#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 -2.50 -3.22 0.54 8.25 -1.26 -4.99 115.22 112.05 1i11 n HIS 2 Ca 0.00 0.92 -0.24 0.00 -0.26 0.00 0.00 57.72 58.14 1i11 n HIS 2 Cb 0.00 -3.92 -0.06 0.00 1.12 0.00 0.00 29.99 27.13 1i11 n HIS 2 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1i11 n ILE 3 N -2.31 0.14 -0.94 1.59 5.41 -1.26 -4.98 119.36 117.01 1i11 n ILE 3 Ca -0.03 -4.40 -0.16 0.00 1.00 0.00 0.00 62.75 59.15 1i11 n ILE 3 Cb 0.55 -1.68 -0.12 0.00 -0.71 0.00 0.00 39.64 37.67 1i11 n ILE 3 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 1i11 n LYS 4 N 1.04 2.12 -3.02 0.38 2.85 -1.26 -4.56 118.16 115.71 1i11 n LYS 4 Ca 0.24 -1.15 -0.28 0.00 -1.05 0.00 0.00 58.31 56.07 1i11 n LYS 4 Cb 0.52 -2.12 -0.04 0.00 -0.65 0.00 0.00 35.03 32.74 1i11 n LYS 4 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 177.40 180.24 1i11 n ARG 5 N 2.85 3.25 -0.74 -1.58 1.85 -1.26 -4.91 116.66 116.12 1i11 n ARG 5 Ca 0.45 -4.82 -0.07 0.00 -1.00 0.00 0.00 57.85 52.42 1i11 n ARG 5 Cb 0.66 -2.26 -0.10 0.00 -1.05 0.00 0.00 32.46 29.71 1i11 n ARG 5 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1i11 n PRO 6 N 0.00 1.49 -2.54 2.89 -0.04 -1.26 -4.82 135.00 130.72 1i11 n PRO 6 Ca 0.32 -0.60 -0.12 0.00 -0.04 0.00 0.00 63.50 63.05 1i11 n PRO 6 Cb 0.39 -1.66 0.01 0.00 -0.04 0.00 0.00 33.50 32.19 1i11 n PRO 6 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1i11 n MET 7 N 2.24 1.05 0.00 0.54 0.00 -1.26 -5.02 117.12 114.67 1i11 n MET 7 Ca 0.26 -1.66 0.00 0.00 0.00 0.00 0.00 57.70 56.30 1i11 n MET 7 Cb 0.69 0.14 0.00 0.00 0.00 0.00 0.00 33.22 34.05 1i11 n MET 7 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 1i11 n ASN 8 N -2.03 0.00 -0.12 7.83 5.15 -1.26 -4.93 115.26 119.90 1i11 n ASN 8 Ca 0.00 0.00 0.06 0.00 -0.60 0.00 0.00 54.58 54.04 1i11 n ASN 8 Cb 0.30 0.00 0.39 0.00 -0.53 0.00 0.00 39.78 39.94 1i11 n ASN 8 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1i11 h ALA 9 N 0.00 1.73 0.50 5.20 0.00 -1.86 1.06 119.26 125.89 1i11 h ALA 9 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1i11 h ALA 9 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1i11 h ALA 9 CO 0.00 0.19 -0.24 0.35 0.00 0.00 0.00 179.25 179.55 1i11 h PHE 10 N 0.67 -0.62 0.00 0.00 3.57 -1.94 2.14 116.94 120.76 1i11 h PHE 10 Ca 0.26 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.74 1i11 h PHE 10 Cb 0.17 0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.12 1i11 h PHE 10 CO -0.00 -0.39 0.00 0.52 -2.23 0.00 0.00 178.31 176.21 1i11 h MET 11 N -1.09 0.00 0.09 1.11 2.86 -1.87 2.48 114.93 118.50 1i11 h MET 11 Ca -0.07 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.39 1i11 h MET 11 Cb 0.51 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.17 1i11 h MET 11 CO 0.11 0.00 -0.91 0.28 1.06 0.00 0.00 176.91 177.45 1i11 h VAL 12 N 0.00 1.33 0.12 -2.22 2.07 0.16 -2.37 116.25 115.34 1i11 h VAL 12 Ca 0.00 -2.41 -0.27 0.00 0.82 0.00 0.00 66.70 64.84 1i11 h VAL 12 Cb 0.13 2.95 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 1i11 h VAL 12 CO 0.00 0.64 -1.26 -0.25 0.02 0.00 0.00 177.57 176.72 1i11 h TRP 13 N -0.56 0.46 0.00 1.57 7.01 0.46 -3.22 115.95 121.69 1i11 h TRP 13 Ca -0.20 -0.34 0.00 0.00 2.11 0.00 0.00 58.89 60.46 1i11 h TRP 13 Cb 1.51 -0.02 0.00 0.00 -2.10 0.00 0.00 29.16 28.55 1i11 h TRP 13 CO 0.18 1.28 0.00 0.00 -2.79 0.00 0.00 178.44 177.10 1i11 h ALA 14 N 0.59 1.00 -0.19 2.65 0.00 0.41 -1.90 119.26 121.83 1i11 h ALA 14 Ca -0.14 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1i11 h ALA 14 Cb 1.97 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.74 1i11 h ALA 14 CO 0.20 0.00 -0.20 1.57 0.00 0.00 0.00 179.25 180.81 1i11 h LYS 15 N 0.00 0.33 0.02 0.00 5.09 -1.42 1.43 116.57 122.00 1i11 h LYS 15 Ca 0.00 -0.10 -0.31 0.00 0.09 0.00 0.00 60.65 60.33 1i11 h LYS 15 Cb 0.64 -0.03 -0.05 0.00 0.10 0.00 0.00 32.23 32.90 1i11 h LYS 15 CO 0.00 0.52 -1.80 -3.47 -2.09 0.00 0.00 179.45 172.61 1i11 n ASP 16 N -4.18 0.97 0.01 7.07 2.03 -1.13 -2.96 116.55 118.35 1i11 n ASP 16 Ca -0.00 0.35 -0.03 0.00 0.52 0.00 0.00 54.79 55.63 1i11 n ASP 16 Cb 0.34 -0.08 0.22 0.00 -0.72 0.00 0.00 41.12 40.89 1i11 n ASP 16 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1i11 h GLU 17 N 0.01 0.49 0.13 -0.67 5.08 -0.94 2.21 114.58 120.88 1i11 h GLU 17 Ca -0.33 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 57.86 1i11 h GLU 17 Cb 2.03 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 31.25 1i11 h GLU 17 CO 0.07 0.67 -0.06 0.00 -1.00 0.00 0.00 179.01 178.69 1i11 h ARG 18 N 0.44 -0.16 -0.59 2.33 2.47 0.19 1.64 114.38 120.70 1i11 h ARG 18 Ca 0.07 0.01 -0.09 0.00 -1.26 0.00 0.00 59.98 58.71 1i11 h ARG 18 Cb 0.59 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.93 1i11 h ARG 18 CO 0.04 0.01 0.01 0.00 0.56 0.00 0.00 179.97 180.59 1i11 h ARG 19 N -0.31 1.01 0.00 0.04 3.08 -1.34 1.63 114.38 118.49 1i11 h ARG 19 Ca -0.02 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 59.70 1i11 h ARG 19 Cb 0.25 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 1i11 h ARG 19 CO 0.03 0.98 -0.14 -0.22 -1.07 0.00 0.00 179.97 179.56 1i11 h LYS 20 N 0.93 0.00 0.02 0.04 1.63 0.42 -2.98 116.57 116.63 1i11 h LYS 20 Ca 0.17 0.00 -0.39 0.00 -0.85 0.00 0.00 60.65 59.58 1i11 h LYS 20 Cb 0.52 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 32.10 1i11 h LYS 20 CO 0.03 0.14 -2.28 -0.89 -3.45 0.00 0.00 179.45 173.00 1i11 n ILE 21 N -3.29 1.55 -0.25 2.00 -0.00 0.55 -4.04 119.36 115.89 1i11 n ILE 21 Ca 0.00 -0.45 0.29 0.00 -0.00 0.00 0.00 62.75 62.60 1i11 n ILE 21 Cb 0.38 -1.71 0.69 0.00 -0.00 0.00 0.00 39.64 39.01 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 -0.47 0.09 -0.85 1.39 5.85 0.23 2.75 115.31 124.31 1i11 h LEU 22 Ca -0.57 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.08 1i11 h LEU 22 Cb 1.74 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.75 1i11 h LEU 22 CO -0.20 0.02 -0.04 0.06 -0.34 0.00 0.00 178.44 177.94 1i11 h GLN 23 N 0.08 0.81 0.00 1.25 3.07 -1.69 1.36 115.11 119.99 1i11 h GLN 23 Ca 0.50 -0.24 0.00 0.00 0.09 0.00 0.00 58.65 59.00 1i11 h GLN 23 Cb 1.84 -0.08 0.00 0.00 0.08 0.00 0.00 27.48 29.31 1i11 h GLN 23 CO -0.05 0.85 -0.41 0.00 0.09 0.00 0.00 178.83 179.30 1i11 n ALA 24 N -2.48 3.19 -2.91 0.06 0.00 0.76 -4.36 120.51 114.77 1i11 n ALA 24 Ca 0.02 -0.28 -0.14 0.00 0.00 0.00 0.00 53.44 53.04 1i11 n ALA 24 Cb 0.33 -1.20 0.01 0.00 0.00 0.00 0.00 19.45 18.58 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 -1.61 -2.24 0.77 0.00 3.72 0.70 -4.96 117.46 113.85 1i11 n PHE 25 Ca 0.05 -2.43 0.07 0.00 -0.05 0.00 0.00 57.45 55.10 1i11 n PHE 25 Cb 0.35 0.85 0.39 0.00 -0.94 0.00 0.00 39.48 40.14 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 1.55 0.31 -0.10 -1.08 -0.04 0.45 -2.05 135.00 134.03 1i11 n PRO 26 Ca 0.13 0.09 -0.12 0.00 -0.04 0.00 0.00 63.50 63.56 1i11 n PRO 26 Cb 0.59 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.44 1i11 n PRO 26 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1i11 n ASP 27 N -1.17 1.65 -4.56 3.54 2.03 -1.26 -4.77 116.55 112.02 1i11 n ASP 27 Ca 0.08 -0.07 -0.26 0.00 0.52 0.00 0.00 54.79 55.07 1i11 n ASP 27 Cb 0.09 0.21 -0.05 0.00 -0.72 0.00 0.00 41.12 40.64 1i11 n ASP 27 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 1i11 s MET 28 N -2.43 2.09 0.95 -0.67 1.75 -0.87 -4.91 119.30 115.20 1i11 s MET 28 Ca -0.20 0.57 -0.16 0.00 -1.25 0.00 0.00 55.69 54.65 1i11 s MET 28 Cb 0.06 -4.73 0.22 0.00 2.84 0.00 0.00 34.83 33.22 1i11 s MET 28 CO 0.59 -3.66 1.16 -2.39 -0.65 0.00 0.00 175.02 170.07 1i11 n HIS 29 N 16.06 -3.96 0.00 4.11 1.44 -1.26 -4.33 115.22 127.29 1i11 n HIS 29 Ca 0.39 -1.03 0.00 0.00 -2.01 0.00 0.00 57.72 55.07 1i11 n HIS 29 Cb 0.48 -0.96 0.00 0.00 0.12 0.00 0.00 29.99 29.63 1i11 n HIS 29 CO 0.00 0.00 0.00 0.27 -2.81 0.00 0.00 176.34 173.80 1i11 n ASN 30 N -4.01 0.00 -0.33 4.39 0.23 -1.26 0.18 115.26 114.47 1i11 n ASN 30 Ca 0.15 0.75 0.28 0.00 -0.53 0.00 0.00 54.58 55.23 1i11 n ASN 30 Cb 0.53 -0.25 0.46 0.00 -2.08 0.00 0.00 39.78 38.44 1i11 n ASN 30 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 1i11 n SER 31 N -1.83 0.14 -0.05 0.53 2.88 -1.26 0.11 113.62 114.14 1i11 n SER 31 Ca 0.00 0.93 -0.21 0.00 -1.33 0.00 0.00 58.87 58.26 1i11 n SER 31 Cb 0.00 -0.46 -0.13 0.00 -0.75 0.00 0.00 64.21 62.87 1i11 n SER 31 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1i11 n ASN 32 N -4.02 2.05 0.06 -3.46 2.85 -0.42 -3.96 115.26 108.35 1i11 n ASN 32 Ca 0.27 0.19 0.18 0.00 -0.11 0.00 0.00 54.58 55.12 1i11 n ASN 32 Cb 1.07 -0.80 0.68 0.00 1.24 0.00 0.00 39.78 41.98 1i11 n ASN 32 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1i11 h ILE 33 N -0.19 0.78 -0.55 -1.44 1.08 0.92 0.55 117.51 118.66 1i11 h ILE 33 Ca -0.46 0.00 0.10 0.00 -0.39 0.00 0.00 64.86 64.11 1i11 h ILE 33 Cb 1.86 0.79 -0.08 0.00 -3.07 0.00 0.00 36.82 36.32 1i11 h ILE 33 CO -0.03 0.00 0.12 0.28 -0.69 0.00 0.00 178.15 177.83 1i11 h SER 34 N 0.00 0.02 0.44 1.72 0.02 -0.37 1.87 113.55 117.25 1i11 h SER 34 Ca 0.20 0.10 -0.05 0.00 -0.84 0.00 0.00 61.79 61.19 1i11 h SER 34 Cb 0.80 0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.46 1i11 h SER 34 CO -0.00 0.03 -0.26 0.11 -1.14 0.00 0.00 176.83 175.57 1i11 h LYS 35 N 0.26 0.00 0.26 3.45 1.57 -1.08 0.33 116.57 121.36 1i11 h LYS 35 Ca 0.28 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.05 1i11 h LYS 35 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1i11 h LYS 35 CO -0.35 0.26 -0.13 0.82 -0.57 0.00 0.00 179.45 179.48 1i11 h ILE 36 N 0.00 0.43 0.46 1.86 5.03 0.99 -0.56 117.51 125.71 1i11 h ILE 36 Ca -0.00 -0.89 -0.01 0.00 -0.12 0.00 0.00 64.86 63.84 1i11 h ILE 36 Cb 0.55 0.72 -0.02 0.00 -3.03 0.00 0.00 36.82 35.03 1i11 h ILE 36 CO 0.03 0.11 -0.50 -0.07 -0.68 0.00 0.00 178.15 177.05 1i11 h LEU 37 N -0.99 -1.38 -0.68 1.44 3.38 0.27 2.04 115.31 119.39 1i11 h LEU 37 Ca -0.04 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1i11 h LEU 37 Cb 0.45 0.46 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1i11 h LEU 37 CO 0.06 -0.64 0.08 0.61 0.09 0.00 0.00 178.44 178.63 1i11 n GLY 38 N -1.54 -0.63 0.01 0.83 0.00 0.11 0.25 105.19 104.22 1i11 n GLY 38 Ca -0.11 0.10 0.10 0.00 0.00 0.00 0.00 46.02 46.10 1i11 n GLY 38 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1i11 n SER 39 N -1.84 0.56 0.02 1.61 7.64 0.71 -3.06 113.62 119.25 1i11 n SER 39 Ca -0.01 -0.08 -0.12 0.00 1.01 0.00 0.00 58.87 59.67 1i11 n SER 39 Cb 0.09 1.82 -0.14 0.00 -1.01 0.00 0.00 64.21 64.98 1i11 n SER 39 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1i11 h ARG 40 N 0.00 0.11 0.70 1.43 2.47 1.11 -2.74 114.38 117.46 1i11 h ARG 40 Ca 0.00 -0.18 -0.03 0.00 -1.26 0.00 0.00 59.98 58.50 1i11 h ARG 40 Cb 0.86 0.07 0.01 0.00 -1.65 0.00 0.00 29.97 29.25 1i11 h ARG 40 CO 0.00 0.84 -0.34 2.35 0.56 0.00 0.00 179.97 183.38 1i11 h TRP 41 N 0.03 -0.87 0.00 3.04 2.91 0.31 -0.70 115.95 120.67 1i11 h TRP 41 Ca -0.25 -0.02 -0.00 0.00 1.13 0.00 0.00 58.89 59.75 1i11 h TRP 41 Cb 1.98 0.29 -0.00 0.00 -0.51 0.00 0.00 29.16 30.92 1i11 h TRP 41 CO 0.03 -0.54 -0.01 0.87 -1.03 0.00 0.00 178.44 177.75 1i11 h LYS 42 N -1.25 0.00 0.00 2.65 1.57 -1.69 0.61 116.57 118.46 1i11 h LYS 42 Ca -0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1i11 h LYS 42 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.03 1i11 h LYS 42 CO 0.16 0.01 0.00 0.00 -0.57 0.00 0.00 179.45 179.05 1i11 n ALA 43 N -2.22 2.22 -1.00 3.86 0.00 -0.98 -4.72 120.51 117.67 1i11 n ALA 43 Ca -0.03 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1i11 n ALA 43 Cb 0.10 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.10 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 -1.82 3.08 -0.23 0.00 2.81 0.21 -5.00 117.12 116.19 1i11 n MET 44 Ca 0.06 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 1i11 n MET 44 Cb 0.35 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.86 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 -5.01 114.28 107.80 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 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 1i11 n THR 45 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1i11 n ASN 46 N 0.00 0.00 0.07 3.42 3.02 -1.26 -4.32 115.26 116.18 1i11 n ASN 46 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.61 1i11 n ASN 46 Cb 0.54 0.00 0.49 0.00 -0.61 0.00 0.00 39.78 40.20 1i11 n ASN 46 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1i11 h LEU 47 N 0.00 0.34 0.00 3.41 6.46 -2.02 0.26 115.31 123.75 1i11 h LEU 47 Ca 0.00 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 1i11 h LEU 47 Cb 0.00 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 39.85 1i11 h LEU 47 CO 0.00 0.24 -0.25 -0.62 -0.62 0.00 0.00 178.44 177.19 1i11 n GLU 48 N -4.49 0.05 0.11 1.25 1.02 -1.26 -3.64 120.64 113.68 1i11 n GLU 48 Ca 0.02 0.02 0.05 0.00 -0.02 0.00 0.00 57.16 57.23 1i11 n GLU 48 Cb 0.08 -1.54 0.01 0.00 -0.02 0.00 0.00 31.44 29.97 1i11 n GLU 48 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1i11 h LYS 49 N 0.00 0.00 -0.37 3.49 3.11 -0.83 -3.36 116.57 118.61 1i11 h LYS 49 Ca 0.00 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.82 1i11 h LYS 49 Cb 0.54 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.75 1i11 h LYS 49 CO 0.00 0.28 0.16 -0.56 -2.81 0.00 0.00 179.45 176.52 1i11 h GLN 50 N 0.00 0.52 -0.09 1.90 -0.00 -1.52 -3.08 115.11 112.83 1i11 h GLN 50 Ca -0.05 -0.06 -0.08 0.00 -0.00 0.00 0.00 58.65 58.45 1i11 h GLN 50 Cb 1.33 -0.10 0.00 0.00 -0.00 0.00 0.00 27.48 28.71 1i11 h GLN 50 CO 0.04 0.43 -0.27 -1.00 -0.00 0.00 0.00 178.83 178.03 1i11 h PRO 51 N 0.53 0.35 0.00 0.06 0.13 -1.80 -2.87 132.00 128.39 1i11 h PRO 51 Ca 0.13 -0.25 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 1i11 h PRO 51 Cb 0.09 0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.26 1i11 h PRO 51 CO -0.01 0.86 0.00 0.66 -0.23 0.00 0.00 178.00 179.28 1i11 n TYR 52 N -4.46 0.00 0.04 1.56 4.01 -1.21 -2.27 117.16 114.83 1i11 n TYR 52 Ca -0.08 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.46 1i11 n TYR 52 Cb 0.46 -0.34 -0.11 0.00 -0.31 0.00 0.00 39.34 39.05 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 1.04 -0.44 -0.72 -1.99 -1.41 -3.22 116.97 110.23 1i11 h TYR 53 Ca 0.00 -0.57 -0.11 0.00 2.00 0.00 0.00 58.73 60.05 1i11 h TYR 53 Cb 0.13 -0.12 -0.02 0.00 2.00 0.00 0.00 36.73 38.73 1i11 h TYR 53 CO 0.00 1.41 -0.18 0.93 -0.00 0.00 0.00 178.16 180.31 1i11 h GLU 54 N 0.38 0.85 0.00 4.88 4.39 -1.53 -2.05 114.58 121.50 1i11 h GLU 54 Ca -0.13 -0.33 0.00 0.00 0.34 0.00 0.00 59.36 59.24 1i11 h GLU 54 Cb 1.70 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 30.30 1i11 h GLU 54 CO 0.20 0.97 0.09 0.93 -1.16 0.00 0.00 179.01 180.05 1i11 h GLU 55 N 0.75 0.00 0.01 2.33 5.08 -1.59 -1.72 114.58 119.44 1i11 h GLU 55 Ca 0.11 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1i11 h GLU 55 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 1i11 h GLU 55 CO 0.05 0.00 -0.01 -0.56 -1.00 0.00 0.00 179.01 177.50 1i11 h GLN 56 N 0.00 -0.01 -0.27 2.33 3.07 -1.38 -3.11 115.11 115.74 1i11 h GLN 56 Ca 0.00 0.00 0.08 0.00 0.09 0.00 0.00 58.65 58.82 1i11 h GLN 56 Cb 0.19 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.74 1i11 h GLN 56 CO 0.00 0.63 0.35 0.00 0.09 0.00 0.00 178.83 179.90 1i11 h ALA 57 N -0.32 1.87 -0.09 0.06 0.00 -1.28 0.71 119.26 120.22 1i11 h ALA 57 Ca -0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1i11 h ALA 57 Cb 0.66 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1i11 h ALA 57 CO 0.00 -0.48 -0.11 0.00 0.00 0.00 0.00 179.25 178.66 1i11 h ARG 58 N 0.00 0.22 -0.27 0.00 2.47 -1.35 -2.29 114.38 113.16 1i11 h ARG 58 Ca 0.13 -0.13 0.08 0.00 -1.26 0.00 0.00 59.98 58.80 1i11 h ARG 58 Cb 0.82 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.14 1i11 h ARG 58 CO -0.00 0.67 0.26 -0.07 0.56 0.00 0.00 179.97 181.39 1i11 h LEU 59 N -0.21 0.00 -0.11 3.04 3.38 -0.80 0.50 115.31 121.11 1i11 h LEU 59 Ca 0.01 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 1i11 h LEU 59 Cb 0.64 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1i11 h LEU 59 CO 0.03 0.00 -0.80 0.28 0.09 0.00 0.00 178.44 178.04 1i11 h SER 60 N 0.00 0.00 -0.26 -0.43 0.02 -1.16 -2.81 113.55 108.91 1i11 h SER 60 Ca 0.13 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 1i11 h SER 60 Cb 0.64 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.17 1i11 h SER 60 CO -0.00 0.80 0.03 0.50 -1.14 0.00 0.00 176.83 177.02 1i11 h LYS 61 N 0.00 0.44 0.00 3.45 3.64 0.56 1.29 116.57 125.95 1i11 h LYS 61 Ca -0.01 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.18 1i11 h LYS 61 Cb 1.56 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.33 1i11 h LYS 61 CO 0.10 0.57 -0.31 -0.56 -2.27 0.00 0.00 179.45 176.99 1i11 h GLN 62 N 0.25 0.00 0.00 1.90 -0.00 -1.47 -1.29 115.11 114.50 1i11 h GLN 62 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.73 1i11 h GLN 62 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.83 1i11 h GLN 62 CO 0.01 0.31 -0.08 1.25 -0.00 0.00 0.00 178.83 180.31 1i11 h HIS 63 N 0.00 0.00 -1.03 0.06 2.76 -1.15 -3.35 115.15 112.44 1i11 h HIS 63 Ca -0.00 0.00 0.29 0.00 -2.20 0.00 0.00 60.37 58.45 1i11 h HIS 63 Cb 0.67 0.00 -0.13 0.00 1.55 0.00 0.00 27.41 29.50 1i11 h HIS 63 CO 0.00 0.00 0.61 -0.07 -1.30 0.00 0.00 177.93 177.17 1i11 h LEU 64 N -0.38 0.56 -2.00 0.26 3.38 0.16 1.66 115.31 118.95 1i11 h LEU 64 Ca 0.00 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1i11 h LEU 64 Cb 0.08 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1i11 h LEU 64 CO 0.00 0.01 0.20 -0.33 0.09 0.00 0.00 178.44 178.40 1i11 h GLU 65 N 0.44 0.00 0.00 1.13 5.08 -1.36 -1.62 114.58 118.25 1i11 h GLU 65 Ca 0.68 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 59.00 1i11 h GLU 65 Cb 1.50 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.74 1i11 h GLU 65 CO -0.49 0.00 -0.20 0.87 -1.00 0.00 0.00 179.01 178.19 1i11 h LYS 66 N 0.00 0.00 -1.48 2.33 1.79 0.24 -3.46 116.57 115.99 1i11 h LYS 66 Ca 0.00 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.35 1i11 h LYS 66 Cb 0.39 0.00 -0.26 0.00 -1.58 0.00 0.00 32.23 30.78 1i11 h LYS 66 CO 0.00 0.78 -0.49 0.71 -1.08 0.00 0.00 179.45 179.37 1i11 s TYR 67 N -2.12 -1.28 0.00 -1.35 1.51 -0.63 -5.09 117.35 108.39 1i11 s TYR 67 Ca -0.17 0.56 0.00 0.00 -1.01 0.00 0.00 57.07 56.45 1i11 s TYR 67 Cb -0.01 -0.01 0.00 0.00 -0.11 0.00 0.00 41.96 41.83 1i11 s TYR 67 CO 0.53 -1.02 0.00 -0.35 -1.11 0.00 0.00 175.55 173.60 1i11 n PRO 68 N 5.37 0.00 0.00 -1.71 -0.04 -1.11 -4.77 135.00 132.74 1i11 n PRO 68 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1i11 n PRO 68 Cb 0.51 -0.02 0.00 0.00 -0.04 0.00 0.00 33.50 33.94 1i11 n PRO 68 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1i11 n ASP 69 N 0.00 0.00 0.00 3.54 9.92 -1.26 -5.06 116.55 123.69 1i11 n ASP 69 Ca 0.00 0.00 0.15 0.00 -0.53 0.00 0.00 54.79 54.41 1i11 n ASP 69 Cb 0.00 0.00 0.88 0.00 -0.64 0.00 0.00 41.12 41.36 1i11 n ASP 69 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11