#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i11 n HIS 2 N 0.00 1.21 -2.83 6.00 -0.00 -1.26 -4.23 115.22 114.11 1i11 n HIS 2 Ca 0.00 -1.80 -0.11 0.00 0.46 0.00 0.00 57.72 56.27 1i11 n HIS 2 Cb 0.00 -1.11 0.05 0.00 -0.12 0.00 0.00 29.99 28.82 1i11 n HIS 2 CO 0.00 0.00 0.00 0.44 0.46 0.00 0.00 176.34 177.24 1i11 n ILE 3 N 0.88 0.15 -0.63 3.57 -5.35 -1.26 -5.00 119.36 111.72 1i11 n ILE 3 Ca 0.34 -2.59 -0.19 0.00 -0.27 0.00 0.00 62.75 60.04 1i11 n ILE 3 Cb 0.60 0.77 -0.01 0.00 -1.74 0.00 0.00 39.64 39.26 1i11 n ILE 3 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1i11 n LYS 4 N 0.03 1.77 -2.15 6.28 5.02 -1.26 -4.87 118.16 122.98 1i11 n LYS 4 Ca 0.09 -1.31 -0.42 0.00 -2.02 0.00 0.00 58.31 54.65 1i11 n LYS 4 Cb 0.75 -2.38 -0.03 0.00 -0.02 0.00 0.00 35.03 33.35 1i11 n LYS 4 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1i11 s ARG 5 N 3.64 4.27 -1.30 1.97 6.06 -1.26 -4.89 118.95 127.45 1i11 s ARG 5 Ca 0.33 2.06 -0.14 0.00 -2.50 0.00 0.00 55.73 55.48 1i11 s ARG 5 Cb 0.09 -3.54 -0.04 0.00 0.06 0.00 0.00 34.95 31.52 1i11 s ARG 5 CO -0.03 -0.59 2.32 -0.35 -2.50 0.00 0.00 175.30 174.14 1i11 n PRO 6 N 5.25 2.69 -3.78 5.12 -0.04 -1.26 -4.90 135.00 138.08 1i11 n PRO 6 Ca 0.14 -2.24 -0.21 0.00 -0.04 0.00 0.00 63.50 61.14 1i11 n PRO 6 Cb 0.43 -3.02 -0.04 0.00 -0.04 0.00 0.00 33.50 30.83 1i11 n PRO 6 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1i11 s MET 7 N 3.36 2.63 0.00 0.54 0.23 -1.26 -4.87 119.30 119.93 1i11 s MET 7 Ca 0.53 -1.39 0.00 0.00 -1.03 0.00 0.00 55.69 53.80 1i11 s MET 7 Cb 0.15 -2.41 0.00 0.00 -1.53 0.00 0.00 34.83 31.03 1i11 s MET 7 CO -0.04 0.02 0.00 -1.71 -2.03 0.00 0.00 175.02 171.26 1i11 n ASN 8 N -1.39 0.00 -0.18 -1.18 2.85 -1.26 -4.89 115.26 109.20 1i11 n ASN 8 Ca -0.01 0.00 0.20 0.00 -0.11 0.00 0.00 54.58 54.66 1i11 n ASN 8 Cb 0.60 0.00 0.57 0.00 1.24 0.00 0.00 39.78 42.19 1i11 n ASN 8 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1i11 h ALA 9 N 0.00 2.33 0.36 5.20 0.00 -1.88 2.19 119.26 127.45 1i11 h ALA 9 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1i11 h ALA 9 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1i11 h ALA 9 CO 0.00 -0.57 -0.17 0.35 0.00 0.00 0.00 179.25 178.86 1i11 h PHE 10 N 0.29 -0.44 0.00 0.00 3.57 -1.93 2.20 116.94 120.63 1i11 h PHE 10 Ca 0.41 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.90 1i11 h PHE 10 Cb 1.16 0.15 0.00 0.00 2.79 0.00 0.00 35.95 40.05 1i11 h PHE 10 CO -0.00 -0.28 0.00 0.52 -2.23 0.00 0.00 178.31 176.32 1i11 h MET 11 N -0.85 0.00 0.08 1.11 2.86 -1.74 2.23 114.93 118.62 1i11 h MET 11 Ca -0.05 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.42 1i11 h MET 11 Cb 0.37 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.03 1i11 h MET 11 CO 0.08 0.00 -0.86 0.28 1.06 0.00 0.00 176.91 177.47 1i11 h VAL 12 N 0.00 1.36 0.04 -2.22 2.07 0.39 -2.51 116.25 115.38 1i11 h VAL 12 Ca 0.00 -2.40 -0.24 0.00 0.82 0.00 0.00 66.70 64.88 1i11 h VAL 12 Cb 0.12 2.98 -0.02 0.00 -1.52 0.00 0.00 31.29 32.85 1i11 h VAL 12 CO 0.00 0.63 -1.14 -0.25 0.02 0.00 0.00 177.57 176.83 1i11 h TRP 13 N -0.58 0.16 0.00 1.57 7.01 0.48 -3.23 115.95 121.36 1i11 h TRP 13 Ca -0.18 -0.12 -0.06 0.00 2.11 0.00 0.00 58.89 60.64 1i11 h TRP 13 Cb 1.48 -0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 28.52 1i11 h TRP 13 CO 0.18 1.10 -0.30 0.00 -2.79 0.00 0.00 178.44 176.63 1i11 h ALA 14 N 0.85 0.99 0.00 2.65 0.00 0.35 0.25 119.26 124.36 1i11 h ALA 14 Ca -0.07 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.50 1i11 h ALA 14 Cb 1.86 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 1i11 h ALA 14 CO 0.15 0.37 -0.30 1.57 0.00 0.00 0.00 179.25 181.04 1i11 h LYS 15 N 0.00 0.00 0.04 0.00 2.10 -1.46 1.93 116.57 119.18 1i11 h LYS 15 Ca -0.00 0.00 -0.34 0.00 -2.00 0.00 0.00 60.65 58.31 1i11 h LYS 15 Cb 0.85 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.13 1i11 h LYS 15 CO 0.04 0.30 -2.00 -3.47 -2.00 0.00 0.00 179.45 172.32 1i11 n ASP 16 N -3.97 1.24 -0.03 7.07 -0.08 -1.01 -2.23 116.55 117.53 1i11 n ASP 16 Ca -0.02 0.22 -0.08 0.00 -1.51 0.00 0.00 54.79 53.40 1i11 n ASP 16 Cb 0.37 -0.17 0.10 0.00 2.34 0.00 0.00 41.12 43.76 1i11 n ASP 16 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1i11 h GLU 17 N 0.02 0.63 -0.04 -0.67 4.39 -0.10 2.07 114.58 120.89 1i11 h GLU 17 Ca -0.41 -0.30 -0.21 0.00 0.34 0.00 0.00 59.36 58.78 1i11 h GLU 17 Cb 2.05 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.69 1i11 h GLU 17 CO 0.05 0.90 -0.86 0.07 -1.16 0.00 0.00 179.01 178.01 1i11 h ARG 18 N 0.53 0.44 -0.47 2.33 -0.00 0.29 0.52 114.38 118.03 1i11 h ARG 18 Ca 0.05 -0.42 -0.13 0.00 -0.00 0.00 0.00 59.98 59.48 1i11 h ARG 18 Cb 0.86 0.11 -0.01 0.00 -0.00 0.00 0.00 29.97 30.92 1i11 h ARG 18 CO 0.07 1.07 -0.21 0.00 -0.00 0.00 0.00 179.97 180.91 1i11 h ARG 19 N 0.27 0.96 0.00 0.08 2.47 -1.00 2.23 114.38 119.39 1i11 h ARG 19 Ca -0.06 -0.40 -0.01 0.00 -1.26 0.00 0.00 59.98 58.25 1i11 h ARG 19 Cb 1.47 -0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 29.76 1i11 h ARG 19 CO 0.15 1.07 -0.06 -0.22 0.56 0.00 0.00 179.97 181.47 1i11 h LYS 20 N 0.83 0.00 0.04 0.04 3.64 0.37 -2.82 116.57 118.67 1i11 h LYS 20 Ca 0.11 0.00 -0.38 0.00 -1.27 0.00 0.00 60.65 59.11 1i11 h LYS 20 Cb 0.78 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.54 1i11 h LYS 20 CO 0.06 0.06 -2.28 -0.89 -2.27 0.00 0.00 179.45 174.14 1i11 n ILE 21 N -3.16 1.59 -0.19 2.00 -0.00 0.18 -4.13 119.36 115.64 1i11 n ILE 21 Ca 0.01 -0.54 0.25 0.00 -0.00 0.00 0.00 62.75 62.46 1i11 n ILE 21 Cb 0.38 -1.60 0.64 0.00 -0.00 0.00 0.00 39.64 39.06 1i11 n ILE 21 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.55 176.80 1i11 h LEU 22 N -0.15 0.15 -0.99 1.39 5.85 0.37 1.83 115.31 123.77 1i11 h LEU 22 Ca -0.53 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.16 1i11 h LEU 22 Cb 1.87 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.87 1i11 h LEU 22 CO -0.08 0.06 0.21 0.06 -0.34 0.00 0.00 178.44 178.34 1i11 h GLN 23 N 0.15 0.94 0.00 1.25 3.07 -1.65 1.20 115.11 120.07 1i11 h GLN 23 Ca 0.44 -0.17 0.00 0.00 0.09 0.00 0.00 58.65 59.00 1i11 h GLN 23 Cb 1.48 -0.15 0.00 0.00 0.08 0.00 0.00 27.48 28.89 1i11 h GLN 23 CO -0.07 0.80 -0.37 0.00 0.09 0.00 0.00 178.83 179.28 1i11 n ALA 24 N -2.45 2.68 -2.77 0.06 0.00 0.53 -4.49 120.51 114.07 1i11 n ALA 24 Ca 0.05 -0.16 -0.08 0.00 0.00 0.00 0.00 53.44 53.25 1i11 n ALA 24 Cb 0.20 -1.29 0.03 0.00 0.00 0.00 0.00 19.45 18.39 1i11 n ALA 24 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1i11 n PHE 25 N -2.15 -3.38 0.54 0.00 3.72 0.36 -4.96 117.46 111.60 1i11 n PHE 25 Ca 0.04 -1.71 0.08 0.00 -0.05 0.00 0.00 57.45 55.80 1i11 n PHE 25 Cb 0.43 1.48 0.33 0.00 -0.94 0.00 0.00 39.48 40.78 1i11 n PHE 25 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1i11 n PRO 26 N 2.01 0.00 -0.07 -1.08 -0.04 0.40 -2.41 135.00 133.80 1i11 n PRO 26 Ca 0.12 0.23 -0.07 0.00 -0.04 0.00 0.00 63.50 63.74 1i11 n PRO 26 Cb 0.61 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.45 1i11 n PRO 26 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1i11 n ASP 27 N -1.50 1.23 0.17 3.54 9.92 -1.26 -4.27 116.55 124.38 1i11 n ASP 27 Ca 0.04 0.00 0.12 0.00 -0.53 0.00 0.00 54.79 54.42 1i11 n ASP 27 Cb 0.18 0.92 0.61 0.00 -0.64 0.00 0.00 41.12 42.20 1i11 n ASP 27 CO 0.00 0.00 0.00 -0.03 0.13 0.00 0.00 177.20 177.30 1i11 h MET 28 N 0.00 0.00 -0.98 -1.24 1.85 -1.85 -2.62 114.93 110.08 1i11 h MET 28 Ca -0.39 0.00 0.12 0.00 -0.61 0.00 0.00 59.70 58.81 1i11 h MET 28 Cb 1.88 0.00 -0.08 0.00 0.43 0.00 0.00 31.60 33.83 1i11 h MET 28 CO 0.02 0.00 0.61 1.12 -0.40 0.00 0.00 176.91 178.27 1i11 h HIS 29 N 0.00 1.11 0.00 1.39 2.07 -1.73 -2.97 115.15 115.02 1i11 h HIS 29 Ca 0.00 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.55 1i11 h HIS 29 Cb 0.06 -0.35 0.00 0.00 2.57 0.00 0.00 27.41 29.69 1i11 h HIS 29 CO 0.00 0.44 0.03 0.09 -3.07 0.00 0.00 177.93 175.42 1i11 n ASN 30 N -4.63 -0.05 -3.27 3.10 5.03 -0.99 0.21 115.26 114.65 1i11 n ASN 30 Ca 0.18 -0.04 -0.20 0.00 0.87 0.00 0.00 54.58 55.40 1i11 n ASN 30 Cb 0.35 -0.02 -0.04 0.00 -1.02 0.00 0.00 39.78 39.05 1i11 n ASN 30 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 1i11 n SER 31 N 0.12 -1.26 -0.01 6.41 2.88 -1.26 -4.65 113.62 115.85 1i11 n SER 31 Ca 0.00 -0.36 -0.04 0.00 -1.33 0.00 0.00 58.87 57.14 1i11 n SER 31 Cb 0.01 -1.16 -0.01 0.00 -0.75 0.00 0.00 64.21 62.30 1i11 n SER 31 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1i11 n ASN 32 N -1.71 0.44 -0.20 -3.46 3.02 0.57 -4.65 115.26 109.27 1i11 n ASN 32 Ca 0.06 0.07 0.30 0.00 -0.03 0.00 0.00 54.58 54.98 1i11 n ASN 32 Cb 0.42 -0.17 0.71 0.00 -0.61 0.00 0.00 39.78 40.13 1i11 n ASN 32 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1i11 h ILE 33 N -0.15 0.35 -0.63 2.41 1.08 -1.40 0.40 117.51 119.58 1i11 h ILE 33 Ca -0.09 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.45 1i11 h ILE 33 Cb 0.94 0.42 -0.06 0.00 -3.07 0.00 0.00 36.82 35.05 1i11 h ILE 33 CO -0.05 0.00 0.32 -1.28 -0.69 0.00 0.00 178.15 176.45 1i11 h SER 34 N 0.00 0.43 0.99 1.72 0.87 -1.82 0.79 113.55 116.53 1i11 h SER 34 Ca 0.45 0.05 -0.08 0.00 -1.23 0.00 0.00 61.79 60.98 1i11 h SER 34 Cb 2.03 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.94 1i11 h SER 34 CO -0.00 0.27 -0.37 0.07 -0.53 0.00 0.00 176.83 176.27 1i11 h LYS 35 N 0.58 0.00 0.14 2.24 2.10 -0.50 -2.29 116.57 118.84 1i11 h LYS 35 Ca 0.30 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.94 1i11 h LYS 35 Cb 0.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.58 1i11 h LYS 35 CO -0.22 0.37 -0.07 0.82 -2.00 0.00 0.00 179.45 178.35 1i11 h ILE 36 N 0.00 1.02 0.45 0.07 5.03 -0.20 -1.85 117.51 122.02 1i11 h ILE 36 Ca -0.00 -0.97 -0.01 0.00 -0.12 0.00 0.00 64.86 63.76 1i11 h ILE 36 Cb 0.96 1.59 -0.03 0.00 -3.03 0.00 0.00 36.82 36.31 1i11 h ILE 36 CO 0.05 0.22 -0.49 -0.07 -0.68 0.00 0.00 178.15 177.18 1i11 h LEU 37 N -0.68 -1.35 -1.43 1.44 3.38 0.50 2.07 115.31 119.24 1i11 h LEU 37 Ca -0.02 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1i11 h LEU 37 Cb 0.50 0.45 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1i11 h LEU 37 CO 0.03 -0.64 0.16 1.23 0.09 0.00 0.00 178.44 179.32 1i11 h GLY 38 N -0.95 0.00 0.00 0.83 0.00 -1.48 2.33 103.07 103.79 1i11 h GLY 38 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1i11 h GLY 38 CO -0.09 0.00 -1.66 -1.26 0.00 0.00 0.00 176.54 173.53 1i11 n SER 39 N -2.34 0.48 0.00 0.19 2.88 0.56 -3.21 113.62 112.18 1i11 n SER 39 Ca -0.01 -0.27 -0.08 0.00 -1.33 0.00 0.00 58.87 57.18 1i11 n SER 39 Cb 0.20 1.68 -0.13 0.00 -0.75 0.00 0.00 64.21 65.20 1i11 n SER 39 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1i11 h ARG 40 N 0.00 0.00 0.59 -1.46 2.47 1.33 -2.98 114.38 114.33 1i11 h ARG 40 Ca 0.00 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.69 1i11 h ARG 40 Cb 0.81 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.13 1i11 h ARG 40 CO 0.00 0.60 -0.28 2.35 0.56 0.00 0.00 179.97 183.20 1i11 h TRP 41 N 0.00 -0.73 0.00 3.04 2.91 0.31 -2.69 115.95 118.79 1i11 h TRP 41 Ca -0.21 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.79 1i11 h TRP 41 Cb 1.93 0.24 0.00 0.00 -0.51 0.00 0.00 29.16 30.82 1i11 h TRP 41 CO 0.00 -0.46 0.00 0.87 -1.03 0.00 0.00 178.44 177.82 1i11 h LYS 42 N -1.19 0.00 -0.73 2.65 1.57 -1.70 0.34 116.57 117.52 1i11 h LYS 42 Ca -0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1i11 h LYS 42 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1i11 h LYS 42 CO 0.13 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 179.01 1i11 n ALA 43 N -2.00 2.94 -1.70 3.86 0.00 -1.03 -4.75 120.51 117.83 1i11 n ALA 43 Ca -0.02 -0.72 0.00 0.00 0.00 0.00 0.00 53.44 52.70 1i11 n ALA 43 Cb 0.09 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1i11 n ALA 43 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1i11 n MET 44 N 0.27 0.00 -0.04 0.00 2.81 0.12 -4.97 117.12 115.31 1i11 n MET 44 Ca 0.11 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.00 1i11 n MET 44 Cb 0.56 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.07 1i11 n MET 44 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1i11 n THR 45 N 0.00 0.00 0.00 2.03 -2.24 -1.26 -5.01 114.28 107.79 1i11 n THR 45 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1i11 n THR 45 Cb 0.00 0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 1i11 n THR 45 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1i11 n ASN 46 N 0.00 0.00 0.15 3.42 4.05 -1.26 -4.17 115.26 117.45 1i11 n ASN 46 Ca 0.00 0.00 0.13 0.00 0.45 0.00 0.00 54.58 55.16 1i11 n ASN 46 Cb 0.51 0.00 0.50 0.00 1.23 0.00 0.00 39.78 42.02 1i11 n ASN 46 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1i11 h LEU 47 N 0.00 0.00 0.00 1.20 -0.00 -2.02 -2.25 115.31 112.23 1i11 h LEU 47 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1i11 h LEU 47 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1i11 h LEU 47 CO 0.00 0.00 -0.13 1.21 -0.00 0.00 0.00 178.44 179.52 1i11 n GLU 48 N -2.41 0.01 0.00 1.13 2.13 -1.26 -3.20 120.64 117.04 1i11 n GLU 48 Ca 0.02 0.01 0.13 0.00 0.66 0.00 0.00 57.16 57.99 1i11 n GLU 48 Cb 0.28 -1.51 0.48 0.00 0.27 0.00 0.00 31.44 30.96 1i11 n GLU 48 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1i11 n LYS 49 N -1.54 0.34 -0.26 5.31 5.02 -0.85 -4.08 118.16 122.10 1i11 n LYS 49 Ca 0.07 -0.13 -0.01 0.00 -2.02 0.00 0.00 58.31 56.21 1i11 n LYS 49 Cb 0.34 -1.50 0.11 0.00 -0.02 0.00 0.00 35.03 33.97 1i11 n LYS 49 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1i11 h GLN 50 N 0.33 0.77 -0.02 1.97 4.20 -1.69 0.20 115.11 120.87 1i11 h GLN 50 Ca 0.00 -0.05 -0.25 0.00 0.06 0.00 0.00 58.65 58.42 1i11 h GLN 50 Cb 0.45 -0.17 0.01 0.00 0.30 0.00 0.00 27.48 28.07 1i11 h GLN 50 CO 0.00 0.51 -0.97 -1.00 -0.67 0.00 0.00 178.83 176.69 1i11 h PRO 51 N 0.79 0.62 0.00 1.46 0.13 -1.84 -2.59 132.00 130.57 1i11 h PRO 51 Ca 0.32 -0.64 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1i11 h PRO 51 Cb 0.17 0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.48 1i11 h PRO 51 CO -0.17 1.24 0.00 0.66 -0.23 0.00 0.00 178.00 179.50 1i11 n TYR 52 N -3.83 0.00 -0.08 1.56 4.01 -1.02 -2.17 117.16 115.64 1i11 n TYR 52 Ca -0.09 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.48 1i11 n TYR 52 Cb 0.85 -0.37 -0.13 0.00 -0.31 0.00 0.00 39.34 39.38 1i11 n TYR 52 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 1i11 h TYR 53 N 0.00 0.01 -0.39 -0.72 -1.99 -0.22 -3.10 116.97 110.56 1i11 h TYR 53 Ca 0.00 -0.01 -0.11 0.00 2.00 0.00 0.00 58.73 60.61 1i11 h TYR 53 Cb 0.26 -0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.97 1i11 h TYR 53 CO 0.00 1.17 -0.20 1.05 -0.00 0.00 0.00 178.16 180.19 1i11 h GLU 54 N -0.99 0.75 0.00 4.88 4.11 -1.40 -1.18 114.58 120.75 1i11 h GLU 54 Ca -0.12 -0.29 0.00 0.00 0.07 0.00 0.00 59.36 59.02 1i11 h GLU 54 Cb 1.12 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1i11 h GLU 54 CO -0.07 0.89 0.00 0.39 0.07 0.00 0.00 179.01 180.29 1i11 n GLU 55 N -4.13 0.12 -0.05 1.06 1.02 -0.92 -1.08 120.64 116.67 1i11 n GLU 55 Ca 0.00 0.45 -0.02 0.00 -0.02 0.00 0.00 57.16 57.57 1i11 n GLU 55 Cb 0.41 -1.77 -0.01 0.00 -0.02 0.00 0.00 31.44 30.06 1i11 n GLU 55 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1i11 h GLN 56 N 0.00 0.00 -0.42 3.49 5.75 -1.15 -3.10 115.11 119.69 1i11 h GLN 56 Ca 0.00 0.00 0.12 0.00 -0.15 0.00 0.00 58.65 58.62 1i11 h GLN 56 Cb 0.21 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.74 1i11 h GLN 56 CO 0.00 0.00 0.41 0.00 -2.65 0.00 0.00 178.83 176.59 1i11 h ALA 57 N -1.23 2.16 0.38 3.38 0.00 -1.29 0.06 119.26 122.72 1i11 h ALA 57 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1i11 h ALA 57 Cb 0.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1i11 h ALA 57 CO 0.00 -0.62 -0.18 0.00 0.00 0.00 0.00 179.25 178.45 1i11 h ARG 58 N 0.00 -0.49 0.00 0.00 3.08 -1.21 -2.53 114.38 113.23 1i11 h ARG 58 Ca 0.20 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1i11 h ARG 58 Cb 1.01 0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.17 1i11 h ARG 58 CO -0.00 -0.33 0.00 1.47 -1.07 0.00 0.00 179.97 180.04 1i11 n LEU 59 N -4.49 0.50 0.07 3.04 -0.00 -0.91 -0.42 117.00 114.79 1i11 n LEU 59 Ca -0.06 0.72 -0.07 0.00 -0.00 0.00 0.00 56.01 56.60 1i11 n LEU 59 Cb 0.20 -0.77 -0.08 0.00 -0.00 0.00 0.00 43.42 42.77 1i11 n LEU 59 CO 0.15 -0.87 0.18 0.28 -0.00 0.00 0.00 177.39 177.14 1i11 h SER 60 N 0.00 0.03 0.31 1.45 0.02 -0.86 -2.39 113.55 112.11 1i11 h SER 60 Ca 0.00 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1i11 h SER 60 Cb 0.03 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1i11 h SER 60 CO 0.00 0.97 -0.15 0.50 -1.14 0.00 0.00 176.83 177.01 1i11 h LYS 61 N 0.01 -0.40 0.00 3.45 1.63 -0.30 -2.91 116.57 118.05 1i11 h LYS 61 Ca -0.02 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1i11 h LYS 61 Cb 1.68 0.09 0.00 0.00 -0.60 0.00 0.00 32.23 33.40 1i11 h LYS 61 CO 0.13 -0.08 0.00 -0.56 -3.45 0.00 0.00 179.45 175.49 1i11 h GLN 62 N -0.95 0.00 0.49 1.90 3.07 -1.62 -2.87 115.11 115.14 1i11 h GLN 62 Ca -0.04 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.67 1i11 h GLN 62 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.07 1i11 h GLN 62 CO 0.07 0.00 -0.24 1.25 0.09 0.00 0.00 178.83 180.00 1i11 h HIS 63 N 0.00 -0.61 -1.06 0.06 2.76 -1.24 -2.63 115.15 112.42 1i11 h HIS 63 Ca 0.00 -0.01 0.30 0.00 -2.20 0.00 0.00 60.37 58.45 1i11 h HIS 63 Cb 0.07 0.20 -0.06 0.00 1.55 0.00 0.00 27.41 29.17 1i11 h HIS 63 CO 0.00 -0.38 0.74 -0.07 -1.30 0.00 0.00 177.93 176.92 1i11 h LEU 64 N -0.80 0.13 -1.88 0.26 3.38 -1.36 2.12 115.31 117.16 1i11 h LEU 64 Ca -0.07 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1i11 h LEU 64 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1i11 h LEU 64 CO 0.11 0.03 0.00 -0.33 0.09 0.00 0.00 178.44 178.34 1i11 h GLU 65 N 0.12 0.00 0.06 1.13 5.08 -1.33 0.33 114.58 119.97 1i11 h GLU 65 Ca 0.53 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.81 1i11 h GLU 65 Cb 1.89 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.14 1i11 h GLU 65 CO -0.09 0.00 -0.37 0.87 -1.00 0.00 0.00 179.01 178.42 1i11 h LYS 66 N 0.00 0.13 -1.67 2.33 1.57 0.36 -3.39 116.57 115.91 1i11 h LYS 66 Ca 0.00 -0.23 -0.50 0.00 -1.87 0.00 0.00 60.65 58.05 1i11 h LYS 66 Cb 0.08 0.09 -0.41 0.00 0.08 0.00 0.00 32.23 32.07 1i11 h LYS 66 CO 0.00 1.11 -0.95 0.66 -0.57 0.00 0.00 179.45 179.70 1i11 n TYR 67 N -4.39 2.20 -0.01 -1.35 4.01 -0.88 -4.89 117.16 111.84 1i11 n TYR 67 Ca -0.12 -3.40 -0.01 0.00 -0.16 0.00 0.00 57.90 54.22 1i11 n TYR 67 Cb 0.64 -0.33 -0.00 0.00 -0.31 0.00 0.00 39.34 39.33 1i11 n TYR 67 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1i11 h PRO 68 N 2.88 -0.04 -2.90 -0.72 0.13 -0.58 -3.39 132.00 127.39 1i11 h PRO 68 Ca 0.11 0.00 -0.76 0.00 -0.87 0.00 0.00 66.00 64.48 1i11 h PRO 68 Cb 0.91 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 31.89 1i11 h PRO 68 CO 0.67 -0.02 2.06 -0.40 -0.23 0.00 0.00 178.00 180.08 1i11 n ASP 69 N -3.61 6.89 0.00 1.44 5.75 -1.26 -4.79 116.55 120.98 1i11 n ASP 69 Ca -0.00 -3.19 0.01 0.00 -0.01 0.00 0.00 54.79 51.59 1i11 n ASP 69 Cb 0.01 -1.38 0.05 0.00 -1.03 0.00 0.00 41.12 38.77 1i11 n ASP 69 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09