#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 0.76 -0.04 6.55 1.82 -2.02 -3.25 116.42 120.25 1g5w h ASP 2 Ca 0.00 -0.76 0.01 0.00 -0.39 0.00 0.00 57.03 55.90 1g5w h ASP 2 Cb 0.00 -0.24 -0.00 0.00 0.68 0.00 0.00 39.33 39.76 1g5w h ASP 2 CO 0.00 1.58 0.06 0.00 -1.61 0.00 0.00 179.24 179.27 1g5w h ALA 3 N 0.33 1.47 0.00 -0.78 0.00 -2.04 -2.52 119.26 115.72 1g5w h ALA 3 Ca -0.20 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1g5w h ALA 3 Cb 2.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.79 1g5w h ALA 3 CO 0.24 -0.08 -0.01 0.74 0.00 0.00 0.00 179.25 180.14 1g5w h PHE 4 N 0.00 0.00 -3.18 0.00 -1.00 -1.98 -3.46 116.94 107.31 1g5w h PHE 4 Ca 0.02 0.00 -0.58 0.00 2.81 0.00 0.00 57.97 60.22 1g5w h PHE 4 Cb 0.14 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 39.65 1g5w h PHE 4 CO 0.00 0.01 0.64 -0.51 -1.61 0.00 0.00 178.31 176.84 1g5w s LEU 5 N -6.21 4.15 0.00 1.54 1.43 -0.95 -4.62 118.68 114.02 1g5w s LEU 5 Ca 0.01 1.35 0.00 0.00 -1.03 0.00 0.00 54.13 54.46 1g5w s LEU 5 Cb 0.09 -3.46 0.00 0.00 0.03 0.00 0.00 46.19 42.85 1g5w s LEU 5 CO 0.54 -0.55 0.00 0.61 0.23 0.00 0.00 176.35 177.17 1g5w n GLY 6 N 3.32 0.84 3.80 -3.19 0.00 -1.06 -5.00 105.19 103.90 1g5w n GLY 6 Ca 0.09 -1.29 -0.38 0.00 0.00 0.00 0.00 46.02 44.44 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 -1.94 5.08 -0.14 2.61 2.01 -1.26 -2.25 115.64 119.76 1g5w s THR 7 Ca 0.00 0.85 -0.03 0.00 0.31 0.00 0.00 61.69 62.81 1g5w s THR 7 Cb 0.00 -3.73 0.05 0.00 0.01 0.00 0.00 72.50 68.83 1g5w s THR 7 CO 0.00 0.51 0.06 0.26 -0.69 0.00 0.00 174.62 174.76 1g5w s TRP 8 N -0.56 0.39 -0.02 4.92 0.52 -0.73 -0.89 118.94 122.57 1g5w s TRP 8 Ca 0.24 -0.28 -0.07 0.00 0.02 0.00 0.00 56.10 56.00 1g5w s TRP 8 Cb -0.16 -0.73 -0.05 0.00 -1.15 0.00 0.00 33.47 31.39 1g5w s TRP 8 CO 0.12 -0.44 0.25 0.15 0.02 0.00 0.00 176.95 177.05 1g5w s LYS 9 N 2.07 3.57 -0.18 4.98 1.02 -1.02 -1.56 119.74 128.62 1g5w s LYS 9 Ca 0.02 -0.06 -0.29 0.00 0.02 0.00 0.00 55.97 55.66 1g5w s LYS 9 Cb -0.15 -3.11 -0.03 0.00 -0.52 0.00 0.00 37.83 34.02 1g5w s LYS 9 CO -0.07 0.68 1.52 -1.17 -0.92 0.00 0.00 175.35 175.38 1g5w s LEU 10 N -1.59 4.06 -0.23 3.17 2.96 -1.26 -3.08 118.68 122.70 1g5w s LEU 10 Ca 0.25 1.74 -0.04 0.00 -0.22 0.00 0.00 54.13 55.86 1g5w s LEU 10 Cb -0.13 -3.53 -0.18 0.00 0.50 0.00 0.00 46.19 42.84 1g5w s LEU 10 CO 0.14 -1.05 -0.11 0.52 -1.32 0.00 0.00 176.35 174.53 1g5w n VAL 11 N 5.94 1.56 -3.74 1.68 0.31 -0.73 -4.96 118.33 118.37 1g5w n VAL 11 Ca 0.17 -0.52 -0.12 0.00 -0.01 0.00 0.00 64.34 63.85 1g5w n VAL 11 Cb 0.45 -1.60 -0.12 0.00 -0.91 0.00 0.00 33.84 31.66 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 -6.82 -0.32 -0.33 4.52 -1.08 -0.97 -5.01 116.67 106.66 1g5w s ASP 12 Ca -0.33 0.61 0.03 0.00 -0.52 0.00 0.00 52.55 52.35 1g5w s ASP 12 Cb 0.09 0.55 0.10 0.00 -1.46 0.00 0.00 42.92 42.20 1g5w s ASP 12 CO 0.61 -0.14 0.04 -0.94 0.52 0.00 0.00 175.17 175.27 1g5w s SER 13 N 0.75 4.64 -0.22 -0.34 1.04 -1.26 -1.88 113.70 116.43 1g5w s SER 13 Ca -0.05 -2.03 -0.17 0.00 0.48 0.00 0.00 55.95 54.18 1g5w s SER 13 Cb -0.06 -1.52 -0.03 0.00 0.10 0.00 0.00 66.02 64.51 1g5w s SER 13 CO -0.05 -0.37 0.48 -0.54 0.98 0.00 0.00 173.24 173.74 1g5w s LYS 14 N 1.01 4.14 -1.38 4.02 1.02 -1.22 -4.47 119.74 122.87 1g5w s LYS 14 Ca 0.09 0.31 0.00 0.00 0.02 0.00 0.00 55.97 56.40 1g5w s LYS 14 Cb -0.19 -3.59 0.00 0.00 -0.52 0.00 0.00 37.83 33.53 1g5w s LYS 14 CO -0.10 -0.19 0.00 0.09 -0.92 0.00 0.00 175.35 174.23 1g5w n ASN 15 N 4.95 -4.54 -0.08 2.83 3.02 -1.26 -3.10 115.26 117.08 1g5w n ASN 15 Ca -0.06 0.28 -0.15 0.00 -0.03 0.00 0.00 54.58 54.62 1g5w n ASN 15 Cb 0.50 -3.31 -0.04 0.00 -0.61 0.00 0.00 39.78 36.32 1g5w n ASN 15 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1g5w h PHE 16 N 0.00 1.10 -0.14 3.10 3.57 -1.92 -2.17 116.94 120.47 1g5w h PHE 16 Ca -0.28 -0.39 -0.00 0.00 3.53 0.00 0.00 57.97 60.83 1g5w h PHE 16 Cb 0.93 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.46 1g5w h PHE 16 CO 0.37 1.22 0.09 -0.44 -2.23 0.00 0.00 178.31 177.32 1g5w h ASP 17 N 0.66 0.17 -0.19 0.41 3.32 -1.93 -2.26 116.42 116.60 1g5w h ASP 17 Ca 0.02 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1g5w h ASP 17 Cb 1.14 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.64 1g5w h ASP 17 CO 0.12 0.13 0.04 -0.78 -1.72 0.00 0.00 179.24 177.03 1g5w h ASP 18 N 0.20 0.30 -0.16 6.45 3.58 -1.94 -2.58 116.42 122.27 1g5w h ASP 18 Ca 0.05 -0.25 0.05 0.00 0.42 0.00 0.00 57.03 57.30 1g5w h ASP 18 Cb -0.01 -0.08 -0.05 0.00 1.72 0.00 0.00 39.33 40.91 1g5w h ASP 18 CO -0.01 0.47 -0.16 0.22 -2.88 0.00 0.00 179.24 176.88 1g5w h TYR 19 N 0.12 -0.41 -0.34 0.28 3.20 -1.25 -1.68 116.97 116.89 1g5w h TYR 19 Ca 0.06 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.91 1g5w h TYR 19 Cb 0.29 0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.75 1g5w h TYR 19 CO 0.02 -0.23 0.02 0.52 -1.64 0.00 0.00 178.16 176.84 1g5w h MET 20 N -0.19 0.52 -0.23 1.82 2.86 -1.52 -2.55 114.93 115.65 1g5w h MET 20 Ca 0.11 -0.10 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1g5w h MET 20 Cb 0.34 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 1g5w h MET 20 CO -0.27 0.53 0.13 -0.22 1.06 0.00 0.00 176.91 178.14 1g5w h LYS 21 N 0.50 0.31 -0.67 1.72 3.64 -1.32 -2.61 116.57 118.14 1g5w h LYS 21 Ca 0.11 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.49 1g5w h LYS 21 Cb 0.30 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 1g5w h LYS 21 CO 0.01 0.28 0.44 0.77 -2.27 0.00 0.00 179.45 178.68 1g5w h SER 22 N 0.26 0.68 -0.50 4.20 0.02 -1.22 -2.90 113.55 114.09 1g5w h SER 22 Ca 0.08 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 1g5w h SER 22 Cb 0.06 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 1g5w h SER 22 CO -0.01 0.46 0.21 -0.07 -1.14 0.00 0.00 176.83 176.28 1g5w h LEU 23 N 0.79 0.68 0.00 5.07 3.38 -1.46 -3.47 115.31 120.29 1g5w h LEU 23 Ca 0.27 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1g5w h LEU 23 Cb 0.10 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1g5w h LEU 23 CO -0.08 0.65 0.00 0.61 0.09 0.00 0.00 178.44 179.72 1g5w n GLY 24 N -0.82 0.64 2.79 0.83 0.00 -1.01 -5.12 105.19 102.50 1g5w n GLY 24 Ca 0.02 -0.67 -0.18 0.00 0.00 0.00 0.00 46.02 45.19 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 0.00 -0.20 0.00 1.61 1.01 -1.08 -5.02 120.40 116.72 1g5w s VAL 25 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.35 1g5w s VAL 25 Cb 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 36.38 36.14 1g5w s VAL 25 CO 0.00 0.15 0.01 0.61 0.00 0.00 0.00 175.10 175.87 1g5w n GLY 26 N 5.22 1.60 3.11 4.51 0.00 -1.26 -4.42 105.19 113.94 1g5w n GLY 26 Ca -0.06 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 1g5w n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1g5w s PHE 27 N -0.02 0.60 0.00 1.61 -0.71 -1.26 -4.83 117.98 113.36 1g5w s PHE 27 Ca 0.00 -1.06 0.00 0.00 -1.04 0.00 0.00 56.93 54.83 1g5w s PHE 27 Cb 0.00 -0.41 0.00 0.00 -1.21 0.00 0.00 43.02 41.40 1g5w s PHE 27 CO 0.00 -0.35 0.00 0.00 -1.34 0.00 0.00 175.22 173.53 1g5w n ALA 28 N 0.08 0.00 -0.24 1.99 0.00 -1.26 -4.53 120.51 116.54 1g5w n ALA 28 Ca -0.13 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.23 1g5w n ALA 28 Cb 0.61 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.11 1g5w n ALA 28 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1g5w h THR 29 N 0.00 1.26 -0.59 0.00 2.02 -1.98 -1.56 112.91 112.06 1g5w h THR 29 Ca 0.00 -1.02 -0.01 0.00 0.77 0.00 0.00 66.41 66.15 1g5w h THR 29 Cb 0.00 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 66.97 1g5w h THR 29 CO 0.00 0.39 0.34 0.03 0.37 0.00 0.00 175.52 176.64 1g5w h ARG 30 N 1.05 0.82 -0.08 6.66 3.08 -1.88 -2.79 114.38 121.24 1g5w h ARG 30 Ca 0.21 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 1g5w h ARG 30 Cb 0.42 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 1g5w h ARG 30 CO 0.01 0.61 0.04 0.37 -1.07 0.00 0.00 179.97 179.94 1g5w h GLN 31 N 0.80 0.11 -0.64 0.04 -0.00 -1.89 -2.71 115.11 110.82 1g5w h GLN 31 Ca 0.21 -0.01 -0.06 0.00 -0.00 0.00 0.00 58.65 58.78 1g5w h GLN 31 Cb 0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 27.48 27.45 1g5w h GLN 31 CO -0.04 0.16 0.16 0.28 0.00 0.00 0.00 178.83 179.40 1g5w h VAL 32 N 0.04 1.26 -0.48 2.39 2.07 -1.37 -2.40 116.25 117.75 1g5w h VAL 32 Ca 0.03 -0.93 -0.12 0.00 0.82 0.00 0.00 66.70 66.50 1g5w h VAL 32 Cb 0.08 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1g5w h VAL 32 CO -0.00 0.35 -0.15 0.00 0.02 0.00 0.00 177.57 177.78 1g5w h ALA 33 N 1.06 0.67 -0.55 1.67 0.00 -1.56 -1.89 119.26 118.67 1g5w h ALA 33 Ca 0.20 -0.36 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 1g5w h ALA 33 Cb 0.36 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1g5w h ALA 33 CO 0.00 0.61 -0.08 0.66 0.00 0.00 0.00 179.25 180.44 1g5w h SER 34 N 0.81 1.00 -0.43 0.00 4.64 -1.54 -3.26 113.55 114.76 1g5w h SER 34 Ca 0.12 -0.31 -0.07 0.00 -0.47 0.00 0.00 61.79 61.05 1g5w h SER 34 Cb 0.72 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 1g5w h SER 34 CO 0.05 1.09 0.03 -0.03 -0.87 0.00 0.00 176.83 177.10 1g5w h MET 35 N 0.90 0.82 -6.99 4.77 -1.53 -1.47 -3.45 114.93 107.98 1g5w h MET 35 Ca 0.15 -0.21 -0.51 0.00 -3.44 0.00 0.00 59.70 55.69 1g5w h MET 35 Cb 0.63 -0.10 0.06 0.00 -0.55 0.00 0.00 31.60 31.64 1g5w h MET 35 CO 0.04 0.81 0.49 0.99 0.14 0.00 0.00 176.91 179.38 1g5w s THR 36 N -5.03 3.12 -0.50 -0.77 2.01 -0.71 -5.05 115.64 108.71 1g5w s THR 36 Ca -0.10 0.86 -0.13 0.00 0.31 0.00 0.00 61.69 62.64 1g5w s THR 36 Cb 0.15 -3.45 0.12 0.00 0.01 0.00 0.00 72.50 69.33 1g5w s THR 36 CO 0.81 0.01 0.42 -0.54 -0.69 0.00 0.00 174.62 174.63 1g5w s LYS 37 N -2.61 2.76 -0.71 4.92 1.02 -1.26 -4.94 119.74 118.93 1g5w s LYS 37 Ca 0.62 -1.69 -0.26 0.00 0.02 0.00 0.00 55.97 54.66 1g5w s LYS 37 Cb -0.29 -4.11 0.04 0.00 -0.52 0.00 0.00 37.83 32.95 1g5w s LYS 37 CO 0.35 -1.23 1.20 -1.25 -0.92 0.00 0.00 175.35 173.50 1g5w s PRO 38 N 1.50 3.20 -0.40 -1.68 0.04 -1.26 -4.67 135.00 131.73 1g5w s PRO 38 Ca 0.04 -0.32 -0.29 0.00 0.04 0.00 0.00 61.00 60.47 1g5w s PRO 38 Cb -0.28 -4.17 0.02 0.00 0.04 0.00 0.00 34.50 30.11 1g5w s PRO 38 CO 0.02 -2.03 1.15 0.99 0.04 0.00 0.00 177.00 177.18 1g5w s THR 39 N 5.29 4.28 -0.36 1.26 2.01 -0.52 -4.66 115.64 122.94 1g5w s THR 39 Ca 0.33 1.40 -0.23 0.00 0.31 0.00 0.00 61.69 63.49 1g5w s THR 39 Cb -0.10 -4.46 0.01 0.00 0.01 0.00 0.00 72.50 67.96 1g5w s THR 39 CO 0.15 -0.74 0.78 -0.89 -0.69 0.00 0.00 174.62 173.23 1g5w s THR 40 N 4.23 4.74 -0.36 -0.82 2.01 -0.60 -1.31 115.64 123.52 1g5w s THR 40 Ca 0.49 0.93 -0.07 0.00 0.31 0.00 0.00 61.69 63.34 1g5w s THR 40 Cb -0.10 -4.20 0.05 0.00 0.01 0.00 0.00 72.50 68.25 1g5w s THR 40 CO 0.25 -0.41 0.15 -0.63 -0.69 0.00 0.00 174.62 173.29 1g5w s ILE 41 N 3.08 3.91 -0.27 1.82 1.01 -0.69 -1.77 121.20 128.29 1g5w s ILE 41 Ca 0.31 -1.21 -0.10 0.00 0.00 0.00 0.00 60.65 59.66 1g5w s ILE 41 Cb -0.13 -3.27 -0.04 0.00 0.01 0.00 0.00 42.46 39.02 1g5w s ILE 41 CO 0.16 -0.27 0.15 -0.63 0.00 0.00 0.00 174.94 174.35 1g5w s ILE 42 N 1.41 5.03 -0.13 2.92 1.01 -0.95 -1.85 121.20 128.64 1g5w s ILE 42 Ca 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 60.65 60.71 1g5w s ILE 42 Cb -0.20 -3.38 0.04 0.00 0.01 0.00 0.00 42.46 38.92 1g5w s ILE 42 CO 0.03 0.28 -0.01 -0.70 0.00 0.00 0.00 174.94 174.54 1g5w s GLU 43 N 1.68 0.90 -0.35 2.79 -6.30 -1.12 -2.57 118.70 113.73 1g5w s GLU 43 Ca 0.07 -0.20 -0.18 0.00 -2.50 0.00 0.00 54.97 52.16 1g5w s GLU 43 Cb -0.16 -1.55 -0.00 0.00 0.00 0.00 0.00 34.13 32.42 1g5w s GLU 43 CO 0.09 -0.41 0.51 0.21 0.02 0.00 0.00 175.26 175.68 1g5w s LYS 44 N 1.84 3.63 0.00 4.30 2.20 -1.26 -1.38 119.74 129.07 1g5w s LYS 44 Ca 0.03 -0.15 0.00 0.00 -0.36 0.00 0.00 55.97 55.48 1g5w s LYS 44 Cb -0.14 -3.81 0.00 0.00 -1.51 0.00 0.00 37.83 32.37 1g5w s LYS 44 CO -0.07 -0.64 0.00 -1.71 -0.36 0.00 0.00 175.35 172.57 1g5w n ASN 45 N 5.74 0.00 -3.22 1.43 5.15 -0.94 -4.88 115.26 118.54 1g5w n ASN 45 Ca -0.05 0.31 -0.23 0.00 -0.60 0.00 0.00 54.58 54.02 1g5w n ASN 45 Cb 0.49 -0.47 -0.07 0.00 -0.53 0.00 0.00 39.78 39.20 1g5w n ASN 45 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1g5w n GLY 46 N 1.87 1.99 3.94 8.20 0.00 -1.26 -4.85 105.19 115.08 1g5w n GLY 46 Ca 0.00 -1.14 -0.26 0.00 0.00 0.00 0.00 46.02 44.62 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 2.28 -1.09 -3.67 1.61 2.03 -1.26 -5.02 116.55 111.43 1g5w n ASP 47 Ca 0.24 -0.96 -0.30 0.00 0.52 0.00 0.00 54.79 54.30 1g5w n ASP 47 Cb 0.51 -3.25 -0.15 0.00 -0.72 0.00 0.00 41.12 37.51 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 -3.79 0.58 -0.63 5.18 -1.09 -1.26 -4.40 121.20 115.79 1g5w s ILE 48 Ca 0.13 -1.21 -0.23 0.00 -2.23 0.00 0.00 60.65 57.12 1g5w s ILE 48 Cb -0.07 -1.45 0.06 0.00 -1.58 0.00 0.00 42.46 39.43 1g5w s ILE 48 CO 0.88 -0.70 0.94 -0.76 -1.23 0.00 0.00 174.94 174.07 1g5w s LEU 49 N 1.76 4.36 -0.68 2.97 1.43 -0.73 -2.22 118.68 125.58 1g5w s LEU 49 Ca 0.10 -0.86 -0.18 0.00 -1.03 0.00 0.00 54.13 52.15 1g5w s LEU 49 Cb -0.17 -2.50 0.12 0.00 0.03 0.00 0.00 46.19 43.67 1g5w s LEU 49 CO -0.29 -1.37 0.79 -0.89 0.23 0.00 0.00 176.35 174.82 1g5w s THR 50 N 3.95 4.90 -0.56 5.49 2.01 -0.48 -2.38 115.64 128.57 1g5w s THR 50 Ca 0.23 -1.28 -0.16 0.00 0.31 0.00 0.00 61.69 60.79 1g5w s THR 50 Cb -0.16 -4.54 0.13 0.00 0.01 0.00 0.00 72.50 67.94 1g5w s THR 50 CO 0.12 -1.19 0.54 -0.22 -0.69 0.00 0.00 174.62 173.19 1g5w s LEU 51 N 2.37 6.10 -0.20 4.42 0.20 -0.54 -2.79 118.68 128.24 1g5w s LEU 51 Ca 0.16 -1.78 -0.14 0.00 0.69 0.00 0.00 54.13 53.07 1g5w s LEU 51 Cb -0.19 -2.22 -0.04 0.00 -0.43 0.00 0.00 46.19 43.30 1g5w s LEU 51 CO 0.02 -0.89 0.29 -0.54 -0.29 0.00 0.00 176.35 174.95 1g5w s LYS 52 N 1.70 4.17 -0.69 1.98 1.02 -0.77 -2.85 119.74 124.30 1g5w s LYS 52 Ca 0.05 0.03 -0.12 0.00 0.02 0.00 0.00 55.97 55.94 1g5w s LYS 52 Cb -0.28 -3.50 0.18 0.00 -0.52 0.00 0.00 37.83 33.70 1g5w s LYS 52 CO 0.03 0.07 0.61 0.99 -0.92 0.00 0.00 175.35 176.13 1g5w s THR 53 N 0.98 5.07 -0.58 2.17 2.01 -0.76 -1.70 115.64 122.83 1g5w s THR 53 Ca 0.15 -2.23 -0.24 0.00 0.31 0.00 0.00 61.69 59.68 1g5w s THR 53 Cb -0.14 -4.20 0.05 0.00 0.01 0.00 0.00 72.50 68.22 1g5w s THR 53 CO 0.05 -0.94 0.97 -1.00 -0.69 0.00 0.00 174.62 173.01 1g5w s HIS 54 N 0.61 2.74 -0.05 4.92 3.76 -0.43 -3.81 115.29 123.04 1g5w s HIS 54 Ca 0.13 -0.12 -0.06 0.00 -0.15 0.00 0.00 55.06 54.86 1g5w s HIS 54 Cb -0.18 -4.15 0.01 0.00 1.11 0.00 0.00 32.58 29.37 1g5w s HIS 54 CO -0.04 -1.45 0.16 0.45 -0.85 0.00 0.00 174.74 173.00 1g5w s SER 55 N 3.06 -0.13 -1.49 1.40 0.15 -1.26 -1.44 113.70 113.99 1g5w s SER 55 Ca 0.29 0.21 -0.11 0.00 0.70 0.00 0.00 55.95 57.05 1g5w s SER 55 Cb -0.13 0.30 0.01 0.00 -1.71 0.00 0.00 66.02 64.50 1g5w s SER 55 CO 0.17 -0.12 2.50 1.07 1.20 0.00 0.00 173.24 178.06 1g5w n THR 56 N 2.68 4.12 0.00 6.45 5.66 -1.26 -4.11 114.28 127.82 1g5w n THR 56 Ca -0.15 -3.16 0.00 0.00 -3.05 0.00 0.00 64.05 57.69 1g5w n THR 56 Cb 0.58 -2.52 0.00 0.00 -1.55 0.00 0.00 70.33 66.84 1g5w n THR 56 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 175.07 172.35 1g5w n PHE 57 N 4.31 -1.71 -3.68 1.09 7.35 -1.26 -4.92 117.46 118.64 1g5w n PHE 57 Ca 0.63 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 57.22 1g5w n PHE 57 Cb 0.31 0.34 -0.10 0.00 0.35 0.00 0.00 39.48 40.38 1g5w n PHE 57 CO 0.00 0.00 0.00 0.21 -0.76 0.00 0.00 176.76 176.21 1g5w s LYS 58 N -0.98 0.48 -0.85 -4.13 2.47 -1.26 -5.12 119.74 110.34 1g5w s LYS 58 Ca 0.00 0.90 -0.18 0.00 -1.56 0.00 0.00 55.97 55.13 1g5w s LYS 58 Cb 0.00 0.02 0.15 0.00 -1.46 0.00 0.00 37.83 36.55 1g5w s LYS 58 CO 0.00 -0.15 0.98 -0.80 0.16 0.00 0.00 175.35 175.53 1g5w s ASN 59 N 1.43 6.60 -0.16 1.43 0.01 -1.26 -4.51 114.94 118.48 1g5w s ASN 59 Ca -0.09 -2.12 -0.11 0.00 -0.71 0.00 0.00 52.86 49.83 1g5w s ASN 59 Cb -0.07 -2.34 -0.05 0.00 0.41 0.00 0.00 41.25 39.20 1g5w s ASN 59 CO -0.14 -0.95 0.20 0.42 -1.51 0.00 0.00 177.10 175.12 1g5w s THR 60 N 2.03 5.37 -0.13 1.60 -4.23 -1.25 -4.92 115.64 114.12 1g5w s THR 60 Ca 0.26 0.34 0.01 0.00 -1.18 0.00 0.00 61.69 61.13 1g5w s THR 60 Cb -0.09 -3.52 0.02 0.00 1.34 0.00 0.00 72.50 70.24 1g5w s THR 60 CO -0.07 0.46 -0.16 -0.70 -0.54 0.00 0.00 174.62 173.61 1g5w s GLU 61 N 0.10 2.42 -0.09 3.99 -6.30 -1.26 -1.84 118.70 115.71 1g5w s GLU 61 Ca 0.13 -0.62 0.04 0.00 -2.50 0.00 0.00 54.97 52.01 1g5w s GLU 61 Cb -0.12 -2.08 -0.01 0.00 0.00 0.00 0.00 34.13 31.93 1g5w s GLU 61 CO 0.02 -0.11 -0.22 0.96 0.02 0.00 0.00 175.26 175.93 1g5w s ILE 62 N 1.11 2.27 -0.25 -3.70 -4.36 -1.13 -4.99 121.20 110.14 1g5w s ILE 62 Ca -0.03 -0.96 0.03 0.00 -0.26 0.00 0.00 60.65 59.43 1g5w s ILE 62 Cb -0.14 -1.87 0.06 0.00 1.25 0.00 0.00 42.46 41.75 1g5w s ILE 62 CO -0.05 0.56 -0.11 -0.55 0.24 0.00 0.00 174.94 175.03 1g5w s SER 63 N 0.14 4.24 -0.01 4.36 0.15 -1.26 -1.46 113.70 119.87 1g5w s SER 63 Ca -0.12 -1.29 -0.01 0.00 0.70 0.00 0.00 55.95 55.23 1g5w s SER 63 Cb -0.16 -1.50 0.00 0.00 -1.71 0.00 0.00 66.02 62.65 1g5w s SER 63 CO 0.06 -0.17 0.03 0.72 1.20 0.00 0.00 173.24 175.08 1g5w s PHE 64 N 1.15 -0.02 -0.48 3.44 -0.71 -1.00 -4.89 117.98 115.46 1g5w s PHE 64 Ca -0.07 0.05 0.16 0.00 -1.04 0.00 0.00 56.93 56.03 1g5w s PHE 64 Cb -0.19 0.00 0.61 0.00 -1.21 0.00 0.00 43.02 42.23 1g5w s PHE 64 CO -0.06 -0.03 1.52 1.63 -1.34 0.00 0.00 175.22 176.94 1g5w n LYS 65 N 2.95 3.57 -2.67 1.99 5.02 -1.26 -1.77 118.16 125.99 1g5w n LYS 65 Ca -0.13 -2.83 -0.02 0.00 -2.02 0.00 0.00 58.31 53.31 1g5w n LYS 65 Cb 0.59 -1.88 -0.01 0.00 -0.02 0.00 0.00 35.03 33.71 1g5w n LYS 65 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1g5w n LEU 66 N 0.23 -7.46 -0.16 -0.35 4.32 -1.25 -4.77 117.00 107.55 1g5w n LEU 66 Ca 0.23 1.67 0.00 0.00 -0.02 0.00 0.00 56.01 57.88 1g5w n LEU 66 Cb 0.91 -3.32 0.00 0.00 -1.62 0.00 0.00 43.42 39.39 1g5w n LEU 66 CO 0.20 -3.42 0.00 0.61 -1.22 0.00 0.00 177.39 173.56 1g5w n GLY 67 N 0.97 1.04 2.70 -0.72 0.00 -0.32 -4.93 105.19 103.92 1g5w n GLY 67 Ca -0.12 -0.26 -0.19 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.32 -0.10 -0.02 1.61 1.01 -1.26 -5.03 120.40 114.29 1g5w s VAL 68 Ca 0.00 0.37 -0.22 0.00 0.00 0.00 0.00 61.98 62.13 1g5w s VAL 68 Cb 0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 36.38 36.20 1g5w s VAL 68 CO 0.00 0.16 0.65 -0.70 0.00 0.00 0.00 175.10 175.20 1g5w s GLU 69 N 1.88 4.39 -0.09 2.72 2.12 -1.26 -4.21 118.70 124.25 1g5w s GLU 69 Ca 0.01 0.82 -0.05 0.00 0.36 0.00 0.00 54.97 56.11 1g5w s GLU 69 Cb -0.12 -3.38 0.03 0.00 0.26 0.00 0.00 34.13 30.92 1g5w s GLU 69 CO -0.03 0.26 0.21 -0.59 -0.54 0.00 0.00 175.26 174.57 1g5w s PHE 70 N 0.15 -0.25 0.32 5.30 -0.71 -1.01 -4.94 117.98 116.84 1g5w s PHE 70 Ca 0.34 0.63 -0.27 0.00 -1.04 0.00 0.00 56.93 56.59 1g5w s PHE 70 Cb -0.18 0.03 -0.09 0.00 -1.21 0.00 0.00 43.02 41.56 1g5w s PHE 70 CO 0.18 -0.17 1.03 0.34 -1.34 0.00 0.00 175.22 175.26 1g5w s ASP 71 N 0.82 7.17 -0.09 1.98 2.15 -1.26 -1.23 116.67 126.20 1g5w s ASP 71 Ca -0.06 2.08 -0.08 0.00 0.43 0.00 0.00 52.55 54.92 1g5w s ASP 71 Cb -0.07 -2.60 0.03 0.00 -0.30 0.00 0.00 42.92 39.97 1g5w s ASP 71 CO -0.05 -0.20 0.24 -0.70 -0.17 0.00 0.00 175.17 174.29 1g5w s GLU 72 N -1.85 0.27 -0.25 4.34 2.56 -0.80 -4.96 118.70 118.01 1g5w s GLU 72 Ca 0.49 0.35 -0.13 0.00 0.00 0.00 0.00 54.97 55.68 1g5w s GLU 72 Cb -0.26 0.11 -0.04 0.00 2.00 0.00 0.00 34.13 35.94 1g5w s GLU 72 CO 0.33 -0.05 0.30 0.99 -0.56 0.00 0.00 175.26 176.27 1g5w s THR 73 N 0.25 5.24 0.70 -1.70 2.01 -1.26 -1.75 115.64 119.13 1g5w s THR 73 Ca -0.01 0.44 -0.06 0.00 0.31 0.00 0.00 61.69 62.37 1g5w s THR 73 Cb -0.03 -3.63 0.06 0.00 0.01 0.00 0.00 72.50 68.92 1g5w s THR 73 CO -0.01 0.23 1.00 0.42 -0.69 0.00 0.00 174.62 175.57 1g5w s THR 74 N 1.67 2.30 0.41 -0.82 -4.23 -0.84 -4.89 115.64 109.24 1g5w s THR 74 Ca 0.13 -0.32 0.09 0.00 -1.18 0.00 0.00 61.69 60.40 1g5w s THR 74 Cb -0.15 -2.98 0.29 0.00 1.34 0.00 0.00 72.50 70.99 1g5w s THR 74 CO 0.09 0.00 2.03 0.00 -0.54 0.00 0.00 174.62 176.19 1g5w h ALA 75 N -0.55 1.79 -1.18 3.99 0.00 -1.97 -2.78 119.26 118.56 1g5w h ALA 75 Ca -0.44 -0.02 -0.77 0.00 0.00 0.00 0.00 54.91 53.68 1g5w h ALA 75 Cb 1.31 -0.15 -0.28 0.00 0.00 0.00 0.00 17.79 18.67 1g5w h ALA 75 CO 0.58 0.15 0.92 -0.25 0.00 0.00 0.00 179.25 180.65 1g5w n ASP 76 N -4.47 7.24 -2.85 0.00 10.43 -1.26 -4.99 116.55 120.64 1g5w n ASP 76 Ca 0.06 -3.76 -0.28 0.00 2.57 0.00 0.00 54.79 53.38 1g5w n ASP 76 Cb 0.16 -1.07 0.03 0.00 1.84 0.00 0.00 41.12 42.08 1g5w n ASP 76 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 1g5w n ASP 77 N -0.32 -4.13 -3.76 -2.24 2.03 -1.05 -5.04 116.55 102.05 1g5w n ASP 77 Ca 0.49 -0.09 -0.14 0.00 0.52 0.00 0.00 54.79 55.57 1g5w n ASP 77 Cb 0.27 -1.18 -0.15 0.00 -0.72 0.00 0.00 41.12 39.33 1g5w n ASP 77 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1g5w s ARG 78 N -1.74 0.02 -0.06 -0.67 0.52 -1.26 -4.92 118.95 110.84 1g5w s ARG 78 Ca 0.27 0.26 -0.30 0.00 -0.52 0.00 0.00 55.73 55.44 1g5w s ARG 78 Cb -0.03 -0.21 -0.05 0.00 0.52 0.00 0.00 34.95 35.18 1g5w s ARG 78 CO 0.61 -0.16 1.53 -1.59 0.02 0.00 0.00 175.30 175.71 1g5w s LYS 79 N 1.08 4.21 -0.02 3.54 0.00 -1.26 -1.98 119.74 125.30 1g5w s LYS 79 Ca -0.09 2.06 0.01 0.00 0.00 0.00 0.00 55.97 57.95 1g5w s LYS 79 Cb -0.12 -3.85 0.02 0.00 0.00 0.00 0.00 37.83 33.89 1g5w s LYS 79 CO -0.04 -0.76 -0.00 0.14 0.00 0.00 0.00 175.35 174.68 1g5w s VAL 80 N 3.55 0.18 -0.60 1.79 -7.23 -0.72 -4.72 120.40 112.65 1g5w s VAL 80 Ca 0.68 0.04 -0.25 0.00 -1.81 0.00 0.00 61.98 60.65 1g5w s VAL 80 Cb -0.31 -0.24 0.04 0.00 0.56 0.00 0.00 36.38 36.43 1g5w s VAL 80 CO 0.26 0.12 1.01 -0.54 -0.31 0.00 0.00 175.10 175.65 1g5w s LYS 81 N 0.76 3.29 -0.68 4.82 3.01 -0.60 -1.91 119.74 128.44 1g5w s LYS 81 Ca -0.08 -0.32 -0.19 0.00 -1.01 0.00 0.00 55.97 54.37 1g5w s LYS 81 Cb -0.11 -4.10 0.11 0.00 -1.01 0.00 0.00 37.83 32.72 1g5w s LYS 81 CO -0.01 -1.65 0.85 -1.12 0.51 0.00 0.00 175.35 173.92 1g5w s SER 82 N 3.12 6.29 -0.26 2.83 0.01 -0.37 -2.82 113.70 122.51 1g5w s SER 82 Ca 0.31 -1.51 -0.07 0.00 1.31 0.00 0.00 55.95 55.99 1g5w s SER 82 Cb -0.12 -2.34 -0.02 0.00 0.21 0.00 0.00 66.02 63.75 1g5w s SER 82 CO 0.18 -1.16 0.05 -0.51 0.41 0.00 0.00 173.24 172.21 1g5w s ILE 83 N 2.87 4.07 -0.02 1.44 1.10 -0.71 -2.39 121.20 127.56 1g5w s ILE 83 Ca 0.18 -0.35 0.01 0.00 -0.51 0.00 0.00 60.65 59.98 1g5w s ILE 83 Cb -0.18 -2.94 0.02 0.00 0.15 0.00 0.00 42.46 39.51 1g5w s ILE 83 CO 0.04 0.29 -0.02 0.54 -2.11 0.00 0.00 174.94 173.68 1g5w s VAL 84 N 1.57 0.29 0.08 4.00 0.11 -1.26 -1.45 120.40 123.73 1g5w s VAL 84 Ca 0.05 -0.03 -0.09 0.00 -2.93 0.00 0.00 61.98 58.99 1g5w s VAL 84 Cb -0.15 -0.33 -0.00 0.00 -1.53 0.00 0.00 36.38 34.36 1g5w s VAL 84 CO 0.02 0.15 0.19 0.28 -3.33 0.00 0.00 175.10 172.40 1g5w s THR 85 N 0.69 0.14 -0.52 5.04 -1.32 -0.98 -1.18 115.64 117.50 1g5w s THR 85 Ca -0.07 -1.13 -0.22 0.00 -1.21 0.00 0.00 61.69 59.05 1g5w s THR 85 Cb -0.11 -1.26 0.04 0.00 -1.51 0.00 0.00 72.50 69.67 1g5w s THR 85 CO -0.01 -0.63 0.81 -0.22 -2.21 0.00 0.00 174.62 172.37 1g5w s LEU 86 N -2.72 4.41 -0.64 9.08 2.96 -1.26 -1.61 118.68 128.91 1g5w s LEU 86 Ca 0.03 -0.50 -0.10 0.00 -0.22 0.00 0.00 54.13 53.34 1g5w s LEU 86 Cb 0.04 -2.72 0.17 0.00 0.50 0.00 0.00 46.19 44.17 1g5w s LEU 86 CO -0.10 -1.07 0.53 -0.62 -1.32 0.00 0.00 176.35 173.78 1g5w s ASP 87 N 2.67 5.98 -1.15 3.68 2.15 -0.31 -4.70 116.67 125.00 1g5w s ASP 87 Ca 0.25 -2.42 -0.00 0.00 0.43 0.00 0.00 52.55 50.81 1g5w s ASP 87 Cb -0.15 -2.05 0.00 0.00 -0.30 0.00 0.00 42.92 40.42 1g5w s ASP 87 CO 0.17 -0.58 0.96 0.61 -0.17 0.00 0.00 175.17 176.16 1g5w n GLY 88 N 4.24 -0.33 2.34 2.66 0.00 -1.26 -2.92 105.19 109.92 1g5w n GLY 88 Ca 0.03 0.08 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.16 1.12 2.93 -0.02 0.00 -1.26 -5.04 105.19 101.76 1g5w n GLY 89 Ca -0.26 -0.47 -0.28 0.00 0.00 0.00 0.00 46.02 45.00 1g5w n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g5w s LYS 90 N -2.73 1.68 -0.73 1.61 1.02 -1.15 -4.66 119.74 114.78 1g5w s LYS 90 Ca 0.00 -0.46 -0.25 0.00 0.02 0.00 0.00 55.97 55.28 1g5w s LYS 90 Cb 0.00 -1.91 0.05 0.00 -0.52 0.00 0.00 37.83 35.45 1g5w s LYS 90 CO 0.00 -0.34 1.18 -1.17 -0.92 0.00 0.00 175.35 174.11 1g5w s LEU 91 N 1.61 3.61 -0.40 3.17 0.20 -0.61 -1.16 118.68 125.10 1g5w s LEU 91 Ca 0.03 -0.70 -0.12 0.00 0.69 0.00 0.00 54.13 54.03 1g5w s LEU 91 Cb -0.14 -2.51 0.04 0.00 -0.43 0.00 0.00 46.19 43.15 1g5w s LEU 91 CO -0.08 -1.68 0.26 -0.69 -0.29 0.00 0.00 176.35 173.86 1g5w s VAL 92 N 5.10 4.70 -0.37 1.68 1.01 -0.63 -1.89 120.40 129.99 1g5w s VAL 92 Ca 0.31 -0.96 -0.07 0.00 0.00 0.00 0.00 61.98 61.26 1g5w s VAL 92 Cb -0.10 -3.69 0.06 0.00 0.00 0.00 0.00 36.38 32.64 1g5w s VAL 92 CO 0.12 -0.34 0.17 -2.28 0.00 0.00 0.00 175.10 172.77 1g5w s HIS 93 N 1.56 3.32 -0.24 5.22 5.04 -1.09 -2.33 115.29 126.77 1g5w s HIS 93 Ca 0.03 -1.56 -0.14 0.00 -1.54 0.00 0.00 55.06 51.86 1g5w s HIS 93 Cb -0.21 -2.62 -0.04 0.00 0.04 0.00 0.00 32.58 29.75 1g5w s HIS 93 CO 0.06 -0.80 0.31 -1.17 -2.34 0.00 0.00 174.74 170.80 1g5w s LEU 94 N 1.39 4.09 -0.27 8.88 2.96 -0.53 -0.91 118.68 134.29 1g5w s LEU 94 Ca 0.01 0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 54.18 1g5w s LEU 94 Cb -0.21 -2.34 0.03 0.00 0.50 0.00 0.00 46.19 44.17 1g5w s LEU 94 CO 0.02 -0.07 -0.02 -1.10 -1.32 0.00 0.00 176.35 173.86 1g5w s GLN 95 N 1.53 2.78 0.02 1.98 -0.21 -0.75 -1.74 119.66 123.28 1g5w s GLN 95 Ca 0.13 -1.03 0.05 0.00 0.02 0.00 0.00 55.36 54.54 1g5w s GLN 95 Cb -0.15 -3.10 -0.03 0.00 1.00 0.00 0.00 33.01 30.73 1g5w s GLN 95 CO 0.08 -0.46 -0.10 -1.59 -2.12 0.00 0.00 175.29 171.10 1g5w s LYS 96 N 1.34 2.38 -0.27 2.91 0.00 -1.13 -1.57 119.74 123.41 1g5w s LYS 96 Ca -0.01 -0.82 -0.03 0.00 0.00 0.00 0.00 55.97 55.11 1g5w s LYS 96 Cb -0.17 -2.39 0.16 0.00 0.00 0.00 0.00 37.83 35.42 1g5w s LYS 96 CO -0.02 0.58 0.49 1.67 0.00 0.00 0.00 175.35 178.06 1g5w s TRP 97 N -1.00 -1.19 0.00 1.78 -2.14 -0.26 -1.55 118.94 114.58 1g5w s TRP 97 Ca 0.17 1.33 0.00 0.00 2.66 0.00 0.00 56.10 60.26 1g5w s TRP 97 Cb -0.11 0.31 0.00 0.00 -3.10 0.00 0.00 33.47 30.57 1g5w s TRP 97 CO 0.07 -0.77 0.00 -3.47 -2.66 0.00 0.00 176.95 170.12 1g5w n ASP 98 N 5.40 0.00 -2.91 -2.66 2.03 -1.26 -2.00 116.55 115.14 1g5w n ASP 98 Ca -0.03 0.00 -0.19 0.00 0.52 0.00 0.00 54.79 55.09 1g5w n ASP 98 Cb 0.50 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.89 1g5w n ASP 98 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1g5w n GLY 99 N 0.00 3.88 3.41 0.27 0.00 -1.26 -5.08 105.19 106.41 1g5w n GLY 99 Ca 0.00 -1.99 -0.07 0.00 0.00 0.00 0.00 46.02 43.96 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 -2.98 0.46 0.02 1.61 -0.21 -0.85 -5.18 119.66 112.54 1g5w s GLN 100 Ca 0.40 1.08 0.03 0.00 0.02 0.00 0.00 55.36 56.89 1g5w s GLN 100 Cb 0.37 0.30 -0.02 0.00 1.00 0.00 0.00 33.01 34.66 1g5w s GLN 100 CO -0.08 -0.20 -0.11 -1.83 -2.12 0.00 0.00 175.29 170.96 1g5w s GLU 101 N 2.15 0.76 -0.08 2.91 4.04 -1.26 -1.10 118.70 126.12 1g5w s GLU 101 Ca -0.06 -0.58 0.01 0.00 0.04 0.00 0.00 54.97 54.38 1g5w s GLU 101 Cb -0.10 -0.71 0.02 0.00 0.02 0.00 0.00 34.13 33.36 1g5w s GLU 101 CO -0.15 0.18 -0.09 -0.08 -1.84 0.00 0.00 175.26 173.28 1g5w s THR 102 N -0.69 0.96 -0.16 1.83 -1.32 -0.61 -4.51 115.64 111.16 1g5w s THR 102 Ca 0.00 -0.33 -0.16 0.00 -1.21 0.00 0.00 61.69 59.99 1g5w s THR 102 Cb -0.06 -0.93 -0.04 0.00 -1.51 0.00 0.00 72.50 69.95 1g5w s THR 102 CO 0.00 0.33 0.39 0.42 -2.21 0.00 0.00 174.62 173.55 1g5w s THR 103 N 1.06 5.24 -0.81 5.08 -4.23 -0.97 -1.81 115.64 119.19 1g5w s THR 103 Ca -0.08 0.74 -0.10 0.00 -1.18 0.00 0.00 61.69 61.07 1g5w s THR 103 Cb -0.14 -3.73 0.21 0.00 1.34 0.00 0.00 72.50 70.18 1g5w s THR 103 CO -0.01 0.33 0.72 -0.76 -0.54 0.00 0.00 174.62 174.37 1g5w s LEU 104 N 0.74 6.25 -0.66 4.79 1.02 -0.09 -2.36 118.68 128.37 1g5w s LEU 104 Ca 0.21 -2.92 -0.19 0.00 0.02 0.00 0.00 54.13 51.25 1g5w s LEU 104 Cb -0.14 -2.10 0.11 0.00 0.02 0.00 0.00 46.19 44.08 1g5w s LEU 104 CO 0.07 -0.46 0.80 -0.69 0.02 0.00 0.00 176.35 176.09 1g5w s VAL 105 N -0.17 4.80 -0.15 -1.59 1.01 -0.76 -2.68 120.40 120.85 1g5w s VAL 105 Ca 0.20 -1.10 -0.19 0.00 0.00 0.00 0.00 61.98 60.89 1g5w s VAL 105 Cb -0.12 -4.55 -0.04 0.00 0.00 0.00 0.00 36.38 31.66 1g5w s VAL 105 CO -0.08 -1.22 0.51 -0.13 0.00 0.00 0.00 175.10 174.19 1g5w s ARG 106 N 2.68 4.29 -0.12 2.72 0.52 -0.79 -1.57 118.95 126.68 1g5w s ARG 106 Ca 0.16 0.46 -0.08 0.00 -0.52 0.00 0.00 55.73 55.76 1g5w s ARG 106 Cb -0.20 -3.49 0.04 0.00 0.52 0.00 0.00 34.95 31.83 1g5w s ARG 106 CO 0.04 0.03 0.29 -1.83 0.02 0.00 0.00 175.30 173.85 1g5w s GLU 107 N 1.05 0.29 -0.37 3.54 -1.05 -0.99 -1.58 118.70 119.59 1g5w s GLU 107 Ca 0.26 0.54 -0.29 0.00 -0.15 0.00 0.00 54.97 55.33 1g5w s GLU 107 Cb -0.15 -0.01 0.02 0.00 -0.44 0.00 0.00 34.13 33.55 1g5w s GLU 107 CO 0.10 -0.12 1.12 -0.51 0.95 0.00 0.00 175.26 176.80 1g5w s LEU 108 N 0.92 3.83 -0.26 1.83 2.01 -1.26 -1.77 118.68 123.97 1g5w s LEU 108 Ca -0.06 0.86 0.02 0.00 0.01 0.00 0.00 54.13 54.96 1g5w s LEU 108 Cb -0.07 -3.55 0.06 0.00 0.01 0.00 0.00 46.19 42.65 1g5w s LEU 108 CO -0.06 -1.03 -0.07 -0.63 1.01 0.00 0.00 176.35 175.57 1g5w s ILE 109 N 3.99 1.87 -1.23 -0.59 1.01 -0.93 -4.83 121.20 120.49 1g5w s ILE 109 Ca 0.47 -1.50 -0.01 0.00 0.00 0.00 0.00 60.65 59.61 1g5w s ILE 109 Cb -0.11 -2.09 0.00 0.00 0.01 0.00 0.00 42.46 40.28 1g5w s ILE 109 CO 0.21 -0.11 0.98 0.47 0.00 0.00 0.00 174.94 176.49 1g5w n ASP 110 N 4.53 -2.36 -1.69 3.58 9.92 -1.26 -2.69 116.55 126.58 1g5w n ASP 110 Ca -0.12 -0.64 -0.18 0.00 -0.53 0.00 0.00 54.79 53.32 1g5w n ASP 110 Cb 0.43 -4.98 -0.05 0.00 -0.64 0.00 0.00 41.12 35.88 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 -1.27 0.83 2.98 0.44 0.00 -1.26 -5.03 105.19 101.88 1g5w n GLY 111 Ca -0.26 -0.14 -0.22 0.00 0.00 0.00 0.00 46.02 45.40 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 -4.14 1.31 -0.52 1.61 1.02 -1.10 -4.57 119.74 113.36 1g5w s LYS 112 Ca 0.00 -0.31 -0.28 0.00 0.02 0.00 0.00 55.97 55.40 1g5w s LYS 112 Cb 0.00 -1.14 0.02 0.00 -0.52 0.00 0.00 37.83 36.19 1g5w s LYS 112 CO 0.00 0.02 1.29 -1.17 -0.92 0.00 0.00 175.35 174.57 1g5w s LEU 113 N 0.62 3.51 -0.58 3.17 2.96 -0.75 -2.20 118.68 125.41 1g5w s LEU 113 Ca -0.11 0.39 -0.16 0.00 -0.22 0.00 0.00 54.13 54.02 1g5w s LEU 113 Cb -0.14 -3.31 0.14 0.00 0.50 0.00 0.00 46.19 43.38 1g5w s LEU 113 CO 0.02 -1.48 0.56 -0.63 -1.32 0.00 0.00 176.35 173.50 1g5w s ILE 114 N 5.23 5.21 -0.58 6.68 -1.09 -0.73 -2.11 121.20 133.80 1g5w s ILE 114 Ca 0.50 -1.55 -0.22 0.00 -2.23 0.00 0.00 60.65 57.15 1g5w s ILE 114 Cb -0.09 -4.37 0.06 0.00 -1.58 0.00 0.00 42.46 36.47 1g5w s ILE 114 CO 0.28 -0.92 0.88 -0.22 -1.23 0.00 0.00 174.94 173.74 1g5w s LEU 115 N 1.58 4.41 -0.44 2.97 2.96 -0.73 -2.34 118.68 127.09 1g5w s LEU 115 Ca 0.06 -0.73 -0.16 0.00 -0.22 0.00 0.00 54.13 53.08 1g5w s LEU 115 Cb -0.27 -2.59 0.04 0.00 0.50 0.00 0.00 46.19 43.87 1g5w s LEU 115 CO 0.02 -1.24 0.38 -0.89 -1.32 0.00 0.00 176.35 173.30 1g5w s THR 116 N 3.70 5.19 -0.51 3.68 2.01 -0.61 -1.71 115.64 127.39 1g5w s THR 116 Ca 0.24 -0.70 -0.15 0.00 0.31 0.00 0.00 61.69 61.38 1g5w s THR 116 Cb -0.16 -4.03 0.11 0.00 0.01 0.00 0.00 72.50 68.43 1g5w s THR 116 CO 0.14 -0.44 0.46 -0.76 -0.69 0.00 0.00 174.62 173.32 1g5w s LEU 117 N 1.82 5.98 -0.29 4.42 1.43 -0.60 -1.83 118.68 129.63 1g5w s LEU 117 Ca 0.07 -1.67 -0.03 0.00 -1.03 0.00 0.00 54.13 51.47 1g5w s LEU 117 Cb -0.20 -2.18 0.04 0.00 0.03 0.00 0.00 46.19 43.87 1g5w s LEU 117 CO 0.10 -0.79 -0.00 -0.89 0.23 0.00 0.00 176.35 175.00 1g5w s THR 118 N 1.59 3.10 0.00 5.49 2.01 -0.99 -1.65 115.64 125.19 1g5w s THR 118 Ca 0.03 -1.20 0.00 0.00 0.31 0.00 0.00 61.69 60.84 1g5w s THR 118 Cb -0.28 -2.71 0.00 0.00 0.01 0.00 0.00 72.50 69.52 1g5w s THR 118 CO 0.04 -0.01 0.00 1.57 -0.69 0.00 0.00 174.62 175.53 1g5w n HIS 119 N 4.67 0.00 0.00 4.92 -0.00 -1.26 -2.29 115.22 121.27 1g5w n HIS 119 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.58 1g5w n HIS 119 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.44 1g5w n HIS 119 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1g5w n GLY 120 N 3.03 0.73 2.86 1.57 0.00 -1.26 -4.83 105.19 107.29 1g5w n GLY 120 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1g5w n GLY 120 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1g5w n THR 121 N 0.00 5.50 -3.03 2.61 -1.04 -1.26 -4.79 114.28 112.26 1g5w n THR 121 Ca 0.00 -5.94 0.04 0.00 -2.04 0.00 0.00 64.05 56.11 1g5w n THR 121 Cb 0.00 -1.88 0.00 0.00 -1.82 0.00 0.00 70.33 66.63 1g5w n THR 121 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1g5w s ALA 122 N -3.35 -3.91 -0.24 2.41 0.00 -1.26 -4.97 121.76 110.44 1g5w s ALA 122 Ca 0.34 1.23 -0.16 0.00 0.00 0.00 0.00 51.96 53.37 1g5w s ALA 122 Cb 0.11 -2.86 -0.04 0.00 0.00 0.00 0.00 23.12 20.33 1g5w s ALA 122 CO 0.02 -2.21 0.40 0.54 0.00 0.00 0.00 175.76 174.51 1g5w s VAL 123 N 2.55 5.17 -0.43 0.00 0.11 -1.26 -4.00 120.40 122.54 1g5w s VAL 123 Ca 0.21 0.67 -0.08 0.00 -2.93 0.00 0.00 61.98 59.86 1g5w s VAL 123 Cb -0.01 -3.73 0.10 0.00 -1.53 0.00 0.00 36.38 31.21 1g5w s VAL 123 CO -0.20 0.19 0.28 0.00 -3.33 0.00 0.00 175.10 172.05 1g5w s THR 125 N 1.34 4.57 -0.22 0.00 2.01 -1.18 -1.55 115.64 120.61 1g5w s THR 125 Ca 0.05 0.29 -0.04 0.00 0.31 0.00 0.00 61.69 62.30 1g5w s THR 125 Cb -0.24 -4.40 -0.01 0.00 0.01 0.00 0.00 72.50 67.85 1g5w s THR 125 CO -0.00 -0.88 -0.03 -0.13 -0.69 0.00 0.00 174.62 172.89 1g5w s ARG 126 N 3.48 3.40 -0.04 4.92 0.52 -0.70 -3.36 118.95 127.17 1g5w s ARG 126 Ca 0.29 -0.61 -0.24 0.00 -0.52 0.00 0.00 55.73 54.65 1g5w s ARG 126 Cb -0.13 -3.04 -0.04 0.00 0.52 0.00 0.00 34.95 32.26 1g5w s ARG 126 CO 0.20 -0.19 0.71 0.99 0.02 0.00 0.00 175.30 177.03 1g5w s THR 127 N 1.49 4.98 -0.10 0.02 2.01 -0.79 -1.77 115.64 121.47 1g5w s THR 127 Ca 0.06 1.48 0.02 0.00 0.31 0.00 0.00 61.69 63.55 1g5w s THR 127 Cb -0.14 -4.05 0.02 0.00 0.01 0.00 0.00 72.50 68.33 1g5w s THR 127 CO -0.03 0.28 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.73 1g5w s TYR 128 N 0.58 1.90 0.35 4.92 1.51 -0.90 -1.78 117.35 123.93 1g5w s TYR 128 Ca 0.38 -0.88 -0.02 0.00 -1.01 0.00 0.00 57.07 55.54 1g5w s TYR 128 Cb -0.18 -1.38 -0.04 0.00 -0.11 0.00 0.00 41.96 40.25 1g5w s TYR 128 CO 0.19 -0.46 0.58 -1.21 -1.11 0.00 0.00 175.55 173.54 1g5w s GLU 129 N 1.00 3.54 -0.17 -0.62 2.02 -1.18 -1.82 118.70 121.48 1g5w s GLU 129 Ca -0.07 -0.15 -0.19 0.00 0.02 0.00 0.00 54.97 54.58 1g5w s GLU 129 Cb -0.15 -2.62 -0.03 0.00 0.10 0.00 0.00 34.13 31.43 1g5w s GLU 129 CO -0.02 0.12 0.53 0.21 0.02 0.00 0.00 175.26 176.12 1g5w s LYS 130 N -4.14 4.25 -0.71 1.61 2.20 -1.26 -2.45 119.74 119.24 1g5w s LYS 130 Ca 0.42 0.47 -0.02 0.00 -0.36 0.00 0.00 55.97 56.48 1g5w s LYS 130 Cb -0.10 -3.52 0.32 0.00 -1.51 0.00 0.00 37.83 33.02 1g5w s LYS 130 CO 0.36 -0.07 2.15 -1.91 -0.36 0.00 0.00 175.35 175.52 1g5w n GLU 131 N 4.47 2.62 0.00 4.03 4.07 -0.07 -4.99 120.64 130.76 1g5w n GLU 131 Ca -0.05 -3.15 0.00 0.00 -0.06 0.00 0.00 57.16 53.90 1g5w n GLU 131 Cb 0.51 -2.21 0.00 0.00 -0.06 0.00 0.00 31.44 29.67 1g5w n GLU 131 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07