#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jqg s GLU 30 N 0.00 2.43 0.02 0.03 -1.05 -1.26 -1.40 118.70 117.47 2jqg s GLU 30 Ca 0.00 -0.87 -0.08 0.00 -0.15 0.00 0.00 54.97 53.86 2jqg s GLU 30 Cb 0.00 -2.17 0.00 0.00 -0.44 0.00 0.00 34.13 31.52 2jqg s GLU 30 CO 0.00 0.47 0.16 -0.48 0.95 0.00 0.00 175.26 176.36 2jqg s LEU 31 N -0.38 1.49 -0.01 1.83 2.34 -1.12 -4.93 118.68 117.89 2jqg s LEU 31 Ca 0.03 -0.33 0.04 0.00 0.06 0.00 0.00 54.13 53.93 2jqg s LEU 31 Cb -0.12 0.81 -0.03 0.00 -0.56 0.00 0.00 46.19 46.29 2jqg s LEU 31 CO 0.02 -0.48 -0.10 0.42 -1.06 0.00 0.00 176.35 175.15 2jqg s THR 32 N -2.13 3.41 0.01 5.48 -4.23 -1.26 -1.79 115.64 115.13 2jqg s THR 32 Ca -0.09 -0.78 0.02 0.00 -1.18 0.00 0.00 61.69 59.67 2jqg s THR 32 Cb -0.03 -2.44 -0.01 0.00 1.34 0.00 0.00 72.50 71.36 2jqg s THR 32 CO -0.02 0.46 -0.08 -1.48 -0.54 0.00 0.00 174.62 172.96 2jqg s LEU 33 N -1.19 2.06 0.35 4.79 -0.00 -1.19 0.21 118.68 123.70 2jqg s LEU 33 Ca 0.15 -0.22 0.22 0.00 -0.00 0.00 0.00 54.13 54.28 2jqg s LEU 33 Cb -0.11 -0.36 1.23 0.00 -0.00 0.00 0.00 46.19 46.96 2jqg s LEU 33 CO 0.05 0.04 1.39 0.00 -0.00 0.00 0.00 176.35 177.83 2jqg n TYR 34 N 2.61 0.89 -2.94 3.48 9.36 0.56 -0.37 117.16 130.75 2jqg n TYR 34 Ca -0.15 0.90 -0.39 0.00 3.32 0.00 0.00 57.90 61.58 2jqg n TYR 34 Cb 0.57 -1.32 -0.00 0.00 -0.63 0.00 0.00 39.34 37.96 2jqg n TYR 34 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 2jqg n ASN 35 N -4.82 6.23 0.00 2.98 5.03 -1.26 -4.39 115.26 119.03 2jqg n ASN 35 Ca 0.34 -3.53 0.00 0.00 0.87 0.00 0.00 54.58 52.26 2jqg n ASN 35 Cb 1.22 -1.10 0.00 0.00 -1.02 0.00 0.00 39.78 38.88 2jqg n ASN 35 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2jqg n GLY 36 N 0.70 0.76 0.00 7.41 0.00 -0.88 -3.69 105.19 109.48 2jqg n GLY 36 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.35 2jqg n GLY 36 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jqg n GLU 37 N 0.00 0.00 -1.37 1.61 1.02 0.50 -4.12 120.64 118.27 2jqg n GLU 37 Ca 0.00 0.00 -0.56 0.00 -0.02 0.00 0.00 57.16 56.58 2jqg n GLU 37 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.32 2jqg n GLU 37 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2jqg n LYS 38 N 0.00 0.51 -3.81 3.49 2.85 -1.26 -3.15 118.16 116.78 2jqg n LYS 38 Ca 0.00 0.14 -0.13 0.00 -1.05 0.00 0.00 58.31 57.27 2jqg n LYS 38 Cb 0.00 -1.93 -0.14 0.00 -0.65 0.00 0.00 35.03 32.31 2jqg n LYS 38 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 2jqg s LYS 39 N 5.84 0.04 -0.13 -1.58 2.47 -0.74 -4.93 119.74 120.71 2jqg s LYS 39 Ca 1.14 0.16 -0.25 0.00 -1.56 0.00 0.00 55.97 55.45 2jqg s LYS 39 Cb -1.21 -0.08 -0.02 0.00 -1.46 0.00 0.00 37.83 35.06 2jqg s LYS 39 CO 0.60 -0.08 0.83 0.99 0.16 0.00 0.00 175.35 177.84 2jqg s THR 40 N 0.52 4.91 0.42 3.43 2.01 -1.26 -2.81 115.64 122.85 2jqg s THR 40 Ca -0.04 1.65 0.08 0.00 0.31 0.00 0.00 61.69 63.69 2jqg s THR 40 Cb -0.06 -4.14 0.01 0.00 0.01 0.00 0.00 72.50 68.32 2jqg s THR 40 CO -0.02 0.08 0.54 -0.36 -0.69 0.00 0.00 174.62 174.17 2jqg s PHE 41 N 1.77 2.81 0.26 4.92 0.40 -0.49 -4.96 117.98 122.68 2jqg s PHE 41 Ca 0.40 -0.41 0.06 0.00 -0.60 0.00 0.00 56.93 56.38 2jqg s PHE 41 Cb -0.17 -2.34 -0.03 0.00 0.51 0.00 0.00 43.02 40.99 2jqg s PHE 41 CO 0.15 -0.36 0.36 0.71 0.70 0.00 0.00 175.22 176.77 2jqg s TYR 42 N -2.36 3.32 0.00 0.36 2.02 -1.26 -4.45 117.35 114.98 2jqg s TYR 42 Ca 0.54 -0.08 0.00 0.00 -0.37 0.00 0.00 57.07 57.16 2jqg s TYR 42 Cb -0.09 -1.64 0.00 0.00 -0.40 0.00 0.00 41.96 39.83 2jqg s TYR 42 CO 0.32 0.35 0.00 0.43 -1.57 0.00 0.00 175.55 175.09 2jqg n SER 43 N -1.42 -0.11 -4.78 2.29 7.64 -1.26 -3.82 113.62 112.16 2jqg n SER 43 Ca -0.07 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.52 2jqg n SER 43 Cb 0.57 0.00 0.13 0.00 -1.01 0.00 0.00 64.21 63.90 2jqg n SER 43 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jqg s ARG 44 N -0.17 1.30 -0.55 1.43 1.70 -1.22 -1.89 118.95 119.55 2jqg s ARG 44 Ca 0.00 0.39 -0.26 0.00 -0.47 0.00 0.00 55.73 55.39 2jqg s ARG 44 Cb 0.00 -1.85 -0.06 0.00 -0.57 0.00 0.00 34.95 32.47 2jqg s ARG 44 CO 0.00 -2.11 2.28 -1.25 -1.08 0.00 0.00 175.30 173.14 2jqg s PRO 45 N -5.22 2.18 0.00 3.89 0.04 -1.26 -4.65 135.00 129.97 2jqg s PRO 45 Ca 0.63 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.78 2jqg s PRO 45 Cb -0.15 -4.57 0.00 0.00 0.04 0.00 0.00 34.50 29.82 2jqg s PRO 45 CO 0.54 -3.27 0.00 -1.71 0.04 0.00 0.00 177.00 172.60 2jqg n ASN 46 N 15.44 0.00 -3.74 6.66 5.15 -1.26 -4.88 115.26 132.64 2jqg n ASN 46 Ca 0.34 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 54.03 2jqg n ASN 46 Cb 0.53 0.00 -0.13 0.00 -0.53 0.00 0.00 39.78 39.65 2jqg n ASN 46 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2jqg s ASN 47 N -1.95 3.72 0.00 1.20 4.22 -1.26 -4.72 114.94 116.14 2jqg s ASN 47 Ca 0.00 -2.73 0.00 0.00 -2.14 0.00 0.00 52.86 47.99 2jqg s ASN 47 Cb 0.00 -1.11 0.00 0.00 1.28 0.00 0.00 41.25 41.42 2jqg s ASN 47 CO 0.00 -0.25 0.00 0.00 -2.04 0.00 0.00 177.10 174.81 2jqg n HIS 48 N 3.42 0.00 -2.64 1.54 1.44 -1.26 -5.07 115.22 112.65 2jqg n HIS 48 Ca 0.09 0.00 -0.05 0.00 -2.01 0.00 0.00 57.72 55.75 2jqg n HIS 48 Cb 0.35 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.41 2jqg n HIS 48 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 2jqg n ASP 49 N 0.00 -1.08 0.00 4.39 8.00 -1.26 -4.73 116.55 121.86 2jqg n ASP 49 Ca 0.00 1.34 0.00 0.00 0.71 0.00 0.00 54.79 56.84 2jqg n ASP 49 Cb 0.00 -5.07 0.00 0.00 -0.02 0.00 0.00 41.12 36.03 2jqg n ASP 49 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2jqg n ASN 50 N 1.72 0.00 -0.09 -2.24 0.23 -1.26 -4.66 115.26 108.97 2jqg n ASN 50 Ca -0.39 -0.74 0.00 0.00 -0.53 0.00 0.00 54.58 52.93 2jqg n ASN 50 Cb 0.60 0.00 0.29 0.00 -2.08 0.00 0.00 39.78 38.59 2jqg n ASN 50 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2jqg h ALA 51 N 0.00 1.43 -0.55 -2.53 0.00 -1.91 0.25 119.26 115.96 2jqg h ALA 51 Ca 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2jqg h ALA 51 Cb 0.37 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2jqg h ALA 51 CO 0.00 0.44 0.29 -1.49 0.00 0.00 0.00 179.25 178.49 2jqg h TRP 52 N 0.73 0.74 -0.36 0.00 4.06 -1.87 -0.07 115.95 119.17 2jqg h TRP 52 Ca 0.18 -0.01 -0.11 0.00 2.06 0.00 0.00 58.89 61.00 2jqg h TRP 52 Cb 0.11 -0.24 -0.01 0.00 -1.00 0.00 0.00 29.16 28.02 2jqg h TRP 52 CO 0.01 0.53 -0.22 -0.07 -3.56 0.00 0.00 178.44 175.13 2jqg h LEU 53 N 0.76 0.82 -1.92 -4.49 3.38 -1.32 -1.71 115.31 110.84 2jqg h LEU 53 Ca 0.19 -0.42 0.22 0.00 0.09 0.00 0.00 57.88 57.96 2jqg h LEU 53 Cb 0.04 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 2jqg h LEU 53 CO -0.03 1.07 0.63 -1.13 0.09 0.00 0.00 178.44 179.07 2jqg h ASN 54 N 0.58 0.00 0.00 -0.43 -1.24 0.12 1.78 115.58 116.38 2jqg h ASN 54 Ca 0.08 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.09 2jqg h ASN 54 Cb 0.78 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.83 2jqg h ASN 54 CO 0.06 0.00 0.00 0.00 -1.29 0.00 0.00 177.43 176.20 2jqg n ALA 55 N -2.54 -0.25 -0.05 1.57 0.00 -0.50 0.41 120.51 119.15 2jqg n ALA 55 Ca 0.15 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.64 2jqg n ALA 55 Cb 0.90 0.00 0.40 0.00 0.00 0.00 0.00 19.45 20.75 2jqg n ALA 55 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2jqg h ILE 56 N 0.00 1.09 0.27 0.00 -2.65 -1.32 0.57 117.51 115.47 2jqg h ILE 56 Ca 0.00 -0.21 -0.01 0.00 1.03 0.00 0.00 64.86 65.66 2jqg h ILE 56 Cb 0.00 0.42 0.00 0.00 -2.05 0.00 0.00 36.82 35.19 2jqg h ILE 56 CO 0.00 0.11 -0.13 -0.07 0.03 0.00 0.00 178.15 178.10 2jqg h LEU 57 N 0.62 -0.30 -2.07 0.16 -0.00 0.27 1.33 115.31 115.31 2jqg h LEU 57 Ca 0.19 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 58.08 2jqg h LEU 57 Cb -0.00 0.08 -0.00 0.00 -0.00 0.00 0.00 40.66 40.74 2jqg h LEU 57 CO -0.04 -0.18 0.01 0.06 -0.00 0.00 0.00 178.44 178.28 2jqg h GLN 58 N -0.42 0.00 -0.34 1.13 -0.00 0.01 0.58 115.11 116.07 2jqg h GLN 58 Ca -0.04 0.00 -0.16 0.00 -0.00 0.00 0.00 58.65 58.45 2jqg h GLN 58 Cb 0.27 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.75 2jqg h GLN 58 CO 0.06 0.00 -0.42 -0.07 -0.00 0.00 0.00 178.83 178.40 2jqg h LEU 59 N 0.00 0.91 -0.54 0.06 -0.00 0.28 -2.75 115.31 113.27 2jqg h LEU 59 Ca 0.01 -0.43 -0.09 0.00 -0.00 0.00 0.00 57.88 57.37 2jqg h LEU 59 Cb 0.03 -0.26 -0.02 0.00 -0.00 0.00 0.00 40.66 40.41 2jqg h LEU 59 CO -0.00 1.20 -0.03 0.15 -0.00 0.00 0.00 178.44 179.76 2jqg h PHE 60 N 0.68 1.07 -0.87 1.13 3.57 0.64 -2.30 116.94 120.85 2jqg h PHE 60 Ca 0.05 -0.20 0.07 0.00 3.53 0.00 0.00 57.97 61.43 2jqg h PHE 60 Cb 1.00 -0.27 -0.07 0.00 2.79 0.00 0.00 35.95 39.40 2jqg h PHE 60 CO 0.06 0.98 0.54 0.00 -2.23 0.00 0.00 178.31 177.65 2jqg h ARG 61 N 0.85 0.92 0.05 1.11 3.08 0.18 0.56 114.38 121.13 2jqg h ARG 61 Ca 0.15 -0.06 -0.21 0.00 0.07 0.00 0.00 59.98 59.94 2jqg h ARG 61 Cb 0.57 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 2jqg h ARG 61 CO 0.03 0.61 -1.10 0.10 -1.07 0.00 0.00 179.97 178.54 2jqg h TYR 62 N 0.95 0.20 0.00 3.04 -0.00 -1.47 -3.32 116.97 116.36 2jqg h TYR 62 Ca 0.39 -0.14 0.00 0.00 -0.00 0.00 0.00 58.73 58.98 2jqg h TYR 62 Cb 0.24 -0.01 0.00 0.00 -0.00 0.00 0.00 36.73 36.96 2jqg h TYR 62 CO -0.03 1.43 0.00 0.28 -0.00 0.00 0.00 178.16 179.84 2jqg h VAL 63 N -0.68 0.00 -2.44 -0.90 2.07 -1.45 -3.08 116.25 109.78 2jqg h VAL 63 Ca -0.27 -0.36 -0.10 0.00 0.82 0.00 0.00 66.70 66.79 2jqg h VAL 63 Cb 1.46 1.21 0.04 0.00 -1.52 0.00 0.00 31.29 32.47 2jqg h VAL 63 CO -0.05 0.00 -0.18 1.21 0.02 0.00 0.00 177.57 178.56 2jqg n GLU 64 N -2.58 -2.02 -3.46 1.57 2.13 0.19 -5.00 120.64 111.48 2jqg n GLU 64 Ca 0.02 0.22 -0.29 0.00 0.66 0.00 0.00 57.16 57.77 2jqg n GLU 64 Cb 0.27 -3.39 -0.12 0.00 0.27 0.00 0.00 31.44 28.47 2jqg n GLU 64 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2jqg s GLU 65 N -5.11 0.52 -0.82 5.31 2.02 -0.84 -5.01 118.70 114.76 2jqg s GLU 65 Ca 0.12 -1.25 -0.25 0.00 0.02 0.00 0.00 54.97 53.61 2jqg s GLU 65 Cb -0.05 -1.26 0.01 0.00 0.10 0.00 0.00 34.13 32.92 2jqg s GLU 65 CO 0.19 -1.20 1.60 -1.25 0.02 0.00 0.00 175.26 174.63 2jqg s PRO 66 N 1.17 3.04 0.27 0.39 0.04 -1.26 -4.45 135.00 134.19 2jqg s PRO 66 Ca 0.17 -0.31 0.14 0.00 0.04 0.00 0.00 61.00 61.04 2jqg s PRO 66 Cb -0.22 -4.75 0.21 0.00 0.04 0.00 0.00 34.50 29.78 2jqg s PRO 66 CO -0.02 -2.56 1.51 0.74 0.04 0.00 0.00 177.00 176.71 2jqg h PHE 67 N 11.33 0.00 -1.89 0.56 0.04 -1.93 -3.15 116.94 121.89 2jqg h PHE 67 Ca -0.06 0.00 -0.73 0.00 2.80 0.00 0.00 57.97 59.98 2jqg h PHE 67 Cb 1.05 0.00 -0.31 0.00 2.20 0.00 0.00 35.95 38.90 2jqg h PHE 67 CO 1.17 0.60 0.62 1.19 -0.60 0.00 0.00 178.31 181.30 2jqg n PHE 68 N -3.42 3.09 -0.41 -0.55 3.01 -1.26 -4.82 117.46 113.10 2jqg n PHE 68 Ca 0.00 -2.53 0.34 0.00 1.01 0.00 0.00 57.45 56.27 2jqg n PHE 68 Cb 0.71 -0.92 0.65 0.00 -0.01 0.00 0.00 39.48 39.91 2jqg n PHE 68 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 2jqg h ASP 69 N 2.93 0.23 -0.33 4.37 3.32 -1.94 0.31 116.42 125.31 2jqg h ASP 69 Ca 0.50 0.08 -0.04 0.00 0.02 0.00 0.00 57.03 57.59 2jqg h ASP 69 Cb 0.25 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 2jqg h ASP 69 CO 1.29 -0.05 0.10 -0.50 -1.72 0.00 0.00 179.24 178.35 2jqg h TRP 70 N 0.15 0.61 0.59 4.55 4.06 -1.89 0.51 115.95 124.54 2jqg h TRP 70 Ca 0.72 -0.04 -0.03 0.00 2.06 0.00 0.00 58.89 61.59 2jqg h TRP 70 Cb 2.32 -0.19 0.01 0.00 -1.00 0.00 0.00 29.16 30.30 2jqg h TRP 70 CO -0.00 0.53 -0.28 0.28 -3.56 0.00 0.00 178.44 175.40 2jqg h VAL 71 N 0.59 0.19 -0.06 1.49 2.07 -0.61 -2.72 116.25 117.21 2jqg h VAL 71 Ca 0.14 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 67.18 2jqg h VAL 71 Cb 0.23 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 2jqg h VAL 71 CO -0.00 0.03 -0.44 0.10 0.02 0.00 0.00 177.57 177.28 2jqg h TYR 72 N -1.11 0.16 0.00 1.57 -0.00 -1.56 -2.64 116.97 113.39 2jqg h TYR 72 Ca -0.08 -0.04 -0.02 0.00 -0.00 0.00 0.00 58.73 58.58 2jqg h TYR 72 Cb 0.66 -0.04 -0.00 0.00 -0.00 0.00 0.00 36.73 37.35 2jqg h TYR 72 CO 0.00 0.56 -0.09 1.03 -0.00 0.00 0.00 178.16 179.66 2jqg h SER 73 N 0.11 0.00 -3.55 0.10 0.87 -0.92 -3.42 113.55 106.75 2jqg h SER 73 Ca 0.01 0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 60.05 2jqg h SER 73 Cb 0.82 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.77 2jqg h SER 73 CO 0.06 0.09 0.38 -0.44 -0.53 0.00 0.00 176.83 176.40 2jqg s SER 74 N -6.31 7.45 0.45 6.23 0.01 -1.00 -4.92 113.70 115.62 2jqg s SER 74 Ca -0.04 1.83 0.24 0.00 1.31 0.00 0.00 55.95 59.29 2jqg s SER 74 Cb 0.14 -2.59 1.05 0.00 0.21 0.00 0.00 66.02 64.83 2jqg s SER 74 CO 0.59 -0.10 1.89 1.55 0.41 0.00 0.00 173.24 177.58 2jqg h PRO 75 N 5.61 0.00 0.00 12.44 0.13 -1.87 -3.45 132.00 144.87 2jqg h PRO 75 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2jqg h PRO 75 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2jqg h PRO 75 CO 0.72 0.22 0.00 -0.85 -0.23 0.00 0.00 178.00 177.86 2jqg n GLU 76 N -3.52 3.90 -2.78 0.86 0.28 -1.26 -5.06 120.64 113.07 2jqg n GLU 76 Ca -0.01 0.00 -0.43 0.00 -0.16 0.00 0.00 57.16 56.57 2jqg n GLU 76 Cb 0.38 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.21 2jqg n GLU 76 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 2jqg s ASN 77 N 0.77 6.28 -0.40 -1.84 0.01 -1.26 -4.86 114.94 113.65 2jqg s ASN 77 Ca 0.00 -0.48 0.07 0.00 -0.71 0.00 0.00 52.86 51.74 2jqg s ASN 77 Cb 0.00 -2.46 0.43 0.00 0.41 0.00 0.00 41.25 39.63 2jqg s ASN 77 CO 0.00 -1.39 1.11 0.18 -1.51 0.00 0.00 177.10 175.48 2jqg n LEU 78 N 7.89 4.33 0.46 0.60 7.99 -1.26 -4.87 117.00 132.14 2jqg n LEU 78 Ca 0.01 -4.92 -0.19 0.00 -0.01 0.00 0.00 56.01 50.90 2jqg n LEU 78 Cb 0.47 -0.32 -0.09 0.00 -0.11 0.00 0.00 43.42 43.37 2jqg n LEU 78 CO 0.66 2.11 0.52 0.00 -1.51 0.00 0.00 177.39 179.17 2jqg h THR 79 N 2.63 0.08 -0.44 -5.08 1.03 -1.91 -2.30 112.91 106.93 2jqg h THR 79 Ca 0.26 -0.08 0.09 0.00 -0.01 0.00 0.00 66.41 66.67 2jqg h THR 79 Cb 1.07 0.09 -0.09 0.00 -1.07 0.00 0.00 68.15 68.15 2jqg h THR 79 CO 0.78 0.00 -0.20 0.17 -0.01 0.00 0.00 175.52 176.26 2jqg h LEU 80 N -1.25 -0.68 -1.75 0.00 8.10 -1.85 0.19 115.31 118.07 2jqg h LEU 80 Ca -0.12 0.16 0.00 0.00 0.11 0.00 0.00 57.88 58.04 2jqg h LEU 80 Cb 0.90 0.38 -0.01 0.00 -0.44 0.00 0.00 40.66 41.49 2jqg h LEU 80 CO 0.20 -0.23 0.17 -0.08 -4.11 0.00 0.00 178.44 174.39 2jqg h GLU 81 N -0.11 0.33 0.59 0.17 4.81 -1.95 0.29 114.58 118.71 2jqg h GLU 81 Ca 0.21 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 2jqg h GLU 81 Cb 0.44 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.75 2jqg h GLU 81 CO -0.51 0.22 -0.28 0.00 -0.73 0.00 0.00 179.01 177.70 2jqg h ALA 82 N 1.84 -0.79 0.09 2.92 0.00 -0.07 -3.22 119.26 120.04 2jqg h ALA 82 Ca 0.09 -0.20 -0.32 0.00 0.00 0.00 0.00 54.91 54.49 2jqg h ALA 82 Cb -0.03 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2jqg h ALA 82 CO -0.02 -0.79 -1.70 0.82 0.00 0.00 0.00 179.25 177.56 2jqg h ILE 83 N -1.10 0.94 -1.03 0.00 5.03 -1.13 -3.22 117.51 117.00 2jqg h ILE 83 Ca -0.08 -2.65 0.26 0.00 -0.12 0.00 0.00 64.86 62.27 2jqg h ILE 83 Cb 0.66 2.61 -0.09 0.00 -3.03 0.00 0.00 36.82 36.97 2jqg h ILE 83 CO 0.13 0.77 0.66 0.50 -0.68 0.00 0.00 178.15 179.53 2jqg h LYS 84 N 0.05 0.39 -0.38 2.37 1.63 -0.58 2.12 116.57 122.18 2jqg h LYS 84 Ca -0.30 -0.02 -0.11 0.00 -0.85 0.00 0.00 60.65 59.37 2jqg h LYS 84 Cb 2.02 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 33.55 2jqg h LYS 84 CO 0.12 0.26 -0.19 0.37 -3.45 0.00 0.00 179.45 176.56 2jqg h GLN 85 N 0.40 0.80 -0.68 1.90 4.15 -1.64 -2.49 115.11 117.55 2jqg h GLN 85 Ca 0.59 -0.35 -0.03 0.00 0.77 0.00 0.00 58.65 59.63 2jqg h GLN 85 Cb 1.48 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 29.11 2jqg h GLN 85 CO -0.29 0.98 0.31 1.25 -1.93 0.00 0.00 178.83 179.15 2jqg h LEU 86 N 0.60 0.88 -1.15 -2.39 7.12 0.27 -1.58 115.31 119.06 2jqg h LEU 86 Ca 0.08 -0.10 0.09 0.00 0.13 0.00 0.00 57.88 58.08 2jqg h LEU 86 Cb 0.74 -0.23 -0.07 0.00 -0.53 0.00 0.00 40.66 40.58 2jqg h LEU 86 CO 0.06 0.76 0.59 -0.08 -0.13 0.00 0.00 178.44 179.64 2jqg h GLU 87 N 0.97 0.92 -0.19 1.25 4.81 0.23 0.94 114.58 123.50 2jqg h GLU 87 Ca 0.23 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.46 2jqg h GLU 87 Cb 0.13 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 2jqg h GLU 87 CO -0.03 0.61 0.14 -0.44 -0.73 0.00 0.00 179.01 178.56 2jqg h ASP 88 N 0.95 0.04 0.00 1.04 3.32 -0.98 1.87 116.42 122.65 2jqg h ASP 88 Ca 0.42 -0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.31 2jqg h ASP 88 Cb 0.37 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2jqg h ASP 88 CO -0.18 0.03 -1.10 -0.11 -1.72 0.00 0.00 179.24 176.15 2jqg n LEU 89 N -4.49 1.85 0.07 1.55 0.00 0.27 -4.44 117.00 111.82 2jqg n LEU 89 Ca 0.01 0.48 -0.10 0.00 0.00 0.00 0.00 56.01 56.41 2jqg n LEU 89 Cb 0.24 -0.92 -0.13 0.00 0.00 0.00 0.00 43.42 42.62 2jqg n LEU 89 CO 0.35 0.03 0.07 0.71 0.00 0.00 0.00 177.39 178.55 2jqg h THR 90 N -1.00 1.64 -2.29 1.96 1.35 -0.01 -3.47 112.91 111.09 2jqg h THR 90 Ca -0.25 -3.31 -0.32 0.00 -0.55 0.00 0.00 66.41 61.99 2jqg h THR 90 Cb 1.05 2.88 -0.01 0.00 -1.73 0.00 0.00 68.15 70.33 2jqg h THR 90 CO -0.15 0.95 -0.41 0.61 -0.25 0.00 0.00 175.52 176.27 2jqg n GLY 91 N 1.41 -0.29 0.03 5.82 0.00 0.64 -4.90 105.19 107.90 2jqg n GLY 91 Ca -0.03 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2jqg n GLY 91 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2jqg n LEU 92 N -2.30 2.03 -1.17 0.99 -0.00 -1.26 -5.04 117.00 110.25 2jqg n LEU 92 Ca -0.19 -1.98 0.00 0.00 -0.00 0.00 0.00 56.01 53.84 2jqg n LEU 92 Cb 0.64 -0.01 0.00 0.00 -0.00 0.00 0.00 43.42 44.05 2jqg n LEU 92 CO 0.22 0.51 -0.29 -0.62 -0.00 0.00 0.00 177.39 177.20 2jqg n GLU 93 N -0.44 -3.23 0.11 1.47 1.02 -1.26 -4.78 120.64 113.52 2jqg n GLU 93 Ca 0.01 2.34 0.00 0.00 -0.02 0.00 0.00 57.16 59.49 2jqg n GLU 93 Cb 0.25 -2.56 0.00 0.00 -0.02 0.00 0.00 31.44 29.11 2jqg n GLU 93 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2jqg n LEU 94 N 0.18 -0.07 -0.41 -4.62 4.77 -1.26 -3.51 117.00 112.08 2jqg n LEU 94 Ca 0.00 0.36 0.34 0.00 -0.03 0.00 0.00 56.01 56.68 2jqg n LEU 94 Cb 0.00 0.28 0.61 0.00 -2.33 0.00 0.00 43.42 41.98 2jqg n LEU 94 CO 0.00 -0.72 1.19 1.12 -1.33 0.00 0.00 177.39 177.65 2jqg h HIS 95 N 0.00 0.63 0.00 -1.77 2.07 -1.89 1.27 115.15 115.46 2jqg h HIS 95 Ca 0.00 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.55 2jqg h HIS 95 Cb 0.00 -0.16 0.00 0.00 2.57 0.00 0.00 27.41 29.82 2jqg h HIS 95 CO 0.00 -0.23 -1.43 -0.85 -3.07 0.00 0.00 177.93 172.35 2jqg n GLU 96 N -4.81 0.88 0.00 5.12 0.28 -1.26 -4.44 120.64 116.40 2jqg n GLU 96 Ca 0.36 -0.10 0.00 0.00 -0.16 0.00 0.00 57.16 57.26 2jqg n GLU 96 Cb 1.33 -1.36 0.00 0.00 1.43 0.00 0.00 31.44 32.84 2jqg n GLU 96 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2jqg n GLY 97 N 1.49 1.56 3.46 -1.84 0.00 0.44 -5.09 105.19 105.20 2jqg n GLY 97 Ca -0.01 -1.64 -0.23 0.00 0.00 0.00 0.00 46.02 44.14 2jqg n GLY 97 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jqg s GLY 98 N 0.00 2.35 -0.03 -0.02 0.00 -1.25 -4.72 107.32 103.65 2jqg s GLY 98 Ca 0.00 -1.54 -0.19 0.00 0.00 0.00 0.00 44.72 42.99 2jqg s GLY 98 CO 0.00 -1.78 0.79 -0.56 0.00 0.00 0.00 173.10 171.55 2jqg h PRO 99 N 1.96 -0.53 -0.02 2.90 0.13 -1.90 -3.20 132.00 131.33 2jqg h PRO 99 Ca -0.36 0.04 0.01 0.00 -0.87 0.00 0.00 66.00 64.81 2jqg h PRO 99 Cb 1.26 0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.51 2jqg h PRO 99 CO 0.59 -0.28 0.05 -1.00 -0.23 0.00 0.00 178.00 177.13 2jqg h PRO 100 N -1.09 0.00 -2.21 1.56 0.13 -1.99 -3.29 132.00 125.12 2jqg h PRO 100 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2jqg h PRO 100 Cb 0.49 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.62 2jqg h PRO 100 CO 0.09 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 177.86 2jqg n ALA 101 N -2.19 0.00 0.00 -0.56 0.00 -1.21 -3.37 120.51 113.18 2jqg n ALA 101 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2jqg n ALA 101 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 2jqg n ALA 101 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jqg n LEU 102 N 1.36 0.00 -0.35 0.00 4.77 -1.26 -4.41 117.00 117.10 2jqg n LEU 102 Ca 0.00 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.05 2jqg n LEU 102 Cb 0.00 -0.13 0.25 0.00 -2.33 0.00 0.00 43.42 41.20 2jqg n LEU 102 CO 0.00 0.00 1.24 0.58 -1.33 0.00 0.00 177.39 177.88 2jqg h VAL 103 N 0.00 0.94 -0.36 4.08 2.07 -1.62 1.31 116.25 122.67 2jqg h VAL 103 Ca 0.00 -0.34 -0.12 0.00 0.82 0.00 0.00 66.70 67.06 2jqg h VAL 103 Cb 0.00 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 29.62 2jqg h VAL 103 CO 0.00 0.18 -0.28 0.40 0.02 0.00 0.00 177.57 177.89 2jqg h ILE 104 N 0.99 1.28 -0.25 4.57 2.04 -1.72 -0.56 117.51 123.86 2jqg h ILE 104 Ca 0.48 -1.41 -0.02 0.00 1.00 0.00 0.00 64.86 64.92 2jqg h ILE 104 Cb 0.46 1.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 2jqg h ILE 104 CO -0.24 0.46 0.10 -0.25 0.00 0.00 0.00 178.15 178.22 2jqg h TRP 105 N 0.64 0.38 0.00 1.37 2.91 0.11 -2.53 115.95 118.84 2jqg h TRP 105 Ca 0.08 -0.03 -0.17 0.00 1.13 0.00 0.00 58.89 59.90 2jqg h TRP 105 Cb 0.80 -0.11 -0.02 0.00 -0.51 0.00 0.00 29.16 29.31 2jqg h TRP 105 CO 0.04 0.40 -0.82 -0.91 -1.03 0.00 0.00 178.44 176.13 2jqg h ASN 106 N 0.25 0.00 -0.04 2.65 2.35 0.36 -3.05 115.58 118.10 2jqg h ASN 106 Ca 0.08 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2jqg h ASN 106 Cb 0.19 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 2jqg h ASN 106 CO -0.01 0.82 0.00 -0.38 -1.65 0.00 0.00 177.43 176.21 2jqg n ILE 107 N -3.57 0.06 -0.27 2.81 5.41 -0.22 -4.54 119.36 119.03 2jqg n ILE 107 Ca -0.01 -0.07 0.00 0.00 1.00 0.00 0.00 62.75 63.68 2jqg n ILE 107 Cb 0.78 -0.07 0.05 0.00 -0.71 0.00 0.00 39.64 39.69 2jqg n ILE 107 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 2jqg n LYS 108 N -0.46 -0.14 0.15 0.38 4.81 -0.96 0.13 118.16 122.06 2jqg n LYS 108 Ca 0.08 1.11 0.10 0.00 -0.87 0.00 0.00 58.31 58.73 2jqg n LYS 108 Cb 0.08 -1.65 0.54 0.00 0.02 0.00 0.00 35.03 34.02 2jqg n LYS 108 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2jqg n HIS 109 N -5.09 0.67 -0.09 5.64 8.25 -1.26 -1.85 115.22 121.50 2jqg n HIS 109 Ca 0.08 0.35 -0.13 0.00 -0.26 0.00 0.00 57.72 57.77 2jqg n HIS 109 Cb 0.31 -1.06 -0.08 0.00 1.12 0.00 0.00 29.99 30.27 2jqg n HIS 109 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2jqg n LEU 110 N -2.19 2.84 0.00 2.41 7.99 0.33 -4.91 117.00 123.47 2jqg n LEU 110 Ca -0.01 -0.07 0.00 0.00 -0.01 0.00 0.00 56.01 55.92 2jqg n LEU 110 Cb 0.03 -0.61 0.00 0.00 -0.11 0.00 0.00 43.42 42.73 2jqg n LEU 110 CO 0.09 0.76 0.00 -0.11 -1.51 0.00 0.00 177.39 176.62 2jqg n LEU 111 N -3.09 0.00 -1.02 2.23 -0.00 0.34 -4.52 117.00 110.94 2jqg n LEU 111 Ca -0.32 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.69 2jqg n LEU 111 Cb 0.83 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.25 2jqg n LEU 111 CO 0.16 0.00 0.17 1.41 -0.00 0.00 0.00 177.39 179.13 2jqg n HIS 112 N 0.00 0.00 0.00 1.96 8.25 -0.85 -4.69 115.22 119.89 2jqg n HIS 112 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2jqg n HIS 112 Cb 0.00 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.00 2jqg n HIS 112 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 2jqg n THR 113 N 0.98 0.00 -3.53 1.59 5.66 0.20 -4.78 114.28 114.40 2jqg n THR 113 Ca 0.00 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.72 2jqg n THR 113 Cb 0.09 -0.72 -0.11 0.00 -1.55 0.00 0.00 70.33 68.04 2jqg n THR 113 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 2jqg s GLY 114 N 0.00 1.56 0.24 1.09 0.00 -1.25 -4.89 107.32 104.06 2jqg s GLY 114 Ca 0.00 -2.68 0.07 0.00 0.00 0.00 0.00 44.72 42.11 2jqg s GLY 114 CO 0.00 1.85 -0.10 -0.42 0.00 0.00 0.00 173.10 174.43 2jqg s ILE 115 N -0.11 1.68 -0.64 0.90 -1.09 -1.25 -4.76 121.20 115.94 2jqg s ILE 115 Ca 0.28 -2.17 0.05 0.00 -2.23 0.00 0.00 60.65 56.58 2jqg s ILE 115 Cb -0.04 -2.22 0.21 0.00 -1.58 0.00 0.00 42.46 38.83 2jqg s ILE 115 CO -0.15 -0.46 0.58 0.61 -1.23 0.00 0.00 174.94 174.29 2jqg n GLY 116 N -0.47 4.09 3.79 6.18 0.00 -0.96 -3.83 105.19 113.98 2jqg n GLY 116 Ca -0.07 -2.48 -0.35 0.00 0.00 0.00 0.00 46.02 43.12 2jqg n GLY 116 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jqg s THR 117 N -1.71 3.51 0.45 2.61 2.01 0.39 -3.45 115.64 119.45 2jqg s THR 117 Ca 0.32 0.98 0.28 0.00 0.31 0.00 0.00 61.69 63.58 2jqg s THR 117 Cb 0.05 -3.42 0.31 0.00 0.01 0.00 0.00 72.50 69.45 2jqg s THR 117 CO -0.11 -0.16 2.11 0.00 -0.69 0.00 0.00 174.62 175.77 2jqg h ALA 118 N 1.59 1.33 0.00 7.40 0.00 -1.82 -2.41 119.26 125.36 2jqg h ALA 118 Ca -0.50 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.25 2jqg h ALA 118 Cb 1.24 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2jqg h ALA 118 CO 0.59 0.12 -1.84 -1.13 0.00 0.00 0.00 179.25 176.98 2jqg n SER 119 N -3.67 0.23 -0.45 0.00 3.41 -1.26 -5.07 113.62 106.80 2jqg n SER 119 Ca -0.02 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 2jqg n SER 119 Cb 0.20 1.39 0.00 0.00 -0.26 0.00 0.00 64.21 65.55 2jqg n SER 119 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2jqg n ARG 120 N -2.47 0.00 -2.40 4.33 0.63 -0.91 -5.16 116.66 110.68 2jqg n ARG 120 Ca -0.09 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.57 2jqg n ARG 120 Cb 0.69 0.00 0.01 0.00 0.45 0.00 0.00 32.46 33.62 2jqg n ARG 120 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2jqg s PRO 121 N -0.35 3.29 0.00 -0.14 0.04 -1.26 0.15 135.00 136.72 2jqg s PRO 121 Ca 0.00 0.21 0.00 0.00 0.04 0.00 0.00 61.00 61.25 2jqg s PRO 121 Cb 0.00 -2.28 0.00 0.00 0.04 0.00 0.00 34.50 32.26 2jqg s PRO 121 CO 0.00 -0.48 0.00 0.43 0.04 0.00 0.00 177.00 176.99 2jqg n SER 122 N -2.49 1.80 -0.01 6.66 7.64 -1.25 -4.69 113.62 121.28 2jqg n SER 122 Ca 0.03 0.00 0.09 0.00 1.01 0.00 0.00 58.87 60.00 2jqg n SER 122 Cb 0.56 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.63 2jqg n SER 122 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2jqg n GLU 123 N 0.00 0.60 0.00 1.43 2.13 -1.26 0.58 120.64 124.12 2jqg n GLU 123 Ca 0.00 -0.15 0.00 0.00 0.66 0.00 0.00 57.16 57.67 2jqg n GLU 123 Cb 0.00 -1.41 0.00 0.00 0.27 0.00 0.00 31.44 30.30 2jqg n GLU 123 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 2jqg n VAL 124 N -2.06 0.00 -3.57 6.31 0.24 -1.26 -4.77 118.33 113.22 2jqg n VAL 124 Ca -0.03 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.90 2jqg n VAL 124 Cb 0.45 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.75 2jqg n VAL 124 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jqg s VAL 126 N -0.64 4.96 -0.31 0.00 1.01 -1.22 0.12 120.40 124.31 2jqg s VAL 126 Ca 0.21 -0.82 0.21 0.00 0.00 0.00 0.00 61.98 61.58 2jqg s VAL 126 Cb -0.15 -3.53 0.17 0.00 0.00 0.00 0.00 36.38 32.87 2jqg s VAL 126 CO 0.09 -0.07 1.38 -0.37 0.00 0.00 0.00 175.10 176.14 2jqg h VAL 127 N 1.88 0.21 -0.07 2.92 -1.51 -1.09 -3.38 116.25 115.21 2jqg h VAL 127 Ca -0.48 -1.31 -0.19 0.00 -1.23 0.00 0.00 66.70 63.48 2jqg h VAL 127 Cb 1.19 1.96 -0.06 0.00 -2.13 0.00 0.00 31.29 32.25 2jqg h VAL 127 CO 0.67 0.12 1.30 -0.67 -1.23 0.00 0.00 177.57 177.75 2jqg n ASP 128 N -3.01 -0.74 -1.91 4.19 2.03 -1.26 -1.38 116.55 114.47 2jqg n ASP 128 Ca 0.02 -1.04 -0.12 0.00 0.52 0.00 0.00 54.79 54.17 2jqg n ASP 128 Cb 0.60 -0.85 -0.03 0.00 -0.72 0.00 0.00 41.12 40.12 2jqg n ASP 128 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jqg n GLY 129 N 5.61 0.30 3.67 0.27 0.00 -1.26 -4.62 105.19 109.17 2jqg n GLY 129 Ca 0.49 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.22 2jqg n GLY 129 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jqg s THR 130 N -2.33 3.85 0.00 2.61 -4.23 -0.48 -5.05 115.64 110.02 2jqg s THR 130 Ca 0.00 -1.20 0.00 0.00 -1.18 0.00 0.00 61.69 59.31 2jqg s THR 130 Cb 0.00 -2.88 0.00 0.00 1.34 0.00 0.00 72.50 70.96 2jqg s THR 130 CO 0.00 0.01 0.00 0.47 -0.54 0.00 0.00 174.62 174.56 2jqg n ASP 131 N 0.25 -0.11 -4.77 3.99 8.00 -1.26 -4.71 116.55 117.94 2jqg n ASP 131 Ca -0.10 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.16 2jqg n ASP 131 Cb 0.53 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.72 2jqg n ASP 131 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2jqg s MET 132 N 0.00 1.95 0.30 -1.24 -1.94 -1.26 -5.10 119.30 112.01 2jqg s MET 132 Ca 0.00 -0.83 0.05 0.00 -1.71 0.00 0.00 55.69 53.20 2jqg s MET 132 Cb 0.00 -2.32 0.05 0.00 2.01 0.00 0.00 34.83 34.57 2jqg s MET 132 CO 0.00 -1.26 0.40 0.00 -0.01 0.00 0.00 175.02 174.14 2jqg n LEU 134 N 0.00 0.00 0.27 0.00 7.99 -1.26 -0.01 117.00 123.98 2jqg n LEU 134 Ca 0.08 0.00 0.11 0.00 -0.01 0.00 0.00 56.01 56.19 2jqg n LEU 134 Cb 0.31 0.00 0.73 0.00 -0.11 0.00 0.00 43.42 44.35 2jqg n LEU 134 CO 0.20 0.00 1.02 0.00 -1.51 0.00 0.00 177.39 177.10 2jqg h ALA 135 N 0.00 1.55 -0.79 -1.18 0.00 -1.90 -3.08 119.26 113.85 2jqg h ALA 135 Ca 0.00 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.92 2jqg h ALA 135 Cb 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 2jqg h ALA 135 CO 0.00 0.10 0.46 0.22 0.00 0.00 0.00 179.25 180.03 2jqg h ASP 136 N 0.00 0.68 -5.05 0.00 3.58 -0.65 -3.45 116.42 111.52 2jqg h ASP 136 Ca -0.00 0.04 -0.05 0.00 0.42 0.00 0.00 57.03 57.44 2jqg h ASP 136 Cb 0.17 -0.10 -0.13 0.00 1.72 0.00 0.00 39.33 41.00 2jqg h ASP 136 CO 0.01 0.41 -0.00 0.72 -2.88 0.00 0.00 179.24 177.50 2jqg s PHE 137 N -6.05 -0.29 -0.43 0.28 -0.12 -1.17 -4.42 117.98 105.78 2jqg s PHE 137 Ca -0.13 0.03 0.05 0.00 -0.05 0.00 0.00 56.93 56.83 2jqg s PHE 137 Cb 0.18 0.33 0.18 0.00 -0.63 0.00 0.00 43.02 43.08 2jqg s PHE 137 CO 0.78 -0.73 0.43 0.72 -0.05 0.00 0.00 175.22 176.37 2jqg n HIS 138 N -0.21 -1.45 0.00 3.49 8.25 -1.11 -4.67 115.22 119.52 2jqg n HIS 138 Ca -0.16 -2.96 0.00 0.00 -0.26 0.00 0.00 57.72 54.34 2jqg n HIS 138 Cb 0.64 0.46 0.00 0.00 1.12 0.00 0.00 29.99 32.21 2jqg n HIS 138 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jqg n ALA 139 N 2.74 0.00 0.00 -1.41 0.00 -1.26 -0.74 120.51 119.85 2jqg n ALA 139 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.71 2jqg n ALA 139 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2jqg n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jqg n GLY 140 N -0.26 0.63 3.55 0.00 0.00 -1.03 -0.87 105.19 107.21 2jqg n GLY 140 Ca 0.00 -2.11 -0.36 0.00 0.00 0.00 0.00 46.02 43.55 2jqg n GLY 140 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jqg s ILE 141 N -1.01 4.66 0.13 -0.61 1.01 -0.45 -3.44 121.20 121.50 2jqg s ILE 141 Ca 0.00 -0.07 0.08 0.00 0.00 0.00 0.00 60.65 60.66 2jqg s ILE 141 Cb 0.00 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.28 2jqg s ILE 141 CO 0.00 0.38 -0.11 -0.36 0.00 0.00 0.00 174.94 174.86 2jqg s PHE 142 N 1.06 2.68 -0.24 3.97 0.40 -0.86 -1.95 117.98 123.04 2jqg s PHE 142 Ca 0.05 -0.19 -0.10 0.00 -0.60 0.00 0.00 56.93 56.09 2jqg s PHE 142 Cb -0.14 -1.37 -0.04 0.00 0.51 0.00 0.00 43.02 41.97 2jqg s PHE 142 CO 0.03 0.45 0.13 -1.17 0.70 0.00 0.00 175.22 175.37 2jqg s LEU 143 N -2.42 3.93 -0.31 -0.37 2.96 0.43 -3.29 118.68 119.62 2jqg s LEU 143 Ca 0.22 0.03 -0.07 0.00 -0.22 0.00 0.00 54.13 54.10 2jqg s LEU 143 Cb -0.10 -2.05 0.02 0.00 0.50 0.00 0.00 46.19 44.55 2jqg s LEU 143 CO 0.14 0.05 0.08 -0.75 -1.32 0.00 0.00 176.35 174.55 2jqg s LYS 144 N 1.16 2.96 -1.02 1.98 2.20 -1.24 -4.57 119.74 121.21 2jqg s LYS 144 Ca 0.06 -0.95 0.00 0.00 -0.36 0.00 0.00 55.97 54.73 2jqg s LYS 144 Cb -0.14 -3.38 0.00 0.00 -1.51 0.00 0.00 37.83 32.80 2jqg s LYS 144 CO 0.05 -0.50 0.00 0.41 -0.36 0.00 0.00 175.35 174.95 2jqg n GLY 145 N 4.85 0.17 1.22 5.54 0.00 -1.26 -4.07 105.19 111.63 2jqg n GLY 145 Ca -0.14 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.02 2jqg n GLY 145 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2jqg n GLN 146 N -2.30 -2.38 -1.76 1.61 6.02 -1.26 -4.68 117.38 112.63 2jqg n GLN 146 Ca -0.12 1.80 -0.13 0.00 -0.01 0.00 0.00 57.00 58.55 2jqg n GLN 146 Cb 0.49 -2.96 -0.04 0.00 1.02 0.00 0.00 30.24 28.75 2jqg n GLN 146 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2jqg n GLU 147 N -3.77 -1.60 -3.75 -1.09 1.02 -1.26 -4.91 120.64 105.27 2jqg n GLU 147 Ca -0.04 0.72 -0.13 0.00 -0.02 0.00 0.00 57.16 57.69 2jqg n GLU 147 Cb 0.62 -5.09 -0.14 0.00 -0.02 0.00 0.00 31.44 26.81 2jqg n GLU 147 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2jqg s HIS 148 N -2.30 -0.22 -0.31 -0.32 3.76 -1.26 -5.07 115.29 109.57 2jqg s HIS 148 Ca 0.00 0.58 -0.09 0.00 -0.15 0.00 0.00 55.06 55.39 2jqg s HIS 148 Cb 0.00 -0.02 -0.01 0.00 1.11 0.00 0.00 32.58 33.67 2jqg s HIS 148 CO 0.00 -0.18 0.15 0.00 -0.85 0.00 0.00 174.74 173.86 2jqg s ALA 149 N 1.02 3.27 0.10 -1.40 0.00 -1.26 -3.65 121.76 119.83 2jqg s ALA 149 Ca -0.08 -1.37 0.06 0.00 0.00 0.00 0.00 51.96 50.57 2jqg s ALA 149 Cb -0.09 -2.36 -0.03 0.00 0.00 0.00 0.00 23.12 20.63 2jqg s ALA 149 CO -0.06 -0.88 -0.15 0.14 0.00 0.00 0.00 175.76 174.81 2jqg s VAL 150 N 1.61 1.30 -0.15 0.00 -7.23 -1.21 -4.83 120.40 109.90 2jqg s VAL 150 Ca 0.05 -1.53 -0.08 0.00 -1.81 0.00 0.00 61.98 58.60 2jqg s VAL 150 Cb -0.17 -1.36 0.06 0.00 0.56 0.00 0.00 36.38 35.47 2jqg s VAL 150 CO 0.06 -0.29 0.36 -0.36 -0.31 0.00 0.00 175.10 174.56 2jqg s PHE 151 N -1.66 -0.52 0.38 2.82 0.08 -1.26 -2.03 117.98 115.80 2jqg s PHE 151 Ca 0.04 1.13 0.08 0.00 0.12 0.00 0.00 56.93 58.30 2jqg s PHE 151 Cb -0.08 0.19 -0.04 0.00 -0.57 0.00 0.00 43.02 42.53 2jqg s PHE 151 CO 0.03 -0.31 0.23 0.00 -0.10 0.00 0.00 175.22 175.06 2jqg s ALA 152 N 1.39 3.69 -0.29 5.36 0.00 -1.22 -0.17 121.76 130.53 2jqg s ALA 152 Ca -0.09 -1.91 -0.20 0.00 0.00 0.00 0.00 51.96 49.76 2jqg s ALA 152 Cb -0.09 -0.74 0.14 0.00 0.00 0.00 0.00 23.12 22.43 2jqg s ALA 152 CO -0.11 -0.09 1.03 0.00 0.00 0.00 0.00 175.76 176.59 2jqg n VAL 154 N 2.98 0.02 -0.50 0.00 0.31 0.08 -2.28 118.33 118.94 2jqg n VAL 154 Ca -0.16 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 63.70 2jqg n VAL 154 Cb 0.57 -2.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.49 2jqg n VAL 154 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2jqg n THR 155 N 7.71 0.00 0.30 2.52 -2.24 0.52 0.21 114.28 123.29 2jqg n THR 155 Ca 0.44 0.00 0.18 0.00 -2.27 0.00 0.00 64.05 62.40 2jqg n THR 155 Cb 0.35 -1.88 0.84 0.00 -2.10 0.00 0.00 70.33 67.54 2jqg n THR 155 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2jqg h SER 156 N -0.06 0.00 -0.21 3.42 4.64 0.20 -1.38 113.55 120.15 2jqg h SER 156 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jqg h SER 156 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2jqg h SER 156 CO 0.00 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.55 2jqg n ASN 157 N -2.88 3.09 0.00 4.97 3.02 -1.26 -5.03 115.26 117.17 2jqg n ASN 157 Ca -0.01 -1.93 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 2jqg n ASN 157 Cb 0.18 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 2jqg n ASN 157 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jqg n GLY 158 N 1.29 -0.40 3.54 7.41 0.00 -0.52 -4.90 105.19 111.60 2jqg n GLY 158 Ca 0.15 -2.21 -0.37 0.00 0.00 0.00 0.00 46.02 43.59 2jqg n GLY 158 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2jqg n TRP 159 N 0.00 1.24 -4.62 1.61 2.14 -1.26 0.19 117.44 116.74 2jqg n TRP 159 Ca 0.00 0.18 -0.27 0.00 2.07 0.00 0.00 57.50 59.47 2jqg n TRP 159 Cb 0.00 -2.58 -0.06 0.00 -0.81 0.00 0.00 31.31 27.86 2jqg n TRP 159 CO 0.00 0.00 0.00 0.66 2.07 0.00 0.00 177.69 180.42 2jqg n TYR 160 N 14.79 0.87 -3.65 -2.67 4.02 -0.97 -0.25 117.16 129.31 2jqg n TYR 160 Ca 0.43 -2.21 -0.12 0.00 -0.01 0.00 0.00 57.90 56.00 2jqg n TYR 160 Cb 0.44 -0.24 -0.08 0.00 -0.02 0.00 0.00 39.34 39.43 2jqg n TYR 160 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2jqg s ALA 161 N -2.80 -1.64 -1.02 -0.72 0.00 0.25 0.18 121.76 116.00 2jqg s ALA 161 Ca 0.03 1.98 -0.23 0.00 0.00 0.00 0.00 51.96 53.74 2jqg s ALA 161 Cb 0.00 -1.16 0.01 0.00 0.00 0.00 0.00 23.12 21.97 2jqg s ALA 161 CO 0.02 -0.32 1.68 0.42 0.00 0.00 0.00 175.76 177.56 2jqg s ILE 162 N 0.79 3.75 -0.23 0.00 1.09 0.76 -2.88 121.20 124.49 2jqg s ILE 162 Ca -0.04 -0.76 -0.15 0.00 -1.10 0.00 0.00 60.65 58.60 2jqg s ILE 162 Cb -0.05 -4.68 -0.04 0.00 -1.06 0.00 0.00 42.46 36.63 2jqg s ILE 162 CO -0.06 -1.54 0.39 -1.81 -0.10 0.00 0.00 174.94 171.81 2jqg s ASP 163 N 6.05 6.35 -0.27 3.58 1.11 0.95 -4.00 116.67 130.44 2jqg s ASP 163 Ca 0.57 0.41 -0.07 0.00 0.18 0.00 0.00 52.55 53.63 2jqg s ASP 163 Cb -0.02 -2.22 0.01 0.00 1.07 0.00 0.00 42.92 41.76 2jqg s ASP 163 CO -0.03 -0.13 0.26 0.47 1.18 0.00 0.00 175.17 176.92 2jqg n ASP 164 N 4.88 -2.08 0.00 0.27 8.00 -1.26 0.17 116.55 126.52 2jqg n ASP 164 Ca -0.08 -0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.16 2jqg n ASP 164 Cb 0.51 -0.65 0.00 0.00 -0.02 0.00 0.00 41.12 40.96 2jqg n ASP 164 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2jqg n GLU 165 N -0.79 0.00 -3.92 -1.24 2.13 -0.79 -3.45 120.64 112.58 2jqg n GLU 165 Ca -0.09 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.37 2jqg n GLU 165 Cb 0.28 -2.65 -0.08 0.00 0.27 0.00 0.00 31.44 29.26 2jqg n GLU 165 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2jqg s ASP 166 N -1.87 6.01 -0.26 4.31 2.15 0.45 -4.73 116.67 122.72 2jqg s ASP 166 Ca 0.00 0.26 -0.10 0.00 0.43 0.00 0.00 52.55 53.14 2jqg s ASP 166 Cb 0.00 -1.98 -0.04 0.00 -0.30 0.00 0.00 42.92 40.59 2jqg s ASP 166 CO 0.00 0.27 0.15 -0.36 -0.17 0.00 0.00 175.17 175.06 2jqg s PHE 167 N -0.22 3.21 0.14 -5.34 0.08 -1.26 -0.03 117.98 114.55 2jqg s PHE 167 Ca 0.09 0.02 -0.13 0.00 0.12 0.00 0.00 56.93 57.04 2jqg s PHE 167 Cb -0.12 -2.31 0.01 0.00 -0.57 0.00 0.00 43.02 40.04 2jqg s PHE 167 CO 0.01 -0.14 0.33 1.52 -0.10 0.00 0.00 175.22 176.85 2jqg s TYR 168 N 1.50 0.05 -0.19 0.36 1.13 -1.14 -4.88 117.35 114.19 2jqg s TYR 168 Ca 0.07 -0.42 -0.29 0.00 -1.41 0.00 0.00 57.07 55.02 2jqg s TYR 168 Cb -0.15 0.12 -0.04 0.00 -1.10 0.00 0.00 41.96 40.79 2jqg s TYR 168 CO 0.07 -0.70 1.78 -1.25 -2.51 0.00 0.00 175.55 172.94 2jqg s PRO 169 N -3.87 3.72 0.10 -3.49 0.04 -1.26 0.84 135.00 131.07 2jqg s PRO 169 Ca 0.08 1.86 0.07 0.00 0.04 0.00 0.00 61.00 63.05 2jqg s PRO 169 Cb 0.03 -4.12 -0.03 0.00 0.04 0.00 0.00 34.50 30.42 2jqg s PRO 169 CO -0.07 -1.40 -0.19 -0.46 0.04 0.00 0.00 177.00 174.92 2jqg s TRP 170 N 5.66 1.65 -0.46 0.56 -0.00 0.65 -4.86 118.94 122.15 2jqg s TRP 170 Ca 0.79 -0.43 -0.19 0.00 -0.00 0.00 0.00 56.10 56.27 2jqg s TRP 170 Cb -0.29 -0.91 0.04 0.00 -0.00 0.00 0.00 33.47 32.31 2jqg s TRP 170 CO 0.32 0.17 0.57 0.99 -0.00 0.00 0.00 176.95 179.01 2jqg s THR 171 N -1.22 4.93 -0.98 5.86 2.01 -1.26 -4.09 115.64 120.88 2jqg s THR 171 Ca 0.05 -0.27 -0.16 0.00 0.31 0.00 0.00 61.69 61.62 2jqg s THR 171 Cb -0.10 -4.19 -0.09 0.00 0.01 0.00 0.00 72.50 68.13 2jqg s THR 171 CO 0.04 -0.63 2.08 -0.81 -0.69 0.00 0.00 174.62 174.62 2jqg n PRO 172 N 6.02 2.01 -2.85 4.92 -0.04 -1.26 -4.92 135.00 138.88 2jqg n PRO 172 Ca -0.05 -1.91 -0.40 0.00 -0.04 0.00 0.00 63.50 61.10 2jqg n PRO 172 Cb 0.47 -2.86 -0.06 0.00 -0.04 0.00 0.00 33.50 31.01 2jqg n PRO 172 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2jqg s ASP 173 N 4.13 7.51 0.00 3.54 -1.08 -1.26 -4.13 116.67 125.38 2jqg s ASP 173 Ca 0.52 1.79 0.00 0.00 -0.52 0.00 0.00 52.55 54.34 2jqg s ASP 173 Cb 0.14 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 39.04 2jqg s ASP 173 CO 0.03 0.15 0.82 -0.81 0.52 0.00 0.00 175.17 175.88 2jqg n PRO 174 N 1.74 0.54 0.06 4.34 -0.04 -1.26 -3.94 135.00 136.43 2jqg n PRO 174 Ca -0.03 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.22 2jqg n PRO 174 Cb 0.48 -1.23 -0.15 0.00 -0.04 0.00 0.00 33.50 32.56 2jqg n PRO 174 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2jqg h SER 175 N 1.70 0.53 0.00 3.54 4.64 -1.96 -3.40 113.55 118.60 2jqg h SER 175 Ca 0.00 -0.93 0.00 0.00 -0.47 0.00 0.00 61.79 60.39 2jqg h SER 175 Cb 0.54 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2jqg h SER 175 CO 0.00 1.51 0.00 0.47 -0.87 0.00 0.00 176.83 177.94 2jqg n ASP 176 N -3.99 0.80 -4.98 4.97 8.00 -1.25 -5.02 116.55 115.07 2jqg n ASP 176 Ca -0.17 -1.11 -0.20 0.00 0.71 0.00 0.00 54.79 54.02 2jqg n ASP 176 Cb 0.90 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 42.03 2jqg n ASP 176 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2jqg s VAL 177 N -0.11 2.90 0.00 2.53 0.11 -1.26 -0.43 120.40 124.15 2jqg s VAL 177 Ca 0.00 -0.74 0.00 0.00 -2.93 0.00 0.00 61.98 58.31 2jqg s VAL 177 Cb 0.00 -3.05 0.00 0.00 -1.53 0.00 0.00 36.38 31.80 2jqg s VAL 177 CO 0.00 -0.03 0.00 0.18 -3.33 0.00 0.00 175.10 171.92 2jqg n LEU 178 N -2.18 0.00 -4.68 2.54 7.99 -0.82 -4.73 117.00 115.12 2jqg n LEU 178 Ca 0.07 0.00 -0.42 0.00 -0.01 0.00 0.00 56.01 55.65 2jqg n LEU 178 Cb 0.59 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.88 2jqg n LEU 178 CO 0.44 0.00 1.08 0.68 -1.51 0.00 0.00 177.39 178.08 2jqg s VAL 179 N 0.15 3.94 0.41 4.08 -7.23 -1.26 -0.52 120.40 119.96 2jqg s VAL 179 Ca 0.00 1.27 0.04 0.00 -1.81 0.00 0.00 61.98 61.48 2jqg s VAL 179 Cb 0.00 -3.82 -0.02 0.00 0.56 0.00 0.00 36.38 33.10 2jqg s VAL 179 CO 0.00 -0.02 0.14 0.72 -0.31 0.00 0.00 175.10 175.62 2jqg s PHE 180 N 2.60 1.78 -0.09 2.82 -0.12 0.31 -1.33 117.98 123.95 2jqg s PHE 180 Ca 0.61 -1.31 0.02 0.00 -0.05 0.00 0.00 56.93 56.20 2jqg s PHE 180 Cb -0.28 -1.14 0.01 0.00 -0.63 0.00 0.00 43.02 40.98 2jqg s PHE 180 CO 0.24 -0.33 -0.13 0.54 -0.05 0.00 0.00 175.22 175.49 2jqg s VAL 181 N -3.22 1.29 -0.04 -2.49 0.11 -0.05 -0.26 120.40 115.74 2jqg s VAL 181 Ca 0.24 -0.53 -0.22 0.00 -2.93 0.00 0.00 61.98 58.54 2jqg s VAL 181 Cb 0.02 -1.18 -0.04 0.00 -1.53 0.00 0.00 36.38 33.65 2jqg s VAL 181 CO 0.15 0.39 0.66 -2.16 -3.33 0.00 0.00 175.10 170.81 2jqg s PRO 182 N 0.89 4.40 0.34 1.54 0.04 -1.26 -2.77 135.00 138.18 2jqg s PRO 182 Ca -0.10 0.82 0.05 0.00 0.04 0.00 0.00 61.00 61.81 2jqg s PRO 182 Cb -0.15 -3.41 0.60 0.00 0.04 0.00 0.00 34.50 31.58 2jqg s PRO 182 CO 0.01 0.18 1.85 0.10 0.04 0.00 0.00 177.00 179.19 2jqg h TYR 183 N 6.31 0.49 -6.58 0.56 -0.00 -1.96 -3.47 116.97 112.33 2jqg h TYR 183 Ca -0.42 -0.06 -0.52 0.00 0.00 0.00 0.00 58.73 57.73 2jqg h TYR 183 Cb 1.20 -0.14 -0.10 0.00 0.00 0.00 0.00 36.73 37.68 2jqg h TYR 183 CO 0.65 0.53 -0.86 -3.47 -0.00 0.00 0.00 178.16 175.01 2jqg n ASP 184 N -4.25 -1.48 -1.51 0.10 2.03 -1.26 -4.84 116.55 105.34 2jqg n ASP 184 Ca 0.01 -1.00 0.05 0.00 0.52 0.00 0.00 54.79 54.37 2jqg n ASP 184 Cb 0.28 -2.98 0.30 0.00 -0.72 0.00 0.00 41.12 38.00 2jqg n ASP 184 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jqg n GLN 185 N -4.42 3.82 -3.77 -0.67 1.13 -1.26 -4.63 117.38 107.59 2jqg n GLN 185 Ca -0.17 -2.32 -0.30 0.00 -1.94 0.00 0.00 57.00 52.27 2jqg n GLN 185 Cb 0.62 -2.04 -0.10 0.00 0.11 0.00 0.00 30.24 28.82 2jqg n GLN 185 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2jqg n GLU 186 N 0.49 2.17 0.08 -1.09 1.02 -1.26 -4.88 120.64 117.17 2jqg n GLU 186 Ca 0.20 -4.52 0.10 0.00 -0.02 0.00 0.00 57.16 52.92 2jqg n GLU 186 Cb 0.93 -2.32 0.42 0.00 -0.02 0.00 0.00 31.44 30.45 2jqg n GLU 186 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2jqg n PRO 187 N 1.89 0.12 -0.00 3.49 -0.04 -1.26 -2.95 135.00 136.24 2jqg n PRO 187 Ca 0.22 0.38 0.08 0.00 -0.04 0.00 0.00 63.50 64.14 2jqg n PRO 187 Cb 0.36 -1.73 0.49 0.00 -0.04 0.00 0.00 33.50 32.58 2jqg n PRO 187 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2jqg h LEU 188 N 0.00 0.35-10.54 1.53 3.38 -1.99 -3.42 115.31 104.62 2jqg h LEU 188 Ca 0.00 -0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.52 2jqg h LEU 188 Cb 0.30 -0.08 0.15 0.00 0.09 0.00 0.00 40.66 41.11 2jqg h LEU 188 CO 0.00 0.24 0.29 0.54 0.09 0.00 0.00 178.44 179.60 2jqg s ASN 189 N -6.54 2.98 0.00 -0.43 4.22 -1.15 -4.99 114.94 109.03 2jqg s ASN 189 Ca -0.07 0.77 0.00 0.00 -2.14 0.00 0.00 52.86 51.42 2jqg s ASN 189 Cb 0.18 -1.19 0.00 0.00 1.28 0.00 0.00 41.25 41.53 2jqg s ASN 189 CO 0.73 -2.86 0.00 0.61 -2.04 0.00 0.00 177.10 173.54 2jqg n GLY 190 N -2.29 3.05 2.87 0.45 0.00 -1.26 -5.07 105.19 102.93 2jqg n GLY 190 Ca 0.09 -1.51 -0.02 0.00 0.00 0.00 0.00 46.02 44.59 2jqg n GLY 190 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jqg n GLU 191 N 0.80 -2.71 -4.17 1.61 1.02 -1.26 -4.97 120.64 110.97 2jqg n GLU 191 Ca 0.00 2.24 -0.36 0.00 -0.02 0.00 0.00 57.16 59.02 2jqg n GLU 191 Cb 0.00 -3.17 -0.08 0.00 -0.02 0.00 0.00 31.44 28.17 2jqg n GLU 191 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2jqg s TRP 192 N -0.69 3.34 -0.04 -0.32 0.51 -1.26 -5.10 118.94 115.38 2jqg s TRP 192 Ca -0.10 0.33 0.02 0.00 -2.12 0.00 0.00 56.10 54.23 2jqg s TRP 192 Cb 0.01 -1.85 0.01 0.00 -0.81 0.00 0.00 33.47 30.83 2jqg s TRP 192 CO 0.42 0.58 -0.09 0.21 -0.51 0.00 0.00 176.95 177.57 2jqg s LYS 193 N -0.95 1.15 0.00 4.98 2.20 -1.26 -5.00 119.74 120.87 2jqg s LYS 193 Ca 0.14 -0.28 0.00 0.00 -0.36 0.00 0.00 55.97 55.47 2jqg s LYS 193 Cb -0.12 -1.04 0.00 0.00 -1.51 0.00 0.00 37.83 35.16 2jqg s LYS 193 CO 0.03 0.03 0.00 0.00 -0.36 0.00 0.00 175.35 175.05 2jqg n ALA 194 N 3.66 1.78 0.13 3.13 0.00 -1.26 -5.30 120.51 122.66 2jqg n ALA 194 Ca -0.22 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.24 2jqg n ALA 194 Cb 0.52 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.99 2jqg n ALA 194 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67