#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dqc s VAL 2 N 0.00 3.56 0.53 3.15 1.01 -1.26 -0.69 120.40 126.70 2dqc s VAL 2 Ca 0.00 -1.17 -0.19 0.00 0.00 0.00 0.00 61.98 60.63 2dqc s VAL 2 Cb 0.00 -3.01 -0.07 0.00 0.00 0.00 0.00 36.38 33.31 2dqc s VAL 2 CO 0.00 -0.13 1.05 -0.36 0.00 0.00 0.00 175.10 175.66 2dqc s PHE 3 N 1.37 2.96 0.49 5.22 0.40 0.01 -4.99 117.98 123.44 2dqc s PHE 3 Ca -0.02 1.55 -0.06 0.00 -0.60 0.00 0.00 56.93 57.80 2dqc s PHE 3 Cb -0.19 -3.07 -0.04 0.00 0.51 0.00 0.00 43.02 40.23 2dqc s PHE 3 CO 0.02 -1.00 0.80 0.20 0.70 0.00 0.00 175.22 175.94 2dqc s GLY 4 N -2.22 1.51 0.10 4.36 0.00 -1.26 -4.83 107.32 104.98 2dqc s GLY 4 Ca 0.67 -0.48 -0.30 0.00 0.00 0.00 0.00 44.72 44.61 2dqc s GLY 4 CO 0.26 -0.31 1.63 -0.09 0.00 0.00 0.00 173.10 174.59 2dqc h ARG 5 N 0.18 -0.62 -0.27 2.90 2.43 -1.96 -0.73 114.38 116.31 2dqc h ARG 5 Ca -0.47 0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 58.67 2dqc h ARG 5 Cb 1.20 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.88 2dqc h ARG 5 CO 0.62 -0.41 -0.17 0.00 -1.51 0.00 0.00 179.97 178.50 2dqc h GLU 7 N 0.43 0.90 -0.24 0.00 4.81 -1.88 -1.10 114.58 117.51 2dqc h GLU 7 Ca 0.08 -0.09 -0.18 0.00 -0.13 0.00 0.00 59.36 59.03 2dqc h GLU 7 Cb 0.55 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.74 2dqc h GLU 7 CO 0.04 0.66 -0.57 1.25 -0.73 0.00 0.00 179.01 179.66 2dqc h LEU 8 N 0.90 0.85 -0.57 1.64 5.85 -0.82 -2.07 115.31 121.08 2dqc h LEU 8 Ca 0.23 -0.46 0.03 0.00 0.84 0.00 0.00 57.88 58.52 2dqc h LEU 8 Cb 0.00 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 2dqc h LEU 8 CO -0.04 1.23 0.34 0.00 -0.34 0.00 0.00 178.44 179.63 2dqc h ALA 9 N 0.78 0.74 -0.48 1.25 0.00 -0.90 0.17 119.26 120.82 2dqc h ALA 9 Ca 0.01 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2dqc h ALA 9 Cb 1.15 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2dqc h ALA 9 CO 0.12 0.06 0.07 0.00 0.00 0.00 0.00 179.25 179.50 2dqc h ALA 10 N 1.26 0.64 -0.48 0.00 0.00 -1.15 -1.83 119.26 117.71 2dqc h ALA 10 Ca 0.24 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2dqc h ALA 10 Cb 0.05 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2dqc h ALA 10 CO -0.11 0.38 0.19 0.00 0.00 0.00 0.00 179.25 179.71 2dqc h ALA 11 N 0.96 0.63 -0.04 0.00 0.00 -0.85 -1.42 119.26 118.55 2dqc h ALA 11 Ca 0.15 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2dqc h ALA 11 Cb 0.40 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2dqc h ALA 11 CO 0.01 0.23 -0.32 0.52 0.00 0.00 0.00 179.25 179.69 2dqc h MET 12 N 0.64 0.07 -0.33 0.00 2.86 -0.58 0.21 114.93 117.79 2dqc h MET 12 Ca 0.16 -0.02 -0.16 0.00 -2.06 0.00 0.00 59.70 57.62 2dqc h MET 12 Cb 0.19 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 2dqc h MET 12 CO -0.01 0.38 -0.42 -0.22 1.06 0.00 0.00 176.91 177.70 2dqc h LYS 13 N 0.06 0.84 0.00 1.72 3.64 -1.00 -0.49 116.57 121.35 2dqc h LYS 13 Ca 0.01 -0.46 -0.08 0.00 -1.27 0.00 0.00 60.65 58.85 2dqc h LYS 13 Cb 0.60 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 2dqc h LYS 13 CO 0.04 1.10 -0.38 -0.09 -2.27 0.00 0.00 179.45 177.85 2dqc h ARG 14 N 0.68 0.00 -0.73 1.90 2.43 -0.66 -2.42 114.38 115.57 2dqc h ARG 14 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2dqc h ARG 14 Cb 1.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.55 2dqc h ARG 14 CO 0.10 0.38 0.00 0.72 -1.51 0.00 0.00 179.97 179.66 2dqc n HIS 15 N -3.94 1.01 -2.30 2.20 8.25 0.01 -4.93 115.22 115.52 2dqc n HIS 15 Ca -0.02 -0.36 -0.14 0.00 -0.26 0.00 0.00 57.72 56.94 2dqc n HIS 15 Cb 0.43 -0.27 -0.01 0.00 1.12 0.00 0.00 29.99 31.26 2dqc n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dqc n GLY 16 N 0.44 -0.22 0.73 -1.41 0.00 -0.91 -4.93 105.19 98.89 2dqc n GLY 16 Ca 0.14 -0.28 0.13 0.00 0.00 0.00 0.00 46.02 46.01 2dqc n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dqc n LEU 17 N -2.09 2.29 -4.59 0.99 4.77 -0.23 -4.49 117.00 113.64 2dqc n LEU 17 Ca -0.16 -0.76 -0.43 0.00 -0.03 0.00 0.00 56.01 54.62 2dqc n LEU 17 Cb 0.63 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.70 2dqc n LEU 17 CO 0.20 0.38 1.07 -0.62 -1.33 0.00 0.00 177.39 177.10 2dqc s ASP 18 N -2.00 6.54 -0.72 -1.43 -1.08 -1.26 -3.43 116.67 113.29 2dqc s ASP 18 Ca 0.33 0.41 -0.02 0.00 -0.52 0.00 0.00 52.55 52.76 2dqc s ASP 18 Cb 0.20 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 39.12 2dqc s ASP 18 CO 0.32 -1.35 0.20 -3.20 0.52 0.00 0.00 175.17 171.66 2dqc n ASN 19 N 8.17 -3.49 -4.68 -0.34 5.15 -0.73 -4.87 115.26 114.46 2dqc n ASN 19 Ca 0.12 -0.10 -0.42 0.00 -0.60 0.00 0.00 54.58 53.58 2dqc n ASN 19 Cb 0.49 -2.49 -0.03 0.00 -0.53 0.00 0.00 39.78 37.22 2dqc n ASN 19 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 2dqc s TYR 20 N -2.72 3.46 -1.61 1.20 5.04 -1.13 -3.91 117.35 117.68 2dqc s TYR 20 Ca 0.10 1.51 -0.12 0.00 -2.44 0.00 0.00 57.07 56.12 2dqc s TYR 20 Cb -0.04 -3.17 0.10 0.00 0.35 0.00 0.00 41.96 39.19 2dqc s TYR 20 CO 0.12 -0.28 0.60 0.54 -1.34 0.00 0.00 175.55 175.19 2dqc n ARG 21 N 5.32 -2.88 -0.94 4.97 5.12 -1.26 -1.56 116.66 125.44 2dqc n ARG 21 Ca 0.09 0.34 0.00 0.00 -1.93 0.00 0.00 57.85 56.35 2dqc n ARG 21 Cb 0.48 -4.77 0.00 0.00 -1.16 0.00 0.00 32.46 27.01 2dqc n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2dqc n GLY 22 N -1.67 0.71 3.32 -0.13 0.00 -1.25 -5.03 105.19 101.15 2dqc n GLY 22 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 2dqc n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dqc s TYR 23 N -2.76 3.11 0.73 1.61 2.02 -0.60 -5.00 117.35 116.46 2dqc s TYR 23 Ca 0.00 -1.03 -0.14 0.00 -0.37 0.00 0.00 57.07 55.53 2dqc s TYR 23 Cb 0.00 -2.21 0.04 0.00 -0.40 0.00 0.00 41.96 39.39 2dqc s TYR 23 CO 0.00 -0.58 1.16 -1.54 -1.57 0.00 0.00 175.55 173.02 2dqc s SER 24 N 1.48 4.37 0.30 2.29 1.04 -1.26 -1.78 113.70 120.13 2dqc s SER 24 Ca 0.03 2.17 0.06 0.00 0.48 0.00 0.00 55.95 58.69 2dqc s SER 24 Cb -0.17 -2.57 0.78 0.00 0.10 0.00 0.00 66.02 64.16 2dqc s SER 24 CO 0.01 -2.14 1.74 0.25 0.98 0.00 0.00 173.24 174.08 2dqc h LEU 25 N -0.45 0.63 -1.76 2.42 5.85 -1.90 -1.37 115.31 118.73 2dqc h LEU 25 Ca -0.46 0.12 0.15 0.00 0.84 0.00 0.00 57.88 58.53 2dqc h LEU 25 Cb 1.27 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 42.29 2dqc h LEU 25 CO 0.50 0.14 0.45 1.23 -0.34 0.00 0.00 178.44 180.43 2dqc h GLY 26 N 0.60 0.40 1.01 3.75 0.00 -1.90 -1.26 103.07 105.66 2dqc h GLY 26 Ca 0.59 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.83 2dqc h GLY 26 CO -0.45 0.04 0.45 3.43 0.00 0.00 0.00 176.54 180.00 2dqc h ASN 27 N 0.24 0.78 -0.12 0.19 2.35 -1.46 -0.48 115.58 117.07 2dqc h ASN 27 Ca 0.32 -0.02 -0.18 0.00 -0.55 0.00 0.00 56.30 55.87 2dqc h ASN 27 Cb 0.92 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 39.10 2dqc h ASN 27 CO -0.07 0.56 -0.56 -0.50 -1.65 0.00 0.00 177.43 175.22 2dqc h TRP 28 N 0.91 0.90 -0.21 1.19 4.06 -1.36 -0.61 115.95 120.84 2dqc h TRP 28 Ca 0.25 -0.32 -0.08 0.00 2.06 0.00 0.00 58.89 60.79 2dqc h TRP 28 Cb -0.10 -0.17 -0.00 0.00 -1.00 0.00 0.00 29.16 27.88 2dqc h TRP 28 CO -0.03 1.11 -0.20 0.28 -3.56 0.00 0.00 178.44 176.04 2dqc h VAL 29 N 0.54 1.33 -0.62 1.49 2.07 -1.36 -1.65 116.25 118.06 2dqc h VAL 29 Ca 0.01 -1.36 0.00 0.00 0.82 0.00 0.00 66.70 66.18 2dqc h VAL 29 Cb 1.14 1.74 -0.03 0.00 -1.52 0.00 0.00 31.29 32.62 2dqc h VAL 29 CO 0.11 0.41 0.40 0.00 0.02 0.00 0.00 177.57 178.52 2dqc h ALA 31 N 1.22 0.35 -0.86 0.00 0.00 -0.99 -2.06 119.26 116.91 2dqc h ALA 31 Ca 0.23 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2dqc h ALA 31 Cb -0.08 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 2dqc h ALA 31 CO -0.05 -0.25 0.52 0.00 0.00 0.00 0.00 179.25 179.48 2dqc h ALA 32 N 1.15 1.29 -0.03 0.00 0.00 -0.97 0.14 119.26 120.84 2dqc h ALA 32 Ca 0.12 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2dqc h ALA 32 Cb 0.04 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2dqc h ALA 32 CO -0.08 0.61 -0.04 -0.22 0.00 0.00 0.00 179.25 179.51 2dqc h LYS 33 N 1.19 -0.06 0.00 0.00 1.63 -0.54 -1.16 116.57 117.63 2dqc h LYS 33 Ca 0.31 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.11 2dqc h LYS 33 Cb -0.05 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.59 2dqc h LYS 33 CO -0.06 -0.04 -0.54 0.74 -3.45 0.00 0.00 179.45 176.10 2dqc h PHE 34 N -0.07 0.00 0.16 1.91 0.04 -1.19 -0.89 116.94 116.90 2dqc h PHE 34 Ca 0.03 0.00 -0.29 0.00 2.80 0.00 0.00 57.97 60.51 2dqc h PHE 34 Cb 0.11 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.27 2dqc h PHE 34 CO -0.13 0.00 -1.45 0.93 -0.60 0.00 0.00 178.31 177.06 2dqc h GLU 35 N 0.00 0.33 0.00 1.51 4.39 -0.68 -3.43 114.58 116.69 2dqc h GLU 35 Ca 0.00 -0.56 0.00 0.00 0.34 0.00 0.00 59.36 59.14 2dqc h GLU 35 Cb 0.90 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.76 2dqc h GLU 35 CO 0.00 1.27 0.00 -1.13 -1.16 0.00 0.00 179.01 177.99 2dqc n SER 36 N -3.83 0.27 -3.53 1.42 3.41 -0.52 -4.80 113.62 106.04 2dqc n SER 36 Ca -0.23 -1.01 -0.24 0.00 -0.26 0.00 0.00 58.87 57.13 2dqc n SER 36 Cb 0.97 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.98 2dqc n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2dqc n ASN 37 N -0.00 -6.23 -0.95 4.04 5.15 -0.34 -2.05 115.26 114.87 2dqc n ASN 37 Ca 0.00 -0.51 -0.12 0.00 -0.60 0.00 0.00 54.58 53.34 2dqc n ASN 37 Cb 0.19 -4.93 -0.05 0.00 -0.53 0.00 0.00 39.78 34.46 2dqc n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2dqc n PHE 38 N -4.91 0.00 -3.32 1.20 3.72 -1.11 -4.84 117.46 108.21 2dqc n PHE 38 Ca -0.01 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.97 2dqc n PHE 38 Cb 0.57 -2.55 -0.09 0.00 -0.94 0.00 0.00 39.48 36.47 2dqc n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2dqc s ASN 39 N -2.61 6.20 0.51 4.37 2.47 -0.87 -0.80 114.94 124.20 2dqc s ASN 39 Ca 0.00 -0.58 0.34 0.00 0.42 0.00 0.00 52.86 53.04 2dqc s ASN 39 Cb 0.00 -2.23 1.68 0.00 -1.45 0.00 0.00 41.25 39.25 2dqc s ASN 39 CO 0.00 -0.56 2.04 0.71 -3.72 0.00 0.00 177.10 175.57 2dqc h THR 40 N 5.71 0.00 -0.15 -5.21 1.35 -1.23 -2.49 112.91 110.88 2dqc h THR 40 Ca -0.27 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 2dqc h THR 40 Cb 1.11 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 2dqc h THR 40 CO 0.79 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 176.06 2dqc n GLN 41 N -2.82 2.34 -1.74 4.72 1.13 -1.26 -3.95 117.38 115.79 2dqc n GLN 41 Ca -0.01 -1.97 -0.42 0.00 -1.94 0.00 0.00 57.00 52.66 2dqc n GLN 41 Cb 0.16 -1.48 -0.01 0.00 0.11 0.00 0.00 30.24 29.02 2dqc n GLN 41 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2dqc n ALA 42 N 1.30 2.15 -3.09 -1.58 0.00 -0.94 -4.77 120.51 113.59 2dqc n ALA 42 Ca 0.16 0.36 -0.11 0.00 0.00 0.00 0.00 53.44 53.85 2dqc n ALA 42 Cb 0.58 -2.40 -0.11 0.00 0.00 0.00 0.00 19.45 17.53 2dqc n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2dqc s THR 43 N -0.63 0.06 -0.13 0.00 -4.23 -1.26 -0.62 115.64 108.83 2dqc s THR 43 Ca 0.59 -0.50 -0.04 0.00 -1.18 0.00 0.00 61.69 60.55 2dqc s THR 43 Cb -0.51 -0.38 0.07 0.00 1.34 0.00 0.00 72.50 73.02 2dqc s THR 43 CO 0.57 -0.28 0.19 0.21 -0.54 0.00 0.00 174.62 174.77 2dqc s ASN 44 N -0.98 0.99 0.04 3.99 2.47 -0.70 -4.96 114.94 115.79 2dqc s ASN 44 Ca -0.11 0.14 -0.30 0.00 0.42 0.00 0.00 52.86 53.01 2dqc s ASN 44 Cb -0.06 0.34 -0.05 0.00 -1.45 0.00 0.00 41.25 40.04 2dqc s ASN 44 CO 0.01 -0.28 1.10 -0.60 -3.72 0.00 0.00 177.10 173.61 2dqc s ARG 45 N 2.31 4.50 0.21 0.43 3.52 -1.26 -0.94 118.95 127.72 2dqc s ARG 45 Ca 0.04 1.61 0.05 0.00 -0.13 0.00 0.00 55.73 57.30 2dqc s ARG 45 Cb -0.13 -3.39 -0.03 0.00 -1.56 0.00 0.00 34.95 29.83 2dqc s ARG 45 CO -0.08 -0.14 0.30 -0.80 -0.81 0.00 0.00 175.30 173.76 2dqc s ASN 46 N 0.96 6.13 0.38 -2.12 0.01 0.14 -4.98 114.94 115.46 2dqc s ASN 46 Ca 0.55 0.03 0.06 0.00 -0.71 0.00 0.00 52.86 52.79 2dqc s ASN 46 Cb -0.26 -1.76 0.76 0.00 0.41 0.00 0.00 41.25 40.40 2dqc s ASN 46 CO 0.29 -0.02 2.00 0.71 -1.51 0.00 0.00 177.10 178.57 2dqc h THR 47 N 1.41 1.08 0.00 1.60 1.35 -1.96 -1.88 112.91 114.50 2dqc h THR 47 Ca -0.50 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.11 2dqc h THR 47 Cb 1.22 0.30 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 2dqc h THR 47 CO 0.63 0.13 0.00 -0.90 -0.25 0.00 0.00 175.52 175.13 2dqc n ASP 48 N -4.46 0.08 0.00 5.36 5.75 -1.26 -4.79 116.55 117.23 2dqc n ASP 48 Ca 0.07 -1.26 0.00 0.00 -0.01 0.00 0.00 54.79 53.59 2dqc n ASP 48 Cb 0.14 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 2dqc n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dqc n GLY 49 N 0.14 2.25 3.91 6.12 0.00 -0.71 -4.77 105.19 112.13 2dqc n GLY 49 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 2dqc n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dqc s SER 50 N -2.60 4.86 0.00 1.61 1.04 -1.25 -4.58 113.70 112.78 2dqc s SER 50 Ca 0.00 0.72 0.01 0.00 0.48 0.00 0.00 55.95 57.16 2dqc s SER 50 Cb 0.00 -1.36 -0.01 0.00 0.10 0.00 0.00 66.02 64.75 2dqc s SER 50 CO 0.00 -1.63 -0.03 -0.89 0.98 0.00 0.00 173.24 171.67 2dqc s THR 51 N -3.37 0.25 -0.12 2.02 2.01 -1.26 0.28 115.64 115.44 2dqc s THR 51 Ca 0.60 -0.25 -0.14 0.00 0.31 0.00 0.00 61.69 62.21 2dqc s THR 51 Cb -0.11 -0.23 -0.05 0.00 0.01 0.00 0.00 72.50 72.12 2dqc s THR 51 CO 0.48 -0.00 0.33 -1.81 -0.69 0.00 0.00 174.62 172.92 2dqc s ASP 52 N -0.27 6.53 -0.02 3.53 1.01 -0.12 -1.10 116.67 126.24 2dqc s ASP 52 Ca -0.01 0.63 0.08 0.00 0.71 0.00 0.00 52.55 53.96 2dqc s ASP 52 Cb -0.02 -2.20 -0.02 0.00 1.01 0.00 0.00 42.92 41.68 2dqc s ASP 52 CO -0.00 0.14 -0.25 -0.31 0.21 0.00 0.00 175.17 174.96 2dqc s TYR 53 N 0.14 2.35 0.01 4.23 1.51 0.15 -1.72 117.35 124.01 2dqc s TYR 53 Ca 0.19 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.83 2dqc s TYR 53 Cb -0.14 -1.50 0.00 0.00 -0.11 0.00 0.00 41.96 40.21 2dqc s TYR 53 CO 0.06 -0.01 0.00 0.41 -1.11 0.00 0.00 175.55 174.91 2dqc n GLY 54 N 2.36 -2.12 0.33 0.71 0.00 0.21 -0.65 105.19 106.03 2dqc n GLY 54 Ca -0.16 -1.45 0.16 0.00 0.00 0.00 0.00 46.02 44.57 2dqc n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2dqc h ILE 55 N -0.02 0.61 -0.18 -0.61 2.10 -1.68 -0.77 117.51 116.95 2dqc h ILE 55 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 2dqc h ILE 55 Cb 0.02 0.86 0.00 0.00 -1.09 0.00 0.00 36.82 36.61 2dqc h ILE 55 CO 0.00 0.00 0.00 0.18 -1.08 0.00 0.00 178.15 177.25 2dqc n LEU 56 N -4.02 3.06 -4.03 2.19 4.77 -1.26 -4.11 117.00 113.60 2dqc n LEU 56 Ca 0.02 -2.67 -0.45 0.00 -0.03 0.00 0.00 56.01 52.88 2dqc n LEU 56 Cb 0.31 -0.37 0.02 0.00 -2.33 0.00 0.00 43.42 41.05 2dqc n LEU 56 CO 0.30 0.67 -0.16 0.00 -1.33 0.00 0.00 177.39 176.87 2dqc n GLN 57 N -0.50 -0.39 -2.60 3.23 1.13 -0.30 -4.89 117.38 113.08 2dqc n GLN 57 Ca 0.15 0.15 -0.42 0.00 -1.94 0.00 0.00 57.00 54.94 2dqc n GLN 57 Cb 0.64 -2.61 -0.03 0.00 0.11 0.00 0.00 30.24 28.36 2dqc n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2dqc s ILE 58 N -3.48 4.42 0.20 5.09 1.01 0.17 -4.35 121.20 124.26 2dqc s ILE 58 Ca 0.46 1.81 -0.30 0.00 0.00 0.00 0.00 60.65 62.63 2dqc s ILE 58 Cb -0.25 -4.16 -0.08 0.00 0.01 0.00 0.00 42.46 37.98 2dqc s ILE 58 CO 0.96 0.18 1.03 0.21 0.00 0.00 0.00 174.94 177.32 2dqc s ASN 59 N 0.73 7.42 0.00 3.58 2.47 -1.26 0.29 114.94 128.16 2dqc s ASN 59 Ca 0.53 2.03 0.29 0.00 0.42 0.00 0.00 52.86 56.12 2dqc s ASN 59 Cb -0.25 -2.61 1.30 0.00 -1.45 0.00 0.00 41.25 38.24 2dqc s ASN 59 CO 0.30 -0.07 1.94 -1.54 -3.72 0.00 0.00 177.10 174.01 2dqc n SER 60 N 2.01 0.00 0.06 -4.21 3.41 -0.26 -1.75 113.62 112.87 2dqc n SER 60 Ca 0.01 0.28 -0.19 0.00 -0.26 0.00 0.00 58.87 58.71 2dqc n SER 60 Cb 0.47 -0.43 -0.14 0.00 -0.26 0.00 0.00 64.21 63.85 2dqc n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2dqc h ARG 61 N 0.00 0.29 0.00 4.33 2.43 -1.84 -3.41 114.38 116.18 2dqc h ARG 61 Ca 0.00 -0.50 -0.20 0.00 -0.81 0.00 0.00 59.98 58.47 2dqc h ARG 61 Cb 0.41 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 30.11 2dqc h ARG 61 CO 0.00 1.16 -1.74 0.91 -1.51 0.00 0.00 179.97 178.79 2dqc n TRP 62 N -3.48 0.00 -0.12 2.20 7.02 -1.24 -0.96 117.44 120.86 2dqc n TRP 62 Ca -0.21 0.00 -0.23 0.00 -1.02 0.00 0.00 57.50 56.04 2dqc n TRP 62 Cb 1.06 -0.52 -0.10 0.00 -2.42 0.00 0.00 31.31 29.33 2dqc n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 2dqc n TRP 63 N -2.66 0.00 -4.42 -5.99 7.02 -0.72 0.54 117.44 111.22 2dqc n TRP 63 Ca -0.21 0.00 -0.22 0.00 -1.02 0.00 0.00 57.50 56.06 2dqc n TRP 63 Cb 0.79 -0.90 -0.10 0.00 -2.42 0.00 0.00 31.31 28.68 2dqc n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2dqc s ASN 65 N -3.43 5.08 0.00 0.00 2.47 -0.76 -4.31 114.94 113.99 2dqc s ASN 65 Ca 0.27 -0.43 0.13 0.00 0.42 0.00 0.00 52.86 53.25 2dqc s ASN 65 Cb -0.02 -1.90 0.26 0.00 -1.45 0.00 0.00 41.25 38.14 2dqc s ASN 65 CO 0.11 -0.10 1.15 -0.90 -3.72 0.00 0.00 177.10 173.64 2dqc n ASP 66 N 4.90 2.70 -0.02 -4.21 5.68 -1.26 -1.84 116.55 122.50 2dqc n ASP 66 Ca -0.16 -1.82 -0.00 0.00 -0.50 0.00 0.00 54.79 52.31 2dqc n ASP 66 Cb 0.50 -0.17 -0.00 0.00 -1.14 0.00 0.00 41.12 40.31 2dqc n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2dqc n GLY 67 N 0.73 0.19 0.00 6.12 0.00 -1.26 -4.80 105.19 106.17 2dqc n GLY 67 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2dqc n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dqc n ARG 68 N -0.44 0.72 -4.12 1.61 1.74 -1.26 -5.05 116.66 109.86 2dqc n ARG 68 Ca -0.00 -0.71 -0.35 0.00 -0.77 0.00 0.00 57.85 56.02 2dqc n ARG 68 Cb 0.33 -0.76 -0.12 0.00 -1.02 0.00 0.00 32.46 30.88 2dqc n ARG 68 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2dqc s THR 69 N -0.31 3.97 0.00 0.55 2.01 -1.26 -4.90 115.64 115.70 2dqc s THR 69 Ca 0.00 -0.31 0.00 0.00 0.31 0.00 0.00 61.69 61.69 2dqc s THR 69 Cb 0.00 -2.79 0.00 0.00 0.01 0.00 0.00 72.50 69.72 2dqc s THR 69 CO 0.00 0.44 0.00 -2.65 -0.69 0.00 0.00 174.62 171.72 2dqc n PRO 70 N 4.11 0.00 -0.42 4.92 -0.02 -1.26 -3.03 135.00 139.31 2dqc n PRO 70 Ca -0.17 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.27 2dqc n PRO 70 Cb 0.52 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.95 2dqc n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dqc n GLY 71 N 0.00 1.86 3.73 -1.23 0.00 -1.26 -4.91 105.19 103.37 2dqc n GLY 71 Ca 0.00 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 2dqc n GLY 71 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dqc n SER 72 N 2.29 3.33 -0.00 1.61 2.88 -1.17 -4.83 113.62 117.74 2dqc n SER 72 Ca 0.13 1.18 0.01 0.00 -1.33 0.00 0.00 58.87 58.86 2dqc n SER 72 Cb 0.40 -1.54 -0.02 0.00 -0.75 0.00 0.00 64.21 62.30 2dqc n SER 72 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2dqc n ARG 73 N 1.27 2.89 -4.11 -1.46 1.74 -0.13 -5.01 116.66 111.85 2dqc n ARG 73 Ca 0.06 -0.01 -0.33 0.00 -0.77 0.00 0.00 57.85 56.80 2dqc n ARG 73 Cb 0.36 -0.85 -0.04 0.00 -1.02 0.00 0.00 32.46 30.91 2dqc n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2dqc n ASN 74 N -1.34 -1.07 0.26 0.55 4.05 -1.17 -4.82 115.26 111.73 2dqc n ASN 74 Ca -0.00 -1.19 0.18 0.00 0.45 0.00 0.00 54.58 54.02 2dqc n ASN 74 Cb 0.05 -2.16 0.92 0.00 1.23 0.00 0.00 39.78 39.82 2dqc n ASN 74 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 2dqc h LEU 75 N -2.00 0.00 -1.13 1.20 3.38 0.20 -0.19 115.31 116.78 2dqc h LEU 75 Ca -0.67 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.30 2dqc h LEU 75 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 2dqc h LEU 75 CO 0.62 0.00 -0.10 0.00 0.09 0.00 0.00 178.44 179.05 2dqc n ASN 77 N 0.30 -4.92 -3.59 0.00 3.02 -0.08 -4.98 115.26 105.01 2dqc n ASN 77 Ca 0.15 -1.11 -0.15 0.00 -0.03 0.00 0.00 54.58 53.44 2dqc n ASN 77 Cb 0.43 -2.85 -0.07 0.00 -0.61 0.00 0.00 39.78 36.68 2dqc n ASN 77 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2dqc s ILE 78 N -3.49 0.00 0.22 2.41 1.10 -1.26 -5.09 121.20 115.09 2dqc s ILE 78 Ca 0.48 0.00 -0.30 0.00 -0.51 0.00 0.00 60.65 60.32 2dqc s ILE 78 Cb -0.20 -1.00 -0.08 0.00 0.15 0.00 0.00 42.46 41.33 2dqc s ILE 78 CO 0.90 0.00 1.11 -2.16 -2.11 0.00 0.00 174.94 172.68 2dqc s PRO 79 N -0.20 4.60 0.53 3.50 0.04 -1.26 -1.83 135.00 140.38 2dqc s PRO 79 Ca -0.04 1.78 0.25 0.00 0.04 0.00 0.00 61.00 63.03 2dqc s PRO 79 Cb -0.03 -3.23 1.41 0.00 0.04 0.00 0.00 34.50 32.68 2dqc s PRO 79 CO 0.04 0.11 2.01 0.00 0.04 0.00 0.00 177.00 179.20 2dqc h SER 81 N 0.00 0.02 0.77 0.00 4.64 -1.91 0.12 113.55 117.20 2dqc h SER 81 Ca 0.23 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2dqc h SER 81 Cb 0.94 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 2dqc h SER 81 CO -0.00 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 2dqc h ALA 82 N 1.90 1.00 -0.24 5.18 0.00 -1.47 -2.28 119.26 123.34 2dqc h ALA 82 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2dqc h ALA 82 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2dqc h ALA 82 CO -0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 2dqc n LEU 83 N -2.91 1.94 -0.91 0.00 4.77 0.43 -3.92 117.00 116.41 2dqc n LEU 83 Ca 0.00 -0.86 0.08 0.00 -0.03 0.00 0.00 56.01 55.20 2dqc n LEU 83 Cb 0.25 -0.16 0.25 0.00 -2.33 0.00 0.00 43.42 41.42 2dqc n LEU 83 CO 0.24 0.43 0.70 0.18 -1.33 0.00 0.00 177.39 177.61 2dqc n LEU 84 N 0.52 3.79 -4.91 2.23 4.32 -0.86 -3.73 117.00 118.36 2dqc n LEU 84 Ca 0.16 -2.75 -0.27 0.00 -0.02 0.00 0.00 56.01 53.12 2dqc n LEU 84 Cb 0.36 -0.48 -0.00 0.00 -1.62 0.00 0.00 43.42 41.67 2dqc n LEU 84 CO 0.12 0.69 0.42 -0.55 -1.22 0.00 0.00 177.39 176.85 2dqc s SER 85 N -1.62 6.28 0.17 -1.43 0.15 -1.25 -4.56 113.70 111.43 2dqc s SER 85 Ca 0.39 0.90 0.24 0.00 0.70 0.00 0.00 55.95 58.18 2dqc s SER 85 Cb 0.29 -2.23 0.91 0.00 -1.71 0.00 0.00 66.02 63.28 2dqc s SER 85 CO 0.11 -0.55 1.73 -1.20 1.20 0.00 0.00 173.24 174.54 2dqc n SER 86 N -2.17 0.53 -4.62 5.45 7.64 -1.26 -4.50 113.62 114.69 2dqc n SER 86 Ca 0.00 0.59 -0.40 0.00 1.01 0.00 0.00 58.87 60.07 2dqc n SER 86 Cb 0.55 -0.71 -0.07 0.00 -1.01 0.00 0.00 64.21 62.97 2dqc n SER 86 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dqc s ASP 87 N -3.98 6.48 0.00 6.43 -1.08 -1.26 -4.96 116.67 118.30 2dqc s ASP 87 Ca 0.08 0.57 0.28 0.00 -0.52 0.00 0.00 52.55 52.96 2dqc s ASP 87 Cb 0.12 -2.30 1.49 0.00 -1.46 0.00 0.00 42.92 40.76 2dqc s ASP 87 CO 0.46 -0.33 1.98 2.30 0.52 0.00 0.00 175.17 180.10 2dqc n ILE 88 N 5.19 0.01 -0.21 4.11 -5.35 -1.26 -4.43 119.36 117.43 2dqc n ILE 88 Ca -0.03 -0.09 -0.10 0.00 -0.27 0.00 0.00 62.75 62.26 2dqc n ILE 88 Cb 0.49 -0.13 -0.06 0.00 -1.74 0.00 0.00 39.64 38.20 2dqc n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2dqc h THR 89 N 0.82 0.05 -0.80 7.28 2.02 -1.94 -0.07 112.91 120.26 2dqc h THR 89 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 2dqc h THR 89 Cb 0.17 0.05 -0.04 0.00 -1.74 0.00 0.00 68.15 66.60 2dqc h THR 89 CO 0.00 0.00 0.33 0.00 0.37 0.00 0.00 175.52 176.22 2dqc h ALA 90 N 0.41 1.04 -0.67 6.16 0.00 -1.84 -0.76 119.26 123.61 2dqc h ALA 90 Ca 0.15 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2dqc h ALA 90 Cb 0.56 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2dqc h ALA 90 CO -0.69 0.65 0.11 0.77 0.00 0.00 0.00 179.25 180.10 2dqc h SER 91 N 1.16 1.06 -0.32 0.00 0.02 -1.67 -1.69 113.55 112.10 2dqc h SER 91 Ca 0.27 -0.26 -0.05 0.00 -0.84 0.00 0.00 61.79 60.91 2dqc h SER 91 Cb 0.20 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 2dqc h SER 91 CO -0.02 1.05 -0.01 0.58 -1.14 0.00 0.00 176.83 177.29 2dqc h VAL 92 N 1.03 1.26 -0.52 2.27 2.07 -0.72 -0.33 116.25 121.30 2dqc h VAL 92 Ca 0.20 -0.97 0.05 0.00 0.82 0.00 0.00 66.70 66.80 2dqc h VAL 92 Cb 0.43 1.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 2dqc h VAL 92 CO 0.01 0.32 0.25 0.78 0.02 0.00 0.00 177.57 178.95 2dqc h ASN 93 N 0.37 0.34 -0.36 0.57 2.35 -0.96 -0.87 115.58 117.02 2dqc h ASN 93 Ca 0.09 0.04 -0.16 0.00 -0.55 0.00 0.00 56.30 55.71 2dqc h ASN 93 Cb 0.46 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 38.80 2dqc h ASN 93 CO 0.02 0.23 -0.41 0.00 -1.65 0.00 0.00 177.43 175.62 2dqc h ALA 95 N 0.75 1.63 -0.13 0.00 0.00 -0.67 -1.16 119.26 119.69 2dqc h ALA 95 Ca 0.05 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2dqc h ALA 95 Cb 1.00 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2dqc h ALA 95 CO 0.10 0.34 -0.26 0.87 0.00 0.00 0.00 179.25 180.30 2dqc h LYS 96 N 0.67 0.23 -0.01 0.00 1.57 -1.01 -1.38 116.57 116.65 2dqc h LYS 96 Ca 0.18 -0.08 -0.20 0.00 -1.87 0.00 0.00 60.65 58.69 2dqc h LYS 96 Cb -0.06 -0.02 0.02 0.00 0.08 0.00 0.00 32.23 32.25 2dqc h LYS 96 CO -0.04 0.48 -0.76 -0.22 -0.57 0.00 0.00 179.45 178.34 2dqc h LYS 97 N 0.21 0.53 -0.31 3.15 3.64 -1.17 -2.96 116.57 119.65 2dqc h LYS 97 Ca 0.03 -0.56 0.04 0.00 -1.27 0.00 0.00 60.65 58.90 2dqc h LYS 97 Cb 0.57 0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 32.51 2dqc h LYS 97 CO 0.04 1.19 0.07 0.82 -2.27 0.00 0.00 179.45 179.30 2dqc h ILE 98 N 0.09 0.86 0.00 2.00 2.04 -1.01 -1.62 117.51 119.87 2dqc h ILE 98 Ca -0.09 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.70 2dqc h ILE 98 Cb 1.45 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 2dqc h ILE 98 CO 0.15 0.03 0.00 0.55 0.00 0.00 0.00 178.15 178.88 2dqc n VAL 99 N -5.08 0.82 1.80 1.67 3.14 -0.54 -2.13 118.33 118.02 2dqc n VAL 99 Ca 0.00 0.18 0.15 0.00 -2.96 0.00 0.00 64.34 61.72 2dqc n VAL 99 Cb 0.13 -1.03 0.85 0.00 -1.06 0.00 0.00 33.84 32.73 2dqc n VAL 99 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2dqc n SER 100 N -1.97 0.16 -4.90 6.55 7.64 -0.61 -4.11 113.62 116.38 2dqc n SER 100 Ca 0.03 -0.84 -0.28 0.00 1.01 0.00 0.00 58.87 58.79 2dqc n SER 100 Cb 0.23 -0.06 0.01 0.00 -1.01 0.00 0.00 64.21 63.38 2dqc n SER 100 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dqc s ASP 101 N -2.15 6.19 0.64 6.43 2.15 -0.90 -4.95 116.67 124.07 2dqc s ASP 101 Ca 0.42 1.04 0.36 0.00 0.43 0.00 0.00 52.55 54.80 2dqc s ASP 101 Cb 0.21 -2.26 2.03 0.00 -0.30 0.00 0.00 42.92 42.61 2dqc s ASP 101 CO 0.39 -0.70 2.23 1.23 -0.17 0.00 0.00 175.17 178.15 2dqc h GLY 102 N 0.04 0.00 1.94 2.66 0.00 -1.88 -1.14 103.07 104.69 2dqc h GLY 102 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 2dqc h GLY 102 CO 0.62 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.86 2dqc n ASN 103 N -3.37 0.00 0.00 0.19 3.02 -1.26 -4.97 115.26 108.87 2dqc n ASN 103 Ca -0.02 0.42 0.00 0.00 -0.03 0.00 0.00 54.58 54.95 2dqc n ASN 103 Cb 0.17 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 38.87 2dqc n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dqc n GLY 104 N 0.75 2.38 0.00 7.41 0.00 -0.43 -1.61 105.19 113.68 2dqc n GLY 104 Ca 0.06 -0.29 0.13 0.00 0.00 0.00 0.00 46.02 45.92 2dqc n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dqc n MET 105 N 14.00 0.71 0.06 1.61 2.81 -1.26 -3.27 117.12 131.78 2dqc n MET 105 Ca 0.00 0.01 0.06 0.00 -1.81 0.00 0.00 57.70 55.97 2dqc n MET 105 Cb 0.00 -1.50 0.30 0.00 -0.71 0.00 0.00 33.22 31.31 2dqc n MET 105 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2dqc n ASN 106 N -1.07 0.25 0.25 7.83 3.02 -0.63 -0.94 115.26 123.97 2dqc n ASN 106 Ca 0.18 0.59 0.11 0.00 -0.03 0.00 0.00 54.58 55.43 2dqc n ASN 106 Cb 0.12 -0.63 0.68 0.00 -0.61 0.00 0.00 39.78 39.34 2dqc n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dqc h ALA 107 N 2.16 1.33 -1.98 5.41 0.00 -1.71 -3.37 119.26 121.10 2dqc h ALA 107 Ca 0.00 -0.13 -0.71 0.00 0.00 0.00 0.00 54.91 54.07 2dqc h ALA 107 Cb 0.12 -0.02 -0.20 0.00 0.00 0.00 0.00 17.79 17.68 2dqc h ALA 107 CO 0.00 0.17 0.03 -1.58 0.00 0.00 0.00 179.25 177.87 2dqc s TRP 108 N -4.23 3.06 0.25 0.00 0.51 -0.11 -4.94 118.94 113.47 2dqc s TRP 108 Ca -0.03 -0.95 -0.04 0.00 -2.12 0.00 0.00 56.10 52.96 2dqc s TRP 108 Cb 0.13 -3.86 0.37 0.00 -0.81 0.00 0.00 33.47 29.30 2dqc s TRP 108 CO 0.60 -1.19 1.86 0.28 -0.51 0.00 0.00 176.95 177.99 2dqc h VAL 109 N 5.90 1.04 -0.46 4.03 2.07 -1.84 -0.37 116.25 126.62 2dqc h VAL 109 Ca -0.29 -0.35 -0.09 0.00 0.82 0.00 0.00 66.70 66.78 2dqc h VAL 109 Cb 1.09 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2dqc h VAL 109 CO 1.06 0.19 -0.10 0.00 0.02 0.00 0.00 177.57 178.74 2dqc h ALA 110 N 1.43 0.97 -0.31 1.67 0.00 -1.92 -0.86 119.26 120.23 2dqc h ALA 110 Ca 0.40 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2dqc h ALA 110 Cb 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2dqc h ALA 110 CO -0.18 0.61 0.08 2.35 0.00 0.00 0.00 179.25 182.11 2dqc h TRP 111 N 0.75 0.52 -0.93 0.00 7.01 -1.68 0.91 115.95 122.53 2dqc h TRP 111 Ca 0.13 -0.06 -0.00 0.00 2.11 0.00 0.00 58.89 61.06 2dqc h TRP 111 Cb 0.59 -0.15 -0.05 0.00 -2.10 0.00 0.00 29.16 27.46 2dqc h TRP 111 CO 0.03 0.55 0.57 -0.09 -2.79 0.00 0.00 178.44 176.71 2dqc h ARG 112 N 0.35 1.25 0.00 2.65 1.12 -0.77 0.43 114.38 119.40 2dqc h ARG 112 Ca 0.10 -0.11 -0.23 0.00 -1.11 0.00 0.00 59.98 58.63 2dqc h ARG 112 Cb 0.28 -0.27 -0.04 0.00 -0.01 0.00 0.00 29.97 29.94 2dqc h ARG 112 CO 0.00 0.87 -1.24 -0.91 -3.11 0.00 0.00 179.97 175.58 2dqc h ASN 113 N 1.27 0.00 0.00 -3.80 -0.26 -0.99 -3.37 115.58 108.44 2dqc h ASN 113 Ca 0.33 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.07 2dqc h ASN 113 Cb -0.07 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.19 2dqc h ASN 113 CO -0.06 0.96 -0.13 0.54 -1.06 0.00 0.00 177.43 177.68 2dqc n ARG 114 N -3.22 6.12 -0.02 0.81 5.12 0.30 -4.88 116.66 120.88 2dqc n ARG 114 Ca -0.06 -0.00 -0.04 0.00 -1.93 0.00 0.00 57.85 55.82 2dqc n ARG 114 Cb 0.97 -0.61 -0.02 0.00 -1.16 0.00 0.00 32.46 31.64 2dqc n ARG 114 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2dqc n LYS 116 N -3.01 2.40 -0.09 0.00 4.81 -0.03 -1.16 118.16 121.07 2dqc n LYS 116 Ca -0.08 0.87 0.00 0.00 -0.87 0.00 0.00 58.31 58.23 2dqc n LYS 116 Cb 0.57 -2.71 0.00 0.00 0.02 0.00 0.00 35.03 32.90 2dqc n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2dqc n GLY 117 N 4.02 0.94 3.96 3.14 0.00 -1.26 -4.92 105.19 111.07 2dqc n GLY 117 Ca 0.19 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.02 2dqc n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dqc s THR 118 N -2.44 2.83 -1.25 2.61 -4.23 -0.31 -5.00 115.64 107.86 2dqc s THR 118 Ca 0.00 -1.14 -0.19 0.00 -1.18 0.00 0.00 61.69 59.18 2dqc s THR 118 Cb 0.00 -2.97 0.00 0.00 1.34 0.00 0.00 72.50 70.88 2dqc s THR 118 CO 0.00 0.00 1.86 -0.67 -0.54 0.00 0.00 174.62 175.27 2dqc n ASP 119 N -1.75 4.10 0.28 3.99 2.03 -1.26 -4.75 116.55 119.19 2dqc n ASP 119 Ca 0.06 -2.83 0.13 0.00 0.52 0.00 0.00 54.79 52.68 2dqc n ASP 119 Cb 0.60 -1.70 0.82 0.00 -0.72 0.00 0.00 41.12 40.12 2dqc n ASP 119 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2dqc h VAL 120 N 5.57 0.60 -0.04 5.18 -1.51 -1.91 -1.86 116.25 122.28 2dqc h VAL 120 Ca 0.38 -0.22 0.01 0.00 -1.23 0.00 0.00 66.70 65.65 2dqc h VAL 120 Cb 0.86 1.13 -0.00 0.00 -2.13 0.00 0.00 31.29 31.15 2dqc h VAL 120 CO 1.45 0.05 0.04 -0.61 -1.23 0.00 0.00 177.57 177.27 2dqc h GLN 121 N 0.00 0.00 -0.20 5.19 5.75 -1.87 -1.16 115.11 122.83 2dqc h GLN 121 Ca -0.00 0.00 0.06 0.00 -0.15 0.00 0.00 58.65 58.56 2dqc h GLN 121 Cb 0.13 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.67 2dqc h GLN 121 CO 0.01 0.00 0.17 0.00 -2.65 0.00 0.00 178.83 176.36 2dqc h ALA 122 N 1.96 1.97 0.00 3.38 0.00 -1.73 -1.32 119.26 123.52 2dqc h ALA 122 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2dqc h ALA 122 Cb 0.11 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2dqc h ALA 122 CO -0.00 -0.27 0.00 0.91 0.00 0.00 0.00 179.25 179.89 2dqc n TRP 123 N -4.10 0.37 0.17 0.00 7.02 -0.44 -2.95 117.44 117.50 2dqc n TRP 123 Ca 0.02 0.14 0.02 0.00 -1.02 0.00 0.00 57.50 56.65 2dqc n TRP 123 Cb 0.31 -0.72 0.00 0.00 -2.42 0.00 0.00 31.31 28.47 2dqc n TRP 123 CO 0.00 0.00 0.00 0.44 -2.02 0.00 0.00 177.69 176.11 2dqc n ILE 124 N -1.83 0.00 -2.46 -0.99 -5.35 -0.51 -4.82 119.36 103.39 2dqc n ILE 124 Ca 0.03 -0.47 -0.33 0.00 -0.27 0.00 0.00 62.75 61.71 2dqc n ILE 124 Cb 0.22 1.05 -0.03 0.00 -1.74 0.00 0.00 39.64 39.14 2dqc n ILE 124 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2dqc s ARG 125 N -0.75 3.78 -0.38 6.28 0.52 -1.11 -3.50 118.95 123.79 2dqc s ARG 125 Ca 0.03 1.25 0.00 0.00 -0.52 0.00 0.00 55.73 56.49 2dqc s ARG 125 Cb 0.03 -2.10 0.00 0.00 0.52 0.00 0.00 34.95 33.40 2dqc s ARG 125 CO 0.09 -0.44 0.00 0.41 0.02 0.00 0.00 175.30 175.38 2dqc n GLY 126 N -0.61 0.53 3.24 -3.53 0.00 -1.26 -5.03 105.19 98.52 2dqc n GLY 126 Ca 0.09 -0.84 -0.24 0.00 0.00 0.00 0.00 46.02 45.02 2dqc n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dqc s ARG 128 N -1.37 3.96 0.00 0.00 1.81 -1.26 -5.14 118.95 116.96 2dqc s ARG 128 Ca 0.06 0.68 0.00 0.00 -1.72 0.00 0.00 55.73 54.75 2dqc s ARG 128 Cb -0.09 -3.74 0.00 0.00 -0.45 0.00 0.00 34.95 30.67 2dqc s ARG 128 CO 0.02 -0.76 0.18 1.28 -0.68 0.00 0.00 175.30 175.35