#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q3w s PHE 3 N 0.00 2.84 -0.02 7.33 0.08 -1.26 -4.33 117.98 122.62 2q3w s PHE 3 Ca 0.00 0.68 0.03 0.00 0.12 0.00 0.00 56.93 57.77 2q3w s PHE 3 Cb 0.00 -3.78 -0.00 0.00 -0.57 0.00 0.00 43.02 38.67 2q3w s PHE 3 CO 0.00 -2.94 -0.11 -1.83 -0.10 0.00 0.00 175.22 170.24 2q3w s GLU 4 N 2.03 1.01 0.08 0.44 -1.05 0.37 -4.80 118.70 116.78 2q3w s GLU 4 Ca 0.68 -0.38 -0.31 0.00 -0.15 0.00 0.00 54.97 54.81 2q3w s GLU 4 Cb -0.36 -0.95 -0.08 0.00 -0.44 0.00 0.00 34.13 32.29 2q3w s GLU 4 CO 0.30 0.18 1.61 0.21 0.95 0.00 0.00 175.26 178.51 2q3w s LYS 5 N -0.03 4.21 -0.16 -4.83 2.20 -1.26 -0.65 119.74 119.23 2q3w s LYS 5 Ca 0.00 2.30 0.11 0.00 -0.36 0.00 0.00 55.97 58.02 2q3w s LYS 5 Cb -0.07 -3.51 -0.17 0.00 -1.51 0.00 0.00 37.83 32.56 2q3w s LYS 5 CO 0.00 -0.69 0.01 1.51 -0.36 0.00 0.00 175.35 175.82 2q3w n ILE 6 N 4.57 1.05 -2.44 5.43 3.06 0.97 -4.90 119.36 127.10 2q3w n ILE 6 Ca 0.15 -0.60 0.00 0.00 -2.50 0.00 0.00 62.75 59.81 2q3w n ILE 6 Cb 0.40 -0.72 0.00 0.00 0.54 0.00 0.00 39.64 39.87 2q3w n ILE 6 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2q3w s SER 8 N 0.84 1.86 0.62 0.00 0.15 -1.26 -2.42 113.70 113.49 2q3w s SER 8 Ca 0.00 -0.87 0.35 0.00 0.70 0.00 0.00 55.95 56.13 2q3w s SER 8 Cb 0.00 -0.04 2.03 0.00 -1.71 0.00 0.00 66.02 66.30 2q3w s SER 8 CO 0.00 -0.21 2.29 -0.07 1.20 0.00 0.00 173.24 176.45 2q3w h LEU 9 N 3.31 0.00 -1.07 3.45 3.38 -1.49 0.25 115.31 123.15 2q3w h LEU 9 Ca -0.38 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.49 2q3w h LEU 9 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 2q3w h LEU 9 CO 0.55 0.00 -0.38 0.44 0.09 0.00 0.00 178.44 179.14 2q3w h ASP 10 N 0.00 0.18 0.85 -0.43 5.19 -1.96 -2.71 116.42 117.54 2q3w h ASP 10 Ca -0.00 -0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.34 2q3w h ASP 10 Cb 0.01 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 39.47 2q3w h ASP 10 CO 0.00 0.54 -0.07 0.47 -3.12 0.00 0.00 179.24 177.06 2q3w n ASP 11 N -4.06 0.09 -3.36 6.45 8.00 0.87 -4.52 116.55 120.02 2q3w n ASP 11 Ca -0.01 0.27 -0.15 0.00 0.71 0.00 0.00 54.79 55.61 2q3w n ASP 11 Cb 0.44 -0.36 -0.08 0.00 -0.02 0.00 0.00 41.12 41.11 2q3w n ASP 11 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2q3w s ILE 12 N -2.92 -0.45 0.64 0.53 1.10 -1.02 -4.98 121.20 114.10 2q3w s ILE 12 Ca 0.16 -0.62 -0.11 0.00 -0.51 0.00 0.00 60.65 59.57 2q3w s ILE 12 Cb 0.19 -0.83 -0.02 0.00 0.15 0.00 0.00 42.46 41.95 2q3w s ILE 12 CO 0.54 -0.45 1.03 0.26 -2.11 0.00 0.00 174.94 174.21 2q3w s TRP 13 N 2.02 3.50 0.21 3.50 0.52 -1.25 -4.74 118.94 122.70 2q3w s TRP 13 Ca 0.13 1.14 -0.32 0.00 0.02 0.00 0.00 56.10 57.07 2q3w s TRP 13 Cb -0.14 -2.82 -0.14 0.00 -1.15 0.00 0.00 33.47 29.22 2q3w s TRP 13 CO -0.20 -0.85 1.42 0.28 0.02 0.00 0.00 176.95 177.62 2q3w n VAL 14 N -2.81 0.66 -0.85 4.03 0.31 -1.26 -1.03 118.33 117.38 2q3w n VAL 14 Ca 0.06 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 2q3w n VAL 14 Cb 0.55 -1.39 0.00 0.00 -0.91 0.00 0.00 33.84 32.09 2q3w n VAL 14 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2q3w n GLY 15 N 2.46 0.67 3.63 2.92 0.00 -0.61 -4.96 105.19 109.31 2q3w n GLY 15 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 2q3w n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2q3w s GLU 16 N -0.15 2.28 0.02 1.61 2.02 -0.20 -4.85 118.70 119.44 2q3w s GLU 16 Ca 0.00 -1.28 0.01 0.00 0.02 0.00 0.00 54.97 53.72 2q3w s GLU 16 Cb 0.00 -2.23 -0.02 0.00 0.10 0.00 0.00 34.13 31.99 2q3w s GLU 16 CO 0.00 0.41 -0.05 0.00 0.02 0.00 0.00 175.26 175.64 2q3w s MET 17 N -3.24 0.37 -0.06 1.61 0.23 -1.26 -1.59 119.30 115.35 2q3w s MET 17 Ca 0.29 -0.52 -0.31 0.00 -1.03 0.00 0.00 55.69 54.12 2q3w s MET 17 Cb -0.08 -0.13 0.08 0.00 -1.53 0.00 0.00 34.83 33.16 2q3w s MET 17 CO 0.18 0.02 0.72 -2.00 -2.03 0.00 0.00 175.02 171.91 2q3w s GLU 18 N -1.10 1.00 -0.15 3.16 2.56 0.25 -4.97 118.70 119.44 2q3w s GLU 18 Ca -0.09 0.24 -0.14 0.00 0.00 0.00 0.00 54.97 54.98 2q3w s GLU 18 Cb -0.07 0.47 -0.05 0.00 2.00 0.00 0.00 34.13 36.48 2q3w s GLU 18 CO -0.00 -0.31 0.30 0.99 -0.56 0.00 0.00 175.26 175.68 2q3w s THR 19 N -1.19 5.30 0.38 -1.70 2.01 -1.26 0.22 115.64 119.39 2q3w s THR 19 Ca -0.10 0.57 0.07 0.00 0.31 0.00 0.00 61.69 62.54 2q3w s THR 19 Cb -0.00 -3.64 -0.07 0.00 0.01 0.00 0.00 72.50 68.80 2q3w s THR 19 CO 0.09 0.39 -0.00 -0.36 -0.69 0.00 0.00 174.62 174.05 2q3w s PHE 20 N 0.42 2.37 0.05 4.92 0.08 -0.36 -4.94 117.98 120.52 2q3w s PHE 20 Ca 0.17 -0.69 0.09 0.00 0.12 0.00 0.00 56.93 56.62 2q3w s PHE 20 Cb -0.13 -1.58 -0.03 0.00 -0.57 0.00 0.00 43.02 40.71 2q3w s PHE 20 CO 0.04 0.39 -0.25 -1.21 -0.10 0.00 0.00 175.22 174.09 2q3w s GLU 21 N -3.72 1.64 0.82 0.44 2.02 -1.26 -0.25 118.70 118.39 2q3w s GLU 21 Ca 0.34 -1.09 -0.10 0.00 0.02 0.00 0.00 54.97 54.15 2q3w s GLU 21 Cb 0.08 -1.83 0.13 0.00 0.10 0.00 0.00 34.13 32.61 2q3w s GLU 21 CO 0.17 0.47 1.16 0.95 0.02 0.00 0.00 175.26 178.02 2q3w s THR 22 N -0.83 2.10 0.24 3.63 -4.23 0.15 -4.90 115.64 111.79 2q3w s THR 22 Ca 0.11 -0.19 -0.06 0.00 -1.18 0.00 0.00 61.69 60.37 2q3w s THR 22 Cb -0.10 -2.91 0.21 0.00 1.34 0.00 0.00 72.50 71.04 2q3w s THR 22 CO 0.02 0.00 1.72 0.77 -0.54 0.00 0.00 174.62 176.59 2q3w h SER 23 N -1.06 0.18 -0.06 3.99 4.64 -1.90 -0.73 113.55 118.61 2q3w h SER 23 Ca -0.43 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2q3w h SER 23 Cb 1.28 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.48 2q3w h SER 23 CO 0.48 0.06 0.00 -0.90 -0.87 0.00 0.00 176.83 175.61 2q3w n ASP 24 N -5.05 0.69 0.00 4.97 5.75 -1.26 -4.88 116.55 116.77 2q3w n ASP 24 Ca 0.13 -1.47 0.00 0.00 -0.01 0.00 0.00 54.79 53.44 2q3w n ASP 24 Cb 0.40 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.46 2q3w n ASP 24 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2q3w n GLY 25 N 0.96 0.90 3.68 6.12 0.00 -0.28 -5.06 105.19 111.52 2q3w n GLY 25 Ca 0.16 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2q3w n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q3w s THR 26 N -2.00 4.03 0.16 2.61 2.01 -1.25 -4.67 115.64 116.52 2q3w s THR 26 Ca 0.00 1.37 -0.26 0.00 0.31 0.00 0.00 61.69 63.10 2q3w s THR 26 Cb 0.00 -3.88 -0.08 0.00 0.01 0.00 0.00 72.50 68.55 2q3w s THR 26 CO 0.00 -0.02 0.82 -1.61 -0.69 0.00 0.00 174.62 173.12 2q3w s GLU 27 N 2.44 4.62 -0.10 4.92 2.02 -1.26 0.30 118.70 131.64 2q3w s GLU 27 Ca 0.59 1.22 -0.03 0.00 0.02 0.00 0.00 54.97 56.78 2q3w s GLU 27 Cb -0.27 -3.29 0.04 0.00 0.10 0.00 0.00 34.13 30.71 2q3w s GLU 27 CO 0.23 0.49 0.05 0.08 0.02 0.00 0.00 175.26 176.13 2q3w s VAL 28 N -0.89 0.10 0.08 2.63 1.01 0.65 -4.05 120.40 119.94 2q3w s VAL 28 Ca 0.38 0.06 -0.31 0.00 0.00 0.00 0.00 61.98 62.11 2q3w s VAL 28 Cb -0.23 -0.48 -0.08 0.00 0.00 0.00 0.00 36.38 35.59 2q3w s VAL 28 CO 0.27 0.03 1.50 -0.22 0.00 0.00 0.00 175.10 176.67 2q3w s LEU 29 N 2.07 4.36 -0.09 3.92 2.96 -0.75 -1.22 118.68 129.92 2q3w s LEU 29 Ca 0.03 2.37 -0.02 0.00 -0.22 0.00 0.00 54.13 56.30 2q3w s LEU 29 Cb -0.14 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 42.95 2q3w s LEU 29 CO -0.06 -0.76 -0.02 -0.63 -1.32 0.00 0.00 176.35 173.56 2q3w s ILE 30 N 1.86 4.11 0.08 6.68 -1.09 0.60 -1.86 121.20 131.58 2q3w s ILE 30 Ca 0.68 -0.32 0.07 0.00 -2.23 0.00 0.00 60.65 58.85 2q3w s ILE 30 Cb -0.37 -2.73 -0.03 0.00 -1.58 0.00 0.00 42.46 37.74 2q3w s ILE 30 CO 0.30 0.59 -0.18 -0.69 -1.23 0.00 0.00 174.94 173.72 2q3w s VAL 31 N -0.67 1.47 -0.49 2.92 1.01 -0.68 0.84 120.40 124.81 2q3w s VAL 31 Ca 0.10 -1.36 0.03 0.00 0.00 0.00 0.00 61.98 60.76 2q3w s VAL 31 Cb -0.12 -1.34 0.14 0.00 0.00 0.00 0.00 36.38 35.06 2q3w s VAL 31 CO 0.02 -0.05 0.28 0.21 0.00 0.00 0.00 175.10 175.56 2q3w s ASN 32 N -1.65 3.80 0.14 3.32 3.04 -0.62 -1.97 114.94 121.01 2q3w s ASN 32 Ca 0.04 -2.88 -0.31 0.00 0.04 0.00 0.00 52.86 49.74 2q3w s ASN 32 Cb -0.10 -1.21 -0.10 0.00 -1.54 0.00 0.00 41.25 38.31 2q3w s ASN 32 CO 0.03 -0.23 1.70 -0.55 -3.04 0.00 0.00 177.10 175.00 2q3w s SER 33 N -0.02 6.50 0.40 -4.21 0.15 -0.96 -1.58 113.70 113.98 2q3w s SER 33 Ca 0.19 2.68 0.07 0.00 0.70 0.00 0.00 55.95 59.59 2q3w s SER 33 Cb -0.21 -2.58 0.83 0.00 -1.71 0.00 0.00 66.02 62.36 2q3w s SER 33 CO -0.03 -0.92 2.05 -0.08 1.20 0.00 0.00 173.24 175.45 2q3w h GLU 34 N 7.66 0.55 0.02 5.44 4.81 -1.93 -3.02 114.58 128.11 2q3w h GLU 34 Ca -0.44 -0.04 -0.39 0.00 -0.13 0.00 0.00 59.36 58.36 2q3w h GLU 34 Cb 1.21 -0.12 -0.06 0.00 0.63 0.00 0.00 28.75 30.41 2q3w h GLU 34 CO 0.94 0.38 -2.27 0.39 -0.73 0.00 0.00 179.01 177.71 2q3w n GLU 35 N -4.46 0.63 0.00 1.92 1.02 -1.26 -4.75 120.64 113.74 2q3w n GLU 35 Ca 0.03 0.26 0.14 0.00 -0.02 0.00 0.00 57.16 57.58 2q3w n GLU 35 Cb 0.07 -1.57 0.54 0.00 -0.02 0.00 0.00 31.44 30.46 2q3w n GLU 35 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2q3w n HIS 36 N -3.81 0.00 0.00 -0.32 8.25 -1.23 -5.07 115.22 113.04 2q3w n HIS 36 Ca -0.45 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.01 2q3w n HIS 36 Cb 0.92 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 32.03 2q3w n HIS 36 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2q3w n GLY 37 N 1.17 -0.70 3.76 -1.41 0.00 -1.14 -4.86 105.19 102.01 2q3w n GLY 37 Ca 0.19 -1.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.07 2q3w n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q3w s VAL 38 N -1.03 3.25 -0.06 1.61 1.01 -1.26 -2.26 120.40 121.66 2q3w s VAL 38 Ca 0.00 1.20 -0.03 0.00 0.00 0.00 0.00 61.98 63.15 2q3w s VAL 38 Cb 0.00 -3.76 0.03 0.00 0.00 0.00 0.00 36.38 32.65 2q3w s VAL 38 CO 0.00 0.26 0.13 -0.54 0.00 0.00 0.00 175.10 174.96 2q3w s LYS 39 N -1.24 0.09 -0.04 2.72 -0.14 -0.83 -4.87 119.74 115.44 2q3w s LYS 39 Ca 0.48 0.33 0.01 0.00 -1.36 0.00 0.00 55.97 55.42 2q3w s LYS 39 Cb -0.35 -0.14 -0.03 0.00 -1.68 0.00 0.00 37.83 35.63 2q3w s LYS 39 CO 0.44 -0.14 -0.03 0.00 -0.76 0.00 0.00 175.35 174.86 2q3w s ALA 40 N 0.98 3.17 0.06 5.17 0.00 -1.26 -1.68 121.76 128.21 2q3w s ALA 40 Ca -0.08 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 50.98 2q3w s ALA 40 Cb -0.10 -1.32 -0.04 0.00 0.00 0.00 0.00 23.12 21.66 2q3w s ALA 40 CO -0.05 0.61 -0.05 0.71 0.00 0.00 0.00 175.76 176.98 2q3w s TYR 41 N -0.95 0.63 0.80 0.00 2.02 -0.78 -1.20 117.35 117.87 2q3w s TYR 41 Ca 0.16 -0.91 -0.16 0.00 -0.37 0.00 0.00 57.07 55.78 2q3w s TYR 41 Cb -0.11 -0.41 -0.09 0.00 -0.40 0.00 0.00 41.96 40.95 2q3w s TYR 41 CO 0.05 -0.26 -0.07 0.00 -1.57 0.00 0.00 175.55 173.71 2q3w n GLN 42 N 0.34 0.04 0.02 -0.62 10.64 -0.38 -1.81 117.38 125.62 2q3w n GLN 42 Ca -0.15 0.04 -0.19 0.00 -1.83 0.00 0.00 57.00 54.87 2q3w n GLN 42 Cb 0.60 -1.39 -0.12 0.00 -0.86 0.00 0.00 30.24 28.47 2q3w n GLN 42 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2q3w h ALA 43 N -0.69 0.04 -2.62 2.61 0.00 -1.91 -3.36 119.26 113.33 2q3w h ALA 43 Ca -0.44 -0.62 -0.55 0.00 0.00 0.00 0.00 54.91 53.30 2q3w h ALA 43 Cb 1.34 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.15 2q3w h ALA 43 CO 0.35 0.42 0.02 -1.64 0.00 0.00 0.00 179.25 178.40 2q3w s MET 44 N -3.06 4.20 0.69 0.00 -1.94 -1.26 -1.81 119.30 116.12 2q3w s MET 44 Ca -0.13 0.76 -0.16 0.00 -1.71 0.00 0.00 55.69 54.46 2q3w s MET 44 Cb 0.03 -3.04 0.02 0.00 2.01 0.00 0.00 34.83 33.86 2q3w s MET 44 CO 0.84 0.51 1.18 0.00 -0.01 0.00 0.00 175.02 177.54 2q3w h PRO 46 N -0.03 0.00 0.30 0.00 0.13 -1.91 -3.30 132.00 127.19 2q3w h PRO 46 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 2q3w h PRO 46 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2q3w h PRO 46 CO 0.52 0.16 -0.14 1.25 -0.23 0.00 0.00 178.00 179.55 2q3w h HIS 47 N 0.00 -0.38 -3.92 1.56 2.76 -1.90 -2.83 115.15 110.45 2q3w h HIS 47 Ca -0.00 -0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.05 2q3w h HIS 47 Cb 0.30 0.12 -0.12 0.00 1.55 0.00 0.00 27.41 29.26 2q3w h HIS 47 CO 0.00 -0.03 -0.33 -0.65 -1.30 0.00 0.00 177.93 175.62 2q3w s GLN 48 N -3.92 1.17 -0.48 5.26 -0.21 -1.24 -4.82 119.66 115.42 2q3w s GLN 48 Ca -0.12 -1.20 -0.07 0.00 0.02 0.00 0.00 55.36 53.99 2q3w s GLN 48 Cb 0.01 0.37 -0.06 0.00 1.00 0.00 0.00 33.01 34.33 2q3w s GLN 48 CO 0.45 -0.43 1.62 0.39 -2.12 0.00 0.00 175.29 175.20 2q3w n GLU 49 N -0.22 1.07 -5.09 2.91 -0.58 -1.26 -3.89 120.64 113.58 2q3w n GLU 49 Ca -0.07 -1.08 -0.31 0.00 -0.42 0.00 0.00 57.16 55.28 2q3w n GLU 49 Cb 0.63 -2.32 -0.17 0.00 -0.57 0.00 0.00 31.44 29.01 2q3w n GLU 49 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2q3w s ILE 50 N 4.42 1.93 -0.09 -3.67 -1.09 -1.26 -4.99 121.20 116.46 2q3w s ILE 50 Ca 0.28 -0.94 -0.30 0.00 -2.23 0.00 0.00 60.65 57.46 2q3w s ILE 50 Cb 0.07 -1.68 -0.05 0.00 -1.58 0.00 0.00 42.46 39.22 2q3w s ILE 50 CO 0.02 0.53 1.63 -0.76 -1.23 0.00 0.00 174.94 175.13 2q3w s LEU 51 N 0.43 4.24 0.57 2.97 1.43 -1.26 -0.90 118.68 126.15 2q3w s LEU 51 Ca -0.17 2.11 0.39 0.00 -1.03 0.00 0.00 54.13 55.42 2q3w s LEU 51 Cb -0.17 -3.53 1.44 0.00 0.03 0.00 0.00 46.19 43.95 2q3w s LEU 51 CO 0.07 -0.98 1.56 -0.07 0.23 0.00 0.00 176.35 177.16 2q3w h LEU 52 N 10.49 0.00 -0.01 1.79 3.38 -1.67 2.71 115.31 132.00 2q3w h LEU 52 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2q3w h LEU 52 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2q3w h LEU 52 CO 0.96 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.95 2q3w n SER 53 N -3.75 0.33 0.01 -0.43 3.41 -1.26 -2.33 113.62 109.60 2q3w n SER 53 Ca 0.32 0.53 0.13 0.00 -0.26 0.00 0.00 58.87 59.59 2q3w n SER 53 Cb 1.63 -0.62 0.47 0.00 -0.26 0.00 0.00 64.21 65.43 2q3w n SER 53 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2q3w n GLU 54 N -1.81 0.03 0.00 4.33 1.02 0.91 -4.82 120.64 120.30 2q3w n GLU 54 Ca 0.06 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2q3w n GLU 54 Cb 0.37 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 2q3w n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2q3w n GLY 55 N 1.48 1.29 3.13 0.62 0.00 -0.98 -4.51 105.19 106.21 2q3w n GLY 55 Ca 0.06 -1.58 -0.16 0.00 0.00 0.00 0.00 46.02 44.35 2q3w n GLY 55 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2q3w s SER 56 N -1.00 1.32 -0.20 1.61 1.04 0.25 -4.72 113.70 112.00 2q3w s SER 56 Ca 0.00 -0.60 -0.02 0.00 0.48 0.00 0.00 55.95 55.81 2q3w s SER 56 Cb 0.00 -0.01 0.06 0.00 0.10 0.00 0.00 66.02 66.17 2q3w s SER 56 CO 0.00 -0.14 0.01 -0.47 0.98 0.00 0.00 173.24 173.62 2q3w s TYR 57 N -1.39 1.41 -0.22 5.02 5.04 -1.26 0.85 117.35 126.80 2q3w s TYR 57 Ca -0.05 -1.08 -0.27 0.00 -2.44 0.00 0.00 57.07 53.23 2q3w s TYR 57 Cb -0.10 -1.18 0.10 0.00 0.35 0.00 0.00 41.96 41.13 2q3w s TYR 57 CO 0.01 -0.64 0.85 -1.21 -1.34 0.00 0.00 175.55 173.22 2q3w s GLU 58 N 1.73 0.73 -0.96 4.97 2.02 -0.82 -4.93 118.70 121.44 2q3w s GLU 58 Ca -0.02 0.62 -0.01 0.00 0.02 0.00 0.00 54.97 55.58 2q3w s GLU 58 Cb -0.17 0.35 0.00 0.00 0.10 0.00 0.00 34.13 34.41 2q3w s GLU 58 CO -0.07 -0.14 0.81 0.41 0.02 0.00 0.00 175.26 176.29 2q3w n GLY 59 N 1.95 -0.19 4.52 -1.39 0.00 -1.26 -2.84 105.19 105.98 2q3w n GLY 59 Ca -0.14 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2q3w n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q3w n GLY 60 N -1.22 1.24 3.84 -0.02 0.00 -1.26 -4.92 105.19 102.84 2q3w n GLY 60 Ca -0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 2q3w n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q3w s VAL 61 N -0.08 5.02 -0.25 1.61 1.01 -1.13 -1.69 120.40 124.89 2q3w s VAL 61 Ca 0.00 0.83 -0.08 0.00 0.00 0.00 0.00 61.98 62.73 2q3w s VAL 61 Cb 0.00 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 2q3w s VAL 61 CO 0.00 0.56 0.09 -0.63 0.00 0.00 0.00 175.10 175.11 2q3w s ILE 62 N -1.11 4.52 -0.21 2.22 1.01 -0.26 -1.94 121.20 125.43 2q3w s ILE 62 Ca 0.25 -0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.80 2q3w s ILE 62 Cb -0.17 -3.11 0.02 0.00 0.01 0.00 0.00 42.46 39.21 2q3w s ILE 62 CO 0.14 0.34 -0.14 -0.89 0.00 0.00 0.00 174.94 174.39 2q3w s THR 63 N 1.51 2.42 0.24 2.92 2.01 0.25 0.13 115.64 125.12 2q3w s THR 63 Ca 0.06 -1.01 -0.31 0.00 0.31 0.00 0.00 61.69 60.73 2q3w s THR 63 Cb -0.15 -2.14 -0.12 0.00 0.01 0.00 0.00 72.50 70.10 2q3w s THR 63 CO 0.05 0.36 1.65 0.00 -0.69 0.00 0.00 174.62 175.98 2q3w h ARG 65 N 5.79 0.00 0.14 0.00 0.11 -1.85 -1.86 114.38 116.71 2q3w h ARG 65 Ca -0.45 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.62 2q3w h ARG 65 Cb 1.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.30 2q3w h ARG 65 CO 0.88 0.21 -0.07 0.00 0.10 0.00 0.00 179.97 181.09 2q3w h ALA 66 N 1.79 -0.53 0.00 0.08 0.00 -1.91 -3.40 119.26 115.29 2q3w h ALA 66 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2q3w h ALA 66 Cb 0.40 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2q3w h ALA 66 CO 0.03 -0.52 -0.03 0.72 0.00 0.00 0.00 179.25 179.45 2q3w n HIS 67 N -2.89 0.00 -3.51 0.00 8.25 -1.26 -5.03 115.22 110.77 2q3w n HIS 67 Ca -0.02 -0.91 -0.25 0.00 -0.26 0.00 0.00 57.72 56.28 2q3w n HIS 67 Cb 0.07 -0.14 0.05 0.00 1.12 0.00 0.00 29.99 31.10 2q3w n HIS 67 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2q3w n LEU 68 N -1.30 -3.92 -4.83 2.41 4.32 -0.70 -4.99 117.00 108.00 2q3w n LEU 68 Ca 0.14 -0.88 -0.38 0.00 -0.02 0.00 0.00 56.01 54.87 2q3w n LEU 68 Cb 0.62 -2.70 -0.06 0.00 -1.62 0.00 0.00 43.42 39.66 2q3w n LEU 68 CO 0.01 0.30 0.08 0.26 -1.22 0.00 0.00 177.39 176.81 2q3w s TRP 69 N -3.42 3.69 0.11 -1.77 0.52 -1.26 -4.82 118.94 111.99 2q3w s TRP 69 Ca 0.45 0.92 0.08 0.00 0.02 0.00 0.00 56.10 57.57 2q3w s TRP 69 Cb -0.13 -2.28 -0.04 0.00 -1.15 0.00 0.00 33.47 29.88 2q3w s TRP 69 CO 0.82 0.59 -0.16 0.95 0.02 0.00 0.00 176.95 179.17 2q3w s THR 70 N -0.85 2.97 -0.01 2.01 -4.23 -0.92 -0.68 115.64 113.92 2q3w s THR 70 Ca 0.23 -1.41 0.01 0.00 -1.18 0.00 0.00 61.69 59.33 2q3w s THR 70 Cb -0.16 -2.36 0.01 0.00 1.34 0.00 0.00 72.50 71.33 2q3w s THR 70 CO 0.12 0.13 -0.04 -0.36 -0.54 0.00 0.00 174.62 173.93 2q3w s PHE 71 N -1.14 0.43 -0.21 3.99 0.08 0.12 -1.11 117.98 120.15 2q3w s PHE 71 Ca 0.18 -0.08 -0.29 0.00 0.12 0.00 0.00 56.93 56.87 2q3w s PHE 71 Cb -0.11 -0.34 -0.04 0.00 -0.57 0.00 0.00 43.02 41.97 2q3w s PHE 71 CO 0.11 -0.05 1.76 1.21 -0.10 0.00 0.00 175.22 178.14 2q3w s ASN 72 N 0.24 6.20 0.55 1.36 3.84 -0.06 -1.10 114.94 125.97 2q3w s ASN 72 Ca -0.02 1.73 0.26 0.00 0.21 0.00 0.00 52.86 55.04 2q3w s ASN 72 Cb -0.06 -2.53 1.46 0.00 -0.55 0.00 0.00 41.25 39.58 2q3w s ASN 72 CO -0.00 -1.39 2.03 -2.24 -2.79 0.00 0.00 177.10 172.71 2q3w h ASP 73 N 11.56 0.00 0.98 -4.21 2.03 -1.66 0.69 116.42 125.80 2q3w h ASP 73 Ca -0.36 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.94 2q3w h ASP 73 Cb 1.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.68 2q3w h ASP 73 CO 0.99 0.00 -0.62 1.23 -1.03 0.00 0.00 179.24 179.82 2q3w h GLY 74 N 0.00 0.00 0.00 7.15 0.00 -1.90 -3.40 103.07 104.93 2q3w h GLY 74 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 2q3w h GLY 74 CO -0.00 0.00 -0.55 -1.30 0.00 0.00 0.00 176.54 174.69 2q3w n THR 75 N -2.27 0.00 -0.22 4.70 -2.24 -0.91 -5.01 114.28 108.33 2q3w n THR 75 Ca 0.03 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2q3w n THR 75 Cb 0.46 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 2q3w n THR 75 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2q3w n GLY 76 N 1.39 2.17 3.78 3.38 0.00 0.23 -4.87 105.19 111.27 2q3w n GLY 76 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2q3w n GLY 76 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2q3w s HIS 77 N -3.09 3.28 0.49 1.61 5.65 -1.26 -1.42 115.29 120.55 2q3w s HIS 77 Ca 0.00 1.64 -0.24 0.00 0.25 0.00 0.00 55.06 56.71 2q3w s HIS 77 Cb 0.00 -3.19 -0.07 0.00 -1.18 0.00 0.00 32.58 28.15 2q3w s HIS 77 CO 0.00 -0.71 1.37 0.20 -0.65 0.00 0.00 174.74 174.95 2q3w s GLY 78 N -1.41 2.90 -0.15 1.59 0.00 0.55 -0.88 107.32 109.92 2q3w s GLY 78 Ca 0.56 1.36 -0.15 0.00 0.00 0.00 0.00 44.72 46.49 2q3w s GLY 78 CO 0.31 1.92 -0.30 1.39 0.00 0.00 0.00 173.10 176.43 2q3w n ILE 79 N -0.54 1.43 -3.51 0.90 5.41 -0.27 -4.36 119.36 118.43 2q3w n ILE 79 Ca 0.07 0.11 -0.22 0.00 1.00 0.00 0.00 62.75 63.71 2q3w n ILE 79 Cb 0.44 -2.17 -0.13 0.00 -0.71 0.00 0.00 39.64 37.06 2q3w n ILE 79 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 2q3w s ASN 80 N -6.10 2.18 0.38 4.38 0.01 -1.25 -2.81 114.94 111.72 2q3w s ASN 80 Ca -0.26 -0.69 -0.26 0.00 -0.71 0.00 0.00 52.86 50.95 2q3w s ASN 80 Cb 0.05 0.11 -0.09 0.00 0.41 0.00 0.00 41.25 41.73 2q3w s ASN 80 CO 0.37 -0.37 1.16 -2.84 -1.51 0.00 0.00 177.10 173.90 2q3w s PRO 81 N 2.24 4.16 -0.14 -0.60 0.02 -1.26 -2.17 135.00 137.25 2q3w s PRO 81 Ca 0.07 1.83 0.05 0.00 0.02 0.00 0.00 61.00 62.97 2q3w s PRO 81 Cb -0.15 -2.76 0.36 0.00 0.02 0.00 0.00 34.50 31.97 2q3w s PRO 81 CO -0.22 -0.22 1.19 -0.40 -0.33 0.00 0.00 177.00 177.02 2q3w n ASP 82 N 0.25 3.26 -0.10 2.53 3.85 -1.12 -4.10 116.55 121.12 2q3w n ASP 82 Ca 0.03 -2.54 -0.13 0.00 -0.71 0.00 0.00 54.79 51.45 2q3w n ASP 82 Cb 0.46 -0.61 -0.10 0.00 -1.35 0.00 0.00 41.12 39.53 2q3w n ASP 82 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 2q3w n ASP 83 N 0.11 2.25 -4.74 -1.12 5.75 -1.26 -4.76 116.55 112.79 2q3w n ASP 83 Ca 0.18 -0.09 -0.31 0.00 -0.01 0.00 0.00 54.79 54.56 2q3w n ASP 83 Cb 0.81 -0.12 0.12 0.00 -1.03 0.00 0.00 41.12 40.90 2q3w n ASP 83 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2q3w s ALA 84 N -2.39 1.96 -0.30 2.12 0.00 -1.26 -4.84 121.76 117.05 2q3w s ALA 84 Ca -0.24 0.32 -0.06 0.00 0.00 0.00 0.00 51.96 51.98 2q3w s ALA 84 Cb 0.06 -3.31 0.17 0.00 0.00 0.00 0.00 23.12 20.04 2q3w s ALA 84 CO 0.49 -2.10 0.68 0.00 0.00 0.00 0.00 175.76 174.83 2q3w s ALA 85 N -2.84 -2.31 0.25 0.00 0.00 -1.26 -0.33 121.76 115.27 2q3w s ALA 85 Ca 0.63 2.01 -0.31 0.00 0.00 0.00 0.00 51.96 54.29 2q3w s ALA 85 Cb -0.19 -2.05 -0.13 0.00 0.00 0.00 0.00 23.12 20.76 2q3w s ALA 85 CO 0.57 -1.16 1.52 1.28 0.00 0.00 0.00 175.76 177.96 2q3w n LEU 86 N 5.40 3.68 -4.77 0.00 4.77 -0.51 -4.78 117.00 120.80 2q3w n LEU 86 Ca -0.06 1.13 -0.41 0.00 -0.03 0.00 0.00 56.01 56.65 2q3w n LEU 86 Cb 0.51 -1.51 -0.02 0.00 -2.33 0.00 0.00 43.42 40.07 2q3w n LEU 86 CO -0.01 -0.16 1.00 0.00 -1.33 0.00 0.00 177.39 176.88 2q3w s ALA 87 N 0.12 3.47 -0.05 -1.18 0.00 -1.26 -4.74 121.76 118.13 2q3w s ALA 87 Ca 0.68 1.30 0.03 0.00 0.00 0.00 0.00 51.96 53.96 2q3w s ALA 87 Cb -0.58 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.02 2q3w s ALA 87 CO 0.47 -0.73 -0.11 -2.00 0.00 0.00 0.00 175.76 173.40 2q3w s GLU 88 N -1.90 2.59 -0.01 0.00 2.12 -1.26 -1.25 118.70 118.99 2q3w s GLU 88 Ca 0.51 -0.65 0.02 0.00 0.36 0.00 0.00 54.97 55.21 2q3w s GLU 88 Cb -0.40 -2.47 -0.03 0.00 0.26 0.00 0.00 34.13 31.48 2q3w s GLU 88 CO 0.54 0.64 -0.04 0.71 -0.54 0.00 0.00 175.26 176.57 2q3w s TYR 89 N -0.80 2.98 0.48 5.30 2.02 -0.34 -4.96 117.35 122.03 2q3w s TYR 89 Ca 0.12 0.03 -0.24 0.00 -0.37 0.00 0.00 57.07 56.61 2q3w s TYR 89 Cb -0.11 -1.66 -0.07 0.00 -0.40 0.00 0.00 41.96 39.72 2q3w s TYR 89 CO 0.02 0.41 1.40 -2.14 -1.57 0.00 0.00 175.55 173.67 2q3w s PRO 90 N -1.35 3.54 -0.10 -1.71 0.02 -1.24 -4.02 135.00 130.13 2q3w s PRO 90 Ca 0.17 2.36 -0.00 0.00 0.02 0.00 0.00 61.00 63.55 2q3w s PRO 90 Cb -0.11 -2.55 0.02 0.00 0.02 0.00 0.00 34.50 31.89 2q3w s PRO 90 CO 0.07 -0.91 -0.07 0.08 -0.33 0.00 0.00 177.00 175.84 2q3w s VAL 91 N -1.23 0.92 -0.06 3.83 1.01 -1.26 -2.45 120.40 121.16 2q3w s VAL 91 Ca 0.64 -0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.40 2q3w s VAL 91 Cb -0.43 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 34.98 2q3w s VAL 91 CO 0.54 0.35 -0.11 -1.61 0.00 0.00 0.00 175.10 174.26 2q3w s GLU 92 N 1.61 2.60 -0.24 2.72 2.02 -0.72 -4.98 118.70 121.70 2q3w s GLU 92 Ca 0.02 -0.64 -0.09 0.00 0.02 0.00 0.00 54.97 54.29 2q3w s GLU 92 Cb -0.13 -2.46 -0.04 0.00 0.10 0.00 0.00 34.13 31.60 2q3w s GLU 92 CO -0.06 0.64 0.12 0.08 0.02 0.00 0.00 175.26 176.06 2q3w s VAL 93 N -0.77 4.93 -0.59 2.63 1.01 -1.26 -0.89 120.40 125.47 2q3w s VAL 93 Ca 0.12 0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.14 2q3w s VAL 93 Cb -0.11 -3.29 0.15 0.00 0.00 0.00 0.00 36.38 33.13 2q3w s VAL 93 CO 0.01 0.35 0.36 -0.54 0.00 0.00 0.00 175.10 175.28 2q3w s LYS 94 N 1.19 2.30 7.62 2.72 1.02 0.42 -4.92 119.74 130.09 2q3w s LYS 94 Ca 0.06 -2.64 0.00 0.00 0.02 0.00 0.00 55.97 53.41 2q3w s LYS 94 Cb -0.14 -3.52 0.00 0.00 -0.52 0.00 0.00 37.83 33.64 2q3w s LYS 94 CO 0.05 -1.15 0.00 0.41 -0.92 0.00 0.00 175.35 173.74 2q3w n GLY 95 N 3.19 2.49 0.73 -3.33 0.00 -1.26 -1.45 105.19 105.57 2q3w n GLY 95 Ca 0.07 -0.30 0.13 0.00 0.00 0.00 0.00 46.02 45.92 2q3w n GLY 95 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2q3w n ASP 96 N 9.27 2.34 -4.74 1.61 3.85 -1.26 -4.94 116.55 122.68 2q3w n ASP 96 Ca 0.00 -1.75 -0.36 0.00 -0.71 0.00 0.00 54.79 51.97 2q3w n ASP 96 Cb 0.00 0.04 -0.07 0.00 -1.35 0.00 0.00 41.12 39.74 2q3w n ASP 96 CO 0.00 0.00 0.00 -1.81 -1.01 0.00 0.00 177.20 174.38 2q3w s ASP 97 N -2.05 6.41 -0.31 -1.12 -0.00 -0.53 -1.30 116.67 117.79 2q3w s ASP 97 Ca 0.31 0.48 -0.15 0.00 -0.00 0.00 0.00 52.55 53.19 2q3w s ASP 97 Cb 0.20 -2.16 -0.03 0.00 -0.00 0.00 0.00 42.92 40.93 2q3w s ASP 97 CO 0.34 0.14 0.35 -0.63 -0.00 0.00 0.00 175.17 175.37 2q3w s ILE 98 N 0.29 5.18 0.16 0.77 1.01 -1.02 0.16 121.20 127.75 2q3w s ILE 98 Ca 0.15 0.28 0.06 0.00 0.00 0.00 0.00 60.65 61.14 2q3w s ILE 98 Cb -0.13 -3.74 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 2q3w s ILE 98 CO 0.03 0.05 0.06 -0.31 0.00 0.00 0.00 174.94 174.77 2q3w s TYR 99 N 2.02 3.00 -0.02 3.97 2.02 -0.06 -0.02 117.35 128.25 2q3w s TYR 99 Ca 0.13 -0.07 -0.15 0.00 -0.37 0.00 0.00 57.07 56.61 2q3w s TYR 99 Cb -0.16 -1.46 0.02 0.00 -0.40 0.00 0.00 41.96 39.97 2q3w s TYR 99 CO 0.11 0.52 0.32 0.08 -1.57 0.00 0.00 175.55 175.01 2q3w s VAL 100 N -1.69 0.05 -0.12 0.71 1.01 0.18 -1.76 120.40 118.79 2q3w s VAL 100 Ca 0.29 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.85 2q3w s VAL 100 Cb -0.10 -0.62 0.01 0.00 0.00 0.00 0.00 36.38 35.67 2q3w s VAL 100 CO 0.21 -0.24 -0.19 -0.55 0.00 0.00 0.00 175.10 174.32 2q3w s SER 101 N -1.27 2.79 0.00 3.32 0.15 -1.03 -0.48 113.70 117.18 2q3w s SER 101 Ca -0.13 -0.52 0.17 0.00 0.70 0.00 0.00 55.95 56.17 2q3w s SER 101 Cb -0.05 -1.27 0.19 0.00 -1.71 0.00 0.00 66.02 63.17 2q3w s SER 101 CO 0.04 0.06 1.09 0.35 1.20 0.00 0.00 173.24 175.98 2q3w n THR 102 N 4.09 0.16 -1.67 6.45 -2.24 -1.26 -3.71 114.28 116.10 2q3w n THR 102 Ca -0.20 -0.58 -0.49 0.00 -2.27 0.00 0.00 64.05 60.52 2q3w n THR 102 Cb 0.51 1.22 -0.05 0.00 -2.10 0.00 0.00 70.33 69.91 2q3w n THR 102 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2q3w n LYS 103 N 0.96 1.94 -1.11 -0.78 4.81 -1.26 -1.47 118.16 121.25 2q3w n LYS 103 Ca 0.11 0.70 -0.04 0.00 -0.87 0.00 0.00 58.31 58.22 2q3w n LYS 103 Cb 0.44 -2.47 -0.02 0.00 0.02 0.00 0.00 35.03 33.00 2q3w n LYS 103 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2q3w n GLY 104 N 3.68 0.65 3.03 3.14 0.00 -1.26 -4.98 105.19 109.45 2q3w n GLY 104 Ca 0.20 -0.34 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 2q3w n GLY 104 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2q3w s ILE 105 N -1.96 1.28 0.26 -0.61 1.01 -0.54 -5.14 121.20 115.50 2q3w s ILE 105 Ca 0.00 -0.54 0.11 0.00 0.00 0.00 0.00 60.65 60.22 2q3w s ILE 105 Cb 0.00 -1.18 -0.05 0.00 0.01 0.00 0.00 42.46 41.25 2q3w s ILE 105 CO 0.00 0.39 -0.10 -0.76 0.00 0.00 0.00 174.94 174.47 2q3w s LEU 106 N 0.83 2.91 0.77 2.97 1.43 -1.26 -4.99 118.68 121.34 2q3w s LEU 106 Ca -0.11 -0.80 -0.11 0.00 -1.03 0.00 0.00 54.13 52.09 2q3w s LEU 106 Cb -0.15 -1.45 0.06 0.00 0.03 0.00 0.00 46.19 44.67 2q3w s LEU 106 CO 0.02 0.03 1.10 -2.16 0.23 0.00 0.00 176.35 175.57 2q3w s PRO 107 N -3.48 2.23 -0.37 1.29 0.04 -1.26 -4.82 135.00 128.63 2q3w s PRO 107 Ca 0.30 1.23 -0.17 0.00 0.04 0.00 0.00 61.00 62.40 2q3w s PRO 107 Cb -0.06 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.59 2q3w s PRO 107 CO 0.17 -1.67 0.43 -0.80 0.04 0.00 0.00 177.00 175.17 2q3w s ASN 108 N -3.24 6.22 -0.09 6.66 0.01 -1.26 -4.97 114.94 118.27 2q3w s ASN 108 Ca 0.62 -0.35 0.05 0.00 -0.71 0.00 0.00 52.86 52.47 2q3w s ASN 108 Cb -0.18 -2.22 -0.00 0.00 0.41 0.00 0.00 41.25 39.25 2q3w s ASN 108 CO 0.54 -0.46 -0.24 -0.54 -1.51 0.00 0.00 177.10 174.89 2q3w s LYS 109 N 2.16 2.88 0.00 -0.60 1.02 -1.26 -4.32 119.74 119.61 2q3w s LYS 109 Ca 0.14 -0.88 0.01 0.00 0.02 0.00 0.00 55.97 55.25 2q3w s LYS 109 Cb -0.16 -2.25 0.08 0.00 -0.52 0.00 0.00 37.83 34.98 2q3w s LYS 109 CO 0.13 0.24 0.58 0.00 -0.92 0.00 0.00 175.35 175.38