#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qox h GLN 2 N 0.00 0.00 -2.59 0.03 1.08 -1.85 0.21 115.11 111.99 2qox h GLN 2 Ca 0.00 0.00 0.23 0.00 -1.45 0.00 0.00 58.65 57.43 2qox h GLN 2 Cb 0.00 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 27.32 2qox h GLN 2 CO 0.00 0.86 -0.70 1.33 -0.95 0.00 0.00 178.83 179.37 2qox n VAL 3 N -4.57 -0.29 -4.52 -0.54 0.24 -1.25 -2.23 118.33 105.16 2qox n VAL 3 Ca -0.16 0.46 -0.34 0.00 -2.04 0.00 0.00 64.34 62.27 2qox n VAL 3 Cb 0.49 -0.77 -0.11 0.00 -1.47 0.00 0.00 33.84 31.98 2qox n VAL 3 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2qox s ILE 4 N -3.85 3.82 -1.25 1.34 1.09 0.14 -3.14 121.20 119.35 2qox s ILE 4 Ca 0.00 -0.52 -0.10 0.00 -1.10 0.00 0.00 60.65 58.93 2qox s ILE 4 Cb 0.00 -2.60 0.18 0.00 -1.06 0.00 0.00 42.46 38.98 2qox s ILE 4 CO 0.00 0.54 1.72 0.18 -0.10 0.00 0.00 174.94 177.28 2qox n LEU 5 N 1.99 6.25 -0.76 2.97 4.77 0.42 -3.05 117.00 129.59 2qox n LEU 5 Ca -0.17 -4.65 0.00 0.00 -0.03 0.00 0.00 56.01 51.16 2qox n LEU 5 Cb 0.53 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 2qox n LEU 5 CO 0.28 1.24 0.11 0.18 -1.33 0.00 0.00 177.39 177.87 2qox n LEU 6 N 4.11 0.58 0.00 2.23 4.32 -1.25 0.53 117.00 127.52 2qox n LEU 6 Ca 0.38 -0.29 0.00 0.00 -0.02 0.00 0.00 56.01 56.08 2qox n LEU 6 Cb 0.38 -0.14 0.00 0.00 -1.62 0.00 0.00 43.42 42.04 2qox n LEU 6 CO 0.76 0.11 0.00 -0.67 -1.22 0.00 0.00 177.39 176.36 2qox n ASP 7 N 0.62 0.00 0.01 -1.43 2.03 -1.26 -4.64 116.55 111.88 2qox n ASP 7 Ca 0.00 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.28 2qox n ASP 7 Cb 0.11 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.50 2qox n ASP 7 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2qox n LYS 8 N 0.00 0.14 -4.12 -0.67 4.81 -1.26 -0.72 118.16 116.33 2qox n LYS 8 Ca 0.00 0.05 -0.36 0.00 -0.87 0.00 0.00 58.31 57.13 2qox n LYS 8 Cb 0.00 -0.74 -0.03 0.00 0.02 0.00 0.00 35.03 34.28 2qox n LYS 8 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2qox n VAL 9 N -3.68 -2.39 0.00 3.15 0.31 -1.26 -1.83 118.33 112.64 2qox n VAL 9 Ca -0.05 -0.58 0.00 0.00 -0.01 0.00 0.00 64.34 63.70 2qox n VAL 9 Cb 0.20 -2.03 0.00 0.00 -0.91 0.00 0.00 33.84 31.10 2qox n VAL 9 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qox n ALA 10 N -4.71 0.00 0.17 3.52 0.00 -1.26 -2.98 120.51 115.24 2qox n ALA 10 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2qox n ALA 10 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 2qox n ALA 10 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2qox n ASN 11 N 4.46 1.51 -2.75 0.00 4.13 -1.26 -4.11 115.26 117.24 2qox n ASN 11 Ca 0.00 -1.07 -0.00 0.00 1.68 0.00 0.00 54.58 55.19 2qox n ASN 11 Cb 0.00 -0.29 0.02 0.00 -1.54 0.00 0.00 39.78 37.97 2qox n ASN 11 CO 0.00 0.00 0.00 -1.48 0.28 0.00 0.00 177.26 176.06 2qox s LEU 12 N 0.00 -0.39 0.03 3.41 2.34 -1.16 -5.17 118.68 117.74 2qox s LEU 12 Ca 0.00 -0.29 -0.28 0.00 0.06 0.00 0.00 54.13 53.62 2qox s LEU 12 Cb 0.00 0.50 0.07 0.00 -0.56 0.00 0.00 46.19 46.20 2qox s LEU 12 CO 0.00 -0.03 0.66 -0.83 -1.06 0.00 0.00 176.35 175.09 2qox s GLY 13 N 1.59 -0.58 0.00 -3.48 0.00 -0.76 -4.24 107.32 99.84 2qox s GLY 13 Ca 0.18 1.02 0.00 0.00 0.00 0.00 0.00 44.72 45.92 2qox s GLY 13 CO -0.13 0.65 0.00 1.44 0.00 0.00 0.00 173.10 175.06 2qox n SER 14 N 0.39 0.00 -3.66 1.64 7.64 0.10 -4.87 113.62 114.86 2qox n SER 14 Ca -0.18 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.47 2qox n SER 14 Cb 0.60 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.80 2qox n SER 14 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2qox n LEU 15 N 0.00 -1.64 0.00 -3.43 -0.00 0.19 -4.22 117.00 107.89 2qox n LEU 15 Ca 0.00 -0.86 0.00 0.00 -0.00 0.00 0.00 56.01 55.15 2qox n LEU 15 Cb 0.00 -1.44 0.00 0.00 -0.00 0.00 0.00 43.42 41.98 2qox n LEU 15 CO 0.00 0.36 0.00 0.61 -0.00 0.00 0.00 177.39 178.36 2qox n GLY 16 N -1.47 0.70 3.09 -3.96 0.00 0.84 -4.85 105.19 99.54 2qox n GLY 16 Ca -0.29 -0.28 -0.28 0.00 0.00 0.00 0.00 46.02 45.18 2qox n GLY 16 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qox s ASP 17 N -0.77 2.31 -0.41 1.61 2.15 -1.24 -4.78 116.67 115.53 2qox s ASP 17 Ca 0.00 -0.40 -0.17 0.00 0.43 0.00 0.00 52.55 52.40 2qox s ASP 17 Cb 0.00 -1.05 0.02 0.00 -0.30 0.00 0.00 42.92 41.58 2qox s ASP 17 CO 0.00 0.06 0.45 -1.58 -0.17 0.00 0.00 175.17 173.93 2qox s GLN 18 N 0.65 3.15 -0.01 4.34 0.74 -1.26 0.16 119.66 127.43 2qox s GLN 18 Ca -0.14 -0.69 -0.00 0.00 0.05 0.00 0.00 55.36 54.58 2qox s GLN 18 Cb -0.16 -3.95 0.02 0.00 1.10 0.00 0.00 33.01 30.02 2qox s GLN 18 CO 0.04 -0.83 0.02 0.14 -0.55 0.00 0.00 175.29 174.11 2qox s VAL 19 N 2.18 -0.04 0.25 1.34 -7.23 -0.95 -5.00 120.40 110.96 2qox s VAL 19 Ca 0.13 0.14 -0.31 0.00 -1.81 0.00 0.00 61.98 60.14 2qox s VAL 19 Cb -0.17 -0.06 -0.11 0.00 0.56 0.00 0.00 36.38 36.60 2qox s VAL 19 CO 0.14 0.06 1.62 0.21 -0.31 0.00 0.00 175.10 176.82 2qox s ASN 20 N 0.71 6.41 -0.20 4.85 3.84 -1.26 -4.41 114.94 124.89 2qox s ASN 20 Ca -0.06 2.88 -0.17 0.00 0.21 0.00 0.00 52.86 55.72 2qox s ASN 20 Cb -0.09 -2.62 0.05 0.00 -0.55 0.00 0.00 41.25 38.05 2qox s ASN 20 CO -0.02 -0.91 0.52 0.54 -2.79 0.00 0.00 177.10 174.43 2qox s VAL 21 N 0.48 -0.00 0.12 -5.21 0.11 0.06 -4.98 120.40 110.97 2qox s VAL 21 Ca 0.67 0.01 -0.35 0.00 -2.93 0.00 0.00 61.98 59.38 2qox s VAL 21 Cb -0.48 -0.72 -0.16 0.00 -1.53 0.00 0.00 36.38 33.49 2qox s VAL 21 CO 0.41 0.00 1.35 0.29 -3.33 0.00 0.00 175.10 173.82 2qox n LYS 22 N 2.98 1.34 0.28 1.54 4.76 -1.26 -3.95 118.16 123.85 2qox n LYS 22 Ca -0.15 0.48 0.10 0.00 -2.87 0.00 0.00 58.31 55.88 2qox n LYS 22 Cb 0.56 -2.12 0.56 0.00 -1.84 0.00 0.00 35.03 32.19 2qox n LYS 22 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qox h ALA 23 N 4.56 1.38 -0.11 7.82 0.00 -1.91 0.12 119.26 131.12 2qox h ALA 23 Ca -0.46 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 2qox h ALA 23 Cb 1.32 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 2qox h ALA 23 CO 0.78 -0.38 -0.03 0.78 0.00 0.00 0.00 179.25 180.40 2qox h GLY 24 N 0.00 0.24 2.00 0.00 0.00 -1.92 -2.37 103.07 101.02 2qox h GLY 24 Ca 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 47.33 47.11 2qox h GLY 24 CO 0.00 0.18 -0.12 -1.82 0.00 0.00 0.00 176.54 174.78 2qox h TYR 25 N -0.10 0.00 -3.93 5.60 3.20 -1.11 -3.39 116.97 117.24 2qox h TYR 25 Ca 0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2qox h TYR 25 Cb 0.44 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.71 2qox h TYR 25 CO 0.05 0.12 0.00 0.00 -1.64 0.00 0.00 178.16 176.69 2qox n ALA 26 N -2.45 0.00 -2.93 1.82 0.00 -0.90 0.15 120.51 116.20 2qox n ALA 26 Ca -0.02 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.25 2qox n ALA 26 Cb 0.20 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.61 2qox n ALA 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qox n ARG 27 N -0.93 -0.91 0.00 0.00 5.12 -1.21 -3.67 116.66 115.06 2qox n ARG 27 Ca 0.00 0.05 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 2qox n ARG 27 Cb 0.00 -1.79 0.00 0.00 -1.16 0.00 0.00 32.46 29.51 2qox n ARG 27 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2qox n ASN 28 N -0.71 0.00 0.00 0.55 5.03 -1.26 -4.93 115.26 113.93 2qox n ASN 28 Ca -0.02 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.43 2qox n ASN 28 Cb 0.22 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.98 2qox n ASN 28 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 2qox n PHE 29 N 0.00 -0.24 -0.23 3.10 7.35 -1.22 -4.93 117.46 121.28 2qox n PHE 29 Ca 0.00 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 56.76 2qox n PHE 29 Cb 0.00 0.05 0.14 0.00 0.35 0.00 0.00 39.48 40.02 2qox n PHE 29 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2qox n LEU 30 N -1.01 -0.17 0.00 -2.13 4.77 0.39 -3.23 117.00 115.64 2qox n LEU 30 Ca 0.00 1.13 0.00 0.00 -0.03 0.00 0.00 56.01 57.11 2qox n LEU 30 Cb 0.00 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 2qox n LEU 30 CO 0.00 -1.11 0.00 0.52 -1.33 0.00 0.00 177.39 175.47 2qox n VAL 31 N -4.98 0.00 -0.64 4.08 0.31 -1.26 -0.60 118.33 115.24 2qox n VAL 31 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 2qox n VAL 31 Cb 0.41 -0.23 0.00 0.00 -0.91 0.00 0.00 33.84 33.11 2qox n VAL 31 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2qox n PRO 32 N -0.38 0.00 0.00 5.55 -0.02 -1.20 0.13 135.00 139.09 2qox n PRO 32 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2qox n PRO 32 Cb 0.00 -0.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.84 2qox n PRO 32 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2qox n GLN 33 N 2.68 0.00 0.00 -0.52 6.02 -1.26 -4.69 117.38 119.61 2qox n GLN 33 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2qox n GLN 33 Cb 0.27 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.53 2qox n GLN 33 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qox n GLY 34 N 0.00 2.63 0.00 1.08 0.00 0.36 -4.95 105.19 104.31 2qox n GLY 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2qox n GLY 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qox n LYS 35 N -0.80 0.00 -3.63 1.61 4.76 -1.09 -4.64 118.16 114.37 2qox n LYS 35 Ca 0.00 0.19 -0.06 0.00 -2.87 0.00 0.00 58.31 55.57 2qox n LYS 35 Cb 0.00 -1.55 -0.02 0.00 -1.84 0.00 0.00 35.03 31.62 2qox n LYS 35 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qox s ALA 36 N -2.28 -1.72 -0.22 7.82 0.00 0.23 -3.83 121.76 121.77 2qox s ALA 36 Ca 0.00 0.54 -0.11 0.00 0.00 0.00 0.00 51.96 52.39 2qox s ALA 36 Cb 0.00 0.55 0.08 0.00 0.00 0.00 0.00 23.12 23.75 2qox s ALA 36 CO 0.00 -0.87 0.51 0.54 0.00 0.00 0.00 175.76 175.95 2qox s VAL 37 N -3.24 -0.25 0.37 0.00 0.11 -1.17 -4.45 120.40 111.76 2qox s VAL 37 Ca 0.08 0.07 -0.24 0.00 -2.93 0.00 0.00 61.98 58.97 2qox s VAL 37 Cb -0.01 -0.77 -0.14 0.00 -1.53 0.00 0.00 36.38 33.93 2qox s VAL 37 CO -0.04 0.03 0.54 -2.65 -3.33 0.00 0.00 175.10 169.65 2qox n PRO 38 N 4.64 0.51 -1.23 1.54 -0.02 -1.26 0.27 135.00 139.46 2qox n PRO 38 Ca -0.18 0.19 -0.21 0.00 -2.02 0.00 0.00 63.50 61.28 2qox n PRO 38 Cb 0.54 -1.41 -0.11 0.00 -0.02 0.00 0.00 33.50 32.50 2qox n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qox n ALA 39 N -0.63 6.57 0.22 3.55 0.00 -1.26 -4.64 120.51 124.32 2qox n ALA 39 Ca 0.12 -2.49 0.00 0.00 0.00 0.00 0.00 53.44 51.07 2qox n ALA 39 Cb 0.37 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.39 2qox n ALA 39 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2qox n THR 40 N 2.15 0.00 0.00 0.00 -2.24 -1.26 -4.80 114.28 108.13 2qox n THR 40 Ca 0.50 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.28 2qox n THR 40 Cb 0.70 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 2qox n THR 40 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2qox n LYS 41 N -0.02 0.00 -0.26 -0.78 4.76 -1.26 -3.83 118.16 116.78 2qox n LYS 41 Ca 0.00 0.00 0.04 0.00 -2.87 0.00 0.00 58.31 55.48 2qox n LYS 41 Cb 0.02 0.00 0.17 0.00 -1.84 0.00 0.00 35.03 33.38 2qox n LYS 41 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 2qox h LYS 42 N 0.00 0.50 -0.13 1.97 3.11 -1.96 0.10 116.57 120.15 2qox h LYS 42 Ca 0.00 -0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.81 2qox h LYS 42 Cb 0.00 -0.11 0.00 0.00 -1.00 0.00 0.00 32.23 31.12 2qox h LYS 42 CO 0.00 0.33 0.00 -1.71 -2.81 0.00 0.00 179.45 175.26 2qox n ASN 43 N -4.94 1.31 -0.53 4.20 2.85 -1.25 -3.27 115.26 113.63 2qox n ASN 43 Ca 0.13 -1.66 0.06 0.00 -0.11 0.00 0.00 54.58 53.01 2qox n ASN 43 Cb 0.37 -0.09 0.07 0.00 1.24 0.00 0.00 39.78 41.37 2qox n ASN 43 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 2qox n ILE 44 N 0.09 0.16 -0.01 -1.44 -5.35 0.30 -4.56 119.36 108.55 2qox n ILE 44 Ca 0.15 -0.58 -0.13 0.00 -0.27 0.00 0.00 62.75 61.93 2qox n ILE 44 Cb 0.27 1.14 -0.10 0.00 -1.74 0.00 0.00 39.64 39.21 2qox n ILE 44 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 2qox h GLU 45 N 2.40 -0.04 -0.90 6.28 5.08 -1.37 -3.02 114.58 123.01 2qox h GLU 45 Ca 0.00 0.00 0.24 0.00 -1.00 0.00 0.00 59.36 58.60 2qox h GLU 45 Cb 0.55 0.01 -0.16 0.00 0.50 0.00 0.00 28.75 29.65 2qox h GLU 45 CO 0.00 0.53 0.06 0.74 -1.00 0.00 0.00 179.01 179.34 2qox h PHE 46 N -0.65 0.02 0.14 4.33 0.05 -1.80 0.24 116.94 119.27 2qox h PHE 46 Ca -0.00 0.06 -0.00 0.00 3.82 0.00 0.00 57.97 61.84 2qox h PHE 46 Cb 0.59 0.14 -0.00 0.00 2.00 0.00 0.00 35.95 38.68 2qox h PHE 46 CO 0.13 -0.34 -0.08 0.74 -0.18 0.00 0.00 178.31 178.57 2qox h PHE 47 N 0.07 -0.22 -0.70 -0.55 0.04 -1.84 -2.40 116.94 111.33 2qox h PHE 47 Ca 0.54 -0.00 0.15 0.00 2.80 0.00 0.00 57.97 61.45 2qox h PHE 47 Cb 1.07 0.08 -0.10 0.00 2.20 0.00 0.00 35.95 39.19 2qox h PHE 47 CO -0.44 -0.13 0.17 1.49 -0.60 0.00 0.00 178.31 178.80 2qox h GLU 48 N -0.22 0.27 0.00 1.51 4.22 -0.44 1.36 114.58 121.29 2qox h GLU 48 Ca -0.01 -0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.41 2qox h GLU 48 Cb 0.18 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 2qox h GLU 48 CO 0.02 0.18 -0.02 0.00 -2.18 0.00 0.00 179.01 177.00 2qox h ALA 49 N 1.57 1.95 0.10 2.92 0.00 -0.92 -2.35 119.26 122.53 2qox h ALA 49 Ca 0.39 -0.02 -0.33 0.00 0.00 0.00 0.00 54.91 54.95 2qox h ALA 49 Cb 0.63 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2qox h ALA 49 CO -0.48 0.03 -1.75 -0.09 0.00 0.00 0.00 179.25 176.96 2qox h ARG 50 N 0.00 0.21 -0.02 0.00 9.65 0.58 -1.95 114.38 122.85 2qox h ARG 50 Ca -0.00 -0.37 0.00 0.00 -1.10 0.00 0.00 59.98 58.51 2qox h ARG 50 Cb 0.04 0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.75 2qox h ARG 50 CO 0.00 1.03 0.00 0.54 2.80 0.00 0.00 179.97 184.35 2qox n ARG 51 N -3.39 0.36 0.00 0.20 1.74 0.41 -1.21 116.66 114.78 2qox n ARG 51 Ca -0.22 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.86 2qox n ARG 51 Cb 1.05 -1.01 0.00 0.00 -1.02 0.00 0.00 32.46 31.48 2qox n ARG 51 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qox n ALA 52 N -0.45 0.00 -0.05 7.54 0.00 -1.14 -4.79 120.51 121.61 2qox n ALA 52 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 2qox n ALA 52 Cb 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.44 2qox n ALA 52 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2qox n GLU 53 N 0.00 0.30 0.00 0.00 0.00 -0.35 -3.78 120.64 116.82 2qox n GLU 53 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 57.16 57.35 2qox n GLU 53 Cb 0.02 -1.11 0.00 0.00 0.00 0.00 0.00 31.44 30.35 2qox n GLU 53 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2qox n LEU 54 N -3.65 0.30 -0.82 4.31 4.77 -0.71 0.06 117.00 121.25 2qox n LEU 54 Ca -0.07 -0.15 0.03 0.00 -0.03 0.00 0.00 56.01 55.79 2qox n LEU 54 Cb 0.27 -0.15 0.05 0.00 -2.33 0.00 0.00 43.42 41.26 2qox n LEU 54 CO 0.11 0.07 0.23 -0.62 -1.33 0.00 0.00 177.39 175.85 2qox n GLU 55 N -0.16 0.31 0.00 3.23 1.02 -1.25 -4.49 120.64 119.30 2qox n GLU 55 Ca 0.00 -1.78 0.00 0.00 -0.02 0.00 0.00 57.16 55.36 2qox n GLU 55 Cb 0.07 -0.55 0.00 0.00 -0.02 0.00 0.00 31.44 30.94 2qox n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qox n ALA 56 N -0.10 0.00 -0.18 0.62 0.00 -0.82 -4.72 120.51 115.31 2qox n ALA 56 Ca 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.42 2qox n ALA 56 Cb 0.86 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.32 2qox n ALA 56 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2qox h LYS 57 N 0.00 0.75 0.00 0.00 1.63 -0.52 -2.23 116.57 116.20 2qox h LYS 57 Ca 0.00 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 59.68 2qox h LYS 57 Cb 0.00 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 31.50 2qox h LYS 57 CO 0.00 0.64 -1.40 1.28 -3.45 0.00 0.00 179.45 176.52 2qox n LEU 58 N -4.58 0.24 -0.03 5.20 4.77 -1.08 -3.53 117.00 117.98 2qox n LEU 58 Ca 0.02 -0.16 -0.13 0.00 -0.03 0.00 0.00 56.01 55.71 2qox n LEU 58 Cb 0.13 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.14 2qox n LEU 58 CO 0.37 0.06 0.66 0.00 -1.33 0.00 0.00 177.39 177.15 2qox h ALA 59 N 1.68 0.12 -0.01 -1.18 0.00 -1.77 -3.17 119.26 114.94 2qox h ALA 59 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2qox h ALA 59 Cb 0.61 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2qox h ALA 59 CO 0.00 -0.11 -0.47 -1.91 0.00 0.00 0.00 179.25 176.76 2qox n GLU 60 N -4.74 0.53 0.00 0.00 4.07 -0.84 -4.02 120.64 115.64 2qox n GLU 60 Ca -0.07 -0.36 0.02 0.00 -0.06 0.00 0.00 57.16 56.70 2qox n GLU 60 Cb 0.27 -1.49 0.14 0.00 -0.06 0.00 0.00 31.44 30.30 2qox n GLU 60 CO 0.00 0.00 0.00 1.55 -0.06 0.00 0.00 177.13 178.62 2qox n VAL 61 N -0.92 0.12 0.63 6.31 3.14 -1.20 -1.66 118.33 124.75 2qox n VAL 61 Ca 0.09 0.03 0.06 0.00 -2.96 0.00 0.00 64.34 61.56 2qox n VAL 61 Cb 0.36 -0.95 0.33 0.00 -1.06 0.00 0.00 33.84 32.52 2qox n VAL 61 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2qox n LEU 62 N -1.03 0.00 -0.29 6.55 -0.00 -1.26 -3.53 117.00 117.44 2qox n LEU 62 Ca 0.03 0.24 -0.01 0.00 -0.00 0.00 0.00 56.01 56.28 2qox n LEU 62 Cb 0.02 -0.24 0.05 0.00 -0.00 0.00 0.00 43.42 43.25 2qox n LEU 62 CO 0.03 -0.14 0.64 0.00 -0.00 0.00 0.00 177.39 177.92 2qox h ALA 63 N 2.63 0.23 -1.10 1.47 0.00 -1.67 0.52 119.26 121.34 2qox h ALA 63 Ca 0.00 0.26 0.30 0.00 0.00 0.00 0.00 54.91 55.47 2qox h ALA 63 Cb 0.10 0.80 -0.09 0.00 0.00 0.00 0.00 17.79 18.61 2qox h ALA 63 CO 0.00 -0.56 0.73 0.00 0.00 0.00 0.00 179.25 179.42 2qox h ALA 64 N 1.41 2.50 0.16 0.00 0.00 -1.88 0.15 119.26 121.61 2qox h ALA 64 Ca 0.33 0.04 -0.30 0.00 0.00 0.00 0.00 54.91 54.98 2qox h ALA 64 Cb 0.59 0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.46 2qox h ALA 64 CO -0.84 -0.91 -1.30 0.00 0.00 0.00 0.00 179.25 176.20 2qox h ALA 65 N 1.57 0.02 -0.22 0.00 0.00 -0.27 -2.76 119.26 117.60 2qox h ALA 65 Ca 0.61 -0.84 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 2qox h ALA 65 Cb 1.79 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.65 2qox h ALA 65 CO -0.23 0.81 -0.05 -0.91 0.00 0.00 0.00 179.25 178.87 2qox h ASN 66 N 0.15 0.30 0.96 0.00 2.35 0.19 -2.47 115.58 117.06 2qox h ASN 66 Ca -0.18 -0.05 -0.22 0.00 -0.55 0.00 0.00 56.30 55.30 2qox h ASN 66 Cb 1.99 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 40.25 2qox h ASN 66 CO 0.23 0.40 -1.07 0.00 -1.65 0.00 0.00 177.43 175.34 2qox h ALA 67 N 1.64 0.42 -0.30 -0.83 0.00 -1.34 -3.35 119.26 115.50 2qox h ALA 67 Ca 0.07 -0.96 0.07 0.00 0.00 0.00 0.00 54.91 54.09 2qox h ALA 67 Cb 0.30 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.94 2qox h ALA 67 CO 0.01 1.26 -0.26 0.00 0.00 0.00 0.00 179.25 180.26 2qox h ARG 68 N 0.00 -0.23 -0.74 0.00 2.47 -1.13 -2.55 114.38 112.21 2qox h ARG 68 Ca -0.05 0.02 0.07 0.00 -1.26 0.00 0.00 59.98 58.76 2qox h ARG 68 Cb 1.78 0.05 -0.09 0.00 -1.65 0.00 0.00 29.97 30.06 2qox h ARG 68 CO 0.12 -0.15 -0.45 0.00 0.56 0.00 0.00 179.97 180.04 2qox h ALA 69 N 0.82 -0.44 -0.20 0.04 0.00 -1.68 -1.00 119.26 116.79 2qox h ALA 69 Ca 0.15 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 2qox h ALA 69 Cb 0.48 1.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.54 2qox h ALA 69 CO -0.44 -0.76 -0.06 1.05 0.00 0.00 0.00 179.25 179.04 2qox h GLU 70 N -0.02 0.31 -0.58 0.00 -0.00 -1.73 0.83 114.58 113.39 2qox h GLU 70 Ca 0.12 -0.06 0.00 0.00 -0.00 0.00 0.00 59.36 59.42 2qox h GLU 70 Cb 0.33 -0.05 -0.03 0.00 -0.00 0.00 0.00 28.75 29.00 2qox h GLU 70 CO -0.71 0.39 0.37 0.87 -0.00 0.00 0.00 179.01 179.93 2qox h LYS 71 N 0.30 0.77 0.00 1.06 6.56 -0.78 0.24 116.57 124.72 2qox h LYS 71 Ca 0.07 -0.05 -0.23 0.00 -1.06 0.00 0.00 60.65 59.37 2qox h LYS 71 Cb 0.30 -0.17 -0.04 0.00 -0.57 0.00 0.00 32.23 31.75 2qox h LYS 71 CO 0.01 0.52 -1.98 0.44 -2.06 0.00 0.00 179.45 176.38 2qox n ILE 72 N -4.44 1.08 -0.05 1.86 -5.35 -0.92 -4.07 119.36 107.48 2qox n ILE 72 Ca 0.06 -0.74 -0.15 0.00 -0.27 0.00 0.00 62.75 61.65 2qox n ILE 72 Cb 0.05 -0.50 -0.07 0.00 -1.74 0.00 0.00 39.64 37.38 2qox n ILE 72 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 2qox h ASN 73 N 0.00 0.75 -0.55 7.28 4.21 0.99 -3.08 115.58 125.18 2qox h ASN 73 Ca -0.31 -0.58 -0.00 0.00 1.21 0.00 0.00 56.30 56.62 2qox h ASN 73 Cb 1.80 -0.22 -0.03 0.00 -1.12 0.00 0.00 38.32 38.75 2qox h ASN 73 CO 0.03 1.19 0.34 0.00 -1.29 0.00 0.00 177.43 177.71 2qox h ALA 74 N 0.58 1.56 0.00 -0.83 0.00 -0.72 0.26 119.26 120.10 2qox h ALA 74 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2qox h ALA 74 Cb 1.10 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2qox h ALA 74 CO 0.11 0.39 0.00 1.28 0.00 0.00 0.00 179.25 181.03 2qox n LEU 75 N -4.43 0.00 0.00 0.00 4.77 -1.16 -4.88 117.00 111.30 2qox n LEU 75 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2qox n LEU 75 Cb 0.07 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2qox n LEU 75 CO 0.36 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 175.80 2qox n GLU 76 N -0.92 0.00 -2.17 3.23 1.02 0.91 -4.58 120.64 118.13 2qox n GLU 76 Ca 0.07 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.94 2qox n GLU 76 Cb 0.03 0.00 0.07 0.00 -0.02 0.00 0.00 31.44 31.52 2qox n GLU 76 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2qox s THR 77 N 0.00 2.42 -0.11 2.62 -4.23 -1.25 -3.13 115.64 111.96 2qox s THR 77 Ca 0.00 -0.18 -0.03 0.00 -1.18 0.00 0.00 61.69 60.29 2qox s THR 77 Cb 0.00 -3.06 0.05 0.00 1.34 0.00 0.00 72.50 70.82 2qox s THR 77 CO 0.00 -0.07 0.09 -0.69 -0.54 0.00 0.00 174.62 173.41 2qox s VAL 78 N -3.27 -0.12 -0.06 2.29 1.01 -0.35 -4.90 120.40 115.01 2qox s VAL 78 Ca 0.60 0.15 -0.17 0.00 0.00 0.00 0.00 61.98 62.55 2qox s VAL 78 Cb -0.11 -0.36 -0.05 0.00 0.00 0.00 0.00 36.38 35.86 2qox s VAL 78 CO 0.46 -0.03 0.47 -0.89 0.00 0.00 0.00 175.10 175.10 2qox s THR 79 N 2.17 5.08 0.52 3.92 2.01 -1.26 -2.97 115.64 125.12 2qox s THR 79 Ca 0.04 0.97 0.03 0.00 0.31 0.00 0.00 61.69 63.03 2qox s THR 79 Cb -0.14 -3.80 0.01 0.00 0.01 0.00 0.00 72.50 68.58 2qox s THR 79 CO -0.06 0.43 0.16 0.27 -0.69 0.00 0.00 174.62 174.72 2qox s ILE 80 N -0.07 1.36 -0.04 1.82 -5.25 -1.22 -5.02 121.20 112.79 2qox s ILE 80 Ca 0.26 -1.80 0.03 0.00 -0.99 0.00 0.00 60.65 58.15 2qox s ILE 80 Cb -0.16 -2.16 0.00 0.00 2.95 0.00 0.00 42.46 43.09 2qox s ILE 80 CO 0.12 0.00 -0.12 0.00 -1.79 0.00 0.00 174.94 173.16 2qox s ALA 81 N -2.84 1.11 -0.29 2.27 0.00 -1.26 -4.12 121.76 116.63 2qox s ALA 81 Ca 0.17 -0.44 -0.15 0.00 0.00 0.00 0.00 51.96 51.54 2qox s ALA 81 Cb 0.00 -0.41 0.11 0.00 0.00 0.00 0.00 23.12 22.82 2qox s ALA 81 CO 0.10 0.17 0.78 -1.12 0.00 0.00 0.00 175.76 175.69 2qox s SER 82 N 0.23 -0.84 0.04 0.00 0.01 -1.25 -5.08 113.70 106.81 2qox s SER 82 Ca -0.05 1.29 -0.37 0.00 1.31 0.00 0.00 55.95 58.14 2qox s SER 82 Cb -0.11 1.52 -0.16 0.00 0.21 0.00 0.00 66.02 67.48 2qox s SER 82 CO 0.01 -0.20 1.47 0.29 0.41 0.00 0.00 173.24 175.22 2qox n LYS 83 N 4.40 1.36 -4.55 12.44 4.01 -1.26 -4.50 118.16 130.07 2qox n LYS 83 Ca -0.17 0.49 -0.27 0.00 -0.51 0.00 0.00 58.31 57.85 2qox n LYS 83 Cb 0.56 -2.17 -0.08 0.00 -0.51 0.00 0.00 35.03 32.83 2qox n LYS 83 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2qox s ALA 84 N 1.17 3.12 0.00 7.82 0.00 -1.26 -4.28 121.76 128.33 2qox s ALA 84 Ca 0.86 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 51.75 2qox s ALA 84 Cb -0.91 0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.88 2qox s ALA 84 CO 0.48 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.35 2qox n GLY 85 N -0.98 -0.93 3.15 0.00 0.00 -1.20 -4.83 105.19 100.40 2qox n GLY 85 Ca -0.08 0.22 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 2qox n GLY 85 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qox n ASP 86 N -1.88 -3.35 -0.33 1.61 8.00 -1.25 -4.75 116.55 114.60 2qox n ASP 86 Ca 0.00 -0.55 0.28 0.00 0.71 0.00 0.00 54.79 55.23 2qox n ASP 86 Cb 0.00 -0.91 0.52 0.00 -0.02 0.00 0.00 41.12 40.70 2qox n ASP 86 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2qox h GLU 87 N -3.05 0.02 0.00 -1.24 -0.00 -2.02 -3.34 114.58 104.95 2qox h GLU 87 Ca -0.36 -0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.00 2qox h GLU 87 Cb 1.08 -0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.82 2qox h GLU 87 CO 0.23 0.01 0.00 0.41 -0.00 0.00 0.00 179.01 179.66 2qox n GLY 88 N -1.32 0.00 3.60 1.06 0.00 -1.26 -4.90 105.19 102.37 2qox n GLY 88 Ca 0.34 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.93 2qox n GLY 88 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qox n LYS 89 N -0.08 1.37 -4.30 1.61 4.01 -1.26 -2.73 118.16 116.78 2qox n LYS 89 Ca 0.00 0.49 -0.30 0.00 -0.51 0.00 0.00 58.31 57.98 2qox n LYS 89 Cb 0.00 -1.94 -0.10 0.00 -0.51 0.00 0.00 35.03 32.48 2qox n LYS 89 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2qox s LEU 90 N 0.02 3.08 0.00 -0.35 1.02 -0.13 -3.28 118.68 119.04 2qox s LEU 90 Ca 0.60 -0.32 0.08 0.00 0.02 0.00 0.00 54.13 54.52 2qox s LEU 90 Cb -0.63 -1.84 0.29 0.00 0.02 0.00 0.00 46.19 44.03 2qox s LEU 90 CO 0.59 0.21 1.22 0.49 0.02 0.00 0.00 176.35 178.87 2qox n PHE 91 N 0.94 0.22 -2.21 0.29 3.01 -1.26 -4.88 117.46 113.56 2qox n PHE 91 Ca -0.14 -0.11 0.00 0.00 1.01 0.00 0.00 57.45 58.21 2qox n PHE 91 Cb 0.52 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.99 2qox n PHE 91 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qox n GLY 92 N 0.82 3.38 3.03 1.37 0.00 -1.26 -5.18 105.19 107.36 2qox n GLY 92 Ca 0.08 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 2qox n GLY 92 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qox s SER 93 N 1.73 0.70 0.01 1.61 1.04 -1.26 -4.68 113.70 112.85 2qox s SER 93 Ca 0.00 -0.47 0.03 0.00 0.48 0.00 0.00 55.95 55.99 2qox s SER 93 Cb 0.00 0.03 -0.01 0.00 0.10 0.00 0.00 66.02 66.14 2qox s SER 93 CO 0.00 -0.18 -0.11 -0.63 0.98 0.00 0.00 173.24 173.30 2qox s ILE 94 N -1.21 0.83 0.00 -1.02 1.09 -0.67 -5.05 121.20 115.18 2qox s ILE 94 Ca -0.09 -0.62 0.00 0.00 -1.10 0.00 0.00 60.65 58.84 2qox s ILE 94 Cb -0.09 -0.73 0.00 0.00 -1.06 0.00 0.00 42.46 40.58 2qox s ILE 94 CO 0.00 0.11 0.00 0.61 -0.10 0.00 0.00 174.94 175.56 2qox n GLY 95 N 2.48 -0.62 0.00 6.18 0.00 -1.26 -3.80 105.19 108.17 2qox n GLY 95 Ca -0.15 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2qox n GLY 95 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2qox n THR 96 N 0.00 0.00 0.38 2.61 5.66 -1.26 0.13 114.28 121.80 2qox n THR 96 Ca 0.00 0.51 0.02 0.00 -3.05 0.00 0.00 64.05 61.53 2qox n THR 96 Cb 0.00 -0.77 0.11 0.00 -1.55 0.00 0.00 70.33 68.12 2qox n THR 96 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 175.07 169.91 2qox n ARG 97 N -0.75 0.19 0.00 1.09 0.00 -1.26 -2.43 116.66 113.49 2qox n ARG 97 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2qox n ARG 97 Cb 0.00 -1.31 0.00 0.00 -0.00 0.00 0.00 32.46 31.15 2qox n ARG 97 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2qox n ASP 98 N -0.81 0.00 0.32 2.89 8.00 0.35 -4.37 116.55 122.92 2qox n ASP 98 Ca 0.03 0.00 0.15 0.00 0.71 0.00 0.00 54.79 55.68 2qox n ASP 98 Cb 0.01 -0.14 0.77 0.00 -0.02 0.00 0.00 41.12 41.74 2qox n ASP 98 CO 0.00 0.00 0.00 0.16 -0.39 0.00 0.00 177.20 176.97 2qox h ILE 99 N 0.00 0.03 0.20 0.53 3.07 -0.56 -2.40 117.51 118.38 2qox h ILE 99 Ca 0.00 0.00 -0.01 0.00 1.55 0.00 0.00 64.86 66.40 2qox h ILE 99 Cb 0.00 0.63 0.00 0.00 -0.27 0.00 0.00 36.82 37.18 2qox h ILE 99 CO 0.00 0.00 -0.10 0.00 -1.05 0.00 0.00 178.15 177.00 2qox h ALA 100 N 1.27 -0.64 -0.18 0.16 0.00 -1.63 -2.89 119.26 115.34 2qox h ALA 100 Ca 0.02 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.92 2qox h ALA 100 Cb 0.78 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2qox h ALA 100 CO -0.00 -0.62 0.28 -0.44 0.00 0.00 0.00 179.25 178.46 2qox h ASP 101 N -0.43 0.00 0.21 0.00 3.32 -1.65 -1.81 116.42 116.07 2qox h ASP 101 Ca -0.03 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 2qox h ASP 101 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 2qox h ASP 101 CO 0.05 0.00 -0.10 0.00 -1.72 0.00 0.00 179.24 177.46 2qox h ALA 102 N 1.62 -0.93 -0.26 3.45 0.00 -1.43 -0.73 119.26 120.97 2qox h ALA 102 Ca 0.09 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.01 2qox h ALA 102 Cb 0.64 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2qox h ALA 102 CO -0.00 -0.91 0.27 -0.24 0.00 0.00 0.00 179.25 178.37 2qox h VAL 103 N -0.32 0.48 -0.25 0.00 3.04 -1.26 0.37 116.25 118.30 2qox h VAL 103 Ca -0.03 0.00 -0.12 0.00 -1.01 0.00 0.00 66.70 65.54 2qox h VAL 103 Cb 0.22 0.78 -0.01 0.00 -2.01 0.00 0.00 31.29 30.27 2qox h VAL 103 CO 0.05 0.00 -0.35 0.74 -1.01 0.00 0.00 177.57 177.00 2qox h THR 104 N 0.00 1.29 0.00 3.17 2.02 -1.09 0.12 112.91 118.42 2qox h THR 104 Ca 0.12 -1.47 0.00 0.00 0.77 0.00 0.00 66.41 65.83 2qox h THR 104 Cb 0.67 1.47 0.00 0.00 -1.74 0.00 0.00 68.15 68.55 2qox h THR 104 CO -0.00 0.47 -0.28 0.00 0.37 0.00 0.00 175.52 176.07 2qox n ALA 105 N -2.50 2.73 0.85 6.16 0.00 0.11 -3.21 120.51 124.65 2qox n ALA 105 Ca -0.01 -0.17 0.11 0.00 0.00 0.00 0.00 53.44 53.37 2qox n ALA 105 Cb 0.48 -1.31 -0.01 0.00 0.00 0.00 0.00 19.45 18.60 2qox n ALA 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qox n ALA 106 N -1.68 4.09 0.00 0.00 0.00 -0.14 -5.03 120.51 117.74 2qox n ALA 106 Ca 0.05 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.99 2qox n ALA 106 Cb 0.39 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.95 2qox n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qox n GLY 107 N 1.46 0.67 3.55 0.00 0.00 0.36 -5.04 105.19 106.19 2qox n GLY 107 Ca 0.03 -0.15 -0.50 0.00 0.00 0.00 0.00 46.02 45.40 2qox n GLY 107 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2qox n VAL 108 N 0.00 0.93 0.00 1.61 0.31 -1.07 -4.68 118.33 115.43 2qox n VAL 108 Ca 0.00 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 2qox n VAL 108 Cb 0.00 -0.69 0.00 0.00 -0.91 0.00 0.00 33.84 32.24 2qox n VAL 108 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2qox n GLU 109 N 1.64 0.00 -2.49 5.55 4.07 -1.26 -2.62 120.64 125.53 2qox n GLU 109 Ca 0.16 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.26 2qox n GLU 109 Cb 0.23 -0.94 0.00 0.00 -0.06 0.00 0.00 31.44 30.67 2qox n GLU 109 CO 0.00 0.00 0.00 1.55 -0.06 0.00 0.00 177.13 178.62 2qox n VAL 110 N -0.45 -0.80 0.00 6.31 3.14 -1.26 -4.03 118.33 121.24 2qox n VAL 110 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2qox n VAL 110 Cb 0.00 -2.02 0.00 0.00 -1.06 0.00 0.00 33.84 30.76 2qox n VAL 110 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2qox n ALA 111 N 2.24 0.00 -1.82 1.55 0.00 -1.26 -4.66 120.51 116.57 2qox n ALA 111 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 2qox n ALA 111 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 2qox n ALA 111 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2qox n LYS 112 N 0.00 3.14 0.00 0.00 -0.00 -1.26 -4.65 118.16 115.38 2qox n LYS 112 Ca 0.00 -3.81 0.00 0.00 -0.00 0.00 0.00 58.31 54.50 2qox n LYS 112 Cb 0.00 -2.28 0.00 0.00 -0.00 0.00 0.00 35.03 32.75 2qox n LYS 112 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 2qox n SER 113 N -0.73 0.00 -3.95 -5.58 7.64 -1.26 -4.73 113.62 105.00 2qox n SER 113 Ca 0.52 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 60.26 2qox n SER 113 Cb 0.71 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.87 2qox n SER 113 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2qox n GLU 114 N 0.00 0.01 -3.20 1.43 0.28 -1.25 -4.81 120.64 113.10 2qox n GLU 114 Ca 0.00 -0.48 -0.39 0.00 -0.16 0.00 0.00 57.16 56.14 2qox n GLU 114 Cb 0.00 -1.77 -0.06 0.00 1.43 0.00 0.00 31.44 31.04 2qox n GLU 114 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2qox s VAL 115 N 5.29 4.69 -0.71 3.84 0.11 -1.26 -0.08 120.40 132.28 2qox s VAL 115 Ca 0.28 1.33 -0.12 0.00 -2.93 0.00 0.00 61.98 60.55 2qox s VAL 115 Cb 0.03 -3.96 -0.10 0.00 -1.53 0.00 0.00 36.38 30.83 2qox s VAL 115 CO 0.11 0.52 1.88 -1.14 -3.33 0.00 0.00 175.10 173.15 2qox n ARG 116 N 1.88 1.53 -3.82 1.54 0.00 0.92 -4.71 116.66 113.99 2qox n ARG 116 Ca -0.09 -1.44 -0.32 0.00 -0.00 0.00 0.00 57.85 56.01 2qox n ARG 116 Cb 0.50 -2.54 -0.11 0.00 0.00 0.00 0.00 32.46 30.31 2qox n ARG 116 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 2qox s LEU 117 N 0.42 4.95 0.32 6.15 2.96 -1.26 -3.51 118.68 128.70 2qox s LEU 117 Ca 0.42 -3.51 0.11 0.00 -0.22 0.00 0.00 54.13 50.92 2qox s LEU 117 Cb 0.11 -1.73 0.59 0.00 0.50 0.00 0.00 46.19 45.65 2qox s LEU 117 CO 0.04 -0.18 1.20 -2.65 -1.32 0.00 0.00 176.35 173.44 2qox n PRO 118 N 2.50 0.08 -3.19 0.98 -0.02 -1.26 -4.25 135.00 129.84 2qox n PRO 118 Ca 0.15 0.55 0.05 0.00 -2.02 0.00 0.00 63.50 62.23 2qox n PRO 118 Cb 0.35 -2.12 -0.03 0.00 -0.02 0.00 0.00 33.50 31.68 2qox n PRO 118 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2qox s ASN 119 N -3.25 -0.31 -0.77 2.55 6.03 -1.26 -5.09 114.94 112.84 2qox s ASN 119 Ca -0.01 0.26 -0.26 0.00 -1.03 0.00 0.00 52.86 51.82 2qox s ASN 119 Cb 0.03 1.29 -0.16 0.00 -3.03 0.00 0.00 41.25 39.38 2qox s ASN 119 CO 0.10 -0.06 2.51 0.61 -2.03 0.00 0.00 177.10 178.23 2qox n GLY 120 N 5.22 -0.19 0.00 0.45 0.00 -1.26 -4.72 105.19 104.70 2qox n GLY 120 Ca -0.08 0.76 0.00 0.00 0.00 0.00 0.00 46.02 46.71 2qox n GLY 120 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2qox n VAL 121 N 7.64 0.00 -1.88 1.61 0.24 -1.25 -4.87 118.33 119.83 2qox n VAL 121 Ca 0.53 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.66 2qox n VAL 121 Cb 0.29 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 32.62 2qox n VAL 121 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2qox n LEU 122 N 0.00 -1.49 0.05 1.34 7.99 -1.25 -1.68 117.00 121.96 2qox n LEU 122 Ca 0.00 0.22 -0.04 0.00 -0.01 0.00 0.00 56.01 56.18 2qox n LEU 122 Cb 0.00 -2.45 -0.09 0.00 -0.11 0.00 0.00 43.42 40.77 2qox n LEU 122 CO 0.00 -0.56 -0.09 0.03 -1.51 0.00 0.00 177.39 175.26 2qox h ARG 123 N 0.00 0.00 -4.77 3.23 3.08 -1.86 -3.40 114.38 110.67 2qox h ARG 123 Ca -0.37 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.01 2qox h ARG 123 Cb 1.20 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 31.05 2qox h ARG 123 CO 0.49 0.57 -0.52 -0.08 -1.07 0.00 0.00 179.97 179.36 2qox s THR 124 N -2.79 4.99 0.53 2.04 -1.32 -1.25 -0.96 115.64 116.87 2qox s THR 124 Ca -0.01 -0.25 -0.22 0.00 -1.21 0.00 0.00 61.69 60.00 2qox s THR 124 Cb 0.09 -3.52 -0.05 0.00 -1.51 0.00 0.00 72.50 67.50 2qox s THR 124 CO 0.80 0.06 1.36 0.42 -2.21 0.00 0.00 174.62 175.06 2qox s THR 125 N 1.68 2.12 -3.13 5.08 -4.23 -1.10 -4.78 115.64 111.28 2qox s THR 125 Ca 0.06 0.09 0.00 0.00 -1.18 0.00 0.00 61.69 60.66 2qox s THR 125 Cb -0.17 -3.05 0.00 0.00 1.34 0.00 0.00 72.50 70.62 2qox s THR 125 CO 0.09 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.78 2qox n GLY 126 N 0.69 0.80 3.72 3.99 0.00 -0.26 -4.84 105.19 109.28 2qox n GLY 126 Ca 0.09 -2.07 -0.30 0.00 0.00 0.00 0.00 46.02 43.74 2qox n GLY 126 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2qox s GLU 127 N -1.16 1.49 -0.28 1.61 1.03 -1.26 0.17 118.70 120.30 2qox s GLU 127 Ca 0.00 1.08 -0.19 0.00 0.03 0.00 0.00 54.97 55.89 2qox s GLU 127 Cb 0.00 -1.82 0.09 0.00 -0.80 0.00 0.00 34.13 31.60 2qox s GLU 127 CO 0.00 -2.15 0.76 -1.01 -1.33 0.00 0.00 175.26 171.53 2qox s HIS 128 N -2.85 -0.88 -0.59 4.83 3.76 0.44 -4.80 115.29 115.21 2qox s HIS 128 Ca 0.63 1.88 -0.13 0.00 -0.15 0.00 0.00 55.06 57.29 2qox s HIS 128 Cb -0.19 0.48 0.15 0.00 1.11 0.00 0.00 32.58 34.13 2qox s HIS 128 CO 0.57 -0.43 0.51 -1.21 -0.85 0.00 0.00 174.74 173.33 2qox s GLU 129 N 1.16 2.95 -0.16 1.40 8.01 -1.26 0.20 118.70 131.00 2qox s GLU 129 Ca -0.06 -1.94 -0.02 0.00 0.01 0.00 0.00 54.97 52.96 2qox s GLU 129 Cb -0.05 -4.19 0.05 0.00 -4.31 0.00 0.00 34.13 25.63 2qox s GLU 129 CO -0.13 -1.27 -0.00 0.08 0.01 0.00 0.00 175.26 173.95 2qox s VAL 130 N 1.12 0.68 0.69 2.63 1.01 -0.94 -4.96 120.40 120.62 2qox s VAL 130 Ca 0.08 -0.42 -0.01 0.00 0.00 0.00 0.00 61.98 61.63 2qox s VAL 130 Cb -0.24 -1.00 0.14 0.00 0.00 0.00 0.00 36.38 35.28 2qox s VAL 130 CO -0.01 0.01 0.95 -1.54 0.00 0.00 0.00 175.10 174.51 2qox n SER 131 N 5.02 1.24 -4.18 3.32 3.41 -1.23 -3.89 113.62 117.30 2qox n SER 131 Ca -0.09 -2.05 -0.11 0.00 -0.26 0.00 0.00 58.87 56.35 2qox n SER 131 Cb 0.48 -0.62 -0.10 0.00 -0.26 0.00 0.00 64.21 63.71 2qox n SER 131 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2qox s PHE 132 N -2.91 0.95 -0.07 7.33 5.36 -0.10 0.31 117.98 128.84 2qox s PHE 132 Ca 0.62 -0.93 -0.01 0.00 -0.96 0.00 0.00 56.93 55.66 2qox s PHE 132 Cb -0.03 -0.54 0.03 0.00 -0.34 0.00 0.00 43.02 42.13 2qox s PHE 132 CO 0.41 -0.16 -0.01 -0.65 -1.46 0.00 0.00 175.22 173.36 2qox s GLN 133 N -3.85 0.72 0.00 10.12 -0.21 0.88 -1.22 119.66 126.10 2qox s GLN 133 Ca 0.14 0.05 0.12 0.00 0.02 0.00 0.00 55.36 55.70 2qox s GLN 133 Cb 0.05 -1.02 -0.12 0.00 1.00 0.00 0.00 33.01 32.93 2qox s GLN 133 CO -0.03 -0.28 0.55 1.33 -2.12 0.00 0.00 175.29 174.74 2qox n VAL 134 N 5.02 0.00 -4.18 1.09 0.24 -1.21 -3.87 118.33 115.42 2qox n VAL 134 Ca -0.09 -0.23 -0.11 0.00 -2.04 0.00 0.00 64.34 61.87 2qox n VAL 134 Cb 0.50 1.02 -0.10 0.00 -1.47 0.00 0.00 33.84 33.79 2qox n VAL 134 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2qox s HIS 135 N -2.11 1.08 0.10 6.34 5.65 -1.25 -5.01 115.29 120.09 2qox s HIS 135 Ca 0.05 -1.33 -0.31 0.00 0.25 0.00 0.00 55.06 53.72 2qox s HIS 135 Cb 0.09 -0.53 -0.12 0.00 -1.18 0.00 0.00 32.58 30.85 2qox s HIS 135 CO 0.49 -0.62 1.60 0.77 -0.65 0.00 0.00 174.74 176.33 2qox h SER 136 N 2.66 -1.05 -0.56 9.88 0.02 -2.04 -2.76 113.55 119.70 2qox h SER 136 Ca -0.36 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2qox h SER 136 Cb 1.24 0.37 0.00 0.00 0.14 0.00 0.00 62.40 64.15 2qox h SER 136 CO 0.54 -0.49 0.00 -0.62 -1.14 0.00 0.00 176.83 175.11 2qox n GLU 137 N -5.46 2.92 -3.60 3.45 4.71 -1.26 -4.85 120.64 116.55 2qox n GLU 137 Ca -0.09 -2.27 -0.40 0.00 -0.01 0.00 0.00 57.16 54.39 2qox n GLU 137 Cb 0.37 -1.66 -0.11 0.00 -1.01 0.00 0.00 31.44 29.03 2qox n GLU 137 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2qox s VAL 138 N -1.56 4.69 -0.40 2.62 1.01 -1.04 -4.97 120.40 120.73 2qox s VAL 138 Ca 0.41 -0.68 0.09 0.00 0.00 0.00 0.00 61.98 61.80 2qox s VAL 138 Cb 0.25 -3.54 0.28 0.00 0.00 0.00 0.00 36.38 33.36 2qox s VAL 138 CO 0.23 -0.15 0.60 2.22 0.00 0.00 0.00 175.10 178.00 2qox n PHE 139 N 5.01 0.11 -1.71 5.22 1.16 -1.26 -3.29 117.46 122.71 2qox n PHE 139 Ca -0.12 -3.67 -0.42 0.00 -1.87 0.00 0.00 57.45 51.36 2qox n PHE 139 Cb 0.47 -0.38 -0.03 0.00 -1.61 0.00 0.00 39.48 37.93 2qox n PHE 139 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2qox s ALA 140 N -1.63 3.64 0.32 1.98 0.00 -0.36 -4.70 121.76 121.02 2qox s ALA 140 Ca 0.37 1.33 -0.19 0.00 0.00 0.00 0.00 51.96 53.47 2qox s ALA 140 Cb 0.22 -3.81 -0.09 0.00 0.00 0.00 0.00 23.12 19.43 2qox s ALA 140 CO -0.10 -1.45 0.80 0.15 0.00 0.00 0.00 175.76 175.16 2qox s LYS 141 N 3.92 4.17 -0.26 0.00 1.02 -1.26 -0.93 119.74 126.40 2qox s LYS 141 Ca 0.85 0.89 -0.21 0.00 0.02 0.00 0.00 55.97 57.51 2qox s LYS 141 Cb -0.43 -2.51 0.07 0.00 -0.52 0.00 0.00 37.83 34.44 2qox s LYS 141 CO 0.39 0.18 0.67 0.08 -0.92 0.00 0.00 175.35 175.76 2qox s VAL 142 N -1.89 -0.00 0.55 3.17 1.01 -1.25 -4.50 120.40 117.50 2qox s VAL 142 Ca 0.53 0.00 -0.15 0.00 0.00 0.00 0.00 61.98 62.36 2qox s VAL 142 Cb -0.12 -0.95 -0.06 0.00 0.00 0.00 0.00 36.38 35.25 2qox s VAL 142 CO 0.18 0.00 1.00 -0.63 0.00 0.00 0.00 175.10 175.65 2qox s ILE 143 N 0.72 4.52 -0.15 2.22 1.01 -1.18 -2.22 121.20 126.11 2qox s ILE 143 Ca -0.03 1.09 -0.04 0.00 0.00 0.00 0.00 60.65 61.67 2qox s ILE 143 Cb -0.05 -3.73 0.07 0.00 0.01 0.00 0.00 42.46 38.76 2qox s ILE 143 CO -0.05 -0.81 0.22 -0.69 0.00 0.00 0.00 174.94 173.62 2qox s VAL 144 N -2.78 -0.34 -0.21 2.92 1.01 0.54 -1.21 120.40 120.34 2qox s VAL 144 Ca 0.58 0.14 -0.11 0.00 0.00 0.00 0.00 61.98 62.60 2qox s VAL 144 Cb -0.11 -0.50 -0.05 0.00 0.00 0.00 0.00 36.38 35.72 2qox s VAL 144 CO 0.39 -0.00 0.16 0.21 0.00 0.00 0.00 175.10 175.86 2qox s ASN 145 N 2.35 6.21 0.06 3.32 3.84 -1.16 0.17 114.94 129.73 2qox s ASN 145 Ca 0.04 0.23 -0.07 0.00 0.21 0.00 0.00 52.86 53.28 2qox s ASN 145 Cb -0.13 -2.11 -0.05 0.00 -0.55 0.00 0.00 41.25 38.41 2qox s ASN 145 CO -0.09 0.13 0.32 -0.69 -2.79 0.00 0.00 177.10 173.98 2qox s VAL 146 N 0.58 5.22 -0.02 -5.21 1.01 0.45 -3.37 120.40 119.07 2qox s VAL 146 Ca 0.09 0.19 0.01 0.00 0.00 0.00 0.00 61.98 62.26 2qox s VAL 146 Cb -0.12 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.67 2qox s VAL 146 CO 0.01 0.27 -0.02 -0.69 0.00 0.00 0.00 175.10 174.67 2qox s VAL 147 N -1.41 0.26 0.00 2.92 1.01 -1.26 -1.11 120.40 120.81 2qox s VAL 147 Ca 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.29 2qox s VAL 147 Cb -0.13 -0.30 0.00 0.00 0.00 0.00 0.00 36.38 35.95 2qox s VAL 147 CO 0.19 0.14 0.00 0.00 0.00 0.00 0.00 175.10 175.43 2qox n ALA 148 N 3.78 0.00 -1.95 5.51 0.00 -1.26 -3.82 120.51 122.76 2qox n ALA 148 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2qox n ALA 148 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2qox n ALA 148 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89