#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gw6 n GLU 2 N 0.00 0.65 0.00 1.43 4.71 -1.26 -4.72 120.64 121.45 2gw6 n GLU 2 Ca 0.00 0.21 0.00 0.00 -0.01 0.00 0.00 57.16 57.36 2gw6 n GLU 2 Cb 0.00 -1.55 0.00 0.00 -1.01 0.00 0.00 31.44 28.88 2gw6 n GLU 2 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 2gw6 n ASP 3 N -3.58 0.00 -0.06 1.62 5.75 -1.26 -1.65 116.55 117.37 2gw6 n ASP 3 Ca -0.45 0.00 0.01 0.00 -0.01 0.00 0.00 54.79 54.33 2gw6 n ASP 3 Cb 0.96 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 41.06 2gw6 n ASP 3 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2gw6 n ALA 4 N 0.48 1.46 0.78 2.12 0.00 -1.26 -2.04 120.51 122.05 2gw6 n ALA 4 Ca 0.00 -0.81 0.12 0.00 0.00 0.00 0.00 53.44 52.75 2gw6 n ALA 4 Cb 0.00 -0.08 0.51 0.00 0.00 0.00 0.00 19.45 19.88 2gw6 n ALA 4 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 2gw6 n TRP 5 N -0.21 0.27 0.00 0.00 4.27 -0.66 -4.28 117.44 116.82 2gw6 n TRP 5 Ca 0.01 0.08 0.00 0.00 -3.89 0.00 0.00 57.50 53.70 2gw6 n TRP 5 Cb 0.47 -0.64 0.00 0.00 -1.36 0.00 0.00 31.31 29.78 2gw6 n TRP 5 CO 0.00 0.00 0.00 -1.33 -2.29 0.00 0.00 177.69 174.07 2gw6 n MET 6 N -1.72 0.00 0.00 -2.67 2.81 -1.26 -5.09 117.12 109.18 2gw6 n MET 6 Ca 0.06 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 2gw6 n MET 6 Cb 0.32 -0.15 0.00 0.00 -0.71 0.00 0.00 33.22 32.68 2gw6 n MET 6 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gw6 n GLY 7 N 0.85 0.93 0.02 3.03 0.00 -1.26 -5.10 105.19 103.67 2gw6 n GLY 7 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2gw6 n GLY 7 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2gw6 n THR 8 N 0.00 0.00 -3.35 2.61 5.66 -0.87 -4.35 114.28 113.99 2gw6 n THR 8 Ca 0.00 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.62 2gw6 n THR 8 Cb 0.00 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.71 2gw6 n THR 8 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 2gw6 s HIS 9 N -1.03 3.43 0.21 1.09 3.76 -1.25 -4.50 115.29 117.00 2gw6 s HIS 9 Ca 0.00 0.73 -0.12 0.00 -0.15 0.00 0.00 55.06 55.52 2gw6 s HIS 9 Cb 0.00 -2.54 0.26 0.00 1.11 0.00 0.00 32.58 31.41 2gw6 s HIS 9 CO 0.00 0.06 1.64 -1.35 -0.85 0.00 0.00 174.74 174.24 2gw6 h PRO 10 N 7.10 0.04 -0.93 8.40 0.11 -1.99 0.33 132.00 145.07 2gw6 h PRO 10 Ca -0.38 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.73 2gw6 h PRO 10 Cb 1.17 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.22 2gw6 h PRO 10 CO 0.74 0.03 0.58 0.87 -0.21 0.00 0.00 178.00 180.00 2gw6 h LYS 11 N 0.04 1.25 -0.12 1.05 1.57 -1.95 0.37 116.57 118.79 2gw6 h LYS 11 Ca 0.31 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.96 2gw6 h LYS 11 Cb 0.49 -0.27 -0.00 0.00 0.08 0.00 0.00 32.23 32.53 2gw6 h LYS 11 CO -0.59 0.86 -0.04 -0.92 -0.57 0.00 0.00 179.45 178.19 2gw6 h TYR 12 N 1.28 0.27 -0.37 -1.35 3.20 -1.62 -1.96 116.97 116.42 2gw6 h TYR 12 Ca 0.34 -0.06 0.06 0.00 3.14 0.00 0.00 58.73 62.20 2gw6 h TYR 12 Cb -0.08 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.08 2gw6 h TYR 12 CO 0.00 0.55 0.07 1.25 -1.64 0.00 0.00 178.16 178.39 2gw6 h LEU 13 N -0.09 -0.01 -1.16 2.82 5.85 0.26 0.23 115.31 123.21 2gw6 h LEU 13 Ca 0.03 0.06 0.22 0.00 0.84 0.00 0.00 57.88 59.03 2gw6 h LEU 13 Cb 0.47 0.09 -0.10 0.00 0.37 0.00 0.00 40.66 41.49 2gw6 h LEU 13 CO 0.01 0.03 0.62 -0.33 -0.34 0.00 0.00 178.44 178.44 2gw6 h GLU 14 N 0.19 0.58 -0.02 1.25 4.39 -0.17 -0.90 114.58 119.89 2gw6 h GLU 14 Ca 0.18 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.81 2gw6 h GLU 14 Cb 0.21 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 2gw6 h GLU 14 CO -0.24 0.39 -0.10 1.98 -1.16 0.00 0.00 179.01 179.87 2gw6 h MET 15 N 0.60 0.11 -0.81 2.33 4.05 -0.45 -3.30 114.93 117.46 2gw6 h MET 15 Ca 0.58 -0.09 0.15 0.00 -0.28 0.00 0.00 59.70 60.07 2gw6 h MET 15 Cb 1.13 0.02 -0.06 0.00 -0.80 0.00 0.00 31.60 31.89 2gw6 h MET 15 CO -0.35 0.75 0.54 0.52 0.23 0.00 0.00 176.91 178.59 2gw6 h MET 16 N -0.50 0.47 -0.03 0.39 2.86 0.58 -1.76 114.93 116.94 2gw6 h MET 16 Ca -0.01 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2gw6 h MET 16 Cb 0.76 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.32 2gw6 h MET 16 CO 0.02 0.31 0.34 1.49 1.06 0.00 0.00 176.91 180.13 2gw6 h GLU 17 N 0.49 0.00 -7.15 1.72 4.81 -1.29 -3.44 114.58 109.71 2gw6 h GLU 17 Ca 0.40 0.00 -0.44 0.00 -0.13 0.00 0.00 59.36 59.20 2gw6 h GLU 17 Cb 0.86 0.00 0.21 0.00 0.63 0.00 0.00 28.75 30.45 2gw6 h GLU 17 CO -0.15 0.00 0.01 -0.48 -0.73 0.00 0.00 179.01 177.66 2gw6 s LEU 18 N -5.91 0.84 -0.03 1.64 2.34 -0.67 -4.87 118.68 112.03 2gw6 s LEU 18 Ca -0.03 1.52 0.01 0.00 0.06 0.00 0.00 54.13 55.68 2gw6 s LEU 18 Cb 0.09 -3.43 0.05 0.00 -0.56 0.00 0.00 46.19 42.35 2gw6 s LEU 18 CO 0.30 -4.21 0.93 0.47 -1.06 0.00 0.00 176.35 172.77 2gw6 n ASP 19 N -4.93 2.54 0.00 1.48 8.00 -1.26 -4.48 116.55 117.91 2gw6 n ASP 19 Ca 0.03 -2.11 0.00 0.00 0.71 0.00 0.00 54.79 53.43 2gw6 n ASP 19 Cb 0.54 -0.52 0.00 0.00 -0.02 0.00 0.00 41.12 41.12 2gw6 n ASP 19 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2gw6 n ILE 20 N 0.28 0.00 -2.89 0.53 -5.35 -1.26 -4.98 119.36 105.69 2gw6 n ILE 20 Ca 0.04 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.50 2gw6 n ILE 20 Cb 0.51 0.00 -0.01 0.00 -1.74 0.00 0.00 39.64 38.40 2gw6 n ILE 20 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2gw6 n GLY 21 N -0.05 -2.62 3.79 3.28 0.00 -1.26 -4.96 105.19 103.37 2gw6 n GLY 21 Ca 0.00 0.57 -0.38 0.00 0.00 0.00 0.00 46.02 46.21 2gw6 n GLY 21 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2gw6 s ASP 22 N -0.97 6.77 0.45 1.61 2.15 -1.26 -4.91 116.67 120.52 2gw6 s ASP 22 Ca -0.07 0.91 0.26 0.00 0.43 0.00 0.00 52.55 54.09 2gw6 s ASP 22 Cb 0.00 -2.27 1.30 0.00 -0.30 0.00 0.00 42.92 41.65 2gw6 s ASP 22 CO 0.44 0.20 1.76 0.00 -0.17 0.00 0.00 175.17 177.40 2gw6 h ALA 23 N 5.51 2.60 0.01 3.66 0.00 -1.98 0.17 119.26 129.22 2gw6 h ALA 23 Ca -0.47 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.42 2gw6 h ALA 23 Cb 1.20 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2gw6 h ALA 23 CO 0.67 -1.01 -0.19 1.15 0.00 0.00 0.00 179.25 179.87 2gw6 h THR 24 N 0.22 1.61 0.05 0.00 2.02 -2.00 -2.59 112.91 112.23 2gw6 h THR 24 Ca 0.61 -2.06 -0.00 0.00 0.77 0.00 0.00 66.41 65.74 2gw6 h THR 24 Cb 1.90 2.96 0.00 0.00 -1.74 0.00 0.00 68.15 71.27 2gw6 h THR 24 CO -0.21 0.55 -0.02 -0.61 0.37 0.00 0.00 175.52 175.60 2gw6 h GLN 25 N -0.65 -0.06 -0.63 6.66 -0.00 -1.53 -2.38 115.11 116.51 2gw6 h GLN 25 Ca -0.03 0.00 0.06 0.00 -0.00 0.00 0.00 58.65 58.68 2gw6 h GLN 25 Cb 1.01 0.01 -0.04 0.00 0.00 0.00 0.00 27.48 28.47 2gw6 h GLN 25 CO 0.04 -0.00 0.42 -0.39 0.00 0.00 0.00 178.83 178.89 2gw6 h VAL 26 N -0.11 1.02 -0.33 2.39 -1.51 -0.86 0.46 116.25 117.31 2gw6 h VAL 26 Ca -0.01 -0.22 0.01 0.00 -1.23 0.00 0.00 66.70 65.25 2gw6 h VAL 26 Cb 0.09 0.32 -0.02 0.00 -2.13 0.00 0.00 31.29 29.55 2gw6 h VAL 26 CO 0.01 0.12 0.21 0.22 -1.23 0.00 0.00 177.57 176.90 2gw6 h TYR 27 N 0.64 0.40 -0.31 5.19 3.20 -1.02 0.14 116.97 125.21 2gw6 h TYR 27 Ca 0.27 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 62.00 2gw6 h TYR 27 Cb 0.24 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 2gw6 h TYR 27 CO -0.00 0.24 -0.40 0.28 -1.64 0.00 0.00 178.16 176.64 2gw6 h VAL 28 N 0.43 1.29 -0.88 1.81 2.07 -0.91 -2.06 116.25 118.00 2gw6 h VAL 28 Ca 0.12 -1.58 -0.02 0.00 0.82 0.00 0.00 66.70 66.04 2gw6 h VAL 28 Cb -0.03 1.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 2gw6 h VAL 28 CO -0.04 0.52 0.49 0.00 0.02 0.00 0.00 177.57 178.55 2gw6 h ALA 29 N 0.71 1.12 -0.42 1.67 0.00 -0.80 -2.00 119.26 119.54 2gw6 h ALA 29 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2gw6 h ALA 29 Cb 1.00 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2gw6 h ALA 29 CO 0.10 0.62 0.27 0.35 0.00 0.00 0.00 179.25 180.59 2gw6 h PHE 30 N 1.22 0.53 -0.36 0.00 3.57 -0.48 0.17 116.94 121.58 2gw6 h PHE 30 Ca 0.31 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.84 2gw6 h PHE 30 Cb 0.02 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.55 2gw6 h PHE 30 CO 0.01 0.34 0.19 -0.07 -2.23 0.00 0.00 178.31 176.54 2gw6 h LEU 31 N 0.56 0.28 -0.23 0.59 4.07 -0.99 -0.60 115.31 119.00 2gw6 h LEU 31 Ca 0.15 0.01 -0.21 0.00 0.08 0.00 0.00 57.88 57.91 2gw6 h LEU 31 Cb -0.06 -0.04 -0.00 0.00 1.08 0.00 0.00 40.66 41.64 2gw6 h LEU 31 CO -0.03 0.21 -0.90 -0.37 -1.08 0.00 0.00 178.44 176.26 2gw6 h VAL 32 N 0.38 1.42 -0.46 1.22 -1.51 -1.17 -1.92 116.25 114.22 2gw6 h VAL 32 Ca 0.15 -2.46 0.07 0.00 -1.23 0.00 0.00 66.70 63.23 2gw6 h VAL 32 Cb 0.05 2.40 -0.06 0.00 -2.13 0.00 0.00 31.29 31.55 2gw6 h VAL 32 CO -0.10 0.73 0.13 0.22 -1.23 0.00 0.00 177.57 177.33 2gw6 h TYR 33 N 0.20 0.23 0.00 5.19 3.20 -0.43 0.22 116.97 125.58 2gw6 h TYR 33 Ca -0.06 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.77 2gw6 h TYR 33 Cb 1.53 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.76 2gw6 h TYR 33 CO 0.05 0.06 -0.31 -0.07 -1.64 0.00 0.00 178.16 176.25 2gw6 h LEU 34 N 0.29 0.00 0.13 2.82 4.07 -1.05 -1.57 115.31 119.99 2gw6 h LEU 34 Ca 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.18 2gw6 h LEU 34 Cb 0.26 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.00 2gw6 h LEU 34 CO -0.26 0.31 -0.06 -0.78 -1.08 0.00 0.00 178.44 176.57 2gw6 h ASP 35 N 0.00 -0.15 -0.78 -0.43 1.82 -0.39 0.60 116.42 117.10 2gw6 h ASP 35 Ca -0.00 -0.39 0.09 0.00 -0.39 0.00 0.00 57.03 56.33 2gw6 h ASP 35 Cb 0.63 0.04 -0.07 0.00 0.68 0.00 0.00 39.33 40.61 2gw6 h ASP 35 CO 0.04 0.37 0.43 -0.07 -1.61 0.00 0.00 179.24 178.41 2gw6 h LEU 36 N -0.74 0.62 0.40 2.28 3.38 -0.57 0.28 115.31 120.95 2gw6 h LEU 36 Ca -0.02 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2gw6 h LEU 36 Cb 0.53 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2gw6 h LEU 36 CO 0.03 0.36 -0.19 0.24 0.09 0.00 0.00 178.44 178.97 2gw6 h MET 37 N 0.74 -0.52 -0.00 1.13 2.86 -1.28 0.16 114.93 118.02 2gw6 h MET 37 Ca 0.37 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 58.05 2gw6 h MET 37 Cb 0.33 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.10 2gw6 h MET 37 CO -0.24 -0.21 -0.48 0.39 1.06 0.00 0.00 176.91 177.44 2gw6 n GLU 38 N -5.19 0.46 -0.01 1.72 1.02 0.20 -2.11 120.64 116.73 2gw6 n GLU 38 Ca -0.10 -0.31 -0.04 0.00 -0.02 0.00 0.00 57.16 56.69 2gw6 n GLU 38 Cb 0.29 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.20 2gw6 n GLU 38 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2gw6 n SER 39 N -1.00 1.47 0.20 1.62 2.88 0.95 -4.75 113.62 115.00 2gw6 n SER 39 Ca 0.08 0.22 0.09 0.00 -1.33 0.00 0.00 58.87 57.94 2gw6 n SER 39 Cb 0.36 -0.51 0.14 0.00 -0.75 0.00 0.00 64.21 63.45 2gw6 n SER 39 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2gw6 h LYS 40 N -0.43 0.00 -6.60 -1.46 6.56 -1.29 -3.49 116.57 109.86 2gw6 h LYS 40 Ca -0.00 0.00 -0.43 0.00 -1.06 0.00 0.00 60.65 59.16 2gw6 h LYS 40 Cb 0.44 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.10 2gw6 h LYS 40 CO -0.00 0.15 -1.09 -1.13 -2.06 0.00 0.00 179.45 175.32 2gw6 n SER 41 N -3.14 -5.25 -4.89 0.86 3.41 0.55 -4.97 113.62 100.19 2gw6 n SER 41 Ca 0.03 -0.62 -0.29 0.00 -0.26 0.00 0.00 58.87 57.73 2gw6 n SER 41 Cb 0.58 -1.88 -0.00 0.00 -0.26 0.00 0.00 64.21 62.65 2gw6 n SER 41 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 2gw6 s TRP 42 N -2.45 3.56 0.23 7.33 0.23 -1.20 -4.99 118.94 121.66 2gw6 s TRP 42 Ca 0.14 0.98 -0.08 0.00 -2.03 0.00 0.00 56.10 55.12 2gw6 s TRP 42 Cb -0.02 -2.44 0.22 0.00 0.03 0.00 0.00 33.47 31.27 2gw6 s TRP 42 CO 0.88 -0.35 1.91 1.25 0.96 0.00 0.00 176.95 181.60 2gw6 h HIS 43 N 0.27 1.14 -2.14 -1.98 -0.00 -1.60 -3.44 115.15 107.41 2gw6 h HIS 43 Ca -0.46 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 59.94 2gw6 h HIS 43 Cb 1.20 -0.39 -0.22 0.00 -0.00 0.00 0.00 27.41 28.00 2gw6 h HIS 43 CO 0.61 0.72 -0.10 -2.00 -0.00 0.00 0.00 177.93 177.16 2gw6 s GLU 44 N -6.13 0.59 -0.03 5.26 2.56 -0.53 -4.96 118.70 115.47 2gw6 s GLU 44 Ca -0.13 1.21 -0.00 0.00 0.00 0.00 0.00 54.97 56.05 2gw6 s GLU 44 Cb 0.17 0.33 0.03 0.00 2.00 0.00 0.00 34.13 36.66 2gw6 s GLU 44 CO 0.80 -0.17 0.02 0.08 -0.56 0.00 0.00 175.26 175.43 2gw6 s VAL 45 N 2.03 0.06 0.14 3.70 1.01 -1.26 -1.15 120.40 124.92 2gw6 s VAL 45 Ca -0.08 0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.13 2gw6 s VAL 45 Cb -0.08 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 36.07 2gw6 s VAL 45 CO -0.18 0.13 -0.12 0.54 0.00 0.00 0.00 175.10 175.47 2gw6 s ASN 46 N 1.19 1.90 -0.26 3.32 2.20 0.38 -4.97 114.94 118.71 2gw6 s ASN 46 Ca -0.07 -0.91 -0.10 0.00 -0.94 0.00 0.00 52.86 50.83 2gw6 s ASN 46 Cb -0.13 -0.04 -0.05 0.00 -2.00 0.00 0.00 41.25 39.03 2gw6 s ASN 46 CO -0.02 -0.24 0.17 0.00 -2.94 0.00 0.00 177.10 174.07 2gw6 s VAL 48 N 1.39 2.04 -0.34 0.00 1.01 0.14 -4.98 120.40 119.67 2gw6 s VAL 48 Ca 0.07 -1.27 -0.14 0.00 0.00 0.00 0.00 61.98 60.65 2gw6 s VAL 48 Cb -0.15 -2.03 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 2gw6 s VAL 48 CO 0.07 0.22 0.29 -0.83 0.00 0.00 0.00 175.10 174.85 2gw6 s GLY 49 N 1.22 1.94 -0.58 4.51 0.00 -1.26 -0.11 107.32 113.04 2gw6 s GLY 49 Ca -0.02 -1.29 -0.14 0.00 0.00 0.00 0.00 44.72 43.26 2gw6 s GLY 49 CO -0.09 0.86 0.52 -2.27 0.00 0.00 0.00 173.10 172.12 2gw6 s LEU 50 N 1.84 6.19 0.36 0.66 1.98 0.12 -4.89 118.68 124.94 2gw6 s LEU 50 Ca 0.08 -1.97 0.10 0.00 -2.89 0.00 0.00 54.13 49.46 2gw6 s LEU 50 Cb -0.17 -2.18 0.85 0.00 0.66 0.00 0.00 46.19 45.36 2gw6 s LEU 50 CO 0.11 -0.78 1.86 -0.65 -1.89 0.00 0.00 176.35 174.99 2gw6 h PRO 51 N 8.62 0.63 -0.91 0.98 0.11 -1.93 0.38 132.00 139.89 2gw6 h PRO 51 Ca -0.22 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 65.94 2gw6 h PRO 51 Cb 1.08 -0.14 -0.07 0.00 0.11 0.00 0.00 31.00 31.99 2gw6 h PRO 51 CO 0.96 0.42 0.59 0.93 -0.21 0.00 0.00 178.00 180.69 2gw6 h GLU 52 N 0.65 0.90 0.00 1.05 5.08 -1.95 -2.42 114.58 117.89 2gw6 h GLU 52 Ca 0.46 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.77 2gw6 h GLU 52 Cb 0.81 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.85 2gw6 h GLU 52 CO -0.22 0.60 -1.25 1.28 -1.00 0.00 0.00 179.01 178.42 2gw6 n LEU 53 N -4.53 0.45 -3.23 1.33 4.77 -1.02 -4.97 117.00 109.81 2gw6 n LEU 53 Ca 0.15 -0.28 -0.23 0.00 -0.03 0.00 0.00 56.01 55.62 2gw6 n LEU 53 Cb 0.29 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.40 2gw6 n LEU 53 CO 0.31 0.11 0.01 0.00 -1.33 0.00 0.00 177.39 176.49 2gw6 n GLN 54 N -1.72 -4.57 -4.21 3.23 6.02 0.13 -4.98 117.38 111.29 2gw6 n GLN 54 Ca 0.00 0.73 -0.23 0.00 -0.01 0.00 0.00 57.00 57.50 2gw6 n GLN 54 Cb 0.35 -5.55 -0.06 0.00 1.02 0.00 0.00 30.24 25.99 2gw6 n GLN 54 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 2gw6 s LEU 55 N -6.69 3.38 0.05 1.08 0.05 -0.95 -4.92 118.68 110.69 2gw6 s LEU 55 Ca 0.37 -0.55 0.08 0.00 0.05 0.00 0.00 54.13 54.08 2gw6 s LEU 55 Cb -0.18 -1.90 -0.03 0.00 -2.05 0.00 0.00 46.19 42.02 2gw6 s LEU 55 CO 0.46 -0.06 -0.19 -0.63 -0.55 0.00 0.00 176.35 175.39 2gw6 s ILE 56 N -2.28 2.73 0.05 1.48 -1.09 -1.26 0.13 121.20 120.96 2gw6 s ILE 56 Ca 0.33 -1.26 -0.19 0.00 -2.23 0.00 0.00 60.65 57.30 2gw6 s ILE 56 Cb -0.06 -2.16 0.04 0.00 -1.58 0.00 0.00 42.46 38.70 2gw6 s ILE 56 CO 0.22 0.30 0.44 0.00 -1.23 0.00 0.00 174.94 174.67 2gw6 s LEU 58 N -2.08 3.10 0.02 0.00 2.01 -0.13 0.26 118.68 121.85 2gw6 s LEU 58 Ca -0.04 -0.24 0.04 0.00 0.01 0.00 0.00 54.13 53.89 2gw6 s LEU 58 Cb -0.00 -1.76 -0.02 0.00 0.01 0.00 0.00 46.19 44.41 2gw6 s LEU 58 CO -0.03 0.09 -0.12 -0.69 1.01 0.00 0.00 176.35 176.60 2gw6 s VAL 59 N 0.85 0.97 0.00 -1.59 1.01 -0.57 -0.76 120.40 120.32 2gw6 s VAL 59 Ca -0.01 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.19 2gw6 s VAL 59 Cb -0.15 -0.86 0.00 0.00 0.00 0.00 0.00 36.38 35.37 2gw6 s VAL 59 CO 0.02 0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.81 2gw6 n GLY 60 N 2.25 1.17 3.21 4.51 0.00 -0.66 -0.47 105.19 115.21 2gw6 n GLY 60 Ca -0.17 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 2gw6 n GLY 60 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gw6 s THR 61 N -0.51 3.08 0.20 2.61 -4.23 -0.30 -1.98 115.64 114.51 2gw6 s THR 61 Ca 0.00 -1.08 -0.10 0.00 -1.18 0.00 0.00 61.69 59.33 2gw6 s THR 61 Cb 0.00 -2.63 0.13 0.00 1.34 0.00 0.00 72.50 71.34 2gw6 s THR 61 CO 0.00 0.09 1.79 -0.08 -0.54 0.00 0.00 174.62 175.87 2gw6 h GLU 62 N 8.04 1.03 -4.07 3.99 4.81 -1.77 -1.40 114.58 125.22 2gw6 h GLU 62 Ca -0.29 -0.15 -0.42 0.00 -0.13 0.00 0.00 59.36 58.37 2gw6 h GLU 62 Cb 1.10 -0.19 -0.34 0.00 0.63 0.00 0.00 28.75 29.95 2gw6 h GLU 62 CO 0.57 0.81 -0.78 0.42 -0.73 0.00 0.00 179.01 179.30 2gw6 s ILE 63 N -5.71 0.59 0.24 2.32 -1.09 -1.26 -3.39 121.20 112.91 2gw6 s ILE 63 Ca -0.13 -0.15 -0.31 0.00 -2.23 0.00 0.00 60.65 57.83 2gw6 s ILE 63 Cb 0.14 -0.61 -0.14 0.00 -1.58 0.00 0.00 42.46 40.27 2gw6 s ILE 63 CO 0.81 0.24 1.32 1.21 -1.23 0.00 0.00 174.94 177.29 2gw6 n GLU 64 N 4.07 1.83 0.00 2.79 2.13 -1.26 -1.49 120.64 128.71 2gw6 n GLU 64 Ca -0.24 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.23 2gw6 n GLU 64 Cb 0.51 -2.25 0.00 0.00 0.27 0.00 0.00 31.44 29.97 2gw6 n GLU 64 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2gw6 n GLY 65 N 1.94 2.61 0.00 8.31 0.00 -1.26 -5.04 105.19 111.75 2gw6 n GLY 65 Ca 0.11 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.68 2gw6 n GLY 65 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2gw6 n GLU 66 N 0.00 0.49 -2.69 1.61 -0.58 -0.56 -5.07 120.64 113.84 2gw6 n GLU 66 Ca 0.00 0.00 -0.06 0.00 -0.42 0.00 0.00 57.16 56.68 2gw6 n GLU 66 Cb 0.00 0.00 0.08 0.00 -0.57 0.00 0.00 31.44 30.95 2gw6 n GLU 66 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2gw6 n GLY 67 N 5.00 0.21 3.36 0.62 0.00 -1.26 -4.96 105.19 108.16 2gw6 n GLY 67 Ca 0.00 0.08 0.02 0.00 0.00 0.00 0.00 46.02 46.12 2gw6 n GLY 67 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2gw6 s LEU 68 N -2.43 -0.54 -0.30 0.99 0.05 -1.24 -5.03 118.68 110.18 2gw6 s LEU 68 Ca 0.17 0.71 -0.08 0.00 0.05 0.00 0.00 54.13 54.97 2gw6 s LEU 68 Cb 0.27 1.60 0.15 0.00 -2.05 0.00 0.00 46.19 46.16 2gw6 s LEU 68 CO -0.08 -0.10 0.65 -1.58 -0.55 0.00 0.00 176.35 174.69 2gw6 s GLN 69 N 2.46 0.56 -0.07 1.48 2.00 -0.84 -4.10 119.66 121.16 2gw6 s GLN 69 Ca -0.02 1.32 -0.02 0.00 -2.00 0.00 0.00 55.36 54.64 2gw6 s GLN 69 Cb -0.06 0.78 0.03 0.00 0.80 0.00 0.00 33.01 34.57 2gw6 s GLN 69 CO -0.17 -0.29 0.04 0.99 -0.50 0.00 0.00 175.29 175.36 2gw6 s THR 70 N 2.87 0.06 -0.05 -0.34 2.01 -1.26 -1.65 115.64 117.28 2gw6 s THR 70 Ca 0.00 0.25 0.05 0.00 0.31 0.00 0.00 61.69 62.31 2gw6 s THR 70 Cb -0.12 -0.33 -0.00 0.00 0.01 0.00 0.00 72.50 72.05 2gw6 s THR 70 CO -0.19 0.15 -0.20 0.68 -0.69 0.00 0.00 174.62 174.37 2gw6 s VAL 71 N 2.10 1.66 -0.19 3.82 -7.23 0.06 -0.70 120.40 119.93 2gw6 s VAL 71 Ca 0.05 -0.84 -0.02 0.00 -1.81 0.00 0.00 61.98 59.36 2gw6 s VAL 71 Cb -0.13 -1.42 -0.01 0.00 0.56 0.00 0.00 36.38 35.39 2gw6 s VAL 71 CO -0.04 0.47 -0.09 0.68 -0.31 0.00 0.00 175.10 175.80 2gw6 s VAL 72 N 0.02 3.09 0.01 1.32 -7.23 -0.64 -0.96 120.40 116.02 2gw6 s VAL 72 Ca -0.05 -0.61 -0.30 0.00 -1.81 0.00 0.00 61.98 59.21 2gw6 s VAL 72 Cb -0.13 -2.36 -0.08 0.00 0.56 0.00 0.00 36.38 34.38 2gw6 s VAL 72 CO 0.03 0.47 1.79 -2.16 -0.31 0.00 0.00 175.10 174.93 2gw6 s PRO 73 N 1.08 4.17 -0.15 4.82 0.04 -1.26 -1.30 135.00 142.39 2gw6 s PRO 73 Ca 0.00 2.41 -0.04 0.00 0.04 0.00 0.00 61.00 63.41 2gw6 s PRO 73 Cb -0.15 -3.97 0.05 0.00 0.04 0.00 0.00 34.50 30.48 2gw6 s PRO 73 CO -0.02 -0.87 0.07 0.99 0.04 0.00 0.00 177.00 177.21 2gw6 s THR 74 N 3.89 0.02 0.65 1.26 2.01 0.13 -4.92 115.64 118.67 2gw6 s THR 74 Ca 0.80 -0.13 -0.13 0.00 0.31 0.00 0.00 61.69 62.54 2gw6 s THR 74 Cb -0.39 -0.58 -0.01 0.00 0.01 0.00 0.00 72.50 71.53 2gw6 s THR 74 CO 0.35 -0.19 1.06 -2.16 -0.69 0.00 0.00 174.62 173.00 2gw6 s PRO 75 N 2.10 3.09 0.67 4.92 0.04 -1.26 -0.44 135.00 144.11 2gw6 s PRO 75 Ca 0.02 1.09 0.40 0.00 0.04 0.00 0.00 61.00 62.55 2gw6 s PRO 75 Cb -0.15 -2.01 2.18 0.00 0.04 0.00 0.00 34.50 34.56 2gw6 s PRO 75 CO -0.08 -0.98 2.24 0.82 0.04 0.00 0.00 177.00 179.03 2gw6 h ILE 76 N -0.18 0.02 -0.01 0.56 1.08 -1.49 -0.62 117.51 116.88 2gw6 h ILE 76 Ca -0.45 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.02 2gw6 h ILE 76 Cb 1.22 0.90 0.00 0.00 -3.07 0.00 0.00 36.82 35.86 2gw6 h ILE 76 CO 0.57 0.00 -0.28 1.07 -0.69 0.00 0.00 178.15 178.82 2gw6 n THR 77 N -3.05 0.00 -3.55 -0.27 5.66 -1.26 -4.87 114.28 106.94 2gw6 n THR 77 Ca -0.03 -0.15 -0.24 0.00 -3.05 0.00 0.00 64.05 60.59 2gw6 n THR 77 Cb 0.17 0.50 -0.02 0.00 -1.55 0.00 0.00 70.33 69.43 2gw6 n THR 77 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2gw6 s ALA 78 N -2.49 3.76 0.34 1.79 0.00 -0.24 -5.10 121.76 119.83 2gw6 s ALA 78 Ca 0.24 -0.94 0.07 0.00 0.00 0.00 0.00 51.96 51.33 2gw6 s ALA 78 Cb 0.19 -2.02 -0.02 0.00 0.00 0.00 0.00 23.12 21.26 2gw6 s ALA 78 CO 0.52 0.12 0.34 -1.54 0.00 0.00 0.00 175.76 175.20 2gw6 s SER 79 N -3.84 5.42 0.04 0.00 1.04 -1.26 -4.90 113.70 110.19 2gw6 s SER 79 Ca 0.39 -0.45 0.07 0.00 0.48 0.00 0.00 55.95 56.43 2gw6 s SER 79 Cb -0.10 -0.99 -0.02 0.00 0.10 0.00 0.00 66.02 65.01 2gw6 s SER 79 CO 0.33 -0.40 -0.19 -0.22 0.98 0.00 0.00 173.24 173.74 2gw6 s LEU 80 N -4.05 2.15 0.04 2.42 1.98 -1.26 -5.08 118.68 114.89 2gw6 s LEU 80 Ca 0.42 -0.49 -0.11 0.00 -2.89 0.00 0.00 54.13 51.07 2gw6 s LEU 80 Cb -0.06 -0.91 0.01 0.00 0.66 0.00 0.00 46.19 45.88 2gw6 s LEU 80 CO 0.28 0.15 0.23 -0.44 -1.89 0.00 0.00 176.35 174.67 2gw6 s SER 81 N -1.08 -0.02 0.56 3.68 0.01 -1.26 -4.97 113.70 110.63 2gw6 s SER 81 Ca 0.06 -0.31 0.35 0.00 1.31 0.00 0.00 55.95 57.37 2gw6 s SER 81 Cb -0.08 0.31 1.49 0.00 0.21 0.00 0.00 66.02 67.94 2gw6 s SER 81 CO 0.01 -0.57 2.03 1.12 0.41 0.00 0.00 173.24 176.25 2gw6 h HIS 82 N 3.41 0.00 -0.36 2.43 2.07 -2.00 -0.18 115.15 120.52 2gw6 h HIS 82 Ca -0.32 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.06 2gw6 h HIS 82 Cb 1.19 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.17 2gw6 h HIS 82 CO 0.49 0.01 -0.31 -0.97 -3.07 0.00 0.00 177.93 174.08 2gw6 h ASN 83 N 0.00 0.89 -0.26 3.10 -1.24 -1.99 -2.52 115.58 113.56 2gw6 h ASN 83 Ca -0.00 -0.45 0.03 0.00 0.71 0.00 0.00 56.30 56.59 2gw6 h ASN 83 Cb 0.45 -0.25 -0.03 0.00 0.73 0.00 0.00 38.32 39.22 2gw6 h ASN 83 CO 0.00 1.16 0.07 -0.09 -1.29 0.00 0.00 177.43 177.28 2gw6 h ARG 84 N 0.64 0.17 -0.57 6.67 9.65 -1.62 -2.21 114.38 127.11 2gw6 h ARG 84 Ca 0.06 -0.01 -0.05 0.00 -1.10 0.00 0.00 59.98 58.89 2gw6 h ARG 84 Cb 0.89 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.40 2gw6 h ARG 84 CO 0.08 0.11 0.16 -0.84 2.80 0.00 0.00 179.97 182.28 2gw6 h ILE 85 N 0.17 1.22 -0.90 1.20 3.07 -1.04 -0.73 117.51 120.51 2gw6 h ILE 85 Ca 0.12 -0.78 0.07 0.00 1.55 0.00 0.00 64.86 65.81 2gw6 h ILE 85 Cb 0.10 0.62 -0.06 0.00 -0.27 0.00 0.00 36.82 37.21 2gw6 h ILE 85 CO -0.14 0.30 0.59 -0.09 -1.05 0.00 0.00 178.15 177.75 2gw6 h ARG 86 N 0.83 0.98 -0.34 0.16 1.12 -1.18 0.31 114.38 116.26 2gw6 h ARG 86 Ca 0.19 -0.06 -0.11 0.00 -1.11 0.00 0.00 59.98 58.88 2gw6 h ARG 86 Cb 0.26 -0.22 -0.01 0.00 -0.01 0.00 0.00 29.97 29.99 2gw6 h ARG 86 CO -0.01 0.65 -0.24 0.93 -3.11 0.00 0.00 179.97 178.19 2gw6 h GLU 87 N 1.01 0.76 -0.30 0.20 5.08 -0.57 -1.99 114.58 118.77 2gw6 h GLU 87 Ca 0.39 -0.36 -0.09 0.00 -1.00 0.00 0.00 59.36 58.30 2gw6 h GLU 87 Cb 0.22 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2gw6 h GLU 87 CO -0.15 0.98 -0.16 0.82 -1.00 0.00 0.00 179.01 179.51 2gw6 h ILE 88 N 0.53 1.29 -0.60 3.13 2.04 -0.34 0.76 117.51 124.33 2gw6 h ILE 88 Ca 0.07 -1.27 0.09 0.00 1.00 0.00 0.00 64.86 64.75 2gw6 h ILE 88 Cb 0.80 1.47 -0.07 0.00 -0.74 0.00 0.00 36.82 38.27 2gw6 h ILE 88 CO 0.06 0.41 0.21 -0.07 0.00 0.00 0.00 178.15 178.76 2gw6 h LEU 89 N 0.40 0.20 -0.23 1.44 3.38 -0.41 0.33 115.31 120.42 2gw6 h LEU 89 Ca 0.07 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 2gw6 h LEU 89 Cb 0.69 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2gw6 h LEU 89 CO 0.05 0.12 0.13 0.50 0.09 0.00 0.00 178.44 179.33 2gw6 h LYS 90 N 0.39 0.32 0.69 1.13 3.64 -0.96 -1.36 116.57 120.42 2gw6 h LYS 90 Ca 0.30 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.61 2gw6 h LYS 90 Cb 0.37 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 32.14 2gw6 h LYS 90 CO -0.31 0.28 -0.33 0.00 -2.27 0.00 0.00 179.45 176.82 2gw6 h ALA 91 N 1.03 -0.92 -0.47 5.00 0.00 -0.10 0.34 119.26 124.13 2gw6 h ALA 91 Ca 0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2gw6 h ALA 91 Cb 0.04 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2gw6 h ALA 91 CO -0.01 -1.01 0.24 0.66 0.00 0.00 0.00 179.25 179.13 2gw6 h SER 92 N -0.94 0.60 0.41 0.00 4.64 -0.39 -2.15 113.55 115.72 2gw6 h SER 92 Ca -0.09 -0.11 -0.08 0.00 -0.47 0.00 0.00 61.79 61.03 2gw6 h SER 92 Cb 0.71 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 2gw6 h SER 92 CO 0.15 0.54 -0.39 0.03 -0.87 0.00 0.00 176.83 176.30 2gw6 h ARG 93 N 0.62 0.00 -0.52 4.77 3.08 -1.22 0.33 114.38 121.44 2gw6 h ARG 93 Ca 0.16 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.22 2gw6 h ARG 93 Cb 0.09 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 2gw6 h ARG 93 CO -0.02 0.39 0.33 -0.22 -1.07 0.00 0.00 179.97 179.38 2gw6 h LYS 94 N 0.00 0.65 0.00 0.04 3.11 -0.27 -1.52 116.57 118.57 2gw6 h LYS 94 Ca -0.00 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.80 2gw6 h LYS 94 Cb 0.71 -0.15 0.00 0.00 -1.00 0.00 0.00 32.23 31.79 2gw6 h LYS 94 CO 0.05 0.43 -0.22 -0.07 -2.81 0.00 0.00 179.45 176.83 2gw6 h LEU 95 N 0.67 0.00 0.00 5.20 -0.00 -1.09 -3.32 115.31 116.77 2gw6 h LEU 95 Ca 0.20 -0.06 -0.08 0.00 -0.00 0.00 0.00 57.88 57.94 2gw6 h LEU 95 Cb -0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.60 2gw6 h LEU 95 CO -0.06 0.03 -0.73 -0.61 -0.00 0.00 0.00 178.44 177.07 2gw6 h GLN 96 N 0.00 0.00 0.00 1.13 5.75 -0.05 -3.48 115.11 118.46 2gw6 h GLN 96 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2gw6 h GLN 96 Cb 0.80 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.35 2gw6 h GLN 96 CO 0.00 0.27 0.00 0.41 -2.65 0.00 0.00 178.83 176.86 2gw6 n GLY 97 N 1.24 1.51 3.38 2.39 0.00 -0.66 -5.04 105.19 108.00 2gw6 n GLY 97 Ca -0.01 -0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 2gw6 n GLY 97 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2gw6 s ASP 98 N -0.00 -0.47 -0.06 1.61 -4.77 -0.97 -5.02 116.67 106.98 2gw6 s ASP 98 Ca 0.00 0.82 0.07 0.00 -3.30 0.00 0.00 52.55 50.13 2gw6 s ASP 98 Cb 0.00 0.84 0.30 0.00 -1.09 0.00 0.00 42.92 42.98 2gw6 s ASP 98 CO 0.00 -0.26 1.08 -0.81 0.70 0.00 0.00 175.17 175.88 2gw6 n PRO 99 N 2.37 2.23 0.00 2.11 -0.04 -1.25 -4.23 135.00 136.19 2gw6 n PRO 99 Ca -0.15 -1.18 0.00 0.00 -0.04 0.00 0.00 63.50 62.13 2gw6 n PRO 99 Cb 0.57 -1.59 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 2gw6 n PRO 99 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2gw6 n ASP 100 N 0.29 0.00 -4.80 3.54 5.68 -1.26 -4.73 116.55 115.26 2gw6 n ASP 100 Ca 0.11 -1.00 -0.33 0.00 -0.50 0.00 0.00 54.79 53.07 2gw6 n ASP 100 Cb 0.49 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.46 2gw6 n ASP 100 CO 0.00 0.00 0.00 -1.48 -1.33 0.00 0.00 177.20 174.39 2gw6 s LEU 101 N 0.00 3.62 -0.26 -2.12 2.34 -1.26 -4.93 118.68 116.08 2gw6 s LEU 101 Ca 0.00 1.83 -0.28 0.00 0.06 0.00 0.00 54.13 55.74 2gw6 s LEU 101 Cb 0.00 -4.54 -0.04 0.00 -0.56 0.00 0.00 46.19 41.05 2gw6 s LEU 101 CO 0.00 -0.99 2.14 -2.84 -1.06 0.00 0.00 176.35 173.60 2gw6 s PRO 102 N -3.80 3.12 0.00 1.48 0.02 -1.26 -4.95 135.00 129.62 2gw6 s PRO 102 Ca 0.64 1.86 0.00 0.00 0.02 0.00 0.00 61.00 63.52 2gw6 s PRO 102 Cb -0.16 -4.35 0.00 0.00 0.02 0.00 0.00 34.50 30.02 2gw6 s PRO 102 CO 0.31 -2.11 0.00 -0.12 -0.33 0.00 0.00 177.00 174.74 2gw6 n MET 103 N 8.71 0.71 -3.83 5.54 1.56 -1.26 -5.13 117.12 123.42 2gw6 n MET 103 Ca 0.29 0.00 -0.06 0.00 -0.27 0.00 0.00 57.70 57.65 2gw6 n MET 103 Cb 0.46 0.00 0.02 0.00 2.15 0.00 0.00 33.22 35.84 2gw6 n MET 103 CO 0.00 0.00 0.00 -1.12 -0.73 0.00 0.00 175.97 174.12 2gw6 s SER 104 N -0.65 -0.03 0.09 6.12 0.01 -1.26 -4.03 113.70 113.95 2gw6 s SER 104 Ca 0.00 -0.89 -0.21 0.00 1.31 0.00 0.00 55.95 56.16 2gw6 s SER 104 Cb 0.00 0.69 0.05 0.00 0.21 0.00 0.00 66.02 66.98 2gw6 s SER 104 CO 0.00 -1.37 0.51 0.72 0.41 0.00 0.00 173.24 173.52 2gw6 s PHE 105 N -2.43 -0.40 -0.17 2.43 -0.71 -0.95 -4.65 117.98 111.09 2gw6 s PHE 105 Ca 0.17 0.31 -0.06 0.00 -1.04 0.00 0.00 56.93 56.31 2gw6 s PHE 105 Cb -0.04 0.37 -0.04 0.00 -1.21 0.00 0.00 43.02 42.10 2gw6 s PHE 105 CO 0.08 -0.70 0.05 0.99 -1.34 0.00 0.00 175.22 174.30 2gw6 s THR 106 N -3.04 4.65 -0.13 -4.49 2.01 0.13 -1.58 115.64 113.19 2gw6 s THR 106 Ca -0.02 -0.09 -0.27 0.00 0.31 0.00 0.00 61.69 61.62 2gw6 s THR 106 Cb -0.00 -3.07 -0.02 0.00 0.01 0.00 0.00 72.50 69.42 2gw6 s THR 106 CO -0.06 0.48 0.90 -0.76 -0.69 0.00 0.00 174.62 174.49 2gw6 s LEU 107 N 0.20 4.22 -0.54 4.42 1.43 0.12 -1.62 118.68 126.91 2gw6 s LEU 107 Ca 0.03 1.34 -0.16 0.00 -1.03 0.00 0.00 54.13 54.31 2gw6 s LEU 107 Cb -0.12 -3.37 0.13 0.00 0.03 0.00 0.00 46.19 42.86 2gw6 s LEU 107 CO 0.01 -0.39 0.51 0.00 0.23 0.00 0.00 176.35 176.71 2gw6 s ALA 108 N 1.92 3.65 -0.25 4.21 0.00 -0.42 -0.29 121.76 130.59 2gw6 s ALA 108 Ca 0.43 -2.54 -0.17 0.00 0.00 0.00 0.00 51.96 49.68 2gw6 s ALA 108 Cb -0.18 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 2gw6 s ALA 108 CO 0.16 -2.03 0.46 0.42 0.00 0.00 0.00 175.76 174.77 2gw6 s ILE 109 N 1.61 5.13 0.02 0.00 1.01 0.68 0.20 121.20 129.84 2gw6 s ILE 109 Ca 0.03 0.77 0.09 0.00 0.00 0.00 0.00 60.65 61.54 2gw6 s ILE 109 Cb -0.30 -3.78 -0.03 0.00 0.01 0.00 0.00 42.46 38.37 2gw6 s ILE 109 CO 0.03 0.15 -0.26 0.68 0.00 0.00 0.00 174.94 175.53 2gw6 s VAL 110 N 1.99 2.09 0.25 2.92 -7.23 0.42 0.35 120.40 121.18 2gw6 s VAL 110 Ca 0.19 -1.27 -0.18 0.00 -1.81 0.00 0.00 61.98 58.91 2gw6 s VAL 110 Cb -0.15 -1.77 -0.08 0.00 0.56 0.00 0.00 36.38 34.93 2gw6 s VAL 110 CO 0.09 0.45 0.72 -0.70 -0.31 0.00 0.00 175.10 175.35 2gw6 s GLU 111 N -0.99 4.18 0.00 4.82 2.12 0.78 -1.10 118.70 128.50 2gw6 s GLU 111 Ca 0.11 0.81 0.14 0.00 0.36 0.00 0.00 54.97 56.39 2gw6 s GLU 111 Cb -0.10 -2.76 0.69 0.00 0.26 0.00 0.00 34.13 32.22 2gw6 s GLU 111 CO 0.01 0.33 1.41 0.43 -0.54 0.00 0.00 175.26 176.90 2gw6 n SER 112 N 0.44 0.00 -0.09 -1.70 7.64 -1.26 -2.40 113.62 116.25 2gw6 n SER 112 Ca -0.01 0.19 -0.18 0.00 1.01 0.00 0.00 58.87 59.89 2gw6 n SER 112 Cb 0.52 -0.34 -0.12 0.00 -1.01 0.00 0.00 64.21 63.25 2gw6 n SER 112 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2gw6 h ASP 113 N 0.00 0.00 0.00 6.43 3.58 -2.05 -3.49 116.42 120.90 2gw6 h ASP 113 Ca 0.00 -0.77 0.00 0.00 0.42 0.00 0.00 57.03 56.68 2gw6 h ASP 113 Cb 0.16 -0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.21 2gw6 h ASP 113 CO 0.00 1.23 0.00 -1.54 -2.88 0.00 0.00 179.24 176.05 2gw6 n SER 114 N -4.53 0.00 -4.68 2.28 3.41 -1.01 -5.14 113.62 103.95 2gw6 n SER 114 Ca -0.21 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 57.98 2gw6 n SER 114 Cb 0.58 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.50 2gw6 n SER 114 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2gw6 n THR 115 N 0.00 0.47 -4.31 6.66 -1.04 -1.26 -4.76 114.28 110.04 2gw6 n THR 115 Ca 0.00 -0.08 -0.33 0.00 -2.04 0.00 0.00 64.05 61.59 2gw6 n THR 115 Cb 0.00 -2.19 -0.15 0.00 -1.82 0.00 0.00 70.33 66.16 2gw6 n THR 115 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2gw6 s ILE 116 N 3.16 2.49 -0.20 12.58 1.01 -1.26 -0.16 121.20 138.82 2gw6 s ILE 116 Ca 0.83 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 60.69 2gw6 s ILE 116 Cb -0.46 -2.06 0.04 0.00 0.01 0.00 0.00 42.46 39.99 2gw6 s ILE 116 CO 0.38 0.51 -0.14 -0.69 0.00 0.00 0.00 174.94 175.00 2gw6 s VAL 117 N 1.09 1.93 -0.28 2.92 1.01 0.16 -4.94 120.40 122.29 2gw6 s VAL 117 Ca -0.00 -1.11 -0.25 0.00 0.00 0.00 0.00 61.98 60.62 2gw6 s VAL 117 Cb -0.14 -1.89 -0.00 0.00 0.00 0.00 0.00 36.38 34.35 2gw6 s VAL 117 CO -0.05 0.28 0.84 -0.31 0.00 0.00 0.00 175.10 175.86 2gw6 s TYR 118 N 1.29 3.25 -0.17 5.22 1.51 -1.26 -0.23 117.35 126.96 2gw6 s TYR 118 Ca -0.00 1.02 0.01 0.00 -1.01 0.00 0.00 57.07 57.09 2gw6 s TYR 118 Cb -0.16 -3.18 0.02 0.00 -0.11 0.00 0.00 41.96 38.53 2gw6 s TYR 118 CO -0.09 -0.50 -0.20 -0.47 -1.11 0.00 0.00 175.55 173.17 2gw6 s TYR 119 N 2.98 2.76 -0.29 2.71 5.04 0.61 -4.95 117.35 126.21 2gw6 s TYR 119 Ca 0.35 -1.57 -0.26 0.00 -2.44 0.00 0.00 57.07 53.15 2gw6 s TYR 119 Cb -0.14 -1.91 0.01 0.00 0.35 0.00 0.00 41.96 40.27 2gw6 s TYR 119 CO 0.10 -0.76 0.91 0.21 -1.34 0.00 0.00 175.55 174.67 2gw6 s LYS 120 N 1.20 4.06 -0.15 4.97 2.36 -1.26 0.12 119.74 131.04 2gw6 s LYS 120 Ca 0.03 0.88 -0.02 0.00 -2.55 0.00 0.00 55.97 54.31 2gw6 s LYS 120 Cb -0.14 -3.71 -0.02 0.00 -1.05 0.00 0.00 37.83 32.92 2gw6 s LYS 120 CO -0.11 -0.72 -0.09 -1.17 1.55 0.00 0.00 175.35 174.82 2gw6 s LEU 121 N 3.18 2.95 0.06 5.43 0.20 -0.62 -4.95 118.68 124.93 2gw6 s LEU 121 Ca 0.38 -0.25 0.09 0.00 0.69 0.00 0.00 54.13 55.04 2gw6 s LEU 121 Cb -0.14 -1.69 -0.03 0.00 -0.43 0.00 0.00 46.19 43.90 2gw6 s LEU 121 CO 0.12 0.15 -0.26 -0.89 -0.29 0.00 0.00 176.35 175.18 2gw6 s THR 122 N 0.44 2.09 -2.94 3.68 2.01 -1.26 -2.25 115.64 117.41 2gw6 s THR 122 Ca -0.07 -1.44 0.24 0.00 0.31 0.00 0.00 61.69 60.74 2gw6 s THR 122 Cb -0.15 -1.81 0.23 0.00 0.01 0.00 0.00 72.50 70.78 2gw6 s THR 122 CO 0.04 0.29 1.32 -0.67 -0.69 0.00 0.00 174.62 174.90