#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fq2 n LYS 2 N 0.00 0.00 0.00 3.23 5.02 -1.26 -3.98 118.16 121.17 2fq2 n LYS 2 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2fq2 n LYS 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2fq2 n LYS 2 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2fq2 n SER 3 N 2.65 0.00 0.08 4.39 3.41 -1.26 -4.95 113.62 117.93 2fq2 n SER 3 Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.75 2fq2 n SER 3 Cb 0.00 0.00 0.64 0.00 -0.26 0.00 0.00 64.21 64.59 2fq2 n SER 3 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2fq2 h THR 4 N 0.00 0.86 -1.06 6.66 2.02 -1.87 -1.90 112.91 117.62 2fq2 h THR 4 Ca 0.00 -0.03 0.32 0.00 0.77 0.00 0.00 66.41 67.47 2fq2 h THR 4 Cb 0.00 0.78 -0.13 0.00 -1.74 0.00 0.00 68.15 67.05 2fq2 h THR 4 CO 0.00 0.01 0.64 0.15 0.37 0.00 0.00 175.52 176.69 2fq2 h PHE 5 N 0.08 0.82 0.00 3.16 3.57 -1.93 0.63 116.94 123.27 2fq2 h PHE 5 Ca 0.17 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.70 2fq2 h PHE 5 Cb 0.57 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.09 2fq2 h PHE 5 CO -0.00 -0.10 0.00 -0.25 -2.23 0.00 0.00 178.31 175.73 2fq2 n ASP 6 N -4.88 0.00 -0.22 0.41 8.00 -0.71 0.12 116.55 119.25 2fq2 n ASP 6 Ca 0.31 0.88 0.25 0.00 0.71 0.00 0.00 54.79 56.94 2fq2 n ASP 6 Cb 1.01 -0.38 0.63 0.00 -0.02 0.00 0.00 41.12 42.37 2fq2 n ASP 6 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2fq2 h ASP 7 N 0.00 0.18 -0.39 -2.24 5.19 -1.61 0.14 116.42 117.69 2fq2 h ASP 7 Ca 0.00 0.02 -0.12 0.00 -0.62 0.00 0.00 57.03 56.31 2fq2 h ASP 7 Cb 0.00 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.49 2fq2 h ASP 7 CO 0.00 0.06 -0.24 0.40 -3.12 0.00 0.00 179.24 176.34 2fq2 h ILE 8 N 0.17 1.28 0.00 0.35 2.04 -0.65 -2.37 117.51 118.33 2fq2 h ILE 8 Ca 0.47 -1.39 -0.02 0.00 1.00 0.00 0.00 64.86 64.92 2fq2 h ILE 8 Cb 1.55 1.32 -0.00 0.00 -0.74 0.00 0.00 36.82 38.94 2fq2 h ILE 8 CO -0.09 0.46 -0.11 0.07 0.00 0.00 0.00 178.15 178.48 2fq2 h LYS 9 N 0.67 0.00 0.06 2.37 2.10 0.25 -1.73 116.57 120.30 2fq2 h LYS 9 Ca 0.08 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.73 2fq2 h LYS 9 Cb 0.81 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.14 2fq2 h LYS 9 CO 0.07 0.11 -0.03 0.87 -2.00 0.00 0.00 179.45 178.46 2fq2 h LYS 10 N 0.00 -0.08 -0.81 0.07 1.57 -1.20 -1.33 116.57 114.79 2fq2 h LYS 10 Ca -0.00 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.87 2fq2 h LYS 10 Cb 0.26 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.52 2fq2 h LYS 10 CO 0.01 0.42 0.47 -0.84 -0.57 0.00 0.00 179.45 178.94 2fq2 h ILE 11 N -0.95 0.93 -0.01 1.86 3.07 -1.31 -1.14 117.51 119.95 2fq2 h ILE 11 Ca -0.01 -0.27 -0.16 0.00 1.55 0.00 0.00 64.86 65.97 2fq2 h ILE 11 Cb 0.53 0.06 -0.02 0.00 -0.27 0.00 0.00 36.82 37.13 2fq2 h ILE 11 CO 0.01 0.15 -0.71 0.16 -1.05 0.00 0.00 178.15 176.70 2fq2 h ILE 12 N 0.80 1.48 -0.33 0.16 3.07 -1.43 0.20 117.51 121.46 2fq2 h ILE 12 Ca 0.39 -2.36 -0.00 0.00 1.55 0.00 0.00 64.86 64.43 2fq2 h ILE 12 Cb 0.32 2.27 -0.02 0.00 -0.27 0.00 0.00 36.82 39.13 2fq2 h ILE 12 CO -0.23 0.68 0.19 0.28 -1.05 0.00 0.00 178.15 178.02 2fq2 h SER 13 N 0.06 0.39 0.00 2.16 0.02 -0.01 0.27 113.55 116.44 2fq2 h SER 13 Ca -0.01 -0.02 -0.13 0.00 -0.84 0.00 0.00 61.79 60.78 2fq2 h SER 13 Cb 1.26 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.68 2fq2 h SER 13 CO 0.10 0.31 -2.07 1.17 -1.14 0.00 0.00 176.83 175.20 2fq2 n LYS 14 N -4.46 0.73 0.00 3.45 4.81 -0.94 -3.43 118.16 118.33 2fq2 n LYS 14 Ca 0.02 -0.12 0.00 0.00 -0.87 0.00 0.00 58.31 57.34 2fq2 n LYS 14 Cb 0.09 -1.48 0.00 0.00 0.02 0.00 0.00 35.03 33.65 2fq2 n LYS 14 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2fq2 n GLN 15 N -2.40 0.00 -0.29 1.64 -0.06 0.70 -4.36 117.38 112.61 2fq2 n GLN 15 Ca -0.14 0.38 0.06 0.00 -2.00 0.00 0.00 57.00 55.29 2fq2 n GLN 15 Cb 0.76 -0.88 0.19 0.00 -4.06 0.00 0.00 30.24 26.25 2fq2 n GLN 15 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 2fq2 n LEU 16 N -2.05 2.59 0.00 1.69 4.77 0.64 -4.93 117.00 119.69 2fq2 n LEU 16 Ca 0.00 -1.30 0.00 0.00 -0.03 0.00 0.00 56.01 54.68 2fq2 n LEU 16 Cb 0.00 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 2fq2 n LEU 16 CO 0.00 0.51 0.00 -0.24 -1.33 0.00 0.00 177.39 176.33 2fq2 n SER 17 N 0.56 0.00 -3.63 -1.43 2.88 0.47 -4.61 113.62 107.86 2fq2 n SER 17 Ca 0.14 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.66 2fq2 n SER 17 Cb 0.47 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.87 2fq2 n SER 17 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2fq2 s VAL 18 N 0.00 -0.03 -0.07 2.46 -7.23 -1.23 -4.09 120.40 110.21 2fq2 s VAL 18 Ca 0.00 0.00 0.03 0.00 -1.81 0.00 0.00 61.98 60.20 2fq2 s VAL 18 Cb 0.00 -1.00 0.09 0.00 0.56 0.00 0.00 36.38 36.03 2fq2 s VAL 18 CO 0.00 0.00 0.69 -1.84 -0.31 0.00 0.00 175.10 173.64 2fq2 n GLU 19 N 3.75 0.30 0.13 4.82 0.28 -1.26 -4.97 120.64 123.69 2fq2 n GLU 19 Ca -0.18 -0.46 0.12 0.00 -0.16 0.00 0.00 57.16 56.48 2fq2 n GLU 19 Cb 0.57 0.33 0.47 0.00 1.43 0.00 0.00 31.44 34.25 2fq2 n GLU 19 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 2fq2 n GLU 20 N -0.34 0.23 0.00 3.44 0.28 -1.26 -2.39 120.64 120.60 2fq2 n GLU 20 Ca -0.09 0.37 0.12 0.00 -0.16 0.00 0.00 57.16 57.40 2fq2 n GLU 20 Cb 0.55 -1.87 0.64 0.00 1.43 0.00 0.00 31.44 32.19 2fq2 n GLU 20 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2fq2 n ASP 21 N -2.29 0.00 0.00 -1.84 8.00 -1.26 -2.91 116.55 116.25 2fq2 n ASP 21 Ca 0.03 -0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.30 2fq2 n ASP 21 Cb 0.29 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 2fq2 n ASP 21 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 2fq2 n LYS 22 N -1.22 0.74 0.08 -1.24 -0.00 -1.00 -4.78 118.16 110.73 2fq2 n LYS 22 Ca 0.13 -0.71 -0.12 0.00 -0.00 0.00 0.00 58.31 57.62 2fq2 n LYS 22 Cb 0.17 -0.66 -0.13 0.00 -0.00 0.00 0.00 35.03 34.40 2fq2 n LYS 22 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 2fq2 h ILE 23 N 1.79 1.56 -0.71 0.58 1.08 -1.39 -3.30 117.51 117.11 2fq2 h ILE 23 Ca 0.00 -3.20 -0.46 0.00 -0.39 0.00 0.00 64.86 60.80 2fq2 h ILE 23 Cb 0.75 2.87 -0.19 0.00 -3.07 0.00 0.00 36.82 37.18 2fq2 h ILE 23 CO 0.00 0.91 0.59 0.00 -0.69 0.00 0.00 178.15 178.96 2fq2 n GLN 24 N -3.42 2.15 0.29 2.37 0.00 -1.26 -4.50 117.38 113.02 2fq2 n GLN 24 Ca -0.05 -2.23 0.18 0.00 0.00 0.00 0.00 57.00 54.90 2fq2 n GLN 24 Cb 0.99 -1.88 0.84 0.00 0.00 0.00 0.00 30.24 30.19 2fq2 n GLN 24 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.06 177.58 2fq2 h MET 25 N 1.76 0.00 -0.56 2.61 2.86 -1.90 -3.46 114.93 116.24 2fq2 h MET 25 Ca 0.41 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.81 2fq2 h MET 25 Cb 0.85 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.41 2fq2 h MET 25 CO 1.06 0.02 -0.22 -1.71 1.06 0.00 0.00 176.91 177.13 2fq2 n ASN 26 N -3.16 -5.27 0.00 1.22 2.85 -1.26 -4.80 115.26 104.83 2fq2 n ASN 26 Ca -0.01 0.29 0.00 0.00 -0.11 0.00 0.00 54.58 54.76 2fq2 n ASN 26 Cb 0.23 -3.82 0.00 0.00 1.24 0.00 0.00 39.78 37.44 2fq2 n ASN 26 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2fq2 n SER 27 N -0.86 0.00 -3.83 1.20 7.64 -1.26 -4.64 113.62 111.87 2fq2 n SER 27 Ca -0.12 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.67 2fq2 n SER 27 Cb 0.53 -0.01 -0.06 0.00 -1.01 0.00 0.00 64.21 63.67 2fq2 n SER 27 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2fq2 s ASN 28 N -0.14 -0.08 -0.21 6.43 0.01 -0.94 -3.97 114.94 116.03 2fq2 s ASN 28 Ca 0.00 -0.63 0.14 0.00 -0.71 0.00 0.00 52.86 51.66 2fq2 s ASN 28 Cb 0.00 0.47 -0.23 0.00 0.41 0.00 0.00 41.25 41.90 2fq2 s ASN 28 CO 0.00 -0.91 0.01 0.49 -1.51 0.00 0.00 177.10 175.18 2fq2 n PHE 29 N -0.23 0.00 -0.13 2.20 3.01 -1.18 -3.82 117.46 117.32 2fq2 n PHE 29 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.35 2fq2 n PHE 29 Cb 0.63 -0.98 0.00 0.00 -0.01 0.00 0.00 39.48 39.12 2fq2 n PHE 29 CO 0.00 0.00 0.00 -2.37 1.01 0.00 0.00 176.76 175.40 2fq2 n THR 30 N -2.84 0.59 0.00 4.37 5.66 -1.26 -4.11 114.28 116.69 2fq2 n THR 30 Ca -0.35 -0.73 0.00 0.00 -3.05 0.00 0.00 64.05 59.92 2fq2 n THR 30 Cb 1.11 0.74 0.00 0.00 -1.55 0.00 0.00 70.33 70.64 2fq2 n THR 30 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2fq2 n LYS 31 N -0.30 2.40 0.07 1.09 5.02 -1.26 -3.72 118.16 121.46 2fq2 n LYS 31 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 2fq2 n LYS 31 Cb 0.20 -0.98 -0.13 0.00 -0.02 0.00 0.00 35.03 34.10 2fq2 n LYS 31 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 2fq2 h ASP 32 N 0.00 0.20 0.00 4.39 3.58 -1.85 -3.39 116.42 119.35 2fq2 h ASP 32 Ca 0.00 -0.24 -0.03 0.00 0.42 0.00 0.00 57.03 57.18 2fq2 h ASP 32 Cb 0.96 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.94 2fq2 h ASP 32 CO 0.00 1.19 -1.12 0.00 -2.88 0.00 0.00 179.24 176.43 2fq2 n LEU 33 N -3.40 0.55 -3.77 2.28 -0.00 -1.26 -4.98 117.00 106.42 2fq2 n LEU 33 Ca -0.07 -0.00 -0.25 0.00 -0.00 0.00 0.00 56.01 55.69 2fq2 n LEU 33 Cb 0.99 0.02 0.02 0.00 -0.00 0.00 0.00 43.42 44.45 2fq2 n LEU 33 CO 0.50 0.13 -0.12 0.61 -0.00 0.00 0.00 177.39 178.50 2fq2 n GLY 34 N 2.98 -0.46 0.00 1.47 0.00 -1.24 -4.94 105.19 103.01 2fq2 n GLY 34 Ca -0.03 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2fq2 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fq2 n ALA 35 N -4.26 -0.17 -3.28 4.61 0.00 -1.26 -4.96 120.51 111.19 2fq2 n ALA 35 Ca -0.25 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.22 2fq2 n ALA 35 Cb 0.66 0.01 -0.04 0.00 0.00 0.00 0.00 19.45 20.07 2fq2 n ALA 35 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2fq2 s ASP 36 N -2.02 -0.18 0.33 0.00 1.11 -1.26 -5.05 116.67 109.61 2fq2 s ASP 36 Ca 0.00 0.25 0.09 0.00 0.18 0.00 0.00 52.55 53.07 2fq2 s ASP 36 Cb 0.00 1.19 0.99 0.00 1.07 0.00 0.00 42.92 46.17 2fq2 s ASP 36 CO 0.00 -0.04 1.56 -1.54 1.18 0.00 0.00 175.17 176.34 2fq2 n SER 37 N 4.47 0.06 0.03 0.27 3.41 -1.26 -0.40 113.62 120.21 2fq2 n SER 37 Ca -0.08 1.68 -0.11 0.00 -0.26 0.00 0.00 58.87 60.10 2fq2 n SER 37 Cb 0.55 -0.69 -0.05 0.00 -0.26 0.00 0.00 64.21 63.76 2fq2 n SER 37 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2fq2 h LEU 38 N 0.00 -0.17 -0.04 1.04 4.07 -1.97 0.26 115.31 118.50 2fq2 h LEU 38 Ca 0.70 0.03 -0.02 0.00 0.08 0.00 0.00 57.88 58.67 2fq2 h LEU 38 Cb 1.63 0.08 -0.00 0.00 1.08 0.00 0.00 40.66 43.45 2fq2 h LEU 38 CO -0.87 -0.08 -0.04 0.44 -1.08 0.00 0.00 178.44 176.81 2fq2 h ASP 39 N -0.08 0.11 -0.08 -0.43 3.32 -1.14 -1.05 116.42 117.07 2fq2 h ASP 39 Ca 0.04 -0.49 0.04 0.00 0.02 0.00 0.00 57.03 56.64 2fq2 h ASP 39 Cb 0.13 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.60 2fq2 h ASP 39 CO -0.09 0.58 -0.20 -0.07 -1.72 0.00 0.00 179.24 177.73 2fq2 h LEU 40 N -0.36 -0.62 -1.59 1.55 -0.00 -0.75 0.28 115.31 113.83 2fq2 h LEU 40 Ca 0.01 0.10 -0.04 0.00 -0.00 0.00 0.00 57.88 57.94 2fq2 h LEU 40 Cb 0.55 0.27 -0.01 0.00 -0.00 0.00 0.00 40.66 41.48 2fq2 h LEU 40 CO 0.01 -0.26 -0.21 0.58 -0.00 0.00 0.00 178.44 178.56 2fq2 h VAL 41 N -0.28 0.79 0.11 1.22 2.07 -0.54 -2.41 116.25 117.20 2fq2 h VAL 41 Ca 0.08 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 2fq2 h VAL 41 Cb 0.40 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 2fq2 h VAL 41 CO -0.25 0.21 -0.05 -0.33 0.02 0.00 0.00 177.57 177.17 2fq2 h GLU 42 N 0.00 -0.14 -1.00 1.57 5.08 0.21 -2.32 114.58 117.98 2fq2 h GLU 42 Ca -0.00 0.01 0.26 0.00 -1.00 0.00 0.00 59.36 58.63 2fq2 h GLU 42 Cb 0.49 0.03 -0.13 0.00 0.50 0.00 0.00 28.75 29.64 2fq2 h GLU 42 CO 0.03 -0.09 0.57 1.37 -1.00 0.00 0.00 179.01 179.89 2fq2 h LEU 43 N -0.38 0.61 -0.01 1.33 8.10 -0.56 0.21 115.31 124.61 2fq2 h LEU 43 Ca -0.01 0.15 -0.00 0.00 0.11 0.00 0.00 57.88 58.13 2fq2 h LEU 43 Cb 0.11 0.07 -0.00 0.00 -0.44 0.00 0.00 40.66 40.40 2fq2 h LEU 43 CO 0.02 0.04 0.00 0.40 -4.11 0.00 0.00 178.44 174.79 2fq2 h ILE 44 N 0.50 1.15 -0.92 0.15 2.04 -1.53 -2.02 117.51 116.89 2fq2 h ILE 44 Ca 0.66 -0.44 0.25 0.00 1.00 0.00 0.00 64.86 66.32 2fq2 h ILE 44 Cb 1.33 1.44 -0.05 0.00 -0.74 0.00 0.00 36.82 38.80 2fq2 h ILE 44 CO -0.51 0.12 0.64 0.00 0.00 0.00 0.00 178.15 178.39 2fq2 h MET 45 N -0.17 0.14 0.07 2.37 -0.00 -0.38 0.77 114.93 117.73 2fq2 h MET 45 Ca 0.00 -0.01 -0.27 0.00 -0.00 0.00 0.00 59.70 59.43 2fq2 h MET 45 Cb 0.19 -0.03 0.02 0.00 -0.00 0.00 0.00 31.60 31.78 2fq2 h MET 45 CO -0.00 0.09 -1.09 0.00 -0.00 0.00 0.00 176.91 175.92 2fq2 h ALA 46 N 1.57 0.04 -0.30 -3.00 0.00 -1.06 -2.28 119.26 114.23 2fq2 h ALA 46 Ca 0.46 -0.72 0.06 0.00 0.00 0.00 0.00 54.91 54.71 2fq2 h ALA 46 Cb 1.56 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 19.37 2fq2 h ALA 46 CO -0.08 0.63 -0.11 1.25 0.00 0.00 0.00 179.25 180.95 2fq2 h LEU 47 N 0.24 -0.37 -0.24 0.00 6.46 -0.13 -1.49 115.31 119.78 2fq2 h LEU 47 Ca -0.16 0.10 -0.13 0.00 -0.12 0.00 0.00 57.88 57.58 2fq2 h LEU 47 Cb 1.76 0.22 -0.00 0.00 -0.73 0.00 0.00 40.66 41.92 2fq2 h LEU 47 CO 0.21 -0.14 -0.34 1.05 -0.62 0.00 0.00 178.44 178.61 2fq2 h GLU 48 N -0.04 0.66 -0.89 1.25 -0.00 -1.55 -2.29 114.58 111.71 2fq2 h GLU 48 Ca 0.15 -0.38 0.25 0.00 -0.00 0.00 0.00 59.36 59.38 2fq2 h GLU 48 Cb 0.27 0.03 -0.04 0.00 -0.00 0.00 0.00 28.75 29.01 2fq2 h GLU 48 CO -0.34 1.00 0.63 1.49 -0.00 0.00 0.00 179.01 181.79 2fq2 h GLU 49 N 0.37 0.06 0.13 1.06 4.81 -0.92 0.29 114.58 120.39 2fq2 h GLU 49 Ca 0.03 -0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.97 2fq2 h GLU 49 Cb 0.92 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.29 2fq2 h GLU 49 CO 0.08 0.04 -1.42 -0.22 -0.73 0.00 0.00 179.01 176.76 2fq2 h LYS 50 N 0.07 0.28 0.00 1.92 1.63 -1.16 -3.31 116.57 116.00 2fq2 h LYS 50 Ca 0.43 -0.48 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 2fq2 h LYS 50 Cb 1.61 0.18 0.00 0.00 -0.60 0.00 0.00 32.23 33.42 2fq2 h LYS 50 CO -0.04 1.23 0.00 0.74 -3.45 0.00 0.00 179.45 177.93 2fq2 h PHE 51 N -0.23 0.00 -4.18 1.91 0.04 -0.54 -3.46 116.94 110.47 2fq2 h PHE 51 Ca -0.30 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.25 2fq2 h PHE 51 Cb 1.82 0.00 0.10 0.00 2.20 0.00 0.00 35.95 40.07 2fq2 h PHE 51 CO 0.13 0.00 -0.46 -1.71 -0.60 0.00 0.00 178.31 175.67 2fq2 n ASN 52 N -2.46 -3.14 -4.77 2.17 2.85 0.86 -4.95 115.26 105.83 2fq2 n ASN 52 Ca 0.01 -0.37 -0.31 0.00 -0.11 0.00 0.00 54.58 53.80 2fq2 n ASN 52 Cb 0.19 -3.38 -0.07 0.00 1.24 0.00 0.00 39.78 37.76 2fq2 n ASN 52 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 2fq2 s VAL 53 N -3.22 1.36 -0.47 3.44 -7.23 -1.13 -5.07 120.40 108.08 2fq2 s VAL 53 Ca 0.15 -1.90 0.03 0.00 -1.81 0.00 0.00 61.98 58.45 2fq2 s VAL 53 Cb -0.07 -2.27 0.13 0.00 0.56 0.00 0.00 36.38 34.73 2fq2 s VAL 53 CO 0.46 0.00 0.24 -0.89 -0.31 0.00 0.00 175.10 174.59 2fq2 s THR 54 N -2.83 2.07 0.16 5.32 2.01 -1.26 -4.76 115.64 116.35 2fq2 s THR 54 Ca 0.14 -2.93 0.03 0.00 0.31 0.00 0.00 61.69 59.25 2fq2 s THR 54 Cb 0.02 -2.45 -0.05 0.00 0.01 0.00 0.00 72.50 70.03 2fq2 s THR 54 CO 0.08 -0.82 -0.05 -0.63 -0.69 0.00 0.00 174.62 172.51 2fq2 s ILE 55 N 0.07 0.95 0.01 1.82 1.09 -1.26 -5.02 121.20 118.86 2fq2 s ILE 55 Ca 0.17 -2.02 0.00 0.00 -1.10 0.00 0.00 60.65 57.70 2fq2 s ILE 55 Cb -0.25 -1.99 0.00 0.00 -1.06 0.00 0.00 42.46 39.16 2fq2 s ILE 55 CO -0.01 -0.62 0.00 -1.20 -0.10 0.00 0.00 174.94 173.01 2fq2 n SER 56 N -0.23 -0.07 -0.11 3.58 7.64 -1.26 -4.90 113.62 118.28 2fq2 n SER 56 Ca -0.09 0.43 0.15 0.00 1.01 0.00 0.00 58.87 60.37 2fq2 n SER 56 Cb 0.62 0.48 0.80 0.00 -1.01 0.00 0.00 64.21 65.09 2fq2 n SER 56 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2fq2 n ASP 57 N -2.85 0.33 -0.02 6.43 9.92 -1.26 -3.47 116.55 125.63 2fq2 n ASP 57 Ca 0.00 -1.17 -0.03 0.00 -0.53 0.00 0.00 54.79 53.06 2fq2 n ASP 57 Cb 0.00 -0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.46 2fq2 n ASP 57 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2fq2 n GLN 58 N -0.71 0.08 0.31 -1.24 1.13 -1.26 -4.63 117.38 111.06 2fq2 n GLN 58 Ca 0.21 0.03 0.21 0.00 -1.94 0.00 0.00 57.00 55.51 2fq2 n GLN 58 Cb 0.16 -0.85 1.11 0.00 0.11 0.00 0.00 30.24 30.77 2fq2 n GLN 58 CO 0.00 0.00 0.00 0.38 -1.44 0.00 0.00 177.06 176.00 2fq2 h ASP 59 N -0.06 0.00 0.53 1.08 3.04 -1.91 0.72 116.42 119.82 2fq2 h ASP 59 Ca -0.08 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.71 2fq2 h ASP 59 Cb 1.10 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.39 2fq2 h ASP 59 CO -0.03 0.00 0.00 0.00 -2.04 0.00 0.00 179.24 177.17 2fq2 n ALA 60 N -2.02 1.65 -2.05 4.15 0.00 -1.23 -3.25 120.51 117.76 2fq2 n ALA 60 Ca -0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 53.44 53.38 2fq2 n ALA 60 Cb 0.08 -1.26 -0.01 0.00 0.00 0.00 0.00 19.45 18.27 2fq2 n ALA 60 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2fq2 n LEU 61 N -1.62 -0.01 -0.02 0.00 -0.00 0.04 -4.83 117.00 110.57 2fq2 n LEU 61 Ca 0.03 -1.21 0.02 0.00 -0.00 0.00 0.00 56.01 54.86 2fq2 n LEU 61 Cb 0.18 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.52 2fq2 n LEU 61 CO 0.14 0.73 -0.67 0.29 -0.00 0.00 0.00 177.39 177.88 2fq2 n LYS 62 N 0.05 0.88 -0.02 1.47 5.02 -0.04 -4.58 118.16 120.93 2fq2 n LYS 62 Ca -0.02 -0.07 0.04 0.00 -2.02 0.00 0.00 58.31 56.24 2fq2 n LYS 62 Cb 0.66 -1.24 -0.15 0.00 -0.02 0.00 0.00 35.03 34.28 2fq2 n LYS 62 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2fq2 n ILE 63 N -1.98 0.52 -0.34 -0.18 -0.00 -1.24 -0.05 119.36 116.10 2fq2 n ILE 63 Ca -0.05 -0.62 0.23 0.00 -0.00 0.00 0.00 62.75 62.30 2fq2 n ILE 63 Cb 0.40 -0.21 0.46 0.00 -0.00 0.00 0.00 39.64 40.29 2fq2 n ILE 63 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 2fq2 h ASN 64 N 0.00 0.53 -3.59 4.38 -0.00 -1.83 -3.36 115.58 111.72 2fq2 h ASN 64 Ca -0.16 0.18 -0.64 0.00 -0.00 0.00 0.00 56.30 55.68 2fq2 h ASN 64 Cb 1.39 0.12 -0.20 0.00 -0.00 0.00 0.00 38.32 39.63 2fq2 h ASN 64 CO 0.01 -0.09 -0.59 0.42 -0.00 0.00 0.00 177.43 177.17 2fq2 s THR 65 N -5.69 4.57 0.52 6.14 -4.23 -1.25 -2.22 115.64 113.47 2fq2 s THR 65 Ca -0.10 -0.09 0.37 0.00 -1.18 0.00 0.00 61.69 60.68 2fq2 s THR 65 Cb 0.30 -3.12 0.56 0.00 1.34 0.00 0.00 72.50 71.58 2fq2 s THR 65 CO 0.79 0.36 1.74 0.58 -0.54 0.00 0.00 174.62 177.55 2fq2 h VAL 66 N 5.34 0.32 0.18 2.29 2.07 -1.83 0.22 116.25 124.84 2fq2 h VAL 66 Ca -0.37 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 2fq2 h VAL 66 Cb 1.18 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 2fq2 h VAL 66 CO 0.60 0.01 -0.09 -0.61 0.02 0.00 0.00 177.57 177.51 2fq2 h GLN 67 N 0.06 -0.23 -0.30 1.57 -0.00 -1.91 -2.67 115.11 111.63 2fq2 h GLN 67 Ca 0.67 0.02 -0.03 0.00 -0.00 0.00 0.00 58.65 59.30 2fq2 h GLN 67 Cb 2.50 0.05 -0.02 0.00 0.00 0.00 0.00 27.48 30.01 2fq2 h GLN 67 CO -0.08 0.17 0.05 -0.44 0.00 0.00 0.00 178.83 178.53 2fq2 h ASP 68 N -0.77 0.41 0.97 -0.69 5.19 -1.05 -2.06 116.42 118.40 2fq2 h ASP 68 Ca -0.02 -0.05 -0.05 0.00 -0.62 0.00 0.00 57.03 56.28 2fq2 h ASP 68 Cb 0.52 -0.10 0.01 0.00 0.18 0.00 0.00 39.33 39.93 2fq2 h ASP 68 CO 0.04 0.43 -0.46 0.00 -3.12 0.00 0.00 179.24 176.13 2fq2 h ALA 69 N 1.63 -1.30 -0.19 3.45 0.00 0.25 0.24 119.26 123.34 2fq2 h ALA 69 Ca 0.10 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 54.78 2fq2 h ALA 69 Cb 0.21 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2fq2 h ALA 69 CO -0.00 -1.21 0.14 -0.84 0.00 0.00 0.00 179.25 177.34 2fq2 h ILE 70 N -1.35 0.92 0.00 0.00 3.07 -1.40 0.93 117.51 119.68 2fq2 h ILE 70 Ca -0.13 -0.01 -0.02 0.00 1.55 0.00 0.00 64.86 66.25 2fq2 h ILE 70 Cb 0.99 0.89 -0.00 0.00 -0.27 0.00 0.00 36.82 38.43 2fq2 h ILE 70 CO 0.22 0.00 -0.08 -0.78 -1.05 0.00 0.00 178.15 176.47 2fq2 h ASP 71 N 0.02 0.00 0.63 2.16 3.58 -1.11 -2.38 116.42 119.32 2fq2 h ASP 71 Ca 0.09 0.00 -0.27 0.00 0.42 0.00 0.00 57.03 57.27 2fq2 h ASP 71 Cb 0.33 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.39 2fq2 h ASP 71 CO -0.00 0.08 -1.21 0.22 -2.88 0.00 0.00 179.24 175.45 2fq2 h TYR 72 N 0.00 0.48 0.00 0.28 3.20 0.20 -2.03 116.97 119.10 2fq2 h TYR 72 Ca -0.00 -0.34 -0.24 0.00 3.14 0.00 0.00 58.73 61.29 2fq2 h TYR 72 Cb 1.05 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 39.26 2fq2 h TYR 72 CO 0.00 1.26 -1.22 -0.84 -1.64 0.00 0.00 178.16 175.71 2fq2 h ILE 73 N 0.08 1.45 0.07 1.81 -0.00 -1.43 -2.67 117.51 116.81 2fq2 h ILE 73 Ca -0.12 -3.20 -0.24 0.00 -0.00 0.00 0.00 64.86 61.30 2fq2 h ILE 73 Cb 1.93 2.72 -0.01 0.00 -0.00 0.00 0.00 36.82 41.46 2fq2 h ILE 73 CO 0.20 0.83 -1.10 -0.33 -0.00 0.00 0.00 178.15 177.75 2fq2 h GLU 74 N 0.00 0.19 0.05 0.16 4.39 -1.51 -1.33 114.58 116.53 2fq2 h GLU 74 Ca -0.10 -0.29 -0.24 0.00 0.34 0.00 0.00 59.36 59.08 2fq2 h GLU 74 Cb 1.85 0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 30.60 2fq2 h GLU 74 CO 0.11 1.11 -1.05 1.57 -1.16 0.00 0.00 179.01 179.59 2fq2 h LYS 75 N 0.06 0.26 0.00 2.33 5.09 -1.46 -2.56 116.57 120.29 2fq2 h LYS 75 Ca -0.08 -0.35 0.00 0.00 0.09 0.00 0.00 60.65 60.31 2fq2 h LYS 75 Cb 1.82 0.12 0.00 0.00 0.10 0.00 0.00 32.23 34.26 2fq2 h LYS 75 CO 0.17 1.10 0.00 0.09 -2.09 0.00 0.00 179.45 178.72 2fq2 n ASN 76 N -3.60 0.00 -0.23 7.07 3.02 -1.01 -4.28 115.26 116.24 2fq2 n ASN 76 Ca -0.06 0.30 0.23 0.00 -0.03 0.00 0.00 54.58 55.02 2fq2 n ASN 76 Cb 0.91 -0.40 0.59 0.00 -0.61 0.00 0.00 39.78 40.27 2fq2 n ASN 76 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 2fq2 h ASN 77 N 0.00 0.26 -6.28 6.41 -0.26 -1.45 -3.45 115.58 110.81 2fq2 h ASN 77 Ca 0.00 0.03 -0.46 0.00 -0.56 0.00 0.00 56.30 55.31 2fq2 h ASN 77 Cb 0.00 -0.02 -0.01 0.00 -1.06 0.00 0.00 38.32 37.23 2fq2 h ASN 77 CO 0.00 0.09 -0.83 0.29 -1.06 0.00 0.00 177.43 175.92 2fq2 n LYS 78 N -4.43 -4.54 0.00 0.81 5.02 -0.96 -5.04 118.16 109.02 2fq2 n LYS 78 Ca 0.20 0.54 0.02 0.00 -2.02 0.00 0.00 58.31 57.05 2fq2 n LYS 78 Cb 0.81 -5.08 0.13 0.00 -0.02 0.00 0.00 35.03 30.87 2fq2 n LYS 78 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92