#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gb3 n HIS 0 N 0.00 0.00 -4.35 -1.40 8.25 -1.26 -5.29 115.22 111.18 2gb3 n HIS 0 Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.14 2gb3 n HIS 0 Cb 0.00 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 30.95 2gb3 n HIS 0 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2gb3 s ASP 2 N 0.24 3.02 -0.55 0.41 1.01 -1.26 -5.25 116.67 114.30 2gb3 s ASP 2 Ca 0.00 -0.60 -0.12 0.00 0.71 0.00 0.00 52.55 52.54 2gb3 s ASP 2 Cb 0.00 -1.41 0.14 0.00 1.01 0.00 0.00 42.92 42.66 2gb3 s ASP 2 CO 0.00 0.03 0.46 -0.69 0.21 0.00 0.00 175.17 175.18 2gb3 s VAL 3 N 1.10 4.72 0.58 -1.27 1.01 -1.26 -5.06 120.40 120.23 2gb3 s VAL 3 Ca -0.01 -1.84 -0.03 0.00 0.00 0.00 0.00 61.98 60.10 2gb3 s VAL 3 Cb -0.14 -4.05 0.03 0.00 0.00 0.00 0.00 36.38 32.22 2gb3 s VAL 3 CO -0.08 -0.85 0.85 -0.36 0.00 0.00 0.00 175.10 174.67 2gb3 s PHE 4 N 1.21 3.06 0.51 5.22 0.08 -1.26 -5.06 117.98 121.74 2gb3 s PHE 4 Ca 0.07 0.34 -0.21 0.00 0.12 0.00 0.00 56.93 57.25 2gb3 s PHE 4 Cb -0.25 -2.77 -0.07 0.00 -0.57 0.00 0.00 43.02 39.36 2gb3 s PHE 4 CO -0.01 -0.89 1.13 -1.54 -0.10 0.00 0.00 175.22 173.81 2gb3 s SER 5 N -4.37 5.96 0.22 1.36 1.04 -1.26 -4.90 113.70 111.75 2gb3 s SER 5 Ca 0.55 2.18 -0.09 0.00 0.48 0.00 0.00 55.95 59.08 2gb3 s SER 5 Cb -0.10 -2.59 0.22 0.00 0.10 0.00 0.00 66.02 63.65 2gb3 s SER 5 CO 0.42 -1.05 1.85 0.44 0.98 0.00 0.00 173.24 175.88 2gb3 h ASP 6 N 1.54 0.76 -0.98 7.02 5.19 -1.98 -1.65 116.42 126.32 2gb3 h ASP 6 Ca -0.50 0.00 0.24 0.00 -0.62 0.00 0.00 57.03 56.15 2gb3 h ASP 6 Cb 1.25 -0.16 -0.18 0.00 0.18 0.00 0.00 39.33 40.42 2gb3 h ASP 6 CO 0.58 0.52 -0.09 -1.14 -3.12 0.00 0.00 179.24 175.99 2gb3 n ARG 7 N -4.65 -0.08 0.02 3.56 0.63 -1.26 -0.97 116.66 113.91 2gb3 n ARG 7 Ca 0.09 1.49 0.07 0.00 -0.92 0.00 0.00 57.85 58.57 2gb3 n ARG 7 Cb 0.10 -2.31 -0.10 0.00 0.45 0.00 0.00 32.46 30.60 2gb3 n ARG 7 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 2gb3 n VAL 8 N -5.52 0.57 -0.04 5.15 0.24 -0.88 -3.98 118.33 113.87 2gb3 n VAL 8 Ca 0.20 -0.59 -0.14 0.00 -2.04 0.00 0.00 64.34 61.77 2gb3 n VAL 8 Cb 0.64 -0.29 -0.02 0.00 -1.47 0.00 0.00 33.84 32.70 2gb3 n VAL 8 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2gb3 h LEU 9 N 0.00 0.86 -1.10 1.34 3.38 -0.32 -3.18 115.31 116.29 2gb3 h LEU 9 Ca -0.09 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.37 2gb3 h LEU 9 Cb 1.25 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 2gb3 h LEU 9 CO 0.01 1.26 -0.12 -0.07 0.09 0.00 0.00 178.44 179.61 2gb3 h LEU 10 N 0.57 0.00 -8.73 1.67 3.38 -1.24 -3.43 115.31 107.53 2gb3 h LEU 10 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 2gb3 h LEU 10 Cb 1.19 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.88 2gb3 h LEU 10 CO 0.12 0.12 1.03 -0.89 0.09 0.00 0.00 178.44 178.91 2gb3 s THR 11 N -3.59 3.98 0.60 0.22 2.01 -1.20 -5.01 115.64 112.64 2gb3 s THR 11 Ca 0.02 0.98 -0.13 0.00 0.31 0.00 0.00 61.69 62.86 2gb3 s THR 11 Cb 0.09 -4.39 -0.04 0.00 0.01 0.00 0.00 72.50 68.17 2gb3 s THR 11 CO 0.61 -0.93 1.02 -1.83 -0.69 0.00 0.00 174.62 172.80 2gb3 s GLU 12 N 4.88 3.60 0.37 4.92 -1.05 -1.26 -5.01 118.70 125.15 2gb3 s GLU 12 Ca 0.55 0.86 -0.24 0.00 -0.15 0.00 0.00 54.97 55.99 2gb3 s GLU 12 Cb -0.11 -2.08 -0.10 0.00 -0.44 0.00 0.00 34.13 31.40 2gb3 s GLU 12 CO 0.31 -0.57 0.96 -2.00 0.95 0.00 0.00 175.26 174.91 2gb3 s GLU 13 N -4.80 4.40 0.20 -4.83 2.12 -1.26 -4.98 118.70 109.55 2gb3 s GLU 13 Ca 0.57 1.26 -0.31 0.00 0.36 0.00 0.00 54.97 56.85 2gb3 s GLU 13 Cb -0.11 -2.52 -0.15 0.00 0.26 0.00 0.00 34.13 31.60 2gb3 s GLU 13 CO 0.47 0.11 1.07 -1.13 -0.54 0.00 0.00 175.26 175.24 2gb3 n SER 14 N 0.01 1.12 0.23 -1.70 3.41 -1.26 -4.79 113.62 110.64 2gb3 n SER 14 Ca 0.04 1.15 0.13 0.00 -0.26 0.00 0.00 58.87 59.94 2gb3 n SER 14 Cb 0.52 -1.21 0.76 0.00 -0.26 0.00 0.00 64.21 64.02 2gb3 n SER 14 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2gb3 h PRO 15 N 2.83 0.00 0.05 4.33 0.11 -1.93 0.07 132.00 137.46 2gb3 h PRO 15 Ca -0.41 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.69 2gb3 h PRO 15 Cb 1.35 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.46 2gb3 h PRO 15 CO 0.67 0.00 -0.03 0.82 -0.21 0.00 0.00 178.00 179.25 2gb3 h ILE 16 N 0.00 1.28 0.00 4.15 2.04 -1.89 -3.22 117.51 119.87 2gb3 h ILE 16 Ca 0.05 -1.27 -0.02 0.00 1.00 0.00 0.00 64.86 64.62 2gb3 h ILE 16 Cb 0.21 2.10 -0.00 0.00 -0.74 0.00 0.00 36.82 38.39 2gb3 h ILE 16 CO -0.00 0.31 -0.08 0.03 0.00 0.00 0.00 178.15 178.41 2gb3 h ARG 17 N -0.65 0.00 0.00 2.37 -0.00 -1.72 -1.78 114.38 112.60 2gb3 h ARG 17 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.47 2gb3 h ARG 17 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.53 2gb3 h ARG 17 CO 0.01 0.08 0.00 1.63 0.00 0.00 0.00 179.97 181.69 2gb3 n LYS 18 N -4.40 0.19 0.05 0.04 4.01 -0.06 -2.24 118.16 115.75 2gb3 n LYS 18 Ca -0.03 0.47 0.12 0.00 -0.51 0.00 0.00 58.31 58.36 2gb3 n LYS 18 Cb 0.16 -1.90 0.12 0.00 -0.51 0.00 0.00 35.03 32.89 2gb3 n LYS 18 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2gb3 n LEU 19 N -2.27 0.66 -0.23 -0.35 4.77 -0.67 -4.38 117.00 114.53 2gb3 n LEU 19 Ca 0.01 0.13 -0.05 0.00 -0.03 0.00 0.00 56.01 56.08 2gb3 n LEU 19 Cb 0.19 -0.15 0.06 0.00 -2.33 0.00 0.00 43.42 41.19 2gb3 n LEU 19 CO 0.18 -0.01 1.14 0.58 -1.33 0.00 0.00 177.39 177.94 2gb3 h VAL 20 N 0.00 1.13 -0.72 4.08 2.07 -1.52 -0.76 116.25 120.52 2gb3 h VAL 20 Ca 0.00 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 2gb3 h VAL 20 Cb 0.73 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 30.68 2gb3 h VAL 20 CO 0.00 0.15 0.42 -0.65 0.02 0.00 0.00 177.57 177.52 2gb3 h PRO 21 N 0.84 0.99 -0.05 1.57 0.11 -1.77 0.19 132.00 133.89 2gb3 h PRO 21 Ca 0.25 -0.09 -0.14 0.00 0.11 0.00 0.00 66.00 66.13 2gb3 h PRO 21 Cb -0.04 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 30.85 2gb3 h PRO 21 CO -0.08 0.70 -0.59 0.74 -0.21 0.00 0.00 178.00 178.56 2gb3 h PHE 22 N 1.00 0.21 -0.11 0.65 0.04 -1.71 -3.19 116.94 113.84 2gb3 h PHE 22 Ca 0.26 -0.08 -0.05 0.00 2.80 0.00 0.00 57.97 60.90 2gb3 h PHE 22 Cb -0.02 -0.04 -0.00 0.00 2.20 0.00 0.00 35.95 38.09 2gb3 h PHE 22 CO 0.00 0.72 -0.13 0.00 -0.60 0.00 0.00 178.31 178.30 2gb3 h ALA 23 N 1.26 0.16 0.00 2.45 0.00 -0.60 -2.64 119.26 119.90 2gb3 h ALA 23 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2gb3 h ALA 23 Cb 1.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2gb3 h ALA 23 CO 0.09 0.03 0.00 -0.85 0.00 0.00 0.00 179.25 178.52 2gb3 n GLU 24 N -4.61 0.00 0.00 0.00 -0.00 0.01 -1.81 120.64 114.23 2gb3 n GLU 24 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.09 2gb3 n GLU 24 Cb 0.35 -1.28 0.00 0.00 -0.00 0.00 0.00 31.44 30.51 2gb3 n GLU 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2gb3 n ALA 26 N 0.82 0.00 0.03 -1.84 0.00 -1.00 -2.52 120.51 116.00 2gb3 n ALA 26 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 2gb3 n ALA 26 Cb 0.00 0.00 0.29 0.00 0.00 0.00 0.00 19.45 19.74 2gb3 n ALA 26 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2gb3 h LYS 27 N 0.00 0.45 -0.37 0.00 5.09 -1.56 -2.18 116.57 118.00 2gb3 h LYS 27 Ca 0.00 -0.12 -0.05 0.00 0.09 0.00 0.00 60.65 60.58 2gb3 h LYS 27 Cb 0.00 -0.05 -0.02 0.00 0.10 0.00 0.00 32.23 32.26 2gb3 h LYS 27 CO 0.00 0.55 0.03 1.57 -2.09 0.00 0.00 179.45 179.52 2gb3 h LYS 28 N 0.42 0.56 0.00 0.07 2.10 -1.77 -2.04 116.57 115.91 2gb3 h LYS 28 Ca 0.08 -0.11 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 2gb3 h LYS 28 Cb 0.43 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 31.68 2gb3 h LYS 28 CO 0.02 0.56 0.00 0.54 -2.00 0.00 0.00 179.45 178.58 2gb3 n ARG 29 N -4.29 0.72 -1.50 0.07 1.74 -0.84 -4.90 116.66 107.66 2gb3 n ARG 29 Ca 0.02 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 2gb3 n ARG 29 Cb 0.23 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 2gb3 n ARG 29 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2gb3 n GLY 30 N 0.87 0.54 3.15 -0.13 0.00 -0.77 -5.09 105.19 103.76 2gb3 n GLY 30 Ca 0.19 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 2gb3 n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gb3 s VAL 31 N -2.61 1.92 -0.37 1.61 1.01 -1.11 -4.93 120.40 115.92 2gb3 s VAL 31 Ca 0.00 -0.90 -0.27 0.00 0.00 0.00 0.00 61.98 60.81 2gb3 s VAL 31 Cb 0.00 -1.70 0.02 0.00 0.00 0.00 0.00 36.38 34.70 2gb3 s VAL 31 CO 0.00 0.52 0.98 0.00 0.00 0.00 0.00 175.10 176.60 2gb3 s ARG 32 N 0.76 3.87 -0.17 2.72 1.04 -0.51 -4.36 118.95 122.30 2gb3 s ARG 32 Ca -0.09 0.67 -0.14 0.00 -1.04 0.00 0.00 55.73 55.13 2gb3 s ARG 32 Cb -0.16 -3.80 -0.05 0.00 -2.04 0.00 0.00 34.95 28.90 2gb3 s ARG 32 CO 0.00 -0.99 0.29 0.42 -0.04 0.00 0.00 175.30 174.99 2gb3 s ILE 33 N 3.62 5.30 -0.48 4.99 1.01 -1.26 -2.15 121.20 132.22 2gb3 s ILE 33 Ca 0.41 0.53 -0.20 0.00 0.00 0.00 0.00 60.65 61.39 2gb3 s ILE 33 Cb -0.11 -3.63 0.04 0.00 0.01 0.00 0.00 42.46 38.76 2gb3 s ILE 33 CO 0.19 0.37 0.65 -1.00 0.00 0.00 0.00 174.94 175.15 2gb3 s HIS 34 N 0.63 3.04 -0.72 3.97 3.76 0.41 -4.98 115.29 121.40 2gb3 s HIS 34 Ca 0.16 -0.30 -0.27 0.00 -0.15 0.00 0.00 55.06 54.51 2gb3 s HIS 34 Cb -0.13 -3.48 0.03 0.00 1.11 0.00 0.00 32.58 30.11 2gb3 s HIS 34 CO 0.04 -0.99 1.24 -1.01 -0.85 0.00 0.00 174.74 173.18 2gb3 s HIS 35 N 2.81 2.34 -0.21 1.40 0.09 -1.26 -4.49 115.29 115.97 2gb3 s HIS 35 Ca 0.19 -0.06 0.16 0.00 -0.00 0.00 0.00 55.06 55.34 2gb3 s HIS 35 Cb -0.16 -4.59 0.36 0.00 -0.00 0.00 0.00 32.58 28.19 2gb3 s HIS 35 CO 0.15 -2.00 1.25 1.28 -0.00 0.00 0.00 174.74 175.43 2gb3 n LEU 36 N 9.15 2.98 0.01 0.89 4.77 -1.26 -4.63 117.00 128.90 2gb3 n LEU 36 Ca 0.03 -2.87 0.11 0.00 -0.03 0.00 0.00 56.01 53.25 2gb3 n LEU 36 Cb 0.49 -0.42 -0.09 0.00 -2.33 0.00 0.00 43.42 41.07 2gb3 n LEU 36 CO 0.70 0.68 -0.29 -0.46 -1.33 0.00 0.00 177.39 176.69 2gb3 n ASN 37 N -0.81 0.51 -4.42 -1.43 6.94 -1.26 -0.43 115.26 114.36 2gb3 n ASN 37 Ca 0.16 -0.35 -0.31 0.00 -0.02 0.00 0.00 54.58 54.07 2gb3 n ASN 37 Cb 0.69 1.28 -0.13 0.00 -2.36 0.00 0.00 39.78 39.25 2gb3 n ASN 37 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2gb3 s ILE 38 N -3.26 2.62 -0.14 1.53 -1.09 -1.26 -4.56 121.20 115.04 2gb3 s ILE 38 Ca 0.01 -1.14 -0.00 0.00 -2.23 0.00 0.00 60.65 57.28 2gb3 s ILE 38 Cb 0.15 -2.06 0.11 0.00 -1.58 0.00 0.00 42.46 39.08 2gb3 s ILE 38 CO 0.86 0.41 1.82 0.61 -1.23 0.00 0.00 174.94 177.42 2gb3 n GLY 39 N 1.82 3.08 3.52 6.18 0.00 -1.26 -4.82 105.19 113.71 2gb3 n GLY 39 Ca -0.16 -0.44 -0.43 0.00 0.00 0.00 0.00 46.02 44.98 2gb3 n GLY 39 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2gb3 s GLN 40 N -0.81 3.31 0.54 1.61 2.00 -1.26 -5.04 119.66 120.01 2gb3 s GLN 40 Ca 0.14 -0.31 -0.22 0.00 -2.00 0.00 0.00 55.36 52.97 2gb3 s GLN 40 Cb 0.11 -3.97 -0.05 0.00 0.80 0.00 0.00 33.01 29.90 2gb3 s GLN 40 CO 0.00 -1.12 1.33 -2.14 -0.50 0.00 0.00 175.29 172.86 2gb3 s PRO 41 N 3.09 3.22 0.00 1.67 0.02 -1.26 -4.85 135.00 136.89 2gb3 s PRO 41 Ca 0.25 2.16 0.23 0.00 0.02 0.00 0.00 61.00 63.66 2gb3 s PRO 41 Cb -0.14 -2.27 0.11 0.00 0.02 0.00 0.00 34.50 32.22 2gb3 s PRO 41 CO 0.20 -1.10 1.16 -0.40 -0.33 0.00 0.00 177.00 176.53 2gb3 n ASP 42 N -0.97 2.55 -4.77 2.53 5.75 -1.26 -4.99 116.55 115.39 2gb3 n ASP 42 Ca 0.10 -1.78 -0.38 0.00 -0.01 0.00 0.00 54.79 52.73 2gb3 n ASP 42 Cb 0.46 0.19 -0.01 0.00 -1.03 0.00 0.00 41.12 40.72 2gb3 n ASP 42 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2gb3 s LEU 43 N -2.13 4.08 0.25 -2.12 1.43 -1.26 -4.98 118.68 113.97 2gb3 s LEU 43 Ca 0.23 2.33 -0.30 0.00 -1.03 0.00 0.00 54.13 55.36 2gb3 s LEU 43 Cb 0.19 -4.15 -0.10 0.00 0.03 0.00 0.00 46.19 42.15 2gb3 s LEU 43 CO 0.39 -0.83 1.45 -0.54 0.23 0.00 0.00 176.35 177.05 2gb3 s LYS 44 N -2.54 4.26 0.13 1.70 3.01 -1.26 -4.86 119.74 120.17 2gb3 s LYS 44 Ca 0.61 2.32 -0.31 0.00 -1.01 0.00 0.00 55.97 57.58 2gb3 s LYS 44 Cb -0.30 -3.10 -0.08 0.00 -1.01 0.00 0.00 37.83 33.34 2gb3 s LYS 44 CO 0.36 -0.43 1.41 0.99 0.51 0.00 0.00 175.35 178.20 2gb3 s THR 45 N -0.05 3.20 0.28 2.17 2.01 -1.26 -4.91 115.64 117.08 2gb3 s THR 45 Ca 0.59 0.86 -0.29 0.00 0.31 0.00 0.00 61.69 63.16 2gb3 s THR 45 Cb -0.42 -3.55 -0.14 0.00 0.01 0.00 0.00 72.50 68.40 2gb3 s THR 45 CO 0.44 0.07 1.20 -2.65 -0.69 0.00 0.00 174.62 172.99 2gb3 n PRO 46 N 3.89 1.71 0.18 4.92 -0.02 -1.26 -4.86 135.00 139.56 2gb3 n PRO 46 Ca 0.12 0.60 0.15 0.00 -2.02 0.00 0.00 63.50 62.34 2gb3 n PRO 46 Cb 0.42 -2.11 0.74 0.00 -0.02 0.00 0.00 33.50 32.52 2gb3 n PRO 46 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2gb3 h GLU 47 N 2.81 0.00 -0.82 -0.52 9.09 -2.01 -2.55 114.58 120.59 2gb3 h GLU 47 Ca -0.43 0.00 0.16 0.00 0.05 0.00 0.00 59.36 59.14 2gb3 h GLU 47 Cb 1.31 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 28.35 2gb3 h GLU 47 CO 0.66 0.00 0.54 -0.24 0.05 0.00 0.00 179.01 180.02 2gb3 h VAL 48 N 0.00 0.78 -0.42 -1.06 3.04 -1.94 -0.76 116.25 115.89 2gb3 h VAL 48 Ca 0.09 -0.16 0.03 0.00 -1.01 0.00 0.00 66.70 65.65 2gb3 h VAL 48 Cb 0.41 0.26 -0.03 0.00 -2.01 0.00 0.00 31.29 29.92 2gb3 h VAL 48 CO -0.00 0.09 0.23 0.15 -1.01 0.00 0.00 177.57 177.02 2gb3 h PHE 49 N 0.47 0.42 0.01 3.17 3.57 -1.65 -0.96 116.94 121.97 2gb3 h PHE 49 Ca 0.41 0.02 -0.25 0.00 3.53 0.00 0.00 57.97 61.68 2gb3 h PHE 49 Cb 0.89 -0.13 0.01 0.00 2.79 0.00 0.00 35.95 39.52 2gb3 h PHE 49 CO -0.00 0.23 -1.01 0.74 -2.23 0.00 0.00 178.31 176.04 2gb3 h PHE 50 N 0.46 0.78 -0.10 0.41 0.04 -1.47 -3.20 116.94 113.85 2gb3 h PHE 50 Ca 0.17 -0.43 -0.00 0.00 2.80 0.00 0.00 57.97 60.51 2gb3 h PHE 50 Cb 0.05 -0.08 -0.00 0.00 2.20 0.00 0.00 35.95 38.11 2gb3 h PHE 50 CO -0.09 1.26 0.05 1.49 -0.60 0.00 0.00 178.31 180.43 2gb3 h GLU 51 N 0.28 0.15 -0.83 1.51 4.57 -0.99 -1.05 114.58 118.22 2gb3 h GLU 51 Ca -0.11 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.06 2gb3 h GLU 51 Cb 1.66 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 30.18 2gb3 h GLU 51 CO 0.18 0.22 0.55 0.00 -1.18 0.00 0.00 179.01 178.78 2gb3 h ARG 52 N 0.04 1.10 -0.22 1.92 2.47 -1.29 0.49 114.38 118.89 2gb3 h ARG 52 Ca 0.04 -0.07 -0.02 0.00 -1.26 0.00 0.00 59.98 58.67 2gb3 h ARG 52 Cb 0.12 -0.25 -0.01 0.00 -1.65 0.00 0.00 29.97 28.18 2gb3 h ARG 52 CO -0.00 0.73 0.08 0.82 0.56 0.00 0.00 179.97 182.15 2gb3 h ILE 53 N 1.13 1.18 -0.62 2.04 2.04 -1.50 -1.22 117.51 120.56 2gb3 h ILE 53 Ca 0.31 -0.56 -0.04 0.00 1.00 0.00 0.00 64.86 65.57 2gb3 h ILE 53 Cb -0.13 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 2gb3 h ILE 53 CO -0.07 0.18 0.23 0.22 0.00 0.00 0.00 178.15 178.72 2gb3 h TYR 54 N 0.19 0.95 -0.06 1.37 3.20 -0.67 -2.70 116.97 119.25 2gb3 h TYR 54 Ca 0.07 -0.08 -0.10 0.00 3.14 0.00 0.00 58.73 61.76 2gb3 h TYR 54 Cb 0.21 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 2gb3 h TYR 54 CO -0.00 0.76 -0.41 0.93 -1.64 0.00 0.00 178.16 177.80 2gb3 h GLU 55 N 0.87 0.14 -1.39 1.82 5.08 -0.83 -3.28 114.58 116.99 2gb3 h GLU 55 Ca 0.20 -0.06 -0.61 0.00 -1.00 0.00 0.00 59.36 57.89 2gb3 h GLU 55 Cb 0.23 -0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.08 2gb3 h GLU 55 CO -0.01 0.53 -0.39 0.09 -1.00 0.00 0.00 179.01 178.23 2gb3 n ASN 56 N -4.03 5.35 -4.63 1.42 3.02 -0.47 -5.03 115.26 110.89 2gb3 n ASN 56 Ca -0.02 -3.75 -0.43 0.00 -0.03 0.00 0.00 54.58 50.36 2gb3 n ASN 56 Cb 0.46 -0.55 -0.03 0.00 -0.61 0.00 0.00 39.78 39.06 2gb3 n ASN 56 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2gb3 s LYS 57 N -3.65 3.81 0.38 3.52 2.20 -1.03 -4.90 119.74 120.06 2gb3 s LYS 57 Ca 0.50 1.75 -0.19 0.00 -0.36 0.00 0.00 55.97 57.67 2gb3 s LYS 57 Cb 0.41 -4.05 -0.10 0.00 -1.51 0.00 0.00 37.83 32.58 2gb3 s LYS 57 CO -0.16 -1.29 0.87 -1.25 -0.36 0.00 0.00 175.35 173.16 2gb3 s PRO 58 N 4.70 4.19 0.31 4.03 0.04 -1.26 -4.96 135.00 142.04 2gb3 s PRO 58 Ca 0.73 0.98 0.05 0.00 0.04 0.00 0.00 61.00 62.81 2gb3 s PRO 58 Cb -0.26 -2.35 0.50 0.00 0.04 0.00 0.00 34.50 32.43 2gb3 s PRO 58 CO 0.30 0.08 1.76 0.93 0.04 0.00 0.00 177.00 180.10 2gb3 h GLU 59 N 2.20 0.37 -4.75 4.56 4.39 -2.04 -3.41 114.58 115.90 2gb3 h GLU 59 Ca -0.48 -0.13 -0.59 0.00 0.34 0.00 0.00 59.36 58.50 2gb3 h GLU 59 Cb 1.18 -0.02 -0.35 0.00 -0.10 0.00 0.00 28.75 29.46 2gb3 h GLU 59 CO 0.63 0.61 -0.84 0.08 -1.16 0.00 0.00 179.01 178.33 2gb3 s VAL 60 N -4.46 1.50 -1.13 3.13 1.01 -1.26 -5.06 120.40 114.13 2gb3 s VAL 60 Ca -0.06 -0.65 -0.19 0.00 0.00 0.00 0.00 61.98 61.09 2gb3 s VAL 60 Cb 0.14 -1.37 0.10 0.00 0.00 0.00 0.00 36.38 35.25 2gb3 s VAL 60 CO 0.77 0.44 1.48 -0.69 0.00 0.00 0.00 175.10 177.10 2gb3 s VAL 61 N 0.98 4.37 0.61 2.92 1.01 -1.26 -4.97 120.40 124.05 2gb3 s VAL 61 Ca -0.07 -1.67 -0.04 0.00 0.00 0.00 0.00 61.98 60.20 2gb3 s VAL 61 Cb -0.15 -5.02 0.03 0.00 0.00 0.00 0.00 36.38 31.24 2gb3 s VAL 61 CO -0.01 -1.82 0.89 -0.72 0.00 0.00 0.00 175.10 173.44 2gb3 s TYR 62 N 3.60 3.05 -0.08 5.22 -0.85 -1.26 -5.05 117.35 121.98 2gb3 s TYR 62 Ca 0.45 0.40 -0.30 0.00 -0.52 0.00 0.00 57.07 57.10 2gb3 s TYR 62 Cb -0.00 -2.86 -0.02 0.00 0.38 0.00 0.00 41.96 39.45 2gb3 s TYR 62 CO -0.02 -1.00 1.11 0.71 -1.52 0.00 0.00 175.55 174.83 2gb3 s TYR 63 N -2.99 3.34 0.98 -3.49 2.02 -1.26 -4.72 117.35 111.23 2gb3 s TYR 63 Ca 0.56 1.39 -0.17 0.00 -0.37 0.00 0.00 57.07 58.49 2gb3 s TYR 63 Cb -0.10 -3.31 0.23 0.00 -0.40 0.00 0.00 41.96 38.37 2gb3 s TYR 63 CO 0.43 -0.80 1.24 -1.13 -1.57 0.00 0.00 175.55 173.72 2gb3 n SER 64 N 5.10 -0.25 -4.75 2.29 3.41 -1.26 -4.97 113.62 113.19 2gb3 n SER 64 Ca 0.10 -1.41 -0.40 0.00 -0.26 0.00 0.00 58.87 56.90 2gb3 n SER 64 Cb 0.47 -0.97 0.02 0.00 -0.26 0.00 0.00 64.21 63.47 2gb3 n SER 64 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2gb3 n HIS 65 N -3.92 2.57 -0.30 7.33 -0.00 -1.26 -4.69 115.22 114.94 2gb3 n HIS 65 Ca 0.16 0.44 0.14 0.00 -0.00 0.00 0.00 57.72 58.46 2gb3 n HIS 65 Cb 0.55 -2.43 0.38 0.00 -0.00 0.00 0.00 29.99 28.50 2gb3 n HIS 65 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.34 177.11 2gb3 h SER 66 N 2.07 0.66 0.74 0.26 0.02 -1.90 0.82 113.55 116.23 2gb3 h SER 66 Ca -0.51 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2gb3 h SER 66 Cb 1.28 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2gb3 h SER 66 CO 0.60 0.28 0.00 0.00 -1.14 0.00 0.00 176.83 176.57 2gb3 n ALA 67 N -2.41 2.23 0.00 3.77 0.00 -1.26 -4.64 120.51 118.20 2gb3 n ALA 67 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2gb3 n ALA 67 Cb 0.57 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.59 2gb3 n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gb3 n GLY 68 N 1.09 2.48 3.75 0.00 0.00 0.28 0.29 105.19 113.08 2gb3 n GLY 68 Ca 0.09 -2.04 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 2gb3 n GLY 68 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2gb3 s ILE 69 N -2.41 2.34 0.26 -0.61 -4.36 -1.26 -4.35 121.20 110.80 2gb3 s ILE 69 Ca 0.00 0.30 -0.02 0.00 -0.26 0.00 0.00 60.65 60.66 2gb3 s ILE 69 Cb 0.00 -3.19 0.24 0.00 1.25 0.00 0.00 42.46 40.76 2gb3 s ILE 69 CO 0.00 0.05 1.71 -0.25 0.24 0.00 0.00 174.94 176.69 2gb3 h TRP 70 N 4.70 0.49 -0.48 1.37 2.91 -1.96 -1.13 115.95 121.85 2gb3 h TRP 70 Ca -0.47 0.04 0.00 0.00 1.13 0.00 0.00 58.89 59.59 2gb3 h TRP 70 Cb 1.22 -0.09 -0.02 0.00 -0.51 0.00 0.00 29.16 29.75 2gb3 h TRP 70 CO 0.59 -0.00 0.31 0.93 -1.03 0.00 0.00 178.44 179.24 2gb3 h GLU 71 N 0.39 0.63 -0.05 2.65 5.08 -1.99 -0.93 114.58 120.37 2gb3 h GLU 71 Ca 0.45 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.59 2gb3 h GLU 71 Cb 0.76 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 2gb3 h GLU 71 CO -0.47 0.42 -0.76 1.25 -1.00 0.00 0.00 179.01 178.45 2gb3 h LEU 72 N 0.65 0.41 -0.85 1.33 5.85 -1.56 0.47 115.31 121.61 2gb3 h LEU 72 Ca 0.17 -0.28 -0.09 0.00 0.84 0.00 0.00 57.88 58.53 2gb3 h LEU 72 Cb -0.07 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 2gb3 h LEU 72 CO -0.04 1.03 -0.07 0.03 -0.34 0.00 0.00 178.44 179.05 2gb3 h ARG 73 N 0.22 0.78 -0.35 1.25 3.08 -0.81 -0.26 114.38 118.29 2gb3 h ARG 73 Ca -0.03 -0.24 -0.17 0.00 0.07 0.00 0.00 59.98 59.61 2gb3 h ARG 73 Cb 1.34 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 31.31 2gb3 h ARG 73 CO 0.13 0.84 -0.44 0.93 -1.07 0.00 0.00 179.97 180.36 2gb3 h GLU 74 N 0.72 0.90 -0.52 0.04 5.08 -1.04 -2.20 114.58 117.56 2gb3 h GLU 74 Ca 0.13 -0.50 0.01 0.00 -1.00 0.00 0.00 59.36 58.00 2gb3 h GLU 74 Cb 0.54 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 2gb3 h GLU 74 CO 0.03 1.15 0.33 0.00 -1.00 0.00 0.00 179.01 179.52 2gb3 h ALA 75 N 0.77 0.66 -0.48 3.43 0.00 -0.35 0.11 119.26 123.39 2gb3 h ALA 75 Ca 0.05 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2gb3 h ALA 75 Cb 1.03 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2gb3 h ALA 75 CO 0.10 0.06 0.12 0.74 0.00 0.00 0.00 179.25 180.28 2gb3 h PHE 76 N 0.67 0.81 -0.22 0.00 0.04 -1.06 -1.50 116.94 115.69 2gb3 h PHE 76 Ca 0.20 -0.10 0.02 0.00 2.80 0.00 0.00 57.97 60.89 2gb3 h PHE 76 Cb -0.04 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 37.86 2gb3 h PHE 76 CO -0.05 0.73 0.08 0.00 -0.60 0.00 0.00 178.31 178.48 2gb3 h ALA 77 N 0.99 0.25 -0.37 2.45 0.00 -0.89 -2.24 119.26 119.45 2gb3 h ALA 77 Ca 0.15 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2gb3 h ALA 77 Cb 0.33 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2gb3 h ALA 77 CO 0.00 -0.33 -0.06 0.77 0.00 0.00 0.00 179.25 179.63 2gb3 h SER 78 N 0.19 0.58 0.03 0.00 0.02 -0.75 -2.58 113.55 111.03 2gb3 h SER 78 Ca 0.09 -0.14 0.01 0.00 -0.84 0.00 0.00 61.79 60.92 2gb3 h SER 78 Cb 0.05 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 2gb3 h SER 78 CO -0.09 0.69 -0.10 0.22 -1.14 0.00 0.00 176.83 176.42 2gb3 h TYR 79 N 0.57 -0.25 -0.52 3.45 3.20 -0.90 -0.01 116.97 122.51 2gb3 h TYR 79 Ca 0.11 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.01 2gb3 h TYR 79 Cb 0.45 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.80 2gb3 h TYR 79 CO 0.02 -0.15 0.34 1.88 -1.64 0.00 0.00 178.16 178.61 2gb3 h TYR 80 N -0.18 0.59 -0.00 -3.82 -1.99 -1.16 0.30 116.97 110.70 2gb3 h TYR 80 Ca 0.03 0.01 -0.07 0.00 2.00 0.00 0.00 58.73 60.70 2gb3 h TYR 80 Cb 0.22 -0.20 0.01 0.00 2.00 0.00 0.00 36.73 38.75 2gb3 h TYR 80 CO -0.15 0.35 -0.27 0.87 -0.00 0.00 0.00 178.16 178.97 2gb3 h LYS 81 N 0.62 0.19 -0.12 4.88 1.57 -1.15 0.20 116.57 122.75 2gb3 h LYS 81 Ca 0.20 -0.20 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 2gb3 h LYS 81 Cb 0.05 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 2gb3 h LYS 81 CO -0.05 0.93 -0.15 -0.09 -0.57 0.00 0.00 179.45 179.51 2gb3 h ARG 82 N -0.47 0.32 0.00 3.15 2.43 -0.83 -3.01 114.38 115.97 2gb3 h ARG 82 Ca -0.03 -0.18 -0.38 0.00 -0.81 0.00 0.00 59.98 58.58 2gb3 h ARG 82 Cb 1.02 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.51 2gb3 h ARG 82 CO 0.05 0.74 -2.43 -2.13 -1.51 0.00 0.00 179.97 174.70 2gb3 n ARG 83 N -4.57 0.67 0.00 0.20 0.63 0.10 -4.51 116.66 109.19 2gb3 n ARG 83 Ca -0.07 0.08 0.12 0.00 -0.92 0.00 0.00 57.85 57.06 2gb3 n ARG 83 Cb 0.37 -1.52 0.13 0.00 0.45 0.00 0.00 32.46 31.88 2gb3 n ARG 83 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 2gb3 n GLN 84 N -3.02 2.21 -3.84 -0.14 1.13 -0.76 -4.97 117.38 107.99 2gb3 n GLN 84 Ca -0.40 -1.80 -0.28 0.00 -1.94 0.00 0.00 57.00 52.58 2gb3 n GLN 84 Cb 1.07 -1.46 0.04 0.00 0.11 0.00 0.00 30.24 30.00 2gb3 n GLN 84 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2gb3 n ARG 85 N 1.18 -6.00 -5.17 -1.09 5.12 0.41 -4.73 116.66 106.38 2gb3 n ARG 85 Ca 0.14 0.65 -0.31 0.00 -1.93 0.00 0.00 57.85 56.40 2gb3 n ARG 85 Cb 0.57 -5.56 -0.17 0.00 -1.16 0.00 0.00 32.46 26.15 2gb3 n ARG 85 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2gb3 s VAL 86 N -3.33 1.93 -0.65 1.55 1.01 0.39 -4.95 120.40 116.35 2gb3 s VAL 86 Ca 0.60 -0.98 -0.23 0.00 0.00 0.00 0.00 61.98 61.37 2gb3 s VAL 86 Cb -0.30 -1.64 0.06 0.00 0.00 0.00 0.00 36.38 34.51 2gb3 s VAL 86 CO 0.81 0.54 0.97 -1.81 0.00 0.00 0.00 175.10 175.61 2gb3 s ASP 87 N 0.01 6.20 0.06 3.32 1.01 -1.26 -2.48 116.67 123.53 2gb3 s ASP 87 Ca -0.08 -0.87 0.08 0.00 0.71 0.00 0.00 52.55 52.40 2gb3 s ASP 87 Cb -0.14 -2.43 -0.03 0.00 1.01 0.00 0.00 42.92 41.33 2gb3 s ASP 87 CO 0.05 -1.43 -0.23 0.68 0.21 0.00 0.00 175.17 174.45 2gb3 s VAL 88 N 4.12 1.90 0.17 -1.27 -7.23 -1.26 -5.08 120.40 111.75 2gb3 s VAL 88 Ca 0.24 -1.36 0.04 0.00 -1.81 0.00 0.00 61.98 59.08 2gb3 s VAL 88 Cb -0.16 -1.65 -0.04 0.00 0.56 0.00 0.00 36.38 35.09 2gb3 s VAL 88 CO 0.12 0.22 0.24 -0.54 -0.31 0.00 0.00 175.10 174.83 2gb3 s LYS 89 N -1.38 3.23 0.50 4.82 1.02 -1.26 -4.78 119.74 121.89 2gb3 s LYS 89 Ca 0.10 -0.74 0.19 0.00 0.02 0.00 0.00 55.97 55.53 2gb3 s LYS 89 Cb -0.09 -2.82 1.24 0.00 -0.52 0.00 0.00 37.83 35.64 2gb3 s LYS 89 CO 0.03 0.49 2.04 -1.35 -0.92 0.00 0.00 175.35 175.63 2gb3 h PRO 90 N 2.03 0.13 0.00 -1.68 0.11 -1.93 -0.59 132.00 130.06 2gb3 h PRO 90 Ca -0.49 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 2gb3 h PRO 90 Cb 1.20 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2gb3 h PRO 90 CO 0.65 0.08 -0.00 0.93 -0.21 0.00 0.00 178.00 179.45 2gb3 h GLU 91 N 0.13 0.00 -0.00 1.05 3.07 -1.94 -1.65 114.58 115.23 2gb3 h GLU 91 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 2gb3 h GLU 91 Cb 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 2gb3 h GLU 91 CO -0.02 0.00 -0.27 0.09 -1.40 0.00 0.00 179.01 177.42 2gb3 n ASN 92 N -3.11 0.39 -4.73 1.42 5.03 -0.23 -4.87 115.26 109.16 2gb3 n ASN 92 Ca -0.02 -0.15 -0.35 0.00 0.87 0.00 0.00 54.58 54.93 2gb3 n ASN 92 Cb 0.15 -0.03 -0.08 0.00 -1.02 0.00 0.00 39.78 38.80 2gb3 n ASN 92 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2gb3 s VAL 93 N -2.86 4.99 -0.22 2.41 1.01 -0.62 -2.14 120.40 122.96 2gb3 s VAL 93 Ca 0.16 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.17 2gb3 s VAL 93 Cb 0.19 -3.20 0.06 0.00 0.00 0.00 0.00 36.38 33.42 2gb3 s VAL 93 CO 0.60 0.54 -0.04 -0.22 0.00 0.00 0.00 175.10 175.97 2gb3 s LEU 94 N -0.32 2.27 0.18 3.92 2.96 -0.20 -4.97 118.68 122.51 2gb3 s LEU 94 Ca 0.09 -1.06 -0.30 0.00 -0.22 0.00 0.00 54.13 52.64 2gb3 s LEU 94 Cb -0.12 -1.07 -0.08 0.00 0.50 0.00 0.00 46.19 45.42 2gb3 s LEU 94 CO 0.01 -0.24 1.11 -0.69 -1.32 0.00 0.00 176.35 175.23 2gb3 s VAL 95 N 1.48 3.81 0.31 1.68 1.01 0.14 -1.17 120.40 127.66 2gb3 s VAL 95 Ca -0.04 1.57 0.03 0.00 0.00 0.00 0.00 61.98 63.53 2gb3 s VAL 95 Cb -0.18 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 2gb3 s VAL 95 CO -0.07 0.27 0.12 0.42 0.00 0.00 0.00 175.10 175.85 2gb3 s THR 96 N -0.26 0.56 -1.26 3.92 -4.23 -0.56 -4.49 115.64 109.32 2gb3 s THR 96 Ca 0.50 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.82 2gb3 s THR 96 Cb -0.30 -2.57 0.01 0.00 1.34 0.00 0.00 72.50 70.98 2gb3 s THR 96 CO 0.35 0.00 1.91 0.59 -0.54 0.00 0.00 174.62 176.93 2gb3 n ASN 97 N -0.80 4.11 -0.40 3.99 4.13 -1.26 -1.35 115.26 123.67 2gb3 n ASN 97 Ca -0.01 -2.84 0.05 0.00 1.68 0.00 0.00 54.58 53.47 2gb3 n ASN 97 Cb 0.66 -1.67 -0.02 0.00 -1.54 0.00 0.00 39.78 37.21 2gb3 n ASN 97 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gb3 n GLY 98 N 5.09 -1.81 0.23 7.41 0.00 -0.87 -3.50 105.19 111.74 2gb3 n GLY 98 Ca 0.49 -1.41 0.04 0.00 0.00 0.00 0.00 46.02 45.14 2gb3 n GLY 98 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2gb3 h GLY 99 N -0.38 0.12 -0.27 -0.02 0.00 -1.83 -3.12 103.07 97.56 2gb3 h GLY 99 Ca -0.01 -0.07 0.12 0.00 0.00 0.00 0.00 47.33 47.37 2gb3 h GLY 99 CO 0.01 0.06 -0.19 1.76 0.00 0.00 0.00 176.54 178.18 2gb3 h SER 100 N 0.10 -0.68 0.12 0.19 0.02 -1.94 -1.02 113.55 110.34 2gb3 h SER 100 Ca 0.02 0.19 -0.18 0.00 -0.84 0.00 0.00 61.79 60.98 2gb3 h SER 100 Cb 0.35 0.42 -0.00 0.00 0.14 0.00 0.00 62.40 63.31 2gb3 h SER 100 CO 0.02 -0.23 -0.69 -0.08 -1.14 0.00 0.00 176.83 174.72 2gb3 h GLU 101 N -0.04 0.51 -0.53 3.45 4.81 -1.58 -2.56 114.58 118.65 2gb3 h GLU 101 Ca 0.29 -0.39 0.02 0.00 -0.13 0.00 0.00 59.36 59.15 2gb3 h GLU 101 Cb 0.48 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 2gb3 h GLU 101 CO -0.65 1.02 0.35 0.00 -0.73 0.00 0.00 179.01 179.00 2gb3 h ALA 102 N 0.88 1.69 -0.11 2.92 0.00 -1.36 0.20 119.26 123.48 2gb3 h ALA 102 Ca -0.02 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2gb3 h ALA 102 Cb 1.26 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2gb3 h ALA 102 CO 0.13 0.26 -0.15 0.82 0.00 0.00 0.00 179.25 180.31 2gb3 h ILE 103 N 0.65 1.37 -0.50 0.00 2.04 -1.11 -1.88 117.51 118.09 2gb3 h ILE 103 Ca 0.20 -1.35 0.04 0.00 1.00 0.00 0.00 64.86 64.75 2gb3 h ILE 103 Cb 0.02 2.00 -0.04 0.00 -0.74 0.00 0.00 36.82 38.06 2gb3 h ILE 103 CO -0.05 0.39 0.26 0.25 0.00 0.00 0.00 178.15 179.00 2gb3 h LEU 104 N -0.11 0.39 -0.37 1.44 5.85 -0.99 -0.96 115.31 120.56 2gb3 h LEU 104 Ca 0.01 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 2gb3 h LEU 104 Cb 0.69 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 2gb3 h LEU 104 CO 0.03 0.27 0.12 -0.26 -0.34 0.00 0.00 178.44 178.26 2gb3 h PHE 105 N 0.51 0.59 -0.30 1.25 0.04 -0.98 -1.36 116.94 116.70 2gb3 h PHE 105 Ca 0.21 -0.06 0.06 0.00 2.80 0.00 0.00 57.97 60.99 2gb3 h PHE 105 Cb 0.10 -0.17 -0.06 0.00 2.20 0.00 0.00 35.95 38.02 2gb3 h PHE 105 CO -0.09 0.57 -0.11 0.77 -0.60 0.00 0.00 178.31 178.84 2gb3 h SER 106 N 0.45 -0.39 -0.28 2.17 0.02 -0.97 0.79 113.55 115.33 2gb3 h SER 106 Ca 0.12 0.10 0.02 0.00 -0.84 0.00 0.00 61.79 61.20 2gb3 h SER 106 Cb 0.25 0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.99 2gb3 h SER 106 CO -0.00 -0.15 0.12 -0.26 -1.14 0.00 0.00 176.83 175.40 2gb3 h PHE 107 N -0.06 0.22 -0.31 3.45 -1.00 -1.02 -2.13 116.94 116.09 2gb3 h PHE 107 Ca 0.15 0.01 -0.09 0.00 2.81 0.00 0.00 57.97 60.85 2gb3 h PHE 107 Cb 0.29 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 39.77 2gb3 h PHE 107 CO -0.32 0.12 -0.18 0.00 -1.61 0.00 0.00 178.31 176.32 2gb3 h ALA 108 N 1.16 1.10 -0.20 2.45 0.00 -0.64 -1.63 119.26 121.50 2gb3 h ALA 108 Ca 0.12 -0.32 -0.20 0.00 0.00 0.00 0.00 54.91 54.51 2gb3 h ALA 108 Cb 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2gb3 h ALA 108 CO -0.10 0.55 -0.66 0.28 0.00 0.00 0.00 179.25 179.33 2gb3 h VAL 109 N 0.51 1.30 0.00 0.00 2.07 -0.68 -3.36 116.25 116.09 2gb3 h VAL 109 Ca 0.08 -1.88 -0.20 0.00 0.82 0.00 0.00 66.70 65.52 2gb3 h VAL 109 Cb 0.60 1.84 -0.04 0.00 -1.52 0.00 0.00 31.29 32.18 2gb3 h VAL 109 CO 0.04 0.60 -1.64 2.30 0.02 0.00 0.00 177.57 178.89 2gb3 n ILE 110 N -3.95 1.18 -4.37 4.57 -5.35 -0.82 -4.97 119.36 105.65 2gb3 n ILE 110 Ca -0.05 -0.71 -0.28 0.00 -0.27 0.00 0.00 62.75 61.43 2gb3 n ILE 110 Cb 0.68 -0.68 -0.13 0.00 -1.74 0.00 0.00 39.64 37.77 2gb3 n ILE 110 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2gb3 s ALA 111 N -2.87 2.27 0.28 -1.28 0.00 -0.62 -4.90 121.76 114.65 2gb3 s ALA 111 Ca -0.05 -1.43 0.01 0.00 0.00 0.00 0.00 51.96 50.50 2gb3 s ALA 111 Cb 0.09 -0.35 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 2gb3 s ALA 111 CO 0.82 0.51 0.45 1.21 0.00 0.00 0.00 175.76 178.75 2gb3 s ASN 112 N -2.03 6.33 0.22 0.00 3.04 -1.26 -4.56 114.94 116.68 2gb3 s ASN 112 Ca 0.13 0.33 -0.31 0.00 0.04 0.00 0.00 52.86 53.05 2gb3 s ASN 112 Cb -0.10 -1.98 -0.11 0.00 -1.54 0.00 0.00 41.25 37.52 2gb3 s ASN 112 CO 0.06 -0.16 1.63 -2.84 -3.04 0.00 0.00 177.10 172.74 2gb3 s PRO 113 N -3.94 4.16 0.00 0.43 0.02 -1.26 -1.61 135.00 132.80 2gb3 s PRO 113 Ca 0.38 2.52 0.00 0.00 0.02 0.00 0.00 61.00 63.91 2gb3 s PRO 113 Cb -0.10 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.34 2gb3 s PRO 113 CO 0.32 -0.66 0.00 0.41 -0.33 0.00 0.00 177.00 176.74 2gb3 n GLY 114 N 3.28 2.12 3.78 0.52 0.00 0.61 -4.97 105.19 110.53 2gb3 n GLY 114 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2gb3 n GLY 114 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gb3 s ASP 115 N -1.41 3.18 0.06 1.61 1.01 -0.63 -4.69 116.67 115.80 2gb3 s ASP 115 Ca 0.00 0.88 0.09 0.00 0.71 0.00 0.00 52.55 54.23 2gb3 s ASP 115 Cb 0.00 -1.38 -0.03 0.00 1.01 0.00 0.00 42.92 42.52 2gb3 s ASP 115 CO 0.00 -2.75 -0.25 -1.61 0.21 0.00 0.00 175.17 170.77 2gb3 s GLU 116 N -5.33 1.76 -0.08 8.23 2.02 0.49 -0.81 118.70 124.98 2gb3 s GLU 116 Ca 0.65 -1.15 0.01 0.00 0.02 0.00 0.00 54.97 54.51 2gb3 s GLU 116 Cb -0.13 -2.00 0.02 0.00 0.10 0.00 0.00 34.13 32.12 2gb3 s GLU 116 CO 0.54 0.50 -0.08 0.42 0.02 0.00 0.00 175.26 176.66 2gb3 s ILE 117 N -0.89 0.90 0.30 -1.63 1.01 -0.58 -0.24 121.20 120.08 2gb3 s ILE 117 Ca 0.13 -0.29 -0.28 0.00 0.00 0.00 0.00 60.65 60.21 2gb3 s ILE 117 Cb -0.10 -0.89 -0.09 0.00 0.01 0.00 0.00 42.46 41.39 2gb3 s ILE 117 CO 0.04 0.32 1.02 -0.76 0.00 0.00 0.00 174.94 175.56 2gb3 s LEU 118 N 1.14 4.45 -0.00 2.97 1.43 0.14 -0.58 118.68 128.22 2gb3 s LEU 118 Ca -0.06 2.07 0.01 0.00 -1.03 0.00 0.00 54.13 55.11 2gb3 s LEU 118 Cb -0.14 -3.81 -0.00 0.00 0.03 0.00 0.00 46.19 42.26 2gb3 s LEU 118 CO -0.01 -0.13 -0.04 0.54 0.23 0.00 0.00 176.35 176.94 2gb3 s VAL 119 N -1.35 0.28 -0.39 -1.59 0.11 0.01 -0.72 120.40 116.74 2gb3 s VAL 119 Ca 0.47 -0.15 -0.25 0.00 -2.93 0.00 0.00 61.98 59.13 2gb3 s VAL 119 Cb -0.26 -0.24 0.02 0.00 -1.53 0.00 0.00 36.38 34.36 2gb3 s VAL 119 CO 0.33 0.08 0.88 -0.76 -3.33 0.00 0.00 175.10 172.30 2gb3 s LEU 120 N -0.07 4.05 0.05 2.54 1.43 -1.24 -0.53 118.68 124.91 2gb3 s LEU 120 Ca 0.01 0.36 -0.18 0.00 -1.03 0.00 0.00 54.13 53.29 2gb3 s LEU 120 Cb -0.02 -3.16 -0.06 0.00 0.03 0.00 0.00 46.19 42.98 2gb3 s LEU 120 CO -0.00 -0.87 0.53 -0.70 0.23 0.00 0.00 176.35 175.54 2gb3 s GLU 121 N 3.42 4.14 0.55 1.70 2.12 -0.72 -3.78 118.70 126.14 2gb3 s GLU 121 Ca 0.35 0.66 -0.18 0.00 0.36 0.00 0.00 54.97 56.16 2gb3 s GLU 121 Cb -0.12 -3.24 -0.06 0.00 0.26 0.00 0.00 34.13 30.97 2gb3 s GLU 121 CO 0.20 0.63 1.07 -1.25 -0.54 0.00 0.00 175.26 175.38 2gb3 s PRO 122 N -1.04 3.46 0.15 4.30 0.04 -1.26 -1.38 135.00 139.27 2gb3 s PRO 122 Ca 0.28 1.37 -0.03 0.00 0.04 0.00 0.00 61.00 62.66 2gb3 s PRO 122 Cb -0.19 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 2gb3 s PRO 122 CO 0.18 -0.72 0.13 -0.59 0.04 0.00 0.00 177.00 176.03 2gb3 s PHE 123 N -2.12 0.81 -0.48 0.56 -0.71 0.03 -4.64 117.98 111.43 2gb3 s PHE 123 Ca 0.67 -1.16 -0.27 0.00 -1.04 0.00 0.00 56.93 55.14 2gb3 s PHE 123 Cb -0.18 -0.39 -0.08 0.00 -1.21 0.00 0.00 43.02 41.16 2gb3 s PHE 123 CO 0.29 -0.60 2.41 0.98 -1.34 0.00 0.00 175.22 176.96 2gb3 n TYR 124 N -0.16 1.45 -0.44 3.49 9.36 -1.13 -4.58 117.16 125.14 2gb3 n TYR 124 Ca -0.04 0.11 0.36 0.00 3.32 0.00 0.00 57.90 61.65 2gb3 n TYR 124 Cb 0.64 -2.63 0.64 0.00 -0.63 0.00 0.00 39.34 37.36 2gb3 n TYR 124 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2gb3 h ALA 125 N 18.51 2.72 -0.00 2.98 0.00 -1.87 -1.47 119.26 140.13 2gb3 h ALA 125 Ca -0.25 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2gb3 h ALA 125 Cb 1.27 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.25 2gb3 h ALA 125 CO 1.15 -1.34 0.00 -0.91 0.00 0.00 0.00 179.25 178.15 2gb3 h ASN 126 N 0.10 0.00 -0.43 0.00 2.35 -1.93 -1.82 115.58 113.84 2gb3 h ASN 126 Ca 0.81 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.54 2gb3 h ASN 126 Cb 2.53 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 40.87 2gb3 h ASN 126 CO -0.41 0.00 0.22 1.88 -1.65 0.00 0.00 177.43 177.47 2gb3 h TYR 127 N 0.00 0.65 -0.19 1.19 0.05 -1.65 -1.31 116.97 115.71 2gb3 h TYR 127 Ca 0.00 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.73 2gb3 h TYR 127 Cb 0.00 -0.21 -0.01 0.00 1.01 0.00 0.00 36.73 37.52 2gb3 h TYR 127 CO 0.00 0.49 -0.04 -0.97 -1.05 0.00 0.00 178.16 176.59 2gb3 h ASN 128 N 0.66 0.26 -0.33 3.88 -1.24 -1.54 -0.57 115.58 116.69 2gb3 h ASN 128 Ca 0.17 -0.04 -0.06 0.00 0.71 0.00 0.00 56.30 57.08 2gb3 h ASN 128 Cb 0.08 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.05 2gb3 h ASN 128 CO -0.02 0.34 -0.03 0.00 -1.29 0.00 0.00 177.43 176.43 2gb3 h ALA 129 N 1.69 0.45 -0.14 1.57 0.00 -1.36 -0.89 119.26 120.59 2gb3 h ALA 129 Ca 0.06 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.58 2gb3 h ALA 129 Cb 0.25 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2gb3 h ALA 129 CO 0.01 0.24 -0.48 0.74 0.00 0.00 0.00 179.25 179.76 2gb3 h PHE 130 N 0.40 0.44 -0.33 0.00 0.04 -1.20 -1.99 116.94 114.30 2gb3 h PHE 130 Ca 0.09 -0.14 -0.03 0.00 2.80 0.00 0.00 57.97 60.69 2gb3 h PHE 130 Cb 0.50 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.54 2gb3 h PHE 130 CO 0.04 0.77 0.07 0.00 -0.60 0.00 0.00 178.31 178.60 2gb3 h ALA 131 N 1.20 0.44 -0.76 2.45 0.00 -0.99 -1.57 119.26 120.03 2gb3 h ALA 131 Ca 0.02 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 2gb3 h ALA 131 Cb 0.95 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 2gb3 h ALA 131 CO 0.08 0.11 0.35 0.87 0.00 0.00 0.00 179.25 180.66 2gb3 h LYS 132 N 0.38 1.10 -0.58 0.00 1.57 -0.96 0.56 116.57 118.63 2gb3 h LYS 132 Ca 0.10 -0.16 -0.10 0.00 -1.87 0.00 0.00 60.65 58.62 2gb3 h LYS 132 Cb 0.31 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 2gb3 h LYS 132 CO 0.00 0.86 -0.03 0.82 -0.57 0.00 0.00 179.45 180.53 2gb3 h ILE 133 N 1.09 1.26 -0.00 1.86 2.04 -1.20 -2.67 117.51 119.90 2gb3 h ILE 133 Ca 0.26 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.95 2gb3 h ILE 133 Cb 0.13 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 2gb3 h ILE 133 CO -0.03 0.42 -0.06 0.00 0.00 0.00 0.00 178.15 178.48 2gb3 n ALA 134 N -2.49 2.60 -1.11 1.87 0.00 -0.61 -4.92 120.51 115.86 2gb3 n ALA 134 Ca 0.03 -0.19 -0.04 0.00 0.00 0.00 0.00 53.44 53.24 2gb3 n ALA 134 Cb 0.36 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.37 2gb3 n ALA 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gb3 n GLY 135 N 1.32 0.67 3.86 0.00 0.00 -0.12 -4.41 105.19 106.52 2gb3 n GLY 135 Ca 0.13 -0.63 -0.36 0.00 0.00 0.00 0.00 46.02 45.15 2gb3 n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gb3 s VAL 136 N -2.08 5.23 -0.07 1.61 1.01 -0.00 -0.28 120.40 125.82 2gb3 s VAL 136 Ca 0.00 0.45 -0.19 0.00 0.00 0.00 0.00 61.98 62.24 2gb3 s VAL 136 Cb 0.00 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 2gb3 s VAL 136 CO 0.00 0.49 0.53 -0.75 0.00 0.00 0.00 175.10 175.37 2gb3 s LYS 137 N -1.36 4.30 -0.25 2.72 2.20 0.01 -4.18 119.74 123.17 2gb3 s LYS 137 Ca 0.24 0.57 -0.10 0.00 -0.36 0.00 0.00 55.97 56.32 2gb3 s LYS 137 Cb -0.14 -3.39 -0.05 0.00 -1.51 0.00 0.00 37.83 32.74 2gb3 s LYS 137 CO 0.12 0.26 0.15 -1.17 -0.36 0.00 0.00 175.35 174.36 2gb3 s LEU 138 N 0.23 3.97 -0.26 5.43 2.96 -1.26 -1.52 118.68 128.23 2gb3 s LEU 138 Ca 0.28 0.03 -0.09 0.00 -0.22 0.00 0.00 54.13 54.13 2gb3 s LEU 138 Cb -0.16 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.41 2gb3 s LEU 138 CO 0.13 0.02 0.11 -0.63 -1.32 0.00 0.00 176.35 174.67 2gb3 s ILE 139 N 1.31 4.65 0.27 6.68 -1.09 0.25 -4.94 121.20 128.33 2gb3 s ILE 139 Ca 0.07 -0.06 -0.28 0.00 -2.23 0.00 0.00 60.65 58.15 2gb3 s ILE 139 Cb -0.14 -3.19 -0.09 0.00 -1.58 0.00 0.00 42.46 37.45 2gb3 s ILE 139 CO 0.06 0.31 0.93 -2.16 -1.23 0.00 0.00 174.94 172.85 2gb3 s PRO 140 N 1.66 4.72 -0.40 2.79 0.04 -1.26 -0.81 135.00 141.74 2gb3 s PRO 140 Ca 0.07 1.39 0.03 0.00 0.04 0.00 0.00 61.00 62.53 2gb3 s PRO 140 Cb -0.15 -3.09 0.11 0.00 0.04 0.00 0.00 34.50 31.41 2gb3 s PRO 140 CO 0.06 0.43 0.14 0.08 0.04 0.00 0.00 177.00 177.76 2gb3 s VAL 141 N -1.35 2.03 0.32 -0.36 1.01 0.30 -4.89 120.40 117.47 2gb3 s VAL 141 Ca 0.44 -2.51 -0.29 0.00 0.00 0.00 0.00 61.98 59.61 2gb3 s VAL 141 Cb -0.23 -2.47 -0.11 0.00 0.00 0.00 0.00 36.38 33.57 2gb3 s VAL 141 CO 0.28 -0.71 1.57 -0.89 0.00 0.00 0.00 175.10 175.35 2gb3 s THR 142 N 0.59 2.04 0.09 3.92 2.01 -1.26 -1.75 115.64 121.28 2gb3 s THR 142 Ca 0.13 0.04 0.09 0.00 0.31 0.00 0.00 61.69 62.26 2gb3 s THR 142 Cb -0.22 -3.02 -0.03 0.00 0.01 0.00 0.00 72.50 69.24 2gb3 s THR 142 CO -0.07 0.01 -0.23 -0.13 -0.69 0.00 0.00 174.62 173.50 2gb3 s ARG 143 N -1.00 1.36 0.00 4.92 0.52 -0.48 -4.69 118.95 119.58 2gb3 s ARG 143 Ca 0.60 -1.14 0.00 0.00 -0.52 0.00 0.00 55.73 54.67 2gb3 s ARG 143 Cb -0.48 -1.63 0.00 0.00 0.52 0.00 0.00 34.95 33.37 2gb3 s ARG 143 CO 0.53 0.40 0.00 0.54 0.02 0.00 0.00 175.30 176.78 2gb3 n ARG 144 N 1.34 3.85 0.00 3.54 3.00 -1.26 -4.63 116.66 122.50 2gb3 n ARG 144 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.66 2gb3 n ARG 144 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.99 2gb3 n ARG 144 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2gb3 n GLU 146 N 0.00 0.00 -0.26 5.56 4.71 -1.26 -0.03 120.64 129.37 2gb3 n GLU 146 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 57.16 57.25 2gb3 n GLU 146 Cb 0.00 0.00 0.24 0.00 -1.01 0.00 0.00 31.44 30.67 2gb3 n GLU 146 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 2gb3 n GLU 147 N 0.00 2.57 -2.13 3.49 2.13 -1.26 -4.93 120.64 120.51 2gb3 n GLU 147 Ca 0.00 -2.36 -0.09 0.00 0.66 0.00 0.00 57.16 55.36 2gb3 n GLU 147 Cb 0.00 -1.48 -0.01 0.00 0.27 0.00 0.00 31.44 30.22 2gb3 n GLU 147 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2gb3 n GLY 148 N 1.36 0.04 3.98 8.31 0.00 -1.13 -3.33 105.19 114.42 2gb3 n GLY 148 Ca 0.20 -0.50 -0.28 0.00 0.00 0.00 0.00 46.02 45.44 2gb3 n GLY 148 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2gb3 n PHE 149 N -3.94 -1.83 -1.98 1.61 3.72 0.96 -4.96 117.46 111.05 2gb3 n PHE 149 Ca -0.11 0.80 -0.29 0.00 -0.05 0.00 0.00 57.45 57.80 2gb3 n PHE 149 Cb 0.57 -3.68 0.06 0.00 -0.94 0.00 0.00 39.48 35.49 2gb3 n PHE 149 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2gb3 s ALA 150 N -3.64 2.91 -0.09 4.37 0.00 -1.21 -4.90 121.76 119.20 2gb3 s ALA 150 Ca 0.30 -0.50 -0.30 0.00 0.00 0.00 0.00 51.96 51.47 2gb3 s ALA 150 Cb -0.16 -2.93 -0.04 0.00 0.00 0.00 0.00 23.12 20.00 2gb3 s ALA 150 CO 0.88 -1.23 1.42 0.42 0.00 0.00 0.00 175.76 177.25 2gb3 s ILE 151 N -3.36 3.92 0.59 0.00 1.01 -1.26 -4.70 121.20 117.40 2gb3 s ILE 151 Ca 0.59 1.16 -0.18 0.00 0.00 0.00 0.00 60.65 62.22 2gb3 s ILE 151 Cb -0.11 -3.75 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 2gb3 s ILE 151 CO 0.50 -0.08 1.12 -2.16 0.00 0.00 0.00 174.94 174.32 2gb3 s PRO 152 N 3.41 3.14 0.38 2.79 0.04 -1.26 -4.93 135.00 138.56 2gb3 s PRO 152 Ca 0.63 1.53 0.28 0.00 0.04 0.00 0.00 61.00 63.48 2gb3 s PRO 152 Cb -0.28 -1.98 1.09 0.00 0.04 0.00 0.00 34.50 33.37 2gb3 s PRO 152 CO 0.22 -1.01 1.82 1.96 0.04 0.00 0.00 177.00 180.03 2gb3 h GLN 153 N 0.74 0.00 -0.75 4.56 7.50 -1.97 -3.07 115.11 122.12 2gb3 h GLN 153 Ca -0.49 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 58.65 2gb3 h GLN 153 Cb 1.26 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.78 2gb3 h GLN 153 CO 0.56 0.00 0.02 -1.71 -1.50 0.00 0.00 178.83 176.19 2gb3 n ASN 154 N -2.60 3.93 -0.20 1.46 5.15 -1.26 -4.55 115.26 117.19 2gb3 n ASN 154 Ca 0.02 -2.59 -0.05 0.00 -0.60 0.00 0.00 54.58 51.36 2gb3 n ASN 154 Cb 0.29 -0.62 0.05 0.00 -0.53 0.00 0.00 39.78 38.97 2gb3 n ASN 154 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 2gb3 h LEU 155 N 2.42 0.55 -1.80 1.20 5.85 -1.93 -2.74 115.31 118.86 2gb3 h LEU 155 Ca 0.02 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 2gb3 h LEU 155 Cb 1.45 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.37 2gb3 h LEU 155 CO 0.32 0.38 -0.14 -0.33 -0.34 0.00 0.00 178.44 178.33 2gb3 h GLU 156 N 0.67 0.00 0.00 1.25 5.08 -1.89 -2.96 114.58 116.73 2gb3 h GLU 156 Ca 0.24 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.58 2gb3 h GLU 156 Cb 0.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 2gb3 h GLU 156 CO -0.11 0.14 -0.07 0.66 -1.00 0.00 0.00 179.01 178.63 2gb3 h SER 157 N 0.00 0.00 0.93 1.42 4.64 -1.83 -2.48 113.55 116.23 2gb3 h SER 157 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2gb3 h SER 157 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2gb3 h SER 157 CO 0.02 0.07 -0.11 0.49 -0.87 0.00 0.00 176.83 176.43 2gb3 n PHE 158 N -3.30 0.06 -2.64 4.77 3.01 -1.12 -4.87 117.46 113.38 2gb3 n PHE 158 Ca -0.01 0.02 -0.40 0.00 1.01 0.00 0.00 57.45 58.06 2gb3 n PHE 158 Cb 0.25 -0.48 -0.05 0.00 -0.01 0.00 0.00 39.48 39.19 2gb3 n PHE 158 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2gb3 s ILE 159 N -3.01 3.94 0.14 4.37 1.01 -0.93 -4.97 121.20 121.75 2gb3 s ILE 159 Ca 0.13 1.86 -0.00 0.00 0.00 0.00 0.00 60.65 62.63 2gb3 s ILE 159 Cb 0.18 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.47 2gb3 s ILE 159 CO 0.57 0.40 0.19 -0.46 0.00 0.00 0.00 174.94 175.64 2gb3 n ASN 160 N 1.72 -0.52 0.27 3.58 0.23 -1.26 -5.02 115.26 114.26 2gb3 n ASN 160 Ca -0.00 -1.76 0.10 0.00 -0.53 0.00 0.00 54.58 52.38 2gb3 n ASN 160 Cb 0.47 0.99 0.71 0.00 -2.08 0.00 0.00 39.78 39.87 2gb3 n ASN 160 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 2gb3 h GLU 161 N 0.00 0.00 -0.00 -3.83 -0.00 -2.02 -2.48 114.58 106.24 2gb3 h GLU 161 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.25 2gb3 h GLU 161 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.22 2gb3 h GLU 161 CO 0.15 0.03 -0.37 0.54 -0.00 0.00 0.00 179.01 179.36 2gb3 n ARG 162 N -4.26 0.53 -2.30 1.06 1.74 -1.26 -4.89 116.66 107.29 2gb3 n ARG 162 Ca -0.03 -0.32 -0.42 0.00 -0.77 0.00 0.00 57.85 56.31 2gb3 n ARG 162 Cb 0.11 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.03 2gb3 n ARG 162 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2gb3 s THR 163 N -2.69 3.89 -0.08 0.55 2.01 -0.94 -0.38 115.64 118.01 2gb3 s THR 163 Ca 0.19 1.25 0.02 0.00 0.31 0.00 0.00 61.69 63.46 2gb3 s THR 163 Cb 0.19 -3.80 -0.02 0.00 0.01 0.00 0.00 72.50 68.87 2gb3 s THR 163 CO 0.59 -0.01 0.07 0.29 -0.69 0.00 0.00 174.62 174.88 2gb3 n LYS 164 N 5.39 5.61 -3.89 4.92 4.76 0.66 -4.87 118.16 130.75 2gb3 n LYS 164 Ca 0.13 -0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 2gb3 n LYS 164 Cb 0.44 -0.64 0.01 0.00 -1.84 0.00 0.00 35.03 33.00 2gb3 n LYS 164 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2gb3 s GLY 165 N -1.30 -0.10 -0.02 0.72 0.00 -1.24 -2.76 107.32 102.62 2gb3 s GLY 165 Ca 0.01 0.02 0.02 0.00 0.00 0.00 0.00 44.72 44.77 2gb3 s GLY 165 CO 0.08 3.51 -0.07 -0.42 0.00 0.00 0.00 173.10 176.19 2gb3 s ILE 166 N -2.18 0.63 -0.00 0.90 1.01 -0.18 -0.68 121.20 120.69 2gb3 s ILE 166 Ca 0.24 -0.30 0.02 0.00 0.00 0.00 0.00 60.65 60.61 2gb3 s ILE 166 Cb -0.00 -0.55 -0.01 0.00 0.01 0.00 0.00 42.46 41.91 2gb3 s ILE 166 CO 0.01 0.19 -0.08 0.54 0.00 0.00 0.00 174.94 175.60 2gb3 s VAL 167 N 0.07 0.61 0.25 2.92 0.11 0.10 -0.36 120.40 124.10 2gb3 s VAL 167 Ca -0.01 -0.41 -0.22 0.00 -2.93 0.00 0.00 61.98 58.42 2gb3 s VAL 167 Cb -0.06 -0.53 0.03 0.00 -1.53 0.00 0.00 36.38 34.29 2gb3 s VAL 167 CO -0.00 0.12 0.78 -1.48 -3.33 0.00 0.00 175.10 171.20 2gb3 s LEU 168 N -0.32 -0.23 -0.00 2.54 2.34 -0.70 -3.62 118.68 118.68 2gb3 s LEU 168 Ca 0.02 -0.57 0.05 0.00 0.06 0.00 0.00 54.13 53.68 2gb3 s LEU 168 Cb -0.04 2.59 -0.03 0.00 -0.56 0.00 0.00 46.19 48.15 2gb3 s LEU 168 CO -0.00 -1.25 -0.14 -0.94 -1.06 0.00 0.00 176.35 172.97 2gb3 s SER 169 N -2.93 4.10 -0.24 1.48 1.04 -1.26 -0.23 113.70 115.64 2gb3 s SER 169 Ca 0.12 -0.27 -0.02 0.00 0.48 0.00 0.00 55.95 56.25 2gb3 s SER 169 Cb -0.05 -0.82 0.13 0.00 0.10 0.00 0.00 66.02 65.38 2gb3 s SER 169 CO 0.06 0.29 0.33 0.21 0.98 0.00 0.00 173.24 175.11 2gb3 s ASN 170 N -1.18 0.74 0.59 7.02 2.47 -0.15 -3.27 114.94 121.16 2gb3 s ASN 170 Ca 0.14 -0.08 -0.20 0.00 0.42 0.00 0.00 52.86 53.14 2gb3 s ASN 170 Cb -0.11 0.85 -0.03 0.00 -1.45 0.00 0.00 41.25 40.51 2gb3 s ASN 170 CO 0.04 -0.32 1.29 -2.65 -3.72 0.00 0.00 177.10 171.73 2gb3 n PRO 171 N 5.34 1.36 -3.07 0.43 -0.02 -1.26 -4.23 135.00 133.55 2gb3 n PRO 171 Ca -0.03 0.51 -0.38 0.00 -2.02 0.00 0.00 63.50 61.58 2gb3 n PRO 171 Cb 0.49 -2.51 -0.06 0.00 -0.02 0.00 0.00 33.50 31.41 2gb3 n PRO 171 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gb3 s ASN 173 N -1.28 4.10 0.00 0.00 3.84 -1.26 -0.48 114.94 119.85 2gb3 s ASN 173 Ca 0.36 -0.37 0.24 0.00 0.21 0.00 0.00 52.86 53.30 2gb3 s ASN 173 Cb -0.21 -1.66 0.25 0.00 -0.55 0.00 0.00 41.25 39.08 2gb3 s ASN 173 CO 0.23 0.07 1.27 -0.81 -2.79 0.00 0.00 177.10 175.07 2gb3 n PRO 174 N 4.18 1.64 0.11 0.43 -0.04 -1.26 -2.85 135.00 137.22 2gb3 n PRO 174 Ca -0.18 -1.29 -0.02 0.00 -0.04 0.00 0.00 63.50 61.96 2gb3 n PRO 174 Cb 0.52 -1.47 0.18 0.00 -0.04 0.00 0.00 33.50 32.69 2gb3 n PRO 174 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 2gb3 h THR 175 N 3.16 1.38 -0.04 0.52 1.35 -1.88 -3.38 112.91 114.01 2gb3 h THR 175 Ca 0.00 -1.85 -0.02 0.00 -0.55 0.00 0.00 66.41 63.99 2gb3 h THR 175 Cb 0.80 1.94 -0.01 0.00 -1.73 0.00 0.00 68.15 69.15 2gb3 h THR 175 CO 0.00 0.54 -0.02 0.61 -0.25 0.00 0.00 175.52 176.40 2gb3 n GLY 176 N 0.08 0.49 3.80 5.82 0.00 0.36 -4.62 105.19 111.13 2gb3 n GLY 176 Ca -0.02 -0.58 -0.34 0.00 0.00 0.00 0.00 46.02 45.09 2gb3 n GLY 176 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gb3 s VAL 177 N -2.00 3.89 -0.24 1.61 1.01 -1.26 -0.31 120.40 123.10 2gb3 s VAL 177 Ca 0.00 1.17 -0.00 0.00 0.00 0.00 0.00 61.98 63.15 2gb3 s VAL 177 Cb 0.00 -3.47 0.07 0.00 0.00 0.00 0.00 36.38 32.97 2gb3 s VAL 177 CO 0.00 -0.26 0.00 -0.69 0.00 0.00 0.00 175.10 174.15 2gb3 s VAL 178 N -2.02 1.15 -0.08 2.92 1.01 -1.26 -0.99 120.40 121.13 2gb3 s VAL 178 Ca 0.66 -1.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.26 2gb3 s VAL 178 Cb -0.15 -1.58 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 2gb3 s VAL 178 CO 0.19 -0.24 1.04 -0.31 0.00 0.00 0.00 175.10 175.78 2gb3 s TYR 179 N 1.55 3.47 0.92 5.22 2.02 -1.26 -5.03 117.35 124.23 2gb3 s TYR 179 Ca -0.01 1.53 -0.16 0.00 -0.37 0.00 0.00 57.07 58.06 2gb3 s TYR 179 Cb -0.18 -3.23 0.22 0.00 -0.40 0.00 0.00 41.96 38.37 2gb3 s TYR 179 CO -0.10 -0.42 1.11 0.41 -1.57 0.00 0.00 175.55 174.98 2gb3 n GLY 180 N 3.12 -1.82 0.17 0.71 0.00 -1.26 -4.63 105.19 101.49 2gb3 n GLY 180 Ca 0.09 -1.64 -0.04 0.00 0.00 0.00 0.00 46.02 44.42 2gb3 n GLY 180 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2gb3 h LYS 181 N 0.00 0.04 -0.34 1.61 3.11 -1.87 -2.75 116.57 116.36 2gb3 h LYS 181 Ca -0.37 -0.00 0.02 0.00 -2.81 0.00 0.00 60.65 57.48 2gb3 h LYS 181 Cb 1.05 -0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 32.25 2gb3 h LYS 181 CO 0.26 0.03 0.19 -0.44 -2.81 0.00 0.00 179.45 176.68 2gb3 h ASP 182 N 0.04 0.31 0.00 4.20 3.32 -1.99 -0.75 116.42 121.54 2gb3 h ASP 182 Ca 0.20 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.26 2gb3 h ASP 182 Cb 0.30 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2gb3 h ASP 182 CO -0.39 0.22 0.00 -0.62 -1.72 0.00 0.00 179.24 176.73 2gb3 n GLU 183 N -4.91 0.26 0.00 3.56 1.02 -1.04 -1.98 120.64 117.55 2gb3 n GLU 183 Ca -0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2gb3 n GLU 183 Cb 0.06 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 2gb3 n GLU 183 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 2gb3 n ARG 185 N 0.62 0.00 -0.21 3.49 0.63 -0.29 -2.23 116.66 118.67 2gb3 n ARG 185 Ca 0.00 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.90 2gb3 n ARG 185 Cb 0.10 0.00 0.08 0.00 0.45 0.00 0.00 32.46 33.09 2gb3 n ARG 185 CO 0.00 0.00 0.00 -0.92 -2.51 0.00 0.00 177.63 174.20 2gb3 h TYR 186 N 0.00 0.61 -0.28 -0.14 3.20 -1.66 0.22 116.97 118.91 2gb3 h TYR 186 Ca 0.00 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.79 2gb3 h TYR 186 Cb 0.00 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.07 2gb3 h TYR 186 CO 0.00 0.29 -0.28 1.25 -1.64 0.00 0.00 178.16 177.78 2gb3 h LEU 187 N 0.62 0.57 -0.36 2.82 5.85 -1.73 -2.24 115.31 120.85 2gb3 h LEU 187 Ca 0.27 -0.21 -0.17 0.00 0.84 0.00 0.00 57.88 58.61 2gb3 h LEU 187 Cb 0.17 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.04 2gb3 h LEU 187 CO -0.17 0.83 -0.45 0.58 -0.34 0.00 0.00 178.44 178.89 2gb3 h VAL 188 N 0.49 1.27 -0.90 1.05 2.07 -1.69 -2.69 116.25 115.84 2gb3 h VAL 188 Ca 0.06 -1.62 -0.00 0.00 0.82 0.00 0.00 66.70 65.96 2gb3 h VAL 188 Cb 0.74 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.93 2gb3 h VAL 188 CO 0.06 0.54 0.56 -0.33 0.02 0.00 0.00 177.57 178.42 2gb3 h GLU 189 N 0.73 1.21 -0.47 1.57 3.07 -0.31 -1.41 114.58 118.97 2gb3 h GLU 189 Ca 0.04 -0.10 -0.07 0.00 -0.50 0.00 0.00 59.36 58.74 2gb3 h GLU 189 Cb 1.05 -0.26 -0.02 0.00 -0.84 0.00 0.00 28.75 28.68 2gb3 h GLU 189 CO 0.11 0.83 0.02 0.82 -1.40 0.00 0.00 179.01 179.39 2gb3 h ILE 190 N 1.24 1.26 -0.09 3.13 2.04 -1.37 -1.10 117.51 122.62 2gb3 h ILE 190 Ca 0.33 -1.03 0.03 0.00 1.00 0.00 0.00 64.86 65.19 2gb3 h ILE 190 Cb -0.08 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 2gb3 h ILE 190 CO -0.06 0.36 -0.07 0.00 0.00 0.00 0.00 178.15 178.38 2gb3 h ALA 191 N 0.93 0.02 -0.51 1.87 0.00 -1.09 -2.35 119.26 118.12 2gb3 h ALA 191 Ca 0.14 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 2gb3 h ALA 191 Cb 0.48 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2gb3 h ALA 191 CO 0.02 -0.53 0.17 0.93 0.00 0.00 0.00 179.25 179.85 2gb3 h GLU 192 N -0.07 0.79 -0.56 0.00 5.08 -1.18 0.39 114.58 119.02 2gb3 h GLU 192 Ca 0.06 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2gb3 h GLU 192 Cb 0.16 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 2gb3 h GLU 192 CO -0.14 0.72 0.35 0.00 -1.00 0.00 0.00 179.01 178.94 2gb3 h ARG 193 N 0.69 0.74 -0.56 2.33 3.08 -1.05 -2.85 114.38 116.77 2gb3 h ARG 193 Ca 0.17 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2gb3 h ARG 193 Cb 0.25 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.14 2gb3 h ARG 193 CO -0.01 0.51 0.00 0.72 -1.07 0.00 0.00 179.97 180.12 2gb3 n HIS 194 N -4.44 0.79 -3.57 3.04 8.25 -0.90 -4.99 115.22 113.41 2gb3 n HIS 194 Ca 0.05 -0.51 -0.23 0.00 -0.26 0.00 0.00 57.72 56.77 2gb3 n HIS 194 Cb 0.06 -0.03 0.08 0.00 1.12 0.00 0.00 29.99 31.22 2gb3 n HIS 194 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gb3 n GLY 195 N 1.10 -0.51 3.67 -1.41 0.00 -0.21 -5.02 105.19 102.83 2gb3 n GLY 195 Ca 0.19 0.23 -0.28 0.00 0.00 0.00 0.00 46.02 46.17 2gb3 n GLY 195 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gb3 s LEU 196 N -7.14 3.36 -0.05 0.99 1.43 0.12 -4.94 118.68 112.44 2gb3 s LEU 196 Ca 0.57 -0.33 -0.15 0.00 -1.03 0.00 0.00 54.13 53.20 2gb3 s LEU 196 Cb -0.25 -2.04 -0.05 0.00 0.03 0.00 0.00 46.19 43.88 2gb3 s LEU 196 CO 0.71 0.11 0.38 -0.36 0.23 0.00 0.00 176.35 177.42 2gb3 s PHE 197 N -1.60 3.65 -0.37 0.29 0.08 -1.11 -4.31 117.98 114.60 2gb3 s PHE 197 Ca 0.27 0.89 -0.12 0.00 0.12 0.00 0.00 56.93 58.09 2gb3 s PHE 197 Cb -0.10 -2.31 0.02 0.00 -0.57 0.00 0.00 43.02 40.05 2gb3 s PHE 197 CO 0.18 0.52 0.22 -1.17 -0.10 0.00 0.00 175.22 174.87 2gb3 s LEU 198 N -0.57 4.67 -0.41 -0.37 2.96 0.14 -1.01 118.68 124.09 2gb3 s LEU 198 Ca 0.22 -0.84 -0.16 0.00 -0.22 0.00 0.00 54.13 53.13 2gb3 s LEU 198 Cb -0.16 -2.06 0.02 0.00 0.50 0.00 0.00 46.19 44.49 2gb3 s LEU 198 CO 0.11 -0.35 0.36 -0.63 -1.32 0.00 0.00 176.35 174.52 2gb3 s ILE 199 N 1.60 5.18 -0.29 6.68 1.01 0.51 -0.64 121.20 135.26 2gb3 s ILE 199 Ca 0.03 -0.47 -0.05 0.00 0.00 0.00 0.00 60.65 60.16 2gb3 s ILE 199 Cb -0.19 -3.97 0.02 0.00 0.01 0.00 0.00 42.46 38.34 2gb3 s ILE 199 CO 0.08 -0.34 0.04 -0.69 0.00 0.00 0.00 174.94 174.03 2gb3 s VAL 200 N 1.90 3.60 -0.63 2.92 1.01 0.14 -1.73 120.40 127.62 2gb3 s VAL 200 Ca 0.08 -0.87 -0.24 0.00 0.00 0.00 0.00 61.98 60.95 2gb3 s VAL 200 Cb -0.18 -2.89 0.05 0.00 0.00 0.00 0.00 36.38 33.37 2gb3 s VAL 200 CO 0.12 0.07 1.01 -0.62 0.00 0.00 0.00 175.10 175.68 2gb3 s ASP 201 N 1.43 6.24 -0.51 3.32 -1.08 0.67 -1.47 116.67 125.27 2gb3 s ASP 201 Ca 0.01 -0.64 0.02 0.00 -0.52 0.00 0.00 52.55 51.42 2gb3 s ASP 201 Cb -0.17 -2.45 0.53 0.00 -1.46 0.00 0.00 42.92 39.36 2gb3 s ASP 201 CO 0.00 -1.43 1.83 -0.62 0.52 0.00 0.00 175.17 175.48 2gb3 n GLU 202 N 7.91 2.53 0.07 4.34 1.02 0.59 -0.98 120.64 136.13 2gb3 n GLU 202 Ca -0.00 -3.28 0.04 0.00 -0.02 0.00 0.00 57.16 53.89 2gb3 n GLU 202 Cb 0.47 -2.19 0.45 0.00 -0.02 0.00 0.00 31.44 30.15 2gb3 n GLU 202 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2gb3 h VAL 203 N 1.13 1.10 -0.42 2.62 2.07 -1.83 -2.46 116.25 118.46 2gb3 h VAL 203 Ca 0.54 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.79 2gb3 h VAL 203 Cb 1.66 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.15 2gb3 h VAL 203 CO 1.19 0.11 0.00 -1.22 0.02 0.00 0.00 177.57 177.67 2gb3 n TYR 204 N -4.45 0.55 -1.84 1.57 4.01 -1.26 -4.24 117.16 111.51 2gb3 n TYR 204 Ca 0.01 -0.28 -0.39 0.00 -0.16 0.00 0.00 57.90 57.09 2gb3 n TYR 204 Cb 0.10 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.16 2gb3 n TYR 204 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2gb3 s SER 205 N -1.18 5.72 0.00 7.72 1.04 -0.93 -1.24 113.70 124.83 2gb3 s SER 205 Ca 0.34 2.82 0.00 0.00 0.48 0.00 0.00 55.95 59.58 2gb3 s SER 205 Cb 0.18 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.66 2gb3 s SER 205 CO 0.25 -1.27 0.00 1.21 0.98 0.00 0.00 173.24 174.40 2gb3 n GLU 206 N -0.46 0.00 -2.82 4.02 4.07 -1.26 -4.90 120.64 119.29 2gb3 n GLU 206 Ca 0.07 0.00 -0.43 0.00 -0.06 0.00 0.00 57.16 56.74 2gb3 n GLU 206 Cb 0.43 0.00 0.01 0.00 -0.06 0.00 0.00 31.44 31.82 2gb3 n GLU 206 CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 2gb3 n ILE 207 N 0.00 5.10 -4.80 6.31 5.41 -0.37 -4.53 119.36 126.48 2gb3 n ILE 207 Ca 0.00 -5.53 -0.26 0.00 1.00 0.00 0.00 62.75 57.95 2gb3 n ILE 207 Cb 0.00 -2.14 -0.16 0.00 -0.71 0.00 0.00 39.64 36.63 2gb3 n ILE 207 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2gb3 s VAL 208 N -1.98 1.42 -0.11 1.39 1.01 -1.26 -0.21 120.40 120.65 2gb3 s VAL 208 Ca 0.33 -0.68 -0.06 0.00 0.00 0.00 0.00 61.98 61.58 2gb3 s VAL 208 Cb 0.06 -1.24 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 2gb3 s VAL 208 CO 0.08 0.41 -0.14 0.49 0.00 0.00 0.00 175.10 175.94 2gb3 n PHE 209 N 3.44 0.00 -3.93 5.22 3.72 0.76 -4.98 117.46 121.69 2gb3 n PHE 209 Ca -0.20 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 56.86 2gb3 n PHE 209 Cb 0.53 -0.40 -0.05 0.00 -0.94 0.00 0.00 39.48 38.61 2gb3 n PHE 209 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2gb3 s ARG 210 N -2.20 3.39 0.24 -1.08 3.52 -1.09 -5.02 118.95 116.70 2gb3 s ARG 210 Ca -0.16 -0.28 0.00 0.00 -0.13 0.00 0.00 55.73 55.16 2gb3 s ARG 210 Cb 0.06 -3.09 0.00 0.00 -1.56 0.00 0.00 34.95 30.36 2gb3 s ARG 210 CO 0.20 0.70 0.00 0.41 -0.81 0.00 0.00 175.30 175.80 2gb3 n GLY 211 N 1.30 -1.92 3.50 8.12 0.00 -1.26 -4.79 105.19 110.14 2gb3 n GLY 211 Ca -0.14 -1.29 -0.39 0.00 0.00 0.00 0.00 46.02 44.20 2gb3 n GLY 211 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gb3 s GLU 212 N -2.13 3.47 0.19 1.61 8.01 -1.26 -5.07 118.70 123.52 2gb3 s GLU 212 Ca 0.00 -0.65 -0.30 0.00 0.01 0.00 0.00 54.97 54.03 2gb3 s GLU 212 Cb 0.00 -3.69 -0.08 0.00 -4.31 0.00 0.00 34.13 26.05 2gb3 s GLU 212 CO 0.00 -0.41 1.09 0.12 0.01 0.00 0.00 175.26 176.07 2gb3 s PHE 213 N 1.68 3.62 -0.13 1.61 5.36 -1.26 -4.66 117.98 124.20 2gb3 s PHE 213 Ca 0.06 1.63 0.00 0.00 -0.96 0.00 0.00 56.93 57.66 2gb3 s PHE 213 Cb -0.17 -3.26 0.02 0.00 -0.34 0.00 0.00 43.02 39.27 2gb3 s PHE 213 CO 0.09 -0.53 -0.12 0.00 -1.46 0.00 0.00 175.22 173.19 2gb3 s ALA 214 N -0.38 1.65 0.54 11.12 0.00 -1.26 -5.03 121.76 128.40 2gb3 s ALA 214 Ca 0.48 -0.75 -0.21 0.00 0.00 0.00 0.00 51.96 51.49 2gb3 s ALA 214 Cb -0.29 -0.95 -0.05 0.00 0.00 0.00 0.00 23.12 21.83 2gb3 s ALA 214 CO 0.35 -0.30 1.21 0.45 0.00 0.00 0.00 175.76 177.47 2gb3 s SER 215 N 1.40 5.54 0.54 0.00 0.15 -1.26 -4.81 113.70 115.27 2gb3 s SER 215 Ca 0.02 2.41 0.25 0.00 0.70 0.00 0.00 55.95 59.33 2gb3 s SER 215 Cb -0.13 -2.60 1.55 0.00 -1.71 0.00 0.00 66.02 63.12 2gb3 s SER 215 CO -0.07 -1.35 2.16 0.00 1.20 0.00 0.00 173.24 175.17 2gb3 h ALA 216 N 1.36 1.55 0.00 5.45 0.00 -1.95 -0.42 119.26 125.25 2gb3 h ALA 216 Ca -0.50 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2gb3 h ALA 216 Cb 1.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2gb3 h ALA 216 CO 0.57 0.07 0.00 -0.07 0.00 0.00 0.00 179.25 179.82 2gb3 h LEU 217 N 0.00 0.00 -1.99 0.00 3.38 -1.96 -2.54 115.31 112.20 2gb3 h LEU 217 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2gb3 h LEU 217 Cb 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2gb3 h LEU 217 CO 0.01 0.00 -0.07 -1.28 0.09 0.00 0.00 178.44 177.19 2gb3 h SER 218 N 0.00 0.00 -2.95 -0.43 0.87 -1.43 -3.32 113.55 106.29 2gb3 h SER 218 Ca 0.00 0.00 -0.72 0.00 -1.23 0.00 0.00 61.79 59.84 2gb3 h SER 218 Cb 0.43 0.00 -0.21 0.00 -0.44 0.00 0.00 62.40 62.18 2gb3 h SER 218 CO 0.00 0.07 0.04 -0.63 -0.53 0.00 0.00 176.83 175.78 2gb3 s ILE 219 N -4.76 4.92 -0.47 2.23 1.09 -0.96 -5.01 121.20 118.25 2gb3 s ILE 219 Ca -0.04 -1.13 -0.27 0.00 -1.10 0.00 0.00 60.65 58.10 2gb3 s ILE 219 Cb 0.16 -4.46 -0.02 0.00 -1.06 0.00 0.00 42.46 37.08 2gb3 s ILE 219 CO 0.64 -1.07 1.83 -1.61 -0.10 0.00 0.00 174.94 174.63 2gb3 s GLU 220 N 2.41 2.97 0.02 2.79 2.02 -1.25 -4.93 118.70 122.73 2gb3 s GLU 220 Ca 0.10 1.03 0.00 0.00 0.02 0.00 0.00 54.97 56.12 2gb3 s GLU 220 Cb -0.25 -4.29 -0.02 0.00 0.10 0.00 0.00 34.13 29.67 2gb3 s GLU 220 CO 0.05 -2.30 -0.03 0.45 0.02 0.00 0.00 175.26 173.45 2gb3 s SER 221 N 7.14 0.30 0.00 -0.19 0.15 -1.26 -5.05 113.70 114.79 2gb3 s SER 221 Ca 0.74 -0.43 0.30 0.00 0.70 0.00 0.00 55.95 57.26 2gb3 s SER 221 Cb -0.17 0.07 1.55 0.00 -1.71 0.00 0.00 66.02 65.77 2gb3 s SER 221 CO 0.27 -0.24 2.03 0.47 1.20 0.00 0.00 173.24 176.98 2gb3 n ASP 222 N 1.81 0.55 -0.64 5.45 8.00 -1.26 -3.65 116.55 126.81 2gb3 n ASP 222 Ca -0.22 -1.13 0.07 0.00 0.71 0.00 0.00 54.79 54.22 2gb3 n ASP 222 Cb 0.56 -0.01 0.12 0.00 -0.02 0.00 0.00 41.12 41.76 2gb3 n ASP 222 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2gb3 n LYS 223 N -0.59 1.81 -3.53 -1.24 5.02 -1.26 -4.50 118.16 113.87 2gb3 n LYS 223 Ca 0.21 -1.71 -0.37 0.00 -2.02 0.00 0.00 58.31 54.43 2gb3 n LYS 223 Cb 0.21 -1.28 -0.07 0.00 -0.02 0.00 0.00 35.03 33.87 2gb3 n LYS 223 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2gb3 s VAL 224 N -1.05 5.24 -0.12 -0.18 1.01 -1.24 0.24 120.40 124.30 2gb3 s VAL 224 Ca 0.21 0.64 -0.00 0.00 0.00 0.00 0.00 61.98 62.83 2gb3 s VAL 224 Cb 0.13 -3.66 0.03 0.00 0.00 0.00 0.00 36.38 32.88 2gb3 s VAL 224 CO 0.18 0.45 -0.07 -0.69 0.00 0.00 0.00 175.10 174.96 2gb3 s VAL 225 N -0.02 1.03 -0.12 2.92 1.01 0.19 -4.43 120.40 120.99 2gb3 s VAL 225 Ca 0.19 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 61.80 2gb3 s VAL 225 Cb -0.14 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 2gb3 s VAL 225 CO 0.07 0.35 0.07 -0.69 0.00 0.00 0.00 175.10 174.90 2gb3 s VAL 226 N 1.70 4.89 -0.09 2.92 1.01 0.27 -0.68 120.40 130.43 2gb3 s VAL 226 Ca 0.05 -0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.02 2gb3 s VAL 226 Cb -0.13 -3.12 -0.02 0.00 0.00 0.00 0.00 36.38 33.11 2gb3 s VAL 226 CO -0.08 0.58 -0.14 -0.63 0.00 0.00 0.00 175.10 174.83 2gb3 s ILE 227 N -0.70 2.99 0.20 2.22 -1.09 -0.54 -0.45 121.20 123.83 2gb3 s ILE 227 Ca 0.12 -0.71 -0.04 0.00 -2.23 0.00 0.00 60.65 57.78 2gb3 s ILE 227 Cb -0.12 -2.21 -0.03 0.00 -1.58 0.00 0.00 42.46 38.52 2gb3 s ILE 227 CO 0.02 0.55 0.21 -0.62 -1.23 0.00 0.00 174.94 173.88 2gb3 s ASP 228 N -0.10 0.10 0.19 3.58 -1.08 -1.01 -0.30 116.67 118.06 2gb3 s ASP 228 Ca -0.02 -1.22 -0.21 0.00 -0.52 0.00 0.00 52.55 50.58 2gb3 s ASP 228 Cb -0.14 0.42 0.05 0.00 -1.46 0.00 0.00 42.92 41.79 2gb3 s ASP 228 CO 0.04 -0.90 0.60 -0.55 0.52 0.00 0.00 175.17 174.88 2gb3 s SER 229 N -3.10 -0.41 0.00 -0.34 0.15 -1.26 -1.44 113.70 107.30 2gb3 s SER 229 Ca 0.32 -0.26 0.25 0.00 0.70 0.00 0.00 55.95 56.95 2gb3 s SER 229 Cb 0.05 0.62 0.58 0.00 -1.71 0.00 0.00 66.02 65.56 2gb3 s SER 229 CO 0.09 -1.07 1.46 1.33 1.20 0.00 0.00 173.24 176.24 2gb3 n VAL 230 N -0.38 0.00 0.13 4.45 0.24 -1.02 -4.55 118.33 117.20 2gb3 n VAL 230 Ca -0.12 -0.08 0.06 0.00 -2.04 0.00 0.00 64.34 62.15 2gb3 n VAL 230 Cb 0.63 0.42 0.31 0.00 -1.47 0.00 0.00 33.84 33.73 2gb3 n VAL 230 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2gb3 n SER 231 N -0.95 0.29 0.00 -1.34 7.64 -1.26 -2.54 113.62 115.46 2gb3 n SER 231 Ca 0.09 0.53 0.00 0.00 1.01 0.00 0.00 58.87 60.51 2gb3 n SER 231 Cb 0.35 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 2gb3 n SER 231 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2gb3 n LYS 233 N -1.91 0.00 -0.15 1.43 5.02 -1.26 -1.23 118.16 120.06 2gb3 n LYS 233 Ca -0.01 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.33 2gb3 n LYS 233 Cb 0.25 0.00 0.12 0.00 -0.02 0.00 0.00 35.03 35.38 2gb3 n LYS 233 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2gb3 n PHE 234 N 0.00 0.38 -3.61 2.13 3.72 -1.05 -4.99 117.46 114.03 2gb3 n PHE 234 Ca 0.00 -0.52 -0.23 0.00 -0.05 0.00 0.00 57.45 56.66 2gb3 n PHE 234 Cb 0.00 -0.04 0.04 0.00 -0.94 0.00 0.00 39.48 38.54 2gb3 n PHE 234 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2gb3 n SER 235 N 0.25 -3.13 -2.47 4.37 2.88 -0.76 -4.35 113.62 110.42 2gb3 n SER 235 Ca 0.10 -0.85 -0.13 0.00 -1.33 0.00 0.00 58.87 56.66 2gb3 n SER 235 Cb 0.41 -4.11 0.03 0.00 -0.75 0.00 0.00 64.21 59.79 2gb3 n SER 235 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2gb3 n ALA 236 N -4.07 3.86 -0.33 -1.46 0.00 -0.36 -4.28 120.51 113.87 2gb3 n ALA 236 Ca -0.21 -3.35 0.12 0.00 0.00 0.00 0.00 53.44 50.00 2gb3 n ALA 236 Cb 0.65 -0.64 0.30 0.00 0.00 0.00 0.00 19.45 19.76 2gb3 n ALA 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gb3 n GLY 238 N -1.33 -0.98 0.21 0.00 0.00 -1.26 -3.39 105.19 98.45 2gb3 n GLY 238 Ca 0.22 -0.10 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 2gb3 n GLY 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gb3 h ALA 239 N 3.02 0.70 -5.74 4.61 0.00 -1.60 -3.48 119.26 116.77 2gb3 h ALA 239 Ca 0.00 -0.51 -0.35 0.00 0.00 0.00 0.00 54.91 54.05 2gb3 h ALA 239 Cb 0.20 -0.08 0.15 0.00 0.00 0.00 0.00 17.79 18.05 2gb3 h ALA 239 CO 0.00 0.69 -0.79 0.54 0.00 0.00 0.00 179.25 179.69 2gb3 n ARG 240 N -3.96 -6.17 -3.91 0.00 5.12 -1.22 -4.83 116.66 101.69 2gb3 n ARG 240 Ca -0.03 0.80 -0.27 0.00 -1.93 0.00 0.00 57.85 56.42 2gb3 n ARG 240 Cb 0.60 -5.72 -0.17 0.00 -1.16 0.00 0.00 32.46 26.01 2gb3 n ARG 240 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2gb3 s VAL 241 N -3.43 1.07 0.00 1.55 1.01 -1.26 -2.06 120.40 117.29 2gb3 s VAL 241 Ca 0.01 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 61.66 2gb3 s VAL 241 Cb -0.00 -1.09 0.00 0.00 0.00 0.00 0.00 36.38 35.29 2gb3 s VAL 241 CO 0.75 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.83 2gb3 n GLY 242 N 4.93 4.15 3.61 4.51 0.00 -0.46 -2.44 105.19 119.49 2gb3 n GLY 242 Ca -0.13 -1.35 -0.09 0.00 0.00 0.00 0.00 46.02 44.46 2gb3 n GLY 242 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gb3 s LEU 244 N -2.78 2.04 -0.05 0.00 0.20 -0.32 -2.40 118.68 115.37 2gb3 s LEU 244 Ca 0.06 -0.59 0.05 0.00 0.69 0.00 0.00 54.13 54.35 2gb3 s LEU 244 Cb -0.02 -1.39 -0.01 0.00 -0.43 0.00 0.00 46.19 44.33 2gb3 s LEU 244 CO -0.04 0.04 -0.21 -0.63 -0.29 0.00 0.00 176.35 175.22 2gb3 s ILE 245 N 0.99 1.76 -0.10 6.68 1.01 0.41 -1.04 121.20 130.91 2gb3 s ILE 245 Ca -0.03 -0.90 -0.30 0.00 0.00 0.00 0.00 60.65 59.41 2gb3 s ILE 245 Cb -0.15 -1.50 0.11 0.00 0.01 0.00 0.00 42.46 40.94 2gb3 s ILE 245 CO -0.05 0.50 0.89 0.28 0.00 0.00 0.00 174.94 176.56 2gb3 s THR 246 N -0.09 0.00 -1.50 2.92 -1.32 -0.91 -0.56 115.64 114.18 2gb3 s THR 246 Ca -0.03 0.00 0.25 0.00 -1.21 0.00 0.00 61.69 60.70 2gb3 s THR 246 Cb -0.12 -1.00 0.12 0.00 -1.51 0.00 0.00 72.50 69.99 2gb3 s THR 246 CO 0.03 0.00 1.42 0.54 -2.21 0.00 0.00 174.62 174.40 2gb3 n ARG 247 N 0.60 0.56 -2.46 7.08 1.74 -1.26 -4.60 116.66 118.32 2gb3 n ARG 247 Ca -0.12 -0.36 -0.41 0.00 -0.77 0.00 0.00 57.85 56.19 2gb3 n ARG 247 Cb 0.58 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.50 2gb3 n ARG 247 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2gb3 s ASN 248 N -2.69 6.05 0.44 0.55 3.84 -1.26 -4.86 114.94 117.01 2gb3 s ASN 248 Ca 0.18 -0.22 0.13 0.00 0.21 0.00 0.00 52.86 53.16 2gb3 s ASN 248 Cb 0.18 -2.55 0.96 0.00 -0.55 0.00 0.00 41.25 39.29 2gb3 s ASN 248 CO 0.61 -1.88 2.00 1.05 -2.79 0.00 0.00 177.10 176.09 2gb3 h GLU 249 N 10.80 0.12 -0.16 0.43 -0.00 -1.95 -2.42 114.58 121.40 2gb3 h GLU 249 Ca -0.27 -0.02 -0.08 0.00 -0.00 0.00 0.00 59.36 58.99 2gb3 h GLU 249 Cb 1.07 -0.02 -0.00 0.00 -0.00 0.00 0.00 28.75 29.80 2gb3 h GLU 249 CO 1.25 0.23 -0.20 0.93 -0.00 0.00 0.00 179.01 181.22 2gb3 h GLU 250 N 0.11 0.42 -0.15 1.06 3.07 -1.99 -1.92 114.58 115.18 2gb3 h GLU 250 Ca 0.03 -0.23 -0.00 0.00 -0.50 0.00 0.00 59.36 58.65 2gb3 h GLU 250 Cb 0.26 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 2gb3 h GLU 250 CO 0.02 0.81 0.09 1.25 -1.40 0.00 0.00 179.01 179.78 2gb3 h LEU 251 N 0.05 0.18 -1.27 1.33 6.46 -1.93 -0.52 115.31 119.61 2gb3 h LEU 251 Ca 0.02 -0.04 -0.04 0.00 -0.12 0.00 0.00 57.88 57.70 2gb3 h LEU 251 Cb 0.75 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.62 2gb3 h LEU 251 CO 0.05 0.17 0.10 -0.29 -0.62 0.00 0.00 178.44 177.85 2gb3 h ILE 252 N 0.18 1.18 -0.46 4.05 2.10 -1.49 0.99 117.51 124.05 2gb3 h ILE 252 Ca 0.05 -0.65 -0.09 0.00 1.08 0.00 0.00 64.86 65.25 2gb3 h ILE 252 Cb 0.02 0.76 -0.02 0.00 -1.09 0.00 0.00 36.82 36.50 2gb3 h ILE 252 CO -0.01 0.24 -0.08 -1.28 -1.08 0.00 0.00 178.15 175.93 2gb3 h SER 253 N 0.59 0.81 0.01 2.19 0.87 -0.82 -2.88 113.55 114.33 2gb3 h SER 253 Ca 0.14 -0.24 -0.20 0.00 -1.23 0.00 0.00 61.79 60.26 2gb3 h SER 253 Cb 0.22 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2gb3 h SER 253 CO -0.00 0.93 -0.72 0.45 -0.53 0.00 0.00 176.83 176.95 2gb3 h HIS 254 N 0.75 0.84 0.00 2.24 3.86 -0.43 -3.24 115.15 119.17 2gb3 h HIS 254 Ca 0.13 -0.36 -0.01 0.00 -1.16 0.00 0.00 60.37 58.97 2gb3 h HIS 254 Cb 0.57 -0.13 -0.00 0.00 1.06 0.00 0.00 27.41 28.91 2gb3 h HIS 254 CO 0.03 1.16 0.03 0.00 0.86 0.00 0.00 177.93 180.01 2gb3 n ALA 255 N -2.56 2.48 0.00 2.45 0.00 0.28 -3.66 120.51 119.50 2gb3 n ALA 255 Ca -0.06 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2gb3 n ALA 255 Cb 0.71 -1.74 0.00 0.00 0.00 0.00 0.00 19.45 18.42 2gb3 n ALA 255 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2gb3 n LYS 257 N 1.98 0.00 0.03 0.00 5.02 -1.22 -1.65 118.16 122.31 2gb3 n LYS 257 Ca 0.02 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.21 2gb3 n LYS 257 Cb 0.20 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.24 2gb3 n LYS 257 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2gb3 h LEU 258 N 0.00 0.59 -1.11 -0.35 3.38 -1.91 -2.85 115.31 113.06 2gb3 h LEU 258 Ca 0.00 -0.36 -0.07 0.00 0.09 0.00 0.00 57.88 57.54 2gb3 h LEU 258 Cb 0.00 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 2gb3 h LEU 258 CO 0.00 1.10 -0.09 0.00 0.09 0.00 0.00 178.44 179.54 2gb3 h ALA 259 N 0.90 1.26 -0.18 1.53 0.00 -1.65 -2.89 119.26 118.24 2gb3 h ALA 259 Ca -0.02 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.50 2gb3 h ALA 259 Cb 1.25 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2gb3 h ALA 259 CO 0.12 0.49 -0.47 1.96 0.00 0.00 0.00 179.25 181.35 2gb3 h GLN 260 N 0.49 0.45 -0.83 0.00 4.20 -1.81 -1.28 115.11 116.33 2gb3 h GLN 260 Ca 0.09 -0.25 -0.03 0.00 0.06 0.00 0.00 58.65 58.52 2gb3 h GLN 260 Cb 0.46 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.21 2gb3 h GLN 260 CO 0.02 0.83 0.39 0.78 -0.67 0.00 0.00 178.83 180.18 2gb3 h GLY 261 N 1.15 1.29 2.00 3.46 0.00 -1.30 -1.36 103.07 108.31 2gb3 h GLY 261 Ca 0.02 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 46.70 2gb3 h GLY 261 CO 0.08 0.61 0.00 -0.09 0.00 0.00 0.00 176.54 177.15 2gb3 h ARG 262 N 1.19 0.00 0.00 4.80 2.43 -1.44 -3.48 114.38 117.88 2gb3 h ARG 262 Ca 0.28 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 2gb3 h ARG 262 Cb 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2gb3 h ARG 262 CO -0.03 0.00 0.00 1.28 -1.51 0.00 0.00 179.97 179.71 2gb3 n LEU 263 N -2.85 0.00 -3.53 3.80 4.77 -0.49 -4.88 117.00 113.82 2gb3 n LEU 263 Ca 0.03 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.94 2gb3 n LEU 263 Cb 0.42 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.49 2gb3 n LEU 263 CO 0.30 0.00 0.73 0.00 -1.33 0.00 0.00 177.39 177.09 2gb3 s ALA 264 N 0.00 -1.85 0.92 -1.18 0.00 -1.26 -3.81 121.76 114.58 2gb3 s ALA 264 Ca 0.00 1.04 -0.14 0.00 0.00 0.00 0.00 51.96 52.86 2gb3 s ALA 264 Cb 0.00 0.36 0.17 0.00 0.00 0.00 0.00 23.12 23.66 2gb3 s ALA 264 CO 0.00 -0.70 1.28 -1.25 0.00 0.00 0.00 175.76 175.09 2gb3 s PRO 265 N -3.04 0.93 0.12 0.00 0.05 -1.26 -4.97 135.00 126.83 2gb3 s PRO 265 Ca 0.06 -0.37 -0.31 0.00 0.05 0.00 0.00 61.00 60.43 2gb3 s PRO 265 Cb -0.01 -1.90 -0.09 0.00 0.05 0.00 0.00 34.50 32.55 2gb3 s PRO 265 CO -0.08 -2.21 1.61 -2.14 0.05 0.00 0.00 177.00 174.23 2gb3 s PRO 266 N -5.79 4.21 0.05 0.56 0.02 -1.26 -4.69 135.00 128.10 2gb3 s PRO 266 Ca 0.71 2.35 -0.35 0.00 0.02 0.00 0.00 61.00 63.73 2gb3 s PRO 266 Cb -0.05 -3.36 -0.20 0.00 0.02 0.00 0.00 34.50 30.91 2gb3 s PRO 266 CO 0.52 -0.67 1.47 1.25 -0.33 0.00 0.00 177.00 179.24 2gb3 h LEU 267 N 7.62 -1.07 -1.26 -5.54 5.85 -1.94 -2.48 115.31 116.48 2gb3 h LEU 267 Ca -0.43 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.36 2gb3 h LEU 267 Cb 1.20 0.28 -0.04 0.00 0.37 0.00 0.00 40.66 42.47 2gb3 h LEU 267 CO 0.92 -0.73 0.51 -0.07 -0.34 0.00 0.00 178.44 178.73 2gb3 h LEU 268 N -1.33 0.83 -1.06 2.25 3.38 -1.95 -1.47 115.31 115.96 2gb3 h LEU 268 Ca -0.13 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 2gb3 h LEU 268 Cb 0.97 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2gb3 h LEU 268 CO 0.21 0.57 -0.17 -0.33 0.09 0.00 0.00 178.44 178.82 2gb3 h GLU 269 N 0.96 0.47 -0.32 1.13 4.39 -1.87 -1.65 114.58 117.68 2gb3 h GLU 269 Ca 0.31 -0.15 -0.13 0.00 0.34 0.00 0.00 59.36 59.73 2gb3 h GLU 269 Cb 0.04 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2gb3 h GLU 269 CO -0.09 0.63 -0.30 1.96 -1.16 0.00 0.00 179.01 180.06 2gb3 h GLN 270 N 0.43 0.77 -0.59 2.33 4.20 -0.81 -1.33 115.11 120.10 2gb3 h GLN 270 Ca 0.08 -0.40 0.03 0.00 0.06 0.00 0.00 58.65 58.42 2gb3 h GLN 270 Cb 0.54 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.29 2gb3 h GLN 270 CO 0.04 1.02 0.36 0.82 -0.67 0.00 0.00 178.83 180.40 2gb3 h ILE 271 N 0.54 1.05 -0.14 2.54 2.04 -1.00 -2.40 117.51 120.14 2gb3 h ILE 271 Ca 0.05 -0.24 -0.13 0.00 1.00 0.00 0.00 64.86 65.55 2gb3 h ILE 271 Cb 0.87 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 2gb3 h ILE 271 CO 0.07 0.13 -0.46 1.23 0.00 0.00 0.00 178.15 179.12 2gb3 h GLY 272 N 0.70 0.38 2.00 5.37 0.00 -1.27 -3.14 103.07 107.10 2gb3 h GLY 272 Ca 0.24 -0.40 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 2gb3 h GLY 272 CO -0.11 0.36 -0.16 1.76 0.00 0.00 0.00 176.54 178.39 2gb3 h SER 273 N 0.28 0.00 -0.50 0.19 0.02 -0.74 -2.42 113.55 110.39 2gb3 h SER 273 Ca 0.02 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 2gb3 h SER 273 Cb 0.93 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.44 2gb3 h SER 273 CO 0.08 0.16 0.20 0.58 -1.14 0.00 0.00 176.83 176.71 2gb3 h VAL 274 N 0.00 1.21 -0.31 2.27 2.07 -1.45 -1.62 116.25 118.42 2gb3 h VAL 274 Ca -0.00 -0.67 -0.18 0.00 0.82 0.00 0.00 66.70 66.66 2gb3 h VAL 274 Cb 0.37 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.71 2gb3 h VAL 274 CO 0.02 0.26 -0.52 1.23 0.02 0.00 0.00 177.57 178.58 2gb3 h GLY 275 N 0.93 0.98 0.92 2.17 0.00 -1.58 -2.97 103.07 103.52 2gb3 h GLY 275 Ca 0.19 -1.11 -0.02 0.00 0.00 0.00 0.00 47.33 46.38 2gb3 h GLY 275 CO -0.01 1.00 0.12 1.41 0.00 0.00 0.00 176.54 179.05 2gb3 h LEU 276 N 0.69 0.48 -2.09 3.11 3.38 -1.31 -2.90 115.31 116.67 2gb3 h LEU 276 Ca 0.02 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 2gb3 h LEU 276 Cb 1.13 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 2gb3 h LEU 276 CO 0.12 0.54 -0.04 -0.07 0.09 0.00 0.00 178.44 179.07 2gb3 h LEU 277 N 0.39 0.00 -1.14 1.67 3.38 -1.33 -2.45 115.31 115.84 2gb3 h LEU 277 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2gb3 h LEU 277 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2gb3 h LEU 277 CO -0.01 0.04 0.00 0.59 0.09 0.00 0.00 178.44 179.16 2gb3 n ASN 278 N -3.27 1.73 -4.71 -0.43 4.13 -1.10 -4.70 115.26 106.91 2gb3 n ASN 278 Ca -0.01 -1.66 -0.40 0.00 1.68 0.00 0.00 54.58 54.19 2gb3 n ASN 278 Cb 0.21 -0.07 0.02 0.00 -1.54 0.00 0.00 39.78 38.40 2gb3 n ASN 278 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2gb3 n LEU 279 N 0.36 4.39 -4.73 3.41 4.77 -0.92 -4.99 117.00 119.29 2gb3 n LEU 279 Ca 0.17 1.05 -0.29 0.00 -0.03 0.00 0.00 56.01 56.91 2gb3 n LEU 279 Cb 0.36 -1.51 0.18 0.00 -2.33 0.00 0.00 43.42 40.12 2gb3 n LEU 279 CO 0.14 -0.72 0.69 1.51 -1.33 0.00 0.00 177.39 177.68 2gb3 s ASP 280 N -0.68 2.51 0.31 -1.43 -4.77 -1.26 -4.96 116.67 106.39 2gb3 s ASP 280 Ca 0.65 0.83 -0.00 0.00 -3.30 0.00 0.00 52.55 50.72 2gb3 s ASP 280 Cb -0.47 -1.26 0.52 0.00 -1.09 0.00 0.00 42.92 40.61 2gb3 s ASP 280 CO 0.55 -3.16 1.96 0.44 0.70 0.00 0.00 175.17 175.66 2gb3 h ASP 281 N -1.92 0.89 -0.90 2.11 5.19 -2.01 -2.74 116.42 117.03 2gb3 h ASP 281 Ca -0.49 -0.01 0.14 0.00 -0.62 0.00 0.00 57.03 56.05 2gb3 h ASP 281 Cb 1.31 -0.21 -0.09 0.00 0.18 0.00 0.00 39.33 40.52 2gb3 h ASP 281 CO 0.50 0.62 0.51 0.28 -3.12 0.00 0.00 179.24 178.03 2gb3 h SER 282 N 1.03 0.67 -0.22 6.45 0.02 -1.99 -1.49 113.55 118.03 2gb3 h SER 282 Ca 0.32 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 2gb3 h SER 282 Cb -0.00 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 2gb3 h SER 282 CO -0.09 0.31 0.14 0.15 -1.14 0.00 0.00 176.83 176.19 2gb3 h PHE 283 N 0.74 0.28 -0.19 3.45 3.57 -1.85 -1.81 116.94 121.13 2gb3 h PHE 283 Ca 0.48 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.90 2gb3 h PHE 283 Cb 0.63 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 2gb3 h PHE 283 CO -0.05 0.20 -0.25 0.74 -2.23 0.00 0.00 178.31 176.71 2gb3 h PHE 284 N 0.28 0.38 -0.57 0.41 0.04 -1.50 -1.98 116.94 114.00 2gb3 h PHE 284 Ca 0.08 -0.07 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 2gb3 h PHE 284 Cb -0.01 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.02 2gb3 h PHE 284 CO -0.06 0.57 0.22 -0.44 -0.60 0.00 0.00 178.31 178.01 2gb3 h ASP 285 N 0.31 0.79 -0.36 2.17 3.32 -1.06 -0.48 116.42 121.10 2gb3 h ASP 285 Ca 0.05 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 56.90 2gb3 h ASP 285 Cb 0.61 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 2gb3 h ASP 285 CO 0.04 0.75 0.15 0.15 -1.72 0.00 0.00 179.24 178.61 2gb3 h PHE 286 N 0.79 0.55 0.02 4.55 3.57 -0.92 -1.47 116.94 124.03 2gb3 h PHE 286 Ca 0.19 -0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.65 2gb3 h PHE 286 Cb 0.21 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.79 2gb3 h PHE 286 CO 0.01 0.51 -0.01 0.28 -2.23 0.00 0.00 178.31 176.86 2gb3 h VAL 287 N 0.44 1.14 -0.31 1.41 2.07 -1.22 -0.29 116.25 119.50 2gb3 h VAL 287 Ca 0.12 -0.51 0.04 0.00 0.82 0.00 0.00 66.70 67.17 2gb3 h VAL 287 Cb 0.18 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 2gb3 h VAL 287 CO -0.01 0.13 0.09 -0.09 0.02 0.00 0.00 177.57 177.71 2gb3 h ARG 288 N -0.25 0.21 0.00 1.57 2.43 -1.07 -2.15 114.38 115.12 2gb3 h ARG 288 Ca -0.00 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.05 2gb3 h ARG 288 Cb 0.24 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 2gb3 h ARG 288 CO 0.01 0.14 -0.51 0.93 -1.51 0.00 0.00 179.97 179.02 2gb3 h GLU 289 N 0.21 0.00 0.07 0.20 4.39 -1.23 -0.95 114.58 117.27 2gb3 h GLU 289 Ca 0.14 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.84 2gb3 h GLU 289 Cb 0.13 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2gb3 h GLU 289 CO -0.16 0.51 -0.03 1.15 -1.16 0.00 0.00 179.01 179.32 2gb3 h THR 290 N 0.00 1.05 0.00 1.13 2.02 -0.69 -2.29 112.91 114.12 2gb3 h THR 290 Ca -0.01 -0.42 -0.06 0.00 0.77 0.00 0.00 66.41 66.69 2gb3 h THR 290 Cb 0.95 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 68.68 2gb3 h THR 290 CO 0.07 0.11 -0.31 1.88 0.37 0.00 0.00 175.52 177.63 2gb3 h TYR 291 N -0.29 0.00 0.07 3.16 0.05 -1.28 -2.53 116.97 116.16 2gb3 h TYR 291 Ca -0.01 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.77 2gb3 h TYR 291 Cb 0.25 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.99 2gb3 h TYR 291 CO -0.01 0.31 -0.03 -0.09 -1.05 0.00 0.00 178.16 177.28 2gb3 h ARG 292 N 0.00 -0.09 -0.32 4.88 2.43 -0.99 -0.95 114.38 119.34 2gb3 h ARG 292 Ca -0.00 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.14 2gb3 h ARG 292 Cb 0.55 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.10 2gb3 h ARG 292 CO 0.04 0.10 0.03 0.93 -1.51 0.00 0.00 179.97 179.56 2gb3 h GLU 293 N -0.27 0.47 -0.01 0.20 5.08 -1.28 -0.85 114.58 117.92 2gb3 h GLU 293 Ca -0.01 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2gb3 h GLU 293 Cb 0.23 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 2gb3 h GLU 293 CO 0.02 0.48 -0.00 0.00 -1.00 0.00 0.00 179.01 178.50 2gb3 h ARG 294 N 0.46 0.02 -0.27 2.33 3.08 -1.29 -1.63 114.38 117.07 2gb3 h ARG 294 Ca 0.10 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.17 2gb3 h ARG 294 Cb 0.25 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 2gb3 h ARG 294 CO 0.00 0.41 0.11 0.28 -1.07 0.00 0.00 179.97 179.70 2gb3 h VAL 295 N -0.37 0.95 -0.72 2.04 2.07 -0.97 -2.29 116.25 116.96 2gb3 h VAL 295 Ca 0.00 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.51 2gb3 h VAL 295 Cb 0.40 0.69 -0.06 0.00 -1.52 0.00 0.00 31.29 30.81 2gb3 h VAL 295 CO 0.00 0.04 0.41 -0.33 0.02 0.00 0.00 177.57 177.71 2gb3 h GLU 296 N 0.24 0.71 -0.32 1.57 5.08 -1.16 -0.98 114.58 119.71 2gb3 h GLU 296 Ca 0.12 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.47 2gb3 h GLU 296 Cb 0.07 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 2gb3 h GLU 296 CO -0.11 0.47 0.11 1.15 -1.00 0.00 0.00 179.01 179.63 2gb3 h THR 297 N 0.74 0.91 -0.28 1.13 2.02 -0.87 -1.07 112.91 115.48 2gb3 h THR 297 Ca 0.32 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 67.39 2gb3 h THR 297 Cb 0.21 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 2gb3 h THR 297 CO -0.19 0.05 0.05 0.58 0.37 0.00 0.00 175.52 176.38 2gb3 h VAL 298 N 0.25 1.23 -0.73 3.16 2.07 -1.00 -1.89 116.25 119.33 2gb3 h VAL 298 Ca 0.15 -0.77 0.08 0.00 0.82 0.00 0.00 66.70 66.97 2gb3 h VAL 298 Cb 0.12 1.19 -0.06 0.00 -1.52 0.00 0.00 31.29 31.01 2gb3 h VAL 298 CO -0.15 0.25 0.41 -0.07 0.02 0.00 0.00 177.57 178.03 2gb3 h LEU 299 N 0.29 0.59 -0.37 2.57 3.38 -0.92 -0.07 115.31 120.77 2gb3 h LEU 299 Ca 0.09 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 2gb3 h LEU 299 Cb 0.32 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2gb3 h LEU 299 CO 0.00 0.36 0.06 0.11 0.09 0.00 0.00 178.44 179.06 2gb3 h LYS 300 N 0.72 0.62 -0.33 1.13 1.57 -1.07 -2.01 116.57 117.21 2gb3 h LYS 300 Ca 0.34 -0.17 -0.09 0.00 -1.87 0.00 0.00 60.65 58.86 2gb3 h LYS 300 Cb 0.27 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 2gb3 h LYS 300 CO -0.22 0.69 -0.17 0.87 -0.57 0.00 0.00 179.45 180.05 2gb3 h LYS 301 N 0.46 0.60 -0.48 3.15 1.57 -0.77 -0.49 116.57 120.61 2gb3 h LYS 301 Ca 0.11 -0.20 -0.12 0.00 -1.87 0.00 0.00 60.65 58.57 2gb3 h LYS 301 Cb 0.37 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 2gb3 h LYS 301 CO 0.01 0.74 -0.16 -0.07 -0.57 0.00 0.00 179.45 179.39 2gb3 h LEU 302 N 0.54 0.97 -0.39 2.94 3.38 -0.97 -2.68 115.31 119.10 2gb3 h LEU 302 Ca 0.09 -0.38 -0.11 0.00 0.09 0.00 0.00 57.88 57.57 2gb3 h LEU 302 Cb 0.59 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2gb3 h LEU 302 CO 0.04 1.13 -0.17 1.05 0.09 0.00 0.00 178.44 180.59 2gb3 h GLU 303 N 0.81 0.81 0.00 1.13 4.11 -1.07 -2.17 114.58 118.20 2gb3 h GLU 303 Ca 0.12 -0.34 -0.02 0.00 0.07 0.00 0.00 59.36 59.18 2gb3 h GLU 303 Cb 0.73 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 2gb3 h GLU 303 CO 0.06 0.97 -0.09 0.93 0.07 0.00 0.00 179.01 180.95 2gb3 h GLU 304 N 0.62 0.00 -0.63 1.06 5.08 -1.06 -2.13 114.58 117.52 2gb3 h GLU 304 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2gb3 h GLU 304 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 2gb3 h GLU 304 CO 0.05 0.09 0.00 0.72 -1.00 0.00 0.00 179.01 178.87 2gb3 n HIS 305 N -4.27 0.85 -0.96 4.33 8.25 -1.02 -4.92 115.22 117.48 2gb3 n HIS 305 Ca -0.03 -0.32 0.00 0.00 -0.26 0.00 0.00 57.72 57.11 2gb3 n HIS 305 Cb 0.17 -0.19 0.00 0.00 1.12 0.00 0.00 29.99 31.09 2gb3 n HIS 305 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gb3 n GLY 306 N 0.62 0.58 3.69 -1.41 0.00 -0.80 -5.00 105.19 102.88 2gb3 n GLY 306 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 2gb3 n GLY 306 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2gb3 s LEU 307 N 0.00 4.30 -0.16 0.99 0.20 -0.83 -4.94 118.68 118.23 2gb3 s LEU 307 Ca 0.00 1.86 -0.13 0.00 0.69 0.00 0.00 54.13 56.55 2gb3 s LEU 307 Cb 0.00 -3.56 -0.05 0.00 -0.43 0.00 0.00 46.19 42.15 2gb3 s LEU 307 CO 0.00 -0.57 -0.24 2.29 -0.29 0.00 0.00 176.35 177.54 2gb3 n LYS 308 N 5.01 0.49 -2.65 1.98 0.00 -1.26 -4.35 118.16 117.38 2gb3 n LYS 308 Ca 0.11 0.39 -0.42 0.00 -0.00 0.00 0.00 58.31 58.39 2gb3 n LYS 308 Cb 0.46 -1.58 -0.03 0.00 -0.00 0.00 0.00 35.03 33.88 2gb3 n LYS 308 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2gb3 s ARG 309 N -2.52 3.48 0.07 -1.58 0.52 -1.26 -4.95 118.95 112.70 2gb3 s ARG 309 Ca -0.22 -1.05 -0.09 0.00 -0.52 0.00 0.00 55.73 53.85 2gb3 s ARG 309 Cb 0.03 -4.97 0.00 0.00 0.52 0.00 0.00 34.95 30.54 2gb3 s ARG 309 CO 0.32 -2.09 0.20 -0.59 0.02 0.00 0.00 175.30 173.17 2gb3 s PHE 310 N 4.62 0.09 -0.10 -0.53 -0.71 -1.26 -0.21 117.98 119.89 2gb3 s PHE 310 Ca 0.40 -0.42 -0.06 0.00 -1.04 0.00 0.00 56.93 55.81 2gb3 s PHE 310 Cb -0.04 -0.03 -0.04 0.00 -1.21 0.00 0.00 43.02 41.70 2gb3 s PHE 310 CO -0.04 -0.50 0.13 0.95 -1.34 0.00 0.00 175.22 174.42 2gb3 s THR 311 N -3.29 5.35 -0.47 -4.49 -4.23 -0.63 -5.01 115.64 102.87 2gb3 s THR 311 Ca 0.01 0.09 -0.18 0.00 -1.18 0.00 0.00 61.69 60.43 2gb3 s THR 311 Cb 0.02 -3.35 0.05 0.00 1.34 0.00 0.00 72.50 70.56 2gb3 s THR 311 CO -0.08 0.57 0.51 -0.54 -0.54 0.00 0.00 174.62 174.54 2gb3 s LYS 312 N -1.17 3.08 0.41 3.99 1.02 -1.26 -4.52 119.74 121.30 2gb3 s LYS 312 Ca 0.17 -0.94 -0.24 0.00 0.02 0.00 0.00 55.97 54.98 2gb3 s LYS 312 Cb -0.12 -4.06 -0.09 0.00 -0.52 0.00 0.00 37.83 33.05 2gb3 s LYS 312 CO 0.06 -1.04 1.06 -1.25 -0.92 0.00 0.00 175.35 173.26 2gb3 s PRO 313 N 2.23 4.09 0.13 -1.68 0.04 -1.26 -4.95 135.00 133.60 2gb3 s PRO 313 Ca 0.12 1.54 0.23 0.00 0.04 0.00 0.00 61.00 62.93 2gb3 s PRO 313 Cb -0.19 -2.49 0.16 0.00 0.04 0.00 0.00 34.50 32.01 2gb3 s PRO 313 CO 0.11 -0.21 1.16 0.43 0.04 0.00 0.00 177.00 178.52 2gb3 n SER 314 N -0.19 0.73 -3.24 6.66 7.64 0.57 -4.78 113.62 121.01 2gb3 n SER 314 Ca 0.06 0.13 -0.09 0.00 1.01 0.00 0.00 58.87 59.97 2gb3 n SER 314 Cb 0.50 0.41 0.00 0.00 -1.01 0.00 0.00 64.21 64.11 2gb3 n SER 314 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2gb3 s GLY 315 N -3.91 0.38 0.11 0.23 0.00 -0.71 -0.17 107.32 103.25 2gb3 s GLY 315 Ca 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 44.02 2gb3 s GLY 315 CO 0.76 -0.35 0.00 0.00 0.00 0.00 0.00 173.10 173.52 2gb3 n ALA 316 N -0.51 -1.21 -1.84 3.20 0.00 0.71 -4.52 120.51 116.35 2gb3 n ALA 316 Ca -0.06 0.15 -0.06 0.00 0.00 0.00 0.00 53.44 53.47 2gb3 n ALA 316 Cb 0.60 -0.42 0.13 0.00 0.00 0.00 0.00 19.45 19.76 2gb3 n ALA 316 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 2gb3 n PHE 317 N -2.31 1.07 -4.47 0.00 1.16 -1.26 -4.92 117.46 106.72 2gb3 n PHE 317 Ca 0.00 -1.74 -0.30 0.00 -1.87 0.00 0.00 57.45 53.54 2gb3 n PHE 317 Cb 0.21 -0.28 -0.12 0.00 -1.61 0.00 0.00 39.48 37.69 2gb3 n PHE 317 CO 0.00 0.00 0.00 0.71 -1.87 0.00 0.00 176.76 175.60 2gb3 s TYR 318 N -3.25 2.59 -0.11 2.97 2.02 -1.26 -0.63 117.35 119.69 2gb3 s TYR 318 Ca 0.42 -0.23 0.00 0.00 -0.37 0.00 0.00 57.07 56.89 2gb3 s TYR 318 Cb 0.38 -1.43 0.02 0.00 -0.40 0.00 0.00 41.96 40.54 2gb3 s TYR 318 CO -0.03 0.33 -0.09 0.42 -1.57 0.00 0.00 175.55 174.61 2gb3 s ILE 319 N -1.04 1.08 -0.17 2.71 1.01 -0.10 -4.61 121.20 120.08 2gb3 s ILE 319 Ca 0.17 -0.34 -0.08 0.00 0.00 0.00 0.00 60.65 60.40 2gb3 s ILE 319 Cb -0.11 -1.06 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 2gb3 s ILE 319 CO 0.08 0.37 0.09 -0.89 0.00 0.00 0.00 174.94 174.59 2gb3 s THR 320 N 1.48 5.06 0.00 2.92 2.01 -1.26 -0.26 115.64 125.59 2gb3 s THR 320 Ca 0.01 0.06 -0.05 0.00 0.31 0.00 0.00 61.69 62.02 2gb3 s THR 320 Cb -0.13 -3.26 -0.00 0.00 0.01 0.00 0.00 72.50 69.11 2gb3 s THR 320 CO -0.06 0.50 0.09 0.00 -0.69 0.00 0.00 174.62 174.46 2gb3 s ALA 321 N -0.00 -0.21 -0.24 7.40 0.00 -0.49 -1.60 121.76 126.62 2gb3 s ALA 321 Ca 0.07 -0.20 -0.10 0.00 0.00 0.00 0.00 51.96 51.73 2gb3 s ALA 321 Cb -0.12 0.08 -0.05 0.00 0.00 0.00 0.00 23.12 23.04 2gb3 s ALA 321 CO 0.00 -0.18 0.16 -1.21 0.00 0.00 0.00 175.76 174.53 2gb3 s GLU 322 N -1.23 4.07 0.25 0.00 8.01 0.71 -0.93 118.70 129.58 2gb3 s GLU 322 Ca -0.13 -0.27 0.03 0.00 0.01 0.00 0.00 54.97 54.61 2gb3 s GLU 322 Cb -0.07 -3.53 -0.03 0.00 -4.31 0.00 0.00 34.13 26.19 2gb3 s GLU 322 CO 0.01 0.08 0.40 -0.51 0.01 0.00 0.00 175.26 175.24 2gb3 s LEU 323 N 1.01 4.24 -1.27 1.80 1.43 -0.46 -4.52 118.68 120.90 2gb3 s LEU 323 Ca 0.07 0.21 -0.06 0.00 -1.03 0.00 0.00 54.13 53.32 2gb3 s LEU 323 Cb -0.13 -3.01 0.05 0.00 0.03 0.00 0.00 46.19 43.13 2gb3 s LEU 323 CO 0.04 -0.11 2.61 -0.81 0.23 0.00 0.00 176.35 178.32 2gb3 n PRO 324 N -1.31 4.09 -4.16 1.29 -0.04 -1.26 -4.87 135.00 128.73 2gb3 n PRO 324 Ca -0.07 -2.96 -0.12 0.00 -0.04 0.00 0.00 63.50 60.30 2gb3 n PRO 324 Cb 0.56 -2.60 -0.10 0.00 -0.04 0.00 0.00 33.50 31.31 2gb3 n PRO 324 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2gb3 s VAL 325 N -0.37 0.78 -0.01 0.52 -7.23 -1.26 -5.05 120.40 107.77 2gb3 s VAL 325 Ca 0.59 -1.75 -0.26 0.00 -1.81 0.00 0.00 61.98 58.75 2gb3 s VAL 325 Cb 0.21 -1.47 -0.20 0.00 0.56 0.00 0.00 36.38 35.48 2gb3 s VAL 325 CO -0.09 -0.72 1.32 1.05 -0.31 0.00 0.00 175.10 176.35 2gb3 h GLU 326 N 3.31 0.00 -4.13 4.82 9.09 -1.94 -3.44 114.58 122.30 2gb3 h GLU 326 Ca -0.36 -0.00 -0.55 0.00 0.05 0.00 0.00 59.36 58.50 2gb3 h GLU 326 Cb 1.18 -0.00 -0.38 0.00 -1.65 0.00 0.00 28.75 27.90 2gb3 h GLU 326 CO 0.58 0.43 -0.79 0.34 0.05 0.00 0.00 179.01 179.63 2gb3 s ASP 327 N -5.64 2.72 0.19 3.06 -1.08 -1.26 -4.40 116.67 110.26 2gb3 s ASP 327 Ca -0.16 -0.61 -0.08 0.00 -0.52 0.00 0.00 52.55 51.18 2gb3 s ASP 327 Cb 0.02 -0.88 0.09 0.00 -1.46 0.00 0.00 42.92 40.69 2gb3 s ASP 327 CO 0.67 -0.18 1.63 0.00 0.52 0.00 0.00 175.17 177.81 2gb3 h ALA 328 N 8.14 0.83 -0.20 3.66 0.00 -0.66 -2.84 119.26 128.19 2gb3 h ALA 328 Ca -0.24 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.30 2gb3 h ALA 328 Cb 1.11 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2gb3 h ALA 328 CO 0.39 0.67 -0.04 1.49 0.00 0.00 0.00 179.25 181.76 2gb3 h GLU 329 N 0.93 0.29 -0.38 0.00 4.81 -1.89 0.13 114.58 118.47 2gb3 h GLU 329 Ca 0.16 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.20 2gb3 h GLU 329 Cb 0.61 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 2gb3 h GLU 329 CO 0.04 0.36 -0.27 1.49 -0.73 0.00 0.00 179.01 179.90 2gb3 h GLU 330 N 0.29 0.85 -0.48 1.92 4.81 -1.90 -2.54 114.58 117.53 2gb3 h GLU 330 Ca 0.06 -0.41 -0.10 0.00 -0.13 0.00 0.00 59.36 58.79 2gb3 h GLU 330 Cb 0.27 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 2gb3 h GLU 330 CO 0.01 1.05 -0.10 0.35 -0.73 0.00 0.00 179.01 179.59 2gb3 h PHE 331 N 0.65 0.97 -0.52 0.92 3.57 -1.18 -0.92 116.94 120.43 2gb3 h PHE 331 Ca 0.07 -0.18 -0.03 0.00 3.53 0.00 0.00 57.97 61.36 2gb3 h PHE 331 Cb 0.84 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 2gb3 h PHE 331 CO 0.06 0.93 0.22 0.00 -2.23 0.00 0.00 178.31 177.29 2gb3 h ALA 332 N 1.09 0.67 -0.44 2.41 0.00 -0.92 -2.90 119.26 119.17 2gb3 h ALA 332 Ca 0.13 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2gb3 h ALA 332 Cb 0.62 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2gb3 h ALA 332 CO 0.04 0.27 -0.06 0.07 0.00 0.00 0.00 179.25 179.58 2gb3 h ARG 333 N 0.70 0.81 -1.96 0.00 -0.00 -1.35 -3.18 114.38 109.39 2gb3 h ARG 333 Ca 0.17 -0.29 0.00 0.00 -0.00 0.00 0.00 59.98 59.87 2gb3 h ARG 333 Cb 0.18 -0.06 0.00 0.00 -0.00 0.00 0.00 29.97 30.09 2gb3 h ARG 333 CO -0.02 0.90 0.00 1.87 -0.00 0.00 0.00 179.97 182.73 2gb3 n TRP 334 N -4.34 0.00 0.00 4.08 -0.00 -0.36 -1.39 117.44 115.43 2gb3 n TRP 334 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 2gb3 n TRP 334 Cb 0.34 -0.15 0.00 0.00 -0.00 0.00 0.00 31.31 31.50 2gb3 n TRP 334 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 2gb3 n LEU 336 N 1.32 0.00 0.01 5.87 4.77 -1.20 -0.93 117.00 126.83 2gb3 n LEU 336 Ca 0.00 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.96 2gb3 n LEU 336 Cb 0.00 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 2gb3 n LEU 336 CO 0.00 0.00 0.05 0.71 -1.33 0.00 0.00 177.39 176.82 2gb3 h THR 337 N 0.00 0.00 -0.86 -5.08 1.35 -1.49 -3.41 112.91 103.43 2gb3 h THR 337 Ca 0.00 -0.89 -0.39 0.00 -0.55 0.00 0.00 66.41 64.58 2gb3 h THR 337 Cb 0.00 0.00 -0.23 0.00 -1.73 0.00 0.00 68.15 66.19 2gb3 h THR 337 CO 0.00 0.00 0.47 0.47 -0.25 0.00 0.00 175.52 176.21 2gb3 n ASP 338 N -4.81 4.02 -3.67 5.36 9.92 -0.11 -4.98 116.55 122.28 2gb3 n ASP 338 Ca -0.02 -3.49 -0.14 0.00 -0.53 0.00 0.00 54.79 50.61 2gb3 n ASP 338 Cb 0.05 -0.79 -0.08 0.00 -0.64 0.00 0.00 41.12 39.66 2gb3 n ASP 338 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 2gb3 s PHE 339 N -3.19 -0.57 0.05 1.24 5.36 -1.18 -5.10 117.98 114.59 2gb3 s PHE 339 Ca 0.55 1.31 -0.07 0.00 -0.96 0.00 0.00 56.93 57.76 2gb3 s PHE 339 Cb 0.46 0.23 0.02 0.00 -0.34 0.00 0.00 43.02 43.39 2gb3 s PHE 339 CO 0.11 -0.35 0.32 0.09 -1.46 0.00 0.00 175.22 173.93 2gb3 n ASN 340 N 2.33 -0.53 0.00 6.13 5.03 -1.26 -4.61 115.26 122.36 2gb3 n ASN 340 Ca -0.15 -1.27 0.00 0.00 0.87 0.00 0.00 54.58 54.03 2gb3 n ASN 340 Cb 0.56 0.85 0.00 0.00 -1.02 0.00 0.00 39.78 40.18 2gb3 n ASN 340 CO 0.00 0.00 0.00 -0.90 -1.83 0.00 0.00 177.26 174.53 2gb3 n ASP 342 N -0.78 0.00 -1.05 6.41 5.68 -1.26 -4.56 116.55 120.99 2gb3 n ASP 342 Ca -0.01 0.00 -0.13 0.00 -0.50 0.00 0.00 54.79 54.16 2gb3 n ASP 342 Cb 0.18 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.11 2gb3 n ASP 342 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2gb3 n GLY 343 N 0.00 1.17 3.20 6.12 0.00 -1.26 -5.00 105.19 109.42 2gb3 n GLY 343 Ca 0.00 -0.42 -0.19 0.00 0.00 0.00 0.00 46.02 45.42 2gb3 n GLY 343 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gb3 s GLU 344 N -3.29 0.91 0.13 1.61 2.02 -1.26 -1.42 118.70 117.39 2gb3 s GLU 344 Ca 0.00 -1.06 -0.08 0.00 0.02 0.00 0.00 54.97 53.85 2gb3 s GLU 344 Cb 0.00 -0.90 -0.01 0.00 0.10 0.00 0.00 34.13 33.32 2gb3 s GLU 344 CO 0.00 0.19 0.22 -0.08 0.02 0.00 0.00 175.26 175.61 2gb3 s THR 345 N -1.54 0.11 0.00 3.63 -1.32 -0.91 -4.30 115.64 111.31 2gb3 s THR 345 Ca 0.02 -1.34 0.00 0.00 -1.21 0.00 0.00 61.69 59.16 2gb3 s THR 345 Cb -0.08 -1.63 0.00 0.00 -1.51 0.00 0.00 72.50 69.28 2gb3 s THR 345 CO 0.03 -0.48 0.00 0.41 -2.21 0.00 0.00 174.62 172.36 2gb3 n THR 346 N -0.13 0.00 0.00 5.08 -1.04 -1.26 -0.44 114.28 116.48 2gb3 n THR 346 Ca -0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 2gb3 n THR 346 Cb 0.63 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.14 2gb3 n THR 346 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2gb3 n VAL 348 N 0.00 0.00 -3.58 12.58 0.24 -1.26 -4.83 118.33 121.48 2gb3 n VAL 348 Ca 0.00 0.00 -0.39 0.00 -2.04 0.00 0.00 64.34 61.91 2gb3 n VAL 348 Cb 0.00 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.26 2gb3 n VAL 348 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2gb3 s ALA 349 N -2.00 3.50 0.37 2.33 0.00 -1.04 -4.77 121.76 120.15 2gb3 s ALA 349 Ca 0.00 -1.20 -0.28 0.00 0.00 0.00 0.00 51.96 50.48 2gb3 s ALA 349 Cb 0.00 -2.52 -0.11 0.00 0.00 0.00 0.00 23.12 20.49 2gb3 s ALA 349 CO 0.00 -0.70 1.45 -2.14 0.00 0.00 0.00 175.76 174.37 2gb3 s PRO 350 N 1.74 4.13 0.00 0.00 0.02 -1.26 -0.35 135.00 139.28 2gb3 s PRO 350 Ca 0.07 2.51 0.29 0.00 0.02 0.00 0.00 61.00 63.88 2gb3 s PRO 350 Cb -0.16 -2.97 1.18 0.00 0.02 0.00 0.00 34.50 32.56 2gb3 s PRO 350 CO 0.10 -0.49 1.87 -0.11 -0.33 0.00 0.00 177.00 178.04 2gb3 n LEU 351 N 0.49 0.14 0.24 -5.54 7.94 -0.55 -3.98 117.00 115.73 2gb3 n LEU 351 Ca 0.01 0.32 0.10 0.00 -1.11 0.00 0.00 56.01 55.33 2gb3 n LEU 351 Cb 0.40 -0.38 0.68 0.00 0.53 0.00 0.00 43.42 44.65 2gb3 n LEU 351 CO 0.63 0.03 1.09 0.08 -1.11 0.00 0.00 177.39 178.11 2gb3 h ARG 352 N 0.08 0.00 0.00 1.96 0.11 -1.72 -0.85 114.38 113.95 2gb3 h ARG 352 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2gb3 h ARG 352 Cb 0.44 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.52 2gb3 h ARG 352 CO 0.00 0.00 0.00 0.41 0.10 0.00 0.00 179.97 180.48 2gb3 n GLY 353 N -1.52 -1.18 0.57 0.08 0.00 -1.26 -2.73 105.19 99.14 2gb3 n GLY 353 Ca -0.02 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 2gb3 n GLY 353 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2gb3 n PHE 354 N -1.83 0.00 -4.61 1.61 3.01 -0.32 -4.62 117.46 110.70 2gb3 n PHE 354 Ca 0.03 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.19 2gb3 n PHE 354 Cb 0.22 -0.01 -0.13 0.00 -0.01 0.00 0.00 39.48 39.55 2gb3 n PHE 354 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 2gb3 s TYR 355 N -2.08 2.49 -0.20 1.38 1.51 -1.11 -0.79 117.35 118.56 2gb3 s TYR 355 Ca 0.33 -0.30 -0.06 0.00 -1.01 0.00 0.00 57.07 56.04 2gb3 s TYR 355 Cb 0.20 -1.41 -0.21 0.00 -0.11 0.00 0.00 41.96 40.44 2gb3 s TYR 355 CO 0.36 0.26 0.06 1.28 -1.11 0.00 0.00 175.55 176.40 2gb3 n LEU 356 N 1.39 2.62 -4.68 -1.29 4.77 -1.26 -4.90 117.00 113.64 2gb3 n LEU 356 Ca -0.16 0.12 -0.45 0.00 -0.03 0.00 0.00 56.01 55.49 2gb3 n LEU 356 Cb 0.52 -1.00 -0.04 0.00 -2.33 0.00 0.00 43.42 40.58 2gb3 n LEU 356 CO 0.26 0.80 1.45 0.41 -1.33 0.00 0.00 177.39 178.98 2gb3 n THR 357 N -3.57 0.43 -2.18 -5.08 -1.04 -1.26 -4.91 114.28 96.67 2gb3 n THR 357 Ca -0.39 -0.08 -0.41 0.00 -2.04 0.00 0.00 64.05 61.13 2gb3 n THR 357 Cb 0.97 -1.98 -0.03 0.00 -1.82 0.00 0.00 70.33 67.48 2gb3 n THR 357 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2gb3 s PRO 358 N 3.08 4.41 0.00 -2.82 0.04 -1.26 -3.19 135.00 135.26 2gb3 s PRO 358 Ca 0.86 2.13 0.00 0.00 0.04 0.00 0.00 61.00 64.03 2gb3 s PRO 358 Cb -0.57 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 30.87 2gb3 s PRO 358 CO 0.42 -0.13 0.00 0.41 0.04 0.00 0.00 177.00 177.74 2gb3 n GLY 359 N 1.03 3.34 3.79 0.56 0.00 -1.26 -5.06 105.19 107.58 2gb3 n GLY 359 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 2gb3 n GLY 359 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gb3 s LEU 360 N 0.00 4.35 -0.37 0.99 1.43 -1.19 -3.91 118.68 119.98 2gb3 s LEU 360 Ca 0.00 1.75 0.00 0.00 -1.03 0.00 0.00 54.13 54.85 2gb3 s LEU 360 Cb 0.00 -3.91 0.00 0.00 0.03 0.00 0.00 46.19 42.31 2gb3 s LEU 360 CO 0.00 -0.04 0.00 0.61 0.23 0.00 0.00 176.35 177.15 2gb3 n GLY 361 N 0.62 0.52 0.27 -3.19 0.00 -1.26 -4.56 105.19 97.59 2gb3 n GLY 361 Ca 0.01 -0.85 -0.08 0.00 0.00 0.00 0.00 46.02 45.10 2gb3 n GLY 361 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gb3 h LYS 362 N 0.00 0.80 -0.57 1.61 1.57 -1.93 -2.81 116.57 115.25 2gb3 h LYS 362 Ca -0.08 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 2gb3 h LYS 362 Cb 0.52 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.79 2gb3 h LYS 362 CO 0.11 0.95 0.00 1.63 -0.57 0.00 0.00 179.45 181.57 2gb3 n LYS 363 N -4.11 2.78 -4.08 3.15 5.02 -1.26 0.05 118.16 119.70 2gb3 n LYS 363 Ca 0.00 -2.40 -0.27 0.00 -2.02 0.00 0.00 58.31 53.61 2gb3 n LYS 363 Cb 0.44 -1.44 -0.06 0.00 -0.02 0.00 0.00 35.03 33.94 2gb3 n LYS 363 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2gb3 s GLU 364 N -1.01 2.85 0.09 1.97 2.02 -1.20 -1.36 118.70 122.06 2gb3 s GLU 364 Ca 0.38 -0.85 0.00 0.00 0.02 0.00 0.00 54.97 54.53 2gb3 s GLU 364 Cb 0.20 -2.64 -0.04 0.00 0.10 0.00 0.00 34.13 31.75 2gb3 s GLU 364 CO 0.26 0.50 -0.02 0.96 0.02 0.00 0.00 175.26 176.98 2gb3 s ILE 365 N -1.66 0.38 -0.05 -1.63 -4.36 -0.11 -1.48 121.20 112.29 2gb3 s ILE 365 Ca 0.30 -1.88 0.06 0.00 -0.26 0.00 0.00 60.65 58.87 2gb3 s ILE 365 Cb -0.10 -1.73 -0.02 0.00 1.25 0.00 0.00 42.46 41.86 2gb3 s ILE 365 CO 0.23 -0.81 -0.24 -0.60 0.24 0.00 0.00 174.94 173.76 2gb3 s ARG 366 N -3.92 2.43 -0.15 0.37 3.52 0.53 -1.40 118.95 120.34 2gb3 s ARG 366 Ca 0.13 -0.89 0.01 0.00 -0.13 0.00 0.00 55.73 54.86 2gb3 s ARG 366 Cb 0.07 -2.16 0.00 0.00 -1.56 0.00 0.00 34.95 31.30 2gb3 s ARG 366 CO -0.05 0.46 -0.18 0.42 -0.81 0.00 0.00 175.30 175.14 2gb3 s ILE 367 N -0.35 2.42 -0.26 4.11 1.01 0.64 -2.50 121.20 126.28 2gb3 s ILE 367 Ca 0.02 -0.86 -0.11 0.00 0.00 0.00 0.00 60.65 59.70 2gb3 s ILE 367 Cb -0.12 -2.00 -0.05 0.00 0.01 0.00 0.00 42.46 40.30 2gb3 s ILE 367 CO 0.02 0.53 0.21 0.00 0.00 0.00 0.00 174.94 175.69 2gb3 s ALA 368 N 0.79 3.56 -1.36 9.38 0.00 0.43 -0.92 121.76 133.65 2gb3 s ALA 368 Ca -0.06 -0.98 -0.10 0.00 0.00 0.00 0.00 51.96 50.82 2gb3 s ALA 368 Cb -0.15 -2.46 0.11 0.00 0.00 0.00 0.00 23.12 20.62 2gb3 s ALA 368 CO -0.00 -0.43 2.11 0.00 0.00 0.00 0.00 175.76 177.44 2gb3 n VAL 370 N 3.63 2.66 -4.11 0.00 0.24 -1.26 -4.93 118.33 114.56 2gb3 n VAL 370 Ca 0.49 -3.41 -0.11 0.00 -2.04 0.00 0.00 64.34 59.27 2gb3 n VAL 370 Cb 0.35 -0.74 -0.11 0.00 -1.47 0.00 0.00 33.84 31.87 2gb3 n VAL 370 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2gb3 s LEU 371 N -3.47 2.39 0.47 1.34 1.43 -1.26 -4.09 118.68 115.49 2gb3 s LEU 371 Ca 0.49 -0.79 -0.24 0.00 -1.03 0.00 0.00 54.13 52.56 2gb3 s LEU 371 Cb 0.42 -0.08 -0.08 0.00 0.03 0.00 0.00 46.19 46.48 2gb3 s LEU 371 CO 0.00 -0.36 1.36 1.21 0.23 0.00 0.00 176.35 178.79 2gb3 n GLU 372 N 0.67 1.99 -0.33 1.70 0.00 -1.26 -4.63 120.64 118.78 2gb3 n GLU 372 Ca -0.17 0.71 0.23 0.00 0.00 0.00 0.00 57.16 57.93 2gb3 n GLU 372 Cb 0.58 -2.54 0.45 0.00 0.00 0.00 0.00 31.44 29.93 2gb3 n GLU 372 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.13 178.70 2gb3 h LYS 373 N 1.96 0.30 -0.44 5.31 2.10 -1.94 -1.19 116.57 122.67 2gb3 h LYS 373 Ca -0.50 -0.02 -0.12 0.00 -2.00 0.00 0.00 60.65 58.01 2gb3 h LYS 373 Cb 1.29 -0.07 -0.01 0.00 -0.90 0.00 0.00 32.23 32.54 2gb3 h LYS 373 CO 0.59 0.20 -0.20 -0.44 -2.00 0.00 0.00 179.45 177.60 2gb3 h ASP 374 N 0.31 0.94 -0.53 7.07 5.19 -1.99 -1.04 116.42 126.36 2gb3 h ASP 374 Ca 0.71 -0.40 -0.06 0.00 -0.62 0.00 0.00 57.03 56.66 2gb3 h ASP 374 Cb 1.61 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 40.84 2gb3 h ASP 374 CO -0.62 1.13 0.08 -0.07 -3.12 0.00 0.00 179.24 176.65 2gb3 h LEU 375 N 0.75 0.84 -0.56 1.55 3.38 -1.62 -2.10 115.31 117.55 2gb3 h LEU 375 Ca 0.10 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 57.85 2gb3 h LEU 375 Cb 0.77 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 2gb3 h LEU 375 CO 0.06 0.89 0.31 -0.07 0.09 0.00 0.00 178.44 179.72 2gb3 h LEU 376 N 0.76 0.48 -0.77 1.67 3.38 -1.16 0.45 115.31 120.13 2gb3 h LEU 376 Ca 0.16 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.15 2gb3 h LEU 376 Cb 0.41 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 2gb3 h LEU 376 CO 0.01 0.33 0.50 0.77 0.09 0.00 0.00 178.44 180.14 2gb3 h SER 377 N 0.61 0.90 -0.35 -0.43 4.64 -1.01 -0.85 113.55 117.05 2gb3 h SER 377 Ca 0.24 -0.03 -0.06 0.00 -0.47 0.00 0.00 61.79 61.47 2gb3 h SER 377 Cb 0.09 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 2gb3 h SER 377 CO -0.13 0.66 -0.01 -0.09 -0.87 0.00 0.00 176.83 176.39 2gb3 h ARG 378 N 1.05 0.63 -0.68 4.77 9.65 -0.67 -1.99 114.38 127.15 2gb3 h ARG 378 Ca 0.28 -0.21 0.05 0.00 -1.10 0.00 0.00 59.98 59.00 2gb3 h ARG 378 Cb -0.10 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 28.38 2gb3 h ARG 378 CO -0.06 0.75 0.45 0.00 2.80 0.00 0.00 179.97 183.91 2gb3 h ALA 379 N 0.86 1.68 -0.02 2.80 0.00 0.34 -1.37 119.26 123.55 2gb3 h ALA 379 Ca 0.10 -0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.77 2gb3 h ALA 379 Cb 0.47 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2gb3 h ALA 379 CO 0.02 0.23 -0.87 0.82 0.00 0.00 0.00 179.25 179.45 2gb3 h ILE 380 N 0.75 1.41 -0.56 0.00 1.08 -0.97 -2.18 117.51 117.04 2gb3 h ILE 380 Ca 0.28 -2.39 0.01 0.00 -0.39 0.00 0.00 64.86 62.37 2gb3 h ILE 380 Cb 0.16 2.34 -0.03 0.00 -3.07 0.00 0.00 36.82 36.22 2gb3 h ILE 380 CO -0.08 0.71 0.37 0.44 -0.69 0.00 0.00 178.15 178.90 2gb3 h ASP 381 N 0.23 0.64 -0.64 1.72 3.32 -0.57 -2.71 116.42 118.41 2gb3 h ASP 381 Ca -0.06 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 56.91 2gb3 h ASP 381 Cb 1.49 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.85 2gb3 h ASP 381 CO 0.15 0.46 0.15 0.58 -1.72 0.00 0.00 179.24 178.86 2gb3 h VAL 382 N 0.76 1.26 0.00 -1.35 2.07 -1.26 -1.65 116.25 116.08 2gb3 h VAL 382 Ca 0.20 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.78 2gb3 h VAL 382 Cb -0.09 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 2gb3 h VAL 382 CO -0.04 0.36 0.00 -0.11 0.02 0.00 0.00 177.57 177.79 2gb3 n LEU 383 N -4.30 0.36 0.00 2.57 7.94 -0.82 -1.79 117.00 120.95 2gb3 n LEU 383 Ca 0.04 -0.18 0.00 0.00 -1.11 0.00 0.00 56.01 54.76 2gb3 n LEU 383 Cb 0.25 -0.14 0.00 0.00 0.53 0.00 0.00 43.42 44.06 2gb3 n LEU 383 CO 0.42 0.08 0.00 -1.84 -1.11 0.00 0.00 177.39 174.94 2gb3 n GLU 385 N 0.42 0.00 -0.10 1.96 0.28 -0.62 -1.11 120.64 121.47 2gb3 n GLU 385 Ca 0.00 0.00 -0.11 0.00 -0.16 0.00 0.00 57.16 56.89 2gb3 n GLU 385 Cb 0.08 0.00 0.02 0.00 1.43 0.00 0.00 31.44 32.97 2gb3 n GLU 385 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 2gb3 h GLY 386 N 0.00 0.94 1.51 -1.84 0.00 -1.61 -3.03 103.07 99.03 2gb3 h GLY 386 Ca 0.00 -0.93 -0.08 0.00 0.00 0.00 0.00 47.33 46.32 2gb3 h GLY 386 CO 0.00 0.84 -0.13 -2.00 0.00 0.00 0.00 176.54 175.25 2gb3 h LEU 387 N 0.71 0.58 -1.21 3.11 5.85 -1.38 -1.63 115.31 121.34 2gb3 h LEU 387 Ca 0.07 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.62 2gb3 h LEU 387 Cb 0.93 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.80 2gb3 h LEU 387 CO 0.09 0.74 0.00 0.29 -0.34 0.00 0.00 178.44 179.21 2gb3 n LYS 388 N -4.18 0.41 0.00 1.25 4.01 -1.15 -3.63 118.16 114.87 2gb3 n LYS 388 Ca 0.01 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.81 2gb3 n LYS 388 Cb 0.35 -1.22 0.00 0.00 -0.51 0.00 0.00 35.03 33.64 2gb3 n LYS 388 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2gb3 n PHE 390 N 0.40 0.00 -2.00 2.13 7.35 -0.61 -5.11 117.46 119.61 2gb3 n PHE 390 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2gb3 n PHE 390 Cb 0.12 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.95 2gb3 n PHE 390 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00