#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qox s LYS 2 N 0.00 0.55 -0.34 0.00 0.00 -1.26 -5.12 119.74 113.57 2qox s LYS 2 Ca 0.00 1.17 0.06 0.00 0.00 0.00 0.00 55.97 57.20 2qox s LYS 2 Cb 0.00 0.33 0.18 0.00 0.00 0.00 0.00 37.83 38.34 2qox s LYS 2 CO 0.00 -0.18 0.56 0.15 0.00 0.00 0.00 175.35 175.88 2qox s LYS 3 N 2.07 0.64 0.02 1.78 3.01 -1.26 -5.15 119.74 120.84 2qox s LYS 3 Ca -0.08 0.07 -0.06 0.00 -1.01 0.00 0.00 55.97 54.90 2qox s LYS 3 Cb -0.09 0.03 -0.01 0.00 -1.01 0.00 0.00 37.83 36.76 2qox s LYS 3 CO -0.17 -1.11 0.10 0.54 0.51 0.00 0.00 175.35 175.21 2qox s VAL 4 N 2.31 0.11 0.70 3.17 0.11 -1.26 -5.16 120.40 120.38 2qox s VAL 4 Ca 0.13 -0.89 -0.18 0.00 -2.93 0.00 0.00 61.98 58.10 2qox s VAL 4 Cb -0.09 -0.60 -0.14 0.00 -1.53 0.00 0.00 36.38 34.03 2qox s VAL 4 CO -0.18 -0.49 -1.02 0.00 -3.33 0.00 0.00 175.10 170.08 2qox n GLN 5 N 1.18 0.00 0.00 1.54 10.64 -1.26 -4.92 117.38 124.56 2qox n GLN 5 Ca -0.21 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 54.96 2qox n GLN 5 Cb 0.57 -0.70 0.00 0.00 -0.86 0.00 0.00 30.24 29.24 2qox n GLN 5 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2qox n ALA 6 N -2.35 -1.25 -2.95 2.61 0.00 -1.26 -5.02 120.51 110.29 2qox n ALA 6 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.32 2qox n ALA 6 Cb 0.51 -0.30 0.01 0.00 0.00 0.00 0.00 19.45 19.67 2qox n ALA 6 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2qox n TYR 7 N 0.47 -3.29 -2.78 0.00 4.19 -1.26 -5.00 117.16 109.50 2qox n TYR 7 Ca 0.00 1.37 -0.25 0.00 3.31 0.00 0.00 57.90 62.33 2qox n TYR 7 Cb 0.00 -3.54 0.01 0.00 0.49 0.00 0.00 39.34 36.30 2qox n TYR 7 CO 0.00 0.00 0.00 0.14 0.91 0.00 0.00 176.86 177.91 2qox s VAL 8 N -2.13 4.12 -0.03 2.97 -7.23 0.38 -4.95 120.40 113.53 2qox s VAL 8 Ca 0.20 -0.23 -0.01 0.00 -1.81 0.00 0.00 61.98 60.13 2qox s VAL 8 Cb -0.05 -3.56 0.02 0.00 0.56 0.00 0.00 36.38 33.35 2qox s VAL 8 CO 0.75 -0.48 0.06 -0.54 -0.31 0.00 0.00 175.10 174.58 2qox s LYS 9 N -4.70 0.04 0.06 4.82 1.02 -1.26 -1.10 119.74 118.61 2qox s LYS 9 Ca 0.49 0.14 -0.22 0.00 0.02 0.00 0.00 55.97 56.40 2qox s LYS 9 Cb -0.10 -0.07 0.05 0.00 -0.52 0.00 0.00 37.83 37.19 2qox s LYS 9 CO 0.41 -0.07 0.52 -0.48 -0.92 0.00 0.00 175.35 174.82 2qox s LEU 10 N 0.43 -0.10 -0.48 3.17 0.05 -0.66 -5.01 118.68 116.10 2qox s LEU 10 Ca -0.03 0.14 -0.05 0.00 0.05 0.00 0.00 54.13 54.24 2qox s LEU 10 Cb -0.05 2.16 0.12 0.00 -2.05 0.00 0.00 46.19 46.37 2qox s LEU 10 CO -0.02 -0.74 0.31 -1.10 -0.55 0.00 0.00 176.35 174.25 2qox s GLN 11 N -2.61 2.30 0.09 1.48 -0.21 -1.26 -0.42 119.66 119.04 2qox s GLN 11 Ca -0.04 -1.93 0.06 0.00 0.02 0.00 0.00 55.36 53.47 2qox s GLN 11 Cb -0.00 -3.75 -0.04 0.00 1.00 0.00 0.00 33.01 30.21 2qox s GLN 11 CO -0.03 -1.14 -0.05 0.54 -2.12 0.00 0.00 175.29 172.49 2qox s VAL 12 N 1.01 3.72 1.05 1.09 0.11 -1.22 -4.92 120.40 121.24 2qox s VAL 12 Ca 0.09 -1.10 -0.17 0.00 -2.93 0.00 0.00 61.98 57.87 2qox s VAL 12 Cb -0.23 -2.75 0.07 0.00 -1.53 0.00 0.00 36.38 31.93 2qox s VAL 12 CO -0.03 0.13 0.10 0.00 -3.33 0.00 0.00 175.10 171.97 2qox n ALA 13 N 0.68 -3.66 -0.84 1.54 0.00 -1.26 -2.85 120.51 114.12 2qox n ALA 13 Ca -0.12 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.29 2qox n ALA 13 Cb 0.52 -1.60 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2qox n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qox n ALA 14 N -4.05 -0.07 -3.02 0.00 0.00 -1.21 -4.24 120.51 107.91 2qox n ALA 14 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.04 2qox n ALA 14 Cb 0.59 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.05 2qox n ALA 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qox n GLY 15 N -0.29 5.08 3.65 0.00 0.00 -1.26 -4.57 105.19 107.81 2qox n GLY 15 Ca 0.00 -2.65 -0.01 0.00 0.00 0.00 0.00 46.02 43.36 2qox n GLY 15 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2qox s MET 16 N -2.60 0.14 0.02 1.61 -2.45 -1.26 -5.03 119.30 109.72 2qox s MET 16 Ca 0.31 0.21 -0.29 0.00 -1.25 0.00 0.00 55.69 54.67 2qox s MET 16 Cb 0.04 0.04 0.10 0.00 1.25 0.00 0.00 34.83 36.26 2qox s MET 16 CO 0.09 -0.02 1.13 0.00 1.05 0.00 0.00 175.02 177.27 2qox s ALA 17 N 0.75 -1.99 0.00 4.11 0.00 -1.26 -4.36 121.76 119.01 2qox s ALA 17 Ca -0.03 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.58 2qox s ALA 17 Cb -0.03 0.40 0.00 0.00 0.00 0.00 0.00 23.12 23.48 2qox s ALA 17 CO -0.12 -0.96 0.00 -1.71 0.00 0.00 0.00 175.76 172.97 2qox n ASN 18 N -0.41 0.00 -4.51 0.00 2.85 -1.26 -4.98 115.26 106.95 2qox n ASN 18 Ca -0.07 0.00 -0.44 0.00 -0.11 0.00 0.00 54.58 53.97 2qox n ASN 18 Cb 0.61 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.63 2qox n ASN 18 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 2qox n PRO 19 N 0.00 0.84 0.27 1.20 -0.02 -1.26 -4.23 135.00 131.79 2qox n PRO 19 Ca 0.00 0.30 -0.14 0.00 -2.02 0.00 0.00 63.50 61.64 2qox n PRO 19 Cb 0.00 -1.59 -0.07 0.00 -0.02 0.00 0.00 33.50 31.81 2qox n PRO 19 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2qox h SER 20 N 1.34 -0.61 0.14 2.55 0.87 -1.97 -0.76 113.55 115.12 2qox h SER 20 Ca -0.38 -0.05 0.02 0.00 -1.23 0.00 0.00 61.79 60.14 2qox h SER 20 Cb 1.38 0.16 -0.04 0.00 -0.44 0.00 0.00 62.40 63.46 2qox h SER 20 CO 0.56 -0.24 -0.31 -0.65 -0.53 0.00 0.00 176.83 175.66 2qox h PRO 21 N -1.02 -0.53 0.55 2.24 0.11 -1.99 -3.20 132.00 128.17 2qox h PRO 21 Ca -0.07 0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.05 2qox h PRO 21 Cb 0.62 0.12 0.01 0.00 0.11 0.00 0.00 31.00 31.86 2qox h PRO 21 CO 0.12 -0.35 -0.27 -1.35 -0.21 0.00 0.00 178.00 175.94 2qox h PRO 22 N -0.55 -0.72 0.00 1.05 0.11 -1.96 -3.46 132.00 126.48 2qox h PRO 22 Ca 0.02 0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.18 2qox h PRO 22 Cb 0.56 0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.84 2qox h PRO 22 CO -0.17 -0.43 0.00 0.28 -0.21 0.00 0.00 178.00 177.48 2qox n VAL 23 N -5.36 0.00 0.00 3.15 0.31 -0.34 -4.80 118.33 111.29 2qox n VAL 23 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2qox n VAL 23 Cb 0.33 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.26 2qox n VAL 23 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2qox n GLY 24 N 5.00 1.93 0.51 2.92 0.00 -0.91 -1.54 105.19 113.11 2qox n GLY 24 Ca 0.00 0.51 0.37 0.00 0.00 0.00 0.00 46.02 46.90 2qox n GLY 24 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2qox h PRO 25 N 0.00 0.10 -0.16 1.61 0.11 -1.87 0.14 132.00 131.93 2qox h PRO 25 Ca 0.00 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.12 2qox h PRO 25 Cb 0.00 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.06 2qox h PRO 25 CO 0.00 0.07 -0.16 0.00 -0.21 0.00 0.00 178.00 177.70 2qox h ALA 26 N 1.46 -0.36 0.00 -0.75 0.00 -1.52 -2.66 119.26 115.42 2qox h ALA 26 Ca 0.76 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.67 2qox h ALA 26 Cb 2.55 0.90 0.00 0.00 0.00 0.00 0.00 17.79 21.24 2qox h ALA 26 CO -0.25 -0.45 -0.96 1.47 0.00 0.00 0.00 179.25 179.06 2qox n LEU 27 N -3.52 0.62 0.04 0.00 -0.00 -1.06 -4.12 117.00 108.97 2qox n LEU 27 Ca -0.01 0.02 0.14 0.00 -0.00 0.00 0.00 56.01 56.16 2qox n LEU 27 Cb 0.09 -0.11 0.60 0.00 -0.00 0.00 0.00 43.42 44.00 2qox n LEU 27 CO -0.01 0.03 1.16 1.23 -0.00 0.00 0.00 177.39 179.80 2qox h GLY 28 N 4.55 0.21 0.97 1.47 0.00 -0.45 -1.18 103.07 108.64 2qox h GLY 28 Ca 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 2qox h GLY 28 CO 0.00 0.04 0.23 1.46 0.00 0.00 0.00 176.54 178.27 2qox h GLN 29 N 0.16 0.59 -0.06 4.80 4.20 -1.64 -2.00 115.11 121.16 2qox h GLN 29 Ca 0.19 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.85 2qox h GLN 29 Cb 0.56 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 2qox h GLN 29 CO -0.03 0.48 0.06 1.96 -0.67 0.00 0.00 178.83 180.63 2qox h GLN 30 N 0.54 0.00 0.00 1.46 1.08 -1.47 -3.45 115.11 113.27 2qox h GLN 30 Ca 0.15 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2qox h GLN 30 Cb 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 2qox h GLN 30 CO -0.02 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.27 2qox n GLY 31 N -1.45 1.69 3.82 3.46 0.00 -0.75 -5.03 105.19 106.93 2qox n GLY 31 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2qox n GLY 31 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qox s VAL 32 N -2.00 4.30 -0.74 1.61 1.01 -1.16 -4.83 120.40 118.58 2qox s VAL 32 Ca 0.00 1.26 -0.20 0.00 0.00 0.00 0.00 61.98 63.04 2qox s VAL 32 Cb 0.00 -3.60 0.11 0.00 0.00 0.00 0.00 36.38 32.88 2qox s VAL 32 CO 0.00 -0.48 0.94 0.20 0.00 0.00 0.00 175.10 175.76 2qox s ASN 33 N -2.59 6.36 0.08 3.32 0.02 -1.26 -4.67 114.94 116.20 2qox s ASN 33 Ca 0.62 -1.55 -0.18 0.00 -1.02 0.00 0.00 52.86 50.72 2qox s ASN 33 Cb -0.11 -2.37 -0.05 0.00 0.02 0.00 0.00 41.25 38.73 2qox s ASN 33 CO 0.24 -1.19 1.30 0.40 0.02 0.00 0.00 177.10 177.88 2qox h ILE 34 N 5.85 0.00 -0.61 0.60 1.08 -1.94 -2.33 117.51 120.16 2qox h ILE 34 Ca -0.12 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.44 2qox h ILE 34 Cb 1.06 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 34.70 2qox h ILE 34 CO 1.11 0.00 -0.44 -0.03 -0.69 0.00 0.00 178.15 178.11 2qox h MET 35 N -0.14 -0.20 -0.10 2.37 4.05 -1.97 -0.31 114.93 118.63 2qox h MET 35 Ca 0.06 0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.53 2qox h MET 35 Cb 0.30 0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 31.08 2qox h MET 35 CO -0.40 -0.13 -0.34 1.49 0.23 0.00 0.00 176.91 177.75 2qox h GLU 36 N -0.21 -0.42 -0.64 0.39 4.81 -1.90 -2.35 114.58 114.25 2qox h GLU 36 Ca 0.19 0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.49 2qox h GLU 36 Cb 0.56 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.99 2qox h GLU 36 CO -0.71 -0.28 0.38 0.35 -0.73 0.00 0.00 179.01 178.02 2qox h PHE 37 N -0.44 0.70 -0.32 0.92 3.57 -0.89 0.21 116.94 120.69 2qox h PHE 37 Ca 0.08 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.67 2qox h PHE 37 Cb 0.57 -0.22 -0.08 0.00 2.79 0.00 0.00 35.95 39.01 2qox h PHE 37 CO -0.41 0.38 -0.43 0.00 -2.23 0.00 0.00 178.31 175.62 2qox h LYS 39 N -0.38 0.74 -0.01 0.00 1.79 -1.30 -2.70 116.57 114.72 2qox h LYS 39 Ca 0.12 -0.50 0.02 0.00 -2.18 0.00 0.00 60.65 58.10 2qox h LYS 39 Cb 0.60 0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.30 2qox h LYS 39 CO -0.52 1.12 -0.08 0.00 -1.08 0.00 0.00 179.45 178.89 2qox h ALA 40 N 0.61 -0.08 0.39 3.86 0.00 -0.02 -0.43 119.26 123.59 2qox h ALA 40 Ca -0.00 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2qox h ALA 40 Cb 1.13 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2qox h ALA 40 CO 0.11 -0.57 -0.19 0.35 0.00 0.00 0.00 179.25 178.95 2qox h PHE 41 N -0.14 -0.49 0.00 0.00 3.57 0.54 -2.72 116.94 117.70 2qox h PHE 41 Ca 0.03 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2qox h PHE 41 Cb 0.19 0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.09 2qox h PHE 41 CO -0.15 -0.30 0.29 -0.91 -2.23 0.00 0.00 178.31 175.01 2qox h ASN 42 N -0.54 0.00 0.23 0.41 2.35 -1.51 -1.34 115.58 115.18 2qox h ASN 42 Ca -0.05 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2qox h ASN 42 Cb 0.40 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 2qox h ASN 42 CO 0.09 0.00 -0.11 0.00 -1.65 0.00 0.00 177.43 175.76 2qox h ALA 43 N 1.28 -0.30 0.00 -0.83 0.00 -0.73 -3.11 119.26 115.57 2qox h ALA 43 Ca 0.00 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 2qox h ALA 43 Cb 0.59 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2qox h ALA 43 CO 0.00 -0.52 -0.42 0.87 0.00 0.00 0.00 179.25 179.18 2qox h LYS 44 N -0.60 0.00 0.00 0.00 1.57 -1.29 -3.21 116.57 113.03 2qox h LYS 44 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2qox h LYS 44 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2qox h LYS 44 CO 0.05 0.34 0.00 1.79 -0.57 0.00 0.00 179.45 181.06 2qox h THR 45 N 0.00 0.00 -0.38 -0.16 1.35 -1.34 -1.98 112.91 110.40 2qox h THR 45 Ca -0.01 -0.15 -0.04 0.00 -0.55 0.00 0.00 66.41 65.65 2qox h THR 45 Cb 1.28 0.98 -0.02 0.00 -1.73 0.00 0.00 68.15 68.66 2qox h THR 45 CO 0.04 0.00 0.07 0.44 -0.25 0.00 0.00 175.52 175.83 2qox h ASP 46 N 0.00 0.60 -0.23 5.36 3.32 -1.54 -3.04 116.42 120.89 2qox h ASP 46 Ca 0.00 -0.25 -0.06 0.00 0.02 0.00 0.00 57.03 56.73 2qox h ASP 46 Cb 0.18 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 2qox h ASP 46 CO 0.00 0.70 -0.10 0.28 -1.72 0.00 0.00 179.24 178.40 2qox h SER 47 N 0.48 0.49 -4.30 6.45 0.02 -1.58 -3.43 113.55 111.67 2qox h SER 47 Ca 0.12 -0.40 -0.51 0.00 -0.84 0.00 0.00 61.79 60.15 2qox h SER 47 Cb 0.35 -0.13 0.13 0.00 0.14 0.00 0.00 62.40 62.89 2qox h SER 47 CO 0.01 0.78 0.31 -0.51 -1.14 0.00 0.00 176.83 176.28 2qox s ILE 48 N -4.61 3.29 -0.39 3.27 2.07 -1.06 -4.84 121.20 118.93 2qox s ILE 48 Ca -0.14 0.42 -0.42 0.00 -1.41 0.00 0.00 60.65 59.10 2qox s ILE 48 Cb 0.07 -2.90 -0.17 0.00 0.13 0.00 0.00 42.46 39.59 2qox s ILE 48 CO 0.77 -0.55 1.86 -0.62 -1.91 0.00 0.00 174.94 174.48 2qox n GLU 49 N -3.54 0.63 -2.90 3.50 -0.58 -1.26 -4.87 120.64 111.61 2qox n GLU 49 Ca 0.09 0.21 -0.38 0.00 -0.42 0.00 0.00 57.16 56.67 2qox n GLU 49 Cb 0.53 -1.89 -0.06 0.00 -0.57 0.00 0.00 31.44 29.45 2qox n GLU 49 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2qox s LYS 50 N 4.31 4.54 0.00 3.49 1.02 -1.26 -3.59 119.74 128.25 2qox s LYS 50 Ca 1.06 1.20 0.00 0.00 0.02 0.00 0.00 55.97 58.25 2qox s LYS 50 Cb -1.23 -3.01 0.00 0.00 -0.52 0.00 0.00 37.83 33.07 2qox s LYS 50 CO 0.67 0.42 0.00 0.41 -0.92 0.00 0.00 175.35 175.93 2qox n GLY 51 N 1.00 1.25 3.47 -3.33 0.00 -1.26 -5.02 105.19 101.30 2qox n GLY 51 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 2qox n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qox s LEU 52 N 0.00 3.34 -0.30 0.99 1.43 -1.24 -4.85 118.68 118.06 2qox s LEU 52 Ca 0.00 -0.16 -0.28 0.00 -1.03 0.00 0.00 54.13 52.66 2qox s LEU 52 Cb 0.00 -1.85 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 2qox s LEU 52 CO 0.00 0.08 1.96 -2.16 0.23 0.00 0.00 176.35 176.46 2qox s PRO 53 N 0.92 3.23 -0.19 1.29 0.04 -1.26 -3.28 135.00 135.75 2qox s PRO 53 Ca 0.02 1.64 -0.04 0.00 0.04 0.00 0.00 61.00 62.65 2qox s PRO 53 Cb -0.14 -4.27 -0.02 0.00 0.04 0.00 0.00 34.50 30.11 2qox s PRO 53 CO 0.02 -1.98 -0.03 -1.50 0.04 0.00 0.00 177.00 173.54 2qox s ILE 54 N 7.53 3.68 -0.18 0.56 -1.16 -1.13 -4.20 121.20 126.28 2qox s ILE 54 Ca 0.87 -0.41 -0.29 0.00 -0.51 0.00 0.00 60.65 60.31 2qox s ILE 54 Cb -0.26 -2.65 -0.01 0.00 0.61 0.00 0.00 42.46 40.16 2qox s ILE 54 CO 0.34 0.45 1.22 -2.16 -2.81 0.00 0.00 174.94 171.97 2qox s PRO 55 N 0.96 4.23 -0.01 3.50 0.04 -1.26 -3.40 135.00 139.06 2qox s PRO 55 Ca 0.00 1.59 0.04 0.00 0.04 0.00 0.00 61.00 62.68 2qox s PRO 55 Cb -0.15 -3.74 -0.03 0.00 0.04 0.00 0.00 34.50 30.62 2qox s PRO 55 CO 0.01 -0.70 -0.12 0.54 0.04 0.00 0.00 177.00 176.77 2qox s VAL 56 N 3.46 3.24 -0.26 -0.36 0.11 0.44 -3.57 120.40 123.46 2qox s VAL 56 Ca 0.53 -0.85 -0.04 0.00 -2.93 0.00 0.00 61.98 58.69 2qox s VAL 56 Cb -0.20 -2.35 0.02 0.00 -1.53 0.00 0.00 36.38 32.31 2qox s VAL 56 CO 0.13 0.46 -0.00 -0.69 -3.33 0.00 0.00 175.10 171.66 2qox s VAL 57 N -0.88 3.34 -0.12 2.04 1.01 -1.23 -1.65 120.40 122.90 2qox s VAL 57 Ca 0.14 -0.85 -0.11 0.00 0.00 0.00 0.00 61.98 61.16 2qox s VAL 57 Cb -0.11 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 2qox s VAL 57 CO 0.04 0.17 0.24 -0.63 0.00 0.00 0.00 175.10 174.92 2qox s ILE 58 N 1.40 5.33 -0.20 2.22 1.01 -0.26 -2.95 121.20 127.75 2qox s ILE 58 Ca 0.01 0.44 0.01 0.00 0.00 0.00 0.00 60.65 61.11 2qox s ILE 58 Cb -0.17 -3.55 0.04 0.00 0.01 0.00 0.00 42.46 38.80 2qox s ILE 58 CO -0.02 0.51 -0.12 0.28 0.00 0.00 0.00 174.94 175.60 2qox s THR 59 N -0.34 1.77 0.13 2.92 -1.32 -0.31 -0.47 115.64 118.01 2qox s THR 59 Ca 0.16 -1.07 -0.08 0.00 -1.21 0.00 0.00 61.69 59.49 2qox s THR 59 Cb -0.13 -1.81 -0.06 0.00 -1.51 0.00 0.00 72.50 68.99 2qox s THR 59 CO 0.05 0.20 0.42 -0.69 -2.21 0.00 0.00 174.62 172.39 2qox s VAL 60 N 1.34 5.09 0.55 5.08 1.01 -1.26 -2.40 120.40 129.81 2qox s VAL 60 Ca -0.01 0.31 0.05 0.00 0.00 0.00 0.00 61.98 62.33 2qox s VAL 60 Cb -0.16 -3.63 0.04 0.00 0.00 0.00 0.00 36.38 32.63 2qox s VAL 60 CO -0.08 0.13 0.42 -0.31 0.00 0.00 0.00 175.10 175.25 2qox s TYR 61 N -1.57 1.55 0.47 5.22 2.02 -0.85 -4.70 117.35 119.48 2qox s TYR 61 Ca 0.39 -0.86 0.21 0.00 -0.37 0.00 0.00 57.07 56.43 2qox s TYR 61 Cb -0.13 -1.91 1.30 0.00 -0.40 0.00 0.00 41.96 40.83 2qox s TYR 61 CO 0.21 -0.52 2.08 0.00 -1.57 0.00 0.00 175.55 175.75 2qox h ALA 62 N 0.71 1.59 0.00 3.71 0.00 -1.99 0.23 119.26 123.51 2qox h ALA 62 Ca -0.36 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2qox h ALA 62 Cb 1.31 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2qox h ALA 62 CO 0.57 0.14 0.00 -3.47 0.00 0.00 0.00 179.25 176.48 2qox n ASP 63 N -4.08 0.00 0.00 0.00 -0.08 -1.26 -4.80 116.55 106.33 2qox n ASP 63 Ca -0.02 0.32 0.00 0.00 -1.51 0.00 0.00 54.79 53.57 2qox n ASP 63 Cb 0.19 -0.40 0.00 0.00 2.34 0.00 0.00 41.12 43.26 2qox n ASP 63 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2qox n ARG 64 N -1.40 0.00 -0.99 -0.67 1.74 0.80 -4.98 116.66 111.15 2qox n ARG 64 Ca 0.04 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.92 2qox n ARG 64 Cb 0.12 -2.52 0.16 0.00 -1.02 0.00 0.00 32.46 29.20 2qox n ARG 64 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2qox n SER 65 N 0.00 -0.92 -3.53 0.55 2.88 -1.26 -4.58 113.62 106.76 2qox n SER 65 Ca 0.00 -1.13 -0.08 0.00 -1.33 0.00 0.00 58.87 56.33 2qox n SER 65 Cb 0.00 -0.70 -0.02 0.00 -0.75 0.00 0.00 64.21 62.74 2qox n SER 65 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2qox s PHE 66 N -2.66 -0.32 0.08 0.66 -0.71 -1.26 -2.01 117.98 111.76 2qox s PHE 66 Ca 0.50 0.17 0.02 0.00 -1.04 0.00 0.00 56.93 56.59 2qox s PHE 66 Cb -0.03 0.55 -0.04 0.00 -1.21 0.00 0.00 43.02 42.29 2qox s PHE 66 CO 0.37 -0.55 -0.07 0.95 -1.34 0.00 0.00 175.22 174.57 2qox s THR 67 N -3.10 0.67 -0.04 -4.49 -4.23 -1.01 -4.97 115.64 98.46 2qox s THR 67 Ca 0.06 -1.62 -0.09 0.00 -1.18 0.00 0.00 61.69 58.86 2qox s THR 67 Cb -0.01 -1.29 0.01 0.00 1.34 0.00 0.00 72.50 72.56 2qox s THR 67 CO -0.08 -0.67 0.21 0.72 -0.54 0.00 0.00 174.62 174.26 2qox s PHE 68 N -2.73 -0.14 -0.28 3.99 -0.71 -1.26 -1.16 117.98 115.69 2qox s PHE 68 Ca 0.04 0.30 -0.04 0.00 -1.04 0.00 0.00 56.93 56.18 2qox s PHE 68 Cb -0.01 0.04 0.02 0.00 -1.21 0.00 0.00 43.02 41.86 2qox s PHE 68 CO -0.02 -0.22 0.02 0.14 -1.34 0.00 0.00 175.22 173.79 2qox s VAL 69 N -0.63 3.47 -0.36 -2.49 -7.23 -1.15 -4.96 120.40 107.04 2qox s VAL 69 Ca -0.07 -0.86 -0.27 0.00 -1.81 0.00 0.00 61.98 58.97 2qox s VAL 69 Cb -0.04 -2.79 0.02 0.00 0.56 0.00 0.00 36.38 34.12 2qox s VAL 69 CO 0.01 0.12 0.98 0.28 -0.31 0.00 0.00 175.10 176.18 2qox s THR 70 N 1.42 4.54 0.00 5.32 -1.32 -1.26 -3.56 115.64 120.78 2qox s THR 70 Ca 0.01 1.34 0.00 0.00 -1.21 0.00 0.00 61.69 61.83 2qox s THR 70 Cb -0.17 -4.37 0.00 0.00 -1.51 0.00 0.00 72.50 66.45 2qox s THR 70 CO -0.01 -0.55 0.00 0.29 -2.21 0.00 0.00 174.62 172.14 2qox n LYS 71 N 6.86 3.71 -4.12 7.08 5.02 -1.23 -5.08 118.16 130.40 2qox n LYS 71 Ca 0.09 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.06 2qox n LYS 71 Cb 0.48 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.42 2qox n LYS 71 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2qox s THR 72 N 2.16 4.53 0.58 -0.18 -1.32 -1.26 -4.82 115.64 115.33 2qox s THR 72 Ca 0.00 -0.59 -0.19 0.00 -1.21 0.00 0.00 61.69 59.70 2qox s THR 72 Cb 0.00 -3.10 -0.05 0.00 -1.51 0.00 0.00 72.50 67.84 2qox s THR 72 CO 0.00 0.27 1.03 -0.81 -2.21 0.00 0.00 174.62 172.90 2qox n PRO 73 N 0.96 1.05 -1.46 7.08 -0.04 -1.26 -4.52 135.00 136.81 2qox n PRO 73 Ca -0.12 0.40 -0.40 0.00 -0.04 0.00 0.00 63.50 63.35 2qox n PRO 73 Cb 0.52 -2.22 0.02 0.00 -0.04 0.00 0.00 33.50 31.79 2qox n PRO 73 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2qox n PRO 74 N -0.92 0.58 -0.19 0.54 -0.02 -1.26 -4.75 135.00 128.98 2qox n PRO 74 Ca 0.13 0.22 -0.04 0.00 -2.02 0.00 0.00 63.50 61.79 2qox n PRO 74 Cb 0.46 -1.63 0.15 0.00 -0.02 0.00 0.00 33.50 32.46 2qox n PRO 74 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qox h ALA 75 N 0.54 1.17 -0.22 3.55 0.00 -1.98 -1.34 119.26 120.98 2qox h ALA 75 Ca -0.43 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.31 2qox h ALA 75 Cb 1.40 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 2qox h ALA 75 CO 0.49 0.58 0.07 0.00 0.00 0.00 0.00 179.25 180.39 2qox h ALA 76 N 1.30 0.24 -0.19 0.00 0.00 -1.92 0.58 119.26 119.26 2qox h ALA 76 Ca 0.21 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2qox h ALA 76 Cb 0.24 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2qox h ALA 76 CO -0.01 -0.35 0.10 0.28 0.00 0.00 0.00 179.25 179.26 2qox h VAL 77 N 0.17 1.12 -0.80 0.00 2.07 -1.84 -1.82 116.25 115.15 2qox h VAL 77 Ca 0.09 -0.35 0.08 0.00 0.82 0.00 0.00 66.70 67.35 2qox h VAL 77 Cb 0.07 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.79 2qox h VAL 77 CO -0.10 0.12 0.52 -0.07 0.02 0.00 0.00 177.57 178.06 2qox h LEU 78 N 0.19 0.72 -0.64 2.57 3.38 -0.90 -1.02 115.31 119.61 2qox h LEU 78 Ca 0.07 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 2qox h LEU 78 Cb 0.10 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2qox h LEU 78 CO -0.01 0.44 -0.37 -0.07 0.09 0.00 0.00 178.44 178.52 2qox h LEU 79 N 0.80 0.69 -0.79 1.67 3.38 -0.49 -1.91 115.31 118.67 2qox h LEU 79 Ca 0.36 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2qox h LEU 79 Cb 0.34 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 2qox h LEU 79 CO -0.13 0.99 0.46 0.11 0.09 0.00 0.00 178.44 179.96 2qox h LYS 80 N 0.55 1.08 0.24 1.13 1.57 -0.36 0.16 116.57 120.94 2qox h LYS 80 Ca 0.05 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2qox h LYS 80 Cb 0.89 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.98 2qox h LYS 80 CO 0.08 0.78 -0.12 0.87 -0.57 0.00 0.00 179.45 180.49 2qox h LYS 81 N 1.08 -0.31 -0.73 3.15 1.57 -1.27 0.37 116.57 120.44 2qox h LYS 81 Ca 0.28 0.02 0.10 0.00 -1.87 0.00 0.00 60.65 59.18 2qox h LYS 81 Cb -0.01 0.07 -0.07 0.00 0.08 0.00 0.00 32.23 32.30 2qox h LYS 81 CO -0.05 0.01 0.36 0.00 -0.57 0.00 0.00 179.45 179.20 2qox h ALA 82 N 0.00 1.01 0.00 3.86 0.00 -1.19 0.20 119.26 123.14 2qox h ALA 82 Ca -0.03 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2qox h ALA 82 Cb 0.46 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2qox h ALA 82 CO 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.25 2qox h ALA 83 N 1.45 1.00 -0.24 0.00 0.00 -0.64 -3.47 119.26 117.36 2qox h ALA 83 Ca 0.36 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.17 2qox h ALA 83 Cb 0.40 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 2qox h ALA 83 CO -0.28 0.00 -0.09 0.41 0.00 0.00 0.00 179.25 179.29 2qox n GLY 84 N 0.71 0.77 4.01 0.00 0.00 0.98 -4.69 105.19 106.97 2qox n GLY 84 Ca 0.03 -0.79 -0.18 0.00 0.00 0.00 0.00 46.02 45.07 2qox n GLY 84 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qox s ILE 85 N -2.18 2.70 -0.17 -0.61 -4.36 0.60 -4.98 121.20 112.20 2qox s ILE 85 Ca 0.00 -0.94 0.02 0.00 -0.26 0.00 0.00 60.65 59.47 2qox s ILE 85 Cb 0.00 -2.75 -0.11 0.00 1.25 0.00 0.00 42.46 40.84 2qox s ILE 85 CO 0.00 0.00 -0.14 0.29 0.24 0.00 0.00 174.94 175.33 2qox n LYS 86 N -2.06 0.50 -4.47 0.37 5.02 -1.26 -4.46 118.16 111.81 2qox n LYS 86 Ca 0.10 0.09 -0.25 0.00 -2.02 0.00 0.00 58.31 56.24 2qox n LYS 86 Cb 0.60 -1.34 -0.08 0.00 -0.02 0.00 0.00 35.03 34.19 2qox n LYS 86 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2qox s SER 87 N -5.60 2.61 0.00 4.39 0.15 -1.26 -5.06 113.70 108.93 2qox s SER 87 Ca -0.22 -1.74 0.00 0.00 0.70 0.00 0.00 55.95 54.68 2qox s SER 87 Cb 0.06 0.59 0.00 0.00 -1.71 0.00 0.00 66.02 64.96 2qox s SER 87 CO 0.40 -1.01 0.00 0.61 1.20 0.00 0.00 173.24 174.44 2qox n GLY 88 N -0.88 -1.19 0.00 9.45 0.00 -1.26 -5.00 105.19 106.31 2qox n GLY 88 Ca -0.03 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.86 2qox n GLY 88 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qox n SER 89 N 0.00 0.89 0.00 1.61 3.41 -1.19 -4.80 113.62 113.54 2qox n SER 89 Ca 0.00 -1.14 0.00 0.00 -0.26 0.00 0.00 58.87 57.47 2qox n SER 89 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2qox n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qox n GLY 90 N -0.07 1.32 2.69 5.00 0.00 -1.26 -4.43 105.19 108.43 2qox n GLY 90 Ca 0.00 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2qox n GLY 90 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qox n LYS 91 N 0.00 2.53 -1.22 1.61 4.01 -1.26 -5.09 118.16 118.74 2qox n LYS 91 Ca 0.00 -4.60 -0.37 0.00 -0.51 0.00 0.00 58.31 52.83 2qox n LYS 91 Cb 0.00 -2.31 0.04 0.00 -0.51 0.00 0.00 35.03 32.25 2qox n LYS 91 CO 0.00 0.00 0.00 -2.30 -1.11 0.00 0.00 177.40 173.99 2qox n PRO 92 N 1.36 0.14 0.00 1.97 -0.02 -1.26 -2.12 135.00 135.07 2qox n PRO 92 Ca 0.26 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 2qox n PRO 92 Cb 0.38 -1.35 0.00 0.00 -0.02 0.00 0.00 33.50 32.51 2qox n PRO 92 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2qox n ASN 93 N 1.52 0.00 -0.04 2.55 5.03 -1.26 -4.55 115.26 118.52 2qox n ASN 93 Ca 0.07 0.00 -0.13 0.00 0.87 0.00 0.00 54.58 55.39 2qox n ASN 93 Cb 0.50 0.00 -0.11 0.00 -1.02 0.00 0.00 39.78 39.14 2qox n ASN 93 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 2qox h LYS 94 N 0.00 -0.00 -4.24 3.52 3.64 -1.83 -3.44 116.57 114.21 2qox h LYS 94 Ca 0.00 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 58.86 2qox h LYS 94 Cb 0.00 0.00 -0.36 0.00 -0.41 0.00 0.00 32.23 31.46 2qox h LYS 94 CO 0.00 0.73 -0.80 0.34 -2.27 0.00 0.00 179.45 177.45 2qox s ASP 95 N -5.94 2.05 -0.06 4.20 2.15 -1.07 -5.12 116.67 112.87 2qox s ASP 95 Ca -0.17 -0.29 -0.21 0.00 0.43 0.00 0.00 52.55 52.31 2qox s ASP 95 Cb -0.01 -0.81 -0.04 0.00 -0.30 0.00 0.00 42.92 41.76 2qox s ASP 95 CO 0.68 -0.10 0.62 -1.59 -0.17 0.00 0.00 175.17 174.61 2qox s LYS 96 N 1.54 4.38 -0.02 4.34 -2.85 -1.26 -4.64 119.74 121.23 2qox s LYS 96 Ca 0.02 0.73 0.22 0.00 -1.00 0.00 0.00 55.97 55.94 2qox s LYS 96 Cb -0.13 -3.42 -0.32 0.00 -2.06 0.00 0.00 37.83 31.91 2qox s LYS 96 CO -0.06 0.17 0.56 1.33 0.10 0.00 0.00 175.35 177.45 2qox n VAL 97 N 3.46 0.00 -3.83 1.79 0.24 -1.09 -5.03 118.33 113.86 2qox n VAL 97 Ca -0.04 -0.40 -0.08 0.00 -2.04 0.00 0.00 64.34 61.77 2qox n VAL 97 Cb 0.51 0.19 0.01 0.00 -1.47 0.00 0.00 33.84 33.08 2qox n VAL 97 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2qox s GLY 98 N -4.21 0.22 0.03 7.63 0.00 -1.26 -4.99 107.32 104.74 2qox s GLY 98 Ca -0.05 -0.60 -0.01 0.00 0.00 0.00 0.00 44.72 44.06 2qox s GLY 98 CO 0.90 -0.24 -0.02 -1.59 0.00 0.00 0.00 173.10 172.14 2qox s LYS 99 N -2.95 0.39 -0.02 2.90 0.00 -1.26 -1.93 119.74 116.87 2qox s LYS 99 Ca 0.14 -0.74 0.00 0.00 0.00 0.00 0.00 55.97 55.38 2qox s LYS 99 Cb -0.05 0.14 0.02 0.00 0.00 0.00 0.00 37.83 37.94 2qox s LYS 99 CO 0.10 -0.07 0.01 0.42 0.00 0.00 0.00 175.35 175.81 2qox s ILE 100 N -2.02 0.07 0.50 3.79 1.01 0.85 -4.44 121.20 120.97 2qox s ILE 100 Ca -0.11 0.10 -0.21 0.00 0.00 0.00 0.00 60.65 60.43 2qox s ILE 100 Cb -0.06 -0.15 -0.07 0.00 0.01 0.00 0.00 42.46 42.19 2qox s ILE 100 CO -0.03 0.09 1.14 -0.94 0.00 0.00 0.00 174.94 175.20 2qox s SER 101 N 0.77 5.96 0.59 3.58 1.04 -1.26 -2.60 113.70 121.78 2qox s SER 101 Ca -0.07 2.22 0.28 0.00 0.48 0.00 0.00 55.95 58.87 2qox s SER 101 Cb -0.10 -2.59 1.57 0.00 0.10 0.00 0.00 66.02 65.00 2qox s SER 101 CO -0.02 -1.05 2.02 0.03 0.98 0.00 0.00 173.24 175.19 2qox h ARG 102 N 1.62 0.00 -0.24 4.02 2.47 -1.74 -0.50 114.38 120.01 2qox h ARG 102 Ca -0.50 0.00 -0.12 0.00 -1.26 0.00 0.00 59.98 58.10 2qox h ARG 102 Cb 1.25 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.57 2qox h ARG 102 CO 0.59 0.00 -0.34 0.00 0.56 0.00 0.00 179.97 180.78 2qox h ALA 103 N 1.65 0.36 -0.48 0.04 0.00 -1.89 -3.05 119.26 115.89 2qox h ALA 103 Ca 0.14 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2qox h ALA 103 Cb 0.77 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2qox h ALA 103 CO -0.00 0.41 0.29 1.96 0.00 0.00 0.00 179.25 181.91 2qox h GLN 104 N 0.35 0.65 -0.95 0.00 4.20 -1.46 -2.28 115.11 115.62 2qox h GLN 104 Ca 0.02 -0.06 0.10 0.00 0.06 0.00 0.00 58.65 58.77 2qox h GLN 104 Cb 0.92 -0.14 -0.07 0.00 0.30 0.00 0.00 27.48 28.50 2qox h GLN 104 CO 0.08 0.47 0.61 -0.07 -0.67 0.00 0.00 178.83 179.25 2qox h LEU 105 N 0.64 0.89 -1.01 1.46 3.38 -1.52 0.24 115.31 119.38 2qox h LEU 105 Ca 0.17 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.10 2qox h LEU 105 Cb -0.01 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 2qox h LEU 105 CO -0.03 0.52 -0.03 1.56 0.09 0.00 0.00 178.44 180.55 2qox h GLN 106 N 0.98 0.68 -0.33 1.13 4.20 -1.33 0.44 115.11 120.88 2qox h GLN 106 Ca 0.44 -0.18 -0.12 0.00 0.06 0.00 0.00 58.65 58.85 2qox h GLN 106 Cb 0.38 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 2qox h GLN 106 CO -0.20 0.72 -0.26 0.93 -0.67 0.00 0.00 178.83 179.35 2qox h GLU 107 N 0.64 0.76 -0.22 1.46 5.08 -0.31 -0.52 114.58 121.47 2qox h GLU 107 Ca 0.13 -0.38 -0.12 0.00 -1.00 0.00 0.00 59.36 57.99 2qox h GLU 107 Cb 0.44 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2qox h GLU 107 CO 0.02 1.00 -0.39 0.82 -1.00 0.00 0.00 179.01 179.46 2qox h ILE 108 N 0.53 1.30 0.00 3.13 2.04 -0.28 -1.65 117.51 122.58 2qox h ILE 108 Ca 0.06 -1.53 -0.09 0.00 1.00 0.00 0.00 64.86 64.30 2qox h ILE 108 Cb 0.83 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 2qox h ILE 108 CO 0.07 0.48 -0.43 0.00 0.00 0.00 0.00 178.15 178.27 2qox h ALA 109 N 1.17 1.24 0.00 1.87 0.00 0.04 -0.23 119.26 123.35 2qox h ALA 109 Ca 0.04 -0.39 -0.15 0.00 0.00 0.00 0.00 54.91 54.41 2qox h ALA 109 Cb 0.86 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 2qox h ALA 109 CO 0.07 0.53 -0.72 0.37 0.00 0.00 0.00 179.25 179.51 2qox h GLN 110 N 0.00 0.00 0.12 0.00 5.75 -0.60 0.59 115.11 120.97 2qox h GLN 110 Ca -0.00 0.00 -0.26 0.00 -0.15 0.00 0.00 58.65 58.23 2qox h GLN 110 Cb 0.78 0.00 0.03 0.00 1.07 0.00 0.00 27.48 29.36 2qox h GLN 110 CO 0.06 0.72 -1.10 1.15 -2.65 0.00 0.00 178.83 177.00 2qox h THR 111 N 0.00 1.35 0.00 2.39 2.02 -0.76 -3.25 112.91 114.66 2qox h THR 111 Ca -0.01 -2.45 0.00 0.00 0.77 0.00 0.00 66.41 64.73 2qox h THR 111 Cb 1.34 2.82 0.00 0.00 -1.74 0.00 0.00 68.15 70.57 2qox h THR 111 CO 0.09 0.73 -0.12 0.29 0.37 0.00 0.00 175.52 176.89 2qox n LYS 112 N -3.91 0.24 -0.32 6.66 4.76 -0.15 -4.13 118.16 121.30 2qox n LYS 112 Ca -0.14 0.17 0.23 0.00 -2.87 0.00 0.00 58.31 55.70 2qox n LYS 112 Cb 0.93 -1.75 0.43 0.00 -1.84 0.00 0.00 35.03 32.80 2qox n LYS 112 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qox n ALA 113 N -1.76 0.75 -0.32 7.82 0.00 0.19 0.12 120.51 127.32 2qox n ALA 113 Ca 0.05 1.02 0.03 0.00 0.00 0.00 0.00 53.44 54.54 2qox n ALA 113 Cb 0.42 -0.88 0.22 0.00 0.00 0.00 0.00 19.45 19.21 2qox n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qox h ALA 114 N 1.94 1.47 -0.01 0.00 0.00 -1.80 -2.58 119.26 118.27 2qox h ALA 114 Ca 0.71 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.59 2qox h ALA 114 Cb 1.70 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.20 2qox h ALA 114 CO -0.83 0.41 -0.56 -0.25 0.00 0.00 0.00 179.25 178.02 2qox n ASP 115 N -4.48 1.60 -4.88 0.00 8.00 0.12 -4.94 116.55 111.96 2qox n ASP 115 Ca 0.13 -1.26 -0.33 0.00 0.71 0.00 0.00 54.79 54.05 2qox n ASP 115 Cb 0.16 0.54 -0.05 0.00 -0.02 0.00 0.00 41.12 41.75 2qox n ASP 115 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2qox s MET 116 N -2.62 3.71 0.00 -1.24 -1.94 -0.11 -4.99 119.30 112.11 2qox s MET 116 Ca 0.17 0.08 0.27 0.00 -1.71 0.00 0.00 55.69 54.50 2qox s MET 116 Cb 0.18 -2.88 0.90 0.00 2.01 0.00 0.00 34.83 35.04 2qox s MET 116 CO 0.64 0.48 1.66 -2.37 -0.01 0.00 0.00 175.02 175.42 2qox n THR 117 N 0.39 0.00 -1.63 2.05 5.66 -1.26 -4.88 114.28 114.62 2qox n THR 117 Ca -0.04 -0.07 -0.60 0.00 -3.05 0.00 0.00 64.05 60.29 2qox n THR 117 Cb 0.52 0.12 -0.08 0.00 -1.55 0.00 0.00 70.33 69.34 2qox n THR 117 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2qox n GLY 118 N 1.37 0.17 0.18 1.09 0.00 -1.26 -4.86 105.19 101.88 2qox n GLY 118 Ca 0.11 0.85 -0.14 0.00 0.00 0.00 0.00 46.02 46.84 2qox n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qox h ALA 119 N 4.54 0.30 -1.94 4.61 0.00 -1.95 -3.46 119.26 121.36 2qox h ALA 119 Ca -0.48 -0.44 -0.54 0.00 0.00 0.00 0.00 54.91 53.46 2qox h ALA 119 Cb 1.38 -0.05 -0.14 0.00 0.00 0.00 0.00 17.79 18.98 2qox h ALA 119 CO 0.82 0.37 -0.63 0.16 0.00 0.00 0.00 179.25 179.96 2qox s ASP 120 N -6.54 3.06 0.39 0.00 1.47 -1.26 -5.04 116.67 108.74 2qox s ASP 120 Ca -0.13 -1.30 0.07 0.00 1.18 0.00 0.00 52.55 52.38 2qox s ASP 120 Cb 0.07 -0.23 0.82 0.00 -0.34 0.00 0.00 42.92 43.24 2qox s ASP 120 CO 0.82 -0.44 2.01 0.16 0.68 0.00 0.00 175.17 178.40 2qox h ILE 121 N 2.06 1.05 -0.20 2.11 -2.65 -2.00 -2.29 117.51 115.60 2qox h ILE 121 Ca -0.42 -0.22 0.02 0.00 1.03 0.00 0.00 64.86 65.28 2qox h ILE 121 Cb 1.24 0.36 -0.02 0.00 -2.05 0.00 0.00 36.82 36.35 2qox h ILE 121 CO 0.72 0.12 0.06 -0.33 0.03 0.00 0.00 178.15 178.75 2qox h GLU 122 N 0.64 0.15 0.19 0.16 3.07 -1.99 0.64 114.58 117.44 2qox h GLU 122 Ca 0.23 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 59.08 2qox h GLU 122 Cb 0.13 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 2qox h GLU 122 CO -0.06 0.10 -0.14 0.00 -1.40 0.00 0.00 179.01 177.50 2qox h ALA 123 N 1.13 -0.31 -0.83 3.43 0.00 -1.82 -1.13 119.26 119.73 2qox h ALA 123 Ca 0.09 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.97 2qox h ALA 123 Cb 0.06 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 2qox h ALA 123 CO -0.10 -0.69 0.53 0.52 0.00 0.00 0.00 179.25 179.52 2qox h MET 124 N -0.33 1.02 -0.47 0.00 2.86 -1.30 0.44 114.93 117.13 2qox h MET 124 Ca -0.01 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 2qox h MET 124 Cb 0.29 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 2qox h MET 124 CO -0.00 0.67 0.27 1.15 1.06 0.00 0.00 176.91 180.06 2qox h THR 125 N 1.05 1.16 -0.42 2.22 2.02 -0.62 -2.67 112.91 115.64 2qox h THR 125 Ca 0.33 -0.38 -0.12 0.00 0.77 0.00 0.00 66.41 67.01 2qox h THR 125 Cb -0.01 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 2qox h THR 125 CO -0.11 0.16 -0.23 -0.09 0.37 0.00 0.00 175.52 175.63 2qox h ARG 126 N 0.63 0.85 -0.96 6.66 2.43 -0.77 -1.94 114.38 121.28 2qox h ARG 126 Ca 0.17 -0.35 0.18 0.00 -0.81 0.00 0.00 59.98 59.16 2qox h ARG 126 Cb 0.02 -0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 29.45 2qox h ARG 126 CO -0.03 0.99 0.61 0.77 -1.51 0.00 0.00 179.97 180.80 2qox h SER 127 N 0.74 0.69 0.76 -3.80 0.02 -0.59 0.11 113.55 111.48 2qox h SER 127 Ca 0.10 0.07 -0.25 0.00 -0.84 0.00 0.00 61.79 60.86 2qox h SER 127 Cb 0.77 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.23 2qox h SER 127 CO 0.06 0.29 -1.19 0.40 -1.14 0.00 0.00 176.83 175.24 2qox h ILE 128 N 0.69 1.53 -0.59 3.27 2.04 -1.26 -3.22 117.51 119.96 2qox h ILE 128 Ca 0.52 -3.17 0.03 0.00 1.00 0.00 0.00 64.86 63.24 2qox h ILE 128 Cb 0.89 2.86 -0.03 0.00 -0.74 0.00 0.00 36.82 39.80 2qox h ILE 128 CO -0.28 0.90 0.39 -0.33 0.00 0.00 0.00 178.15 178.83 2qox h GLU 129 N 0.04 0.67 0.00 2.37 5.08 -0.06 0.25 114.58 122.93 2qox h GLU 129 Ca -0.10 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 2qox h GLU 129 Cb 1.89 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.99 2qox h GLU 129 CO 0.16 0.44 -0.27 0.78 -1.00 0.00 0.00 179.01 179.12 2qox h GLY 130 N 0.69 0.00 1.62 -3.84 0.00 -1.13 -0.66 103.07 99.75 2qox h GLY 130 Ca 0.24 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.31 2qox h GLY 130 CO -0.06 0.00 -1.15 -0.91 0.00 0.00 0.00 176.54 174.41 2qox h THR 131 N 0.00 1.47 -0.16 4.70 1.35 -0.67 -3.03 112.91 116.57 2qox h THR 131 Ca -0.00 -2.89 -0.04 0.00 -0.55 0.00 0.00 66.41 62.93 2qox h THR 131 Cb 0.65 2.80 -0.00 0.00 -1.73 0.00 0.00 68.15 69.86 2qox h THR 131 CO 0.04 0.85 -0.05 0.00 -0.25 0.00 0.00 175.52 176.10 2qox h ALA 132 N 0.63 0.23 0.00 6.62 0.00 -0.36 -2.15 119.26 124.23 2qox h ALA 132 Ca -0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 2qox h ALA 132 Cb 1.86 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.59 2qox h ALA 132 CO 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 179.25 179.42 2qox h ARG 133 N 0.02 0.00 0.00 0.00 3.08 -1.22 0.17 114.38 116.43 2qox h ARG 133 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2qox h ARG 133 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.55 2qox h ARG 133 CO 0.02 0.03 -0.39 0.77 -1.07 0.00 0.00 179.97 179.32 2qox h SER 134 N 0.00 0.00 -0.02 7.04 0.02 -1.34 -3.23 113.55 116.02 2qox h SER 134 Ca -0.00 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2qox h SER 134 Cb 0.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.64 2qox h SER 134 CO 0.00 0.05 -0.40 0.23 -1.14 0.00 0.00 176.83 175.58 2qox n MET 135 N -2.28 1.39 -1.50 3.45 2.81 0.46 -4.71 117.12 116.74 2qox n MET 135 Ca 0.04 -1.15 -0.02 0.00 -1.81 0.00 0.00 57.70 54.76 2qox n MET 135 Cb 0.45 -1.48 -0.00 0.00 -0.71 0.00 0.00 33.22 31.48 2qox n MET 135 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qox n GLY 136 N 1.41 0.41 3.40 3.03 0.00 -0.59 -3.16 105.19 109.70 2qox n GLY 136 Ca 0.10 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.80 2qox n GLY 136 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qox s LEU 137 N -0.44 4.48 0.61 0.99 1.43 -0.36 -2.67 118.68 122.73 2qox s LEU 137 Ca 0.00 -0.80 -0.14 0.00 -1.03 0.00 0.00 54.13 52.16 2qox s LEU 137 Cb 0.00 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 2qox s LEU 137 CO 0.00 -0.31 1.04 -0.69 0.23 0.00 0.00 176.35 176.62 2qox s VAL 138 N 1.58 4.09 -0.15 -1.59 1.01 -0.81 -4.07 120.40 120.46 2qox s VAL 138 Ca 0.03 0.86 -0.01 0.00 0.00 0.00 0.00 61.98 62.87 2qox s VAL 138 Cb -0.18 -3.49 0.04 0.00 0.00 0.00 0.00 36.38 32.74 2qox s VAL 138 CO 0.07 -0.71 -0.06 -0.69 0.00 0.00 0.00 175.10 173.71 2qox s VAL 139 N -2.74 1.08 -0.24 2.92 1.01 -1.26 -0.10 120.40 121.07 2qox s VAL 139 Ca 0.60 -0.54 -0.09 0.00 0.00 0.00 0.00 61.98 61.95 2qox s VAL 139 Cb -0.14 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 2qox s VAL 139 CO 0.43 0.19 0.12 -1.83 0.00 0.00 0.00 175.10 174.01 2qox s GLU 140 N 1.66 3.90 0.00 2.72 1.03 -1.07 -4.86 118.70 122.08 2qox s GLU 140 Ca 0.02 -0.36 0.28 0.00 0.03 0.00 0.00 54.97 54.95 2qox s GLU 140 Cb -0.15 -3.45 1.69 0.00 -0.80 0.00 0.00 34.13 31.42 2qox s GLU 140 CO -0.08 -0.04 2.03 -3.47 -1.33 0.00 0.00 175.26 172.37