#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ab6 s LEU 6 N 0.00 3.13 -0.32 -4.62 1.43 -1.26 -4.92 118.68 112.12 1ab6 s LEU 6 Ca 0.00 2.24 -0.15 0.00 -1.03 0.00 0.00 54.13 55.19 1ab6 s LEU 6 Cb 0.00 -4.57 -0.02 0.00 0.03 0.00 0.00 46.19 41.62 1ab6 s LEU 6 CO 0.00 -2.52 0.36 -0.75 0.23 0.00 0.00 176.35 173.67 1ab6 s LYS 7 N -4.27 3.73 0.08 1.70 2.20 -1.26 -4.51 119.74 117.41 1ab6 s LYS 7 Ca 0.70 -0.25 -0.11 0.00 -0.36 0.00 0.00 55.97 55.95 1ab6 s LYS 7 Cb -0.26 -3.75 -0.06 0.00 -1.51 0.00 0.00 37.83 32.26 1ab6 s LYS 7 CO 0.51 -0.43 0.43 -0.06 -0.36 0.00 0.00 175.35 175.44 1ab6 s PHE 8 N 2.04 3.60 -0.21 4.03 0.40 -0.60 -1.61 117.98 125.64 1ab6 s PHE 8 Ca 0.13 0.86 0.00 0.00 -0.60 0.00 0.00 56.93 57.32 1ab6 s PHE 8 Cb -0.16 -2.21 0.02 0.00 0.51 0.00 0.00 43.02 41.18 1ab6 s PHE 8 CO 0.11 0.51 -0.14 -1.17 0.70 0.00 0.00 175.22 175.24 1ab6 s LEU 9 N -1.84 2.60 -0.27 -0.37 2.96 0.29 -0.87 118.68 121.18 1ab6 s LEU 9 Ca 0.33 -0.74 -0.08 0.00 -0.22 0.00 0.00 54.13 53.42 1ab6 s LEU 9 Cb -0.14 -1.56 -0.02 0.00 0.50 0.00 0.00 46.19 44.97 1ab6 s LEU 9 CO 0.18 -0.05 0.09 -0.69 -1.32 0.00 0.00 176.35 174.56 1ab6 s VAL 10 N 1.30 4.29 -0.21 1.68 1.01 0.80 -1.44 120.40 127.84 1ab6 s VAL 10 Ca 0.03 -0.35 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 1ab6 s VAL 10 Cb -0.15 -3.09 0.01 0.00 0.00 0.00 0.00 36.38 33.15 1ab6 s VAL 10 CO -0.09 0.22 -0.12 -0.69 0.00 0.00 0.00 175.10 174.43 1ab6 s VAL 11 N 1.59 2.69 -0.29 2.92 1.01 -0.06 -0.83 120.40 127.43 1ab6 s VAL 11 Ca 0.05 -0.79 -0.16 0.00 0.00 0.00 0.00 61.98 61.07 1ab6 s VAL 11 Cb -0.16 -2.22 0.12 0.00 0.00 0.00 0.00 36.38 34.12 1ab6 s VAL 11 CO 0.04 0.43 0.89 -0.62 0.00 0.00 0.00 175.10 175.84 1ab6 s ASP 12 N 1.37 -0.64 0.50 3.32 -1.08 -1.07 -1.63 116.67 117.43 1ab6 s ASP 12 Ca 0.04 1.04 0.28 0.00 -0.52 0.00 0.00 52.55 53.39 1ab6 s ASP 12 Cb -0.14 1.25 1.18 0.00 -1.46 0.00 0.00 42.92 43.75 1ab6 s ASP 12 CO -0.08 -0.16 1.93 -2.24 0.52 0.00 0.00 175.17 175.13 1ab6 h ASP 13 N 6.26 0.00 -3.07 -0.34 2.03 -1.66 -3.41 116.42 116.23 1ab6 h ASP 13 Ca -0.29 0.00 -0.59 0.00 -0.73 0.00 0.00 57.03 55.43 1ab6 h ASP 13 Cb 1.20 0.00 -0.10 0.00 -0.83 0.00 0.00 39.33 39.60 1ab6 h ASP 13 CO 0.18 0.13 0.74 0.21 -1.03 0.00 0.00 179.24 179.47 1ab6 s ASN 14 N -5.99 6.34 0.17 4.15 3.84 -1.26 -4.93 114.94 117.27 1ab6 s ASN 14 Ca 0.00 -0.27 -0.15 0.00 0.21 0.00 0.00 52.86 52.66 1ab6 s ASN 14 Cb 0.10 -2.48 0.14 0.00 -0.55 0.00 0.00 41.25 38.45 1ab6 s ASN 14 CO 0.59 -1.38 1.71 0.77 -2.79 0.00 0.00 177.10 176.00 1ab6 h SER 15 N 9.47 -0.07 0.10 -4.21 4.64 -1.99 -1.62 113.55 119.87 1ab6 h SER 15 Ca -0.26 0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.13 1ab6 h SER 15 Cb 1.07 0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1ab6 h SER 15 CO 1.15 -0.00 -0.06 0.74 -0.87 0.00 0.00 176.83 177.78 1ab6 h THR 16 N 0.17 0.80 0.00 2.95 2.02 -1.96 -1.13 112.91 115.76 1ab6 h THR 16 Ca 0.21 -0.22 -0.08 0.00 0.77 0.00 0.00 66.41 67.09 1ab6 h THR 16 Cb 0.29 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 1ab6 h THR 16 CO -0.31 0.06 -0.63 0.24 0.37 0.00 0.00 175.52 175.25 1ab6 h MET 17 N 0.00 0.00 0.18 6.66 2.86 -1.71 -2.92 114.93 119.99 1ab6 h MET 17 Ca -0.00 0.00 -0.30 0.00 -2.06 0.00 0.00 59.70 57.34 1ab6 h MET 17 Cb 0.12 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.80 1ab6 h MET 17 CO 0.01 0.31 -1.33 0.00 1.06 0.00 0.00 176.91 176.95 1ab6 h ARG 18 N 0.00 0.40 -0.58 1.72 3.08 -0.82 -2.92 114.38 115.27 1ab6 h ARG 18 Ca -0.03 -0.67 -0.05 0.00 0.07 0.00 0.00 59.98 59.30 1ab6 h ARG 18 Cb 1.31 0.25 -0.03 0.00 0.08 0.00 0.00 29.97 31.58 1ab6 h ARG 18 CO 0.04 1.32 0.15 -0.09 -1.07 0.00 0.00 179.97 180.31 1ab6 h ARG 19 N 0.12 0.88 0.63 0.04 2.43 -1.29 0.13 114.38 117.32 1ab6 h ARG 19 Ca -0.18 -0.18 -0.03 0.00 -0.81 0.00 0.00 59.98 58.77 1ab6 h ARG 19 Cb 2.04 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 31.46 1ab6 h ARG 19 CO 0.23 0.79 -0.30 0.82 -1.51 0.00 0.00 179.97 180.00 1ab6 h ILE 20 N 0.85 0.27 -0.34 1.20 2.04 -1.55 -0.71 117.51 119.27 1ab6 h ILE 20 Ca 0.19 -0.26 0.04 0.00 1.00 0.00 0.00 64.86 65.83 1ab6 h ILE 20 Cb 0.30 0.34 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 1ab6 h ILE 20 CO -0.00 0.03 0.10 0.58 0.00 0.00 0.00 178.15 178.85 1ab6 h VAL 21 N -1.04 0.87 -0.63 1.67 2.07 -1.43 0.41 116.25 118.17 1ab6 h VAL 21 Ca -0.09 -0.08 0.11 0.00 0.82 0.00 0.00 66.70 67.46 1ab6 h VAL 21 Cb 0.69 0.62 -0.08 0.00 -1.52 0.00 0.00 31.29 31.01 1ab6 h VAL 21 CO 0.14 0.04 0.20 -0.09 0.02 0.00 0.00 177.57 177.89 1ab6 h ARG 22 N 0.23 0.35 -0.05 1.57 2.43 -0.73 0.81 114.38 118.99 1ab6 h ARG 22 Ca 0.16 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.24 1ab6 h ARG 22 Cb 0.15 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1ab6 h ARG 22 CO -0.18 0.23 -0.27 -0.97 -1.51 0.00 0.00 179.97 177.27 1ab6 h ASN 23 N 0.36 0.09 -0.21 -3.80 -0.73 -0.06 -1.19 115.58 110.04 1ab6 h ASN 23 Ca 0.32 -0.02 -0.14 0.00 1.87 0.00 0.00 56.30 58.34 1ab6 h ASN 23 Cb 0.44 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 39.01 1ab6 h ASN 23 CO -0.35 0.37 -0.40 -0.07 -0.37 0.00 0.00 177.43 176.61 1ab6 h LEU 24 N 0.08 0.72 -0.39 0.34 3.38 0.12 -2.35 115.31 117.21 1ab6 h LEU 24 Ca 0.01 -0.54 -0.00 0.00 0.09 0.00 0.00 57.88 57.44 1ab6 h LEU 24 Cb 0.53 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1ab6 h LEU 24 CO 0.04 1.12 0.23 -0.07 0.09 0.00 0.00 178.44 179.85 1ab6 h LEU 25 N 0.34 0.47 -0.93 1.67 3.38 -0.64 -2.33 115.31 117.27 1ab6 h LEU 25 Ca 0.01 -0.06 0.11 0.00 0.09 0.00 0.00 57.88 58.03 1ab6 h LEU 25 Cb 0.99 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 41.55 1ab6 h LEU 25 CO 0.09 0.39 0.56 0.50 0.09 0.00 0.00 178.44 180.07 1ab6 h LYS 26 N 0.51 0.88 0.00 1.13 3.64 -1.15 0.22 116.57 121.79 1ab6 h LYS 26 Ca 0.14 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1ab6 h LYS 26 Cb 0.01 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.63 1ab6 h LYS 26 CO -0.03 0.58 0.00 0.39 -2.27 0.00 0.00 179.45 178.13 1ab6 n GLU 27 N -4.68 0.06 0.00 1.90 1.02 -0.89 -2.52 120.64 115.54 1ab6 n GLU 27 Ca 0.17 0.05 0.11 0.00 -0.02 0.00 0.00 57.16 57.47 1ab6 n GLU 27 Cb 0.32 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.26 1ab6 n GLU 27 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1ab6 n LEU 28 N -1.47 2.29 0.00 -4.62 4.77 -0.09 -4.96 117.00 112.92 1ab6 n LEU 28 Ca 0.07 -0.82 0.00 0.00 -0.03 0.00 0.00 56.01 55.23 1ab6 n LEU 28 Cb 0.29 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1ab6 n LEU 28 CO 0.24 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.32 1ab6 n GLY 29 N 1.40 0.52 3.39 -0.72 0.00 -0.80 -5.04 105.19 103.94 1ab6 n GLY 29 Ca 0.10 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.67 1ab6 n GLY 29 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ab6 s PHE 30 N -2.00 3.50 -1.52 1.61 0.08 -0.29 -4.87 117.98 114.49 1ab6 s PHE 30 Ca 0.00 -1.78 0.16 0.00 0.12 0.00 0.00 56.93 55.43 1ab6 s PHE 30 Cb 0.00 -4.05 0.55 0.00 -0.57 0.00 0.00 43.02 38.95 1ab6 s PHE 30 CO 0.00 -1.23 1.44 0.09 -0.10 0.00 0.00 175.22 175.43 1ab6 n ASN 31 N 5.11 3.59 -4.15 1.36 3.02 -1.26 -3.30 115.26 119.62 1ab6 n ASN 31 Ca 0.20 -2.22 -0.39 0.00 -0.03 0.00 0.00 54.58 52.14 1ab6 n ASN 31 Cb 0.47 -0.47 -0.08 0.00 -0.61 0.00 0.00 39.78 39.10 1ab6 n ASN 31 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1ab6 s ASN 32 N -0.88 5.59 0.04 6.41 2.47 -1.26 -5.04 114.94 122.27 1ab6 s ASN 32 Ca 0.40 -2.76 0.03 0.00 0.42 0.00 0.00 52.86 50.95 1ab6 s ASN 32 Cb 0.24 -1.94 -0.02 0.00 -1.45 0.00 0.00 41.25 38.08 1ab6 s ASN 32 CO 0.22 -0.43 -0.09 -0.69 -3.72 0.00 0.00 177.10 172.39 1ab6 s VAL 33 N 0.07 0.67 0.05 -5.21 1.01 -1.26 -1.55 120.40 114.19 1ab6 s VAL 33 Ca 0.16 -0.97 0.05 0.00 0.00 0.00 0.00 61.98 61.22 1ab6 s VAL 33 Cb -0.18 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 1ab6 s VAL 33 CO -0.04 -0.23 -0.14 -0.70 0.00 0.00 0.00 175.10 173.99 1ab6 s GLU 34 N -1.32 0.85 0.07 2.72 2.56 -0.05 -4.93 118.70 118.60 1ab6 s GLU 34 Ca -0.06 -0.85 0.07 0.00 0.00 0.00 0.00 54.97 54.14 1ab6 s GLU 34 Cb -0.08 -0.84 -0.04 0.00 2.00 0.00 0.00 34.13 35.17 1ab6 s GLU 34 CO 0.01 0.20 -0.17 -1.21 -0.56 0.00 0.00 175.26 173.52 1ab6 s GLU 35 N -1.44 2.01 0.10 4.30 2.02 -1.26 -0.14 118.70 124.29 1ab6 s GLU 35 Ca -0.01 -1.03 0.04 0.00 0.02 0.00 0.00 54.97 53.99 1ab6 s GLU 35 Cb -0.09 -2.19 -0.04 0.00 0.10 0.00 0.00 34.13 31.92 1ab6 s GLU 35 CO 0.02 0.52 -0.11 0.00 0.02 0.00 0.00 175.26 175.71 1ab6 s ALA 36 N -1.02 1.20 -0.11 5.21 0.00 -0.01 -4.92 121.76 122.12 1ab6 s ALA 36 Ca 0.16 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 50.97 1ab6 s ALA 36 Cb -0.11 -0.00 -0.24 0.00 0.00 0.00 0.00 23.12 22.77 1ab6 s ALA 36 CO 0.07 0.01 0.39 -1.91 0.00 0.00 0.00 175.76 174.33 1ab6 n GLU 37 N 0.62 0.70 -3.81 0.00 2.13 -1.26 -2.59 120.64 116.42 1ab6 n GLU 37 Ca -0.16 0.24 -0.14 0.00 0.66 0.00 0.00 57.16 57.76 1ab6 n GLU 37 Cb 0.57 -1.70 -0.03 0.00 0.27 0.00 0.00 31.44 30.55 1ab6 n GLU 37 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1ab6 n ASP 38 N -3.23 -1.27 -0.07 4.31 5.68 -1.26 -1.98 116.55 118.73 1ab6 n ASP 38 Ca -0.28 -2.76 0.09 0.00 -0.50 0.00 0.00 54.79 51.33 1ab6 n ASP 38 Cb 1.05 2.37 0.46 0.00 -1.14 0.00 0.00 41.12 43.86 1ab6 n ASP 38 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1ab6 h GLY 39 N 1.84 0.63 0.90 6.12 0.00 -1.11 -2.32 103.07 109.12 1ab6 h GLY 39 Ca -0.25 -0.20 -0.18 0.00 0.00 0.00 0.00 47.33 46.70 1ab6 h GLY 39 CO 0.34 0.15 -0.66 -2.08 0.00 0.00 0.00 176.54 174.29 1ab6 h VAL 40 N 0.50 1.38 -0.77 4.60 2.07 -1.87 -2.81 116.25 119.34 1ab6 h VAL 40 Ca 0.24 -2.04 0.01 0.00 0.82 0.00 0.00 66.70 65.73 1ab6 h VAL 40 Cb 0.31 2.43 -0.04 0.00 -1.52 0.00 0.00 31.29 32.46 1ab6 h VAL 40 CO -0.07 0.61 0.50 -0.78 0.02 0.00 0.00 177.57 177.85 1ab6 h ASP 41 N 0.07 0.89 0.01 0.57 3.58 -1.93 -1.58 116.42 118.04 1ab6 h ASP 41 Ca -0.07 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.35 1ab6 h ASP 41 Cb 1.34 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 42.17 1ab6 h ASP 41 CO 0.13 0.65 -0.01 0.00 -2.88 0.00 0.00 179.24 177.14 1ab6 h ALA 42 N 1.28 -0.02 -0.91 -0.78 0.00 -1.45 -1.78 119.26 115.60 1ab6 h ALA 42 Ca 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1ab6 h ALA 42 Cb -0.11 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1ab6 h ALA 42 CO -0.06 -0.51 0.57 -0.07 0.00 0.00 0.00 179.25 179.18 1ab6 h LEU 43 N -0.03 1.07 -2.55 0.00 3.38 -1.35 0.11 115.31 115.94 1ab6 h LEU 43 Ca 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1ab6 h LEU 43 Cb 0.02 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 1ab6 h LEU 43 CO -0.00 0.80 0.01 -1.13 0.09 0.00 0.00 178.44 178.20 1ab6 h ASN 44 N 1.24 0.00 0.07 -0.43 -0.00 -0.67 -0.29 115.58 115.50 1ab6 h ASN 44 Ca 0.33 0.00 -0.32 0.00 -0.00 0.00 0.00 56.30 56.31 1ab6 h ASN 44 Cb -0.10 0.00 -0.03 0.00 -0.00 0.00 0.00 38.32 38.20 1ab6 h ASN 44 CO -0.07 0.00 -1.73 0.29 -0.00 0.00 0.00 177.43 175.92 1ab6 n LYS 45 N -3.72 0.68 0.22 6.67 5.02 0.04 -4.02 118.16 123.05 1ab6 n LYS 45 Ca -0.03 0.38 0.16 0.00 -2.02 0.00 0.00 58.31 56.81 1ab6 n LYS 45 Cb 0.09 -1.72 0.84 0.00 -0.02 0.00 0.00 35.03 34.22 1ab6 n LYS 45 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1ab6 h LEU 46 N -0.37 0.00 -1.33 -0.35 3.38 -0.24 0.21 115.31 116.60 1ab6 h LEU 46 Ca -0.41 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.50 1ab6 h LEU 46 Cb 1.74 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.48 1ab6 h LEU 46 CO -0.04 0.00 -0.29 -0.61 0.09 0.00 0.00 178.44 177.59 1ab6 h GLN 47 N 0.00 0.00 0.00 1.13 5.75 -1.21 -1.38 115.11 119.40 1ab6 h GLN 47 Ca 0.07 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.54 1ab6 h GLN 47 Cb 0.37 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.92 1ab6 h GLN 47 CO -0.00 0.29 -0.13 0.00 -2.65 0.00 0.00 178.83 176.34 1ab6 h ALA 48 N 1.71 0.96 0.00 3.38 0.00 -0.74 -3.50 119.26 121.07 1ab6 h ALA 48 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1ab6 h ALA 48 Cb 0.65 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1ab6 h ALA 48 CO 0.04 0.16 0.00 0.41 0.00 0.00 0.00 179.25 179.86 1ab6 n GLY 49 N 0.59 -1.18 0.25 0.00 0.00 -0.52 -5.02 105.19 99.31 1ab6 n GLY 49 Ca 0.02 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1ab6 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ab6 n GLY 50 N -1.25 0.38 3.83 -0.02 0.00 -1.26 -4.91 105.19 101.96 1ab6 n GLY 50 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1ab6 n GLY 50 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ab6 s TYR 51 N -2.12 3.59 0.00 1.61 2.02 -1.26 -4.46 117.35 116.73 1ab6 s TYR 51 Ca 0.00 1.25 0.00 0.00 -0.37 0.00 0.00 57.07 57.95 1ab6 s TYR 51 Cb 0.00 -2.52 0.00 0.00 -0.40 0.00 0.00 41.96 39.04 1ab6 s TYR 51 CO 0.00 0.33 0.17 0.41 -1.57 0.00 0.00 175.55 174.89 1ab6 n GLY 52 N 0.58 0.15 3.64 0.71 0.00 -0.63 -4.93 105.19 104.70 1ab6 n GLY 52 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 1ab6 n GLY 52 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ab6 s PHE 53 N -0.37 -0.72 -0.03 1.61 2.19 -1.14 -4.31 117.98 115.20 1ab6 s PHE 53 Ca 0.00 1.65 0.05 0.00 0.33 0.00 0.00 56.93 58.96 1ab6 s PHE 53 Cb 0.00 0.38 -0.01 0.00 -1.31 0.00 0.00 43.02 42.08 1ab6 s PHE 53 CO 0.00 -0.35 -0.18 0.08 1.83 0.00 0.00 175.22 176.60 1ab6 s VAL 54 N 0.69 1.46 -0.19 3.12 1.01 -0.16 -0.55 120.40 125.78 1ab6 s VAL 54 Ca -0.02 -0.75 -0.00 0.00 0.00 0.00 0.00 61.98 61.21 1ab6 s VAL 54 Cb -0.05 -1.24 0.05 0.00 0.00 0.00 0.00 36.38 35.14 1ab6 s VAL 54 CO -0.07 0.42 -0.05 -0.63 0.00 0.00 0.00 175.10 174.76 1ab6 s ILE 55 N -0.13 1.24 0.10 2.22 1.01 -0.52 -0.50 121.20 124.62 1ab6 s ILE 55 Ca -0.00 -0.80 0.05 0.00 0.00 0.00 0.00 60.65 59.89 1ab6 s ILE 55 Cb -0.10 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 1ab6 s ILE 55 CO 0.01 0.06 -0.12 -0.94 0.00 0.00 0.00 174.94 173.96 1ab6 s SER 56 N 1.56 1.67 0.59 3.58 1.04 -0.19 -0.89 113.70 121.06 1ab6 s SER 56 Ca -0.01 -0.79 -0.12 0.00 0.48 0.00 0.00 55.95 55.51 1ab6 s SER 56 Cb -0.16 -0.03 -0.05 0.00 0.10 0.00 0.00 66.02 65.88 1ab6 s SER 56 CO -0.07 -0.20 1.02 -0.62 0.98 0.00 0.00 173.24 174.34 1ab6 s ASP 57 N -2.37 6.32 -0.01 7.02 2.15 -0.64 -0.66 116.67 128.47 1ab6 s ASP 57 Ca 0.06 1.45 -0.24 0.00 0.43 0.00 0.00 52.55 54.25 1ab6 s ASP 57 Cb -0.04 -2.48 -0.17 0.00 -0.30 0.00 0.00 42.92 39.93 1ab6 s ASP 57 CO 0.01 -0.80 1.12 -0.25 -0.17 0.00 0.00 175.17 175.09 1ab6 h TRP 58 N -0.03 -0.27 -3.54 -5.34 2.91 -1.61 -3.08 115.95 105.00 1ab6 h TRP 58 Ca -0.45 -0.01 -0.70 0.00 1.13 0.00 0.00 58.89 58.87 1ab6 h TRP 58 Cb 1.19 0.09 -0.19 0.00 -0.51 0.00 0.00 29.16 29.73 1ab6 h TRP 58 CO 0.65 0.11 -0.27 1.21 -1.03 0.00 0.00 178.44 179.11 1ab6 s ASN 59 N -5.29 6.17 -0.02 2.65 3.84 -1.26 -1.22 114.94 119.81 1ab6 s ASN 59 Ca -0.14 -0.71 -0.04 0.00 0.21 0.00 0.00 52.86 52.18 1ab6 s ASN 59 Cb 0.02 -2.20 0.00 0.00 -0.55 0.00 0.00 41.25 38.51 1ab6 s ASN 59 CO 0.54 -0.53 0.10 -0.04 -2.79 0.00 0.00 177.10 174.38 1ab6 s MET 60 N 2.00 0.28 0.50 0.43 -1.94 -1.26 -4.84 119.30 114.46 1ab6 s MET 60 Ca 0.10 -0.15 -0.20 0.00 -1.71 0.00 0.00 55.69 53.72 1ab6 s MET 60 Cb -0.18 0.12 -0.07 0.00 2.01 0.00 0.00 34.83 36.71 1ab6 s MET 60 CO 0.12 -0.05 1.09 -1.25 -0.01 0.00 0.00 175.02 174.92 1ab6 s PRO 61 N -0.66 3.66 0.00 2.03 0.04 -1.26 -2.69 135.00 136.11 1ab6 s PRO 61 Ca -0.07 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1ab6 s PRO 61 Cb -0.05 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1ab6 s PRO 61 CO 0.00 -0.58 0.00 0.09 0.04 0.00 0.00 177.00 176.56 1ab6 n ASN 62 N -0.98 0.00 -3.38 6.66 4.13 -1.26 -4.31 115.26 116.11 1ab6 n ASN 62 Ca 0.10 0.00 -0.13 0.00 1.68 0.00 0.00 54.58 56.22 1ab6 n ASN 62 Cb 0.51 0.00 -0.09 0.00 -1.54 0.00 0.00 39.78 38.66 1ab6 n ASN 62 CO 0.00 0.00 0.00 -0.32 0.28 0.00 0.00 177.26 177.22 1ab6 s MET 63 N 0.00 0.32 1.21 3.52 -2.45 -1.26 -4.91 119.30 115.74 1ab6 s MET 63 Ca 0.00 0.19 -0.19 0.00 -1.25 0.00 0.00 55.69 54.44 1ab6 s MET 63 Cb 0.00 -0.64 0.29 0.00 1.25 0.00 0.00 34.83 35.73 1ab6 s MET 63 CO 0.00 -0.84 1.08 0.16 1.05 0.00 0.00 175.02 176.47 1ab6 s ASP 64 N 2.45 0.82 0.17 1.11 -4.77 -1.10 -0.72 116.67 114.64 1ab6 s ASP 64 Ca 0.10 0.73 -0.14 0.00 -3.30 0.00 0.00 52.55 49.94 1ab6 s ASP 64 Cb -0.14 -1.04 0.12 0.00 -1.09 0.00 0.00 42.92 40.76 1ab6 s ASP 64 CO -0.23 -4.19 1.77 1.23 0.70 0.00 0.00 175.17 174.44 1ab6 h GLY 65 N -2.63 0.62 0.62 2.12 0.00 -1.07 -2.34 103.07 100.40 1ab6 h GLY 65 Ca -0.46 -0.13 0.04 0.00 0.00 0.00 0.00 47.33 46.78 1ab6 h GLY 65 CO 0.36 0.07 0.02 -2.00 0.00 0.00 0.00 176.54 174.98 1ab6 h LEU 66 N 0.40 -0.07 -0.47 3.11 5.85 -1.85 -0.39 115.31 121.90 1ab6 h LEU 66 Ca 0.21 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 1ab6 h LEU 66 Cb 0.16 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1ab6 h LEU 66 CO -0.18 -0.00 0.21 -0.33 -0.34 0.00 0.00 178.44 177.80 1ab6 h GLU 67 N 0.10 0.69 -0.32 1.25 4.39 -1.88 -1.45 114.58 117.36 1ab6 h GLU 67 Ca 0.12 -0.11 0.07 0.00 0.34 0.00 0.00 59.36 59.78 1ab6 h GLU 67 Cb 0.15 -0.12 -0.06 0.00 -0.10 0.00 0.00 28.75 28.62 1ab6 h GLU 67 CO -0.20 0.60 -0.10 1.25 -1.16 0.00 0.00 179.01 179.40 1ab6 h LEU 68 N 0.62 -0.35 -0.08 1.33 5.85 -0.93 0.59 115.31 122.33 1ab6 h LEU 68 Ca 0.16 0.10 0.02 0.00 0.84 0.00 0.00 57.88 59.00 1ab6 h LEU 68 Cb 0.15 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1ab6 h LEU 68 CO -0.02 -0.13 -0.05 0.25 -0.34 0.00 0.00 178.44 178.16 1ab6 h LEU 69 N -0.03 -0.15 -1.44 2.25 5.85 -0.91 -0.28 115.31 120.60 1ab6 h LEU 69 Ca 0.16 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.97 1ab6 h LEU 69 Cb 0.27 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 1ab6 h LEU 69 CO -0.34 -0.07 0.44 0.11 -0.34 0.00 0.00 178.44 178.24 1ab6 h LYS 70 N -0.05 0.67 -0.06 1.25 1.57 -0.54 0.66 116.57 120.07 1ab6 h LYS 70 Ca 0.05 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.63 1ab6 h LYS 70 Cb 0.12 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1ab6 h LYS 70 CO -0.11 0.44 -0.66 1.15 -0.57 0.00 0.00 179.45 179.70 1ab6 h THR 71 N 0.69 1.40 0.03 -0.16 2.02 -0.08 -0.56 112.91 116.24 1ab6 h THR 71 Ca 0.29 -2.09 -0.00 0.00 0.77 0.00 0.00 66.41 65.37 1ab6 h THR 71 Cb 0.25 2.08 0.00 0.00 -1.74 0.00 0.00 68.15 68.74 1ab6 h THR 71 CO -0.09 0.62 -0.01 0.40 0.37 0.00 0.00 175.52 176.81 1ab6 h ILE 72 N 0.18 1.34 -0.57 3.11 2.04 0.09 -1.20 117.51 122.50 1ab6 h ILE 72 Ca -0.01 -1.20 0.00 0.00 1.00 0.00 0.00 64.86 64.65 1ab6 h ILE 72 Cb 1.19 2.14 -0.03 0.00 -0.74 0.00 0.00 36.82 39.38 1ab6 h ILE 72 CO 0.10 0.30 0.36 0.03 0.00 0.00 0.00 178.15 178.95 1ab6 h ARG 73 N -0.56 0.76 0.00 2.37 2.47 -0.92 -2.15 114.38 116.35 1ab6 h ARG 73 Ca -0.00 -0.05 -0.12 0.00 -1.26 0.00 0.00 59.98 58.54 1ab6 h ARG 73 Cb 0.53 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.66 1ab6 h ARG 73 CO 0.01 0.52 -0.56 0.00 0.56 0.00 0.00 179.97 180.50 1ab6 h ALA 74 N 1.62 0.65 -2.73 0.04 0.00 -1.09 -3.40 119.26 114.34 1ab6 h ALA 74 Ca 0.21 -0.51 -0.53 0.00 0.00 0.00 0.00 54.91 54.09 1ab6 h ALA 74 Cb -0.06 -0.09 0.07 0.00 0.00 0.00 0.00 17.79 17.71 1ab6 h ALA 74 CO -0.04 0.70 0.87 0.34 0.00 0.00 0.00 179.25 181.11 1ab6 s ASP 75 N -6.49 6.49 0.56 0.00 2.15 -0.46 -4.89 116.67 114.03 1ab6 s ASP 75 Ca 0.03 2.80 0.25 0.00 0.43 0.00 0.00 52.55 56.06 1ab6 s ASP 75 Cb 0.08 -2.62 1.53 0.00 -0.30 0.00 0.00 42.92 41.61 1ab6 s ASP 75 CO 0.75 -0.85 2.12 1.23 -0.17 0.00 0.00 175.17 178.26 1ab6 h GLY 76 N 5.49 0.00 0.00 2.66 0.00 -1.88 -2.18 103.07 107.15 1ab6 h GLY 76 Ca -0.45 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.50 1ab6 h GLY 76 CO 0.83 0.00 -2.31 0.00 0.00 0.00 0.00 176.54 175.06 1ab6 n ALA 77 N -2.44 1.48 0.44 3.60 0.00 -1.26 -4.64 120.51 117.69 1ab6 n ALA 77 Ca 0.01 -0.94 0.10 0.00 0.00 0.00 0.00 53.44 52.61 1ab6 n ALA 77 Cb 0.27 0.14 0.43 0.00 0.00 0.00 0.00 19.45 20.29 1ab6 n ALA 77 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1ab6 n MET 78 N -3.80 0.13 -0.24 0.00 2.81 -1.21 -4.36 117.12 110.45 1ab6 n MET 78 Ca -0.45 0.36 0.18 0.00 -1.81 0.00 0.00 57.70 55.98 1ab6 n MET 78 Cb 0.86 -1.74 0.33 0.00 -0.71 0.00 0.00 33.22 31.95 1ab6 n MET 78 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1ab6 n SER 79 N -1.99 0.10 -0.01 7.83 7.64 -0.82 -1.56 113.62 124.80 1ab6 n SER 79 Ca 0.03 1.21 0.13 0.00 1.01 0.00 0.00 58.87 61.25 1ab6 n SER 79 Cb 0.22 -0.52 0.49 0.00 -1.01 0.00 0.00 64.21 63.39 1ab6 n SER 79 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ab6 n ALA 80 N -2.83 2.81 -1.67 -0.43 0.00 -1.26 -4.50 120.51 112.63 1ab6 n ALA 80 Ca 0.23 -0.21 -0.47 0.00 0.00 0.00 0.00 53.44 52.99 1ab6 n ALA 80 Cb 0.77 -1.33 -0.04 0.00 0.00 0.00 0.00 19.45 18.84 1ab6 n ALA 80 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ab6 n LEU 81 N -1.43 3.08 -4.68 0.00 7.94 -0.60 -4.90 117.00 116.39 1ab6 n LEU 81 Ca 0.07 1.06 -0.42 0.00 -1.11 0.00 0.00 56.01 55.61 1ab6 n LEU 81 Cb 0.33 -1.40 -0.03 0.00 0.53 0.00 0.00 43.42 42.85 1ab6 n LEU 81 CO 0.29 -0.29 1.07 -2.16 -1.11 0.00 0.00 177.39 175.20 1ab6 s PRO 82 N 1.55 4.30 -0.28 1.96 0.04 -1.26 -4.93 135.00 136.37 1ab6 s PRO 82 Ca 0.82 1.85 0.02 0.00 0.04 0.00 0.00 61.00 63.73 1ab6 s PRO 82 Cb -0.70 -3.60 0.08 0.00 0.04 0.00 0.00 34.50 30.32 1ab6 s PRO 82 CO 0.41 -0.55 -0.03 0.08 0.04 0.00 0.00 177.00 176.96 1ab6 s VAL 83 N 2.48 1.89 -0.17 -0.36 1.01 -1.25 -0.99 120.40 123.01 1ab6 s VAL 83 Ca 0.61 -1.70 -0.19 0.00 0.00 0.00 0.00 61.98 60.70 1ab6 s VAL 83 Cb -0.28 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.86 1ab6 s VAL 83 CO 0.24 -0.28 0.52 -0.22 0.00 0.00 0.00 175.10 175.36 1ab6 s LEU 84 N 1.18 4.20 -0.17 3.92 2.96 0.34 -0.97 118.68 130.14 1ab6 s LEU 84 Ca -0.00 0.75 -0.11 0.00 -0.22 0.00 0.00 54.13 54.55 1ab6 s LEU 84 Cb -0.19 -2.73 -0.05 0.00 0.50 0.00 0.00 46.19 43.72 1ab6 s LEU 84 CO -0.08 -0.13 0.20 -0.32 -1.32 0.00 0.00 176.35 174.71 1ab6 s MET 85 N 1.30 4.11 0.44 1.98 -2.45 -0.43 -1.03 119.30 123.22 1ab6 s MET 85 Ca 0.26 -0.06 0.07 0.00 -1.25 0.00 0.00 55.69 54.70 1ab6 s MET 85 Cb -0.15 -3.38 -0.01 0.00 1.25 0.00 0.00 34.83 32.53 1ab6 s MET 85 CO 0.10 0.35 0.35 0.95 1.05 0.00 0.00 175.02 177.83 1ab6 s THR 86 N 0.16 2.39 0.00 10.11 -4.23 0.17 -0.38 115.64 123.86 1ab6 s THR 86 Ca 0.13 -1.44 0.00 0.00 -1.18 0.00 0.00 61.69 59.20 1ab6 s THR 86 Cb -0.12 -2.83 0.00 0.00 1.34 0.00 0.00 72.50 70.89 1ab6 s THR 86 CO 0.02 0.00 0.00 1.07 -0.54 0.00 0.00 174.62 175.17 1ab6 n THR 87 N -1.53 0.00 -0.10 3.99 5.66 -1.06 -1.41 114.28 119.83 1ab6 n THR 87 Ca 0.02 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.79 1ab6 n THR 87 Cb 0.63 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.29 1ab6 n THR 87 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ab6 n ALA 88 N -0.19 1.19 -1.73 1.79 0.00 -1.26 0.05 120.51 120.35 1ab6 n ALA 88 Ca 0.00 -0.94 -0.41 0.00 0.00 0.00 0.00 53.44 52.10 1ab6 n ALA 88 Cb 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 19.45 19.24 1ab6 n ALA 88 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1ab6 n GLU 89 N -3.71 3.59 -3.06 0.00 0.00 -1.26 -4.72 120.64 111.48 1ab6 n GLU 89 Ca -0.44 -2.77 -0.45 0.00 0.00 0.00 0.00 57.16 53.50 1ab6 n GLU 89 Cb 0.94 -2.94 -0.01 0.00 0.00 0.00 0.00 31.44 29.42 1ab6 n GLU 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ab6 s ALA 90 N 1.59 3.86 -0.06 -1.84 0.00 -1.26 -4.72 121.76 119.32 1ab6 s ALA 90 Ca 0.55 -3.18 -0.06 0.00 0.00 0.00 0.00 51.96 49.27 1ab6 s ALA 90 Cb 0.15 -3.91 -0.03 0.00 0.00 0.00 0.00 23.12 19.33 1ab6 s ALA 90 CO -0.06 -2.69 -0.13 1.17 0.00 0.00 0.00 175.76 174.04 1ab6 n LYS 91 N 5.32 0.21 0.00 0.00 3.00 -1.26 -5.06 118.16 120.36 1ab6 n LYS 91 Ca 0.26 0.09 0.00 0.00 -0.00 0.00 0.00 58.31 58.66 1ab6 n LYS 91 Cb 0.46 -0.85 0.00 0.00 0.00 0.00 0.00 35.03 34.63 1ab6 n LYS 91 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1ab6 n LYS 92 N -3.62 0.00 -0.21 1.64 2.85 -1.26 -5.00 118.16 112.56 1ab6 n LYS 92 Ca -0.14 0.00 0.01 0.00 -1.05 0.00 0.00 58.31 57.13 1ab6 n LYS 92 Cb 0.46 0.00 0.05 0.00 -0.65 0.00 0.00 35.03 34.89 1ab6 n LYS 92 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1ab6 n GLU 93 N 0.00 -0.09 -0.05 -1.58 2.13 -1.26 -1.03 120.64 118.76 1ab6 n GLU 93 Ca 0.00 0.88 -0.13 0.00 0.66 0.00 0.00 57.16 58.57 1ab6 n GLU 93 Cb 0.00 -1.31 -0.09 0.00 0.27 0.00 0.00 31.44 30.31 1ab6 n GLU 93 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1ab6 h ASN 94 N 0.00 -1.59 -0.54 4.31 2.35 -1.95 0.62 115.58 118.78 1ab6 h ASN 94 Ca 0.23 0.20 0.11 0.00 -0.55 0.00 0.00 56.30 56.29 1ab6 h ASN 94 Cb 0.38 0.63 -0.09 0.00 0.05 0.00 0.00 38.32 39.29 1ab6 h ASN 94 CO -0.58 -0.41 0.03 0.40 -1.65 0.00 0.00 177.43 175.23 1ab6 h ILE 95 N -0.47 0.60 -0.28 2.81 2.04 -1.44 0.35 117.51 121.12 1ab6 h ILE 95 Ca 0.04 -0.05 -0.09 0.00 1.00 0.00 0.00 64.86 65.76 1ab6 h ILE 95 Cb 0.58 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1ab6 h ILE 95 CO -0.44 0.03 -0.19 0.40 0.00 0.00 0.00 178.15 177.95 1ab6 h ILE 96 N 0.15 1.25 0.00 -0.67 2.04 -1.15 -1.00 117.51 118.13 1ab6 h ILE 96 Ca 0.28 -1.16 -0.15 0.00 1.00 0.00 0.00 64.86 64.83 1ab6 h ILE 96 Cb 0.42 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.72 1ab6 h ILE 96 CO -0.43 0.37 -0.73 0.00 0.00 0.00 0.00 178.15 177.36 1ab6 h ALA 97 N 1.34 0.72 -0.03 1.87 0.00 0.25 0.06 119.26 123.48 1ab6 h ALA 97 Ca 0.08 -0.67 -0.02 0.00 0.00 0.00 0.00 54.91 54.30 1ab6 h ALA 97 Cb 0.59 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1ab6 h ALA 97 CO 0.04 0.92 -0.05 0.00 0.00 0.00 0.00 179.25 180.16 1ab6 h ALA 98 N 1.27 0.04 0.12 0.00 0.00 -0.12 -0.04 119.26 120.54 1ab6 h ALA 98 Ca -0.01 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.63 1ab6 h ALA 98 Cb 1.35 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 1ab6 h ALA 98 CO 0.10 -0.15 -0.22 0.00 0.00 0.00 0.00 179.25 178.98 1ab6 h ALA 99 N 0.48 -0.37 -0.60 0.00 0.00 -1.15 0.16 119.26 117.79 1ab6 h ALA 99 Ca 0.00 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1ab6 h ALA 99 Cb 0.59 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 1ab6 h ALA 99 CO 0.01 -0.75 0.40 0.37 0.00 0.00 0.00 179.25 179.28 1ab6 h GLN 100 N -0.41 0.56 -0.00 0.00 4.15 -0.99 0.04 115.11 118.45 1ab6 h GLN 100 Ca 0.03 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1ab6 h GLN 100 Cb 0.43 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.99 1ab6 h GLN 100 CO -0.12 0.37 -0.00 0.00 -1.93 0.00 0.00 178.83 177.15 1ab6 n ALA 101 N -2.48 2.67 -1.05 3.38 0.00 -0.03 -4.90 120.51 118.09 1ab6 n ALA 101 Ca 0.08 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1ab6 n ALA 101 Cb 0.24 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.23 1ab6 n ALA 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ab6 n GLY 102 N 1.05 0.85 3.77 0.00 0.00 0.00 -4.65 105.19 106.22 1ab6 n GLY 102 Ca 0.22 -0.60 -0.40 0.00 0.00 0.00 0.00 46.02 45.24 1ab6 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ab6 s ALA 103 N -2.00 3.40 -0.35 4.61 0.00 0.47 -4.89 121.76 123.01 1ab6 s ALA 103 Ca 0.00 1.26 0.21 0.00 0.00 0.00 0.00 51.96 53.44 1ab6 s ALA 103 Cb 0.00 -3.49 0.31 0.00 0.00 0.00 0.00 23.12 19.94 1ab6 s ALA 103 CO 0.00 -0.73 1.58 0.77 0.00 0.00 0.00 175.76 177.38 1ab6 h SER 104 N 3.07 0.00 -5.38 0.00 0.02 -1.39 -3.44 113.55 106.43 1ab6 h SER 104 Ca -0.49 0.00 0.18 0.00 -0.84 0.00 0.00 61.79 60.64 1ab6 h SER 104 Cb 1.23 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.70 1ab6 h SER 104 CO 0.64 0.13 0.53 -0.83 -1.14 0.00 0.00 176.83 176.16 1ab6 s GLY 105 N -4.27 -0.15 -0.15 -3.77 0.00 -1.18 -4.87 107.32 92.93 1ab6 s GLY 105 Ca 0.06 0.04 -0.06 0.00 0.00 0.00 0.00 44.72 44.76 1ab6 s GLY 105 CO 0.68 0.60 0.32 -0.47 0.00 0.00 0.00 173.10 174.23 1ab6 s TYR 106 N -2.92 -0.51 0.15 1.90 5.04 -1.26 -1.31 117.35 118.44 1ab6 s TYR 106 Ca 0.15 1.11 0.10 0.00 -2.44 0.00 0.00 57.07 55.98 1ab6 s TYR 106 Cb -0.01 0.12 -0.04 0.00 0.35 0.00 0.00 41.96 42.38 1ab6 s TYR 106 CO 0.03 -0.34 -0.23 0.14 -1.34 0.00 0.00 175.55 173.81 1ab6 s VAL 107 N 1.91 2.06 -0.09 3.14 -7.23 0.49 -4.96 120.40 115.72 1ab6 s VAL 107 Ca -0.05 -1.83 -0.02 0.00 -1.81 0.00 0.00 61.98 58.27 1ab6 s VAL 107 Cb -0.11 -1.90 -0.03 0.00 0.56 0.00 0.00 36.38 34.90 1ab6 s VAL 107 CO -0.10 -0.11 -0.01 -0.69 -0.31 0.00 0.00 175.10 173.88 1ab6 s VAL 108 N -1.52 4.25 0.06 1.32 1.01 -1.26 -2.55 120.40 121.72 1ab6 s VAL 108 Ca 0.15 -0.27 -0.21 0.00 0.00 0.00 0.00 61.98 61.65 1ab6 s VAL 108 Cb -0.08 -2.78 -0.06 0.00 0.00 0.00 0.00 36.38 33.45 1ab6 s VAL 108 CO 0.07 0.60 0.61 -0.54 0.00 0.00 0.00 175.10 175.84 1ab6 s LYS 109 N -0.82 4.28 0.54 2.72 1.02 0.11 -3.96 119.74 123.63 1ab6 s LYS 109 Ca 0.12 0.80 -0.02 0.00 0.02 0.00 0.00 55.97 56.90 1ab6 s LYS 109 Cb -0.11 -3.27 0.02 0.00 -0.52 0.00 0.00 37.83 33.94 1ab6 s LYS 109 CO 0.02 0.55 0.80 -1.25 -0.92 0.00 0.00 175.35 174.55 1ab6 s PRO 110 N -0.85 2.77 0.06 -1.68 0.04 -1.26 -4.73 135.00 129.35 1ab6 s PRO 110 Ca 0.31 -0.44 -0.04 0.00 0.04 0.00 0.00 61.00 60.87 1ab6 s PRO 110 Cb -0.20 -2.42 -0.03 0.00 0.04 0.00 0.00 34.50 31.89 1ab6 s PRO 110 CO 0.20 -0.62 0.05 -0.59 0.04 0.00 0.00 177.00 176.08 1ab6 s PHE 111 N -2.80 0.37 0.46 0.56 -0.71 -1.25 -5.16 117.98 109.45 1ab6 s PHE 111 Ca 0.54 -0.87 0.08 0.00 -1.04 0.00 0.00 56.93 55.64 1ab6 s PHE 111 Cb -0.10 -0.26 0.01 0.00 -1.21 0.00 0.00 43.02 41.46 1ab6 s PHE 111 CO 0.40 -0.43 0.47 0.95 -1.34 0.00 0.00 175.22 175.27 1ab6 s THR 112 N -3.80 2.45 0.31 -4.49 -4.23 -1.26 -4.96 115.64 99.66 1ab6 s THR 112 Ca 0.05 -1.27 0.07 0.00 -1.18 0.00 0.00 61.69 59.36 1ab6 s THR 112 Cb 0.06 -2.72 0.31 0.00 1.34 0.00 0.00 72.50 71.49 1ab6 s THR 112 CO -0.10 0.00 1.80 0.00 -0.54 0.00 0.00 174.62 175.78 1ab6 h ALA 113 N 0.79 1.72 -0.19 3.99 0.00 -1.99 -1.35 119.26 122.22 1ab6 h ALA 113 Ca -0.39 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1ab6 h ALA 113 Cb 1.28 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1ab6 h ALA 113 CO 0.53 -0.06 0.02 0.00 0.00 0.00 0.00 179.25 179.75 1ab6 h ALA 114 N 1.62 0.26 -0.64 0.00 0.00 -1.98 -0.67 119.26 117.86 1ab6 h ALA 114 Ca 0.55 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 55.20 1ab6 h ALA 114 Cb 0.86 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1ab6 h ALA 114 CO -0.33 -0.06 0.10 1.15 0.00 0.00 0.00 179.25 180.10 1ab6 h THR 115 N 0.10 1.26 -0.09 0.00 2.02 -1.76 -0.47 112.91 113.97 1ab6 h THR 115 Ca 0.06 -1.02 -0.02 0.00 0.77 0.00 0.00 66.41 66.20 1ab6 h THR 115 Cb 0.34 0.66 -0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1ab6 h THR 115 CO 0.01 0.38 -0.02 0.25 0.37 0.00 0.00 175.52 176.50 1ab6 h LEU 116 N 0.98 0.17 -0.68 2.58 5.85 -1.25 -2.62 115.31 120.34 1ab6 h LEU 116 Ca 0.19 -0.38 0.08 0.00 0.84 0.00 0.00 57.88 58.62 1ab6 h LEU 116 Cb 0.43 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.35 1ab6 h LEU 116 CO 0.01 0.51 0.34 -0.08 -0.34 0.00 0.00 178.44 178.88 1ab6 h GLU 117 N -0.17 0.57 -0.20 1.25 4.81 -0.94 -0.08 114.58 119.83 1ab6 h GLU 117 Ca 0.02 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1ab6 h GLU 117 Cb 0.44 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 1ab6 h GLU 117 CO 0.01 0.38 0.04 1.49 -0.73 0.00 0.00 179.01 180.20 1ab6 h GLU 118 N 0.59 0.11 -0.43 1.92 4.81 -1.01 -0.31 114.58 120.26 1ab6 h GLU 118 Ca 0.33 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.54 1ab6 h GLU 118 Cb 0.32 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1ab6 h GLU 118 CO -0.25 0.07 0.21 0.87 -0.73 0.00 0.00 179.01 179.18 1ab6 h LYS 119 N 0.11 0.62 -0.19 1.92 1.79 -0.99 -1.21 116.57 118.62 1ab6 h LYS 119 Ca 0.09 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1ab6 h LYS 119 Cb 0.09 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.61 1ab6 h LYS 119 CO -0.12 0.53 0.12 -0.07 -1.08 0.00 0.00 179.45 178.83 1ab6 h LEU 120 N 0.55 0.20 -0.07 2.94 3.38 -0.76 -0.49 115.31 121.06 1ab6 h LEU 120 Ca 0.15 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.15 1ab6 h LEU 120 Cb 0.12 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 1ab6 h LEU 120 CO -0.02 0.15 -0.20 0.78 0.09 0.00 0.00 178.44 179.24 1ab6 h ASN 121 N 0.24 -0.61 -0.24 -0.43 2.35 -0.81 0.51 115.58 116.61 1ab6 h ASN 121 Ca 0.07 0.10 0.04 0.00 -0.55 0.00 0.00 56.30 55.96 1ab6 h ASN 121 Cb -0.02 0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.57 1ab6 h ASN 121 CO -0.02 -0.26 -0.01 0.50 -1.65 0.00 0.00 177.43 175.99 1ab6 h LYS 122 N -0.29 0.06 -0.48 0.81 3.64 -1.00 0.13 116.57 119.44 1ab6 h LYS 122 Ca 0.08 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.40 1ab6 h LYS 122 Cb 0.40 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1ab6 h LYS 122 CO -0.24 0.04 0.05 0.82 -2.27 0.00 0.00 179.45 177.85 1ab6 h ILE 123 N 0.06 1.23 -0.10 2.00 2.04 -0.69 -1.58 117.51 120.48 1ab6 h ILE 123 Ca 0.11 -0.90 -0.08 0.00 1.00 0.00 0.00 64.86 64.99 1ab6 h ILE 123 Cb 0.15 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 1ab6 h ILE 123 CO -0.20 0.32 -0.30 -0.26 0.00 0.00 0.00 178.15 177.71 1ab6 h PHE 124 N 0.72 0.20 0.18 1.37 0.04 0.97 -3.16 116.94 117.27 1ab6 h PHE 124 Ca 0.15 -0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.87 1ab6 h PHE 124 Cb 0.37 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.48 1ab6 h PHE 124 CO 0.02 0.47 -0.09 0.93 -0.60 0.00 0.00 178.31 179.04 1ab6 h GLU 125 N 0.16 -0.23 0.00 1.51 5.08 0.07 -3.14 114.58 118.03 1ab6 h GLU 125 Ca 0.02 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1ab6 h GLU 125 Cb 0.62 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1ab6 h GLU 125 CO 0.05 0.17 0.00 1.63 -1.00 0.00 0.00 179.01 179.85 1ab6 n LYS 126 N -4.99 0.05 -0.04 2.33 4.01 -0.68 -1.47 118.16 117.37 1ab6 n LYS 126 Ca -0.09 0.00 -0.16 0.00 -0.51 0.00 0.00 58.31 57.55 1ab6 n LYS 126 Cb 0.26 -1.17 -0.14 0.00 -0.51 0.00 0.00 35.03 33.47 1ab6 n LYS 126 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 1ab6 n LEU 127 N -0.67 2.02 0.00 -0.35 4.77 -1.19 -4.96 117.00 116.62 1ab6 n LEU 127 Ca 0.00 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 1ab6 n LEU 127 Cb 0.00 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.50 1ab6 n LEU 127 CO 0.00 0.73 0.00 0.61 -1.33 0.00 0.00 177.39 177.40 1ab6 n GLY 128 N 1.93 1.02 0.79 -0.72 0.00 -0.54 -5.16 105.19 102.51 1ab6 n GLY 128 Ca -0.32 -1.99 0.10 0.00 0.00 0.00 0.00 46.02 43.81 1ab6 n GLY 128 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47