#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gw6 s GLU 2 N 0.00 3.95 0.00 4.33 -1.05 -1.26 -4.38 118.70 120.29 2gw6 s GLU 2 Ca 0.00 -2.17 0.00 0.00 -0.15 0.00 0.00 54.97 52.65 2gw6 s GLU 2 Cb 0.00 -5.21 0.00 0.00 -0.44 0.00 0.00 34.13 28.48 2gw6 s GLU 2 CO 0.00 -1.95 0.00 -3.47 0.95 0.00 0.00 175.26 170.79 2gw6 n ASP 3 N 6.85 0.00 -0.83 0.83 2.03 -1.26 -4.83 116.55 119.34 2gw6 n ASP 3 Ca 0.38 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.69 2gw6 n ASP 3 Cb 0.45 -0.28 0.00 0.00 -0.72 0.00 0.00 41.12 40.58 2gw6 n ASP 3 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2gw6 n ALA 4 N 0.36 2.03 0.04 -1.67 0.00 -1.26 -1.52 120.51 118.48 2gw6 n ALA 4 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 2gw6 n ALA 4 Cb 0.00 -1.00 -0.13 0.00 0.00 0.00 0.00 19.45 18.32 2gw6 n ALA 4 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 2gw6 h TRP 5 N 0.67 0.04 0.00 0.00 6.55 -1.88 -3.44 115.95 117.89 2gw6 h TRP 5 Ca 0.00 -0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.81 2gw6 h TRP 5 Cb 0.49 -0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.79 2gw6 h TRP 5 CO 0.00 1.03 0.00 -1.33 -1.05 0.00 0.00 178.44 177.09 2gw6 n MET 6 N -3.26 0.00 0.00 0.49 2.81 -0.95 -5.09 117.12 111.12 2gw6 n MET 6 Ca -0.07 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 2gw6 n MET 6 Cb 0.98 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.49 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 0.32 0.63 0.37 3.03 0.00 -0.58 -5.04 105.19 103.93 2gw6 n GLY 7 Ca 0.00 -0.82 0.03 0.00 0.00 0.00 0.00 46.02 45.24 2gw6 n GLY 7 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2gw6 n THR 8 N 0.00 0.92 -1.73 2.61 -1.04 -1.26 -4.14 114.28 109.63 2gw6 n THR 8 Ca 0.00 -0.96 -0.42 0.00 -2.04 0.00 0.00 64.05 60.63 2gw6 n THR 8 Cb 0.00 0.55 -0.02 0.00 -1.82 0.00 0.00 70.33 69.04 2gw6 n THR 8 CO 0.00 0.00 0.00 1.57 -0.64 0.00 0.00 175.07 176.00 2gw6 n HIS 9 N 0.13 2.78 -0.39 -1.42 -0.00 -1.26 -4.69 115.22 110.37 2gw6 n HIS 9 Ca 0.07 0.21 0.32 0.00 0.46 0.00 0.00 57.72 58.77 2gw6 n HIS 9 Cb 0.34 -2.61 0.59 0.00 -0.12 0.00 0.00 29.99 28.19 2gw6 n HIS 9 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2gw6 h PRO 10 N 5.32 0.15 0.20 1.57 0.11 -1.98 0.20 132.00 137.56 2gw6 h PRO 10 Ca -0.46 -0.01 -0.26 0.00 0.11 0.00 0.00 66.00 65.38 2gw6 h PRO 10 Cb 1.22 -0.03 0.03 0.00 0.11 0.00 0.00 31.00 32.33 2gw6 h PRO 10 CO 0.84 0.10 -1.14 -0.22 -0.21 0.00 0.00 178.00 177.37 2gw6 h LYS 11 N 0.16 0.41 0.55 1.05 1.63 -1.98 -1.36 116.57 117.04 2gw6 h LYS 11 Ca 0.78 -0.71 -0.02 0.00 -0.85 0.00 0.00 60.65 59.85 2gw6 h LYS 11 Cb 2.22 0.26 0.00 0.00 -0.60 0.00 0.00 32.23 34.11 2gw6 h LYS 11 CO -0.49 1.34 -0.30 -0.92 -3.45 0.00 0.00 179.45 175.62 2gw6 h TYR 12 N -0.13 -0.78 -0.53 1.91 5.03 -1.06 -0.16 116.97 121.24 2gw6 h TYR 12 Ca -0.20 -0.01 0.08 0.00 2.58 0.00 0.00 58.73 61.18 2gw6 h TYR 12 Cb 1.89 0.27 -0.07 0.00 1.55 0.00 0.00 36.73 40.37 2gw6 h TYR 12 CO 0.17 -0.47 0.16 1.25 -1.32 0.00 0.00 178.16 177.94 2gw6 h LEU 13 N -0.79 0.11 -1.35 2.82 5.85 -1.06 0.05 115.31 120.94 2gw6 h LEU 13 Ca -0.07 0.08 0.13 0.00 0.84 0.00 0.00 57.88 58.86 2gw6 h LEU 13 Cb 0.63 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.68 2gw6 h LEU 13 CO 0.10 0.08 0.55 -0.08 -0.34 0.00 0.00 178.44 178.75 2gw6 h GLU 14 N 0.32 0.64 -0.01 1.25 4.81 -0.95 0.95 114.58 121.59 2gw6 h GLU 14 Ca 0.27 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 59.28 2gw6 h GLU 14 Cb 0.33 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 2gw6 h GLU 14 CO -0.30 0.42 -0.79 1.98 -0.73 0.00 0.00 179.01 179.60 2gw6 h MET 15 N 0.66 0.15 -0.23 1.92 4.05 0.74 -2.92 114.93 119.31 2gw6 h MET 15 Ca 0.41 -0.15 -0.17 0.00 -0.28 0.00 0.00 59.70 59.52 2gw6 h MET 15 Cb 0.67 0.04 -0.00 0.00 -0.80 0.00 0.00 31.60 31.50 2gw6 h MET 15 CO -0.17 0.86 -0.53 0.52 0.23 0.00 0.00 176.91 177.82 2gw6 h MET 16 N 0.09 0.67 0.00 0.39 2.86 0.71 -2.94 114.93 116.71 2gw6 h MET 16 Ca -0.03 -0.41 0.00 0.00 -2.06 0.00 0.00 59.70 57.20 2gw6 h MET 16 Cb 1.38 0.04 0.00 0.00 0.06 0.00 0.00 31.60 33.08 2gw6 h MET 16 CO 0.12 1.03 0.00 0.39 1.06 0.00 0.00 176.91 179.50 2gw6 n GLU 17 N -3.98 0.20 -0.74 1.72 1.02 0.13 -4.20 120.64 114.80 2gw6 n GLU 17 Ca -0.03 0.13 -0.33 0.00 -0.02 0.00 0.00 57.16 56.91 2gw6 n GLU 17 Cb 0.60 -1.50 0.14 0.00 -0.02 0.00 0.00 31.44 30.66 2gw6 n GLU 17 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2gw6 n LEU 18 N -1.19 -1.45 -0.56 -4.62 4.77 -1.11 -4.80 117.00 108.04 2gw6 n LEU 18 Ca 0.06 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2gw6 n LEU 18 Cb 0.06 -1.06 0.00 0.00 -2.33 0.00 0.00 43.42 40.09 2gw6 n LEU 18 CO 0.07 -3.40 0.09 0.47 -1.33 0.00 0.00 177.39 173.29 2gw6 n ASP 19 N -1.32 0.40 0.17 -1.43 8.00 -1.26 -3.45 116.55 117.65 2gw6 n ASP 19 Ca 0.03 -0.65 0.00 0.00 0.71 0.00 0.00 54.79 54.88 2gw6 n ASP 19 Cb 0.58 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 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 0.39 0.00 -2.41 0.53 -0.00 -1.26 -4.66 119.36 111.95 2gw6 n ILE 20 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 62.75 62.74 2gw6 n ILE 20 Cb 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.73 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 -1.48 -3.54 3.69 3.28 0.00 -1.22 -5.01 105.19 100.91 2gw6 n GLY 21 Ca 0.00 0.37 -0.35 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.35 5.95 0.29 1.61 -1.08 -1.26 -4.99 116.67 115.84 2gw6 s ASP 22 Ca 0.03 0.17 -0.01 0.00 -0.52 0.00 0.00 52.55 52.22 2gw6 s ASP 22 Cb -0.01 -2.03 0.43 0.00 -1.46 0.00 0.00 42.92 39.86 2gw6 s ASP 22 CO 0.58 0.18 1.85 0.00 0.52 0.00 0.00 175.17 178.30 2gw6 h ALA 23 N 6.65 1.26 -0.09 3.66 0.00 -1.99 0.27 119.26 129.02 2gw6 h ALA 23 Ca -0.39 -0.18 -0.21 0.00 0.00 0.00 0.00 54.91 54.12 2gw6 h ALA 23 Cb 1.16 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2gw6 h ALA 23 CO 0.73 0.52 -0.79 1.15 0.00 0.00 0.00 179.25 180.86 2gw6 h THR 24 N 0.80 1.33 0.08 0.00 2.02 -2.00 -2.60 112.91 112.55 2gw6 h THR 24 Ca 0.18 -2.11 -0.00 0.00 0.77 0.00 0.00 66.41 65.25 2gw6 h THR 24 Cb 0.24 2.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.76 2gw6 h THR 24 CO -0.01 0.65 -0.04 -0.61 0.37 0.00 0.00 175.52 175.89 2gw6 h GLN 25 N 0.39 -0.10 -0.71 6.66 -0.00 -1.79 -2.40 115.11 117.16 2gw6 h GLN 25 Ca -0.05 0.01 0.11 0.00 -0.00 0.00 0.00 58.65 58.71 2gw6 h GLN 25 Cb 1.40 0.02 -0.05 0.00 0.00 0.00 0.00 27.48 28.86 2gw6 h GLN 25 CO 0.15 0.20 0.47 -0.39 0.00 0.00 0.00 178.83 179.27 2gw6 h VAL 26 N -0.40 0.90 0.15 2.39 -1.51 -0.50 0.45 116.25 117.72 2gw6 h VAL 26 Ca -0.01 -0.19 -0.01 0.00 -1.23 0.00 0.00 66.70 65.27 2gw6 h VAL 26 Cb 0.35 0.30 0.00 0.00 -2.13 0.00 0.00 31.29 29.81 2gw6 h VAL 26 CO 0.02 0.10 -0.07 0.22 -1.23 0.00 0.00 177.57 176.61 2gw6 h TYR 27 N 0.55 -0.18 -0.28 5.19 3.20 -1.31 -1.22 116.97 122.91 2gw6 h TYR 27 Ca 0.33 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.15 2gw6 h TYR 27 Cb 0.57 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 2gw6 h TYR 27 CO -0.00 -0.04 -0.03 0.28 -1.64 0.00 0.00 178.16 176.73 2gw6 h VAL 28 N -0.29 1.27 -0.94 1.81 2.07 -0.60 -2.58 116.25 116.99 2gw6 h VAL 28 Ca -0.02 -1.00 0.01 0.00 0.82 0.00 0.00 66.70 66.51 2gw6 h VAL 28 Cb 0.23 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 2gw6 h VAL 28 CO 0.03 0.32 0.62 0.00 0.02 0.00 0.00 177.57 178.56 2gw6 h ALA 29 N 0.80 1.35 -0.42 1.67 0.00 -0.21 -1.62 119.26 120.83 2gw6 h ALA 29 Ca 0.07 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.98 2gw6 h ALA 29 Cb 0.48 -0.37 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 2gw6 h ALA 29 CO 0.02 0.60 0.14 0.35 0.00 0.00 0.00 179.25 180.36 2gw6 h PHE 30 N 1.25 0.24 -0.27 0.00 3.57 -0.96 0.16 116.94 120.93 2gw6 h PHE 30 Ca 0.35 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.87 2gw6 h PHE 30 Cb -0.12 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.56 2gw6 h PHE 30 CO -0.00 0.08 0.17 -0.07 -2.23 0.00 0.00 178.31 176.26 2gw6 h LEU 31 N 0.30 0.31 -0.19 0.59 -0.00 -0.94 -1.86 115.31 113.53 2gw6 h LEU 31 Ca 0.20 -0.03 -0.16 0.00 -0.00 0.00 0.00 57.88 57.89 2gw6 h LEU 31 Cb 0.20 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 40.78 2gw6 h LEU 31 CO -0.21 0.24 -0.51 -0.37 -0.00 0.00 0.00 178.44 177.60 2gw6 h VAL 32 N 0.35 1.32 -0.45 1.22 -1.51 -1.15 -2.27 116.25 113.76 2gw6 h VAL 32 Ca 0.10 -1.74 0.09 0.00 -1.23 0.00 0.00 66.70 63.92 2gw6 h VAL 32 Cb -0.02 1.92 -0.09 0.00 -2.13 0.00 0.00 31.29 30.97 2gw6 h VAL 32 CO -0.02 0.54 -0.18 0.22 -1.23 0.00 0.00 177.57 176.91 2gw6 h TYR 33 N 0.36 -0.43 -0.22 5.19 3.20 -0.60 0.16 116.97 124.62 2gw6 h TYR 33 Ca -0.01 0.05 -0.05 0.00 3.14 0.00 0.00 58.73 61.86 2gw6 h TYR 33 Cb 1.12 0.26 -0.01 0.00 1.54 0.00 0.00 36.73 39.64 2gw6 h TYR 33 CO 0.09 -0.26 -0.07 -0.07 -1.64 0.00 0.00 178.16 176.21 2gw6 h LEU 34 N -0.08 0.32 0.00 2.82 4.07 -1.33 -1.50 115.31 119.61 2gw6 h LEU 34 Ca 0.22 -0.06 -0.00 0.00 0.08 0.00 0.00 57.88 58.12 2gw6 h LEU 34 Cb 0.42 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.07 2gw6 h LEU 34 CO -0.51 0.43 -0.00 -0.78 -1.08 0.00 0.00 178.44 176.50 2gw6 h ASP 35 N 0.33 -0.00 -0.41 -0.43 1.82 -0.54 -0.69 116.42 116.50 2gw6 h ASP 35 Ca 0.07 -0.51 0.08 0.00 -0.39 0.00 0.00 57.03 56.29 2gw6 h ASP 35 Cb 0.33 0.00 -0.08 0.00 0.68 0.00 0.00 39.33 40.26 2gw6 h ASP 35 CO 0.02 0.51 -0.11 -0.07 -1.61 0.00 0.00 179.24 177.97 2gw6 h LEU 36 N -0.51 -0.42 0.08 2.28 3.38 -0.67 0.31 115.31 119.76 2gw6 h LEU 36 Ca -0.00 0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2gw6 h LEU 36 Cb 0.51 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.53 2gw6 h LEU 36 CO 0.00 -0.15 -0.04 -0.03 0.09 0.00 0.00 178.44 178.31 2gw6 h MET 37 N -0.02 -0.11 0.00 1.13 4.05 -1.16 0.15 114.93 118.97 2gw6 h MET 37 Ca 0.20 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.62 2gw6 h MET 37 Cb 0.32 0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.14 2gw6 h MET 37 CO -0.43 0.25 -1.08 -0.85 0.23 0.00 0.00 176.91 175.04 2gw6 n GLU 38 N -4.97 0.34 -0.02 0.39 0.28 -0.28 -3.37 120.64 113.01 2gw6 n GLU 38 Ca -0.08 -0.00 -0.06 0.00 -0.16 0.00 0.00 57.16 56.85 2gw6 n GLU 38 Cb 0.22 -1.61 -0.02 0.00 1.43 0.00 0.00 31.44 31.45 2gw6 n GLU 38 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2gw6 n SER 39 N -2.04 1.27 0.10 -1.84 2.88 0.96 -4.56 113.62 110.39 2gw6 n SER 39 Ca 0.01 0.20 0.12 0.00 -1.33 0.00 0.00 58.87 57.87 2gw6 n SER 39 Cb 0.45 -0.46 0.46 0.00 -0.75 0.00 0.00 64.21 63.91 2gw6 n SER 39 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2gw6 n LYS 40 N -3.79 0.18 -3.40 -1.46 4.76 -0.44 -4.92 118.16 109.09 2gw6 n LYS 40 Ca -0.11 0.34 -0.19 0.00 -2.87 0.00 0.00 58.31 55.47 2gw6 n LYS 40 Cb 0.36 -1.80 0.07 0.00 -1.84 0.00 0.00 35.03 31.82 2gw6 n LYS 40 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2gw6 n SER 41 N -2.12 -4.70 -4.70 4.39 7.64 0.30 -4.94 113.62 109.47 2gw6 n SER 41 Ca 0.03 -0.50 -0.42 0.00 1.01 0.00 0.00 58.87 58.99 2gw6 n SER 41 Cb 0.27 -4.52 -0.03 0.00 -1.01 0.00 0.00 64.21 58.92 2gw6 n SER 41 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 2gw6 s TRP 42 N -3.29 2.82 0.33 1.43 0.52 0.03 -4.88 118.94 115.91 2gw6 s TRP 42 Ca 0.36 0.60 0.05 0.00 0.02 0.00 0.00 56.10 57.13 2gw6 s TRP 42 Cb -0.16 -3.85 0.60 0.00 -1.15 0.00 0.00 33.47 28.90 2gw6 s TRP 42 CO 0.64 -3.24 1.85 1.25 0.02 0.00 0.00 176.95 177.48 2gw6 h HIS 43 N 7.53 0.49 -2.15 -1.98 -0.00 -0.86 -3.44 115.15 114.74 2gw6 h HIS 43 Ca -0.42 -0.06 0.01 0.00 -0.00 0.00 0.00 60.37 59.90 2gw6 h HIS 43 Cb 1.20 -0.14 -0.22 0.00 -0.00 0.00 0.00 27.41 28.25 2gw6 h HIS 43 CO 0.72 0.54 -0.13 -2.00 -0.00 0.00 0.00 177.93 177.05 2gw6 s GLU 44 N -4.83 0.57 -0.10 5.26 2.56 -0.07 -4.97 118.70 117.12 2gw6 s GLU 44 Ca -0.07 1.24 0.00 0.00 0.00 0.00 0.00 54.97 56.14 2gw6 s GLU 44 Cb 0.15 0.43 0.02 0.00 2.00 0.00 0.00 34.13 36.73 2gw6 s GLU 44 CO 0.76 -0.18 -0.08 0.08 -0.56 0.00 0.00 175.26 175.28 2gw6 s VAL 45 N 2.23 1.03 0.22 3.70 1.01 -1.26 -1.51 120.40 125.81 2gw6 s VAL 45 Ca -0.07 -0.31 0.11 0.00 0.00 0.00 0.00 61.98 61.71 2gw6 s VAL 45 Cb -0.09 -1.03 -0.05 0.00 0.00 0.00 0.00 36.38 35.22 2gw6 s VAL 45 CO -0.18 0.36 -0.20 0.20 0.00 0.00 0.00 175.10 175.28 2gw6 s ASN 46 N 1.50 3.62 -0.04 3.32 0.01 -0.86 -4.97 114.94 117.51 2gw6 s ASN 46 Ca 0.01 -0.87 0.04 0.00 -0.71 0.00 0.00 52.86 51.33 2gw6 s ASN 46 Cb -0.13 -0.34 -0.00 0.00 0.41 0.00 0.00 41.25 41.18 2gw6 s ASN 46 CO -0.06 0.09 -0.17 0.00 -1.51 0.00 0.00 177.10 175.46 2gw6 s VAL 48 N 0.08 0.55 -0.21 0.00 1.01 -0.43 -4.98 120.40 116.41 2gw6 s VAL 48 Ca -0.05 -0.24 -0.06 0.00 0.00 0.00 0.00 61.98 61.64 2gw6 s VAL 48 Cb -0.12 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 2gw6 s VAL 48 CO 0.02 0.18 0.02 -0.83 0.00 0.00 0.00 175.10 174.49 2gw6 s GLY 49 N 0.18 1.74 -0.45 4.51 0.00 -1.26 -1.15 107.32 110.89 2gw6 s GLY 49 Ca -0.02 -1.02 -0.07 0.00 0.00 0.00 0.00 44.72 43.61 2gw6 s GLY 49 CO -0.00 0.31 0.30 1.08 0.00 0.00 0.00 173.10 174.79 2gw6 s LEU 50 N 1.14 5.53 0.49 0.66 1.02 0.14 -4.63 118.68 123.04 2gw6 s LEU 50 Ca 0.03 -1.93 0.15 0.00 0.02 0.00 0.00 54.13 52.41 2gw6 s LEU 50 Cb -0.14 -1.95 1.18 0.00 0.02 0.00 0.00 46.19 45.29 2gw6 s LEU 50 CO 0.02 -0.64 2.09 -0.65 0.02 0.00 0.00 176.35 177.19 2gw6 h PRO 51 N 8.33 0.16 -0.37 1.29 0.11 -1.83 0.27 132.00 139.95 2gw6 h PRO 51 Ca -0.19 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 65.79 2gw6 h PRO 51 Cb 1.07 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 2gw6 h PRO 51 CO 0.81 0.10 -0.23 0.93 -0.21 0.00 0.00 178.00 179.40 2gw6 h GLU 52 N 0.16 0.82 -0.01 1.05 3.07 -1.94 -2.72 114.58 115.00 2gw6 h GLU 52 Ca 0.10 -0.38 0.00 0.00 -0.50 0.00 0.00 59.36 58.58 2gw6 h GLU 52 Cb 0.20 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 2gw6 h GLU 52 CO -0.02 1.01 -0.45 1.28 -1.40 0.00 0.00 179.01 179.43 2gw6 n LEU 53 N -4.23 1.25 -1.24 1.33 4.32 -1.09 -4.94 117.00 112.41 2gw6 n LEU 53 Ca -0.02 -0.40 -0.16 0.00 -0.02 0.00 0.00 56.01 55.41 2gw6 n LEU 53 Cb 0.45 -0.09 -0.07 0.00 -1.62 0.00 0.00 43.42 42.09 2gw6 n LEU 53 CO 0.45 0.25 -0.15 1.67 -1.22 0.00 0.00 177.39 178.38 2gw6 n GLN 54 N -0.69 -1.11 -4.33 3.23 -0.06 0.87 -4.96 117.38 110.31 2gw6 n GLN 54 Ca 0.09 1.06 -0.25 0.00 -2.00 0.00 0.00 57.00 55.90 2gw6 n GLN 54 Cb 0.38 -5.24 -0.09 0.00 -4.06 0.00 0.00 30.24 21.23 2gw6 n GLN 54 CO 0.00 0.00 0.00 -0.48 -0.20 0.00 0.00 177.06 176.38 2gw6 s LEU 55 N -3.65 2.96 0.08 1.69 0.05 -0.75 -4.93 118.68 114.12 2gw6 s LEU 55 Ca 0.00 -0.70 0.09 0.00 0.05 0.00 0.00 54.13 53.56 2gw6 s LEU 55 Cb 0.00 -1.55 -0.04 0.00 -2.05 0.00 0.00 46.19 42.55 2gw6 s LEU 55 CO 0.00 0.05 -0.21 -0.63 -0.55 0.00 0.00 176.35 175.01 2gw6 s ILE 56 N -2.10 2.59 -0.11 1.48 -1.09 -1.26 0.28 121.20 120.99 2gw6 s ILE 56 Ca 0.28 -1.42 -0.08 0.00 -2.23 0.00 0.00 60.65 57.20 2gw6 s ILE 56 Cb -0.07 -2.12 0.04 0.00 -1.58 0.00 0.00 42.46 38.73 2gw6 s ILE 56 CO 0.17 0.23 0.28 0.00 -1.23 0.00 0.00 174.94 174.39 2gw6 s LEU 58 N 0.56 4.05 -0.04 0.00 1.02 0.15 -1.31 118.68 123.10 2gw6 s LEU 58 Ca -0.03 0.12 0.02 0.00 0.02 0.00 0.00 54.13 54.26 2gw6 s LEU 58 Cb -0.05 -2.22 0.01 0.00 0.02 0.00 0.00 46.19 43.95 2gw6 s LEU 58 CO -0.03 -0.07 -0.09 -0.69 0.02 0.00 0.00 176.35 175.49 2gw6 s VAL 59 N 1.71 0.80 0.00 -1.59 1.01 -0.68 -0.47 120.40 121.18 2gw6 s VAL 59 Ca 0.10 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.74 2gw6 s VAL 59 Cb -0.15 -0.74 0.00 0.00 0.00 0.00 0.00 36.38 35.49 2gw6 s VAL 59 CO 0.10 0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.07 2gw6 n GLY 60 N 3.54 1.97 3.18 4.51 0.00 -1.21 -2.03 105.19 115.15 2gw6 n GLY 60 Ca -0.21 -0.28 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.74 3.06 0.28 2.61 -4.23 -0.57 -4.32 115.64 111.73 2gw6 s THR 61 Ca 0.00 -1.38 -0.04 0.00 -1.18 0.00 0.00 61.69 59.09 2gw6 s THR 61 Cb 0.00 -2.77 0.25 0.00 1.34 0.00 0.00 72.50 71.32 2gw6 s THR 61 CO 0.00 -0.13 1.94 -0.08 -0.54 0.00 0.00 174.62 175.81 2gw6 h GLU 62 N 8.02 1.17 -4.17 3.99 4.81 -1.94 -0.07 114.58 126.38 2gw6 h GLU 62 Ca -0.21 -0.08 -0.43 0.00 -0.13 0.00 0.00 59.36 58.51 2gw6 h GLU 62 Cb 1.06 -0.26 -0.34 0.00 0.63 0.00 0.00 28.75 29.85 2gw6 h GLU 62 CO 0.54 0.79 -0.78 0.42 -0.73 0.00 0.00 179.01 179.25 2gw6 s ILE 63 N -5.95 0.68 0.63 2.32 -1.09 -1.26 -1.40 121.20 115.13 2gw6 s ILE 63 Ca -0.12 -0.22 -0.19 0.00 -2.23 0.00 0.00 60.65 57.90 2gw6 s ILE 63 Cb 0.18 -0.67 -0.02 0.00 -1.58 0.00 0.00 42.46 40.37 2gw6 s ILE 63 CO 0.80 0.25 1.29 -1.83 -1.23 0.00 0.00 174.94 174.23 2gw6 s GLU 64 N 0.79 2.67 0.00 2.79 -1.05 -1.26 -2.39 118.70 120.24 2gw6 s GLU 64 Ca -0.12 2.06 0.00 0.00 -0.15 0.00 0.00 54.97 56.76 2gw6 s GLU 64 Cb -0.14 -1.90 0.00 0.00 -0.44 0.00 0.00 34.13 31.64 2gw6 s GLU 64 CO 0.01 -1.51 0.00 0.41 0.95 0.00 0.00 175.26 175.12 2gw6 n GLY 65 N 0.84 2.89 0.00 -3.83 0.00 -1.26 -4.99 105.19 98.84 2gw6 n GLY 65 Ca 0.15 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 1.23 0.00 1.61 -0.58 -1.01 -5.06 120.64 116.83 2gw6 n GLU 66 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2gw6 n GLU 66 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 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 -0.15 2.58 0.62 0.00 -1.26 -4.90 105.19 107.07 2gw6 n GLY 67 Ca 0.00 0.05 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 2gw6 n GLY 67 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2gw6 s LEU 68 N 0.00 0.20 -0.30 0.99 1.98 -1.26 -5.05 118.68 115.24 2gw6 s LEU 68 Ca 0.00 -2.37 -0.08 0.00 -2.89 0.00 0.00 54.13 48.79 2gw6 s LEU 68 Cb 0.00 0.51 0.15 0.00 0.66 0.00 0.00 46.19 47.51 2gw6 s LEU 68 CO 0.00 -0.15 0.67 -1.10 -1.89 0.00 0.00 176.35 173.88 2gw6 s GLN 69 N 0.57 0.55 -0.15 1.98 -1.52 -1.26 -5.00 119.66 114.82 2gw6 s GLN 69 Ca 0.29 1.25 -0.00 0.00 -1.95 0.00 0.00 55.36 54.95 2gw6 s GLN 69 Cb -0.01 0.74 0.03 0.00 -0.22 0.00 0.00 33.01 33.55 2gw6 s GLN 69 CO -0.12 -0.31 -0.09 0.99 -0.25 0.00 0.00 175.29 175.51 2gw6 s THR 70 N 2.86 1.28 -0.06 -0.19 2.01 -1.26 -3.29 115.64 116.98 2gw6 s THR 70 Ca 0.02 -0.61 0.06 0.00 0.31 0.00 0.00 61.69 61.47 2gw6 s THR 70 Cb -0.12 -1.34 -0.01 0.00 0.01 0.00 0.00 72.50 71.04 2gw6 s THR 70 CO -0.19 0.27 -0.25 0.68 -0.69 0.00 0.00 174.62 174.44 2gw6 s VAL 71 N 1.58 2.03 -0.07 3.82 -7.23 0.38 -0.91 120.40 120.00 2gw6 s VAL 71 Ca 0.02 -1.05 0.02 0.00 -1.81 0.00 0.00 61.98 59.17 2gw6 s VAL 71 Cb -0.14 -1.73 0.01 0.00 0.56 0.00 0.00 36.38 35.09 2gw6 s VAL 71 CO -0.09 0.56 -0.12 0.54 -0.31 0.00 0.00 175.10 175.69 2gw6 s VAL 72 N -0.09 1.14 0.24 1.32 0.11 -0.86 -0.68 120.40 121.58 2gw6 s VAL 72 Ca -0.06 -0.47 -0.31 0.00 -2.93 0.00 0.00 61.98 58.21 2gw6 s VAL 72 Cb -0.14 -1.05 -0.11 0.00 -1.53 0.00 0.00 36.38 33.55 2gw6 s VAL 72 CO 0.04 0.36 1.57 -2.16 -3.33 0.00 0.00 175.10 171.58 2gw6 s PRO 73 N 0.74 4.18 -0.13 1.54 0.04 -1.26 -1.96 135.00 138.16 2gw6 s PRO 73 Ca -0.13 2.46 -0.04 0.00 0.04 0.00 0.00 61.00 63.33 2gw6 s PRO 73 Cb -0.16 -3.09 0.06 0.00 0.04 0.00 0.00 34.50 31.36 2gw6 s PRO 73 CO 0.03 -0.59 0.15 0.99 0.04 0.00 0.00 177.00 177.61 2gw6 s THR 74 N 0.48 -0.23 0.67 1.26 2.01 0.13 -4.88 115.64 115.08 2gw6 s THR 74 Ca 0.66 0.14 -0.12 0.00 0.31 0.00 0.00 61.69 62.68 2gw6 s THR 74 Cb -0.46 -0.43 -0.00 0.00 0.01 0.00 0.00 72.50 71.62 2gw6 s THR 74 CO 0.40 -0.03 1.06 -2.16 -0.69 0.00 0.00 174.62 173.20 2gw6 s PRO 75 N 2.26 3.06 0.27 4.92 0.04 -1.26 -0.76 135.00 143.52 2gw6 s PRO 75 Ca 0.04 0.98 0.15 0.00 0.04 0.00 0.00 61.00 62.22 2gw6 s PRO 75 Cb -0.14 -2.00 0.83 0.00 0.04 0.00 0.00 34.50 33.23 2gw6 s PRO 75 CO -0.08 -1.01 1.42 -0.89 0.04 0.00 0.00 177.00 176.48 2gw6 n ILE 76 N -2.90 0.98 0.84 0.56 2.08 -0.88 -1.43 119.36 118.61 2gw6 n ILE 76 Ca 0.08 0.70 0.10 0.00 0.56 0.00 0.00 62.75 64.19 2gw6 n ILE 76 Cb 0.53 -1.70 0.06 0.00 -0.75 0.00 0.00 39.64 37.78 2gw6 n ILE 76 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 2gw6 n THR 77 N -2.05 0.00 -4.03 1.39 -2.24 -1.26 -4.95 114.28 101.13 2gw6 n THR 77 Ca -0.01 -0.44 -0.26 0.00 -2.27 0.00 0.00 64.05 61.07 2gw6 n THR 77 Cb 0.14 1.36 -0.05 0.00 -2.10 0.00 0.00 70.33 69.69 2gw6 n THR 77 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gw6 s ALA 78 N -1.83 3.72 -0.05 6.98 0.00 -0.52 -5.09 121.76 124.98 2gw6 s ALA 78 Ca 0.21 -1.15 -0.02 0.00 0.00 0.00 0.00 51.96 51.00 2gw6 s ALA 78 Cb 0.16 -1.52 -0.04 0.00 0.00 0.00 0.00 23.12 21.73 2gw6 s ALA 78 CO 0.32 0.51 0.07 -1.54 0.00 0.00 0.00 175.76 175.12 2gw6 s SER 79 N -3.18 5.71 0.48 0.00 1.04 -1.26 -4.82 113.70 111.66 2gw6 s SER 79 Ca 0.32 0.21 0.07 0.00 0.48 0.00 0.00 55.95 57.03 2gw6 s SER 79 Cb -0.10 -1.68 0.03 0.00 0.10 0.00 0.00 66.02 64.37 2gw6 s SER 79 CO 0.25 0.32 0.66 -0.22 0.98 0.00 0.00 173.24 175.24 2gw6 s LEU 80 N -1.40 3.47 -0.10 2.42 1.98 -1.26 -4.97 118.68 118.83 2gw6 s LEU 80 Ca 0.19 -0.43 -0.33 0.00 -2.89 0.00 0.00 54.13 50.67 2gw6 s LEU 80 Cb -0.12 -2.48 0.13 0.00 0.66 0.00 0.00 46.19 44.39 2gw6 s LEU 80 CO 0.09 -0.97 1.27 -0.94 -1.89 0.00 0.00 176.35 173.91 2gw6 s SER 81 N -4.44 -0.08 0.41 3.68 1.04 -1.26 -4.83 113.70 108.22 2gw6 s SER 81 Ca 0.57 -0.07 0.29 0.00 0.48 0.00 0.00 55.95 57.21 2gw6 s SER 81 Cb -0.09 0.14 1.19 0.00 0.10 0.00 0.00 66.02 67.36 2gw6 s SER 81 CO 0.35 -0.25 1.85 1.12 0.98 0.00 0.00 173.24 177.30 2gw6 h HIS 82 N 2.00 0.00 0.01 5.02 2.07 -2.00 -2.21 115.15 120.04 2gw6 h HIS 82 Ca -0.21 0.00 -0.22 0.00 -2.85 0.00 0.00 60.37 57.09 2gw6 h HIS 82 Cb 1.18 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.16 2gw6 h HIS 82 CO 0.31 0.00 -0.94 -0.97 -3.07 0.00 0.00 177.93 173.25 2gw6 h ASN 83 N 0.00 0.43 -0.24 3.10 -1.24 -1.99 -3.13 115.58 112.51 2gw6 h ASN 83 Ca 0.00 -0.36 0.06 0.00 0.71 0.00 0.00 56.30 56.71 2gw6 h ASN 83 Cb 0.43 -0.13 -0.07 0.00 0.73 0.00 0.00 38.32 39.28 2gw6 h ASN 83 CO 0.00 1.16 -0.20 -0.09 -1.29 0.00 0.00 177.43 177.01 2gw6 h ARG 84 N 0.18 -0.19 -0.64 6.67 1.12 -1.72 -0.37 114.38 119.43 2gw6 h ARG 84 Ca -0.07 0.01 -0.05 0.00 -1.11 0.00 0.00 59.98 58.76 2gw6 h ARG 84 Cb 1.58 0.04 -0.03 0.00 -0.01 0.00 0.00 29.97 31.56 2gw6 h ARG 84 CO 0.16 -0.13 0.21 -0.84 -3.11 0.00 0.00 179.97 176.25 2gw6 h ILE 85 N -0.20 1.24 -0.77 1.20 3.07 -1.62 -0.24 117.51 120.18 2gw6 h ILE 85 Ca 0.14 -0.81 -0.01 0.00 1.55 0.00 0.00 64.86 65.73 2gw6 h ILE 85 Cb 0.41 0.53 -0.04 0.00 -0.27 0.00 0.00 36.82 37.45 2gw6 h ILE 85 CO -0.36 0.31 0.44 -0.09 -1.05 0.00 0.00 178.15 177.41 2gw6 h ARG 86 N 0.94 1.06 -0.03 0.16 1.12 -1.12 0.69 114.38 117.19 2gw6 h ARG 86 Ca 0.21 -0.11 -0.06 0.00 -1.11 0.00 0.00 59.98 58.92 2gw6 h ARG 86 Cb 0.26 -0.22 0.00 0.00 -0.01 0.00 0.00 29.97 30.00 2gw6 h ARG 86 CO -0.01 0.76 -0.20 0.93 -3.11 0.00 0.00 179.97 178.34 2gw6 h GLU 87 N 1.07 0.20 -0.21 0.20 4.39 -0.67 -2.65 114.58 116.91 2gw6 h GLU 87 Ca 0.27 -0.17 -0.12 0.00 0.34 0.00 0.00 59.36 59.69 2gw6 h GLU 87 Cb -0.00 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2gw6 h GLU 87 CO -0.05 0.83 -0.39 0.82 -1.16 0.00 0.00 179.01 179.06 2gw6 h ILE 88 N -0.38 1.30 -0.45 3.13 2.04 -0.61 0.15 117.51 122.69 2gw6 h ILE 88 Ca -0.02 -1.54 0.05 0.00 1.00 0.00 0.00 64.86 64.36 2gw6 h ILE 88 Cb 0.87 1.57 -0.05 0.00 -0.74 0.00 0.00 36.82 38.48 2gw6 h ILE 88 CO 0.04 0.48 0.18 -0.07 0.00 0.00 0.00 178.15 178.78 2gw6 h LEU 89 N 0.39 0.22 -0.60 1.44 3.38 0.30 0.32 115.31 120.77 2gw6 h LEU 89 Ca 0.04 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.07 2gw6 h LEU 89 Cb 0.86 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.59 2gw6 h LEU 89 CO 0.07 0.16 0.38 0.50 0.09 0.00 0.00 178.44 179.65 2gw6 h LYS 90 N 0.37 0.74 0.12 1.13 3.64 -1.00 0.18 116.57 121.75 2gw6 h LYS 90 Ca 0.21 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.55 2gw6 h LYS 90 Cb 0.17 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2gw6 h LYS 90 CO -0.19 0.49 -0.15 0.00 -2.27 0.00 0.00 179.45 177.34 2gw6 h ALA 91 N 1.25 -0.27 -0.85 5.00 0.00 -0.42 -2.12 119.26 121.84 2gw6 h ALA 91 Ca 0.23 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 2gw6 h ALA 91 Cb -0.02 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 2gw6 h ALA 91 CO -0.08 -0.67 0.43 0.77 0.00 0.00 0.00 179.25 179.69 2gw6 h SER 92 N -0.31 1.09 -0.14 0.00 0.02 0.17 -0.31 113.55 114.08 2gw6 h SER 92 Ca 0.01 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.81 2gw6 h SER 92 Cb 0.30 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 2gw6 h SER 92 CO -0.06 0.91 0.03 0.03 -1.14 0.00 0.00 176.83 176.60 2gw6 h ARG 93 N 1.20 0.32 0.10 3.45 2.47 -0.39 0.53 114.38 122.06 2gw6 h ARG 93 Ca 0.29 -0.05 -0.27 0.00 -1.26 0.00 0.00 59.98 58.70 2gw6 h ARG 93 Cb 0.09 -0.06 0.03 0.00 -1.65 0.00 0.00 29.97 28.38 2gw6 h ARG 93 CO -0.04 0.33 -1.11 -0.22 0.56 0.00 0.00 179.97 179.49 2gw6 h LYS 94 N 0.32 0.57 0.00 0.04 3.64 -0.85 -0.53 116.57 119.76 2gw6 h LYS 94 Ca 0.08 -0.75 -0.04 0.00 -1.27 0.00 0.00 60.65 58.67 2gw6 h LYS 94 Cb 0.18 0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 2gw6 h LYS 94 CO 0.00 1.33 -0.66 1.37 -2.27 0.00 0.00 179.45 179.22 2gw6 h LEU 95 N 0.16 0.00 0.00 5.20 8.10 -0.36 -3.36 115.31 125.05 2gw6 h LEU 95 Ca -0.17 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.81 2gw6 h LEU 95 Cb 1.80 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 42.02 2gw6 h LEU 95 CO 0.21 0.15 -1.73 0.00 -4.11 0.00 0.00 178.44 172.97 2gw6 n GLN 96 N -2.92 0.51 -2.73 0.17 6.02 0.18 -5.08 117.38 113.53 2gw6 n GLN 96 Ca 0.00 -0.14 -0.04 0.00 -0.01 0.00 0.00 57.00 56.81 2gw6 n GLN 96 Cb 0.61 -1.37 -0.03 0.00 1.02 0.00 0.00 30.24 30.46 2gw6 n GLN 96 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2gw6 n GLY 97 N 1.62 -3.99 3.38 1.08 0.00 -0.21 -5.04 105.19 102.04 2gw6 n GLY 97 Ca -0.04 1.28 -0.25 0.00 0.00 0.00 0.00 46.02 47.01 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 -0.66 3.08 0.00 1.61 1.01 -1.25 -5.00 116.67 115.45 2gw6 s ASP 98 Ca -0.20 -0.83 0.00 0.00 0.71 0.00 0.00 52.55 52.23 2gw6 s ASP 98 Cb 0.01 -0.21 0.00 0.00 1.01 0.00 0.00 42.92 43.74 2gw6 s ASP 98 CO 0.62 0.07 1.56 -2.65 0.21 0.00 0.00 175.17 174.98 2gw6 n PRO 99 N 0.42 0.84 -1.59 8.23 -0.02 -1.26 -4.73 135.00 136.89 2gw6 n PRO 99 Ca -0.14 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.19 2gw6 n PRO 99 Cb 0.56 -1.08 -0.06 0.00 -0.02 0.00 0.00 33.50 32.90 2gw6 n PRO 99 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2gw6 n ASP 100 N 1.44 -4.10 -4.78 2.55 2.03 -1.26 -4.95 116.55 107.49 2gw6 n ASP 100 Ca 0.00 0.34 -0.35 0.00 0.52 0.00 0.00 54.79 55.30 2gw6 n ASP 100 Cb 0.42 -3.70 -0.01 0.00 -0.72 0.00 0.00 41.12 37.11 2gw6 n ASP 100 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 2gw6 s LEU 101 N -4.28 3.77 -0.20 -2.67 0.05 -1.26 -4.90 118.68 109.18 2gw6 s LEU 101 Ca 0.00 2.10 -0.28 0.00 0.05 0.00 0.00 54.13 56.00 2gw6 s LEU 101 Cb 0.00 -4.57 -0.05 0.00 -2.05 0.00 0.00 46.19 39.51 2gw6 s LEU 101 CO 0.00 -1.11 2.15 -2.84 -0.55 0.00 0.00 176.35 174.00 2gw6 s PRO 102 N -3.29 3.27 0.00 1.48 0.02 -1.26 -4.92 135.00 130.29 2gw6 s PRO 102 Ca 0.71 2.03 0.00 0.00 0.02 0.00 0.00 61.00 63.76 2gw6 s PRO 102 Cb -0.22 -4.33 0.00 0.00 0.02 0.00 0.00 34.50 29.97 2gw6 s PRO 102 CO 0.25 -1.95 0.00 -0.12 -0.33 0.00 0.00 177.00 174.85 2gw6 n MET 103 N 8.58 1.08 -3.10 5.54 1.56 -1.26 -5.16 117.12 124.36 2gw6 n MET 103 Ca 0.28 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.71 2gw6 n MET 103 Cb 0.45 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.82 2gw6 n MET 103 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 2gw6 n SER 104 N -1.57 0.00 -3.47 6.12 3.41 -1.26 -4.60 113.62 112.24 2gw6 n SER 104 Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.47 2gw6 n SER 104 Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 2gw6 n SER 104 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2gw6 s PHE 105 N -2.76 -0.54 -0.15 7.33 -0.71 -1.24 -4.64 117.98 115.27 2gw6 s PHE 105 Ca 0.00 0.54 -0.11 0.00 -1.04 0.00 0.00 56.93 56.32 2gw6 s PHE 105 Cb 0.00 0.48 -0.05 0.00 -1.21 0.00 0.00 43.02 42.25 2gw6 s PHE 105 CO 0.00 -0.76 0.21 0.99 -1.34 0.00 0.00 175.22 174.32 2gw6 s THR 106 N -2.93 5.36 -0.02 -4.49 2.01 -0.08 -2.70 115.64 112.79 2gw6 s THR 106 Ca -0.03 0.37 -0.23 0.00 0.31 0.00 0.00 61.69 62.12 2gw6 s THR 106 Cb -0.01 -3.53 -0.05 0.00 0.01 0.00 0.00 72.50 68.93 2gw6 s THR 106 CO -0.06 0.47 0.67 -0.76 -0.69 0.00 0.00 174.62 174.25 2gw6 s LEU 107 N -0.00 4.38 -0.45 4.42 1.43 -0.35 -2.02 118.68 126.08 2gw6 s LEU 107 Ca 0.14 1.22 -0.08 0.00 -1.03 0.00 0.00 54.13 54.38 2gw6 s LEU 107 Cb -0.12 -3.04 0.11 0.00 0.03 0.00 0.00 46.19 43.17 2gw6 s LEU 107 CO 0.03 -0.01 0.30 0.00 0.23 0.00 0.00 176.35 176.90 2gw6 s ALA 108 N 0.26 3.32 -0.07 4.21 0.00 -0.83 -1.19 121.76 127.47 2gw6 s ALA 108 Ca 0.35 -2.47 -0.24 0.00 0.00 0.00 0.00 51.96 49.60 2gw6 s ALA 108 Cb -0.18 -2.70 -0.03 0.00 0.00 0.00 0.00 23.12 20.20 2gw6 s ALA 108 CO 0.18 -1.84 0.75 0.42 0.00 0.00 0.00 175.76 175.28 2gw6 s ILE 109 N 1.32 5.01 -0.08 0.00 1.01 0.82 0.19 121.20 129.47 2gw6 s ILE 109 Ca 0.06 1.54 0.03 0.00 0.00 0.00 0.00 60.65 62.28 2gw6 s ILE 109 Cb -0.25 -4.09 0.01 0.00 0.01 0.00 0.00 42.46 38.14 2gw6 s ILE 109 CO -0.01 0.22 -0.17 0.54 0.00 0.00 0.00 174.94 175.52 2gw6 s VAL 110 N 0.94 1.50 0.40 2.92 0.11 0.06 -0.16 120.40 126.17 2gw6 s VAL 110 Ca 0.39 -0.70 0.01 0.00 -2.93 0.00 0.00 61.98 58.76 2gw6 s VAL 110 Cb -0.18 -1.32 -0.02 0.00 -1.53 0.00 0.00 36.38 33.33 2gw6 s VAL 110 CO 0.19 0.43 0.60 -0.70 -3.33 0.00 0.00 175.10 172.29 2gw6 s GLU 111 N 0.48 3.23 0.00 1.54 2.12 -1.04 -2.07 118.70 122.96 2gw6 s GLU 111 Ca -0.15 -0.49 0.00 0.00 0.36 0.00 0.00 54.97 54.69 2gw6 s GLU 111 Cb -0.16 -2.63 0.00 0.00 0.26 0.00 0.00 34.13 31.60 2gw6 s GLU 111 CO 0.05 -0.07 0.25 0.43 -0.54 0.00 0.00 175.26 175.39 2gw6 n SER 112 N -1.91 0.26 -0.01 -1.70 7.64 -1.26 -3.38 113.62 113.25 2gw6 n SER 112 Ca -0.01 -0.76 -0.05 0.00 1.01 0.00 0.00 58.87 59.06 2gw6 n SER 112 Cb 0.57 -0.13 -0.02 0.00 -1.01 0.00 0.00 64.21 63.63 2gw6 n SER 112 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2gw6 n ASP 113 N 0.05 1.31 0.00 6.43 8.00 -1.26 -5.04 116.55 126.04 2gw6 n ASP 113 Ca 0.00 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.70 2gw6 n ASP 113 Cb 0.06 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 40.70 2gw6 n ASP 113 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2gw6 n SER 114 N -3.80 0.00 -4.72 -2.24 2.88 -1.22 -5.15 113.62 99.38 2gw6 n SER 114 Ca -0.08 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.09 2gw6 n SER 114 Cb 0.29 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.67 2gw6 n SER 114 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2gw6 s THR 115 N 0.00 5.32 -0.19 2.46 -1.32 -1.26 -5.00 115.64 115.65 2gw6 s THR 115 Ca 0.00 0.46 -0.03 0.00 -1.21 0.00 0.00 61.69 60.91 2gw6 s THR 115 Cb 0.00 -3.60 -0.01 0.00 -1.51 0.00 0.00 72.50 67.38 2gw6 s THR 115 CO 0.00 0.38 -0.05 -0.63 -2.21 0.00 0.00 174.62 172.11 2gw6 s ILE 116 N 0.59 3.49 -0.19 5.08 1.09 -1.26 -2.49 121.20 127.51 2gw6 s ILE 116 Ca 0.14 -0.47 0.01 0.00 -1.10 0.00 0.00 60.65 59.23 2gw6 s ILE 116 Cb -0.13 -2.56 0.03 0.00 -1.06 0.00 0.00 42.46 38.74 2gw6 s ILE 116 CO 0.03 0.45 -0.18 -0.69 -0.10 0.00 0.00 174.94 174.45 2gw6 s VAL 117 N 1.05 2.04 -0.05 2.92 1.01 0.78 -4.91 120.40 123.24 2gw6 s VAL 117 Ca 0.01 -1.04 -0.23 0.00 0.00 0.00 0.00 61.98 60.72 2gw6 s VAL 117 Cb -0.15 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 2gw6 s VAL 117 CO 0.00 0.43 0.68 -0.31 0.00 0.00 0.00 175.10 175.90 2gw6 s TYR 118 N 1.27 3.60 -0.04 5.22 1.51 -1.26 -0.13 117.35 127.53 2gw6 s TYR 118 Ca 0.03 1.24 0.02 0.00 -1.01 0.00 0.00 57.07 57.34 2gw6 s TYR 118 Cb -0.14 -2.76 0.02 0.00 -0.11 0.00 0.00 41.96 38.96 2gw6 s TYR 118 CO -0.11 0.15 -0.06 -0.47 -1.11 0.00 0.00 175.55 173.94 2gw6 s TYR 119 N 0.57 0.87 -0.18 2.71 5.04 -0.33 -4.99 117.35 121.04 2gw6 s TYR 119 Ca 0.36 -0.25 -0.26 0.00 -2.44 0.00 0.00 57.07 54.47 2gw6 s TYR 119 Cb -0.18 -0.71 -0.01 0.00 0.35 0.00 0.00 41.96 41.41 2gw6 s TYR 119 CO 0.18 -0.18 0.88 0.21 -1.34 0.00 0.00 175.55 175.30 2gw6 s LYS 120 N 0.70 4.29 -0.21 4.97 2.36 -1.26 -1.21 119.74 129.38 2gw6 s LYS 120 Ca -0.10 1.10 -0.04 0.00 -2.55 0.00 0.00 55.97 54.37 2gw6 s LYS 120 Cb -0.13 -3.59 -0.01 0.00 -1.05 0.00 0.00 37.83 33.04 2gw6 s LYS 120 CO 0.01 -0.40 -0.03 -1.17 1.55 0.00 0.00 175.35 175.31 2gw6 s LEU 121 N 2.40 3.02 0.17 5.43 2.96 -1.10 -4.98 118.68 126.57 2gw6 s LEU 121 Ca 0.40 -0.32 0.06 0.00 -0.22 0.00 0.00 54.13 54.05 2gw6 s LEU 121 Cb -0.16 -1.76 -0.05 0.00 0.50 0.00 0.00 46.19 44.72 2gw6 s LEU 121 CO 0.11 0.02 -0.12 -0.89 -1.32 0.00 0.00 176.35 174.16 2gw6 s THR 122 N 1.23 1.36 -2.76 3.68 2.01 -1.26 -3.62 115.64 116.28 2gw6 s THR 122 Ca 0.03 -2.11 0.26 0.00 0.31 0.00 0.00 61.69 60.17 2gw6 s THR 122 Cb -0.14 -1.92 0.36 0.00 0.01 0.00 0.00 72.50 70.81 2gw6 s THR 122 CO -0.01 -0.69 1.49 -0.67 -0.69 0.00 0.00 174.62 174.06