#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i11 s HIS 2 N 0.00 -1.59 0.00 6.00 -3.43 -1.26 -5.14 115.29 109.87 1i11 s HIS 2 Ca 0.00 -0.58 0.00 0.00 -0.80 0.00 0.00 55.06 53.68 1i11 s HIS 2 Cb 0.00 0.30 0.00 0.00 -1.43 0.00 0.00 32.58 31.45 1i11 s HIS 2 CO 0.00 -1.27 0.00 0.44 -2.00 0.00 0.00 174.74 171.91 1i11 n ILE 3 N 2.95 0.00 -1.68 -5.38 -5.35 -1.26 -5.02 119.36 103.62 1i11 n ILE 3 Ca 0.18 0.00 -0.33 0.00 -0.27 0.00 0.00 62.75 62.33 1i11 n ILE 3 Cb 0.56 0.00 -0.06 0.00 -1.74 0.00 0.00 39.64 38.39 1i11 n ILE 3 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 1i11 n LYS 4 N 0.00 1.45 -0.81 6.28 3.00 -1.26 -4.92 118.16 121.90 1i11 n LYS 4 Ca 0.00 -2.18 -0.29 0.00 -0.00 0.00 0.00 58.31 55.84 1i11 n LYS 4 Cb 0.00 -3.42 0.21 0.00 0.00 0.00 0.00 35.03 31.81 1i11 n LYS 4 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1i11 s ARG 5 N 6.08 -0.01 -1.27 1.64 0.52 -1.26 -4.85 118.95 119.80 1i11 s ARG 5 Ca 0.65 0.86 -0.18 0.00 -0.52 0.00 0.00 55.73 56.55 1i11 s ARG 5 Cb 0.05 -1.66 0.01 0.00 0.52 0.00 0.00 34.95 33.87 1i11 s ARG 5 CO 0.14 -3.12 1.96 -0.35 0.02 0.00 0.00 175.30 173.95 1i11 n PRO 6 N -4.50 2.63 -3.90 3.54 -0.04 -1.26 -4.88 135.00 126.60 1i11 n PRO 6 Ca 0.05 -2.75 -0.35 0.00 -0.04 0.00 0.00 63.50 60.41 1i11 n PRO 6 Cb 0.55 -3.39 -0.14 0.00 -0.04 0.00 0.00 33.50 30.48 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 4.31 3.34 0.07 0.54 0.23 -1.26 -4.89 119.30 121.64 1i11 s MET 7 Ca 0.54 -0.65 -0.26 0.00 -1.03 0.00 0.00 55.69 54.29 1i11 s MET 7 Cb 0.08 -3.04 0.07 0.00 -1.53 0.00 0.00 34.83 30.42 1i11 s MET 7 CO 0.04 -0.22 0.65 -0.80 -2.03 0.00 0.00 175.02 172.66 1i11 s ASN 8 N 1.48 -0.58 0.53 -1.18 -0.87 -1.26 -4.99 114.94 108.06 1i11 s ASN 8 Ca 0.05 0.25 0.26 0.00 -1.57 0.00 0.00 52.86 51.86 1i11 s ASN 8 Cb -0.15 0.56 1.41 0.00 -0.02 0.00 0.00 41.25 43.06 1i11 s ASN 8 CO -0.03 -0.82 1.98 0.00 -2.57 0.00 0.00 177.10 175.66 1i11 h ALA 9 N 2.34 2.57 0.14 0.60 0.00 -1.89 0.99 119.26 124.02 1i11 h ALA 9 Ca -0.31 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1i11 h ALA 9 Cb 1.25 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1i11 h ALA 9 CO 0.38 -0.74 -0.07 0.35 0.00 0.00 0.00 179.25 179.17 1i11 h PHE 10 N 0.00 -0.18 0.00 0.00 3.57 -1.94 2.01 116.94 120.40 1i11 h PHE 10 Ca 0.29 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.78 1i11 h PHE 10 Cb 1.15 0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.95 1i11 h PHE 10 CO -0.00 -0.11 0.00 0.00 -2.23 0.00 0.00 178.31 175.97 1i11 h MET 11 N -0.32 0.00 0.11 1.11 -0.00 -1.83 2.40 114.93 116.40 1i11 h MET 11 Ca -0.02 0.00 -0.15 0.00 -0.00 0.00 0.00 59.70 59.53 1i11 h MET 11 Cb 0.15 0.00 0.02 0.00 -0.00 0.00 0.00 31.60 31.77 1i11 h MET 11 CO 0.03 0.00 -0.67 0.28 -0.00 0.00 0.00 176.91 176.55 1i11 h VAL 12 N 0.00 1.55 0.04 -0.10 2.07 0.13 -2.46 116.25 117.47 1i11 h VAL 12 Ca 0.00 -2.50 -0.24 0.00 0.82 0.00 0.00 66.70 64.79 1i11 h VAL 12 Cb 0.04 3.22 -0.02 0.00 -1.52 0.00 0.00 31.29 33.01 1i11 h VAL 12 CO 0.00 0.69 -1.14 -0.25 0.02 0.00 0.00 177.57 176.89 1i11 h TRP 13 N -0.50 0.15 0.00 1.57 7.01 0.51 -3.23 115.95 121.47 1i11 h TRP 13 Ca -0.12 -0.11 0.00 0.00 2.11 0.00 0.00 58.89 60.77 1i11 h TRP 13 Cb 1.52 -0.01 0.00 0.00 -2.10 0.00 0.00 29.16 28.57 1i11 h TRP 13 CO 0.21 1.09 0.00 0.00 -2.79 0.00 0.00 178.44 176.96 1i11 h ALA 14 N 0.86 1.00 -0.44 2.65 0.00 0.39 -2.36 119.26 121.36 1i11 h ALA 14 Ca -0.07 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1i11 h ALA 14 Cb 1.85 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.62 1i11 h ALA 14 CO 0.15 0.00 0.04 0.87 0.00 0.00 0.00 179.25 180.31 1i11 h LYS 15 N 0.00 0.70 0.04 0.00 1.79 -1.45 1.56 116.57 119.21 1i11 h LYS 15 Ca 0.00 -0.16 -0.30 0.00 -2.18 0.00 0.00 60.65 58.02 1i11 h LYS 15 Cb 0.53 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 31.05 1i11 h LYS 15 CO 0.00 0.68 -1.64 0.22 -1.08 0.00 0.00 179.45 177.64 1i11 h ASP 16 N 0.66 0.15 0.21 0.86 3.58 -1.71 -2.89 116.42 117.27 1i11 h ASP 16 Ca 0.14 -0.27 -0.07 0.00 0.42 0.00 0.00 57.03 57.25 1i11 h ASP 16 Cb 0.35 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 1i11 h ASP 16 CO 0.01 1.23 -0.29 -0.33 -2.88 0.00 0.00 179.24 176.98 1i11 h GLU 17 N 0.03 0.14 -0.06 0.28 4.39 -0.98 1.88 114.58 120.25 1i11 h GLU 17 Ca -0.27 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.37 1i11 h GLU 17 Cb 1.99 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 30.63 1i11 h GLU 17 CO 0.10 0.43 -0.01 0.00 -1.16 0.00 0.00 179.01 178.37 1i11 h ARG 18 N 0.13 0.12 -0.59 2.33 2.47 0.22 0.48 114.38 119.54 1i11 h ARG 18 Ca 0.02 -0.04 -0.09 0.00 -1.26 0.00 0.00 59.98 58.60 1i11 h ARG 18 Cb 0.59 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.88 1i11 h ARG 18 CO 0.04 0.44 0.01 0.00 0.56 0.00 0.00 179.97 181.02 1i11 h ARG 19 N -0.21 1.04 0.00 0.04 3.08 -1.18 1.76 114.38 118.90 1i11 h ARG 19 Ca 0.02 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1i11 h ARG 19 Cb 0.40 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1i11 h ARG 19 CO 0.01 1.02 0.00 1.57 -1.07 0.00 0.00 179.97 181.49 1i11 h LYS 20 N 0.93 0.00 0.01 0.04 5.09 0.31 -2.76 116.57 120.19 1i11 h LYS 20 Ca 0.17 0.00 -0.41 0.00 0.09 0.00 0.00 60.65 60.50 1i11 h LYS 20 Cb 0.54 0.00 -0.06 0.00 0.10 0.00 0.00 32.23 32.81 1i11 h LYS 20 CO 0.03 0.00 -2.26 -0.89 -2.09 0.00 0.00 179.45 174.24 1i11 n ILE 21 N -2.71 1.54 -0.13 0.07 5.41 0.17 -4.19 119.36 119.52 1i11 n ILE 21 Ca 0.02 -0.35 0.27 0.00 1.00 0.00 0.00 62.75 63.70 1i11 n ILE 21 Cb 0.32 -1.85 0.71 0.00 -0.71 0.00 0.00 39.64 38.11 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 -0.83 0.00 -1.07 1.39 5.85 0.26 2.35 115.31 123.26 1i11 h LEU 22 Ca -0.61 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.07 1i11 h LEU 22 Cb 1.61 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.61 1i11 h LEU 22 CO -0.32 0.00 0.24 0.06 -0.34 0.00 0.00 178.44 178.07 1i11 h GLN 23 N 0.00 0.90 -0.00 1.25 3.07 -1.65 0.36 115.11 119.03 1i11 h GLN 23 Ca 0.39 -0.15 0.00 0.00 0.09 0.00 0.00 58.65 58.98 1i11 h GLN 23 Cb 1.76 -0.15 0.00 0.00 0.08 0.00 0.00 27.48 29.16 1i11 h GLN 23 CO -0.00 0.74 -0.43 0.00 0.09 0.00 0.00 178.83 179.23 1i11 n ALA 24 N -2.45 3.42 -2.88 0.06 0.00 0.74 -4.49 120.51 114.92 1i11 n ALA 24 Ca 0.05 -0.36 -0.11 0.00 0.00 0.00 0.00 53.44 53.02 1i11 n ALA 24 Cb 0.18 -1.13 0.01 0.00 0.00 0.00 0.00 19.45 18.51 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 -1.28 -2.76 0.71 0.00 3.72 0.15 -4.96 117.46 113.04 1i11 n PHE 25 Ca 0.07 -2.10 0.07 0.00 -0.05 0.00 0.00 57.45 55.44 1i11 n PHE 25 Cb 0.34 1.12 0.37 0.00 -0.94 0.00 0.00 39.48 40.36 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 1.97 0.24 -0.10 -1.08 -0.04 0.11 -2.18 135.00 133.92 1i11 n PRO 26 Ca 0.15 0.13 -0.12 0.00 -0.04 0.00 0.00 63.50 63.62 1i11 n PRO 26 Cb 0.59 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.43 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 -1.24 1.47 -4.56 3.54 2.03 -1.26 -4.76 116.55 111.77 1i11 n ASP 27 Ca 0.07 -0.06 -0.24 0.00 0.52 0.00 0.00 54.79 55.09 1i11 n ASP 27 Cb 0.10 0.33 -0.05 0.00 -0.72 0.00 0.00 41.12 40.78 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 2.06 0.99 -0.67 1.75 -0.93 -4.91 119.30 115.17 1i11 s MET 28 Ca -0.18 0.45 -0.16 0.00 -1.25 0.00 0.00 55.69 54.54 1i11 s MET 28 Cb 0.06 -4.78 0.21 0.00 2.84 0.00 0.00 34.83 33.16 1i11 s MET 28 CO 0.61 -3.77 1.27 -3.38 -0.65 0.00 0.00 175.02 169.10 1i11 s HIS 29 N 12.44 1.52 0.00 4.11 -3.43 -1.26 -4.28 115.29 124.38 1i11 s HIS 29 Ca 0.84 0.40 0.00 0.00 -0.80 0.00 0.00 55.06 55.50 1i11 s HIS 29 Cb -0.12 -3.93 0.00 0.00 -1.43 0.00 0.00 32.58 27.10 1i11 s HIS 29 CO 0.10 -2.81 0.94 0.27 -2.00 0.00 0.00 174.74 171.24 1i11 n ASN 30 N -3.92 0.00 -0.50 7.38 6.94 -1.26 0.16 115.26 124.06 1i11 n ASN 30 Ca 0.14 0.94 0.38 0.00 -0.02 0.00 0.00 54.58 56.02 1i11 n ASN 30 Cb 0.60 -0.44 0.59 0.00 -2.36 0.00 0.00 39.78 38.17 1i11 n ASN 30 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 1i11 n SER 31 N -2.69 0.03 -0.13 0.53 2.88 -1.26 0.51 113.62 113.49 1i11 n SER 31 Ca 0.00 0.80 -0.21 0.00 -1.33 0.00 0.00 58.87 58.12 1i11 n SER 31 Cb 0.00 -0.40 -0.12 0.00 -0.75 0.00 0.00 64.21 62.95 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 -3.58 1.98 -0.12 -3.46 3.02 0.68 -4.27 115.26 109.51 1i11 n ASN 32 Ca 0.33 0.01 0.11 0.00 -0.03 0.00 0.00 54.58 54.99 1i11 n ASN 32 Cb 1.44 -0.55 0.46 0.00 -0.61 0.00 0.00 39.78 40.52 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 -0.28 0.92 -0.80 2.41 1.08 0.68 -0.52 117.51 120.99 1i11 h ILE 33 Ca -0.61 -0.17 0.19 0.00 -0.39 0.00 0.00 64.86 63.88 1i11 h ILE 33 Cb 1.82 0.36 -0.12 0.00 -3.07 0.00 0.00 36.82 35.81 1i11 h ILE 33 CO -0.18 0.09 0.20 0.28 -0.69 0.00 0.00 178.15 177.85 1i11 h SER 34 N 0.51 -0.00 0.51 1.72 0.02 -0.28 2.22 113.55 118.24 1i11 h SER 34 Ca 0.30 0.17 -0.07 0.00 -0.84 0.00 0.00 61.79 61.35 1i11 h SER 34 Cb 0.50 0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.26 1i11 h SER 34 CO -0.09 -0.08 -0.35 0.11 -1.14 0.00 0.00 176.83 175.28 1i11 h LYS 35 N 0.25 0.00 0.26 3.45 1.57 -1.31 0.31 116.57 121.11 1i11 h LYS 35 Ca 0.47 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.24 1i11 h LYS 35 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.18 1i11 h LYS 35 CO -0.58 0.35 -0.13 0.82 -0.57 0.00 0.00 179.45 179.34 1i11 h ILE 36 N 0.00 0.28 0.19 1.86 5.03 0.31 -1.79 117.51 123.40 1i11 h ILE 36 Ca -0.00 -0.85 0.00 0.00 -0.12 0.00 0.00 64.86 63.89 1i11 h ILE 36 Cb 0.70 0.48 -0.03 0.00 -3.03 0.00 0.00 36.82 34.94 1i11 h ILE 36 CO 0.05 0.08 -0.39 -0.07 -0.68 0.00 0.00 178.15 177.13 1i11 h LEU 37 N -1.04 -1.13 -1.44 1.44 3.38 0.22 1.64 115.31 118.39 1i11 h LEU 37 Ca -0.04 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1i11 h LEU 37 Cb 0.40 0.40 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1i11 h LEU 37 CO 0.06 -0.44 0.11 1.23 0.09 0.00 0.00 178.44 179.49 1i11 h GLY 38 N -0.63 0.00 0.16 0.83 0.00 -1.07 2.03 103.07 104.40 1i11 h GLY 38 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1i11 h GLY 38 CO -0.15 0.00 -1.69 1.44 0.00 0.00 0.00 176.54 176.14 1i11 n SER 39 N -2.31 0.27 -0.00 0.19 7.64 0.36 -3.20 113.62 116.56 1i11 n SER 39 Ca -0.01 -0.10 -0.08 0.00 1.01 0.00 0.00 58.87 59.69 1i11 n SER 39 Cb 0.15 1.61 -0.13 0.00 -1.01 0.00 0.00 64.21 64.82 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 0.00 0.81 1.43 2.47 1.09 -3.03 114.38 117.14 1i11 h ARG 40 Ca 0.00 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.68 1i11 h ARG 40 Cb 0.92 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.25 1i11 h ARG 40 CO 0.00 0.60 -0.39 2.35 0.56 0.00 0.00 179.97 183.09 1i11 h TRP 41 N 0.00 -1.01 0.00 3.04 2.91 0.26 0.67 115.95 121.83 1i11 h TRP 41 Ca -0.22 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 59.77 1i11 h TRP 41 Cb 1.95 0.33 0.00 0.00 -0.51 0.00 0.00 29.16 30.94 1i11 h TRP 41 CO 0.00 -0.63 0.00 1.63 -1.03 0.00 0.00 178.44 178.41 1i11 n LYS 42 N -5.18 0.15 0.07 2.65 5.02 -1.19 -1.13 118.16 118.54 1i11 n LYS 42 Ca -0.13 0.58 0.12 0.00 -2.02 0.00 0.00 58.31 56.85 1i11 n LYS 42 Cb 0.43 -1.93 0.16 0.00 -0.02 0.00 0.00 35.03 33.67 1i11 n LYS 42 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1i11 h ALA 43 N 2.07 0.60 -3.00 7.82 0.00 -1.15 -3.45 119.26 122.15 1i11 h ALA 43 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1i11 h ALA 43 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1i11 h ALA 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1i11 n MET 44 N -2.20 0.00 -3.56 0.00 0.00 0.13 -4.98 117.12 106.51 1i11 n MET 44 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 57.70 57.44 1i11 n MET 44 Cb 0.45 0.00 -0.14 0.00 0.00 0.00 0.00 33.22 33.53 1i11 n MET 44 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 1i11 s THR 45 N 0.00 0.23 0.46 3.17 -4.23 -1.26 -4.97 115.64 109.04 1i11 s THR 45 Ca 0.00 -1.22 0.37 0.00 -1.18 0.00 0.00 61.69 59.66 1i11 s THR 45 Cb 0.00 -1.19 0.55 0.00 1.34 0.00 0.00 72.50 73.20 1i11 s THR 45 CO 0.00 -0.80 1.22 -0.46 -0.54 0.00 0.00 174.62 174.05 1i11 n ASN 46 N 4.76 0.00 0.20 3.99 6.94 -1.26 0.44 115.26 130.33 1i11 n ASN 46 Ca 0.00 0.77 0.11 0.00 -0.02 0.00 0.00 54.58 55.45 1i11 n ASN 46 Cb 0.40 -0.37 0.14 0.00 -2.36 0.00 0.00 39.78 37.60 1i11 n ASN 46 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1i11 h LEU 47 N 0.00 0.00 -1.66 -4.53 6.46 -2.00 -3.26 115.31 110.33 1i11 h LEU 47 Ca 0.70 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 58.43 1i11 h LEU 47 Cb 2.95 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 42.86 1i11 h LEU 47 CO -0.01 0.03 0.03 1.21 -0.62 0.00 0.00 178.44 179.08 1i11 n GLU 48 N -3.06 1.44 0.04 1.25 2.13 1.50 -3.92 120.64 120.02 1i11 n GLU 48 Ca 0.03 -0.44 0.13 0.00 0.66 0.00 0.00 57.16 57.54 1i11 n GLU 48 Cb 0.54 -1.47 0.43 0.00 0.27 0.00 0.00 31.44 31.22 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 0.14 0.13 -0.19 5.31 5.02 -1.23 -4.06 118.16 123.28 1i11 n LYS 49 Ca 0.05 0.08 -0.02 0.00 -2.02 0.00 0.00 58.31 56.41 1i11 n LYS 49 Cb 0.48 -1.62 0.08 0.00 -0.02 0.00 0.00 35.03 33.94 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 0.00 0.44 -0.03 1.97 4.20 -1.89 0.98 115.11 120.79 1i11 h GLN 50 Ca 0.00 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 1i11 h GLN 50 Cb 0.61 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1i11 h GLN 50 CO 0.00 0.29 -0.15 -1.00 -0.67 0.00 0.00 178.83 177.30 1i11 h PRO 51 N 0.46 0.15 0.00 1.46 0.13 -1.92 -2.66 132.00 129.63 1i11 h PRO 51 Ca 0.27 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1i11 h PRO 51 Cb 0.27 0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.42 1i11 h PRO 51 CO -0.24 0.78 0.00 0.66 -0.23 0.00 0.00 178.00 178.98 1i11 n TYR 52 N -4.61 0.00 0.11 1.56 4.01 -1.18 -2.48 117.16 114.57 1i11 n TYR 52 Ca -0.09 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.42 1i11 n TYR 52 Cb 0.41 -0.48 -0.15 0.00 -0.31 0.00 0.00 39.34 38.80 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 0.82 0.00 -0.72 0.05 -0.61 -3.29 116.97 113.22 1i11 h TYR 53 Ca 0.00 -0.60 -0.07 0.00 0.05 0.00 0.00 58.73 58.11 1i11 h TYR 53 Cb 0.26 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 37.96 1i11 h TYR 53 CO 0.00 1.60 -0.34 1.05 -1.05 0.00 0.00 178.16 179.42 1i11 h GLU 54 N 0.12 0.00 0.00 4.88 4.11 -1.16 -1.30 114.58 121.24 1i11 h GLU 54 Ca -0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.13 1i11 h GLU 54 Cb 2.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.38 1i11 h GLU 54 CO 0.22 0.34 0.00 0.93 0.07 0.00 0.00 179.01 180.57 1i11 h GLU 55 N 0.00 0.00 0.00 1.06 4.39 -1.62 0.46 114.58 118.87 1i11 h GLU 55 Ca -0.00 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 1i11 h GLU 55 Cb 0.62 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.25 1i11 h GLU 55 CO 0.04 0.00 -0.71 -0.56 -1.16 0.00 0.00 179.01 176.63 1i11 h GLN 56 N 0.00 0.00 -0.20 2.33 3.07 -1.33 -3.03 115.11 115.95 1i11 h GLN 56 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.74 1i11 h GLN 56 Cb 0.34 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.89 1i11 h GLN 56 CO 0.00 0.93 0.11 0.00 0.09 0.00 0.00 178.83 179.96 1i11 h ALA 57 N -0.34 1.82 0.02 0.06 0.00 -1.25 0.13 119.26 119.69 1i11 h ALA 57 Ca -0.19 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1i11 h ALA 57 Cb 1.11 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1i11 h ALA 57 CO -0.12 0.16 -0.01 0.07 0.00 0.00 0.00 179.25 179.35 1i11 h ARG 58 N 0.27 -0.03 0.00 0.00 0.11 -1.02 -2.55 114.38 111.17 1i11 h ARG 58 Ca 0.07 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.15 1i11 h ARG 58 Cb 0.01 0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.10 1i11 h ARG 58 CO -0.01 0.53 0.00 1.37 0.10 0.00 0.00 179.97 181.96 1i11 h LEU 59 N -0.60 0.00 -0.40 0.08 8.10 -1.34 -0.90 115.31 120.26 1i11 h LEU 59 Ca -0.00 0.00 -0.18 0.00 0.11 0.00 0.00 57.88 57.80 1i11 h LEU 59 Cb 0.56 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.78 1i11 h LEU 59 CO 0.00 0.00 -0.78 0.77 -4.11 0.00 0.00 178.44 174.33 1i11 h SER 60 N 0.00 0.33 -0.46 0.17 4.64 -0.52 -1.93 113.55 115.79 1i11 h SER 60 Ca 0.00 -0.23 -0.01 0.00 -0.47 0.00 0.00 61.79 61.08 1i11 h SER 60 Cb 0.28 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.25 1i11 h SER 60 CO 0.00 0.98 0.26 0.50 -0.87 0.00 0.00 176.83 177.70 1i11 h LYS 61 N 0.17 0.63 0.00 4.77 1.63 -0.75 0.11 116.57 123.13 1i11 h LYS 61 Ca -0.03 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.70 1i11 h LYS 61 Cb 1.36 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.87 1i11 h LYS 61 CO 0.12 0.49 0.00 1.96 -3.45 0.00 0.00 179.45 178.57 1i11 h GLN 62 N 0.60 0.00 0.00 1.90 1.08 -1.43 -1.00 115.11 116.26 1i11 h GLN 62 Ca 0.16 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.36 1i11 h GLN 62 Cb 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1i11 h GLN 62 CO -0.03 0.00 -0.02 1.25 -0.95 0.00 0.00 178.83 179.08 1i11 h HIS 63 N 0.00 0.00 -0.76 2.96 2.76 -0.17 -3.29 115.15 116.65 1i11 h HIS 63 Ca 0.00 0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.21 1i11 h HIS 63 Cb 0.48 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 29.39 1i11 h HIS 63 CO 0.00 0.00 0.50 -0.07 -1.30 0.00 0.00 177.93 177.06 1i11 h LEU 64 N -0.35 0.77 -1.89 0.26 3.38 -0.95 0.15 115.31 116.69 1i11 h LEU 64 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1i11 h LEU 64 Cb 0.02 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1i11 h LEU 64 CO 0.00 0.52 0.18 -0.33 0.09 0.00 0.00 178.44 178.90 1i11 h GLU 65 N 0.89 0.00 0.00 1.13 5.08 -1.33 -2.35 114.58 118.00 1i11 h GLU 65 Ca 0.31 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.65 1i11 h GLU 65 Cb 0.11 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 1i11 h GLU 65 CO -0.09 0.00 -0.33 0.87 -1.00 0.00 0.00 179.01 178.45 1i11 h LYS 66 N 0.00 0.00 -2.18 2.33 1.57 -0.76 -3.48 116.57 114.04 1i11 h LYS 66 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1i11 h LYS 66 Cb 0.36 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.43 1i11 h LYS 66 CO 0.00 0.19 -0.26 1.52 -0.57 0.00 0.00 179.45 180.33 1i11 s TYR 67 N -1.98 -1.09 0.00 -1.35 -0.85 -0.89 -5.11 117.35 106.09 1i11 s TYR 67 Ca -0.11 1.88 0.00 0.00 -0.52 0.00 0.00 57.07 58.32 1i11 s TYR 67 Cb 0.01 0.54 0.00 0.00 0.38 0.00 0.00 41.96 42.89 1i11 s TYR 67 CO 0.21 -0.60 0.00 -0.35 -1.52 0.00 0.00 175.55 173.30 1i11 n PRO 68 N 5.42 0.00 0.00 -3.49 -0.04 -1.24 -4.67 135.00 130.97 1i11 n PRO 68 Ca -0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 1i11 n PRO 68 Cb 0.49 -0.04 0.00 0.00 -0.04 0.00 0.00 33.50 33.92 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 8.00 -1.26 -4.99 116.55 121.84 1i11 n ASP 69 Ca 0.00 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.57 1i11 n ASP 69 Cb 0.00 0.00 0.44 0.00 -0.02 0.00 0.00 41.12 41.54 1i11 n ASP 69 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81