#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 0.00 -3.57 1.43 0.00 -1.26 -5.08 120.64 112.15 2gw6 n GLU 2 Ca 0.00 -1.02 -0.28 0.00 0.00 0.00 0.00 57.16 55.86 2gw6 n GLU 2 Cb 0.00 0.30 -0.16 0.00 0.00 0.00 0.00 31.44 31.58 2gw6 n GLU 2 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.13 177.29 2gw6 s ASP 3 N -1.02 3.14 0.00 -1.84 -4.77 -1.26 -4.81 116.67 106.11 2gw6 s ASP 3 Ca 0.06 -1.06 0.00 0.00 -3.30 0.00 0.00 52.55 48.24 2gw6 s ASP 3 Cb 0.07 -0.33 0.00 0.00 -1.09 0.00 0.00 42.92 41.56 2gw6 s ASP 3 CO -0.03 -0.41 0.00 0.00 0.70 0.00 0.00 175.17 175.43 2gw6 n ALA 4 N 5.24 0.00 -0.01 2.11 0.00 -0.95 -4.66 120.51 122.25 2gw6 n ALA 4 Ca -0.06 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.37 2gw6 n ALA 4 Cb 0.44 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.89 2gw6 n ALA 4 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2gw6 n TRP 5 N 0.00 0.04 -0.11 0.00 7.02 -1.26 -4.79 117.44 118.35 2gw6 n TRP 5 Ca 0.00 0.02 -0.18 0.00 -1.02 0.00 0.00 57.50 56.32 2gw6 n TRP 5 Cb 0.00 -0.19 -0.09 0.00 -2.42 0.00 0.00 31.31 28.62 2gw6 n TRP 5 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 2gw6 n MET 6 N -2.50 0.50 -4.41 -0.99 2.81 -1.26 -4.96 117.12 106.30 2gw6 n MET 6 Ca -0.01 0.15 -0.23 0.00 -1.81 0.00 0.00 57.70 55.80 2gw6 n MET 6 Cb 0.03 -1.36 -0.11 0.00 -0.71 0.00 0.00 33.22 31.06 2gw6 n MET 6 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2gw6 s GLY 7 N -5.78 1.66 -0.12 3.03 0.00 -1.26 -5.02 107.32 99.83 2gw6 s GLY 7 Ca -0.29 -1.69 0.11 0.00 0.00 0.00 0.00 44.72 42.85 2gw6 s GLY 7 CO 0.44 -1.76 0.35 2.41 0.00 0.00 0.00 173.10 174.55 2gw6 n THR 8 N -0.14 1.54 -3.60 0.90 -1.04 -1.26 -2.24 114.28 108.45 2gw6 n THR 8 Ca -0.09 -0.78 -0.37 0.00 -2.04 0.00 0.00 64.05 60.77 2gw6 n THR 8 Cb 0.58 -0.95 -0.07 0.00 -1.82 0.00 0.00 70.33 68.08 2gw6 n THR 8 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 2gw6 s HIS 9 N -2.55 3.55 0.22 -1.42 3.76 -1.26 -3.98 115.29 113.60 2gw6 s HIS 9 Ca -0.11 0.67 -0.09 0.00 -0.15 0.00 0.00 55.06 55.38 2gw6 s HIS 9 Cb 0.07 -2.25 0.32 0.00 1.11 0.00 0.00 32.58 31.83 2gw6 s HIS 9 CO 0.80 0.43 1.72 -1.35 -0.85 0.00 0.00 174.74 175.49 2gw6 h PRO 10 N 5.89 0.31 -0.47 8.40 0.11 -1.90 0.43 132.00 144.78 2gw6 h PRO 10 Ca -0.46 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 2gw6 h PRO 10 Cb 1.19 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2gw6 h PRO 10 CO 0.69 0.20 -0.02 0.87 -0.21 0.00 0.00 178.00 179.53 2gw6 h LYS 11 N 0.32 0.78 0.13 1.05 6.56 -1.98 0.28 116.57 123.71 2gw6 h LYS 11 Ca 0.33 -0.22 -0.01 0.00 -1.06 0.00 0.00 60.65 59.69 2gw6 h LYS 11 Cb 0.48 -0.09 0.00 0.00 -0.57 0.00 0.00 32.23 32.05 2gw6 h LYS 11 CO -0.38 0.81 -0.06 -0.92 -2.06 0.00 0.00 179.45 176.83 2gw6 h TYR 12 N 0.73 -0.16 -0.33 -1.35 3.20 -1.61 -2.16 116.97 115.29 2gw6 h TYR 12 Ca 0.14 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.08 2gw6 h TYR 12 Cb 0.48 0.05 -0.08 0.00 1.54 0.00 0.00 36.73 38.72 2gw6 h TYR 12 CO 0.02 0.19 -0.22 1.25 -1.64 0.00 0.00 178.16 177.77 2gw6 h LEU 13 N -0.53 -0.71 -0.77 2.82 5.85 0.00 -1.73 115.31 120.23 2gw6 h LEU 13 Ca -0.02 0.15 0.16 0.00 0.84 0.00 0.00 57.88 59.01 2gw6 h LEU 13 Cb 0.42 0.36 -0.10 0.00 0.37 0.00 0.00 40.66 41.71 2gw6 h LEU 13 CO 0.03 -0.25 0.28 -0.08 -0.34 0.00 0.00 178.44 178.08 2gw6 h GLU 14 N -0.18 0.38 -0.22 1.25 4.57 -0.43 -0.94 114.58 119.01 2gw6 h GLU 14 Ca 0.17 -0.02 -0.07 0.00 -1.18 0.00 0.00 59.36 58.25 2gw6 h GLU 14 Cb 0.44 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 2gw6 h GLU 14 CO -0.43 0.25 -0.17 1.98 -1.18 0.00 0.00 179.01 179.46 2gw6 h MET 15 N 0.39 0.39 0.00 1.92 4.05 -0.65 -2.81 114.93 118.22 2gw6 h MET 15 Ca 0.43 -0.11 0.00 0.00 -0.28 0.00 0.00 59.70 59.74 2gw6 h MET 15 Cb 0.71 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.47 2gw6 h MET 15 CO -0.45 0.55 0.00 0.52 0.23 0.00 0.00 176.91 177.76 2gw6 h MET 16 N 0.36 0.00 0.00 0.39 2.86 -0.50 -2.78 114.93 115.25 2gw6 h MET 16 Ca 0.06 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2gw6 h MET 16 Cb 0.51 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.17 2gw6 h MET 16 CO 0.03 0.00 -0.01 1.49 1.06 0.00 0.00 176.91 179.49 2gw6 h GLU 17 N 0.00 0.00 -0.01 1.72 4.81 -1.50 0.82 114.58 120.43 2gw6 h GLU 17 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2gw6 h GLU 17 Cb 0.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.64 2gw6 h GLU 17 CO 0.00 0.01 -0.11 1.47 -0.73 0.00 0.00 179.01 179.65 2gw6 n LEU 18 N -4.22 0.69 0.00 1.64 -0.00 -1.05 -4.92 117.00 109.14 2gw6 n LEU 18 Ca -0.03 -0.12 0.00 0.00 -0.00 0.00 0.00 56.01 55.86 2gw6 n LEU 18 Cb 0.09 -0.12 0.00 0.00 -0.00 0.00 0.00 43.42 43.39 2gw6 n LEU 18 CO 0.31 0.12 0.00 -0.67 -0.00 0.00 0.00 177.39 177.15 2gw6 n ASP 19 N -0.72 0.00 0.00 1.45 2.03 0.28 -4.84 116.55 114.74 2gw6 n ASP 19 Ca 0.16 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.47 2gw6 n ASP 19 Cb 0.29 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.69 2gw6 n ASP 19 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2gw6 n ILE 20 N 0.00 0.00 0.00 5.18 5.41 -1.26 -3.96 119.36 124.73 2gw6 n ILE 20 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2gw6 n ILE 20 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 2gw6 n ILE 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2gw6 n GLY 21 N 0.00 1.30 2.75 7.39 0.00 -1.26 -5.05 105.19 110.32 2gw6 n GLY 21 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.30 1.38 0.40 1.61 2.15 -1.25 -4.99 116.67 114.67 2gw6 s ASP 22 Ca 0.00 -0.23 0.29 0.00 0.43 0.00 0.00 52.55 53.04 2gw6 s ASP 22 Cb 0.00 0.38 1.23 0.00 -0.30 0.00 0.00 42.92 44.24 2gw6 s ASP 22 CO 0.00 -0.33 1.85 0.00 -0.17 0.00 0.00 175.17 176.53 2gw6 h ALA 23 N 8.31 1.00 -0.22 3.66 0.00 -1.99 -2.93 119.26 127.09 2gw6 h ALA 23 Ca -0.17 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 2gw6 h ALA 23 Cb 1.15 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2gw6 h ALA 23 CO 0.28 0.00 -0.10 1.15 0.00 0.00 0.00 179.25 180.58 2gw6 h THR 24 N 0.00 1.30 0.05 0.00 2.02 -1.98 0.12 112.91 114.42 2gw6 h THR 24 Ca 0.00 -1.16 -0.00 0.00 0.77 0.00 0.00 66.41 66.02 2gw6 h THR 24 Cb 0.37 1.60 0.00 0.00 -1.74 0.00 0.00 68.15 68.38 2gw6 h THR 24 CO 0.00 0.36 -0.02 1.56 0.37 0.00 0.00 175.52 177.78 2gw6 h GLN 25 N 0.17 -0.07 -0.65 6.66 1.08 -1.91 0.54 115.11 120.93 2gw6 h GLN 25 Ca 0.05 0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.33 2gw6 h GLN 25 Cb 0.59 0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.97 2gw6 h GLN 25 CO 0.03 -0.00 0.31 0.28 -0.95 0.00 0.00 178.83 178.50 2gw6 h VAL 26 N -0.11 0.86 -0.17 -0.54 2.07 -1.39 0.29 116.25 117.27 2gw6 h VAL 26 Ca -0.01 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 2gw6 h VAL 26 Cb 0.10 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.12 2gw6 h VAL 26 CO 0.01 0.10 -0.06 0.22 0.02 0.00 0.00 177.57 177.86 2gw6 h TYR 27 N 0.55 0.39 -0.17 1.57 3.20 -0.54 -0.73 116.97 121.23 2gw6 h TYR 27 Ca 0.31 -0.09 -0.18 0.00 3.14 0.00 0.00 58.73 61.92 2gw6 h TYR 27 Cb 0.30 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.48 2gw6 h TYR 27 CO -0.12 0.63 -0.61 0.28 -1.64 0.00 0.00 178.16 176.70 2gw6 h VAL 28 N 0.03 1.32 -0.49 1.81 2.07 -0.62 -1.66 116.25 118.71 2gw6 h VAL 28 Ca 0.04 -1.88 -0.10 0.00 0.82 0.00 0.00 66.70 65.58 2gw6 h VAL 28 Cb 0.52 1.85 -0.02 0.00 -1.52 0.00 0.00 31.29 32.12 2gw6 h VAL 28 CO 0.02 0.58 -0.09 0.00 0.02 0.00 0.00 177.57 178.10 2gw6 h ALA 29 N 0.89 0.92 -0.78 1.67 0.00 -0.45 -2.19 119.26 119.32 2gw6 h ALA 29 Ca -0.01 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 54.61 2gw6 h ALA 29 Cb 1.18 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 2gw6 h ALA 29 CO 0.12 0.63 0.50 0.35 0.00 0.00 0.00 179.25 180.84 2gw6 h PHE 30 N 0.79 0.93 0.03 0.00 3.57 -0.85 0.27 116.94 121.70 2gw6 h PHE 30 Ca 0.13 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.66 2gw6 h PHE 30 Cb 0.60 -0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.03 2gw6 h PHE 30 CO 0.03 0.54 -0.04 -0.07 -2.23 0.00 0.00 178.31 176.55 2gw6 h LEU 31 N 0.98 -0.10 -0.29 0.59 3.38 -0.91 -1.27 115.31 117.68 2gw6 h LEU 31 Ca 0.31 0.01 -0.20 0.00 0.09 0.00 0.00 57.88 58.09 2gw6 h LEU 31 Cb -0.01 0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2gw6 h LEU 31 CO -0.11 -0.06 -0.80 -0.37 0.09 0.00 0.00 178.44 177.20 2gw6 h VAL 32 N -0.08 1.36 -0.30 1.22 -1.51 -1.16 -2.11 116.25 113.66 2gw6 h VAL 32 Ca 0.01 -2.17 0.07 0.00 -1.23 0.00 0.00 66.70 63.37 2gw6 h VAL 32 Cb 0.09 2.16 -0.08 0.00 -2.13 0.00 0.00 31.29 31.33 2gw6 h VAL 32 CO -0.02 0.66 -0.26 0.22 -1.23 0.00 0.00 177.57 176.94 2gw6 h TYR 33 N 0.33 -0.70 -0.18 5.19 3.20 -0.32 0.24 116.97 124.72 2gw6 h TYR 33 Ca -0.05 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 2gw6 h TYR 33 Cb 1.40 0.35 -0.01 0.00 1.54 0.00 0.00 36.73 40.01 2gw6 h TYR 33 CO 0.06 -0.33 -0.06 -0.07 -1.64 0.00 0.00 178.16 176.12 2gw6 h LEU 34 N -0.24 0.25 -0.06 2.82 4.07 -1.18 -2.30 115.31 118.68 2gw6 h LEU 34 Ca 0.16 -0.04 -0.02 0.00 0.08 0.00 0.00 57.88 58.05 2gw6 h LEU 34 Cb 0.48 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.15 2gw6 h LEU 34 CO -0.44 0.35 -0.05 -0.78 -1.08 0.00 0.00 178.44 176.44 2gw6 h ASP 35 N 0.27 0.14 -0.49 -0.43 3.58 -0.42 0.25 116.42 119.32 2gw6 h ASP 35 Ca 0.06 -0.47 0.03 0.00 0.42 0.00 0.00 57.03 57.07 2gw6 h ASP 35 Cb 0.28 -0.04 -0.03 0.00 1.72 0.00 0.00 39.33 41.27 2gw6 h ASP 35 CO 0.01 0.58 0.33 -0.07 -2.88 0.00 0.00 179.24 177.21 2gw6 h LEU 36 N -0.30 0.48 0.13 2.28 3.38 -0.48 0.28 115.31 121.08 2gw6 h LEU 36 Ca 0.01 -0.01 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 2gw6 h LEU 36 Cb 0.54 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2gw6 h LEU 36 CO 0.01 0.33 -1.98 0.24 0.09 0.00 0.00 178.44 177.13 2gw6 h MET 37 N 0.56 0.28 0.00 1.13 2.86 -1.27 0.10 114.93 118.59 2gw6 h MET 37 Ca 0.20 -0.47 -0.25 0.00 -2.06 0.00 0.00 59.70 57.11 2gw6 h MET 37 Cb 0.09 0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.88 2gw6 h MET 37 CO -0.05 1.23 -1.77 0.39 1.06 0.00 0.00 176.91 177.76 2gw6 n GLU 38 N -3.49 0.64 -0.07 1.72 -0.58 0.07 -3.30 120.64 115.63 2gw6 n GLU 38 Ca -0.31 0.18 -0.12 0.00 -0.42 0.00 0.00 57.16 56.49 2gw6 n GLU 38 Cb 1.05 -1.72 -0.04 0.00 -0.57 0.00 0.00 31.44 30.16 2gw6 n GLU 38 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2gw6 n SER 39 N -2.89 1.55 0.16 1.62 2.88 0.74 -4.50 113.62 113.18 2gw6 n SER 39 Ca -0.17 0.26 0.13 0.00 -1.33 0.00 0.00 58.87 57.75 2gw6 n SER 39 Cb 0.98 -0.59 0.29 0.00 -0.75 0.00 0.00 64.21 64.14 2gw6 n SER 39 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2gw6 h LYS 40 N -0.68 0.00 -5.98 -1.46 1.63 -0.97 -3.49 116.57 105.62 2gw6 h LYS 40 Ca -0.19 0.00 -0.31 0.00 -0.85 0.00 0.00 60.65 59.30 2gw6 h LYS 40 Cb 0.97 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 32.61 2gw6 h LYS 40 CO -0.11 0.00 -1.05 0.45 -3.45 0.00 0.00 179.45 175.28 2gw6 n SER 41 N -2.68 -4.89 -4.94 4.20 2.88 0.24 -4.94 113.62 103.48 2gw6 n SER 41 Ca 0.05 -0.09 -0.24 0.00 -1.33 0.00 0.00 58.87 57.25 2gw6 n SER 41 Cb 0.48 -1.39 0.03 0.00 -0.75 0.00 0.00 64.21 62.58 2gw6 n SER 41 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 2gw6 s TRP 42 N -1.23 3.10 0.31 0.66 0.51 -0.46 -4.98 118.94 116.86 2gw6 s TRP 42 Ca 0.30 0.36 0.06 0.00 -2.12 0.00 0.00 56.10 54.71 2gw6 s TRP 42 Cb -0.03 -2.72 0.51 0.00 -0.81 0.00 0.00 33.47 30.42 2gw6 s TRP 42 CO 0.68 -0.83 1.74 1.25 -0.51 0.00 0.00 176.95 179.29 2gw6 h HIS 43 N -0.06 0.31 -1.97 -1.98 -0.00 -0.92 -3.46 115.15 107.08 2gw6 h HIS 43 Ca -0.45 -0.07 -0.04 0.00 -0.00 0.00 0.00 60.37 59.82 2gw6 h HIS 43 Cb 1.27 -0.07 -0.21 0.00 -0.00 0.00 0.00 27.41 28.40 2gw6 h HIS 43 CO 0.42 0.58 0.17 -2.00 -0.00 0.00 0.00 177.93 177.10 2gw6 s GLU 44 N -4.30 0.86 -0.03 5.26 2.56 -0.30 -4.95 118.70 117.79 2gw6 s GLU 44 Ca -0.05 0.81 0.00 0.00 0.00 0.00 0.00 54.97 55.73 2gw6 s GLU 44 Cb 0.14 0.42 0.03 0.00 2.00 0.00 0.00 34.13 36.71 2gw6 s GLU 44 CO 0.77 -0.15 0.00 0.08 -0.56 0.00 0.00 175.26 175.40 2gw6 s VAL 45 N 0.02 0.17 0.18 3.70 1.01 -1.26 -0.60 120.40 123.62 2gw6 s VAL 45 Ca -0.02 0.11 0.04 0.00 0.00 0.00 0.00 61.98 62.11 2gw6 s VAL 45 Cb -0.04 -0.28 -0.05 0.00 0.00 0.00 0.00 36.38 36.01 2gw6 s VAL 45 CO 0.02 0.15 -0.07 0.54 0.00 0.00 0.00 175.10 175.75 2gw6 s ASN 46 N 1.15 1.87 -0.08 3.32 2.20 -0.76 -4.96 114.94 117.68 2gw6 s ASN 46 Ca -0.08 -1.09 0.05 0.00 -0.94 0.00 0.00 52.86 50.80 2gw6 s ASN 46 Cb -0.13 -0.01 -0.00 0.00 -2.00 0.00 0.00 41.25 39.10 2gw6 s ASN 46 CO -0.02 -0.38 -0.23 0.00 -2.94 0.00 0.00 177.10 173.52 2gw6 s VAL 48 N 0.17 0.69 -0.13 0.00 1.01 -0.13 -5.00 120.40 117.00 2gw6 s VAL 48 Ca -0.13 -0.22 -0.06 0.00 0.00 0.00 0.00 61.98 61.57 2gw6 s VAL 48 Cb -0.16 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 2gw6 s VAL 48 CO 0.07 0.25 0.10 -0.83 0.00 0.00 0.00 175.10 174.69 2gw6 s GLY 49 N 0.78 2.05 -0.48 4.51 0.00 -1.26 -0.66 107.32 112.26 2gw6 s GLY 49 Ca -0.12 -0.69 0.03 0.00 0.00 0.00 0.00 44.72 43.94 2gw6 s GLY 49 CO 0.01 -0.29 0.22 1.08 0.00 0.00 0.00 173.10 174.12 2gw6 s LEU 50 N -0.62 4.60 0.49 0.66 2.01 0.11 -4.99 118.68 120.93 2gw6 s LEU 50 Ca 0.12 -2.71 0.16 0.00 0.01 0.00 0.00 54.13 51.72 2gw6 s LEU 50 Cb -0.12 -1.67 1.18 0.00 0.01 0.00 0.00 46.19 45.59 2gw6 s LEU 50 CO 0.02 -0.31 2.06 -0.65 1.01 0.00 0.00 176.35 178.49 2gw6 h PRO 51 N 6.95 0.18 -0.03 1.29 0.11 -1.94 -0.11 132.00 138.44 2gw6 h PRO 51 Ca -0.06 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 65.86 2gw6 h PRO 51 Cb 0.94 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 2gw6 h PRO 51 CO 0.65 0.12 -0.74 1.49 -0.21 0.00 0.00 178.00 179.30 2gw6 h GLU 52 N 0.18 0.19 -0.00 1.05 4.57 -1.94 -2.33 114.58 116.30 2gw6 h GLU 52 Ca 0.15 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 2gw6 h GLU 52 Cb 0.36 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.99 2gw6 h GLU 52 CO -0.02 0.85 -0.40 1.28 -1.18 0.00 0.00 179.01 179.53 2gw6 n LEU 53 N -3.75 0.58 -2.14 1.64 4.32 -0.85 -4.92 117.00 111.87 2gw6 n LEU 53 Ca -0.03 -0.03 -0.18 0.00 -0.02 0.00 0.00 56.01 55.76 2gw6 n LEU 53 Cb 0.71 -0.23 0.00 0.00 -1.62 0.00 0.00 43.42 42.28 2gw6 n LEU 53 CO 0.46 0.13 -0.16 1.67 -1.22 0.00 0.00 177.39 178.27 2gw6 n GLN 54 N -1.29 -2.19 -4.25 3.23 0.00 -0.11 -4.96 117.38 107.81 2gw6 n GLN 54 Ca 0.07 0.82 -0.14 0.00 -0.00 0.00 0.00 57.00 57.75 2gw6 n GLN 54 Cb 0.34 -5.30 -0.10 0.00 0.00 0.00 0.00 30.24 25.17 2gw6 n GLN 54 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.06 176.58 2gw6 s LEU 55 N -5.18 1.95 0.06 1.69 0.05 -0.85 -4.99 118.68 111.42 2gw6 s LEU 55 Ca 0.07 -1.23 0.09 0.00 0.05 0.00 0.00 54.13 53.12 2gw6 s LEU 55 Cb -0.03 0.00 -0.03 0.00 -2.05 0.00 0.00 46.19 44.08 2gw6 s LEU 55 CO 0.09 -0.62 -0.25 -0.63 -0.55 0.00 0.00 176.35 174.39 2gw6 s ILE 56 N -3.72 2.29 -0.05 1.48 1.09 -1.26 0.06 121.20 121.10 2gw6 s ILE 56 Ca 0.28 -1.43 -0.04 0.00 -1.10 0.00 0.00 60.65 58.35 2gw6 s ILE 56 Cb 0.07 -1.93 0.01 0.00 -1.06 0.00 0.00 42.46 39.54 2gw6 s ILE 56 CO 0.06 0.30 0.12 0.00 -0.10 0.00 0.00 174.94 175.33 2gw6 s LEU 58 N 0.07 3.59 -0.17 0.00 1.02 0.58 -0.96 118.68 122.81 2gw6 s LEU 58 Ca -0.00 -0.01 0.01 0.00 0.02 0.00 0.00 54.13 54.15 2gw6 s LEU 58 Cb -0.01 -1.89 0.02 0.00 0.02 0.00 0.00 46.19 44.33 2gw6 s LEU 58 CO 0.00 0.16 -0.19 -0.69 0.02 0.00 0.00 176.35 175.66 2gw6 s VAL 59 N 0.41 1.96 0.31 -1.59 1.01 -0.72 -0.15 120.40 121.63 2gw6 s VAL 59 Ca 0.00 -0.88 0.10 0.00 0.00 0.00 0.00 61.98 61.20 2gw6 s VAL 59 Cb -0.13 -1.78 -0.06 0.00 0.00 0.00 0.00 36.38 34.41 2gw6 s VAL 59 CO 0.01 0.52 -0.13 -0.83 0.00 0.00 0.00 175.10 174.67 2gw6 s GLY 60 N 1.33 2.01 -0.33 4.51 0.00 -1.21 -1.83 107.32 111.80 2gw6 s GLY 60 Ca 0.05 -1.98 -0.11 0.00 0.00 0.00 0.00 44.72 42.69 2gw6 s GLY 60 CO -0.12 -1.98 0.19 -0.51 0.00 0.00 0.00 173.10 170.67 2gw6 s THR 61 N -2.62 4.74 0.28 0.90 -4.23 0.23 -4.42 115.64 110.52 2gw6 s THR 61 Ca 0.31 -0.49 -0.01 0.00 -1.18 0.00 0.00 61.69 60.32 2gw6 s THR 61 Cb -0.00 -3.48 0.14 0.00 1.34 0.00 0.00 72.50 70.50 2gw6 s THR 61 CO 0.15 -0.03 1.81 1.05 -0.54 0.00 0.00 174.62 177.06 2gw6 h GLU 62 N 8.41 0.77 -3.54 3.99 4.11 -1.81 -0.64 114.58 125.87 2gw6 h GLU 62 Ca -0.30 -0.17 -0.35 0.00 0.07 0.00 0.00 59.36 58.60 2gw6 h GLU 62 Cb 1.14 -0.11 -0.36 0.00 0.50 0.00 0.00 28.75 29.92 2gw6 h GLU 62 CO 0.63 0.74 -0.74 0.42 0.07 0.00 0.00 179.01 180.13 2gw6 s ILE 63 N -5.10 0.05 -0.31 -1.06 1.09 -1.26 -2.21 121.20 112.40 2gw6 s ILE 63 Ca -0.09 0.23 -0.40 0.00 -1.10 0.00 0.00 60.65 59.29 2gw6 s ILE 63 Cb 0.15 -0.22 -0.15 0.00 -1.06 0.00 0.00 42.46 41.18 2gw6 s ILE 63 CO 0.80 0.16 1.83 -1.84 -0.10 0.00 0.00 174.94 175.78 2gw6 n GLU 64 N 4.64 1.07 0.00 2.79 0.28 -1.26 -0.71 120.64 127.46 2gw6 n GLU 64 Ca -0.17 0.38 0.00 0.00 -0.16 0.00 0.00 57.16 57.21 2gw6 n GLU 64 Cb 0.50 -2.11 0.00 0.00 1.43 0.00 0.00 31.44 31.26 2gw6 n GLU 64 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2gw6 n GLY 65 N 4.69 2.30 1.75 -1.84 0.00 -1.26 -4.85 105.19 105.98 2gw6 n GLY 65 Ca 0.30 -0.26 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 2gw6 n GLY 65 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2gw6 n GLU 66 N 0.00 2.90 -1.61 1.61 2.13 0.12 -4.89 120.64 120.90 2gw6 n GLU 66 Ca 0.00 -2.32 -0.15 0.00 0.66 0.00 0.00 57.16 55.35 2gw6 n GLU 66 Cb 0.00 -1.98 -0.09 0.00 0.27 0.00 0.00 31.44 29.64 2gw6 n GLU 66 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2gw6 s GLY 67 N -0.66 -0.90 -0.41 8.31 0.00 -1.23 -4.61 107.32 107.82 2gw6 s GLY 67 Ca 0.42 -1.10 0.07 0.00 0.00 0.00 0.00 44.72 44.11 2gw6 s GLY 67 CO 0.10 4.22 0.50 1.04 0.00 0.00 0.00 173.10 178.97 2gw6 n LEU 68 N 18.88 0.31 -3.42 0.66 4.77 -1.26 -5.00 117.00 131.94 2gw6 n LEU 68 Ca 0.45 -4.69 0.01 0.00 -0.03 0.00 0.00 56.01 51.75 2gw6 n LEU 68 Cb 0.45 0.52 -0.04 0.00 -2.33 0.00 0.00 43.42 42.03 2gw6 n LEU 68 CO 0.56 2.03 0.48 -1.10 -1.33 0.00 0.00 177.39 178.03 2gw6 s GLN 69 N -1.04 0.38 -0.28 3.23 -0.21 -1.26 -5.04 119.66 115.43 2gw6 s GLN 69 Ca 0.35 0.91 0.02 0.00 0.02 0.00 0.00 55.36 56.66 2gw6 s GLN 69 Cb 0.14 0.54 0.08 0.00 1.00 0.00 0.00 33.01 34.77 2gw6 s GLN 69 CO -0.12 -0.18 -0.02 0.99 -2.12 0.00 0.00 175.29 173.84 2gw6 s THR 70 N 2.65 1.91 -0.15 -0.19 2.01 -1.26 -3.31 115.64 117.30 2gw6 s THR 70 Ca -0.01 -1.73 -0.05 0.00 0.31 0.00 0.00 61.69 60.21 2gw6 s THR 70 Cb -0.09 -2.22 -0.03 0.00 0.01 0.00 0.00 72.50 70.17 2gw6 s THR 70 CO -0.18 -0.29 0.02 0.68 -0.69 0.00 0.00 174.62 174.16 2gw6 s VAL 71 N 1.17 4.42 -0.14 3.82 -7.23 0.78 -1.94 120.40 121.29 2gw6 s VAL 71 Ca -0.00 -0.18 0.01 0.00 -1.81 0.00 0.00 61.98 60.00 2gw6 s VAL 71 Cb -0.19 -2.94 0.02 0.00 0.56 0.00 0.00 36.38 33.83 2gw6 s VAL 71 CO -0.08 0.52 -0.14 0.54 -0.31 0.00 0.00 175.10 175.63 2gw6 s VAL 72 N -0.03 1.51 0.05 1.32 0.11 -0.90 -0.31 120.40 122.16 2gw6 s VAL 72 Ca 0.04 -0.61 -0.31 0.00 -2.93 0.00 0.00 61.98 58.17 2gw6 s VAL 72 Cb -0.13 -1.41 -0.10 0.00 -1.53 0.00 0.00 36.38 33.21 2gw6 s VAL 72 CO 0.02 0.45 1.88 -0.81 -3.33 0.00 0.00 175.10 173.31 2gw6 n PRO 73 N 4.64 2.68 -3.67 1.54 -0.04 -1.26 -2.03 135.00 136.86 2gw6 n PRO 73 Ca -0.17 0.98 -0.25 0.00 -0.04 0.00 0.00 63.50 64.01 2gw6 n PRO 73 Cb 0.50 -2.88 -0.17 0.00 -0.04 0.00 0.00 33.50 30.91 2gw6 n PRO 73 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2gw6 s THR 74 N 3.52 0.13 0.64 0.52 2.01 0.85 -4.92 115.64 118.39 2gw6 s THR 74 Ca 0.86 -0.16 -0.12 0.00 0.31 0.00 0.00 61.69 62.58 2gw6 s THR 74 Cb -0.51 -0.64 -0.02 0.00 0.01 0.00 0.00 72.50 71.34 2gw6 s THR 74 CO 0.42 -0.14 1.04 -2.16 -0.69 0.00 0.00 174.62 173.09 2gw6 s PRO 75 N 2.05 3.33 0.50 4.92 0.04 -1.26 -0.88 135.00 143.68 2gw6 s PRO 75 Ca 0.02 0.90 0.33 0.00 0.04 0.00 0.00 61.00 62.29 2gw6 s PRO 75 Cb -0.15 -2.04 1.75 0.00 0.04 0.00 0.00 34.50 34.09 2gw6 s PRO 75 CO -0.07 -0.79 2.02 0.82 0.04 0.00 0.00 177.00 179.02 2gw6 h ILE 76 N -0.30 0.00 0.00 0.56 1.08 -1.78 -2.31 117.51 114.76 2gw6 h ILE 76 Ca -0.44 -0.07 0.00 0.00 -0.39 0.00 0.00 64.86 63.95 2gw6 h ILE 76 Cb 1.20 0.86 0.00 0.00 -3.07 0.00 0.00 36.82 35.81 2gw6 h ILE 76 CO 0.59 0.00 -0.86 0.00 -0.69 0.00 0.00 178.15 177.20 2gw6 h THR 77 N 0.00 0.00 -2.72 -0.27 1.03 -1.92 -3.46 112.91 105.56 2gw6 h THR 77 Ca 0.00 -0.89 -0.46 0.00 -0.01 0.00 0.00 66.41 65.05 2gw6 h THR 77 Cb 0.08 1.44 0.12 0.00 -1.07 0.00 0.00 68.15 68.73 2gw6 h THR 77 CO 0.00 0.00 0.24 0.00 -0.01 0.00 0.00 175.52 175.75 2gw6 s ALA 78 N -3.31 3.10 0.06 0.00 0.00 -0.87 -5.10 121.76 115.65 2gw6 s ALA 78 Ca 0.01 -1.65 0.04 0.00 0.00 0.00 0.00 51.96 50.37 2gw6 s ALA 78 Cb 0.10 -2.26 -0.03 0.00 0.00 0.00 0.00 23.12 20.93 2gw6 s ALA 78 CO 0.77 -1.99 -0.11 -1.54 0.00 0.00 0.00 175.76 172.89 2gw6 s SER 79 N -4.87 1.33 0.33 0.00 1.04 -1.26 -4.91 113.70 105.37 2gw6 s SER 79 Ca 0.71 -0.60 0.08 0.00 0.48 0.00 0.00 55.95 56.63 2gw6 s SER 79 Cb -0.03 -0.01 -0.04 0.00 0.10 0.00 0.00 66.02 66.04 2gw6 s SER 79 CO 0.49 -0.14 0.17 -0.22 0.98 0.00 0.00 173.24 174.52 2gw6 s LEU 80 N -1.70 3.36 -0.06 2.42 1.98 -1.26 -5.02 118.68 118.39 2gw6 s LEU 80 Ca -0.05 -0.67 -0.31 0.00 -2.89 0.00 0.00 54.13 50.21 2gw6 s LEU 80 Cb -0.10 -1.88 0.11 0.00 0.66 0.00 0.00 46.19 44.99 2gw6 s LEU 80 CO 0.01 -0.28 1.04 -0.44 -1.89 0.00 0.00 176.35 174.80 2gw6 s SER 81 N -3.87 -0.24 0.52 3.68 0.01 -1.26 -4.90 113.70 107.65 2gw6 s SER 81 Ca 0.38 -0.04 0.31 0.00 1.31 0.00 0.00 55.95 57.90 2gw6 s SER 81 Cb -0.04 0.29 1.34 0.00 0.21 0.00 0.00 66.02 67.82 2gw6 s SER 81 CO 0.23 -0.48 1.99 1.12 0.41 0.00 0.00 173.24 176.52 2gw6 h HIS 82 N 2.00 0.00 0.09 2.43 2.07 -2.01 -0.27 115.15 119.47 2gw6 h HIS 82 Ca -0.18 0.00 -0.28 0.00 -2.85 0.00 0.00 60.37 57.06 2gw6 h HIS 82 Cb 1.21 0.00 0.02 0.00 2.57 0.00 0.00 27.41 31.21 2gw6 h HIS 82 CO 0.28 0.09 -1.18 -0.97 -3.07 0.00 0.00 177.93 173.08 2gw6 h ASN 83 N 0.00 0.71 -0.69 3.10 -1.24 -2.00 -3.25 115.58 112.22 2gw6 h ASN 83 Ca -0.00 -0.66 -0.06 0.00 0.71 0.00 0.00 56.30 56.30 2gw6 h ASN 83 Cb 0.51 -0.22 -0.03 0.00 0.73 0.00 0.00 38.32 39.30 2gw6 h ASN 83 CO 0.01 1.48 0.22 -0.09 -1.29 0.00 0.00 177.43 177.76 2gw6 h ARG 84 N 0.23 1.08 -0.20 6.67 1.12 -1.63 -1.26 114.38 120.39 2gw6 h ARG 84 Ca -0.15 -0.22 -0.10 0.00 -1.11 0.00 0.00 59.98 58.39 2gw6 h ARG 84 Cb 1.85 -0.16 -0.01 0.00 -0.01 0.00 0.00 29.97 31.64 2gw6 h ARG 84 CO 0.22 0.92 -0.31 -0.84 -3.11 0.00 0.00 179.97 176.85 2gw6 h ILE 85 N 1.04 1.28 -0.65 1.20 -2.65 -1.22 -1.57 117.51 114.95 2gw6 h ILE 85 Ca 0.23 -1.35 0.01 0.00 1.03 0.00 0.00 64.86 64.78 2gw6 h ILE 85 Cb 0.29 1.46 -0.03 0.00 -2.05 0.00 0.00 36.82 36.49 2gw6 h ILE 85 CO -0.01 0.42 0.43 -0.09 0.03 0.00 0.00 178.15 178.93 2gw6 h ARG 86 N 0.35 0.84 -0.23 0.16 1.12 -1.33 0.46 114.38 115.76 2gw6 h ARG 86 Ca 0.05 -0.05 -0.04 0.00 -1.11 0.00 0.00 59.98 58.83 2gw6 h ARG 86 Cb 0.72 -0.19 -0.01 0.00 -0.01 0.00 0.00 29.97 30.48 2gw6 h ARG 86 CO 0.06 0.56 -0.00 0.93 -3.11 0.00 0.00 179.97 178.40 2gw6 h GLU 87 N 0.87 0.41 0.62 0.20 4.39 -0.56 -1.61 114.58 118.89 2gw6 h GLU 87 Ca 0.24 -0.13 -0.02 0.00 0.34 0.00 0.00 59.36 59.78 2gw6 h GLU 87 Cb -0.09 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 2gw6 h GLU 87 CO -0.05 0.60 -0.43 0.82 -1.16 0.00 0.00 179.01 178.78 2gw6 h ILE 88 N 0.18 0.13 -0.84 3.13 2.04 -0.41 -2.52 117.51 119.21 2gw6 h ILE 88 Ca 0.06 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.10 2gw6 h ILE 88 Cb 0.41 0.13 -0.06 0.00 -0.74 0.00 0.00 36.82 36.56 2gw6 h ILE 88 CO 0.01 0.00 0.56 -0.07 0.00 0.00 0.00 178.15 178.65 2gw6 h LEU 89 N -1.01 0.44 -0.16 1.44 3.38 0.00 0.05 115.31 119.46 2gw6 h LEU 89 Ca -0.08 0.03 -0.23 0.00 0.09 0.00 0.00 57.88 57.70 2gw6 h LEU 89 Cb 0.83 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.54 2gw6 h LEU 89 CO 0.04 0.21 -0.87 0.50 0.09 0.00 0.00 178.44 178.41 2gw6 h LYS 90 N 0.46 0.64 0.91 1.13 3.11 -1.19 -2.77 116.57 118.86 2gw6 h LYS 90 Ca 0.43 -0.59 -0.04 0.00 -2.81 0.00 0.00 60.65 57.63 2gw6 h LYS 90 Cb 0.97 0.14 0.01 0.00 -1.00 0.00 0.00 32.23 32.35 2gw6 h LYS 90 CO -0.16 1.20 -0.44 0.00 -2.81 0.00 0.00 179.45 177.25 2gw6 h ALA 91 N 0.61 -1.22 0.00 5.00 0.00 -0.54 -2.53 119.26 120.58 2gw6 h ALA 91 Ca -0.07 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2gw6 h ALA 91 Cb 1.49 0.47 0.00 0.00 0.00 0.00 0.00 17.79 19.76 2gw6 h ALA 91 CO 0.17 -1.15 -0.31 0.66 0.00 0.00 0.00 179.25 178.61 2gw6 h SER 92 N -1.29 0.00 -0.17 0.00 4.64 -1.64 -2.50 113.55 112.59 2gw6 h SER 92 Ca -0.12 -0.06 -0.12 0.00 -0.47 0.00 0.00 61.79 61.01 2gw6 h SER 92 Cb 0.94 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 2gw6 h SER 92 CO 0.21 0.03 -0.30 -0.09 -0.87 0.00 0.00 176.83 175.81 2gw6 h ARG 93 N 0.00 0.66 -0.72 4.77 9.65 -1.51 -0.02 114.38 127.21 2gw6 h ARG 93 Ca 0.00 -0.29 -0.05 0.00 -1.10 0.00 0.00 59.98 58.53 2gw6 h ARG 93 Cb 0.83 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 29.36 2gw6 h ARG 93 CO 0.00 0.88 0.24 -0.22 2.80 0.00 0.00 179.97 183.67 2gw6 h LYS 94 N 0.57 1.11 -0.73 0.20 3.64 -0.97 0.35 116.57 120.74 2gw6 h LYS 94 Ca 0.07 -0.23 -0.04 0.00 -1.27 0.00 0.00 60.65 59.17 2gw6 h LYS 94 Cb 0.80 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.42 2gw6 h LYS 94 CO 0.07 0.94 0.29 1.25 -2.27 0.00 0.00 179.45 179.72 2gw6 h LEU 95 N 1.05 1.01 -0.21 5.20 5.85 -0.95 -1.76 115.31 125.50 2gw6 h LEU 95 Ca 0.23 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2gw6 h LEU 95 Cb 0.29 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.06 2gw6 h LEU 95 CO -0.01 0.91 -0.06 0.00 -0.34 0.00 0.00 178.44 178.94 2gw6 n GLN 96 N -4.34 0.79 -0.42 1.25 3.00 -0.08 -4.94 117.38 112.64 2gw6 n GLN 96 Ca 0.06 -0.21 0.00 0.00 -0.01 0.00 0.00 57.00 56.84 2gw6 n GLN 96 Cb 0.18 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 28.93 2gw6 n GLN 96 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2gw6 n GLY 97 N 1.22 0.97 2.99 1.08 0.00 -0.03 -5.07 105.19 106.36 2gw6 n GLY 97 Ca 0.17 -0.11 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 2gw6 n GLY 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gw6 s ASP 98 N -2.14 0.08 0.21 1.61 1.01 0.10 -4.97 116.67 112.57 2gw6 s ASP 98 Ca 0.00 -0.20 -0.04 0.00 0.71 0.00 0.00 52.55 53.02 2gw6 s ASP 98 Cb 0.00 0.13 0.17 0.00 1.01 0.00 0.00 42.92 44.23 2gw6 s ASP 98 CO 0.00 -0.21 1.59 1.55 0.21 0.00 0.00 175.17 178.30 2gw6 h PRO 99 N 5.08 0.68 0.00 8.23 0.13 -1.93 -2.36 132.00 141.84 2gw6 h PRO 99 Ca -0.29 -0.33 -0.06 0.00 -0.87 0.00 0.00 66.00 64.46 2gw6 h PRO 99 Cb 1.20 -0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.27 2gw6 h PRO 99 CO 0.43 0.93 -0.13 -3.47 -0.23 0.00 0.00 178.00 175.53 2gw6 n ASP 100 N -4.06 -0.45 -4.71 1.44 2.03 -1.26 -4.74 116.55 104.80 2gw6 n ASP 100 Ca -0.01 -0.92 -0.38 0.00 0.52 0.00 0.00 54.79 54.00 2gw6 n ASP 100 Cb 0.50 0.14 -0.06 0.00 -0.72 0.00 0.00 41.12 40.97 2gw6 n ASP 100 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2gw6 s LEU 101 N 0.00 4.24 0.14 -2.67 2.96 -1.26 -4.92 118.68 117.16 2gw6 s LEU 101 Ca 0.00 0.73 -0.31 0.00 -0.22 0.00 0.00 54.13 54.33 2gw6 s LEU 101 Cb 0.00 -2.65 -0.11 0.00 0.50 0.00 0.00 46.19 43.93 2gw6 s LEU 101 CO 0.00 -0.03 1.82 -2.65 -1.32 0.00 0.00 176.35 174.16 2gw6 n PRO 102 N 3.96 2.80 -0.94 0.98 -0.02 -1.26 -4.86 135.00 135.65 2gw6 n PRO 102 Ca -0.07 1.01 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 2gw6 n PRO 102 Cb 0.51 -2.90 0.00 0.00 -0.02 0.00 0.00 33.50 31.09 2gw6 n PRO 102 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 2gw6 n MET 103 N 5.29 2.12 -5.08 -0.52 1.56 -1.26 -4.93 117.12 114.31 2gw6 n MET 103 Ca 0.18 0.00 -0.32 0.00 -0.27 0.00 0.00 57.70 57.29 2gw6 n MET 103 Cb 0.37 0.00 -0.15 0.00 2.15 0.00 0.00 33.22 35.59 2gw6 n MET 103 CO 0.00 0.00 0.00 -1.54 -0.73 0.00 0.00 175.97 173.70 2gw6 s SER 104 N -0.70 3.55 -0.04 6.12 1.04 -1.26 -3.70 113.70 118.71 2gw6 s SER 104 Ca 0.00 -0.35 -0.15 0.00 0.48 0.00 0.00 55.95 55.93 2gw6 s SER 104 Cb 0.00 -0.78 0.03 0.00 0.10 0.00 0.00 66.02 65.37 2gw6 s SER 104 CO 0.00 0.30 0.33 0.72 0.98 0.00 0.00 173.24 175.57 2gw6 s PHE 105 N -0.47 -0.25 -0.21 5.02 -0.71 -1.21 -4.45 117.98 115.69 2gw6 s PHE 105 Ca 0.06 0.46 -0.09 0.00 -1.04 0.00 0.00 56.93 56.31 2gw6 s PHE 105 Cb -0.12 0.12 -0.05 0.00 -1.21 0.00 0.00 43.02 41.76 2gw6 s PHE 105 CO 0.01 -0.35 0.12 0.99 -1.34 0.00 0.00 175.22 174.65 2gw6 s THR 106 N -0.97 5.14 -0.05 -4.49 2.01 -0.82 -2.71 115.64 113.76 2gw6 s THR 106 Ca -0.10 0.10 -0.28 0.00 0.31 0.00 0.00 61.69 61.71 2gw6 s THR 106 Cb -0.04 -3.36 -0.03 0.00 0.01 0.00 0.00 72.50 69.08 2gw6 s THR 106 CO 0.04 0.41 0.91 -0.76 -0.69 0.00 0.00 174.62 174.52 2gw6 s LEU 107 N 0.68 4.32 -0.53 4.42 1.43 -0.14 -2.11 118.68 126.75 2gw6 s LEU 107 Ca 0.06 1.49 -0.15 0.00 -1.03 0.00 0.00 54.13 54.50 2gw6 s LEU 107 Cb -0.13 -3.43 0.13 0.00 0.03 0.00 0.00 46.19 42.80 2gw6 s LEU 107 CO 0.01 -0.27 0.47 0.00 0.23 0.00 0.00 176.35 176.80 2gw6 s ALA 108 N 1.21 3.60 -0.33 4.21 0.00 -0.86 -1.18 121.76 128.41 2gw6 s ALA 108 Ca 0.47 -2.55 -0.20 0.00 0.00 0.00 0.00 51.96 49.68 2gw6 s ALA 108 Cb -0.19 -3.18 -0.00 0.00 0.00 0.00 0.00 23.12 19.74 2gw6 s ALA 108 CO 0.23 -2.00 0.61 0.42 0.00 0.00 0.00 175.76 175.02 2gw6 s ILE 109 N 1.54 4.94 -0.04 0.00 1.01 0.85 -0.11 121.20 129.39 2gw6 s ILE 109 Ca 0.04 0.65 0.06 0.00 0.00 0.00 0.00 60.65 61.40 2gw6 s ILE 109 Cb -0.29 -4.02 -0.02 0.00 0.01 0.00 0.00 42.46 38.14 2gw6 s ILE 109 CO 0.02 -0.22 -0.22 0.68 0.00 0.00 0.00 174.94 175.20 2gw6 s VAL 110 N 2.60 2.33 0.38 2.92 -7.23 -0.06 0.43 120.40 121.77 2gw6 s VAL 110 Ca 0.23 -0.99 -0.24 0.00 -1.81 0.00 0.00 61.98 59.17 2gw6 s VAL 110 Cb -0.15 -1.85 -0.10 0.00 0.56 0.00 0.00 36.38 34.85 2gw6 s VAL 110 CO 0.13 0.58 1.00 -0.70 -0.31 0.00 0.00 175.10 175.80 2gw6 s GLU 111 N -0.47 4.31 0.00 4.82 2.12 0.81 -2.02 118.70 128.26 2gw6 s GLU 111 Ca 0.06 1.38 0.09 0.00 0.36 0.00 0.00 54.97 56.86 2gw6 s GLU 111 Cb -0.11 -2.55 0.40 0.00 0.26 0.00 0.00 34.13 32.12 2gw6 s GLU 111 CO 0.01 0.01 1.30 0.43 -0.54 0.00 0.00 175.26 176.47 2gw6 n SER 112 N 0.02 0.00 -0.06 -1.70 7.64 -1.26 -3.17 113.62 115.09 2gw6 n SER 112 Ca 0.04 0.50 -0.03 0.00 1.01 0.00 0.00 58.87 60.39 2gw6 n SER 112 Cb 0.51 -0.50 -0.01 0.00 -1.01 0.00 0.00 64.21 63.20 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 1.82 -2.04 -3.49 116.42 119.14 2gw6 h ASP 113 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2gw6 h ASP 113 Cb 0.16 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.17 2gw6 h ASP 113 CO 0.00 0.61 0.00 -1.20 -1.61 0.00 0.00 179.24 177.04 2gw6 n SER 114 N -4.50 0.00 -4.64 2.28 7.64 -1.19 -5.12 113.62 108.08 2gw6 n SER 114 Ca -0.04 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.41 2gw6 n SER 114 Cb 0.15 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.33 2gw6 n SER 114 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2gw6 s THR 115 N -0.20 3.55 -0.21 0.44 2.01 -1.26 -4.85 115.64 115.13 2gw6 s THR 115 Ca 0.00 0.64 -0.04 0.00 0.31 0.00 0.00 61.69 62.60 2gw6 s THR 115 Cb 0.00 -3.50 -0.01 0.00 0.01 0.00 0.00 72.50 69.00 2gw6 s THR 115 CO 0.00 -0.15 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.11 2gw6 s ILE 116 N 4.89 3.50 -0.21 1.82 1.01 -1.26 -0.14 121.20 130.81 2gw6 s ILE 116 Ca 0.76 -0.46 0.02 0.00 0.00 0.00 0.00 60.65 60.96 2gw6 s ILE 116 Cb -0.30 -2.58 0.03 0.00 0.01 0.00 0.00 42.46 39.62 2gw6 s ILE 116 CO 0.31 0.43 -0.17 -0.69 0.00 0.00 0.00 174.94 174.82 2gw6 s VAL 117 N 1.25 2.11 -0.06 2.92 1.01 0.17 -4.94 120.40 122.86 2gw6 s VAL 117 Ca 0.03 -1.20 -0.24 0.00 0.00 0.00 0.00 61.98 60.57 2gw6 s VAL 117 Cb -0.14 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 2gw6 s VAL 117 CO -0.01 0.33 0.74 -0.31 0.00 0.00 0.00 175.10 175.85 2gw6 s TYR 118 N 1.22 3.59 -0.02 5.22 1.51 -1.26 -0.10 117.35 127.50 2gw6 s TYR 118 Ca -0.00 1.31 0.01 0.00 -1.01 0.00 0.00 57.07 57.38 2gw6 s TYR 118 Cb -0.16 -2.85 0.01 0.00 -0.11 0.00 0.00 41.96 38.85 2gw6 s TYR 118 CO -0.10 0.07 -0.05 -0.47 -1.11 0.00 0.00 175.55 173.89 2gw6 s TYR 119 N 0.85 0.61 -0.06 2.71 5.04 -0.33 -4.99 117.35 121.19 2gw6 s TYR 119 Ca 0.40 -0.13 -0.22 0.00 -2.44 0.00 0.00 57.07 54.67 2gw6 s TYR 119 Cb -0.18 -0.48 -0.04 0.00 0.35 0.00 0.00 41.96 41.60 2gw6 s TYR 119 CO 0.19 -0.09 0.63 0.21 -1.34 0.00 0.00 175.55 175.15 2gw6 s LYS 120 N 0.36 4.39 -0.06 4.97 2.20 -1.26 -0.97 119.74 129.37 2gw6 s LYS 120 Ca -0.04 0.75 0.04 0.00 -0.36 0.00 0.00 55.97 56.36 2gw6 s LYS 120 Cb -0.08 -3.42 -0.00 0.00 -1.51 0.00 0.00 37.83 32.82 2gw6 s LYS 120 CO -0.00 0.17 -0.20 -1.17 -0.36 0.00 0.00 175.35 173.78 2gw6 s LEU 121 N 0.49 1.96 0.02 5.43 0.20 -1.10 -4.98 118.68 120.70 2gw6 s LEU 121 Ca 0.33 -0.44 0.04 0.00 0.69 0.00 0.00 54.13 54.75 2gw6 s LEU 121 Cb -0.17 -1.16 -0.04 0.00 -0.43 0.00 0.00 46.19 44.39 2gw6 s LEU 121 CO 0.16 0.16 -0.06 -0.89 -0.29 0.00 0.00 176.35 175.44 2gw6 s THR 122 N 0.15 3.70 -2.00 3.68 2.01 -1.26 -3.35 115.64 118.56 2gw6 s THR 122 Ca -0.09 -0.83 0.18 0.00 0.31 0.00 0.00 61.69 61.26 2gw6 s THR 122 Cb -0.14 -2.64 0.51 0.00 0.01 0.00 0.00 72.50 70.23 2gw6 s THR 122 CO 0.04 0.34 1.46 -0.90 -0.69 0.00 0.00 174.62 174.87