#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gwy n LEU 2 N 0.00 1.73 -4.75 0.00 4.77 -1.26 -4.84 117.00 112.65 1gwy n LEU 2 Ca 0.00 0.30 -0.41 0.00 -0.03 0.00 0.00 56.01 55.87 1gwy n LEU 2 Cb 0.00 -0.71 -0.02 0.00 -2.33 0.00 0.00 43.42 40.36 1gwy n LEU 2 CO 0.00 0.39 1.16 0.00 -1.33 0.00 0.00 177.39 177.62 1gwy s ALA 3 N -2.49 3.67 0.00 -1.18 0.00 -1.26 -2.16 121.76 118.34 1gwy s ALA 3 Ca -0.33 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.09 1gwy s ALA 3 Cb 0.12 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.64 1gwy s ALA 3 CO 0.42 -0.87 0.00 0.41 0.00 0.00 0.00 175.76 175.72 1gwy n GLY 4 N 1.94 0.65 3.67 0.00 0.00 0.23 -4.86 105.19 106.82 1gwy n GLY 4 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 1gwy n GLY 4 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gwy s THR 5 N -2.21 1.46 0.04 2.61 -4.23 -0.92 -4.42 115.64 107.97 1gwy s THR 5 Ca 0.00 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 58.59 1gwy s THR 5 Cb 0.00 -2.55 -0.03 0.00 1.34 0.00 0.00 72.50 71.25 1gwy s THR 5 CO 0.00 0.00 -0.20 -0.63 -0.54 0.00 0.00 174.62 173.25 1gwy s ILE 6 N -2.86 2.62 0.23 2.99 -1.09 -1.26 -1.58 121.20 120.24 1gwy s ILE 6 Ca 0.21 -1.25 0.00 0.00 -2.23 0.00 0.00 60.65 57.38 1gwy s ILE 6 Cb 0.06 -2.09 -0.05 0.00 -1.58 0.00 0.00 42.46 38.80 1gwy s ILE 6 CO 0.11 0.34 0.11 0.27 -1.23 0.00 0.00 174.94 174.54 1gwy s ILE 7 N -0.90 0.30 0.20 2.92 -4.36 -0.15 -4.96 121.20 114.25 1gwy s ILE 7 Ca 0.14 -2.00 -0.31 0.00 -0.26 0.00 0.00 60.65 58.22 1gwy s ILE 7 Cb -0.10 -2.57 -0.10 0.00 1.25 0.00 0.00 42.46 40.93 1gwy s ILE 7 CO 0.04 0.00 1.50 0.00 0.24 0.00 0.00 174.94 176.73 1gwy s ALA 8 N -3.94 3.70 0.36 2.27 0.00 -1.26 0.17 121.76 123.06 1gwy s ALA 8 Ca 0.38 1.34 0.10 0.00 0.00 0.00 0.00 51.96 53.78 1gwy s ALA 8 Cb 0.07 -3.59 0.84 0.00 0.00 0.00 0.00 23.12 20.45 1gwy s ALA 8 CO 0.13 -0.76 1.87 0.78 0.00 0.00 0.00 175.76 177.78 1gwy h GLY 9 N 6.02 1.17 2.00 0.00 0.00 -1.16 -0.45 103.07 110.65 1gwy h GLY 9 Ca -0.44 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 46.60 1gwy h GLY 9 CO 0.85 0.08 0.00 0.00 0.00 0.00 0.00 176.54 177.47 1gwy h ALA 10 N 1.60 1.00 -0.02 3.60 0.00 -1.90 -2.63 119.26 120.92 1gwy h ALA 10 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1gwy h ALA 10 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1gwy h ALA 10 CO -0.20 0.00 -0.11 -1.13 0.00 0.00 0.00 179.25 177.81 1gwy n SER 11 N -3.00 2.04 -4.66 0.00 3.41 -0.18 -4.89 113.62 106.33 1gwy n SER 11 Ca -0.01 -1.59 -0.43 0.00 -0.26 0.00 0.00 58.87 56.59 1gwy n SER 11 Cb 0.19 0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.21 1gwy n SER 11 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1gwy s LEU 12 N -2.15 4.24 0.25 1.04 2.96 -0.99 -4.87 118.68 119.17 1gwy s LEU 12 Ca 0.30 1.93 -0.01 0.00 -0.22 0.00 0.00 54.13 56.12 1gwy s LEU 12 Cb 0.20 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.33 1gwy s LEU 12 CO 0.39 -0.83 0.25 0.42 -1.32 0.00 0.00 176.35 175.25 1gwy s THR 13 N 3.74 0.00 0.30 3.68 -4.23 -1.26 -5.03 115.64 112.84 1gwy s THR 13 Ca 0.63 -1.87 0.17 0.00 -1.18 0.00 0.00 61.69 59.44 1gwy s THR 13 Cb -0.27 -2.47 0.13 0.00 1.34 0.00 0.00 72.50 71.23 1gwy s THR 13 CO 0.21 0.00 1.81 -0.26 -0.54 0.00 0.00 174.62 175.85 1gwy h PHE 14 N 2.42 0.00 -0.25 3.99 -1.00 -1.99 -1.58 116.94 118.54 1gwy h PHE 14 Ca -0.32 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.44 1gwy h PHE 14 Cb 1.25 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.80 1gwy h PHE 14 CO 0.74 0.36 0.05 0.37 -1.61 0.00 0.00 178.31 178.21 1gwy h GLN 15 N 0.00 0.40 -0.25 1.51 4.15 -1.96 0.19 115.11 119.15 1gwy h GLN 15 Ca -0.00 -0.10 0.01 0.00 0.77 0.00 0.00 58.65 59.32 1gwy h GLN 15 Cb 0.73 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.35 1gwy h GLN 15 CO 0.05 0.52 0.13 0.28 -1.93 0.00 0.00 178.83 177.88 1gwy h VAL 16 N 0.22 1.01 -0.10 2.39 2.07 -1.79 -1.51 116.25 118.53 1gwy h VAL 16 Ca 0.08 -0.10 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 1gwy h VAL 16 Cb 0.31 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1gwy h VAL 16 CO 0.00 0.05 -0.22 -0.07 0.02 0.00 0.00 177.57 177.35 1gwy h LEU 17 N 0.28 0.17 -0.78 2.57 3.38 -1.14 -1.99 115.31 117.79 1gwy h LEU 17 Ca 0.10 -0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 1gwy h LEU 17 Cb 0.01 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1gwy h LEU 17 CO -0.06 0.41 -0.56 -0.78 0.09 0.00 0.00 178.44 177.54 1gwy h ASP 18 N 0.16 0.15 0.50 -0.43 1.82 -0.52 -1.26 116.42 116.85 1gwy h ASP 18 Ca 0.03 -0.08 -0.09 0.00 -0.39 0.00 0.00 57.03 56.50 1gwy h ASP 18 Cb 0.49 -0.04 -0.01 0.00 0.68 0.00 0.00 39.33 40.45 1gwy h ASP 18 CO 0.03 0.68 -0.41 0.11 -1.61 0.00 0.00 179.24 178.04 1gwy h LYS 19 N 0.10 0.00 -0.27 0.28 1.57 -0.63 -0.45 116.57 117.17 1gwy h LYS 19 Ca -0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 1gwy h LYS 19 Cb 1.02 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 1gwy h LYS 19 CO 0.08 0.41 -0.41 0.28 -0.57 0.00 0.00 179.45 179.24 1gwy h VAL 20 N 0.00 1.29 -0.62 0.50 2.07 -0.64 -2.36 116.25 116.49 1gwy h VAL 20 Ca -0.00 -1.58 -0.08 0.00 0.82 0.00 0.00 66.70 65.86 1gwy h VAL 20 Cb 0.77 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 1gwy h VAL 20 CO 0.05 0.51 0.10 -0.07 0.02 0.00 0.00 177.57 178.18 1gwy h LEU 21 N 0.54 1.00 -0.99 2.57 3.38 -0.48 -2.99 115.31 118.34 1gwy h LEU 21 Ca 0.04 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1gwy h LEU 21 Cb 0.94 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 1gwy h LEU 21 CO 0.08 1.01 0.51 -0.08 0.09 0.00 0.00 178.44 180.05 1gwy h GLU 22 N 0.95 1.21 0.00 1.13 4.81 -0.80 -2.33 114.58 119.55 1gwy h GLU 22 Ca 0.19 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1gwy h GLU 22 Cb 0.44 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1gwy h GLU 22 CO 0.01 0.87 0.00 -0.85 -0.73 0.00 0.00 179.01 178.31 1gwy n GLU 23 N -4.35 0.09 0.06 1.92 0.28 -0.92 -1.83 120.64 115.90 1gwy n GLU 23 Ca 0.10 0.36 0.12 0.00 -0.16 0.00 0.00 57.16 57.58 1gwy n GLU 23 Cb 0.08 -1.68 0.48 0.00 1.43 0.00 0.00 31.44 31.74 1gwy n GLU 23 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1gwy n LEU 24 N -1.86 0.39 0.00 -1.84 4.77 -0.88 -5.00 117.00 112.58 1gwy n LEU 24 Ca 0.02 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.56 1gwy n LEU 24 Cb 0.18 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 1gwy n LEU 24 CO 0.15 -0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.63 1gwy n GLY 25 N 0.98 -0.21 3.52 -0.72 0.00 -0.76 -4.59 105.19 103.40 1gwy n GLY 25 Ca 0.05 -1.02 -0.42 0.00 0.00 0.00 0.00 46.02 44.63 1gwy n GLY 25 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1gwy s LYS 26 N 0.00 3.40 -0.17 1.61 2.20 -1.26 -4.93 119.74 120.59 1gwy s LYS 26 Ca 0.00 -0.92 -0.07 0.00 -0.36 0.00 0.00 55.97 54.62 1gwy s LYS 26 Cb 0.00 -4.77 0.07 0.00 -1.51 0.00 0.00 37.83 31.62 1gwy s LYS 26 CO 0.00 -2.06 0.37 0.54 -0.36 0.00 0.00 175.35 173.84 1gwy s VAL 27 N 4.69 -0.31 0.59 4.02 0.11 -1.26 -5.01 120.40 123.23 1gwy s VAL 27 Ca 0.37 0.16 0.29 0.00 -2.93 0.00 0.00 61.98 59.87 1gwy s VAL 27 Cb -0.06 -0.58 0.35 0.00 -1.53 0.00 0.00 36.38 34.57 1gwy s VAL 27 CO 0.01 0.07 2.25 0.77 -3.33 0.00 0.00 175.10 174.86 1gwy h SER 28 N 7.70 0.00 -3.26 3.54 4.64 -1.95 -3.40 113.55 120.81 1gwy h SER 28 Ca -0.26 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.57 1gwy h SER 28 Cb 1.14 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 62.87 1gwy h SER 28 CO 0.21 0.00 -0.79 -0.13 -0.87 0.00 0.00 176.83 175.25 1gwy s ARG 29 N -4.65 1.24 0.29 4.77 1.81 -1.26 -4.46 118.95 116.70 1gwy s ARG 29 Ca -0.05 -0.17 -0.17 0.00 -1.72 0.00 0.00 55.73 53.62 1gwy s ARG 29 Cb 0.15 -1.32 0.02 0.00 -0.45 0.00 0.00 34.95 33.35 1gwy s ARG 29 CO 0.55 -0.21 0.66 -1.59 -0.68 0.00 0.00 175.30 174.03 1gwy s LYS 30 N 1.53 1.79 -0.13 3.54 -2.85 -0.12 -1.04 119.74 122.47 1gwy s LYS 30 Ca 0.00 -1.15 -0.14 0.00 -1.00 0.00 0.00 55.97 53.69 1gwy s LYS 30 Cb -0.13 0.57 0.04 0.00 -2.06 0.00 0.00 37.83 36.25 1gwy s LYS 30 CO -0.05 -0.81 0.38 -1.50 0.10 0.00 0.00 175.35 173.48 1gwy s ILE 31 N -3.69 0.01 -0.15 3.79 2.07 0.07 -1.16 121.20 122.14 1gwy s ILE 31 Ca 0.15 -0.06 -0.01 0.00 -1.41 0.00 0.00 60.65 59.32 1gwy s ILE 31 Cb -0.04 -0.56 -0.01 0.00 0.13 0.00 0.00 42.46 41.97 1gwy s ILE 31 CO 0.09 -0.03 -0.12 0.00 -1.91 0.00 0.00 174.94 172.97 1gwy s ALA 32 N -0.01 2.64 -0.06 1.50 0.00 -0.05 -1.72 121.76 124.06 1gwy s ALA 32 Ca -0.02 -0.96 0.06 0.00 0.00 0.00 0.00 51.96 51.04 1gwy s ALA 32 Cb -0.03 -1.30 -0.01 0.00 0.00 0.00 0.00 23.12 21.78 1gwy s ALA 32 CO 0.01 0.09 -0.23 0.08 0.00 0.00 0.00 175.76 175.71 1gwy s VAL 33 N 0.60 2.24 -0.06 0.00 1.01 0.49 -0.97 120.40 123.71 1gwy s VAL 33 Ca -0.07 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 60.90 1gwy s VAL 33 Cb -0.15 -1.82 0.03 0.00 0.00 0.00 0.00 36.38 34.43 1gwy s VAL 33 CO 0.03 0.57 -0.01 -0.83 0.00 0.00 0.00 175.10 174.86 1gwy s GLY 34 N -0.25 0.45 -0.18 4.51 0.00 -0.01 -0.77 107.32 111.08 1gwy s GLY 34 Ca -0.01 -0.09 0.00 0.00 0.00 0.00 0.00 44.72 44.62 1gwy s GLY 34 CO 0.03 0.96 -0.09 -0.42 0.00 0.00 0.00 173.10 173.58 1gwy s ILE 35 N 1.69 1.42 -0.35 0.90 1.01 -0.73 -0.83 121.20 124.32 1gwy s ILE 35 Ca 0.01 -0.78 -0.24 0.00 0.00 0.00 0.00 60.65 59.64 1gwy s ILE 35 Cb -0.13 -1.50 0.01 0.00 0.01 0.00 0.00 42.46 40.85 1gwy s ILE 35 CO -0.04 0.21 0.80 -0.62 0.00 0.00 0.00 174.94 175.30 1gwy s ASP 36 N 1.50 6.59 -0.57 3.58 2.15 0.11 -1.12 116.67 128.92 1gwy s ASP 36 Ca 0.01 0.45 -0.22 0.00 0.43 0.00 0.00 52.55 53.22 1gwy s ASP 36 Cb -0.15 -2.41 0.06 0.00 -0.30 0.00 0.00 42.92 40.12 1gwy s ASP 36 CO -0.08 -0.72 0.86 0.21 -0.17 0.00 0.00 175.17 175.26 1gwy s ASN 37 N 1.80 6.25 -0.26 -0.34 2.47 0.07 -1.50 114.94 123.43 1gwy s ASN 37 Ca 0.32 -0.74 0.10 0.00 0.42 0.00 0.00 52.86 52.97 1gwy s ASN 37 Cb -0.13 -2.39 0.46 0.00 -1.45 0.00 0.00 41.25 37.73 1gwy s ASN 37 CO 0.16 -1.20 1.19 -0.62 -3.72 0.00 0.00 177.10 172.91 1gwy n GLU 38 N 7.16 2.88 0.00 0.43 -0.58 -0.12 0.09 120.64 130.51 1gwy n GLU 38 Ca -0.03 -3.85 0.13 0.00 -0.42 0.00 0.00 57.16 52.99 1gwy n GLU 38 Cb 0.46 -2.00 0.43 0.00 -0.57 0.00 0.00 31.44 29.76 1gwy n GLU 38 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1gwy n SER 39 N -0.75 0.32 0.00 1.62 3.41 -1.10 -2.92 113.62 114.20 1gwy n SER 39 Ca 0.34 -0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.94 1gwy n SER 39 Cb 0.90 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.78 1gwy n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gwy n GLY 40 N 1.47 3.24 3.39 5.00 0.00 -1.26 -4.63 105.19 112.41 1gwy n GLY 40 Ca 0.07 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 1gwy n GLY 40 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gwy s GLY 41 N -2.88 2.17 0.23 -0.02 0.00 -1.26 -4.85 107.32 100.71 1gwy s GLY 41 Ca 0.00 -1.69 -0.25 0.00 0.00 0.00 0.00 44.72 42.79 1gwy s GLY 41 CO 0.00 -1.68 0.83 -1.59 0.00 0.00 0.00 173.10 170.67 1gwy s THR 42 N -3.48 4.33 0.00 0.90 2.01 -1.26 -3.83 115.64 114.31 1gwy s THR 42 Ca 0.33 1.70 -0.01 0.00 0.31 0.00 0.00 61.69 64.02 1gwy s THR 42 Cb 0.05 -4.07 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 1gwy s THR 42 CO 0.16 0.35 0.11 0.26 -0.69 0.00 0.00 174.62 174.82 1gwy s TRP 43 N -1.35 3.35 -0.16 4.92 0.51 -0.68 -3.87 118.94 121.66 1gwy s TRP 43 Ca 0.42 0.24 0.01 0.00 -2.12 0.00 0.00 56.10 54.65 1gwy s TRP 43 Cb -0.21 -1.75 0.02 0.00 -0.81 0.00 0.00 33.47 30.72 1gwy s TRP 43 CO 0.25 0.58 -0.19 0.99 -0.51 0.00 0.00 176.95 178.07 1gwy s THR 44 N -1.25 1.91 0.34 2.01 2.01 0.68 -1.55 115.64 119.79 1gwy s THR 44 Ca 0.25 -0.85 -0.29 0.00 0.31 0.00 0.00 61.69 61.11 1gwy s THR 44 Cb -0.12 -1.73 -0.12 0.00 0.01 0.00 0.00 72.50 70.54 1gwy s THR 44 CO 0.16 0.52 1.47 0.00 -0.69 0.00 0.00 174.62 176.08 1gwy n ALA 45 N 4.56 2.12 -0.76 7.40 0.00 -0.26 -0.03 120.51 133.54 1gwy n ALA 45 Ca -0.20 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1gwy n ALA 45 Cb 0.50 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.56 1gwy n ALA 45 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1gwy n LEU 46 N 1.03 0.00 -3.73 0.00 4.32 -0.38 -4.81 117.00 113.44 1gwy n LEU 46 Ca 0.04 0.00 -0.05 0.00 -0.02 0.00 0.00 56.01 55.98 1gwy n LEU 46 Cb 0.37 -0.09 -0.02 0.00 -1.62 0.00 0.00 43.42 42.07 1gwy n LEU 46 CO 0.63 -0.12 0.64 0.54 -1.22 0.00 0.00 177.39 177.86 1gwy s ASN 47 N -1.37 -0.24 -0.08 -1.43 4.22 -1.22 -5.01 114.94 109.81 1gwy s ASN 47 Ca 0.00 -0.38 0.04 0.00 -2.14 0.00 0.00 52.86 50.38 1gwy s ASN 47 Cb 0.00 0.54 -0.00 0.00 1.28 0.00 0.00 41.25 43.07 1gwy s ASN 47 CO 0.00 -0.98 -0.22 0.00 -2.04 0.00 0.00 177.10 173.87 1gwy s ALA 48 N -3.45 1.94 -0.27 3.54 0.00 -1.26 -1.47 121.76 120.79 1gwy s ALA 48 Ca 0.10 -0.86 -0.01 0.00 0.00 0.00 0.00 51.96 51.19 1gwy s ALA 48 Cb -0.02 -0.70 0.04 0.00 0.00 0.00 0.00 23.12 22.43 1gwy s ALA 48 CO 0.01 0.29 -0.05 -0.47 0.00 0.00 0.00 175.76 175.54 1gwy s TYR 49 N 0.24 3.17 -0.38 0.00 5.04 0.51 -5.00 117.35 120.94 1gwy s TYR 49 Ca -0.13 -1.82 -0.16 0.00 -2.44 0.00 0.00 57.07 52.52 1gwy s TYR 49 Cb -0.16 -2.05 0.00 0.00 0.35 0.00 0.00 41.96 40.11 1gwy s TYR 49 CO 0.06 -0.79 0.37 -0.06 -1.34 0.00 0.00 175.55 173.79 1gwy s PHE 50 N 1.26 3.20 0.14 4.97 0.40 -1.26 -1.20 117.98 125.49 1gwy s PHE 50 Ca -0.03 -0.25 -0.01 0.00 -0.60 0.00 0.00 56.93 56.04 1gwy s PHE 50 Cb -0.18 -2.72 -0.07 0.00 0.51 0.00 0.00 43.02 40.55 1gwy s PHE 50 CO -0.03 -0.55 1.32 -0.09 0.70 0.00 0.00 175.22 176.57 1gwy h ARG 51 N 8.59 0.28 -3.55 0.44 1.12 -1.01 -3.45 114.38 116.80 1gwy h ARG 51 Ca -0.28 -0.32 -0.22 0.00 -1.11 0.00 0.00 59.98 58.05 1gwy h ARG 51 Cb 1.13 0.09 -0.28 0.00 -0.01 0.00 0.00 29.97 30.90 1gwy h ARG 51 CO 0.73 1.04 -0.65 0.45 -3.11 0.00 0.00 179.97 178.43 1gwy s SER 52 N -7.00 -0.06 0.00 -3.80 0.15 -0.72 -4.95 113.70 97.32 1gwy s SER 52 Ca -0.04 0.13 0.00 0.00 0.70 0.00 0.00 55.95 56.74 1gwy s SER 52 Cb 0.09 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.52 1gwy s SER 52 CO 0.85 -0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.86 1gwy n GLY 53 N 3.24 -1.83 2.13 9.45 0.00 -1.07 -0.98 105.19 116.13 1gwy n GLY 53 Ca -0.15 -1.42 -0.06 0.00 0.00 0.00 0.00 46.02 44.40 1gwy n GLY 53 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1gwy n THR 54 N 0.00 0.00 -4.10 2.61 5.66 -0.04 -4.82 114.28 113.58 1gwy n THR 54 Ca 0.00 -0.68 -0.09 0.00 -3.05 0.00 0.00 64.05 60.24 1gwy n THR 54 Cb 0.00 0.59 -0.10 0.00 -1.55 0.00 0.00 70.33 69.27 1gwy n THR 54 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1gwy s THR 55 N -2.52 0.37 -1.42 1.09 -1.32 -1.26 -0.78 115.64 109.80 1gwy s THR 55 Ca 0.11 -1.73 0.12 0.00 -1.21 0.00 0.00 61.69 58.98 1gwy s THR 55 Cb -0.02 -1.41 0.14 0.00 -1.51 0.00 0.00 72.50 69.71 1gwy s THR 55 CO 0.08 -0.88 0.96 0.47 -2.21 0.00 0.00 174.62 173.04 1gwy n ASP 56 N 0.27 2.21 -4.43 8.08 8.00 -1.26 -5.02 116.55 124.40 1gwy n ASP 56 Ca -0.15 -1.60 -0.24 0.00 0.71 0.00 0.00 54.79 53.51 1gwy n ASP 56 Cb 0.60 -0.05 -0.10 0.00 -0.02 0.00 0.00 41.12 41.55 1gwy n ASP 56 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1gwy s VAL 57 N -1.01 1.16 -0.05 2.53 -7.23 -1.26 -5.13 120.40 109.41 1gwy s VAL 57 Ca 0.16 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.30 1gwy s VAL 57 Cb 0.11 -2.68 -0.04 0.00 0.56 0.00 0.00 36.38 34.32 1gwy s VAL 57 CO 0.16 0.00 0.14 -0.63 -0.31 0.00 0.00 175.10 174.45 1gwy s ILE 58 N -3.18 5.27 0.15 -0.62 -1.09 -1.26 -5.01 121.20 115.45 1gwy s ILE 58 Ca 0.32 -0.08 -0.31 0.00 -2.23 0.00 0.00 60.65 58.35 1gwy s ILE 58 Cb 0.07 -3.38 -0.11 0.00 -1.58 0.00 0.00 42.46 37.47 1gwy s ILE 58 CO 0.15 0.45 1.74 -0.76 -1.23 0.00 0.00 174.94 175.29 1gwy s LEU 59 N -1.51 4.38 -0.31 2.97 1.43 -1.26 -4.29 118.68 120.09 1gwy s LEU 59 Ca 0.21 2.74 -0.39 0.00 -1.03 0.00 0.00 54.13 55.66 1gwy s LEU 59 Cb -0.12 -3.58 -0.15 0.00 0.03 0.00 0.00 46.19 42.37 1gwy s LEU 59 CO 0.12 -0.95 1.87 -2.65 0.23 0.00 0.00 176.35 174.96 1gwy n PRO 60 N 4.86 1.08 -0.24 1.29 -0.02 -1.26 -4.82 135.00 135.89 1gwy n PRO 60 Ca 0.16 0.38 0.03 0.00 -2.02 0.00 0.00 63.50 62.05 1gwy n PRO 60 Cb 0.37 -2.14 0.15 0.00 -0.02 0.00 0.00 33.50 31.86 1gwy n PRO 60 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1gwy h GLU 61 N 8.40 0.43 -4.79 -0.52 5.08 -1.88 -3.38 114.58 117.92 1gwy h GLU 61 Ca -0.40 -0.03 -0.39 0.00 -1.00 0.00 0.00 59.36 57.54 1gwy h GLU 61 Cb 1.32 -0.10 -0.27 0.00 0.50 0.00 0.00 28.75 30.20 1gwy h GLU 61 CO 0.98 0.28 -0.78 -0.06 -1.00 0.00 0.00 179.01 178.44 1gwy s PHE 62 N -6.05 0.85 -0.40 4.33 0.40 -1.26 -1.11 117.98 114.74 1gwy s PHE 62 Ca -0.13 -0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.01 1gwy s PHE 62 Cb 0.19 -0.53 0.12 0.00 0.51 0.00 0.00 43.02 43.31 1gwy s PHE 62 CO 0.76 -0.01 0.18 0.08 0.70 0.00 0.00 175.22 176.93 1gwy s VAL 63 N -0.40 1.37 0.93 -0.44 1.01 -0.59 -4.94 120.40 117.34 1gwy s VAL 63 Ca 0.02 -2.24 -0.11 0.00 0.00 0.00 0.00 61.98 59.65 1gwy s VAL 63 Cb -0.05 -1.98 0.15 0.00 0.00 0.00 0.00 36.38 34.50 1gwy s VAL 63 CO -0.00 -0.81 1.11 -2.84 0.00 0.00 0.00 175.10 172.56 1gwy s PRO 64 N 0.73 0.93 0.60 2.72 0.02 -1.26 -1.68 135.00 137.06 1gwy s PRO 64 Ca 0.15 1.29 -0.20 0.00 0.02 0.00 0.00 61.00 62.26 1gwy s PRO 64 Cb -0.22 -1.74 -0.03 0.00 0.02 0.00 0.00 34.50 32.53 1gwy s PRO 64 CO -0.07 -2.60 1.33 1.21 -0.33 0.00 0.00 177.00 176.53 1gwy s ASN 65 N -2.85 4.91 0.00 2.53 3.04 -1.25 -1.93 114.94 119.38 1gwy s ASN 65 Ca 0.66 2.69 0.00 0.00 0.04 0.00 0.00 52.86 56.25 1gwy s ASN 65 Cb -0.22 -2.63 0.00 0.00 -1.54 0.00 0.00 41.25 36.87 1gwy s ASN 65 CO 0.59 -1.81 0.00 0.35 -3.04 0.00 0.00 177.10 173.19 1gwy n THR 66 N -1.50 0.00 -4.23 -5.21 -2.24 0.11 -5.01 114.28 96.21 1gwy n THR 66 Ca 0.13 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.64 1gwy n THR 66 Cb 0.47 -0.16 -0.09 0.00 -2.10 0.00 0.00 70.33 68.45 1gwy n THR 66 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1gwy s LYS 67 N -0.32 2.24 -0.05 -0.78 -0.14 -0.81 -0.69 119.74 119.20 1gwy s LYS 67 Ca 0.00 -1.11 0.05 0.00 -1.36 0.00 0.00 55.97 53.55 1gwy s LYS 67 Cb 0.00 -2.30 -0.02 0.00 -1.68 0.00 0.00 37.83 33.83 1gwy s LYS 67 CO 0.00 0.47 -0.18 0.00 -0.76 0.00 0.00 175.35 174.88 1gwy s ALA 68 N -1.55 2.49 0.10 5.17 0.00 0.13 -0.75 121.76 127.34 1gwy s ALA 68 Ca 0.25 -1.02 -0.13 0.00 0.00 0.00 0.00 51.96 51.07 1gwy s ALA 68 Cb -0.10 -0.85 -0.06 0.00 0.00 0.00 0.00 23.12 22.11 1gwy s ALA 68 CO 0.16 0.52 0.47 -0.48 0.00 0.00 0.00 175.76 176.44 1gwy s LEU 69 N -0.61 4.37 -0.11 0.00 0.05 -0.27 -0.98 118.68 121.12 1gwy s LEU 69 Ca 0.09 0.94 0.03 0.00 0.05 0.00 0.00 54.13 55.24 1gwy s LEU 69 Cb -0.11 -3.05 -0.00 0.00 -2.05 0.00 0.00 46.19 40.98 1gwy s LEU 69 CO 0.01 0.17 -0.21 -0.76 -0.55 0.00 0.00 176.35 175.00 1gwy s LEU 70 N -1.80 2.26 0.19 1.48 1.43 -0.62 -1.77 118.68 119.84 1gwy s LEU 70 Ca 0.34 -0.51 -0.04 0.00 -1.03 0.00 0.00 54.13 52.89 1gwy s LEU 70 Cb -0.15 -1.47 -0.03 0.00 0.03 0.00 0.00 46.19 44.57 1gwy s LEU 70 CO 0.18 0.15 0.20 -0.47 0.23 0.00 0.00 176.35 176.63 1gwy s TYR 71 N 0.43 0.87 0.16 0.29 5.04 0.05 0.77 117.35 124.97 1gwy s TYR 71 Ca -0.15 -1.16 -0.21 0.00 -2.44 0.00 0.00 57.07 53.11 1gwy s TYR 71 Cb -0.17 -0.35 0.05 0.00 0.35 0.00 0.00 41.96 41.84 1gwy s TYR 71 CO 0.06 -0.69 0.55 -1.54 -1.34 0.00 0.00 175.55 172.60 1gwy s SER 72 N -3.09 -0.44 0.15 4.32 1.04 -1.26 -0.38 113.70 114.03 1gwy s SER 72 Ca 0.31 -0.16 -0.11 0.00 0.48 0.00 0.00 55.95 56.47 1gwy s SER 72 Cb 0.05 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.75 1gwy s SER 72 CO 0.08 -0.97 0.30 -0.83 0.98 0.00 0.00 173.24 172.80 1gwy s GLY 73 N -2.78 0.24 0.20 7.32 0.00 -0.70 -4.62 107.32 106.97 1gwy s GLY 73 Ca 0.03 -0.66 -0.15 0.00 0.00 0.00 0.00 44.72 43.94 1gwy s GLY 73 CO -0.11 -0.71 0.48 1.09 0.00 0.00 0.00 173.10 173.85 1gwy s ARG 74 N -3.91 1.37 0.81 2.90 1.70 0.04 -0.75 118.95 121.11 1gwy s ARG 74 Ca 0.12 -0.98 -0.11 0.00 -0.47 0.00 0.00 55.73 54.29 1gwy s ARG 74 Cb 0.03 0.49 0.08 0.00 -0.57 0.00 0.00 34.95 34.98 1gwy s ARG 74 CO -0.04 -0.57 1.10 -1.59 -1.08 0.00 0.00 175.30 173.12 1gwy s LYS 75 N -3.91 1.99 0.49 3.89 -2.85 -0.21 -0.86 119.74 118.28 1gwy s LYS 75 Ca 0.12 0.66 -0.23 0.00 -1.00 0.00 0.00 55.97 55.52 1gwy s LYS 75 Cb -0.00 -1.91 -0.07 0.00 -2.06 0.00 0.00 37.83 33.80 1gwy s LYS 75 CO -0.01 -1.69 1.26 -0.51 0.10 0.00 0.00 175.35 174.50 1gwy s ASP 76 N -3.85 5.83 0.40 0.03 1.01 -1.26 -4.59 116.67 114.24 1gwy s ASP 76 Ca 0.61 2.53 -0.25 0.00 0.71 0.00 0.00 52.55 56.15 1gwy s ASP 76 Cb -0.15 -2.62 -0.09 0.00 1.01 0.00 0.00 42.92 41.08 1gwy s ASP 76 CO 0.54 -1.17 1.12 0.28 0.21 0.00 0.00 175.17 176.16 1gwy s THR 77 N -1.41 3.39 0.00 -1.27 -1.32 -1.26 -4.79 115.64 108.98 1gwy s THR 77 Ca 0.66 1.12 0.00 0.00 -1.21 0.00 0.00 61.69 62.26 1gwy s THR 77 Cb -0.34 -3.61 0.00 0.00 -1.51 0.00 0.00 72.50 67.04 1gwy s THR 77 CO 0.42 0.06 0.00 0.61 -2.21 0.00 0.00 174.62 173.50 1gwy n GLY 78 N 0.54 -1.80 2.26 6.08 0.00 -1.26 -4.66 105.19 106.35 1gwy n GLY 78 Ca 0.05 -1.82 -0.03 0.00 0.00 0.00 0.00 46.02 44.22 1gwy n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1gwy n PRO 79 N 0.00 0.51 -4.49 1.61 -0.04 -1.26 -4.77 135.00 126.56 1gwy n PRO 79 Ca 0.00 -0.23 -0.25 0.00 -0.04 0.00 0.00 63.50 62.98 1gwy n PRO 79 Cb 0.00 -1.59 -0.17 0.00 -0.04 0.00 0.00 33.50 31.71 1gwy n PRO 79 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1gwy s VAL 80 N 2.25 1.12 -1.01 0.52 -7.23 -1.26 -5.08 120.40 109.70 1gwy s VAL 80 Ca 0.15 -0.45 -0.17 0.00 -1.81 0.00 0.00 61.98 59.70 1gwy s VAL 80 Cb 0.07 -1.04 0.15 0.00 0.56 0.00 0.00 36.38 36.12 1gwy s VAL 80 CO 0.00 0.36 1.21 0.00 -0.31 0.00 0.00 175.10 176.36 1gwy s ALA 81 N 0.80 3.58 0.17 1.32 0.00 -1.26 -4.90 121.76 121.48 1gwy s ALA 81 Ca -0.12 -2.97 -0.08 0.00 0.00 0.00 0.00 51.96 48.79 1gwy s ALA 81 Cb -0.15 -4.06 -0.01 0.00 0.00 0.00 0.00 23.12 18.89 1gwy s ALA 81 CO 0.02 -2.90 0.27 0.95 0.00 0.00 0.00 175.76 174.10 1gwy s THR 82 N 2.27 0.06 0.00 0.00 -4.23 -1.26 -4.91 115.64 107.57 1gwy s THR 82 Ca 0.35 -1.50 0.00 0.00 -1.18 0.00 0.00 61.69 59.37 1gwy s THR 82 Cb -0.04 -1.96 0.00 0.00 1.34 0.00 0.00 72.50 71.83 1gwy s THR 82 CO -0.07 -0.25 0.00 0.61 -0.54 0.00 0.00 174.62 174.37 1gwy n GLY 83 N -0.23 3.96 2.85 3.99 0.00 -1.26 -4.43 105.19 110.08 1gwy n GLY 83 Ca -0.06 -1.82 -0.30 0.00 0.00 0.00 0.00 46.02 43.84 1gwy n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gwy s ALA 84 N -2.35 1.73 -0.06 4.61 0.00 -0.14 -2.59 121.76 122.97 1gwy s ALA 84 Ca 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 50.54 1gwy s ALA 84 Cb 0.00 -1.48 0.02 0.00 0.00 0.00 0.00 23.12 21.66 1gwy s ALA 84 CO 0.00 -1.37 -0.03 0.08 0.00 0.00 0.00 175.76 174.44 1gwy s VAL 85 N 1.50 0.51 0.27 0.00 1.01 -0.15 -1.14 120.40 122.40 1gwy s VAL 85 Ca 0.01 -0.05 -0.15 0.00 0.00 0.00 0.00 61.98 61.79 1gwy s VAL 85 Cb -0.18 -0.58 0.01 0.00 0.00 0.00 0.00 36.38 35.63 1gwy s VAL 85 CO -0.12 0.25 0.57 0.00 0.00 0.00 0.00 175.10 175.79 1gwy s ALA 86 N 1.33 -0.54 -0.02 5.51 0.00 -0.56 -0.27 121.76 127.20 1gwy s ALA 86 Ca -0.05 -0.71 0.01 0.00 0.00 0.00 0.00 51.96 51.21 1gwy s ALA 86 Cb -0.13 0.99 0.02 0.00 0.00 0.00 0.00 23.12 23.99 1gwy s ALA 86 CO -0.02 -0.92 -0.01 0.00 0.00 0.00 0.00 175.76 174.81 1gwy s ALA 87 N -3.89 0.27 0.14 0.00 0.00 -0.34 -1.73 121.76 116.21 1gwy s ALA 87 Ca 0.19 0.08 0.03 0.00 0.00 0.00 0.00 51.96 52.26 1gwy s ALA 87 Cb -0.03 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 1gwy s ALA 87 CO 0.09 -0.03 -0.07 -0.59 0.00 0.00 0.00 175.76 175.16 1gwy s PHE 88 N 0.64 1.15 0.01 0.00 -0.12 0.36 -0.36 117.98 119.67 1gwy s PHE 88 Ca -0.06 -0.86 0.00 0.00 -0.05 0.00 0.00 56.93 55.96 1gwy s PHE 88 Cb -0.09 -0.62 -0.01 0.00 -0.63 0.00 0.00 43.02 41.66 1gwy s PHE 88 CO -0.01 -0.05 -0.03 0.00 -0.05 0.00 0.00 175.22 175.09 1gwy s ALA 89 N -3.48 0.12 -0.06 1.99 0.00 -0.54 -0.94 121.76 118.84 1gwy s ALA 89 Ca 0.17 -0.42 0.03 0.00 0.00 0.00 0.00 51.96 51.74 1gwy s ALA 89 Cb 0.04 0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.26 1gwy s ALA 89 CO -0.00 -0.10 -0.17 0.71 0.00 0.00 0.00 175.76 176.21 1gwy s TYR 90 N -1.00 1.77 0.00 0.00 1.51 -0.38 -1.25 117.35 118.01 1gwy s TYR 90 Ca -0.10 -0.61 -0.24 0.00 -1.01 0.00 0.00 57.07 55.11 1gwy s TYR 90 Cb -0.07 -1.22 -0.05 0.00 -0.11 0.00 0.00 41.96 40.51 1gwy s TYR 90 CO -0.01 -0.26 0.71 -0.47 -1.11 0.00 0.00 175.55 174.42 1gwy s TYR 91 N 0.34 3.68 0.14 2.71 5.04 0.96 -0.19 117.35 130.03 1gwy s TYR 91 Ca -0.11 1.35 0.06 0.00 -2.44 0.00 0.00 57.07 55.93 1gwy s TYR 91 Cb -0.14 -2.77 -0.04 0.00 0.35 0.00 0.00 41.96 39.36 1gwy s TYR 91 CO 0.04 0.24 0.06 -1.64 -1.34 0.00 0.00 175.55 172.90 1gwy s MET 92 N 0.17 2.66 0.48 4.97 -1.94 0.07 -0.23 119.30 125.48 1gwy s MET 92 Ca 0.37 -0.93 0.33 0.00 -1.71 0.00 0.00 55.69 53.75 1gwy s MET 92 Cb -0.19 -2.54 1.70 0.00 2.01 0.00 0.00 34.83 35.81 1gwy s MET 92 CO 0.20 0.49 1.99 0.77 -0.01 0.00 0.00 175.02 178.47 1gwy h SER 93 N 2.80 0.00 0.39 3.03 0.02 -1.85 -0.49 113.55 117.44 1gwy h SER 93 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 1gwy h SER 93 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1gwy h SER 93 CO 0.61 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.76 1gwy n SER 94 N -2.67 0.00 0.00 3.07 3.41 -1.26 -4.82 113.62 111.34 1gwy n SER 94 Ca -0.02 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 1gwy n SER 94 Cb 0.09 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 1gwy n SER 94 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gwy n GLY 95 N 0.13 0.64 3.41 5.00 0.00 -0.20 -4.98 105.19 109.19 1gwy n GLY 95 Ca 0.06 -0.48 -0.21 0.00 0.00 0.00 0.00 46.02 45.39 1gwy n GLY 95 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gwy s ASN 96 N -2.43 3.09 -0.10 1.61 0.01 -1.23 -1.65 114.94 114.24 1gwy s ASN 96 Ca 0.00 -1.04 -0.01 0.00 -0.71 0.00 0.00 52.86 51.11 1gwy s ASN 96 Cb 0.00 -0.22 -0.03 0.00 0.41 0.00 0.00 41.25 41.41 1gwy s ASN 96 CO 0.00 -0.08 -0.06 -0.89 -1.51 0.00 0.00 177.10 174.56 1gwy s THR 97 N -2.75 3.74 -0.33 1.60 2.01 0.24 -0.75 115.64 119.40 1gwy s THR 97 Ca 0.27 -0.45 -0.18 0.00 0.31 0.00 0.00 61.69 61.64 1gwy s THR 97 Cb -0.02 -2.57 -0.01 0.00 0.01 0.00 0.00 72.50 69.91 1gwy s THR 97 CO 0.11 0.56 0.49 -0.22 -0.69 0.00 0.00 174.62 174.87 1gwy s LEU 98 N -0.39 4.27 -0.14 4.42 2.96 0.74 -0.13 118.68 130.42 1gwy s LEU 98 Ca 0.06 0.08 -0.05 0.00 -0.22 0.00 0.00 54.13 54.00 1gwy s LEU 98 Cb -0.12 -2.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 1gwy s LEU 98 CO 0.02 -0.41 0.03 -0.83 -1.32 0.00 0.00 176.35 173.84 1gwy s GLY 99 N 1.71 1.87 -0.04 7.98 0.00 0.15 -1.25 107.32 117.73 1gwy s GLY 99 Ca 0.18 -0.77 0.03 0.00 0.00 0.00 0.00 44.72 44.16 1gwy s GLY 99 CO 0.12 -0.22 -0.11 0.14 0.00 0.00 0.00 173.10 173.02 1gwy s VAL 100 N -0.19 1.02 0.03 1.40 1.01 -0.12 -1.15 120.40 122.40 1gwy s VAL 100 Ca 0.06 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.64 1gwy s VAL 100 Cb -0.12 -0.91 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 1gwy s VAL 100 CO 0.02 0.32 -0.17 -0.32 0.00 0.00 0.00 175.10 174.94 1gwy s MET 101 N 0.37 1.20 -0.00 2.72 1.75 -0.48 -0.49 119.30 124.38 1gwy s MET 101 Ca -0.08 -0.77 -0.02 0.00 -1.25 0.00 0.00 55.69 53.58 1gwy s MET 101 Cb -0.12 -1.23 -0.00 0.00 2.84 0.00 0.00 34.83 36.31 1gwy s MET 101 CO 0.02 0.32 0.03 -0.59 -0.65 0.00 0.00 175.02 174.15 1gwy s PHE 102 N -0.69 0.07 -0.15 4.11 -0.12 -0.71 -2.16 117.98 118.33 1gwy s PHE 102 Ca 0.05 -0.14 -0.05 0.00 -0.05 0.00 0.00 56.93 56.75 1gwy s PHE 102 Cb -0.08 -0.06 0.06 0.00 -0.63 0.00 0.00 43.02 42.31 1gwy s PHE 102 CO 0.01 -0.12 0.09 0.45 -0.05 0.00 0.00 175.22 175.60 1gwy s SER 103 N -0.68 2.14 -0.38 1.98 0.15 0.38 -1.50 113.70 115.79 1gwy s SER 103 Ca -0.08 -0.50 0.03 0.00 0.70 0.00 0.00 55.95 56.10 1gwy s SER 103 Cb -0.05 -0.21 0.11 0.00 -1.71 0.00 0.00 66.02 64.16 1gwy s SER 103 CO -0.00 -0.33 0.11 -0.69 1.20 0.00 0.00 173.24 173.53 1gwy s VAL 104 N 2.15 2.51 0.79 4.45 1.01 -0.29 -1.70 120.40 129.32 1gwy s VAL 104 Ca 0.03 -2.47 -0.11 0.00 0.00 0.00 0.00 61.98 59.42 1gwy s VAL 104 Cb -0.15 -2.81 0.07 0.00 0.00 0.00 0.00 36.38 33.48 1gwy s VAL 104 CO -0.08 -0.65 1.10 -2.16 0.00 0.00 0.00 175.10 173.30 1gwy s PRO 105 N 0.73 2.14 0.02 2.72 0.04 -1.26 -0.97 135.00 138.41 1gwy s PRO 105 Ca 0.12 0.65 -0.22 0.00 0.04 0.00 0.00 61.00 61.59 1gwy s PRO 105 Cb -0.21 -1.92 -0.17 0.00 0.04 0.00 0.00 34.50 32.24 1gwy s PRO 105 CO -0.06 -1.59 1.29 0.35 0.04 0.00 0.00 177.00 177.04 1gwy h PHE 106 N -1.06 0.32 -3.06 0.56 3.57 -1.91 -3.44 116.94 111.92 1gwy h PHE 106 Ca -0.47 -0.10 -0.67 0.00 3.53 0.00 0.00 57.97 60.26 1gwy h PHE 106 Cb 1.27 -0.06 -0.12 0.00 2.79 0.00 0.00 35.95 39.82 1gwy h PHE 106 CO 0.47 0.72 -0.56 -0.51 -2.23 0.00 0.00 178.31 176.19 1gwy s ASP 107 N -6.06 5.70 -0.44 0.41 1.01 -1.26 -5.01 116.67 111.03 1gwy s ASP 107 Ca -0.15 0.26 0.04 0.00 0.71 0.00 0.00 52.55 53.42 1gwy s ASP 107 Cb 0.04 -1.73 0.54 0.00 1.01 0.00 0.00 42.92 42.77 1gwy s ASP 107 CO 0.74 0.38 1.71 -1.22 0.21 0.00 0.00 175.17 176.98 1gwy n TYR 108 N 2.18 2.44 0.00 4.23 4.01 -1.25 -4.15 117.16 124.61 1gwy n TYR 108 Ca -0.19 -2.13 0.00 0.00 -0.16 0.00 0.00 57.90 55.42 1gwy n TYR 108 Cb 0.54 -0.86 0.00 0.00 -0.31 0.00 0.00 39.34 38.72 1gwy n TYR 108 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1gwy n ASN 109 N -1.03 0.00 -0.56 7.72 3.02 -1.26 -4.51 115.26 118.64 1gwy n ASN 109 Ca 0.50 0.35 0.09 0.00 -0.03 0.00 0.00 54.58 55.49 1gwy n ASN 109 Cb 1.13 -0.29 0.04 0.00 -0.61 0.00 0.00 39.78 40.04 1gwy n ASN 109 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1gwy n TRP 110 N -1.38 0.00 -4.91 3.10 7.02 -1.26 -4.94 117.44 115.06 1gwy n TRP 110 Ca 0.00 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.15 1gwy n TRP 110 Cb 0.00 0.00 -0.13 0.00 -2.42 0.00 0.00 31.31 28.76 1gwy n TRP 110 CO 0.00 0.00 0.00 0.71 -2.02 0.00 0.00 177.69 176.38 1gwy s TYR 111 N -1.78 2.68 0.17 -5.99 2.02 -1.26 -5.12 117.35 108.07 1gwy s TYR 111 Ca 0.18 -0.18 0.01 0.00 -0.37 0.00 0.00 57.07 56.70 1gwy s TYR 111 Cb 0.15 -1.63 -0.00 0.00 -0.40 0.00 0.00 41.96 40.08 1gwy s TYR 111 CO 0.34 0.17 0.02 0.43 -1.57 0.00 0.00 175.55 174.93 1gwy n SER 112 N 2.34 1.96 -4.85 2.29 7.64 -1.26 -3.97 113.62 117.77 1gwy n SER 112 Ca -0.17 -1.80 -0.34 0.00 1.01 0.00 0.00 58.87 57.57 1gwy n SER 112 Cb 0.52 0.22 -0.06 0.00 -1.01 0.00 0.00 64.21 63.89 1gwy n SER 112 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1gwy s ASN 113 N -1.97 6.79 0.04 6.43 0.01 -1.26 -4.46 114.94 120.53 1gwy s ASN 113 Ca 0.03 1.11 -0.02 0.00 -0.71 0.00 0.00 52.86 53.27 1gwy s ASN 113 Cb 0.00 -2.30 -0.03 0.00 0.41 0.00 0.00 41.25 39.33 1gwy s ASN 113 CO 0.02 -0.00 0.01 0.26 -1.51 0.00 0.00 177.10 175.87 1gwy s TRP 114 N -1.65 0.37 0.21 2.20 0.52 -0.69 -0.66 118.94 119.24 1gwy s TRP 114 Ca 0.44 -0.79 -0.22 0.00 0.02 0.00 0.00 56.10 55.54 1gwy s TRP 114 Cb -0.13 -0.27 0.05 0.00 -1.15 0.00 0.00 33.47 31.97 1gwy s TRP 114 CO 0.20 -0.34 0.65 1.67 0.02 0.00 0.00 176.95 179.15 1gwy s TRP 115 N -3.01 -0.40 -0.05 -1.98 1.48 0.04 -0.47 118.94 114.56 1gwy s TRP 115 Ca -0.02 0.09 -0.31 0.00 -1.06 0.00 0.00 56.10 54.81 1gwy s TRP 115 Cb 0.01 0.62 0.11 0.00 -1.16 0.00 0.00 33.47 33.05 1gwy s TRP 115 CO -0.07 -1.00 1.03 0.34 -4.06 0.00 0.00 176.95 173.19 1gwy s ASP 116 N -2.82 -0.25 0.00 -2.66 -1.08 -0.92 0.16 116.67 109.10 1gwy s ASP 116 Ca 0.05 -0.05 0.02 0.00 -0.52 0.00 0.00 52.55 52.05 1gwy s ASP 116 Cb -0.03 0.30 -0.01 0.00 -1.46 0.00 0.00 42.92 41.73 1gwy s ASP 116 CO -0.05 -0.50 -0.06 -0.69 0.52 0.00 0.00 175.17 174.38 1gwy s VAL 117 N -2.86 0.50 0.06 1.11 1.01 -1.26 -1.38 120.40 117.58 1gwy s VAL 117 Ca 0.08 -0.36 -0.20 0.00 0.00 0.00 0.00 61.98 61.49 1gwy s VAL 117 Cb -0.01 -0.44 0.04 0.00 0.00 0.00 0.00 36.38 35.97 1gwy s VAL 117 CO -0.06 0.08 0.47 -0.75 0.00 0.00 0.00 175.10 174.84 1gwy s LYS 118 N -0.31 1.01 -0.18 2.72 2.20 -0.30 -5.00 119.74 119.88 1gwy s LYS 118 Ca 0.01 -0.36 -0.05 0.00 -0.36 0.00 0.00 55.97 55.21 1gwy s LYS 118 Cb -0.03 0.46 -0.03 0.00 -1.51 0.00 0.00 37.83 36.72 1gwy s LYS 118 CO -0.00 -0.37 -0.00 0.42 -0.36 0.00 0.00 175.35 175.04 1gwy s ILE 119 N -2.73 4.07 0.01 5.43 1.01 -1.26 0.31 121.20 128.04 1gwy s ILE 119 Ca -0.04 -0.28 0.02 0.00 0.00 0.00 0.00 60.65 60.35 1gwy s ILE 119 Cb -0.00 -2.82 -0.04 0.00 0.01 0.00 0.00 42.46 39.61 1gwy s ILE 119 CO -0.04 0.45 -0.00 -0.31 0.00 0.00 0.00 174.94 175.04 1gwy s TYR 120 N 0.71 3.06 0.24 3.97 1.51 0.82 -4.94 117.35 122.72 1gwy s TYR 120 Ca -0.00 0.06 -0.30 0.00 -1.01 0.00 0.00 57.07 55.83 1gwy s TYR 120 Cb -0.14 -1.65 -0.09 0.00 -0.11 0.00 0.00 41.96 39.97 1gwy s TYR 120 CO 0.02 0.46 1.24 -1.54 -1.11 0.00 0.00 175.55 174.62 1gwy s SER 121 N -1.65 6.99 0.31 2.29 1.04 -1.26 -0.59 113.70 120.83 1gwy s SER 121 Ca 0.20 2.39 0.00 0.00 0.48 0.00 0.00 55.95 59.03 1gwy s SER 121 Cb -0.12 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.38 1gwy s SER 121 CO 0.11 -0.41 0.00 0.61 0.98 0.00 0.00 173.24 174.53 1gwy n GLY 122 N 1.76 -1.78 3.64 7.32 0.00 -0.66 -4.70 105.19 110.78 1gwy n GLY 122 Ca 0.03 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.32 1gwy n GLY 122 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1gwy s LYS 123 N -0.28 4.12 -0.19 1.61 2.20 -1.26 -2.36 119.74 123.59 1gwy s LYS 123 Ca 0.00 1.07 -0.01 0.00 -0.36 0.00 0.00 55.97 56.67 1gwy s LYS 123 Cb 0.00 -3.70 0.05 0.00 -1.51 0.00 0.00 37.83 32.67 1gwy s LYS 123 CO 0.00 -0.75 -0.02 0.50 -0.36 0.00 0.00 175.35 174.72 1gwy s ARG 124 N 3.33 1.22 0.58 4.03 3.52 -1.26 -5.03 118.95 125.34 1gwy s ARG 124 Ca 0.42 -0.59 -0.17 0.00 -0.13 0.00 0.00 55.73 55.26 1gwy s ARG 124 Cb -0.14 -2.15 -0.04 0.00 -1.56 0.00 0.00 34.95 31.07 1gwy s ARG 124 CO 0.11 -0.53 1.10 -0.98 -0.81 0.00 0.00 175.30 174.19 1gwy s ARG 125 N 1.65 3.21 0.14 5.12 1.70 -1.26 -4.88 118.95 124.63 1gwy s ARG 125 Ca -0.01 1.45 -0.30 0.00 -0.47 0.00 0.00 55.73 56.39 1gwy s ARG 125 Cb -0.17 -2.00 -0.07 0.00 -0.57 0.00 0.00 34.95 32.15 1gwy s ARG 125 CO -0.07 -0.93 1.05 0.00 -1.08 0.00 0.00 175.30 174.26 1gwy s ALA 126 N -2.09 3.31 0.30 7.88 0.00 -1.26 -4.83 121.76 125.07 1gwy s ALA 126 Ca 0.69 0.71 -0.15 0.00 0.00 0.00 0.00 51.96 53.21 1gwy s ALA 126 Cb -0.21 -3.33 0.06 0.00 0.00 0.00 0.00 23.12 19.64 1gwy s ALA 126 CO 0.33 -0.15 0.78 -0.40 0.00 0.00 0.00 175.76 176.32 1gwy n ASP 127 N 2.69 -1.94 -0.30 0.00 5.68 -1.26 -4.59 116.55 116.84 1gwy n ASP 127 Ca 0.03 -2.26 0.13 0.00 -0.50 0.00 0.00 54.79 52.19 1gwy n ASP 127 Cb 0.48 3.21 0.38 0.00 -1.14 0.00 0.00 41.12 44.04 1gwy n ASP 127 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 1gwy h GLN 128 N 0.00 0.66 -0.42 0.11 5.75 -1.94 -0.13 115.11 119.14 1gwy h GLN 128 Ca -0.29 -0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.16 1gwy h GLN 128 Cb 1.11 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 29.49 1gwy h GLN 128 CO 0.37 0.44 0.20 0.78 -2.65 0.00 0.00 178.83 177.97 1gwy h GLY 129 N 0.68 0.65 0.89 2.39 0.00 -1.96 0.33 103.07 106.06 1gwy h GLY 129 Ca 0.49 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.46 1gwy h GLY 129 CO -0.25 0.30 0.02 1.98 0.00 0.00 0.00 176.54 178.59 1gwy h MET 130 N 0.54 0.55 -0.28 4.80 1.85 -1.47 -0.91 114.93 120.01 1gwy h MET 130 Ca 0.14 -0.16 0.05 0.00 -0.61 0.00 0.00 59.70 59.12 1gwy h MET 130 Cb 0.12 -0.05 -0.05 0.00 0.43 0.00 0.00 31.60 32.05 1gwy h MET 130 CO -0.02 0.67 -0.02 -0.92 -0.40 0.00 0.00 176.91 176.22 1gwy h TYR 131 N 0.36 -0.06 -0.36 1.39 3.20 -0.88 -1.46 116.97 119.16 1gwy h TYR 131 Ca 0.09 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.94 1gwy h TYR 131 Cb 0.41 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 1gwy h TYR 131 CO 0.03 -0.07 0.04 0.93 -1.64 0.00 0.00 178.16 177.45 1gwy h GLU 132 N 0.05 0.54 -0.50 1.82 5.08 -0.76 0.31 114.58 121.14 1gwy h GLU 132 Ca 0.13 -0.11 -0.09 0.00 -1.00 0.00 0.00 59.36 58.30 1gwy h GLU 132 Cb 0.19 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1gwy h GLU 132 CO -0.25 0.54 -0.04 0.22 -1.00 0.00 0.00 179.01 178.49 1gwy h ASP 133 N 0.53 0.84 0.15 1.42 1.82 -0.51 -0.89 116.42 119.78 1gwy h ASP 133 Ca 0.12 -0.23 -0.26 0.00 -0.39 0.00 0.00 57.03 56.27 1gwy h ASP 133 Cb 0.28 -0.23 0.01 0.00 0.68 0.00 0.00 39.33 40.08 1gwy h ASP 133 CO 0.00 0.93 -1.21 -0.07 -1.61 0.00 0.00 179.24 177.28 1gwy h LEU 134 N 0.79 0.51 -0.35 2.28 3.38 -0.89 -3.08 115.31 117.94 1gwy h LEU 134 Ca 0.14 -0.91 -0.19 0.00 0.09 0.00 0.00 57.88 57.01 1gwy h LEU 134 Cb 0.53 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 1gwy h LEU 134 CO 0.03 1.56 -0.66 0.22 0.09 0.00 0.00 178.44 179.68 1gwy h TYR 135 N -0.23 0.84 -0.61 1.13 3.20 -0.40 -3.27 116.97 117.63 1gwy h TYR 135 Ca -0.24 -0.34 0.00 0.00 3.14 0.00 0.00 58.73 61.30 1gwy h TYR 135 Cb 1.81 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 39.93 1gwy h TYR 135 CO 0.15 1.12 0.00 0.66 -1.64 0.00 0.00 178.16 178.45 1gwy n TYR 136 N -3.93 0.82 0.00 -3.82 4.02 -0.34 -4.54 117.16 109.36 1gwy n TYR 136 Ca -0.05 -0.41 0.00 0.00 -0.01 0.00 0.00 57.90 57.43 1gwy n TYR 136 Cb 0.67 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.99 1gwy n TYR 136 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1gwy n GLY 137 N 1.55 1.23 2.52 2.72 0.00 -1.17 -4.98 105.19 107.06 1gwy n GLY 137 Ca 0.22 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.10 1gwy n GLY 137 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1gwy n ASN 138 N 0.00 -1.36 -4.78 1.61 5.15 -1.26 -5.11 115.26 109.50 1gwy n ASN 138 Ca 0.00 -3.23 -0.32 0.00 -0.60 0.00 0.00 54.58 50.43 1gwy n ASN 138 Cb 0.00 0.86 0.05 0.00 -0.53 0.00 0.00 39.78 40.15 1gwy n ASN 138 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1gwy s PRO 139 N -0.43 2.85 0.49 1.20 0.04 -1.25 -5.03 135.00 132.86 1gwy s PRO 139 Ca 0.31 1.25 -0.08 0.00 0.04 0.00 0.00 61.00 62.52 1gwy s PRO 139 Cb 0.26 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.79 1gwy s PRO 139 CO -0.13 -1.19 0.83 0.71 0.04 0.00 0.00 177.00 177.26 1gwy s TYR 140 N -2.56 3.55 0.15 0.56 1.51 0.12 -4.84 117.35 115.84 1gwy s TYR 140 Ca 0.64 0.98 -0.02 0.00 -1.01 0.00 0.00 57.07 57.66 1gwy s TYR 140 Cb -0.18 -2.43 -0.05 0.00 -0.11 0.00 0.00 41.96 39.19 1gwy s TYR 140 CO 0.45 -0.32 0.35 0.50 -1.11 0.00 0.00 175.55 175.42 1gwy s ARG 141 N -4.59 3.54 -0.98 -0.62 3.52 -1.26 -0.78 118.95 117.78 1gwy s ARG 141 Ca 0.50 -0.26 -0.23 0.00 -0.13 0.00 0.00 55.73 55.61 1gwy s ARG 141 Cb -0.10 -2.88 0.02 0.00 -1.56 0.00 0.00 34.95 30.43 1gwy s ARG 141 CO 0.43 0.47 1.59 0.20 -0.81 0.00 0.00 175.30 177.18 1gwy s GLY 142 N -2.75 0.95 -0.11 8.12 0.00 0.16 -4.68 107.32 109.01 1gwy s GLY 142 Ca 0.39 -2.03 0.15 0.00 0.00 0.00 0.00 44.72 43.23 1gwy s GLY 142 CO 0.27 2.92 1.19 2.09 0.00 0.00 0.00 173.10 179.56 1gwy n ASP 143 N 10.34 2.64 -1.59 1.64 5.68 -0.92 -3.42 116.55 130.91 1gwy n ASP 143 Ca 0.35 -2.83 -0.19 0.00 -0.50 0.00 0.00 54.79 51.61 1gwy n ASP 143 Cb 0.50 -0.37 -0.06 0.00 -1.14 0.00 0.00 41.12 40.04 1gwy n ASP 143 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1gwy n ASN 144 N -0.99 -5.28 -4.31 -1.12 3.02 -0.85 -4.88 115.26 100.85 1gwy n ASN 144 Ca 0.14 0.35 -0.18 0.00 -0.03 0.00 0.00 54.58 54.86 1gwy n ASN 144 Cb 0.62 -4.40 -0.10 0.00 -0.61 0.00 0.00 39.78 35.28 1gwy n ASN 144 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1gwy s GLY 145 N -2.65 1.32 0.19 7.41 0.00 -1.26 -5.00 107.32 107.32 1gwy s GLY 145 Ca 0.00 -1.58 -0.13 0.00 0.00 0.00 0.00 44.72 43.01 1gwy s GLY 145 CO 0.00 -1.67 0.58 -0.98 0.00 0.00 0.00 173.10 171.03 1gwy s TRP 146 N -2.90 3.54 0.03 1.90 0.52 -1.26 -4.30 118.94 116.46 1gwy s TRP 146 Ca 0.19 1.04 0.01 0.00 0.02 0.00 0.00 56.10 57.37 1gwy s TRP 146 Cb -0.01 -2.37 -0.02 0.00 -1.15 0.00 0.00 33.47 29.92 1gwy s TRP 146 CO 0.05 0.35 -0.05 -1.01 0.02 0.00 0.00 176.95 176.31 1gwy s HIS 147 N -1.62 0.40 0.02 -1.98 3.76 -0.21 -4.98 115.29 110.69 1gwy s HIS 147 Ca 0.42 -0.49 -0.15 0.00 -0.15 0.00 0.00 55.06 54.70 1gwy s HIS 147 Cb -0.14 -0.26 0.02 0.00 1.11 0.00 0.00 32.58 33.32 1gwy s HIS 147 CO 0.20 -0.14 0.32 -1.83 -0.85 0.00 0.00 174.74 172.44 1gwy s GLU 148 N -1.41 0.77 0.06 1.40 -1.05 -1.26 -1.15 118.70 116.06 1gwy s GLU 148 Ca -0.13 -0.36 -0.27 0.00 -0.15 0.00 0.00 54.97 54.06 1gwy s GLU 148 Cb -0.09 0.34 0.09 0.00 -0.44 0.00 0.00 34.13 34.02 1gwy s GLU 148 CO -0.00 -0.24 0.88 -1.59 0.95 0.00 0.00 175.26 175.26 1gwy s LYS 149 N -2.05 0.98 0.00 -4.83 -2.85 -0.74 -5.01 119.74 105.25 1gwy s LYS 149 Ca -0.08 -0.43 -0.27 0.00 -1.00 0.00 0.00 55.97 54.18 1gwy s LYS 149 Cb -0.02 0.41 -0.04 0.00 -2.06 0.00 0.00 37.83 36.11 1gwy s LYS 149 CO -0.00 -0.44 0.87 1.21 0.10 0.00 0.00 175.35 177.09 1gwy s ASN 150 N -2.65 7.26 0.00 0.03 3.84 -1.26 -1.53 114.94 120.64 1gwy s ASN 150 Ca 0.07 1.52 0.24 0.00 0.21 0.00 0.00 52.86 54.89 1gwy s ASN 150 Cb -0.01 -2.51 0.21 0.00 -0.55 0.00 0.00 41.25 38.38 1gwy s ASN 150 CO -0.06 -0.16 1.22 0.18 -2.79 0.00 0.00 177.10 175.50 1gwy n LEU 151 N 3.56 1.55 0.00 3.21 4.77 0.47 -4.94 117.00 125.62 1gwy n LEU 151 Ca 0.02 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 1gwy n LEU 151 Cb 0.51 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1gwy n LEU 151 CO 0.50 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 1gwy n GLY 152 N 1.41 -0.82 2.47 -0.72 0.00 -1.15 -4.60 105.19 101.79 1gwy n GLY 152 Ca 0.09 -1.70 -0.20 0.00 0.00 0.00 0.00 46.02 44.22 1gwy n GLY 152 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1gwy n TYR 153 N -0.79 -0.39 -1.37 1.61 4.02 -1.26 -1.34 117.16 117.64 1gwy n TYR 153 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.80 1gwy n TYR 153 Cb 0.00 -3.48 -0.03 0.00 -0.02 0.00 0.00 39.34 35.81 1gwy n TYR 153 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1gwy n GLY 154 N -0.56 0.90 3.33 2.72 0.00 -1.26 -5.02 105.19 105.30 1gwy n GLY 154 Ca -0.21 -0.64 -0.20 0.00 0.00 0.00 0.00 46.02 44.97 1gwy n GLY 154 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gwy s LEU 155 N -2.01 2.47 0.19 0.99 1.43 -0.45 -4.36 118.68 116.93 1gwy s LEU 155 Ca 0.00 -0.90 -0.03 0.00 -1.03 0.00 0.00 54.13 52.17 1gwy s LEU 155 Cb 0.00 -0.76 -0.03 0.00 0.03 0.00 0.00 46.19 45.43 1gwy s LEU 155 CO 0.00 -0.08 0.17 0.00 0.23 0.00 0.00 176.35 176.67 1gwy s ARG 156 N -3.01 1.18 0.01 1.70 1.70 0.07 -0.39 118.95 120.21 1gwy s ARG 156 Ca 0.17 -1.51 0.00 0.00 -0.47 0.00 0.00 55.73 53.92 1gwy s ARG 156 Cb -0.04 0.30 -0.01 0.00 -0.57 0.00 0.00 34.95 34.62 1gwy s ARG 156 CO 0.06 -0.40 -0.02 0.00 -1.08 0.00 0.00 175.30 173.86 1gwy s MET 157 N -4.11 0.24 -0.02 3.89 0.23 -0.58 -1.58 119.30 117.36 1gwy s MET 157 Ca 0.32 -0.44 0.01 0.00 -1.03 0.00 0.00 55.69 54.55 1gwy s MET 157 Cb 0.06 0.05 0.02 0.00 -1.53 0.00 0.00 34.83 33.43 1gwy s MET 157 CO 0.09 -0.03 -0.02 0.21 -2.03 0.00 0.00 175.02 173.24 1gwy s LYS 158 N -1.03 0.43 0.28 3.16 2.20 -0.73 -1.79 119.74 122.26 1gwy s LYS 158 Ca -0.11 -0.03 -0.20 0.00 -0.36 0.00 0.00 55.97 55.27 1gwy s LYS 158 Cb -0.07 -0.51 0.05 0.00 -1.51 0.00 0.00 37.83 35.79 1gwy s LYS 158 CO -0.01 -0.05 0.86 0.20 -0.36 0.00 0.00 175.35 175.99 1gwy s GLY 159 N 0.65 0.10 0.01 5.54 0.00 -0.30 -0.45 107.32 112.87 1gwy s GLY 159 Ca -0.07 -0.40 -0.13 0.00 0.00 0.00 0.00 44.72 44.12 1gwy s GLY 159 CO -0.01 0.39 0.27 -1.50 0.00 0.00 0.00 173.10 172.25 1gwy s ILE 160 N -2.82 0.07 -0.02 0.90 2.07 -0.02 -1.05 121.20 120.33 1gwy s ILE 160 Ca 0.15 -0.61 0.00 0.00 -1.41 0.00 0.00 60.65 58.79 1gwy s ILE 160 Cb -0.04 -0.69 0.02 0.00 0.13 0.00 0.00 42.46 41.89 1gwy s ILE 160 CO 0.07 -0.33 0.02 -0.32 -1.91 0.00 0.00 174.94 172.47 1gwy s MET 161 N -1.74 0.04 0.81 3.50 -2.45 -1.26 -1.16 119.30 117.04 1gwy s MET 161 Ca -0.11 0.13 -0.12 0.00 -1.25 0.00 0.00 55.69 54.34 1gwy s MET 161 Cb -0.04 -0.25 0.08 0.00 1.25 0.00 0.00 34.83 35.87 1gwy s MET 161 CO 0.01 -0.13 1.12 0.95 1.05 0.00 0.00 175.02 178.02 1gwy s THR 162 N 0.86 2.71 -2.46 10.11 -4.23 -0.38 -2.00 115.64 120.25 1gwy s THR 162 Ca -0.07 0.23 0.26 0.00 -1.18 0.00 0.00 61.69 60.92 1gwy s THR 162 Cb -0.11 -3.06 0.30 0.00 1.34 0.00 0.00 72.50 70.97 1gwy s THR 162 CO -0.02 -0.30 1.45 -1.54 -0.54 0.00 0.00 174.62 173.67 1gwy n SER 163 N -3.42 1.99 -4.90 3.99 3.41 -1.22 -4.51 113.62 108.96 1gwy n SER 163 Ca 0.07 -1.56 -0.21 0.00 -0.26 0.00 0.00 58.87 56.91 1gwy n SER 163 Cb 0.58 0.10 0.06 0.00 -0.26 0.00 0.00 64.21 64.69 1gwy n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gwy s ALA 164 N -2.16 4.17 0.45 7.33 0.00 -1.26 -4.73 121.76 125.56 1gwy s ALA 164 Ca 0.29 -1.75 0.20 0.00 0.00 0.00 0.00 51.96 50.71 1gwy s ALA 164 Cb 0.20 -1.81 1.23 0.00 0.00 0.00 0.00 23.12 22.74 1gwy s ALA 164 CO 0.39 -0.94 2.05 0.78 0.00 0.00 0.00 175.76 178.04 1gwy h GLY 165 N -0.00 0.00 -7.63 0.00 0.00 -1.91 -3.20 103.07 90.32 1gwy h GLY 165 Ca -0.36 0.00 -0.74 0.00 0.00 0.00 0.00 47.33 46.22 1gwy h GLY 165 CO 0.44 0.00 -0.07 -0.54 0.00 0.00 0.00 176.54 176.36 1gwy s GLU 166 N -4.51 3.22 0.21 4.80 2.02 -1.26 -0.94 118.70 122.23 1gwy s GLU 166 Ca -0.04 -2.67 -0.06 0.00 0.02 0.00 0.00 54.97 52.23 1gwy s GLU 166 Cb 0.15 -4.11 -0.06 0.00 0.10 0.00 0.00 34.13 30.21 1gwy s GLU 166 CO 0.65 -1.24 0.47 0.00 0.02 0.00 0.00 175.26 175.16 1gwy s ALA 167 N -0.26 3.69 -0.02 5.21 0.00 -0.31 -4.98 121.76 125.09 1gwy s ALA 167 Ca 0.20 -0.51 0.06 0.00 0.00 0.00 0.00 51.96 51.70 1gwy s ALA 167 Cb -0.14 -2.24 -0.01 0.00 0.00 0.00 0.00 23.12 20.73 1gwy s ALA 167 CO -0.07 0.49 -0.19 0.15 0.00 0.00 0.00 175.76 176.14 1gwy s LYS 168 N -3.00 1.64 -0.07 0.00 1.02 -1.26 -0.87 119.74 117.20 1gwy s LYS 168 Ca 0.43 -0.69 -0.01 0.00 0.02 0.00 0.00 55.97 55.72 1gwy s LYS 168 Cb -0.11 -1.55 0.03 0.00 -0.52 0.00 0.00 37.83 35.67 1gwy s LYS 168 CO 0.26 0.39 -0.01 1.41 -0.92 0.00 0.00 175.35 176.47 1gwy s MET 169 N -0.37 0.70 -0.11 1.68 1.75 -0.14 -1.25 119.30 121.56 1gwy s MET 169 Ca 0.05 0.05 0.03 0.00 -1.25 0.00 0.00 55.69 54.57 1gwy s MET 169 Cb -0.08 -0.98 0.01 0.00 2.84 0.00 0.00 34.83 36.61 1gwy s MET 169 CO -0.00 -0.26 -0.21 -1.14 -0.65 0.00 0.00 175.02 172.75 1gwy s GLN 170 N 1.76 2.85 0.02 4.11 0.74 -0.31 -0.83 119.66 128.00 1gwy s GLN 170 Ca 0.02 -0.80 0.02 0.00 0.05 0.00 0.00 55.36 54.65 1gwy s GLN 170 Cb -0.13 -2.23 -0.01 0.00 1.10 0.00 0.00 33.01 31.74 1gwy s GLN 170 CO -0.05 0.08 -0.06 0.42 -0.55 0.00 0.00 175.29 175.13 1gwy s ILE 171 N 0.59 0.43 -0.07 -2.34 1.01 -0.01 -0.84 121.20 119.97 1gwy s ILE 171 Ca -0.13 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 59.92 1gwy s ILE 171 Cb -0.17 -0.44 0.01 0.00 0.01 0.00 0.00 42.46 41.87 1gwy s ILE 171 CO 0.04 -0.15 -0.16 -0.75 0.00 0.00 0.00 174.94 173.92 1gwy s LYS 172 N -0.84 2.11 -0.29 2.79 2.20 0.41 0.10 119.74 126.22 1gwy s LYS 172 Ca -0.04 -0.56 -0.05 0.00 -0.36 0.00 0.00 55.97 54.95 1gwy s LYS 172 Cb -0.06 -1.68 0.02 0.00 -1.51 0.00 0.00 37.83 34.60 1gwy s LYS 172 CO 0.00 0.08 0.05 0.42 -0.36 0.00 0.00 175.35 175.54 1gwy s ILE 173 N 0.53 3.64 0.10 5.43 -1.09 -0.56 -1.77 121.20 127.48 1gwy s ILE 173 Ca -0.15 -0.86 0.10 0.00 -2.23 0.00 0.00 60.65 57.51 1gwy s ILE 173 Cb -0.16 -2.90 -0.04 0.00 -1.58 0.00 0.00 42.46 37.78 1gwy s ILE 173 CO 0.05 0.07 -0.24 -0.44 -1.23 0.00 0.00 174.94 173.15 1gwy s SER 174 N 1.43 3.48 0.00 3.58 0.01 -0.62 -0.94 113.70 120.65 1gwy s SER 174 Ca 0.01 -0.63 0.19 0.00 1.31 0.00 0.00 55.95 56.83 1gwy s SER 174 Cb -0.17 -0.36 0.15 0.00 0.21 0.00 0.00 66.02 65.84 1gwy s SER 174 CO 0.01 0.21 1.10 -2.11 0.41 0.00 0.00 173.24 172.85