#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g5w h ASP 2 N 0.00 0.17 -0.32 6.55 3.04 -2.01 -3.10 116.42 120.75 1g5w h ASP 2 Ca 0.00 -0.30 0.09 0.00 -3.24 0.00 0.00 57.03 53.58 1g5w h ASP 2 Cb 0.00 -0.05 -0.01 0.00 -1.04 0.00 0.00 39.33 38.23 1g5w h ASP 2 CO 0.00 0.43 0.28 0.00 -2.04 0.00 0.00 179.24 177.91 1g5w h ALA 3 N 0.75 2.13 0.00 4.15 0.00 -2.04 -2.17 119.26 122.08 1g5w h ALA 3 Ca 0.03 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1g5w h ALA 3 Cb 0.34 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1g5w h ALA 3 CO 0.00 -0.44 -0.28 0.74 0.00 0.00 0.00 179.25 179.27 1g5w h PHE 4 N 0.00 0.00 -3.36 0.00 0.04 -1.97 -3.46 116.94 108.19 1g5w h PHE 4 Ca 0.15 0.00 -0.57 0.00 2.80 0.00 0.00 57.97 60.36 1g5w h PHE 4 Cb 0.71 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.80 1g5w h PHE 4 CO 0.00 0.28 0.99 -0.51 -0.60 0.00 0.00 178.31 178.47 1g5w s LEU 5 N -7.40 3.70 0.00 1.54 1.43 -0.82 -4.62 118.68 112.52 1g5w s LEU 5 Ca -0.02 0.85 0.00 0.00 -1.03 0.00 0.00 54.13 53.94 1g5w s LEU 5 Cb 0.12 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.80 1g5w s LEU 5 CO 0.66 -1.25 0.00 0.61 0.23 0.00 0.00 176.35 176.60 1g5w n GLY 6 N 4.72 0.06 3.82 -3.19 0.00 -0.84 -4.99 105.19 104.77 1g5w n GLY 6 Ca 0.15 -1.17 -0.38 0.00 0.00 0.00 0.00 46.02 44.61 1g5w n GLY 6 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1g5w s THR 7 N -2.00 4.79 -0.14 2.61 2.01 -1.26 -1.76 115.64 119.89 1g5w s THR 7 Ca 0.00 1.14 -0.04 0.00 0.31 0.00 0.00 61.69 63.09 1g5w s THR 7 Cb 0.00 -3.86 0.06 0.00 0.01 0.00 0.00 72.50 68.71 1g5w s THR 7 CO 0.00 0.55 0.11 0.26 -0.69 0.00 0.00 174.62 174.84 1g5w s TRP 8 N -1.12 0.08 0.05 4.92 0.52 -0.65 -1.18 118.94 121.56 1g5w s TRP 8 Ca 0.28 -0.07 -0.06 0.00 0.02 0.00 0.00 56.10 56.27 1g5w s TRP 8 Cb -0.19 -0.58 -0.05 0.00 -1.15 0.00 0.00 33.47 31.50 1g5w s TRP 8 CO 0.18 -0.44 0.31 0.15 0.02 0.00 0.00 176.95 177.17 1g5w s LYS 9 N 2.18 3.61 0.05 4.98 1.02 -1.12 -1.55 119.74 128.91 1g5w s LYS 9 Ca 0.03 -0.05 -0.31 0.00 0.02 0.00 0.00 55.97 55.66 1g5w s LYS 9 Cb -0.15 -3.02 -0.07 0.00 -0.52 0.00 0.00 37.83 34.07 1g5w s LYS 9 CO -0.08 0.60 1.55 -1.17 -0.92 0.00 0.00 175.35 175.33 1g5w s LEU 10 N -2.00 4.35 -0.27 3.17 2.96 -1.26 -3.09 118.68 122.53 1g5w s LEU 10 Ca 0.32 2.37 -0.11 0.00 -0.22 0.00 0.00 54.13 56.48 1g5w s LEU 10 Cb -0.13 -3.57 -0.13 0.00 0.50 0.00 0.00 46.19 42.86 1g5w s LEU 10 CO 0.19 -0.82 -0.32 0.52 -1.32 0.00 0.00 176.35 174.60 1g5w n VAL 11 N 4.62 1.52 -3.91 1.68 0.31 -0.65 -4.94 118.33 116.97 1g5w n VAL 11 Ca 0.15 -0.42 -0.11 0.00 -0.01 0.00 0.00 64.34 63.95 1g5w n VAL 11 Cb 0.41 -1.79 -0.13 0.00 -0.91 0.00 0.00 33.84 31.42 1g5w n VAL 11 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1g5w s ASP 12 N -7.29 0.08 -0.41 4.52 -1.08 -0.88 -5.01 116.67 106.60 1g5w s ASP 12 Ca -0.38 -0.16 0.02 0.00 -0.52 0.00 0.00 52.55 51.51 1g5w s ASP 12 Cb 0.14 0.03 0.12 0.00 -1.46 0.00 0.00 42.92 41.75 1g5w s ASP 12 CO 0.52 -0.10 0.18 -0.94 0.52 0.00 0.00 175.17 175.35 1g5w s SER 13 N -0.47 4.10 -0.25 -0.34 1.04 -1.26 -1.96 113.70 114.56 1g5w s SER 13 Ca -0.05 -2.41 -0.26 0.00 0.48 0.00 0.00 55.95 53.71 1g5w s SER 13 Cb -0.03 -1.25 0.00 0.00 0.10 0.00 0.00 66.02 64.84 1g5w s SER 13 CO -0.00 -0.31 0.91 -0.75 0.98 0.00 0.00 173.24 174.06 1g5w s LYS 14 N 0.59 4.18 -0.64 4.02 2.20 -0.93 -4.25 119.74 124.91 1g5w s LYS 14 Ca 0.14 1.05 0.00 0.00 -0.36 0.00 0.00 55.97 56.80 1g5w s LYS 14 Cb -0.22 -3.66 0.00 0.00 -1.51 0.00 0.00 37.83 32.44 1g5w s LYS 14 CO -0.07 -0.59 0.00 0.09 -0.36 0.00 0.00 175.35 174.42 1g5w n ASN 15 N 6.18 -3.05 -4.39 1.43 3.02 -1.26 -2.05 115.26 115.14 1g5w n ASN 15 Ca 0.08 0.06 -0.44 0.00 -0.03 0.00 0.00 54.58 54.25 1g5w n ASN 15 Cb 0.47 -1.95 0.00 0.00 -0.61 0.00 0.00 39.78 37.69 1g5w n ASN 15 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1g5w n PHE 16 N -3.58 4.69 0.10 3.10 7.35 -1.26 -3.98 117.46 123.87 1g5w n PHE 16 Ca -0.08 -3.27 0.00 0.00 -0.76 0.00 0.00 57.45 53.35 1g5w n PHE 16 Cb 0.44 -2.18 0.00 0.00 0.35 0.00 0.00 39.48 38.10 1g5w n PHE 16 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1g5w n ASP 17 N 5.50 -1.72 -0.14 -2.13 2.03 -1.26 -4.64 116.55 114.19 1g5w n ASP 17 Ca 0.38 0.58 -0.04 0.00 0.52 0.00 0.00 54.79 56.23 1g5w n ASP 17 Cb 0.42 1.85 0.05 0.00 -0.72 0.00 0.00 41.12 42.71 1g5w n ASP 17 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 1g5w h ASP 18 N 0.00 0.01 -0.31 1.67 3.58 -1.99 -1.25 116.42 118.14 1g5w h ASP 18 Ca 0.00 0.08 0.07 0.00 0.42 0.00 0.00 57.03 57.59 1g5w h ASP 18 Cb 0.00 0.10 -0.08 0.00 1.72 0.00 0.00 39.33 41.07 1g5w h ASP 18 CO 0.00 0.04 -0.33 0.22 -2.88 0.00 0.00 179.24 176.29 1g5w h TYR 19 N 0.23 -0.91 -0.68 0.28 3.20 -1.79 -1.34 116.97 115.95 1g5w h TYR 19 Ca 0.22 0.05 -0.05 0.00 3.14 0.00 0.00 58.73 62.09 1g5w h TYR 19 Cb 0.27 0.45 -0.03 0.00 1.54 0.00 0.00 36.73 38.96 1g5w h TYR 19 CO -0.21 -0.39 0.24 0.52 -1.64 0.00 0.00 178.16 176.68 1g5w h MET 20 N -0.30 1.05 -0.47 1.82 2.86 -1.88 -2.67 114.93 115.34 1g5w h MET 20 Ca 0.15 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.52 1g5w h MET 20 Cb 0.54 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 1g5w h MET 20 CO -0.48 0.89 0.09 -0.22 1.06 0.00 0.00 176.91 178.26 1g5w h LYS 21 N 0.99 0.77 -1.00 1.72 3.64 -1.19 -2.61 116.57 118.88 1g5w h LYS 21 Ca 0.22 -0.20 0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1g5w h LYS 21 Cb 0.26 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 31.94 1g5w h LYS 21 CO -0.01 0.77 0.66 0.77 -2.27 0.00 0.00 179.45 179.37 1g5w h SER 22 N 0.64 1.15 0.14 4.20 0.02 -1.28 -2.98 113.55 115.43 1g5w h SER 22 Ca 0.14 -0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 61.02 1g5w h SER 22 Cb 0.36 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1g5w h SER 22 CO 0.01 0.83 -0.18 -0.07 -1.14 0.00 0.00 176.83 176.27 1g5w h LEU 23 N 1.36 0.09 -1.30 5.07 3.38 -1.48 -3.49 115.31 118.94 1g5w h LEU 23 Ca 0.37 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1g5w h LEU 23 Cb -0.16 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.57 1g5w h LEU 23 CO -0.08 0.29 0.00 0.61 0.09 0.00 0.00 178.44 179.35 1g5w n GLY 24 N -0.89 0.20 2.70 0.83 0.00 -1.02 -5.09 105.19 101.92 1g5w n GLY 24 Ca -0.02 -0.45 -0.28 0.00 0.00 0.00 0.00 46.02 45.27 1g5w n GLY 24 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g5w s VAL 25 N -1.25 1.80 0.00 1.61 1.01 -1.02 -5.03 120.40 117.52 1g5w s VAL 25 Ca 0.00 -3.50 0.00 0.00 0.00 0.00 0.00 61.98 58.48 1g5w s VAL 25 Cb 0.00 -2.20 0.00 0.00 0.00 0.00 0.00 36.38 34.18 1g5w s VAL 25 CO 0.00 -1.08 0.00 0.61 0.00 0.00 0.00 175.10 174.63 1g5w n GLY 26 N 2.46 1.22 1.76 4.51 0.00 -1.26 -3.65 105.19 110.23 1g5w n GLY 26 Ca 0.22 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.46 1g5w n GLY 26 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1g5w n PHE 27 N 7.06 -0.92 0.38 1.61 7.35 -1.26 -4.88 117.46 126.79 1g5w n PHE 27 Ca 0.00 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 56.83 1g5w n PHE 27 Cb 0.00 0.44 0.51 0.00 0.35 0.00 0.00 39.48 40.78 1g5w n PHE 27 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1g5w h ALA 28 N 0.05 1.00 -0.34 3.13 0.00 -2.00 -2.65 119.26 118.46 1g5w h ALA 28 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1g5w h ALA 28 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1g5w h ALA 28 CO 0.00 0.00 -0.19 1.15 0.00 0.00 0.00 179.25 180.21 1g5w h THR 29 N 0.00 1.29 -0.65 0.00 2.02 -1.93 -1.52 112.91 112.12 1g5w h THR 29 Ca 0.00 -1.32 0.08 0.00 0.77 0.00 0.00 66.41 65.94 1g5w h THR 29 Cb 0.54 1.41 -0.06 0.00 -1.74 0.00 0.00 68.15 68.30 1g5w h THR 29 CO 0.00 0.43 0.32 -0.09 0.37 0.00 0.00 175.52 176.55 1g5w h ARG 30 N 0.51 0.55 0.17 6.66 2.43 -1.59 -2.37 114.38 120.73 1g5w h ARG 30 Ca 0.07 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1g5w h ARG 30 Cb 0.74 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 1g5w h ARG 30 CO 0.06 0.36 -0.08 0.37 -1.51 0.00 0.00 179.97 179.17 1g5w h GLN 31 N 0.56 -0.22 -0.52 0.20 -0.00 -1.50 -3.20 115.11 110.43 1g5w h GLN 31 Ca 0.31 0.01 -0.09 0.00 -0.00 0.00 0.00 58.65 58.88 1g5w h GLN 31 Cb 0.30 0.05 -0.02 0.00 0.00 0.00 0.00 27.48 27.81 1g5w h GLN 31 CO -0.24 0.08 -0.04 0.28 0.00 0.00 0.00 178.83 178.90 1g5w h VAL 32 N -0.52 1.26 -0.30 2.39 2.07 -1.35 -2.98 116.25 116.83 1g5w h VAL 32 Ca -0.02 -1.13 -0.07 0.00 0.82 0.00 0.00 66.70 66.29 1g5w h VAL 32 Cb 0.40 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 1g5w h VAL 32 CO 0.04 0.40 -0.13 0.00 0.02 0.00 0.00 177.57 177.90 1g5w h ALA 33 N 1.12 1.23 -0.50 1.67 0.00 -1.55 -1.74 119.26 119.48 1g5w h ALA 33 Ca 0.15 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 1g5w h ALA 33 Cb 0.55 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1g5w h ALA 33 CO 0.03 0.50 -0.16 0.66 0.00 0.00 0.00 179.25 180.28 1g5w h SER 34 N 0.47 1.00 -0.66 0.00 4.64 -1.57 -3.30 113.55 114.12 1g5w h SER 34 Ca 0.09 -0.35 -0.07 0.00 -0.47 0.00 0.00 61.79 60.99 1g5w h SER 34 Cb 0.50 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.29 1g5w h SER 34 CO 0.03 1.14 0.16 -0.03 -0.87 0.00 0.00 176.83 177.26 1g5w h MET 35 N 0.86 1.07 -7.15 4.77 -1.53 -1.46 -3.46 114.93 108.02 1g5w h MET 35 Ca 0.12 -0.26 -0.48 0.00 -3.44 0.00 0.00 59.70 55.64 1g5w h MET 35 Cb 0.73 -0.14 0.04 0.00 -0.55 0.00 0.00 31.60 31.68 1g5w h MET 35 CO 0.06 0.96 0.38 0.99 0.14 0.00 0.00 176.91 179.43 1g5w s THR 36 N -5.30 3.96 -0.51 -0.77 2.01 -0.66 -5.06 115.64 109.31 1g5w s THR 36 Ca -0.12 1.03 -0.13 0.00 0.31 0.00 0.00 61.69 62.77 1g5w s THR 36 Cb 0.14 -3.47 0.13 0.00 0.01 0.00 0.00 72.50 69.30 1g5w s THR 36 CO 0.84 -0.45 0.43 -0.54 -0.69 0.00 0.00 174.62 174.21 1g5w s LYS 37 N -3.79 2.77 -0.39 4.92 1.02 -1.26 -4.94 119.74 118.07 1g5w s LYS 37 Ca 0.64 -1.73 -0.27 0.00 0.02 0.00 0.00 55.97 54.62 1g5w s LYS 37 Cb -0.15 -4.14 0.02 0.00 -0.52 0.00 0.00 37.83 33.04 1g5w s LYS 37 CO 0.30 -1.27 1.00 -1.25 -0.92 0.00 0.00 175.35 173.21 1g5w s PRO 38 N 1.50 3.85 -0.50 -1.68 0.04 -1.26 -4.70 135.00 132.24 1g5w s PRO 38 Ca 0.04 0.66 -0.26 0.00 0.04 0.00 0.00 61.00 61.48 1g5w s PRO 38 Cb -0.28 -3.82 0.03 0.00 0.04 0.00 0.00 34.50 30.47 1g5w s PRO 38 CO 0.01 -1.05 1.00 0.99 0.04 0.00 0.00 177.00 177.99 1g5w s THR 39 N 3.74 4.35 -0.31 1.26 2.01 -0.53 -4.52 115.64 121.64 1g5w s THR 39 Ca 0.42 0.73 -0.28 0.00 0.31 0.00 0.00 61.69 62.87 1g5w s THR 39 Cb -0.11 -4.52 0.01 0.00 0.01 0.00 0.00 72.50 67.89 1g5w s THR 39 CO 0.21 -0.99 1.00 -0.89 -0.69 0.00 0.00 174.62 173.26 1g5w s THR 40 N 4.07 4.58 -0.31 -0.82 2.01 -0.60 -1.35 115.64 123.22 1g5w s THR 40 Ca 0.38 1.60 -0.01 0.00 0.31 0.00 0.00 61.69 63.97 1g5w s THR 40 Cb -0.10 -4.35 0.06 0.00 0.01 0.00 0.00 72.50 68.13 1g5w s THR 40 CO 0.25 -0.42 0.02 -0.63 -0.69 0.00 0.00 174.62 173.15 1g5w s ILE 41 N 3.47 2.87 -0.27 1.82 1.01 -0.66 -1.64 121.20 127.80 1g5w s ILE 41 Ca 0.42 -1.58 -0.09 0.00 0.00 0.00 0.00 60.65 59.40 1g5w s ILE 41 Cb -0.13 -2.73 -0.04 0.00 0.01 0.00 0.00 42.46 39.57 1g5w s ILE 41 CO 0.14 -0.21 0.14 -0.63 0.00 0.00 0.00 174.94 174.38 1g5w s ILE 42 N 1.19 4.81 -0.16 2.92 1.01 -0.72 -1.76 121.20 128.49 1g5w s ILE 42 Ca -0.03 -0.04 -0.04 0.00 0.00 0.00 0.00 60.65 60.54 1g5w s ILE 42 Cb -0.20 -3.30 0.06 0.00 0.01 0.00 0.00 42.46 39.03 1g5w s ILE 42 CO -0.03 0.26 0.06 -0.70 0.00 0.00 0.00 174.94 174.54 1g5w s GLU 43 N 1.68 0.32 -0.36 2.79 -6.30 -1.11 -1.99 118.70 113.72 1g5w s GLU 43 Ca 0.06 -0.17 -0.24 0.00 -2.50 0.00 0.00 54.97 52.13 1g5w s GLU 43 Cb -0.16 -1.80 0.01 0.00 0.00 0.00 0.00 34.13 32.19 1g5w s GLU 43 CO 0.07 -0.61 0.82 0.21 0.02 0.00 0.00 175.26 175.77 1g5w s LYS 44 N 2.02 3.79 -0.74 4.30 2.20 -1.26 -1.11 119.74 128.94 1g5w s LYS 44 Ca 0.01 0.40 0.02 0.00 -0.36 0.00 0.00 55.97 56.04 1g5w s LYS 44 Cb -0.16 -3.80 0.18 0.00 -1.51 0.00 0.00 37.83 32.54 1g5w s LYS 44 CO -0.08 -0.86 0.56 1.21 -0.36 0.00 0.00 175.35 175.82 1g5w s ASN 45 N 1.83 5.23 -0.99 1.43 2.47 -0.64 -4.82 114.94 119.46 1g5w s ASN 45 Ca 0.33 -3.61 -0.05 0.00 0.42 0.00 0.00 52.86 49.95 1g5w s ASN 45 Cb -0.13 -1.76 -0.06 0.00 -1.45 0.00 0.00 41.25 37.85 1g5w s ASN 45 CO 0.17 -0.17 0.87 0.61 -3.72 0.00 0.00 177.10 174.86 1g5w n GLY 46 N 2.38 -1.01 4.32 1.21 0.00 -1.26 -2.82 105.19 108.02 1g5w n GLY 46 Ca 0.17 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.71 1g5w n GLY 46 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1g5w n ASP 47 N -3.12 0.00 -4.46 1.61 2.03 -1.26 -4.98 116.55 106.37 1g5w n ASP 47 Ca -0.08 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.80 1g5w n ASP 47 Cb 0.61 -0.57 -0.04 0.00 -0.72 0.00 0.00 41.12 40.41 1g5w n ASP 47 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1g5w s ILE 48 N -1.20 4.32 -0.55 5.18 -1.09 -1.13 -4.04 121.20 122.70 1g5w s ILE 48 Ca 0.00 -0.44 -0.28 0.00 -2.23 0.00 0.00 60.65 57.70 1g5w s ILE 48 Cb 0.00 -4.71 0.03 0.00 -1.58 0.00 0.00 42.46 36.20 1g5w s ILE 48 CO 0.00 -1.49 1.17 -0.76 -1.23 0.00 0.00 174.94 172.63 1g5w s LEU 49 N 4.04 3.52 -0.72 2.97 1.43 -0.51 -1.62 118.68 127.79 1g5w s LEU 49 Ca 0.24 0.20 -0.16 0.00 -1.03 0.00 0.00 54.13 53.38 1g5w s LEU 49 Cb -0.15 -3.27 0.16 0.00 0.03 0.00 0.00 46.19 42.96 1g5w s LEU 49 CO 0.08 -1.41 0.74 -0.89 0.23 0.00 0.00 176.35 175.10 1g5w s THR 50 N 4.78 5.23 -0.51 5.49 2.01 -0.27 -2.14 115.64 130.23 1g5w s THR 50 Ca 0.44 -1.81 -0.16 0.00 0.31 0.00 0.00 61.69 60.47 1g5w s THR 50 Cb -0.07 -4.48 0.10 0.00 0.01 0.00 0.00 72.50 68.05 1g5w s THR 50 CO 0.27 -1.08 0.47 -0.22 -0.69 0.00 0.00 174.62 173.37 1g5w s LEU 51 N 1.38 5.81 -0.29 4.42 0.20 -0.50 -2.77 118.68 126.93 1g5w s LEU 51 Ca 0.15 -1.50 -0.09 0.00 0.69 0.00 0.00 54.13 53.38 1g5w s LEU 51 Cb -0.17 -2.22 -0.01 0.00 -0.43 0.00 0.00 46.19 43.36 1g5w s LEU 51 CO -0.03 -0.77 0.13 -0.54 -0.29 0.00 0.00 176.35 174.84 1g5w s LYS 52 N 1.74 3.41 -0.76 1.98 1.02 -0.72 -2.52 119.74 123.88 1g5w s LYS 52 Ca 0.05 -0.66 -0.14 0.00 0.02 0.00 0.00 55.97 55.24 1g5w s LYS 52 Cb -0.26 -3.49 0.20 0.00 -0.52 0.00 0.00 37.83 33.76 1g5w s LYS 52 CO 0.05 -0.35 0.70 0.99 -0.92 0.00 0.00 175.35 175.82 1g5w s THR 53 N 1.61 5.45 -0.77 2.17 2.01 -0.88 -1.65 115.64 123.58 1g5w s THR 53 Ca 0.05 -2.30 -0.21 0.00 0.31 0.00 0.00 61.69 59.53 1g5w s THR 53 Cb -0.17 -4.40 0.09 0.00 0.01 0.00 0.00 72.50 68.03 1g5w s THR 53 CO 0.05 -0.99 1.05 -1.00 -0.69 0.00 0.00 174.62 173.04 1g5w s HIS 54 N 0.43 2.80 0.27 4.92 3.76 -0.45 -3.68 115.29 123.34 1g5w s HIS 54 Ca 0.15 -0.83 0.02 0.00 -0.15 0.00 0.00 55.06 54.25 1g5w s HIS 54 Cb -0.14 -4.32 -0.03 0.00 1.11 0.00 0.00 32.58 29.19 1g5w s HIS 54 CO -0.06 -1.62 0.44 0.45 -0.85 0.00 0.00 174.74 173.09 1g5w s SER 55 N 3.75 6.33 -1.50 1.40 0.15 -0.50 -1.45 113.70 121.89 1g5w s SER 55 Ca 0.27 0.31 -0.12 0.00 0.70 0.00 0.00 55.95 57.11 1g5w s SER 55 Cb -0.12 -1.97 0.01 0.00 -1.71 0.00 0.00 66.02 62.23 1g5w s SER 55 CO 0.03 -0.15 2.47 0.35 1.20 0.00 0.00 173.24 177.14 1g5w n THR 56 N -1.32 3.94 0.00 6.45 -2.24 -1.26 -3.60 114.28 116.25 1g5w n THR 56 Ca -0.06 -3.06 0.00 0.00 -2.27 0.00 0.00 64.05 58.66 1g5w n THR 56 Cb 0.56 -2.56 0.00 0.00 -2.10 0.00 0.00 70.33 66.23 1g5w n THR 56 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1g5w n PHE 57 N 4.76 0.00 -4.19 4.78 -0.00 -1.26 -5.07 117.46 116.48 1g5w n PHE 57 Ca 0.61 0.00 -0.11 0.00 -0.00 0.00 0.00 57.45 57.95 1g5w n PHE 57 Cb 0.32 0.00 -0.10 0.00 -0.00 0.00 0.00 39.48 39.70 1g5w n PHE 57 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.76 175.17 1g5w s LYS 58 N 0.00 0.96 -0.38 -4.13 0.00 -1.24 -5.13 119.74 109.82 1g5w s LYS 58 Ca 0.00 -1.43 0.02 0.00 0.00 0.00 0.00 55.97 54.56 1g5w s LYS 58 Cb 0.00 -0.12 0.15 0.00 0.00 0.00 0.00 37.83 37.86 1g5w s LYS 58 CO 0.00 -0.12 0.31 0.54 0.00 0.00 0.00 175.35 176.08 1g5w s ASN 59 N -3.09 1.93 -0.07 0.03 4.22 -1.26 -1.41 114.94 115.28 1g5w s ASN 59 Ca 0.19 -2.18 -0.23 0.00 -2.14 0.00 0.00 52.86 48.50 1g5w s ASN 59 Cb 0.06 -0.02 -0.04 0.00 1.28 0.00 0.00 41.25 42.53 1g5w s ASN 59 CO -0.00 -0.25 0.68 0.42 -2.04 0.00 0.00 177.10 175.91 1g5w s THR 60 N 0.96 5.06 -0.15 0.54 -4.23 -1.24 -4.86 115.64 111.71 1g5w s THR 60 Ca 0.21 1.41 -0.02 0.00 -1.18 0.00 0.00 61.69 62.11 1g5w s THR 60 Cb -0.14 -4.02 -0.02 0.00 1.34 0.00 0.00 72.50 69.65 1g5w s THR 60 CO -0.04 0.26 -0.07 -0.70 -0.54 0.00 0.00 174.62 173.52 1g5w s GLU 61 N 0.80 3.56 -0.13 3.99 -6.30 -1.26 -2.08 118.70 117.27 1g5w s GLU 61 Ca 0.37 -0.58 -0.01 0.00 -2.50 0.00 0.00 54.97 52.25 1g5w s GLU 61 Cb -0.18 -2.82 -0.02 0.00 0.00 0.00 0.00 34.13 31.12 1g5w s GLU 61 CO 0.17 0.22 -0.10 0.96 0.02 0.00 0.00 175.26 176.53 1g5w s ILE 62 N 0.39 3.32 -0.31 -3.70 -4.36 -1.05 -4.99 121.20 110.51 1g5w s ILE 62 Ca -0.06 -0.57 0.03 0.00 -0.26 0.00 0.00 60.65 59.79 1g5w s ILE 62 Cb -0.15 -2.41 0.08 0.00 1.25 0.00 0.00 42.46 41.24 1g5w s ILE 62 CO 0.04 0.52 -0.01 -0.94 0.24 0.00 0.00 174.94 174.79 1g5w s SER 63 N 0.25 4.59 -0.02 4.36 1.04 -1.25 -1.40 113.70 121.27 1g5w s SER 63 Ca -0.07 -1.83 0.00 0.00 0.48 0.00 0.00 55.95 54.53 1g5w s SER 63 Cb -0.15 -1.55 0.02 0.00 0.10 0.00 0.00 66.02 64.44 1g5w s SER 63 CO 0.05 -0.31 0.00 0.72 0.98 0.00 0.00 173.24 174.68 1g5w s PHE 64 N 1.02 0.17 0.29 5.02 -0.71 -0.91 -4.86 117.98 117.99 1g5w s PHE 64 Ca 0.03 0.03 -0.15 0.00 -1.04 0.00 0.00 56.93 55.80 1g5w s PHE 64 Cb -0.19 -0.24 -0.08 0.00 -1.21 0.00 0.00 43.02 41.29 1g5w s PHE 64 CO -0.08 -0.07 0.70 0.15 -1.34 0.00 0.00 175.22 174.58 1g5w s LYS 65 N 0.64 4.01 -0.22 1.99 1.02 -1.26 -1.42 119.74 124.50 1g5w s LYS 65 Ca -0.06 0.63 -0.29 0.00 0.02 0.00 0.00 55.97 56.27 1g5w s LYS 65 Cb -0.09 -2.55 -0.01 0.00 -0.52 0.00 0.00 37.83 34.65 1g5w s LYS 65 CO -0.01 0.23 1.40 -0.51 -0.92 0.00 0.00 175.35 175.53 1g5w s LEU 66 N -2.76 4.01 0.00 3.17 2.01 -1.26 -3.10 118.68 120.75 1g5w s LEU 66 Ca 0.51 1.54 0.00 0.00 0.01 0.00 0.00 54.13 56.18 1g5w s LEU 66 Cb -0.12 -3.54 0.00 0.00 0.01 0.00 0.00 46.19 42.55 1g5w s LEU 66 CO 0.19 -1.02 0.00 0.61 1.01 0.00 0.00 176.35 177.14 1g5w n GLY 67 N 4.18 0.72 2.80 -3.19 0.00 -0.36 -4.92 105.19 104.42 1g5w n GLY 67 Ca 0.16 -0.27 -0.22 0.00 0.00 0.00 0.00 46.02 45.69 1g5w n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g5w s VAL 68 N -2.19 0.40 -0.14 1.61 1.01 -1.18 -5.01 120.40 114.90 1g5w s VAL 68 Ca 0.00 0.07 -0.21 0.00 0.00 0.00 0.00 61.98 61.84 1g5w s VAL 68 Cb 0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 1g5w s VAL 68 CO 0.00 0.25 0.62 -0.70 0.00 0.00 0.00 175.10 175.27 1g5w s GLU 69 N 1.73 4.31 -0.02 2.72 2.12 -1.26 -3.98 118.70 124.32 1g5w s GLU 69 Ca 0.01 0.67 0.00 0.00 0.36 0.00 0.00 54.97 56.01 1g5w s GLU 69 Cb -0.13 -3.51 0.02 0.00 0.26 0.00 0.00 34.13 30.77 1g5w s GLU 69 CO -0.04 -0.07 0.02 -0.59 -0.54 0.00 0.00 175.26 174.03 1g5w s PHE 70 N 1.33 0.07 -0.15 5.30 -0.71 -1.06 -4.87 117.98 117.89 1g5w s PHE 70 Ca 0.31 0.07 -0.29 0.00 -1.04 0.00 0.00 56.93 55.98 1g5w s PHE 70 Cb -0.16 -0.19 -0.03 0.00 -1.21 0.00 0.00 43.02 41.42 1g5w s PHE 70 CO 0.13 -0.07 1.51 0.16 -1.34 0.00 0.00 175.22 175.61 1g5w s ASP 71 N 0.74 6.66 -0.04 1.98 1.47 -1.26 -1.35 116.67 124.86 1g5w s ASP 71 Ca -0.06 1.83 0.05 0.00 1.18 0.00 0.00 52.55 55.54 1g5w s ASP 71 Cb -0.09 -2.53 -0.01 0.00 -0.34 0.00 0.00 42.92 39.95 1g5w s ASP 71 CO -0.02 -0.99 -0.18 -0.70 0.68 0.00 0.00 175.17 173.96 1g5w s GLU 72 N 4.09 1.74 -0.21 2.11 2.56 -0.64 -4.91 118.70 123.44 1g5w s GLU 72 Ca 0.66 -0.63 -0.19 0.00 0.00 0.00 0.00 54.97 54.81 1g5w s GLU 72 Cb -0.26 -1.55 -0.03 0.00 2.00 0.00 0.00 34.13 34.29 1g5w s GLU 72 CO 0.25 0.29 0.54 0.99 -0.56 0.00 0.00 175.26 176.77 1g5w s THR 73 N -0.08 5.08 0.77 -1.70 2.01 -1.26 -1.66 115.64 118.80 1g5w s THR 73 Ca -0.01 0.99 -0.10 0.00 0.31 0.00 0.00 61.69 62.88 1g5w s THR 73 Cb -0.10 -3.86 0.08 0.00 0.01 0.00 0.00 72.50 68.62 1g5w s THR 73 CO 0.02 0.15 1.12 0.42 -0.69 0.00 0.00 174.62 175.63 1g5w s THR 74 N 1.79 2.12 0.52 -0.82 -4.23 -0.96 -4.90 115.64 109.15 1g5w s THR 74 Ca 0.25 -0.12 0.26 0.00 -1.18 0.00 0.00 61.69 60.89 1g5w s THR 74 Cb -0.15 -2.99 0.42 0.00 1.34 0.00 0.00 72.50 71.12 1g5w s THR 74 CO 0.10 0.00 1.95 0.00 -0.54 0.00 0.00 174.62 176.12 1g5w h ALA 75 N -0.90 2.57 -3.00 3.99 0.00 -1.98 -3.30 119.26 116.64 1g5w h ALA 75 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1g5w h ALA 75 Cb 1.32 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1g5w h ALA 75 CO 0.61 -0.77 0.00 -0.25 0.00 0.00 0.00 179.25 178.84 1g5w n ASP 76 N -4.36 0.00 0.00 0.00 9.92 -1.26 -5.05 116.55 115.80 1g5w n ASP 76 Ca 0.14 0.01 0.00 0.00 -0.53 0.00 0.00 54.79 54.41 1g5w n ASP 76 Cb 0.73 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.21 1g5w n ASP 76 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1g5w n ASP 77 N -0.21 0.00 -3.72 -2.24 5.75 -1.24 -5.18 116.55 109.71 1g5w n ASP 77 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 54.79 54.61 1g5w n ASP 77 Cb 0.00 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 39.92 1g5w n ASP 77 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1g5w s ARG 78 N 0.00 -0.05 -0.23 0.11 0.52 -1.26 -4.92 118.95 113.11 1g5w s ARG 78 Ca 0.00 0.30 -0.29 0.00 -0.52 0.00 0.00 55.73 55.22 1g5w s ARG 78 Cb 0.00 -0.37 -0.02 0.00 0.52 0.00 0.00 34.95 35.08 1g5w s ARG 78 CO 0.00 -0.25 1.43 -1.59 0.02 0.00 0.00 175.30 174.91 1g5w s LYS 79 N 1.65 3.95 -0.04 3.54 0.00 -1.26 -2.27 119.74 125.31 1g5w s LYS 79 Ca -0.02 1.53 0.01 0.00 0.00 0.00 0.00 55.97 57.50 1g5w s LYS 79 Cb -0.12 -3.92 0.02 0.00 0.00 0.00 0.00 37.83 33.80 1g5w s LYS 79 CO -0.03 -1.09 -0.05 0.14 0.00 0.00 0.00 175.35 174.32 1g5w s VAL 80 N 4.50 0.55 -0.60 1.79 -7.23 -0.67 -4.80 120.40 113.94 1g5w s VAL 80 Ca 0.63 -0.13 -0.26 0.00 -1.81 0.00 0.00 61.98 60.41 1g5w s VAL 80 Cb -0.22 -0.57 0.04 0.00 0.56 0.00 0.00 36.38 36.19 1g5w s VAL 80 CO 0.24 0.23 1.08 -0.54 -0.31 0.00 0.00 175.10 175.80 1g5w s LYS 81 N 0.91 3.35 -0.64 4.82 -0.14 -0.76 -1.62 119.74 125.66 1g5w s LYS 81 Ca -0.11 -0.14 -0.14 0.00 -1.36 0.00 0.00 55.97 54.22 1g5w s LYS 81 Cb -0.14 -4.08 0.16 0.00 -1.68 0.00 0.00 37.83 32.09 1g5w s LYS 81 CO 0.00 -1.69 0.58 -1.12 -0.76 0.00 0.00 175.35 172.36 1g5w s SER 82 N 3.11 6.31 -0.25 2.83 0.01 -0.46 -2.24 113.70 123.01 1g5w s SER 82 Ca 0.35 -2.19 -0.09 0.00 1.31 0.00 0.00 55.95 55.33 1g5w s SER 82 Cb -0.11 -2.17 -0.04 0.00 0.21 0.00 0.00 66.02 63.91 1g5w s SER 82 CO 0.20 -0.71 0.12 -0.51 0.41 0.00 0.00 173.24 172.74 1g5w s ILE 83 N 0.96 4.80 -0.06 1.44 1.10 -0.63 -2.55 121.20 126.26 1g5w s ILE 83 Ca 0.09 -0.01 -0.03 0.00 -0.51 0.00 0.00 60.65 60.20 1g5w s ILE 83 Cb -0.22 -3.25 0.04 0.00 0.15 0.00 0.00 42.46 39.18 1g5w s ILE 83 CO -0.02 0.32 0.12 0.54 -2.11 0.00 0.00 174.94 173.79 1g5w s VAL 84 N 1.48 -0.16 0.08 4.00 0.11 -1.26 -1.30 120.40 123.36 1g5w s VAL 84 Ca 0.06 0.32 0.01 0.00 -2.93 0.00 0.00 61.98 59.44 1g5w s VAL 84 Cb -0.15 -0.22 -0.04 0.00 -1.53 0.00 0.00 36.38 34.44 1g5w s VAL 84 CO 0.06 0.13 -0.06 0.28 -3.33 0.00 0.00 175.10 172.19 1g5w s THR 85 N 1.87 0.56 -0.42 5.04 -1.32 -0.98 -1.23 115.64 119.16 1g5w s THR 85 Ca -0.01 -1.88 -0.21 0.00 -1.21 0.00 0.00 61.69 58.38 1g5w s THR 85 Cb -0.12 -1.61 0.02 0.00 -1.51 0.00 0.00 72.50 69.28 1g5w s THR 85 CO -0.05 -0.90 0.69 -0.22 -2.21 0.00 0.00 174.62 171.93 1g5w s LEU 86 N -2.97 4.37 -0.86 9.08 2.96 -1.26 -1.59 118.68 128.41 1g5w s LEU 86 Ca 0.10 -0.15 -0.12 0.00 -0.22 0.00 0.00 54.13 53.74 1g5w s LEU 86 Cb 0.06 -2.81 0.22 0.00 0.50 0.00 0.00 46.19 44.16 1g5w s LEU 86 CO -0.06 -0.78 0.79 -0.62 -1.32 0.00 0.00 176.35 174.37 1g5w s ASP 87 N 1.99 6.68 -1.28 3.68 2.15 -0.19 -4.70 116.67 124.99 1g5w s ASP 87 Ca 0.25 -2.91 -0.03 0.00 0.43 0.00 0.00 52.55 50.30 1g5w s ASP 87 Cb -0.14 -2.16 0.01 0.00 -0.30 0.00 0.00 42.92 40.33 1g5w s ASP 87 CO 0.19 -0.49 0.97 0.61 -0.17 0.00 0.00 175.17 176.29 1g5w n GLY 88 N 3.63 -0.39 2.11 2.66 0.00 -1.26 -2.96 105.19 108.98 1g5w n GLY 88 Ca 0.15 0.14 -0.05 0.00 0.00 0.00 0.00 46.02 46.26 1g5w n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1g5w n GLY 89 N -1.43 0.28 2.77 -0.02 0.00 -1.26 -5.07 105.19 100.46 1g5w n GLY 89 Ca -0.21 -0.69 -0.25 0.00 0.00 0.00 0.00 46.02 44.86 1g5w n GLY 89 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1g5w s LYS 90 N -3.90 0.73 -0.73 1.61 2.20 -1.16 -4.76 119.74 113.73 1g5w s LYS 90 Ca 0.00 -0.11 -0.23 0.00 -0.36 0.00 0.00 55.97 55.27 1g5w s LYS 90 Cb 0.00 -1.42 0.07 0.00 -1.51 0.00 0.00 37.83 34.97 1g5w s LYS 90 CO 0.00 -0.41 1.07 -1.17 -0.36 0.00 0.00 175.35 174.48 1g5w s LEU 91 N 1.90 4.22 -0.38 5.43 0.20 -0.89 -1.03 118.68 128.14 1g5w s LEU 91 Ca 0.03 -1.08 -0.10 0.00 0.69 0.00 0.00 54.13 53.67 1g5w s LEU 91 Cb -0.14 -2.45 0.04 0.00 -0.43 0.00 0.00 46.19 43.21 1g5w s LEU 91 CO -0.06 -1.46 0.20 -0.69 -0.29 0.00 0.00 176.35 174.04 1g5w s VAL 92 N 4.21 4.38 -0.10 1.68 1.01 -0.62 -1.74 120.40 129.22 1g5w s VAL 92 Ca 0.27 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 1g5w s VAL 92 Cb -0.13 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 1g5w s VAL 92 CO 0.07 -0.28 -0.06 -2.28 0.00 0.00 0.00 175.10 172.55 1g5w s HIS 93 N 1.51 2.96 -0.10 5.22 5.04 -1.20 -2.32 115.29 126.39 1g5w s HIS 93 Ca 0.01 -0.11 -0.00 0.00 -1.54 0.00 0.00 55.06 53.42 1g5w s HIS 93 Cb -0.20 -1.79 0.02 0.00 0.04 0.00 0.00 32.58 30.65 1g5w s HIS 93 CO 0.05 0.19 -0.07 -1.17 -2.34 0.00 0.00 174.74 171.41 1g5w s LEU 94 N -0.39 1.14 -0.26 8.88 2.96 -0.42 -1.44 118.68 129.15 1g5w s LEU 94 Ca 0.06 -0.26 -0.06 0.00 -0.22 0.00 0.00 54.13 53.64 1g5w s LEU 94 Cb -0.12 -0.77 -0.01 0.00 0.50 0.00 0.00 46.19 45.79 1g5w s LEU 94 CO 0.02 -0.11 0.04 -1.10 -1.32 0.00 0.00 176.35 173.88 1g5w s GLN 95 N 1.63 3.38 -0.06 1.98 -0.21 -0.74 -1.61 119.66 124.03 1g5w s GLN 95 Ca 0.03 -0.65 0.05 0.00 0.02 0.00 0.00 55.36 54.81 1g5w s GLN 95 Cb -0.13 -3.26 -0.01 0.00 1.00 0.00 0.00 33.01 30.61 1g5w s GLN 95 CO -0.06 -0.28 -0.23 -1.59 -2.12 0.00 0.00 175.29 171.01 1g5w s LYS 96 N 1.54 2.36 -0.29 2.91 -2.85 -0.95 -1.26 119.74 121.20 1g5w s LYS 96 Ca 0.05 -0.82 -0.01 0.00 -1.00 0.00 0.00 55.97 54.19 1g5w s LYS 96 Cb -0.16 -1.99 0.18 0.00 -2.06 0.00 0.00 37.83 33.80 1g5w s LYS 96 CO 0.01 0.33 0.55 1.67 0.10 0.00 0.00 175.35 178.01 1g5w s TRP 97 N -0.07 -1.45 -1.23 1.78 -2.14 -0.38 -1.82 118.94 113.63 1g5w s TRP 97 Ca -0.05 1.53 -0.07 0.00 2.66 0.00 0.00 56.10 60.18 1g5w s TRP 97 Cb -0.13 0.46 -0.01 0.00 -3.10 0.00 0.00 33.47 30.68 1g5w s TRP 97 CO 0.04 -0.85 0.74 -3.47 -2.66 0.00 0.00 176.95 170.75 1g5w n ASP 98 N 5.42 -3.02 0.00 -2.66 -0.08 -1.26 -1.97 116.55 112.98 1g5w n ASP 98 Ca -0.02 -0.87 0.00 0.00 -1.51 0.00 0.00 54.79 52.40 1g5w n ASP 98 Cb 0.51 -3.99 0.00 0.00 2.34 0.00 0.00 41.12 39.98 1g5w n ASP 98 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1g5w n GLY 99 N -1.57 1.90 3.73 0.27 0.00 -1.26 -5.02 105.19 103.24 1g5w n GLY 99 Ca -0.21 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.07 1g5w n GLY 99 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1g5w s GLN 100 N 0.00 4.44 -0.05 1.61 -0.21 -0.83 -5.07 119.66 119.54 1g5w s GLN 100 Ca 0.00 0.90 -0.02 0.00 0.02 0.00 0.00 55.36 56.27 1g5w s GLN 100 Cb 0.00 -3.42 0.04 0.00 1.00 0.00 0.00 33.01 30.62 1g5w s GLN 100 CO 0.00 0.13 0.10 -1.83 -2.12 0.00 0.00 175.29 171.57 1g5w s GLU 101 N 0.56 0.01 -0.14 2.91 1.03 -1.26 -1.25 118.70 120.55 1g5w s GLU 101 Ca 0.37 0.35 0.02 0.00 0.03 0.00 0.00 54.97 55.75 1g5w s GLU 101 Cb -0.18 -0.28 0.01 0.00 -0.80 0.00 0.00 34.13 32.88 1g5w s GLU 101 CO 0.19 -0.22 -0.20 -0.08 -1.33 0.00 0.00 175.26 173.61 1g5w s THR 102 N 1.53 1.94 -0.04 1.83 -1.32 -0.39 -4.37 115.64 114.82 1g5w s THR 102 Ca -0.04 -0.90 -0.08 0.00 -1.21 0.00 0.00 61.69 59.45 1g5w s THR 102 Cb -0.12 -1.74 -0.05 0.00 -1.51 0.00 0.00 72.50 69.09 1g5w s THR 102 CO -0.04 0.53 0.24 0.42 -2.21 0.00 0.00 174.62 173.55 1g5w s THR 103 N 0.95 5.33 -0.70 5.08 -4.23 -0.87 -1.79 115.64 119.40 1g5w s THR 103 Ca -0.05 0.30 0.05 0.00 -1.18 0.00 0.00 61.69 60.82 1g5w s THR 103 Cb -0.15 -3.53 0.17 0.00 1.34 0.00 0.00 72.50 70.33 1g5w s THR 103 CO -0.04 0.51 0.49 -0.76 -0.54 0.00 0.00 174.62 174.28 1g5w s LEU 104 N -1.35 4.83 -0.42 4.79 1.02 -0.52 -2.72 118.68 124.32 1g5w s LEU 104 Ca 0.22 -3.82 -0.21 0.00 0.02 0.00 0.00 54.13 50.34 1g5w s LEU 104 Cb -0.13 -1.65 0.02 0.00 0.02 0.00 0.00 46.19 44.45 1g5w s LEU 104 CO 0.11 -0.09 0.67 -0.69 0.02 0.00 0.00 176.35 176.37 1g5w s VAL 105 N -1.41 4.80 -0.18 -1.59 1.01 -0.87 -3.24 120.40 118.93 1g5w s VAL 105 Ca 0.25 0.30 -0.07 0.00 0.00 0.00 0.00 61.98 62.46 1g5w s VAL 105 Cb -0.06 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 1g5w s VAL 105 CO -0.16 -0.56 0.04 -0.13 0.00 0.00 0.00 175.10 174.30 1g5w s ARG 106 N 2.90 3.91 -0.10 2.72 0.52 -0.71 -1.24 118.95 126.94 1g5w s ARG 106 Ca 0.25 -0.37 -0.05 0.00 -0.52 0.00 0.00 55.73 55.04 1g5w s ARG 106 Cb -0.14 -3.16 0.05 0.00 0.52 0.00 0.00 34.95 32.22 1g5w s ARG 106 CO 0.19 0.28 0.23 -1.83 0.02 0.00 0.00 175.30 174.19 1g5w s GLU 107 N 0.33 0.18 -0.31 3.54 -1.05 -0.97 -2.10 118.70 118.32 1g5w s GLU 107 Ca 0.02 0.51 -0.29 0.00 -0.15 0.00 0.00 54.97 55.06 1g5w s GLU 107 Cb -0.13 -0.13 0.02 0.00 -0.44 0.00 0.00 34.13 33.45 1g5w s GLU 107 CO 0.01 -0.17 1.09 -0.51 0.95 0.00 0.00 175.26 176.62 1g5w s LEU 108 N 1.33 3.95 -0.34 1.83 2.01 -1.26 -1.58 118.68 124.63 1g5w s LEU 108 Ca -0.08 1.11 0.04 0.00 0.01 0.00 0.00 54.13 55.20 1g5w s LEU 108 Cb -0.11 -3.54 0.10 0.00 0.01 0.00 0.00 46.19 42.65 1g5w s LEU 108 CO -0.08 -0.87 0.05 -0.63 1.01 0.00 0.00 176.35 175.83 1g5w s ILE 109 N 3.64 2.27 -1.25 -0.59 -1.09 -0.58 -4.86 121.20 118.74 1g5w s ILE 109 Ca 0.46 -2.33 -0.00 0.00 -2.23 0.00 0.00 60.65 56.54 1g5w s ILE 109 Cb -0.13 -2.68 0.00 0.00 -1.58 0.00 0.00 42.46 38.07 1g5w s ILE 109 CO 0.15 -0.59 0.87 0.47 -1.23 0.00 0.00 174.94 174.61 1g5w n ASP 110 N 4.26 -1.74 0.00 3.58 9.92 -1.26 -2.26 116.55 129.04 1g5w n ASP 110 Ca 0.04 -0.70 0.00 0.00 -0.53 0.00 0.00 54.79 53.59 1g5w n ASP 110 Cb 0.42 -4.66 0.00 0.00 -0.64 0.00 0.00 41.12 36.24 1g5w n ASP 110 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1g5w n GLY 111 N -1.33 2.11 3.73 0.44 0.00 -1.26 -5.05 105.19 103.82 1g5w n GLY 111 Ca -0.29 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 44.96 1g5w n GLY 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g5w s LYS 112 N 0.00 4.56 -0.41 1.61 1.02 -0.96 -4.74 119.74 120.81 1g5w s LYS 112 Ca 0.00 1.22 -0.28 0.00 0.02 0.00 0.00 55.97 56.94 1g5w s LYS 112 Cb 0.00 -3.40 0.02 0.00 -0.52 0.00 0.00 37.83 33.93 1g5w s LYS 112 CO 0.00 0.15 1.04 -1.17 -0.92 0.00 0.00 175.35 174.46 1g5w s LEU 113 N 0.34 3.84 -0.51 3.17 2.96 -0.86 -1.53 118.68 126.09 1g5w s LEU 113 Ca 0.44 0.59 -0.16 0.00 -0.22 0.00 0.00 54.13 54.78 1g5w s LEU 113 Cb -0.21 -3.43 0.10 0.00 0.50 0.00 0.00 46.19 43.15 1g5w s LEU 113 CO 0.25 -1.04 0.46 -0.63 -1.32 0.00 0.00 176.35 174.07 1g5w s ILE 114 N 3.93 5.21 -0.58 6.68 -1.09 -0.61 -1.97 121.20 132.76 1g5w s ILE 114 Ca 0.44 -1.27 -0.21 0.00 -2.23 0.00 0.00 60.65 57.37 1g5w s ILE 114 Cb -0.10 -4.24 0.07 0.00 -1.58 0.00 0.00 42.46 36.60 1g5w s ILE 114 CO 0.24 -0.74 0.83 -0.22 -1.23 0.00 0.00 174.94 173.81 1g5w s LEU 115 N 1.66 4.65 -0.39 2.97 2.96 -0.54 -2.30 118.68 127.69 1g5w s LEU 115 Ca 0.04 -0.90 -0.20 0.00 -0.22 0.00 0.00 54.13 52.84 1g5w s LEU 115 Cb -0.27 -2.50 0.01 0.00 0.50 0.00 0.00 46.19 43.93 1g5w s LEU 115 CO 0.05 -1.20 0.63 -0.89 -1.32 0.00 0.00 176.35 173.62 1g5w s THR 116 N 3.43 4.87 -0.83 3.68 2.01 -0.37 -1.62 115.64 126.81 1g5w s THR 116 Ca 0.20 0.38 -0.09 0.00 0.31 0.00 0.00 61.69 62.49 1g5w s THR 116 Cb -0.18 -4.12 0.21 0.00 0.01 0.00 0.00 72.50 68.43 1g5w s THR 116 CO 0.12 -0.42 0.74 -0.76 -0.69 0.00 0.00 174.62 173.61 1g5w s LEU 117 N 2.73 6.15 -0.36 4.42 1.43 -0.43 -2.05 118.68 130.57 1g5w s LEU 117 Ca 0.23 -3.01 -0.11 0.00 -1.03 0.00 0.00 54.13 50.20 1g5w s LEU 117 Cb -0.14 -2.08 0.01 0.00 0.03 0.00 0.00 46.19 44.01 1g5w s LEU 117 CO 0.16 -0.42 0.21 -0.89 0.23 0.00 0.00 176.35 175.64 1g5w s THR 118 N -0.32 4.78 -0.77 5.49 2.01 -1.10 -1.56 115.64 124.16 1g5w s THR 118 Ca 0.21 -0.61 -0.05 0.00 0.31 0.00 0.00 61.69 61.55 1g5w s THR 118 Cb -0.12 -3.57 0.20 0.00 0.01 0.00 0.00 72.50 69.02 1g5w s THR 118 CO -0.08 -0.12 0.64 -2.28 -0.69 0.00 0.00 174.62 172.09 1g5w s HIS 119 N 1.61 3.66 0.00 4.92 5.04 -1.16 -2.06 115.29 127.30 1g5w s HIS 119 Ca 0.04 -2.66 0.00 0.00 -1.54 0.00 0.00 55.06 50.90 1g5w s HIS 119 Cb -0.18 -3.37 0.00 0.00 0.04 0.00 0.00 32.58 29.07 1g5w s HIS 119 CO 0.08 -0.85 0.00 0.41 -2.34 0.00 0.00 174.74 172.04 1g5w n GLY 120 N 3.21 1.34 0.09 1.59 0.00 -1.26 -3.38 105.19 106.78 1g5w n GLY 120 Ca 0.14 0.20 -0.18 0.00 0.00 0.00 0.00 46.02 46.18 1g5w n GLY 120 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1g5w h THR 121 N 0.00 1.00 -3.21 2.61 2.02 -2.00 -3.46 112.91 109.87 1g5w h THR 121 Ca 0.00 -2.06 -0.56 0.00 0.77 0.00 0.00 66.41 64.56 1g5w h THR 121 Cb 0.00 2.20 -0.06 0.00 -1.74 0.00 0.00 68.15 68.54 1g5w h THR 121 CO 0.00 0.34 1.03 0.00 0.37 0.00 0.00 175.52 177.26 1g5w s ALA 122 N -2.37 2.98 -0.21 6.16 0.00 -1.22 -5.01 121.76 122.09 1g5w s ALA 122 Ca -0.24 -0.56 -0.06 0.00 0.00 0.00 0.00 51.96 51.11 1g5w s ALA 122 Cb 0.03 -4.01 -0.03 0.00 0.00 0.00 0.00 23.12 19.12 1g5w s ALA 122 CO 0.56 -2.61 0.02 0.54 0.00 0.00 0.00 175.76 174.27 1g5w s VAL 123 N 5.31 4.09 -0.42 0.00 0.11 -1.26 -2.99 120.40 125.24 1g5w s VAL 123 Ca 0.51 -0.26 -0.14 0.00 -2.93 0.00 0.00 61.98 59.16 1g5w s VAL 123 Cb -0.10 -2.86 0.04 0.00 -1.53 0.00 0.00 36.38 31.93 1g5w s VAL 123 CO 0.28 0.41 0.30 0.00 -3.33 0.00 0.00 175.10 172.77 1g5w s THR 125 N 1.63 4.72 -0.27 0.00 2.01 -0.87 -1.32 115.64 121.54 1g5w s THR 125 Ca 0.04 0.44 -0.07 0.00 0.31 0.00 0.00 61.69 62.42 1g5w s THR 125 Cb -0.21 -4.26 -0.01 0.00 0.01 0.00 0.00 72.50 68.04 1g5w s THR 125 CO 0.08 -0.62 0.06 -0.13 -0.69 0.00 0.00 174.62 173.32 1g5w s ARG 126 N 3.12 3.32 -0.02 4.92 0.52 -0.64 -2.19 118.95 127.98 1g5w s ARG 126 Ca 0.28 -0.70 -0.21 0.00 -0.52 0.00 0.00 55.73 54.59 1g5w s ARG 126 Cb -0.13 -3.31 -0.05 0.00 0.52 0.00 0.00 34.95 31.98 1g5w s ARG 126 CO 0.20 -0.33 0.59 0.99 0.02 0.00 0.00 175.30 176.78 1g5w s THR 127 N 1.54 4.94 -0.04 0.02 2.01 -0.83 -1.47 115.64 121.81 1g5w s THR 127 Ca 0.04 1.24 0.04 0.00 0.31 0.00 0.00 61.69 63.32 1g5w s THR 127 Cb -0.16 -3.93 -0.00 0.00 0.01 0.00 0.00 72.50 68.42 1g5w s THR 127 CO 0.02 0.40 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.90 1g5w s TYR 128 N -0.08 1.39 0.13 4.92 1.51 -0.83 -1.64 117.35 122.76 1g5w s TYR 128 Ca 0.31 -0.38 0.02 0.00 -1.01 0.00 0.00 57.07 56.02 1g5w s TYR 128 Cb -0.18 -0.95 -0.04 0.00 -0.11 0.00 0.00 41.96 40.68 1g5w s TYR 128 CO 0.17 -0.13 0.24 -1.21 -1.11 0.00 0.00 175.55 173.51 1g5w s GLU 129 N 0.09 3.34 -0.13 -0.62 0.41 -1.18 -2.03 118.70 118.59 1g5w s GLU 129 Ca -0.03 -0.62 -0.25 0.00 -0.41 0.00 0.00 54.97 53.66 1g5w s GLU 129 Cb -0.10 -2.92 -0.02 0.00 -1.78 0.00 0.00 34.13 29.30 1g5w s GLU 129 CO 0.01 0.53 0.80 0.21 -0.49 0.00 0.00 175.26 176.32 1g5w s LYS 130 N -3.08 4.35 -0.42 1.61 2.20 -1.26 -2.80 119.74 120.34 1g5w s LYS 130 Ca 0.34 0.99 0.07 0.00 -0.36 0.00 0.00 55.97 57.01 1g5w s LYS 130 Cb -0.11 -3.53 0.43 0.00 -1.51 0.00 0.00 37.83 33.10 1g5w s LYS 130 CO 0.27 -0.20 1.08 0.39 -0.36 0.00 0.00 175.35 176.53 1g5w n GLU 131 N 4.76 3.05 0.00 4.03 -0.58 -0.32 -4.97 120.64 126.60 1g5w n GLU 131 Ca 0.03 -4.31 0.03 0.00 -0.42 0.00 0.00 57.16 52.49 1g5w n GLU 131 Cb 0.50 -2.08 0.03 0.00 -0.57 0.00 0.00 31.44 29.31 1g5w n GLU 131 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65