p5l h ILE 10 CO 0.13 0.00 -0.31 0.03 0.00 0.00 0.00 178.15 178.00 2p5l h ARG 11 N -0.24 -0.06 -0.46 2.37 3.08 -0.92 0.32 114.38 118.46 2p5l h ARG 11 Ca 0.05 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.11 2p5l h ARG 11 Cb 0.30 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 2p5l h ARG 11 CO -0.13 -0.04 0.31 1.49 -1.07 0.00 0.00 179.97 180.52 2p5l h GLU 12 N -0.07 0.59 0.16 0.04 4.81 -0.79 -2.57 114.58 116.76 2p5l h GLU 12 Ca 0.32 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.50 2p5l h GLU 12 Cb 0.58 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.83 2p5l h GLU 12 CO -0.82 0.39 -0.08 0.82 -0.73 0.00 0.00 179.01 178.60 2p5l h ILE 13 N 0.61 0.82 -0.07 2.32 2.04 0.25 -2.98 117.51 120.50 2p5l h ILE 13 Ca 0.17 -1.13 0.01 0.00 1.00 0.00 0.00 64.86 64.91 2p5l h ILE 13 Cb -0.05 1.38 -0.00 0.00 -0.74 0.00 0.00 36.82 37.41 2p5l h ILE 13 CO -0.04 0.21 0.05 0.16 0.00 0.00 0.00 178.15 178.54 2p5l h ILE 14 N -0.87 0.99 -0.06 -0.67 3.07 -1.23 0.34 117.51 119.08 2p5l h ILE 14 Ca -0.02 -0.02 -0.13 0.00 1.55 0.00 0.00 64.86 66.24 2p5l h ILE 14 Cb 0.52 0.93 -0.01 0.00 -0.27 0.00 0.00 36.82 37.99 2p5l h ILE 14 CO 0.04 0.01 -0.55 0.74 -1.05 0.00 0.00 178.15 177.34 2p5l h THR 15 N 0.06 1.38 -0.18 0.16 2.02 -1.50 -3.25 112.91 111.60 2p5l h THR 15 Ca 0.03 -1.87 0.00 0.00 0.77 0.00 0.00 66.41 65.34 2p5l h THR 15 Cb 0.05 1.95 0.00 0.00 -1.74 0.00 0.00 68.15 68.41 2p5l h THR 15 CO -0.00 0.55 0.00 -1.54 0.37 0.00 0.00 175.52 174.89 2p5l n SER 16 N -3.90 2.36 -4.07 4.18 3.41 -0.44 -4.99 113.62 110.17 2p5l n SER 16 Ca -0.02 -1.76 -0.08 0.00 -0.26 0.00 0.00 58.87 56.75 2p5l n SER 16 Cb 0.57 -0.11 -0.09 0.00 -0.26 0.00 0.00 64.21 64.31 2p5l n SER 16 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2p5l s ASN 17 N -0.90 0.34 -0.87 4.04 0.01 0.11 -5.06 114.94 112.60 2p5l s ASN 17 Ca 0.15 -1.01 -0.14 0.00 -0.71 0.00 0.00 52.86 51.16 2p5l s ASN 17 Cb 0.09 0.27 0.22 0.00 0.41 0.00 0.00 41.25 42.24 2p5l s ASN 17 CO 0.12 -0.69 0.84 -1.61 -1.51 0.00 0.00 177.10 174.25 2p5l s GLU 18 N -3.96 3.68 -0.51 -0.60 2.02 -1.26 -4.48 118.70 113.59 2p5l s GLU 18 Ca 0.13 -2.50 -0.25 0.00 0.02 0.00 0.00 54.97 52.38 2p5l s GLU 18 Cb 0.07 -4.49 0.03 0.00 0.10 0.00 0.00 34.13 29.85 2p5l s GLU 18 CO -0.05 -1.32 0.92 0.42 0.02 0.00 0.00 175.26 175.25 2p5l s ILE 19 N 0.20 4.44 -0.13 -1.63 -1.09 -1.26 -4.89 121.20 116.84 2p5l s ILE 19 Ca 0.21 0.49 0.20 0.00 -2.23 0.00 0.00 60.65 59.32 2p5l s ILE 19 Cb -0.10 -4.48 -0.20 0.00 -1.58 0.00 0.00 42.46 36.11 2p5l s ILE 19 CO -0.09 -0.97 0.63 1.21 -1.23 0.00 0.00 174.94 174.49 2p5l n GLU 20 N 7.29 0.64 -4.17 2.79 2.13 -1.26 -0.49 120.64 127.57 2p5l n GLU 20 Ca 0.04 0.01 -0.11 0.00 0.66 0.00 0.00 57.16 57.75 2p5l n GLU 20 Cb 0.48 -1.66 -0.10 0.00 0.27 0.00 0.00 31.44 30.42 2p5l n GLU 20 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2p5l s THR 21 N -3.17 0.73 0.30 6.31 -4.23 -1.26 -4.82 115.64 109.50 2p5l s THR 21 Ca -0.05 -1.84 0.09 0.00 -1.18 0.00 0.00 61.69 58.71 2p5l s THR 21 Cb 0.10 -1.56 0.02 0.00 1.34 0.00 0.00 72.50 72.40 2p5l s THR 21 CO 0.85 -0.79 1.69 1.56 -0.54 0.00 0.00 174.62 177.39 2p5l h GLN 22 N 3.15 0.12 -0.81 3.99 4.20 -1.97 -1.84 115.11 121.94 2p5l h GLN 22 Ca -0.36 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.30 2p5l h GLN 22 Cb 1.17 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.91 2p5l h GLN 22 CO 0.61 0.57 0.54 -0.44 -0.67 0.00 0.00 178.83 179.45 2p5l h ASP 23 N 0.09 0.93 -0.47 1.46 3.32 -1.95 0.28 116.42 120.09 2p5l h ASP 23 Ca 0.00 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 2p5l h ASP 23 Cb 0.88 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 2p5l h ASP 23 CO 0.07 0.67 0.28 -0.33 -1.72 0.00 0.00 179.24 178.21 2p5l h GLU 24 N 1.09 0.63 -0.41 3.56 5.08 -1.75 0.26 114.58 123.04 2p5l h GLU 24 Ca 0.30 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.58 2p5l h GLU 24 Cb -0.11 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 28.98 2p5l h GLU 24 CO -0.07 0.46 0.14 1.25 -1.00 0.00 0.00 179.01 179.79 2p5l h LEU 25 N 0.62 0.53 0.64 1.33 5.85 -0.78 0.57 115.31 124.08 2p5l h LEU 25 Ca 0.17 -0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 2p5l h LEU 25 Cb -0.01 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 40.89 2p5l h LEU 25 CO -0.03 0.50 -0.31 0.58 -0.34 0.00 0.00 178.44 178.84 2p5l h VAL 26 N 0.58 0.27 -0.68 1.05 2.07 0.13 0.20 116.25 119.87 2p5l h VAL 26 Ca 0.14 -0.23 0.19 0.00 0.82 0.00 0.00 66.70 67.62 2p5l h VAL 26 Cb 0.16 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 2p5l h VAL 26 CO -0.01 0.02 0.48 0.44 0.02 0.00 0.00 177.57 178.53 2p5l h ASP 27 N -1.04 0.06 0.05 0.57 3.45 0.50 -0.20 116.42 119.80 2p5l h ASP 27 Ca -0.09 0.00 -0.09 0.00 0.43 0.00 0.00 57.03 57.28 2p5l h ASP 27 Cb 0.70 -0.01 0.01 0.00 -0.56 0.00 0.00 39.33 39.48 2p5l h ASP 27 CO 0.15 0.03 -0.39 0.24 -1.57 0.00 0.00 179.24 177.70 2p5l h MET 28 N 0.06 0.18 -0.75 3.56 2.86 0.25 -3.18 114.93 117.92 2p5l h MET 28 Ca 0.33 -0.26 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 2p5l h MET 28 Cb 1.21 0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.92 2p5l h MET 28 CO -0.02 1.07 0.41 -0.07 1.06 0.00 0.00 176.91 179.35 2p5l h LEU 29 N -0.58 0.92 -1.00 1.22 3.38 0.11 -0.71 115.31 118.65 2p5l h LEU 29 Ca -0.06 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 2p5l h LEU 29 Cb 1.24 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 2p5l h LEU 29 CO 0.07 0.74 -0.10 0.11 0.09 0.00 0.00 178.44 179.36 2p5l h LYS 30 N 1.04 0.61 0.00 1.13 1.57 -0.74 0.38 116.57 120.56 2p5l h LYS 30 Ca 0.26 -0.18 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 2p5l h LYS 30 Cb 0.02 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2p5l h LYS 30 CO -0.04 0.70 -0.30 1.96 -0.57 0.00 0.00 179.45 181.19 2p5l h GLN 31 N 0.56 0.00 -0.66 3.15 4.20 -1.27 -2.13 115.11 118.97 2p5l h GLN 31 Ca 0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 2p5l h GLN 31 Cb 0.50 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.28 2p5l h GLN 31 CO 0.03 0.30 0.00 -0.25 -0.67 0.00 0.00 178.83 178.24 2p5l n ASP 32 N -3.48 4.20 0.00 1.46 10.43 -0.37 -4.95 116.55 123.83 2p5l n ASP 32 Ca -0.00 -2.29 0.00 0.00 2.57 0.00 0.00 54.79 55.07 2p5l n ASP 32 Cb 0.47 -0.53 0.00 0.00 1.84 0.00 0.00 41.12 42.90 2p5l n ASP 32 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2p5l n GLY 33 N 1.23 0.73 3.42 0.44 0.00 -0.09 -5.02 105.19 105.90 2p5l n GLY 33 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 2p5l n GLY 33 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2p5l s TYR 34 N -2.39 3.19 -0.36 1.61 1.51 0.11 -4.95 117.35 116.08 2p5l s TYR 34 Ca 0.00 -0.67 -0.19 0.00 -1.01 0.00 0.00 57.07 55.20 2p5l s TYR 34 Cb 0.00 -2.36 0.00 0.00 -0.11 0.00 0.00 41.96 39.49 2p5l s TYR 34 CO 0.00 -0.50 0.58 0.15 -1.11 0.00 0.00 175.55 174.67 2p5l s LYS 35 N 1.59 3.63 0.31 -0.62 1.02 -1.26 -2.33 119.74 122.09 2p5l s LYS 35 Ca 0.04 -0.07 -0.04 0.00 0.02 0.00 0.00 55.97 55.92 2p5l s LYS 35 Cb -0.17 -3.81 -0.00 0.00 -0.52 0.00 0.00 37.83 33.32 2p5l s LYS 35 CO 0.06 -0.70 0.44 0.14 -0.92 0.00 0.00 175.35 174.37 2p5l s VAL 36 N 2.56 0.00 0.33 3.17 -7.23 -1.26 -5.08 120.40 112.89 2p5l s VAL 36 Ca 0.22 -1.60 0.10 0.00 -1.81 0.00 0.00 61.98 58.89 2p5l s VAL 36 Cb -0.15 -2.54 -0.06 0.00 0.56 0.00 0.00 36.38 34.19 2p5l s VAL 36 CO 0.14 0.00 -0.12 0.42 -0.31 0.00 0.00 175.10 175.23 2p5l s THR 37 N -3.34 2.32 0.30 5.32 -4.23 -1.26 -4.96 115.64 109.78 2p5l s THR 37 Ca 0.30 -2.25 0.03 0.00 -1.18 0.00 0.00 61.69 58.59 2p5l s THR 37 Cb 0.00 -2.57 0.35 0.00 1.34 0.00 0.00 72.50 71.62 2p5l s THR 37 CO 0.17 -0.25 1.61 -0.61 -0.54 0.00 0.00 174.62 175.01 2p5l h GLN 38 N 2.08 0.11 -0.44 3.99 -0.00 -1.98 0.85 115.11 119.72 2p5l h GLN 38 Ca -0.42 -0.01 0.07 0.00 -0.00 0.00 0.00 58.65 58.30 2p5l h GLN 38 Cb 1.25 -0.03 -0.06 0.00 0.00 0.00 0.00 27.48 28.65 2p5l h GLN 38 CO 0.68 0.07 0.07 0.00 0.00 0.00 0.00 178.83 179.65 2p5l h ALA 39 N 1.87 0.47 -0.59 3.38 0.00 -1.99 -0.15 119.26 122.25 2p5l h ALA 39 Ca 0.59 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.50 2p5l h ALA 39 Cb 1.23 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 2p5l h ALA 39 CO -0.76 -0.33 0.02 1.15 0.00 0.00 0.00 179.25 179.33 2p5l h THR 40 N 0.20 1.26 -0.59 0.00 2.02 0.31 -2.18 112.91 113.93 2p5l h THR 40 Ca 0.21 -1.12 0.03 0.00 0.77 0.00 0.00 66.41 66.30 2p5l h THR 40 Cb 0.28 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 67.46 2p5l h THR 40 CO -0.29 0.41 0.36 0.58 0.37 0.00 0.00 175.52 176.94 2p5l h VAL 41 N 0.93 1.05 -0.44 3.16 2.07 -0.78 0.15 116.25 122.39 2p5l h VAL 41 Ca 0.17 -0.24 0.06 0.00 0.82 0.00 0.00 66.70 67.51 2p5l h VAL 41 Cb 0.53 0.29 -0.05 0.00 -1.52 0.00 0.00 31.29 30.54 2p5l h VAL 41 CO 0.03 0.13 0.13 -1.28 0.02 0.00 0.00 177.57 176.60 2p5l h SER 42 N 0.70 0.11 -0.50 0.57 0.87 -0.70 0.18 113.55 114.77 2p5l h SER 42 Ca 0.24 0.06 -0.06 0.00 -1.23 0.00 0.00 61.79 60.80 2p5l h SER 42 Cb 0.04 0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2p5l h SER 42 CO -0.11 0.09 0.07 0.03 -0.53 0.00 0.00 176.83 176.38 2p5l h ARG 43 N 0.29 0.83 0.13 2.24 3.08 -0.68 -0.54 114.38 119.74 2p5l h ARG 43 Ca 0.21 -0.23 0.01 0.00 0.07 0.00 0.00 59.98 60.04 2p5l h ARG 43 Cb 0.23 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 2p5l h ARG 43 CO -0.24 0.84 -0.21 -0.44 -1.07 0.00 0.00 179.97 178.85 2p5l h ASP 44 N 0.71 -0.58 -0.71 7.04 3.32 -0.49 -0.42 116.42 125.27 2p5l h ASP 44 Ca 0.15 0.07 0.09 0.00 0.02 0.00 0.00 57.03 57.36 2p5l h ASP 44 Cb 0.42 0.22 -0.07 0.00 0.22 0.00 0.00 39.33 40.11 2p5l h ASP 44 CO 0.01 -0.30 0.35 0.40 -1.72 0.00 0.00 179.24 177.99 2p5l h ILE 45 N -0.41 0.84 -0.40 0.35 2.04 -0.37 0.75 117.51 120.31 2p5l h ILE 45 Ca 0.02 -0.20 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 2p5l h ILE 45 Cb 0.42 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 2p5l h ILE 45 CO -0.11 0.11 0.18 0.50 0.00 0.00 0.00 178.15 178.83 2p5l h LYS 46 N 0.60 0.59 -0.12 2.37 3.64 -0.91 -1.20 116.57 121.53 2p5l h LYS 46 Ca 0.35 -0.10 -0.07 0.00 -1.27 0.00 0.00 60.65 59.56 2p5l h LYS 46 Cb 0.38 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 2p5l h LYS 46 CO -0.27 0.53 -0.26 0.93 -2.27 0.00 0.00 179.45 178.11 2p5l h GLU 47 N 0.50 0.22 0.00 1.90 5.08 0.45 -0.73 114.58 122.01 2p5l h GLU 47 Ca 0.14 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2p5l h GLU 47 Cb 0.15 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2p5l h GLU 47 CO -0.01 0.47 0.00 1.28 -1.00 0.00 0.00 179.01 179.75 2p5l n LEU 48 N -4.16 0.00 -2.06 1.33 4.77 0.25 -4.91 117.00 112.22 2p5l n LEU 48 Ca -0.01 0.39 -0.20 0.00 -0.03 0.00 0.00 56.01 56.16 2p5l n LEU 48 Cb 0.36 -0.39 -0.03 0.00 -2.33 0.00 0.00 43.42 41.03 2p5l n LEU 48 CO 0.40 -0.03 -0.24 1.41 -1.33 0.00 0.00 177.39 177.60 2p5l n HIS 49 N -1.39 -0.67 -0.78 -1.77 8.25 -0.28 -4.98 115.22 113.60 2p5l n HIS 49 Ca 0.10 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.26 2p5l n HIS 49 Cb 0.27 -3.70 0.19 0.00 1.12 0.00 0.00 29.99 27.87 2p5l n HIS 49 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2p5l s LEU 50 N -5.38 1.83 0.04 2.41 1.43 -0.81 -4.95 118.68 113.25 2p5l s LEU 50 Ca 0.00 1.71 0.02 0.00 -1.03 0.00 0.00 54.13 54.83 2p5l s LEU 50 Cb 0.00 -3.90 -0.02 0.00 0.03 0.00 0.00 46.19 42.29 2p5l s LEU 50 CO 0.00 -3.44 -0.07 0.68 0.23 0.00 0.00 176.35 173.75 2p5l s VAL 51 N -2.65 0.50 -0.39 -1.59 -7.23 -0.82 -4.91 120.40 103.31 2p5l s VAL 51 Ca 0.66 -1.10 -0.16 0.00 -1.81 0.00 0.00 61.98 59.58 2p5l s VAL 51 Cb -0.22 -0.62 0.01 0.00 0.56 0.00 0.00 36.38 36.11 2p5l s VAL 51 CO 0.60 -0.41 0.39 -0.75 -0.31 0.00 0.00 175.10 174.62 2p5l s LYS 52 N -1.66 3.26 0.18 4.82 2.20 -1.26 -0.90 119.74 126.38 2p5l s LYS 52 Ca -0.10 -0.66 0.10 0.00 -0.36 0.00 0.00 55.97 54.96 2p5l s LYS 52 Cb -0.09 -3.90 -0.04 0.00 -1.51 0.00 0.00 37.83 32.28 2p5l s LYS 52 CO 0.00 -0.71 -0.20 0.14 -0.36 0.00 0.00 175.35 174.22 2p5l s VAL 53 N 2.03 2.62 0.34 4.02 -7.23 0.01 -4.89 120.40 117.31 2p5l s VAL 53 Ca 0.11 -1.86 -0.29 0.00 -1.81 0.00 0.00 61.98 58.13 2p5l s VAL 53 Cb -0.17 -2.26 -0.11 0.00 0.56 0.00 0.00 36.38 34.40 2p5l s VAL 53 CO 0.12 -0.08 1.45 -2.84 -0.31 0.00 0.00 175.10 173.44 2p5l s PRO 54 N -2.62 4.19 0.00 4.82 0.02 -1.26 -1.04 135.00 139.11 2p5l s PRO 54 Ca 0.21 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.68 2p5l s PRO 54 Cb -0.09 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.42 2p5l s PRO 54 CO 0.11 -0.44 0.00 0.25 -0.33 0.00 0.00 177.00 176.59 2p5l n THR 55 N 0.94 0.00 0.10 0.99 -2.24 0.34 -4.81 114.28 109.60 2p5l n THR 55 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2p5l n THR 55 Cb 0.40 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.90 2p5l n THR 55 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2p5l n ASN 56 N -0.88 0.19 -3.17 3.42 2.85 -1.24 -4.93 115.26 111.52 2p5l n ASN 56 Ca 0.00 0.32 -0.32 0.00 -0.11 0.00 0.00 54.58 54.47 2p5l n ASN 56 Cb 0.00 0.15 -0.02 0.00 1.24 0.00 0.00 39.78 41.15 2p5l n ASN 56 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 2p5l n ASN 57 N -3.32 5.45 -0.03 1.20 3.02 -1.26 -4.68 115.26 115.63 2p5l n ASN 57 Ca 0.00 -3.69 -0.00 0.00 -0.03 0.00 0.00 54.58 50.86 2p5l n ASN 57 Cb 0.00 -0.76 -0.00 0.00 -0.61 0.00 0.00 39.78 38.41 2p5l n ASN 57 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2p5l n GLY 58 N -0.19 0.40 3.80 7.41 0.00 -1.26 -5.02 105.19 110.33 2p5l n GLY 58 Ca 0.36 -0.06 -0.23 0.00 0.00 0.00 0.00 46.02 46.10 2p5l n GLY 58 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2p5l s SER 59 N -2.07 4.74 0.34 1.61 1.04 -1.26 -4.97 113.70 113.14 2p5l s SER 59 Ca 0.00 -0.89 0.05 0.00 0.48 0.00 0.00 55.95 55.59 2p5l s SER 59 Cb 0.00 -0.56 -0.07 0.00 0.10 0.00 0.00 66.02 65.49 2p5l s SER 59 CO 0.00 -0.56 0.04 -0.31 0.98 0.00 0.00 173.24 173.39 2p5l s TYR 60 N -2.52 2.10 0.10 5.02 1.51 -1.26 0.13 117.35 122.42 2p5l s TYR 60 Ca 0.44 -0.86 -0.16 0.00 -1.01 0.00 0.00 57.07 55.47 2p5l s TYR 60 Cb -0.00 -1.39 0.03 0.00 -0.11 0.00 0.00 41.96 40.50 2p5l s TYR 60 CO 0.25 0.14 0.38 -1.59 -1.11 0.00 0.00 175.55 173.62 2p5l s LYS 61 N -3.83 1.00 0.17 -0.62 -2.85 -0.20 -4.23 119.74 109.17 2p5l s LYS 61 Ca 0.35 -0.62 -0.30 0.00 -1.00 0.00 0.00 55.97 54.41 2p5l s LYS 61 Cb 0.09 0.44 -0.07 0.00 -2.06 0.00 0.00 37.83 36.22 2p5l s LYS 61 CO 0.16 -0.37 1.02 0.71 0.10 0.00 0.00 175.35 176.97 2p5l s TYR 62 N -3.37 3.74 0.07 1.78 2.02 0.36 -0.81 117.35 121.13 2p5l s TYR 62 Ca 0.00 1.73 0.03 0.00 -0.37 0.00 0.00 57.07 58.46 2p5l s TYR 62 Cb 0.01 -3.15 -0.03 0.00 -0.40 0.00 0.00 41.96 38.39 2p5l s TYR 62 CO -0.09 -0.14 -0.09 0.45 -1.57 0.00 0.00 175.55 174.12 2p5l s SER 63 N -0.29 1.12 0.00 2.29 0.15 -0.08 -4.70 113.70 112.19 2p5l s SER 63 Ca 0.47 -0.71 0.25 0.00 0.70 0.00 0.00 55.95 56.65 2p5l s SER 63 Cb -0.27 0.03 1.47 0.00 -1.71 0.00 0.00 66.02 65.55 2p5l s SER 63 CO 0.33 -0.26 1.83 0.18 1.20 0.00 0.00 173.24 176.52