#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gbz n ASP 9 N 0.00 -3.18 -4.15 0.53 10.43 -1.26 -4.99 116.55 113.93 2gbz n ASP 9 Ca 0.00 0.00 -0.24 0.00 2.57 0.00 0.00 54.79 57.12 2gbz n ASP 9 Cb 0.00 -1.30 -0.15 0.00 1.84 0.00 0.00 41.12 41.51 2gbz n ASP 9 CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 2gbz s ARG 10 N -0.56 1.28 0.01 -1.24 0.52 -1.26 -0.48 118.95 117.23 2gbz s ARG 10 Ca 0.00 -0.60 0.06 0.00 -0.52 0.00 0.00 55.73 54.67 2gbz s ARG 10 Cb 0.00 -1.25 -0.03 0.00 0.52 0.00 0.00 34.95 34.19 2gbz s ARG 10 CO 0.00 0.34 -0.16 -0.51 0.02 0.00 0.00 175.30 174.99 2gbz s LEU 11 N -0.45 2.68 -0.28 2.53 1.43 0.18 -4.62 118.68 120.15 2gbz s LEU 11 Ca 0.06 -0.33 -0.08 0.00 -1.03 0.00 0.00 54.13 52.75 2gbz s LEU 11 Cb -0.06 -1.56 -0.02 0.00 0.03 0.00 0.00 46.19 44.58 2gbz s LEU 11 CO -0.00 0.29 0.10 -0.63 0.23 0.00 0.00 176.35 176.33 2gbz s ILE 12 N -0.86 4.33 -0.07 -0.59 1.01 -1.26 -1.52 121.20 122.24 2gbz s ILE 12 Ca 0.14 -0.34 -0.04 0.00 0.00 0.00 0.00 60.65 60.42 2gbz s ILE 12 Cb -0.11 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.21 2gbz s ILE 12 CO 0.04 0.21 0.10 0.26 0.00 0.00 0.00 174.94 175.56 2gbz s TRP 13 N 1.59 3.43 0.00 3.97 0.52 0.80 -1.80 118.94 127.45 2gbz s TRP 13 Ca 0.05 0.36 -0.11 0.00 0.02 0.00 0.00 56.10 56.42 2gbz s TRP 13 Cb -0.16 -1.84 0.01 0.00 -1.15 0.00 0.00 33.47 30.33 2gbz s TRP 13 CO 0.04 0.62 0.22 -1.50 0.02 0.00 0.00 176.95 176.35 2gbz s ILE 14 N -1.08 0.08 -0.03 2.03 2.07 -0.66 -1.01 121.20 122.60 2gbz s ILE 14 Ca 0.18 -0.64 -0.11 0.00 -1.41 0.00 0.00 60.65 58.67 2gbz s ILE 14 Cb -0.12 -0.59 0.02 0.00 0.13 0.00 0.00 42.46 41.90 2gbz s ILE 14 CO 0.08 -0.35 0.24 -0.62 -1.91 0.00 0.00 174.94 172.38 2gbz s ASP 15 N -1.49 -0.14 0.11 4.50 2.15 -0.95 -4.62 116.67 116.23 2gbz s ASP 15 Ca -0.13 0.08 0.04 0.00 0.43 0.00 0.00 52.55 52.97 2gbz s ASP 15 Cb -0.06 0.32 -0.04 0.00 -0.30 0.00 0.00 42.92 42.85 2gbz s ASP 15 CO 0.02 -0.35 -0.10 -0.76 -0.17 0.00 0.00 175.17 173.80 2gbz s LEU 16 N -1.07 2.43 -0.02 -1.34 1.43 -1.26 -2.35 118.68 116.51 2gbz s LEU 16 Ca -0.11 -0.86 0.05 0.00 -1.03 0.00 0.00 54.13 52.17 2gbz s LEU 16 Cb -0.05 -0.31 -0.03 0.00 0.03 0.00 0.00 46.19 45.83 2gbz s LEU 16 CO 0.03 -0.28 -0.16 -1.61 0.23 0.00 0.00 176.35 174.55 2gbz s GLU 17 N -3.03 2.35 0.25 1.70 0.41 -0.56 -4.98 118.70 114.85 2gbz s GLU 17 Ca 0.08 -0.79 0.04 0.00 -0.41 0.00 0.00 54.97 53.88 2gbz s GLU 17 Cb -0.01 -2.30 -0.05 0.00 -1.78 0.00 0.00 34.13 29.98 2gbz s GLU 17 CO -0.00 0.59 0.01 -1.64 -0.49 0.00 0.00 175.26 173.73 2gbz s MET 18 N -0.93 1.42 0.35 1.61 -1.94 -1.26 -0.62 119.30 117.93 2gbz s MET 18 Ca 0.12 -1.74 0.18 0.00 -1.71 0.00 0.00 55.69 52.55 2gbz s MET 18 Cb -0.11 -0.69 0.55 0.00 2.01 0.00 0.00 34.83 36.59 2gbz s MET 18 CO 0.02 -0.11 1.67 1.79 -0.01 0.00 0.00 175.02 178.38 2gbz h THR 19 N 2.38 0.91 -0.81 2.05 1.35 -1.56 -3.46 112.91 113.77 2gbz h THR 19 Ca -0.39 -1.70 0.00 0.00 -0.55 0.00 0.00 66.41 63.77 2gbz h THR 19 Cb 1.23 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 69.69 2gbz h THR 19 CO 0.65 0.41 0.00 0.61 -0.25 0.00 0.00 175.52 176.94 2gbz n GLY 20 N 0.43 2.24 0.00 5.82 0.00 -1.26 -4.56 105.19 107.85 2gbz n GLY 20 Ca 0.00 -0.74 0.09 0.00 0.00 0.00 0.00 46.02 45.37 2gbz n GLY 20 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gbz n LEU 21 N 0.00 0.73 -4.57 0.99 4.77 -1.26 -4.88 117.00 112.77 2gbz n LEU 21 Ca 0.00 -0.42 -0.41 0.00 -0.03 0.00 0.00 56.01 55.15 2gbz n LEU 21 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 2gbz n LEU 21 CO 0.00 0.18 1.31 -0.62 -1.33 0.00 0.00 177.39 176.93 2gbz s ASP 22 N -2.95 6.02 0.00 -1.43 3.68 -1.26 -4.85 116.67 115.88 2gbz s ASP 22 Ca 0.05 0.37 0.02 0.00 2.13 0.00 0.00 52.55 55.11 2gbz s ASP 22 Cb 0.14 -2.54 0.07 0.00 -1.45 0.00 0.00 42.92 39.13 2gbz s ASP 22 CO 0.76 -1.78 1.04 0.35 0.13 0.00 0.00 175.17 175.67 2gbz n THR 23 N 6.94 1.86 -0.11 1.71 -2.24 -1.26 -0.83 114.28 120.34 2gbz n THR 23 Ca 0.14 0.46 -0.13 0.00 -2.27 0.00 0.00 64.05 62.25 2gbz n THR 23 Cb 0.49 -1.44 -0.14 0.00 -2.10 0.00 0.00 70.33 67.14 2gbz n THR 23 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2gbz n ASP 24 N -1.49 0.88 -0.08 3.42 8.00 -1.26 -4.73 116.55 121.28 2gbz n ASP 24 Ca 0.00 -0.06 -0.11 0.00 0.71 0.00 0.00 54.79 55.33 2gbz n ASP 24 Cb 0.02 0.39 -0.08 0.00 -0.02 0.00 0.00 41.12 41.43 2gbz n ASP 24 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2gbz n ARG 25 N -2.97 0.56 -1.06 -1.24 5.12 -0.93 -5.05 116.66 111.10 2gbz n ARG 25 Ca -0.38 0.08 -0.30 0.00 -1.93 0.00 0.00 57.85 55.33 2gbz n ARG 25 Cb 1.08 -1.33 0.16 0.00 -1.16 0.00 0.00 32.46 31.21 2gbz n ARG 25 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2gbz s ASP 26 N -5.50 2.99 0.14 0.55 -0.00 -0.01 -5.06 116.67 109.79 2gbz s ASP 26 Ca -0.21 1.54 0.08 0.00 -0.00 0.00 0.00 52.55 53.96 2gbz s ASP 26 Cb 0.06 -2.20 -0.04 0.00 -0.00 0.00 0.00 42.92 40.73 2gbz s ASP 26 CO 0.39 -2.95 -0.18 -0.55 -0.00 0.00 0.00 175.17 171.89 2gbz s SER 27 N -3.22 2.49 -0.13 0.27 0.15 -1.26 -4.92 113.70 107.08 2gbz s SER 27 Ca 0.65 -0.79 -0.29 0.00 0.70 0.00 0.00 55.95 56.21 2gbz s SER 27 Cb -0.19 -0.13 -0.01 0.00 -1.71 0.00 0.00 66.02 63.97 2gbz s SER 27 CO 0.58 -0.02 1.11 -0.63 1.20 0.00 0.00 173.24 175.48 2gbz s ILE 28 N -1.76 4.53 -0.24 6.45 1.01 -1.26 -1.31 121.20 128.61 2gbz s ILE 28 Ca 0.11 1.83 0.12 0.00 0.00 0.00 0.00 60.65 62.71 2gbz s ILE 28 Cb -0.07 -4.18 -0.17 0.00 0.01 0.00 0.00 42.46 38.05 2gbz s ILE 28 CO 0.05 -0.07 0.37 2.30 0.00 0.00 0.00 174.94 177.59 2gbz n ILE 29 N 4.90 0.00 -3.71 2.92 -5.35 0.21 -4.75 119.36 113.59 2gbz n ILE 29 Ca 0.11 -0.26 -0.14 0.00 -0.27 0.00 0.00 62.75 62.19 2gbz n ILE 29 Cb 0.47 0.54 -0.08 0.00 -1.74 0.00 0.00 39.64 38.82 2gbz n ILE 29 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2gbz s GLU 30 N -2.56 0.71 -0.00 6.28 2.12 -1.15 0.54 118.70 124.63 2gbz s GLU 30 Ca -0.01 0.09 -0.09 0.00 0.36 0.00 0.00 54.97 55.32 2gbz s GLU 30 Cb 0.08 0.32 0.01 0.00 0.26 0.00 0.00 34.13 34.80 2gbz s GLU 30 CO 0.50 -0.18 0.18 -1.50 -0.54 0.00 0.00 175.26 173.72 2gbz s ILE 31 N -0.92 0.08 -0.10 -3.70 2.07 -0.53 -1.50 121.20 116.60 2gbz s ILE 31 Ca -0.10 -0.64 -0.21 0.00 -1.41 0.00 0.00 60.65 58.29 2gbz s ILE 31 Cb -0.04 -0.48 0.05 0.00 0.13 0.00 0.00 42.46 42.13 2gbz s ILE 31 CO 0.04 -0.35 0.51 0.00 -1.91 0.00 0.00 174.94 173.23 2gbz s ALA 32 N -1.37 -1.29 0.07 1.50 0.00 -0.99 -1.65 121.76 118.02 2gbz s ALA 32 Ca -0.14 1.09 0.02 0.00 0.00 0.00 0.00 51.96 52.92 2gbz s ALA 32 Cb -0.07 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.70 2gbz s ALA 32 CO 0.02 -0.29 -0.06 0.95 0.00 0.00 0.00 175.76 176.38 2gbz s THR 33 N -0.66 0.56 -0.08 0.00 -4.23 -1.26 -2.24 115.64 107.73 2gbz s THR 33 Ca -0.07 -1.54 -0.06 0.00 -1.18 0.00 0.00 61.69 58.83 2gbz s THR 33 Cb -0.03 -1.18 0.03 0.00 1.34 0.00 0.00 72.50 72.65 2gbz s THR 33 CO 0.05 -0.68 0.19 -0.63 -0.54 0.00 0.00 174.62 173.01 2gbz s ILE 34 N -2.69 -0.01 -0.17 2.99 1.01 -0.18 -0.05 121.20 122.10 2gbz s ILE 34 Ca 0.02 0.05 -0.05 0.00 0.00 0.00 0.00 60.65 60.67 2gbz s ILE 34 Cb -0.01 -0.29 -0.03 0.00 0.01 0.00 0.00 42.46 42.14 2gbz s ILE 34 CO -0.03 0.02 -0.01 -0.69 0.00 0.00 0.00 174.94 174.23 2gbz s VAL 35 N 0.44 4.07 0.32 2.92 1.01 -0.34 -0.14 120.40 128.68 2gbz s VAL 35 Ca -0.03 -0.29 0.07 0.00 0.00 0.00 0.00 61.98 61.73 2gbz s VAL 35 Cb -0.04 -2.81 -0.06 0.00 0.00 0.00 0.00 36.38 33.46 2gbz s VAL 35 CO -0.02 0.47 -0.04 0.42 0.00 0.00 0.00 175.10 175.93 2gbz s THR 36 N 0.53 1.74 0.65 3.92 -4.23 -0.57 -0.48 115.64 117.20 2gbz s THR 36 Ca -0.01 -2.10 -0.07 0.00 -1.18 0.00 0.00 61.69 58.32 2gbz s THR 36 Cb -0.14 -2.63 0.14 0.00 1.34 0.00 0.00 72.50 71.22 2gbz s THR 36 CO 0.02 -0.19 0.89 -0.90 -0.54 0.00 0.00 174.62 173.90 2gbz n ASP 37 N -0.70 0.47 0.29 3.99 5.68 -0.37 -0.65 116.55 125.27 2gbz n ASP 37 Ca -0.05 -1.57 0.19 0.00 -0.50 0.00 0.00 54.79 52.86 2gbz n ASP 37 Cb 0.64 -0.64 0.87 0.00 -1.14 0.00 0.00 41.12 40.85 2gbz n ASP 37 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2gbz h ALA 38 N -1.31 1.00 -0.51 2.12 0.00 -1.13 -2.24 119.26 117.20 2gbz h ALA 38 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2gbz h ALA 38 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2gbz h ALA 38 CO 0.24 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.53 2gbz n GLN 39 N -3.03 2.81 -1.42 0.00 1.13 -1.26 -4.93 117.38 110.68 2gbz n GLN 39 Ca -0.01 -2.10 -0.09 0.00 -1.94 0.00 0.00 57.00 52.87 2gbz n GLN 39 Cb 0.21 -1.64 -0.03 0.00 0.11 0.00 0.00 30.24 28.89 2gbz n GLN 39 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2gbz n LEU 40 N 0.90 -0.78 -4.74 1.08 4.77 -0.84 -5.02 117.00 112.36 2gbz n LEU 40 Ca 0.19 0.18 -0.39 0.00 -0.03 0.00 0.00 56.01 55.96 2gbz n LEU 40 Cb 0.62 -1.52 -0.05 0.00 -2.33 0.00 0.00 43.42 40.14 2gbz n LEU 40 CO 0.16 -0.41 0.36 0.20 -1.33 0.00 0.00 177.39 176.38 2gbz s ASN 41 N -2.85 7.02 0.03 -1.43 0.01 -1.26 -4.83 114.94 111.62 2gbz s ASN 41 Ca 0.00 1.22 -0.30 0.00 -0.71 0.00 0.00 52.86 53.07 2gbz s ASN 41 Cb 0.00 -2.40 -0.06 0.00 0.41 0.00 0.00 41.25 39.20 2gbz s ASN 41 CO 0.00 0.02 1.36 -0.69 -1.51 0.00 0.00 177.10 176.28 2gbz s VAL 42 N 0.15 3.70 -0.19 1.60 1.01 -1.26 -1.24 120.40 124.18 2gbz s VAL 42 Ca 0.34 1.14 0.15 0.00 0.00 0.00 0.00 61.98 63.62 2gbz s VAL 42 Cb -0.18 -3.73 -0.23 0.00 0.00 0.00 0.00 36.38 32.24 2gbz s VAL 42 CO 0.19 0.03 0.04 0.18 0.00 0.00 0.00 175.10 175.53 2gbz n LEU 43 N 4.91 0.24 -3.62 3.92 4.77 0.36 -4.93 117.00 122.66 2gbz n LEU 43 Ca 0.12 -0.01 -0.08 0.00 -0.03 0.00 0.00 56.01 56.01 2gbz n LEU 43 Cb 0.44 0.36 -0.06 0.00 -2.33 0.00 0.00 43.42 41.83 2gbz n LEU 43 CO 0.58 0.50 0.86 0.00 -1.33 0.00 0.00 177.39 178.00 2gbz s ALA 44 N -2.46 -2.01 -0.19 -1.18 0.00 -1.02 -5.01 121.76 109.90 2gbz s ALA 44 Ca -0.11 1.73 -0.08 0.00 0.00 0.00 0.00 51.96 53.50 2gbz s ALA 44 Cb 0.06 -1.20 -0.04 0.00 0.00 0.00 0.00 23.12 21.93 2gbz s ALA 44 CO 0.75 -0.25 0.08 -1.21 0.00 0.00 0.00 175.76 175.13 2gbz s GLU 45 N -0.50 4.03 0.87 0.00 2.02 -1.26 -1.20 118.70 122.67 2gbz s GLU 45 Ca 0.02 -0.31 -0.13 0.00 0.02 0.00 0.00 54.97 54.57 2gbz s GLU 45 Cb -0.03 -3.27 0.20 0.00 0.10 0.00 0.00 34.13 31.14 2gbz s GLU 45 CO -0.05 0.28 1.19 0.41 0.02 0.00 0.00 175.26 177.12 2gbz n GLY 46 N 3.52 -1.16 3.77 -1.39 0.00 0.93 -4.99 105.19 105.87 2gbz n GLY 46 Ca -0.16 -1.75 -0.40 0.00 0.00 0.00 0.00 46.02 43.70 2gbz n GLY 46 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2gbz s PRO 47 N -5.58 4.23 -0.37 1.61 0.04 -1.26 -4.61 135.00 129.07 2gbz s PRO 47 Ca 0.69 2.08 -0.07 0.00 0.04 0.00 0.00 61.00 63.73 2gbz s PRO 47 Cb -0.02 -2.93 0.06 0.00 0.04 0.00 0.00 34.50 31.65 2gbz s PRO 47 CO 0.48 -0.24 0.17 -2.00 0.04 0.00 0.00 177.00 175.45 2gbz s GLU 48 N -1.96 2.59 -0.05 4.56 2.12 -1.26 -4.14 118.70 120.56 2gbz s GLU 48 Ca 0.52 -1.31 0.06 0.00 0.36 0.00 0.00 54.97 54.59 2gbz s GLU 48 Cb -0.37 -3.60 -0.02 0.00 0.26 0.00 0.00 34.13 30.40 2gbz s GLU 48 CO 0.48 -0.80 -0.22 -0.51 -0.54 0.00 0.00 175.26 173.67 2gbz s LEU 49 N 1.40 2.27 -0.03 2.70 2.01 -0.66 -4.98 118.68 121.39 2gbz s LEU 49 Ca 0.01 -0.41 -0.08 0.00 0.01 0.00 0.00 54.13 53.66 2gbz s LEU 49 Cb -0.21 -1.42 -0.05 0.00 0.01 0.00 0.00 46.19 44.52 2gbz s LEU 49 CO 0.02 0.29 0.25 0.00 1.01 0.00 0.00 176.35 177.92 2gbz s ALA 50 N -0.41 3.84 -0.19 4.21 0.00 -1.26 -1.45 121.76 126.50 2gbz s ALA 50 Ca 0.04 -0.55 -0.04 0.00 0.00 0.00 0.00 51.96 51.41 2gbz s ALA 50 Cb -0.12 -2.08 -0.02 0.00 0.00 0.00 0.00 23.12 20.90 2gbz s ALA 50 CO 0.02 0.62 -0.03 0.42 0.00 0.00 0.00 175.76 176.78 2gbz s ILE 51 N -1.18 3.74 -0.29 0.00 1.01 0.19 -4.56 121.20 120.11 2gbz s ILE 51 Ca 0.23 -0.39 -0.41 0.00 0.00 0.00 0.00 60.65 60.07 2gbz s ILE 51 Cb -0.13 -2.67 -0.17 0.00 0.01 0.00 0.00 42.46 39.50 2gbz s ILE 51 CO 0.12 0.45 1.66 0.00 0.00 0.00 0.00 174.94 177.17 2gbz n ALA 52 N 4.13 -0.60 -2.53 9.38 0.00 -0.49 -4.81 120.51 125.59 2gbz n ALA 52 Ca -0.17 0.43 -0.08 0.00 0.00 0.00 0.00 53.44 53.61 2gbz n ALA 52 Cb 0.52 -2.14 -0.10 0.00 0.00 0.00 0.00 19.45 17.74 2gbz n ALA 52 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2gbz s HIS 53 N 3.08 0.32 0.50 0.00 3.76 -1.23 -4.96 115.29 116.75 2gbz s HIS 53 Ca 0.98 -0.71 -0.18 0.00 -0.15 0.00 0.00 55.06 55.00 2gbz s HIS 53 Cb -1.16 -0.23 -0.08 0.00 1.11 0.00 0.00 32.58 32.22 2gbz s HIS 53 CO 0.67 -0.36 1.00 -1.54 -0.85 0.00 0.00 174.74 173.66 2gbz s SER 54 N -2.35 6.53 0.42 1.40 1.04 -1.26 -4.46 113.70 115.01 2gbz s SER 54 Ca -0.02 1.70 0.12 0.00 0.48 0.00 0.00 55.95 58.23 2gbz s SER 54 Cb 0.01 -2.53 0.97 0.00 0.10 0.00 0.00 66.02 64.57 2gbz s SER 54 CO -0.06 -0.65 1.97 0.25 0.98 0.00 0.00 173.24 175.72 2gbz h LEU 55 N 1.20 0.44 -1.13 2.42 7.12 -1.98 0.10 115.31 123.48 2gbz h LEU 55 Ca -0.48 0.01 -0.03 0.00 0.13 0.00 0.00 57.88 57.51 2gbz h LEU 55 Cb 1.19 -0.08 -0.03 0.00 -0.53 0.00 0.00 40.66 41.21 2gbz h LEU 55 CO 0.60 0.26 0.25 -0.08 -0.13 0.00 0.00 178.44 179.35 2gbz h GLU 56 N 0.49 0.87 -0.45 1.25 4.81 -1.99 -1.99 114.58 117.57 2gbz h GLU 56 Ca 0.30 -0.13 -0.15 0.00 -0.13 0.00 0.00 59.36 59.25 2gbz h GLU 56 Cb 0.51 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 2gbz h GLU 56 CO -0.09 0.70 -0.29 1.15 -0.73 0.00 0.00 179.01 179.75 2gbz h THR 57 N 0.86 1.27 -0.43 0.32 2.02 -1.35 -2.82 112.91 112.77 2gbz h THR 57 Ca 0.21 -1.46 -0.05 0.00 0.77 0.00 0.00 66.41 65.88 2gbz h THR 57 Cb 0.15 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 2gbz h THR 57 CO -0.02 0.50 0.08 -0.07 0.37 0.00 0.00 175.52 176.37 2gbz h LEU 58 N 0.83 0.67 -0.83 2.58 3.38 -1.09 -2.58 115.31 118.26 2gbz h LEU 58 Ca 0.09 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2gbz h LEU 58 Cb 0.88 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2gbz h LEU 58 CO 0.08 0.76 0.00 -0.33 0.09 0.00 0.00 178.44 179.04 2gbz h GLU 59 N 0.56 0.00 -0.00 1.13 5.08 -1.40 -2.27 114.58 117.69 2gbz h GLU 59 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2gbz h GLU 59 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2gbz h GLU 59 CO 0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 179.01 177.99 2gbz n ALA 60 N -1.84 2.46 -1.22 3.43 0.00 -0.98 -4.86 120.51 117.51 2gbz n ALA 60 Ca 0.02 -0.14 -0.29 0.00 0.00 0.00 0.00 53.44 53.04 2gbz n ALA 60 Cb 0.25 -1.46 0.18 0.00 0.00 0.00 0.00 19.45 18.42 2gbz n ALA 60 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2gbz s MET 61 N -2.79 0.25 0.00 0.00 -1.94 -0.86 -5.05 119.30 108.91 2gbz s MET 61 Ca 0.21 0.36 0.00 0.00 -1.71 0.00 0.00 55.69 54.55 2gbz s MET 61 Cb 0.20 -1.73 0.00 0.00 2.01 0.00 0.00 34.83 35.31 2gbz s MET 61 CO 0.50 -2.82 0.00 -0.25 -0.01 0.00 0.00 175.02 172.45 2gbz n ASP 62 N -4.21 0.00 -0.06 3.03 8.00 -1.26 -4.86 116.55 117.20 2gbz n ASP 62 Ca 0.06 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.44 2gbz n ASP 62 Cb 0.58 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.64 2gbz n ASP 62 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2gbz n GLU 63 N 0.00 0.29 -0.33 -1.24 4.71 -1.26 -4.11 120.64 118.70 2gbz n GLU 63 Ca 0.00 0.12 0.02 0.00 -0.01 0.00 0.00 57.16 57.29 2gbz n GLU 63 Cb 0.00 -0.99 0.16 0.00 -1.01 0.00 0.00 31.44 29.60 2gbz n GLU 63 CO 0.00 0.00 0.00 0.11 0.09 0.00 0.00 177.13 177.33 2gbz h TRP 64 N -0.51 1.03 0.27 -0.32 0.09 -1.99 -0.68 115.95 113.84 2gbz h TRP 64 Ca -0.25 0.03 0.01 0.00 0.09 0.00 0.00 58.89 58.76 2gbz h TRP 64 Cb 1.07 -0.33 -0.03 0.00 0.08 0.00 0.00 29.16 29.95 2gbz h TRP 64 CO -0.10 0.50 -0.35 -0.91 0.09 0.00 0.00 178.44 177.68 2gbz h ASN 65 N 0.99 -0.96 -0.35 0.11 2.35 -1.95 0.70 115.58 116.47 2gbz h ASN 65 Ca 0.40 0.09 0.06 0.00 -0.55 0.00 0.00 56.30 56.30 2gbz h ASN 65 Cb 0.23 0.34 -0.05 0.00 0.05 0.00 0.00 38.32 38.88 2gbz h ASN 65 CO -0.19 -0.47 0.01 0.03 -1.65 0.00 0.00 177.43 175.16 2gbz h ARG 66 N -0.67 0.11 -0.25 0.81 3.08 -1.53 -1.36 114.38 114.57 2gbz h ARG 66 Ca -0.00 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 2gbz h ARG 66 Cb 0.63 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 2gbz h ARG 66 CO -0.11 0.07 0.14 -0.91 -1.07 0.00 0.00 179.97 178.10 2gbz h ASN 67 N 0.11 0.31 0.10 7.04 4.21 -0.94 -1.28 115.58 125.14 2gbz h ASN 67 Ca 0.17 -0.07 0.01 0.00 1.21 0.00 0.00 56.30 57.62 2gbz h ASN 67 Cb 0.23 -0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 37.33 2gbz h ASN 67 CO -0.27 0.29 -0.12 -0.61 -1.29 0.00 0.00 177.43 175.43 2gbz h GLN 68 N 0.30 -0.24 0.00 0.81 5.75 -0.53 -0.78 115.11 120.42 2gbz h GLN 68 Ca 0.09 0.02 -0.06 0.00 -0.15 0.00 0.00 58.65 58.55 2gbz h GLN 68 Cb 0.04 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.64 2gbz h GLN 68 CO -0.02 -0.16 -0.28 0.45 -2.65 0.00 0.00 178.83 176.17 2gbz h HIS 69 N -0.25 0.00 0.13 3.99 3.86 -1.23 -1.20 115.15 120.44 2gbz h HIS 69 Ca 0.01 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 2gbz h HIS 69 Cb 0.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.73 2gbz h HIS 69 CO -0.13 0.28 -0.06 0.00 0.86 0.00 0.00 177.93 178.88 2gbz h ARG 70 N 0.00 -0.16 -0.57 2.45 2.47 -0.93 -1.42 114.38 116.22 2gbz h ARG 70 Ca -0.00 0.01 -0.02 0.00 -1.26 0.00 0.00 59.98 58.71 2gbz h ARG 70 Cb 0.56 0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.89 2gbz h ARG 70 CO 0.04 0.23 0.29 -0.09 0.56 0.00 0.00 179.97 181.00 2gbz h ARG 71 N -0.60 0.79 0.00 0.04 2.43 -0.95 -2.39 114.38 113.70 2gbz h ARG 71 Ca -0.02 -0.09 -0.07 0.00 -0.81 0.00 0.00 59.98 58.99 2gbz h ARG 71 Cb 0.47 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 2gbz h ARG 71 CO 0.03 0.60 -0.34 0.66 -1.51 0.00 0.00 179.97 179.41 2gbz h SER 72 N 0.80 0.00 0.00 -3.80 4.64 -1.25 -3.47 113.55 110.46 2gbz h SER 72 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2gbz h SER 72 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2gbz h SER 72 CO -0.03 0.34 0.00 0.61 -0.87 0.00 0.00 176.83 176.88 2gbz n GLY 73 N 0.81 0.62 0.28 -0.77 0.00 -0.79 -4.88 105.19 100.45 2gbz n GLY 73 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 2gbz n GLY 73 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2gbz h LEU 74 N 0.00 0.59 -0.81 0.99 5.85 -1.56 -2.58 115.31 117.78 2gbz h LEU 74 Ca 0.00 -0.11 0.12 0.00 0.84 0.00 0.00 57.88 58.73 2gbz h LEU 74 Cb 0.00 -0.15 -0.08 0.00 0.37 0.00 0.00 40.66 40.80 2gbz h LEU 74 CO 0.00 0.62 0.43 -0.25 -0.34 0.00 0.00 178.44 178.91 2gbz h TRP 75 N 0.60 0.77 -0.00 1.25 2.91 -1.63 0.06 115.95 119.92 2gbz h TRP 75 Ca 0.13 0.03 -0.20 0.00 1.13 0.00 0.00 58.89 59.99 2gbz h TRP 75 Cb 0.31 -0.22 -0.01 0.00 -0.51 0.00 0.00 29.16 28.73 2gbz h TRP 75 CO 0.01 0.26 -0.87 0.37 -1.03 0.00 0.00 178.44 177.18 2gbz h GLN 76 N 0.68 0.21 -0.26 2.65 5.75 -1.75 -3.02 115.11 119.37 2gbz h GLN 76 Ca 0.41 -0.23 -0.08 0.00 -0.15 0.00 0.00 58.65 58.60 2gbz h GLN 76 Cb 0.48 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.08 2gbz h GLN 76 CO -0.30 0.95 -0.20 0.00 -2.65 0.00 0.00 178.83 176.64 2gbz h ARG 77 N 0.12 0.48 -0.17 1.69 3.08 -0.93 -1.73 114.38 116.91 2gbz h ARG 77 Ca -0.04 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 59.81 2gbz h ARG 77 Cb 1.49 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.50 2gbz h ARG 77 CO 0.13 0.65 -0.05 0.28 -1.07 0.00 0.00 179.97 179.91 2gbz h VAL 78 N 0.43 1.30 -0.53 2.04 2.07 -0.98 0.13 116.25 120.70 2gbz h VAL 78 Ca 0.07 -1.05 -0.08 0.00 0.82 0.00 0.00 66.70 66.47 2gbz h VAL 78 Cb 0.59 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.98 2gbz h VAL 78 CO 0.04 0.31 0.02 -0.07 0.02 0.00 0.00 177.57 177.89 2gbz h LEU 79 N 0.03 0.86 0.00 2.57 4.07 -1.46 -2.88 115.31 118.49 2gbz h LEU 79 Ca 0.04 -0.21 0.00 0.00 0.08 0.00 0.00 57.88 57.79 2gbz h LEU 79 Cb 0.50 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 42.01 2gbz h LEU 79 CO 0.02 0.91 -0.11 0.47 -1.08 0.00 0.00 178.44 178.64 2gbz n ASP 80 N -4.21 0.75 -4.76 -0.43 10.43 -0.66 -4.91 116.55 112.76 2gbz n ASP 80 Ca 0.03 0.48 -0.39 0.00 2.57 0.00 0.00 54.79 57.49 2gbz n ASP 80 Cb 0.31 -0.60 0.01 0.00 1.84 0.00 0.00 41.12 42.67 2gbz n ASP 80 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 2gbz s SER 81 N -4.37 5.96 0.00 -2.24 0.15 0.03 -4.93 113.70 108.30 2gbz s SER 81 Ca 0.10 2.62 0.05 0.00 0.70 0.00 0.00 55.95 59.42 2gbz s SER 81 Cb 0.13 -2.63 0.10 0.00 -1.71 0.00 0.00 66.02 61.91 2gbz s SER 81 CO 0.62 -1.08 0.93 0.00 1.20 0.00 0.00 173.24 174.90 2gbz n GLN 82 N -0.35 1.63 -3.36 5.44 1.13 -1.26 -4.48 117.38 116.14 2gbz n GLN 82 Ca 0.06 -1.37 -0.38 0.00 -1.94 0.00 0.00 57.00 53.38 2gbz n GLN 82 Cb 0.45 -1.11 -0.06 0.00 0.11 0.00 0.00 30.24 29.63 2gbz n GLN 82 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2gbz s VAL 83 N -0.76 5.08 0.44 5.09 1.01 -1.26 -4.95 120.40 125.05 2gbz s VAL 83 Ca 0.09 0.96 0.08 0.00 0.00 0.00 0.00 61.98 63.11 2gbz s VAL 83 Cb 0.05 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.64 2gbz s VAL 83 CO 0.07 0.43 0.58 0.42 0.00 0.00 0.00 175.10 176.60 2gbz s THR 84 N -0.07 2.87 0.19 3.92 -4.23 -1.26 -1.39 115.64 115.67 2gbz s THR 84 Ca 0.26 -1.02 -0.12 0.00 -1.18 0.00 0.00 61.69 59.63 2gbz s THR 84 Cb -0.16 -2.90 0.11 0.00 1.34 0.00 0.00 72.50 70.89 2gbz s THR 84 CO 0.12 0.00 1.82 0.45 -0.54 0.00 0.00 174.62 176.47 2gbz h HIS 85 N 0.61 0.65 -0.68 3.99 3.86 -1.93 -1.00 115.15 120.65 2gbz h HIS 85 Ca -0.39 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 58.81 2gbz h HIS 85 Cb 1.28 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 29.51 2gbz h HIS 85 CO 0.41 0.35 0.29 0.00 0.86 0.00 0.00 177.93 179.85 2gbz h ALA 86 N 1.28 1.22 -0.36 2.45 0.00 -1.95 -0.97 119.26 120.92 2gbz h ALA 86 Ca 0.25 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 2gbz h ALA 86 Cb 0.07 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2gbz h ALA 86 CO -0.12 0.58 -0.22 1.96 0.00 0.00 0.00 179.25 181.45 2gbz h GLN 87 N 0.98 0.78 -0.62 0.00 4.20 -1.80 -1.48 115.11 117.18 2gbz h GLN 87 Ca 0.23 -0.36 -0.09 0.00 0.06 0.00 0.00 58.65 58.49 2gbz h GLN 87 Cb 0.16 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 2gbz h GLN 87 CO -0.02 0.98 0.04 0.00 -0.67 0.00 0.00 178.83 179.16 2gbz h ALA 88 N 0.78 0.90 -0.10 3.87 0.00 -1.00 -1.87 119.26 121.85 2gbz h ALA 88 Ca 0.07 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2gbz h ALA 88 Cb 0.77 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 2gbz h ALA 88 CO 0.06 0.66 0.05 1.49 0.00 0.00 0.00 179.25 181.51 2gbz h GLU 89 N 0.97 0.13 -0.70 0.00 4.81 -1.07 -1.62 114.58 117.11 2gbz h GLU 89 Ca 0.18 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 2gbz h GLU 89 Cb 0.51 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.83 2gbz h GLU 89 CO 0.02 0.17 0.45 0.00 -0.73 0.00 0.00 179.01 178.93 2gbz h ALA 90 N 0.96 0.89 -0.43 2.92 0.00 -1.11 -1.13 119.26 121.36 2gbz h ALA 90 Ca 0.03 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 2gbz h ALA 90 Cb 0.08 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2gbz h ALA 90 CO -0.01 0.32 -0.21 1.96 0.00 0.00 0.00 179.25 181.32 2gbz h GLN 91 N 0.95 0.85 -0.17 0.00 4.20 -1.20 -1.84 115.11 117.90 2gbz h GLN 91 Ca 0.26 -0.34 -0.03 0.00 0.06 0.00 0.00 58.65 58.59 2gbz h GLN 91 Cb -0.09 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 2gbz h GLN 91 CO -0.05 0.98 -0.02 1.15 -0.67 0.00 0.00 178.83 180.22 2gbz h THR 92 N 0.74 1.27 -0.95 -0.54 2.02 -1.00 -0.78 112.91 113.66 2gbz h THR 92 Ca 0.10 -0.92 0.06 0.00 0.77 0.00 0.00 66.41 66.42 2gbz h THR 92 Cb 0.74 1.54 -0.06 0.00 -1.74 0.00 0.00 68.15 68.63 2gbz h THR 92 CO 0.06 0.27 0.62 0.58 0.37 0.00 0.00 175.52 177.42 2gbz h VAL 93 N 0.04 1.09 -0.45 3.16 2.07 -1.17 0.05 116.25 121.04 2gbz h VAL 93 Ca 0.05 -0.38 -0.06 0.00 0.82 0.00 0.00 66.70 67.13 2gbz h VAL 93 Cb 0.42 -0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 2gbz h VAL 93 CO 0.01 0.20 0.06 0.00 0.02 0.00 0.00 177.57 177.86 2gbz h ALA 94 N 1.48 0.60 -0.03 1.67 0.00 -1.08 -0.05 119.26 121.84 2gbz h ALA 94 Ca 0.41 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 55.09 2gbz h ALA 94 Cb 0.17 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2gbz h ALA 94 CO -0.15 0.34 -0.01 0.35 0.00 0.00 0.00 179.25 179.78 2gbz h PHE 95 N 0.62 -0.01 -0.43 0.00 3.57 -0.22 -2.71 116.94 117.76 2gbz h PHE 95 Ca 0.14 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 2gbz h PHE 95 Cb 0.41 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 2gbz h PHE 95 CO 0.03 -0.01 0.18 -0.07 -2.23 0.00 0.00 178.31 176.21 2gbz h LEU 96 N 0.00 0.54 -1.69 0.59 3.38 -0.85 -2.65 115.31 114.63 2gbz h LEU 96 Ca 0.02 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2gbz h LEU 96 Cb 0.02 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2gbz h LEU 96 CO -0.03 0.49 0.03 1.23 0.09 0.00 0.00 178.44 180.24 2gbz h GLY 97 N 0.74 0.00 -1.44 0.83 0.00 -0.66 -0.42 103.07 102.13 2gbz h GLY 97 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2gbz h GLY 97 CO -0.02 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.70 2gbz n GLU 98 N -2.40 2.06 0.00 4.80 1.02 -1.00 -4.43 120.64 120.69 2gbz n GLU 98 Ca -0.02 -1.59 0.00 0.00 -0.02 0.00 0.00 57.16 55.53 2gbz n GLU 98 Cb 0.07 -1.45 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 2gbz n GLU 98 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 2gbz n TRP 99 N 0.83 0.00 -3.58 -0.32 7.02 -0.22 -5.12 117.44 116.04 2gbz n TRP 99 Ca 0.17 0.00 -0.14 0.00 -1.02 0.00 0.00 57.50 56.51 2gbz n TRP 99 Cb 0.45 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.28 2gbz n TRP 99 CO 0.00 0.00 0.00 -1.50 -2.02 0.00 0.00 177.69 174.17 2gbz s ILE 100 N -0.91 0.00 0.74 -0.99 2.07 -0.84 -5.00 121.20 116.27 2gbz s ILE 100 Ca 0.00 0.00 -0.11 0.00 -1.41 0.00 0.00 60.65 59.13 2gbz s ILE 100 Cb 0.00 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.62 2gbz s ILE 100 CO 0.00 0.00 1.07 0.00 -1.91 0.00 0.00 174.94 174.10 2gbz s ARG 101 N -0.40 2.57 0.59 3.50 1.70 -1.26 -4.41 118.95 121.23 2gbz s ARG 101 Ca -0.04 0.97 -0.19 0.00 -0.47 0.00 0.00 55.73 56.01 2gbz s ARG 101 Cb -0.03 -1.95 -0.04 0.00 -0.57 0.00 0.00 34.95 32.37 2gbz s ARG 101 CO 0.03 -1.37 1.18 0.00 -1.08 0.00 0.00 175.30 174.07 2gbz s ALA 102 N -3.01 2.56 0.00 7.88 0.00 -1.26 -3.33 121.76 124.60 2gbz s ALA 102 Ca 0.59 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.48 2gbz s ALA 102 Cb -0.15 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.55 2gbz s ALA 102 CO 0.55 -1.09 0.00 0.41 0.00 0.00 0.00 175.76 175.63 2gbz n GLY 103 N 0.34 1.61 0.09 0.00 0.00 0.16 -4.89 105.19 102.50 2gbz n GLY 103 Ca 0.13 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.97 2gbz n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gbz h ALA 104 N 0.00 0.04 -2.68 4.61 0.00 -1.77 -3.37 119.26 116.10 2gbz h ALA 104 Ca 0.00 -0.72 -0.61 0.00 0.00 0.00 0.00 54.91 53.58 2gbz h ALA 104 Cb 0.00 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2gbz h ALA 104 CO 0.00 0.30 -0.27 0.45 0.00 0.00 0.00 179.25 179.73 2gbz s SER 105 N -6.60 6.65 0.92 0.00 0.15 -1.26 -4.79 113.70 108.77 2gbz s SER 105 Ca -0.19 0.78 -0.12 0.00 0.70 0.00 0.00 55.95 57.11 2gbz s SER 105 Cb 0.00 -2.18 0.14 0.00 -1.71 0.00 0.00 66.02 62.28 2gbz s SER 105 CO 0.72 0.24 1.13 -2.84 1.20 0.00 0.00 173.24 173.70 2gbz s PRO 106 N -1.60 1.06 -0.26 5.44 0.02 -1.26 -0.53 135.00 137.87 2gbz s PRO 106 Ca 0.28 0.31 -0.21 0.00 0.02 0.00 0.00 61.00 61.40 2gbz s PRO 106 Cb -0.14 -1.83 -0.02 0.00 0.02 0.00 0.00 34.50 32.53 2gbz s PRO 106 CO 0.15 -2.26 0.66 1.41 -0.33 0.00 0.00 177.00 176.63 2gbz s MET 107 N -5.25 4.10 -0.08 5.54 1.75 -0.82 -4.24 119.30 120.31 2gbz s MET 107 Ca 0.64 0.58 -0.01 0.00 -1.25 0.00 0.00 55.69 55.66 2gbz s MET 107 Cb -0.15 -3.66 -0.03 0.00 2.84 0.00 0.00 34.83 33.83 2gbz s MET 107 CO 0.54 -0.44 -0.03 0.00 -0.65 0.00 0.00 175.02 174.43 2gbz n GLY 109 N 2.18 -0.49 3.41 0.00 0.00 -1.01 -1.66 105.19 107.63 2gbz n GLY 109 Ca -0.18 -1.05 -0.34 0.00 0.00 0.00 0.00 46.02 44.45 2gbz n GLY 109 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2gbz s ASN 110 N -4.00 4.43 -1.31 1.61 -0.87 -1.26 -1.13 114.94 112.41 2gbz s ASN 110 Ca 0.00 -0.26 -0.01 0.00 -1.57 0.00 0.00 52.86 51.02 2gbz s ASN 110 Cb 0.00 -1.72 -0.00 0.00 -0.02 0.00 0.00 41.25 39.51 2gbz s ASN 110 CO 0.00 0.12 0.67 -1.20 -2.57 0.00 0.00 177.10 174.12 2gbz n SER 111 N 3.85 -1.29 0.07 -1.22 7.64 -1.26 -4.87 113.62 116.54 2gbz n SER 111 Ca -0.18 -0.85 0.12 0.00 1.01 0.00 0.00 58.87 58.98 2gbz n SER 111 Cb 0.52 -3.92 0.47 0.00 -1.01 0.00 0.00 64.21 60.27 2gbz n SER 111 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 2gbz n ILE 112 N -4.26 0.52 -0.27 0.44 -6.64 -1.26 -3.18 119.36 104.71 2gbz n ILE 112 Ca -0.29 -0.04 -0.05 0.00 -1.77 0.00 0.00 62.75 60.59 2gbz n ILE 112 Cb 0.68 -0.72 0.09 0.00 -1.44 0.00 0.00 39.64 38.24 2gbz n ILE 112 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2gbz h GLN 114 N 1.12 0.61 -0.52 0.00 5.75 -1.93 -2.23 115.11 117.91 2gbz h GLN 114 Ca 0.26 -0.11 -0.03 0.00 -0.15 0.00 0.00 58.65 58.62 2gbz h GLN 114 Cb 0.22 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.65 2gbz h GLN 114 CO -0.02 0.57 0.22 -0.44 -2.65 0.00 0.00 178.83 176.51 2gbz h ASP 115 N 0.51 0.71 -0.66 -0.69 3.45 -1.46 -2.73 116.42 115.54 2gbz h ASP 115 Ca 0.13 -0.16 0.00 0.00 0.43 0.00 0.00 57.03 57.44 2gbz h ASP 115 Cb 0.20 -0.18 -0.03 0.00 -0.56 0.00 0.00 39.33 38.75 2gbz h ASP 115 CO -0.01 0.67 0.43 -0.09 -1.57 0.00 0.00 179.24 178.67 2gbz h ARG 116 N 0.70 0.89 0.00 3.56 2.43 -0.48 -0.58 114.38 120.89 2gbz h ARG 116 Ca 0.17 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.19 2gbz h ARG 116 Cb 0.18 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 2gbz h ARG 116 CO -0.02 0.60 -0.44 0.00 -1.51 0.00 0.00 179.97 178.60 2gbz h ARG 117 N 0.91 0.00 -0.03 0.20 3.08 -1.15 -0.40 114.38 116.99 2gbz h ARG 117 Ca 0.24 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 60.08 2gbz h ARG 117 Cb -0.08 0.00 0.02 0.00 0.08 0.00 0.00 29.97 29.98 2gbz h ARG 117 CO -0.05 0.44 -0.81 0.74 -1.07 0.00 0.00 179.97 179.22 2gbz h PHE 118 N 0.00 0.87 -0.70 3.04 -1.00 -1.01 -3.22 116.94 114.92 2gbz h PHE 118 Ca -0.00 -0.46 -0.05 0.00 2.81 0.00 0.00 57.97 60.27 2gbz h PHE 118 Cb 0.83 -0.11 -0.03 0.00 3.61 0.00 0.00 35.95 40.25 2gbz h PHE 118 CO 0.00 1.28 0.23 -0.07 -1.61 0.00 0.00 178.31 178.14 2gbz h LEU 119 N 0.21 1.01 -1.41 1.54 3.38 -0.91 -1.55 115.31 117.58 2gbz h LEU 119 Ca -0.09 -0.18 0.11 0.00 0.09 0.00 0.00 57.88 57.81 2gbz h LEU 119 Cb 1.48 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.92 2gbz h LEU 119 CO 0.16 0.93 0.51 -0.74 0.09 0.00 0.00 178.44 179.39 2gbz h HIS 120 N 1.04 0.70 0.09 1.13 2.76 -1.11 0.31 115.15 120.07 2gbz h HIS 120 Ca 0.23 0.02 -0.29 0.00 -2.20 0.00 0.00 60.37 58.13 2gbz h HIS 120 Cb 0.28 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 29.00 2gbz h HIS 120 CO 0.02 0.31 -1.52 -0.09 -1.30 0.00 0.00 177.93 175.35 2gbz h ARG 121 N 0.64 0.18 0.00 5.26 2.43 -1.46 -3.39 114.38 118.04 2gbz h ARG 121 Ca 0.36 -0.31 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2gbz h ARG 121 Cb 0.54 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 2gbz h ARG 121 CO -0.14 1.15 -1.81 1.04 -1.51 0.00 0.00 179.97 178.70 2gbz n GLN 122 N -3.94 0.54 -3.12 0.20 6.02 -0.62 -4.70 117.38 111.76 2gbz n GLN 122 Ca -0.29 -0.16 -0.20 0.00 -0.01 0.00 0.00 57.00 56.34 2gbz n GLN 122 Cb 0.88 -1.51 -0.04 0.00 1.02 0.00 0.00 30.24 30.58 2gbz n GLN 122 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 2gbz n MET 123 N -2.11 0.78 -0.25 -1.09 2.81 0.11 -4.75 117.12 112.61 2gbz n MET 123 Ca -0.02 -3.01 -0.02 0.00 -1.81 0.00 0.00 57.70 52.83 2gbz n MET 123 Cb 0.52 -1.33 0.09 0.00 -0.71 0.00 0.00 33.22 31.79 2gbz n MET 123 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 2gbz h SER 124 N 3.78 0.69 -0.94 7.83 0.02 -1.64 -1.48 113.55 121.80 2gbz h SER 124 Ca 0.04 0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.01 2gbz h SER 124 Cb 0.92 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 63.28 2gbz h SER 124 CO 0.44 0.47 0.62 -0.09 -1.14 0.00 0.00 176.83 177.13 2gbz h ARG 125 N 0.82 1.23 -0.18 3.45 2.43 -1.94 -0.43 114.38 119.76 2gbz h ARG 125 Ca 0.30 -0.07 -0.17 0.00 -0.81 0.00 0.00 59.98 59.22 2gbz h ARG 125 Cb 0.08 -0.28 -0.00 0.00 -0.42 0.00 0.00 29.97 29.35 2gbz h ARG 125 CO -0.13 0.81 -0.59 1.25 -1.51 0.00 0.00 179.97 179.80 2gbz h LEU 126 N 1.26 0.66 -0.13 3.80 5.85 -1.80 -2.54 115.31 122.41 2gbz h LEU 126 Ca 0.35 -0.37 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 2gbz h LEU 126 Cb -0.12 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.71 2gbz h LEU 126 CO -0.08 1.10 0.07 -0.08 -0.34 0.00 0.00 178.44 179.11 2gbz h GLU 127 N 0.44 0.18 0.00 1.25 4.22 -0.65 -2.12 114.58 117.89 2gbz h GLU 127 Ca -0.00 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.42 2gbz h GLU 127 Cb 1.15 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2gbz h GLU 127 CO 0.11 0.18 0.00 0.00 -2.18 0.00 0.00 179.01 177.12 2gbz h ARG 128 N 0.13 0.00 0.00 1.92 3.08 -1.05 -1.79 114.38 116.66 2gbz h ARG 128 Ca 0.05 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 2gbz h ARG 128 Cb 0.05 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 2gbz h ARG 128 CO -0.01 0.00 -0.04 -0.92 -1.07 0.00 0.00 179.97 177.93 2gbz h TYR 129 N 0.00 0.00 -3.53 3.04 3.20 -0.94 -3.39 116.97 115.36 2gbz h TYR 129 Ca 0.00 0.00 -0.49 0.00 3.14 0.00 0.00 58.73 61.38 2gbz h TYR 129 Cb 0.24 0.00 0.02 0.00 1.54 0.00 0.00 36.73 38.53 2gbz h TYR 129 CO 0.00 0.04 0.07 -0.06 -1.64 0.00 0.00 178.16 176.57 2gbz s PHE 130 N -3.81 3.52 0.69 -3.82 0.08 -0.68 -0.66 117.98 113.31 2gbz s PHE 130 Ca -0.00 0.84 -0.11 0.00 0.12 0.00 0.00 56.93 57.77 2gbz s PHE 130 Cb 0.10 -2.30 0.01 0.00 -0.57 0.00 0.00 43.02 40.26 2gbz s PHE 130 CO 0.54 -0.15 1.06 -1.58 -0.10 0.00 0.00 175.22 174.98 2gbz s HIS 131 N -2.53 3.06 -0.58 0.36 5.65 0.31 -4.43 115.29 117.12 2gbz s HIS 131 Ca 0.48 1.44 0.24 0.00 0.25 0.00 0.00 55.06 57.46 2gbz s HIS 131 Cb -0.10 -2.91 0.93 0.00 -1.18 0.00 0.00 32.58 29.32 2gbz s HIS 131 CO 0.39 -1.27 1.71 2.48 -0.65 0.00 0.00 174.74 177.40 2gbz n TYR 132 N -3.07 0.76 -2.77 3.88 0.18 -1.26 -4.47 117.16 110.40 2gbz n TYR 132 Ca 0.08 0.28 -0.37 0.00 1.88 0.00 0.00 57.90 59.76 2gbz n TYR 132 Cb 0.53 -0.95 -0.06 0.00 -0.38 0.00 0.00 39.34 38.48 2gbz n TYR 132 CO 0.00 0.00 0.00 0.50 -2.08 0.00 0.00 176.86 175.28 2gbz s ARG 133 N -3.24 4.61 0.12 -3.48 3.52 -1.26 -4.97 118.95 114.26 2gbz s ARG 133 Ca 0.06 1.36 0.06 0.00 -0.13 0.00 0.00 55.73 57.08 2gbz s ARG 133 Cb 0.10 -2.86 -0.04 0.00 -1.56 0.00 0.00 34.95 30.59 2gbz s ARG 133 CO 0.43 0.30 -0.03 -0.80 -0.81 0.00 0.00 175.30 174.40 2gbz s ASN 134 N -1.55 4.78 -0.46 -2.12 0.01 -1.26 -1.94 114.94 112.39 2gbz s ASN 134 Ca 0.49 -0.30 0.03 0.00 -0.71 0.00 0.00 52.86 52.36 2gbz s ASN 134 Cb -0.20 -1.04 0.13 0.00 0.41 0.00 0.00 41.25 40.55 2gbz s ASN 134 CO 0.25 0.15 0.24 -0.22 -1.51 0.00 0.00 177.10 176.01 2gbz s LEU 135 N -2.50 3.05 -0.33 0.60 0.20 -0.10 -4.87 118.68 114.74 2gbz s LEU 135 Ca 0.25 -2.71 -0.12 0.00 0.69 0.00 0.00 54.13 52.24 2gbz s LEU 135 Cb -0.11 -1.17 -0.03 0.00 -0.43 0.00 0.00 46.19 44.46 2gbz s LEU 135 CO 0.17 -0.26 0.23 -0.62 -0.29 0.00 0.00 176.35 175.58 2gbz s ASP 136 N 0.21 6.05 0.56 3.68 3.68 -1.26 -2.39 116.67 127.20 2gbz s ASP 136 Ca 0.17 -0.31 0.27 0.00 2.13 0.00 0.00 52.55 54.81 2gbz s ASP 136 Cb -0.25 -2.14 1.63 0.00 -1.45 0.00 0.00 42.92 40.72 2gbz s ASP 136 CO 0.00 -0.19 2.18 0.58 0.13 0.00 0.00 175.17 177.87 2gbz h VAL 137 N 5.46 0.60 -0.55 1.11 2.07 -1.52 -1.87 116.25 121.55 2gbz h VAL 137 Ca -0.32 -0.21 0.05 0.00 0.82 0.00 0.00 66.70 67.03 2gbz h VAL 137 Cb 1.17 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 2gbz h VAL 137 CO 0.61 0.05 0.36 0.28 0.02 0.00 0.00 177.57 178.90 2gbz h SER 138 N 0.00 0.50 -0.85 0.57 0.02 -1.93 -1.55 113.55 110.32 2gbz h SER 138 Ca -0.00 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2gbz h SER 138 Cb 0.13 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.51 2gbz h SER 138 CO 0.01 0.34 0.56 0.74 -1.14 0.00 0.00 176.83 177.33 2gbz h THR 139 N 0.57 1.21 -0.17 -2.27 2.02 -1.73 0.74 112.91 113.29 2gbz h THR 139 Ca 0.23 -0.39 -0.17 0.00 0.77 0.00 0.00 66.41 66.85 2gbz h THR 139 Cb 0.18 -0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 66.56 2gbz h THR 139 CO -0.06 0.21 -0.59 0.40 0.37 0.00 0.00 175.52 175.84 2gbz h ILE 140 N 1.14 1.33 -0.68 3.11 2.04 -1.49 -2.45 117.51 120.51 2gbz h ILE 140 Ca 0.32 -1.86 -0.05 0.00 1.00 0.00 0.00 64.86 64.26 2gbz h ILE 140 Cb -0.11 1.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.78 2gbz h ILE 140 CO -0.07 0.58 0.24 0.50 0.00 0.00 0.00 178.15 179.39 2gbz h LYS 141 N 0.41 1.03 -0.51 2.37 3.64 -0.65 -0.44 116.57 122.43 2gbz h LYS 141 Ca -0.00 -0.20 -0.09 0.00 -1.27 0.00 0.00 60.65 59.10 2gbz h LYS 141 Cb 1.15 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.78 2gbz h LYS 141 CO 0.11 0.87 -0.03 0.93 -2.27 0.00 0.00 179.45 179.06 2gbz h GLU 142 N 1.00 0.87 -0.29 1.90 4.39 -0.71 -1.57 114.58 120.19 2gbz h GLU 142 Ca 0.23 -0.26 -0.12 0.00 0.34 0.00 0.00 59.36 59.54 2gbz h GLU 142 Cb 0.25 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2gbz h GLU 142 CO -0.01 0.89 -0.30 -0.07 -1.16 0.00 0.00 179.01 178.36 2gbz h LEU 143 N 0.80 0.76 -0.47 1.33 3.38 -0.95 -2.70 115.31 117.46 2gbz h LEU 143 Ca 0.15 -0.48 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 2gbz h LEU 143 Cb 0.52 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2gbz h LEU 143 CO 0.03 1.08 0.29 0.00 0.09 0.00 0.00 178.44 179.93 2gbz h ALA 144 N 0.70 0.60 -0.77 1.53 0.00 -0.98 0.27 119.26 120.60 2gbz h ALA 144 Ca 0.04 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.94 2gbz h ALA 144 Cb 0.87 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 2gbz h ALA 144 CO 0.07 0.09 0.51 -0.09 0.00 0.00 0.00 179.25 179.83 2gbz h ARG 145 N 0.63 0.86 0.04 0.00 2.43 -1.26 0.38 114.38 117.46 2gbz h ARG 145 Ca 0.17 -0.05 -0.31 0.00 -0.81 0.00 0.00 59.98 58.98 2gbz h ARG 145 Cb -0.02 -0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 29.30 2gbz h ARG 145 CO -0.03 0.57 -1.75 0.00 -1.51 0.00 0.00 179.97 177.25 2gbz h ARG 146 N 0.89 0.08 0.00 0.20 3.08 -1.10 -3.40 114.38 114.13 2gbz h ARG 146 Ca 0.32 -0.13 -0.25 0.00 0.07 0.00 0.00 59.98 59.99 2gbz h ARG 146 Cb 0.14 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.19 2gbz h ARG 146 CO -0.10 0.71 -1.96 0.91 -1.07 0.00 0.00 179.97 178.46 2gbz n TRP 147 N -3.18 0.00 -3.13 3.04 8.01 0.90 -4.85 117.44 118.24 2gbz n TRP 147 Ca -0.20 0.00 -0.21 0.00 -1.31 0.00 0.00 57.50 55.78 2gbz n TRP 147 Cb 1.05 -0.68 -0.05 0.00 -2.01 0.00 0.00 31.31 29.62 2gbz n TRP 147 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2gbz n ALA 148 N -2.61 1.87 -0.28 6.99 0.00 0.12 -5.00 120.51 121.59 2gbz n ALA 148 Ca -0.24 -3.12 0.10 0.00 0.00 0.00 0.00 53.44 50.18 2gbz n ALA 148 Cb 0.92 -0.89 0.25 0.00 0.00 0.00 0.00 19.45 19.73 2gbz n ALA 148 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2gbz h PRO 149 N 3.93 0.29 -0.86 0.00 0.11 -1.43 -1.55 132.00 132.49 2gbz h PRO 149 Ca 0.04 -0.02 0.21 0.00 0.11 0.00 0.00 66.00 66.35 2gbz h PRO 149 Cb 0.91 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 31.90 2gbz h PRO 149 CO 0.44 0.19 0.59 0.00 -0.21 0.00 0.00 178.00 179.01 2gbz h ALA 150 N 1.69 2.39 -0.08 -0.75 0.00 -1.95 -1.90 119.26 118.67 2gbz h ALA 150 Ca 0.50 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.43 2gbz h ALA 150 Cb 0.93 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 2gbz h ALA 150 CO -0.56 -0.66 0.14 0.28 0.00 0.00 0.00 179.25 178.46 2gbz h VAL 151 N 0.27 0.28 0.02 0.00 2.07 -1.62 -2.06 116.25 115.21 2gbz h VAL 151 Ca 0.44 0.00 -0.21 0.00 0.82 0.00 0.00 66.70 67.74 2gbz h VAL 151 Cb 1.28 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.91 2gbz h VAL 151 CO -0.12 0.00 -1.01 0.00 0.02 0.00 0.00 177.57 176.46 2gbz h ALA 152 N 1.79 0.35 -0.08 1.67 0.00 -1.52 -3.33 119.26 118.14 2gbz h ALA 152 Ca 0.04 -0.88 0.02 0.00 0.00 0.00 0.00 54.91 54.09 2gbz h ALA 152 Cb 0.32 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2gbz h ALA 152 CO -0.00 1.18 0.25 0.66 0.00 0.00 0.00 179.25 181.34 2gbz h SER 153 N 0.01 0.00 0.27 0.00 4.64 -1.52 -1.95 113.55 115.00 2gbz h SER 153 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2gbz h SER 153 Cb 1.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.85 2gbz h SER 153 CO 0.14 0.00 -0.14 0.61 -0.87 0.00 0.00 176.83 176.57 2gbz n GLY 154 N -1.25 -0.75 3.26 -0.77 0.00 -1.25 -4.87 105.19 99.56 2gbz n GLY 154 Ca -0.01 -0.32 -0.28 0.00 0.00 0.00 0.00 46.02 45.41 2gbz n GLY 154 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2gbz s PHE 155 N -2.41 2.00 -0.01 1.61 5.36 -0.74 -5.13 117.98 118.67 2gbz s PHE 155 Ca 0.29 -0.38 -0.00 0.00 -0.96 0.00 0.00 56.93 55.88 2gbz s PHE 155 Cb 0.20 -1.25 0.01 0.00 -0.34 0.00 0.00 43.02 41.63 2gbz s PHE 155 CO 0.47 0.02 0.01 0.00 -1.46 0.00 0.00 175.22 174.26 2gbz s ALA 156 N -0.62 0.01 0.39 11.12 0.00 -1.26 -5.03 121.76 126.37 2gbz s ALA 156 Ca 0.09 0.09 -0.24 0.00 0.00 0.00 0.00 51.96 51.90 2gbz s ALA 156 Cb -0.09 -0.07 -0.09 0.00 0.00 0.00 0.00 23.12 22.87 2gbz s ALA 156 CO 0.00 -0.03 1.01 0.15 0.00 0.00 0.00 175.76 176.89 2gbz s LYS 157 N 0.28 4.26 0.68 0.00 1.02 -1.26 -5.01 119.74 119.71 2gbz s LYS 157 Ca -0.02 1.42 -0.17 0.00 0.02 0.00 0.00 55.97 57.22 2gbz s LYS 157 Cb -0.03 -2.55 -0.02 0.00 -0.52 0.00 0.00 37.83 34.71 2gbz s LYS 157 CO -0.01 -0.04 0.95 -1.13 -0.92 0.00 0.00 175.35 174.20 2gbz n SER 158 N -0.01 0.52 -0.01 2.83 3.41 -1.26 -4.88 113.62 114.22 2gbz n SER 158 Ca 0.05 0.72 -0.01 0.00 -0.26 0.00 0.00 58.87 59.37 2gbz n SER 158 Cb 0.50 -1.39 0.28 0.00 -0.26 0.00 0.00 64.21 63.34 2gbz n SER 158 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2gbz h SER 159 N 0.03 0.51 -1.25 4.04 0.02 -2.00 -3.45 113.55 111.44 2gbz h SER 159 Ca -0.48 -0.10 -0.46 0.00 -0.84 0.00 0.00 61.79 59.91 2gbz h SER 159 Cb 1.35 -0.13 0.23 0.00 0.14 0.00 0.00 62.40 63.98 2gbz h SER 159 CO 0.48 0.59 -2.16 0.00 -1.14 0.00 0.00 176.83 174.61 2gbz n ALA 160 N -2.48 -5.23 0.00 3.77 0.00 -1.26 -4.99 120.51 110.32 2gbz n ALA 160 Ca 0.01 -1.01 0.00 0.00 0.00 0.00 0.00 53.44 52.45 2gbz n ALA 160 Cb 0.26 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 18.88 2gbz n ALA 160 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2gbz n HIS 161 N -2.79 0.00 -0.82 0.00 -0.00 -1.26 -4.94 115.22 105.41 2gbz n HIS 161 Ca -0.02 0.00 -0.33 0.00 -0.00 0.00 0.00 57.72 57.37 2gbz n HIS 161 Cb 0.61 0.00 0.11 0.00 -0.00 0.00 0.00 29.99 30.72 2gbz n HIS 161 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 2gbz n THR 162 N -1.61 0.00 0.10 1.59 -2.24 -1.26 -4.75 114.28 106.11 2gbz n THR 162 Ca 0.00 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 2gbz n THR 162 Cb 0.20 -0.50 0.30 0.00 -2.10 0.00 0.00 70.33 68.23 2gbz n THR 162 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gbz h ALA 163 N -1.53 1.31 -0.61 6.98 0.00 -1.92 -2.65 119.26 120.83 2gbz h ALA 163 Ca -0.45 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.13 2gbz h ALA 163 Cb 1.30 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 2gbz h ALA 163 CO 0.33 0.47 0.24 1.25 0.00 0.00 0.00 179.25 181.54 2gbz h LEU 164 N 0.24 0.81 -0.14 0.00 6.46 -1.90 -1.23 115.31 119.56 2gbz h LEU 164 Ca 0.04 -0.11 -0.22 0.00 -0.12 0.00 0.00 57.88 57.47 2gbz h LEU 164 Cb 0.57 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.29 2gbz h LEU 164 CO 0.04 0.73 -0.98 0.77 -0.62 0.00 0.00 178.44 178.38 2gbz h SER 165 N 0.88 0.30 0.09 1.25 4.64 -1.86 -2.24 113.55 116.61 2gbz h SER 165 Ca 0.21 -0.27 -0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2gbz h SER 165 Cb 0.17 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2gbz h SER 165 CO -0.02 1.12 -0.04 0.44 -0.87 0.00 0.00 176.83 177.46 2gbz h ASP 166 N 0.10 -0.10 -0.72 4.97 3.45 -1.10 0.25 116.42 123.27 2gbz h ASP 166 Ca -0.07 -0.08 -0.03 0.00 0.43 0.00 0.00 57.03 57.28 2gbz h ASP 166 Cb 1.65 0.03 -0.03 0.00 -0.56 0.00 0.00 39.33 40.41 2gbz h ASP 166 CO 0.15 0.02 0.35 1.62 -1.57 0.00 0.00 179.24 179.82 2gbz h VAL 167 N -0.21 1.23 -0.62 -1.35 3.04 -1.30 -0.55 116.25 116.49 2gbz h VAL 167 Ca -0.01 -0.66 -0.01 0.00 -1.01 0.00 0.00 66.70 65.01 2gbz h VAL 167 Cb 0.18 0.29 -0.03 0.00 -2.01 0.00 0.00 31.29 29.72 2gbz h VAL 167 CO 0.02 0.28 0.35 -0.09 -1.01 0.00 0.00 177.57 177.12 2gbz h ARG 168 N 1.05 0.85 -0.10 4.17 2.43 -0.97 -1.82 114.38 120.00 2gbz h ARG 168 Ca 0.26 -0.08 -0.15 0.00 -0.81 0.00 0.00 59.98 59.19 2gbz h ARG 168 Cb 0.11 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 2gbz h ARG 168 CO -0.03 0.62 -0.60 -0.44 -1.51 0.00 0.00 179.97 178.01 2gbz h ASP 169 N 0.86 0.38 -0.60 -3.80 3.32 0.71 -2.84 116.42 114.44 2gbz h ASP 169 Ca 0.22 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 2gbz h ASP 169 Cb 0.01 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.42 2gbz h ASP 169 CO -0.04 0.89 0.27 0.28 -1.72 0.00 0.00 179.24 178.92 2gbz h SER 170 N 0.25 0.80 -0.53 6.45 0.02 -0.32 0.75 113.55 120.97 2gbz h SER 170 Ca -0.00 -0.15 -0.04 0.00 -0.84 0.00 0.00 61.79 60.76 2gbz h SER 170 Cb 1.12 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.43 2gbz h SER 170 CO 0.10 0.72 0.18 0.40 -1.14 0.00 0.00 176.83 177.10 2gbz h ILE 171 N 0.82 1.23 -0.39 3.27 2.04 -1.41 -2.01 117.51 121.06 2gbz h ILE 171 Ca 0.20 -0.74 -0.08 0.00 1.00 0.00 0.00 64.86 65.24 2gbz h ILE 171 Cb 0.15 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 2gbz h ILE 171 CO -0.02 0.28 -0.11 0.44 0.00 0.00 0.00 178.15 178.74 2gbz h ASP 172 N 0.72 0.67 -0.40 1.72 3.45 -1.27 -1.01 116.42 120.30 2gbz h ASP 172 Ca 0.17 -0.19 -0.03 0.00 0.43 0.00 0.00 57.03 57.41 2gbz h ASP 172 Cb 0.24 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 38.82 2gbz h ASP 172 CO -0.01 0.81 0.13 -0.08 -1.57 0.00 0.00 179.24 178.51 2gbz h GLU 173 N 0.62 0.62 -0.50 3.56 4.81 -0.52 0.65 114.58 123.82 2gbz h GLU 173 Ca 0.11 -0.13 -0.08 0.00 -0.13 0.00 0.00 59.36 59.13 2gbz h GLU 173 Cb 0.55 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 2gbz h GLU 173 CO 0.03 0.62 -0.00 1.25 -0.73 0.00 0.00 179.01 180.18 2gbz h LEU 174 N 0.50 0.86 -1.27 1.64 5.85 -1.20 -1.43 115.31 120.25 2gbz h LEU 174 Ca 0.13 -0.31 0.08 0.00 0.84 0.00 0.00 57.88 58.62 2gbz h LEU 174 Cb 0.26 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.00 2gbz h LEU 174 CO -0.00 0.96 0.54 -0.09 -0.34 0.00 0.00 178.44 179.50 2gbz h ARG 175 N 0.74 0.82 0.07 1.25 2.43 -0.85 0.14 114.38 118.98 2gbz h ARG 175 Ca 0.14 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2gbz h ARG 175 Cb 0.52 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 2gbz h ARG 175 CO 0.03 0.54 -0.03 1.25 -1.51 0.00 0.00 179.97 180.24 2gbz h HIS 176 N 0.84 -0.09 -0.33 2.20 2.76 -0.40 -3.22 115.15 116.91 2gbz h HIS 176 Ca 0.37 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.52 2gbz h HIS 176 Cb 0.33 0.03 -0.02 0.00 1.55 0.00 0.00 27.41 29.30 2gbz h HIS 176 CO -0.00 0.33 0.13 1.88 -1.30 0.00 0.00 177.93 178.96 2gbz h TYR 177 N -0.52 0.46 -0.71 5.26 0.05 -0.54 -2.61 116.97 118.37 2gbz h TYR 177 Ca -0.01 -0.01 0.14 0.00 0.05 0.00 0.00 58.73 58.89 2gbz h TYR 177 Cb 0.45 -0.15 -0.05 0.00 1.01 0.00 0.00 36.73 38.00 2gbz h TYR 177 CO 0.07 0.38 0.48 -0.09 -1.05 0.00 0.00 178.16 177.94 2gbz h ARG 178 N 0.47 0.38 0.00 4.88 2.43 -0.75 -0.90 114.38 120.90 2gbz h ARG 178 Ca 0.12 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 2gbz h ARG 178 Cb 0.11 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2gbz h ARG 178 CO -0.01 0.25 -0.09 1.96 -1.51 0.00 0.00 179.97 180.57 2gbz h GLN 179 N 0.39 0.00 -0.41 0.20 4.20 -1.54 -2.67 115.11 115.28 2gbz h GLN 179 Ca 0.34 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.05 2gbz h GLN 179 Cb 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.56 2gbz h GLN 179 CO -0.10 0.09 0.00 1.19 -0.67 0.00 0.00 178.83 179.34 2gbz n PHE 180 N -4.06 1.13 0.35 2.96 3.72 -0.36 -4.54 117.46 116.66 2gbz n PHE 180 Ca -0.02 -0.72 0.11 0.00 -0.05 0.00 0.00 57.45 56.77 2gbz n PHE 180 Cb 0.18 -0.27 0.26 0.00 -0.94 0.00 0.00 39.48 38.72 2gbz n PHE 180 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 2gbz n MET 181 N 0.23 2.37 0.00 -1.08 2.81 -1.01 -5.05 117.12 115.39 2gbz n MET 181 Ca 0.21 -2.09 0.00 0.00 -1.81 0.00 0.00 57.70 54.01 2gbz n MET 181 Cb 0.84 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.86 2gbz n MET 181 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gbz n GLY 182 N 1.45 2.73 0.25 3.03 0.00 -1.26 -2.70 105.19 108.69 2gbz n GLY 182 Ca 0.19 -0.27 0.03 0.00 0.00 0.00 0.00 46.02 45.97 2gbz n GLY 182 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2gbz h THR 183 N 0.00 0.66 -0.12 2.61 2.02 -1.97 -0.46 112.91 115.65 2gbz h THR 183 Ca 0.00 -0.13 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 2gbz h THR 183 Cb 0.00 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 66.67 2gbz h THR 183 CO 0.00 0.07 0.04 0.25 0.37 0.00 0.00 175.52 176.25 2gbz h LEU 184 N 0.36 0.14 -0.91 2.58 5.85 -1.93 -0.14 115.31 121.26 2gbz h LEU 184 Ca 0.36 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.07 2gbz h LEU 184 Cb 0.53 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.52 2gbz h LEU 184 CO -0.39 0.14 0.00 1.23 -0.34 0.00 0.00 178.44 179.08 2gbz h GLY 185 N 0.25 0.00 0.00 3.75 0.00 -0.91 -3.51 103.07 102.66 2gbz h GLY 185 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2gbz h GLY 185 CO -0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15