#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g9k n PRO 11 N 0.00 0.13 -3.60 0.00 -0.04 -1.26 -4.72 135.00 125.51 2g9k n PRO 11 Ca 0.00 0.11 -0.20 0.00 -0.04 0.00 0.00 63.50 63.37 2g9k n PRO 11 Cb 0.00 -1.65 -0.15 0.00 -0.04 0.00 0.00 33.50 31.65 2g9k n PRO 11 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2g9k s LEU 12 N -3.77 0.06 0.07 1.53 2.96 -1.25 -0.02 118.68 118.25 2g9k s LEU 12 Ca 0.12 -0.14 0.06 0.00 -0.22 0.00 0.00 54.13 53.96 2g9k s LEU 12 Cb 0.16 0.11 -0.03 0.00 0.50 0.00 0.00 46.19 46.93 2g9k s LEU 12 CO 0.56 -0.30 -0.16 -0.32 -1.32 0.00 0.00 176.35 174.81 2g9k s MET 13 N 2.25 0.94 -0.06 1.98 -2.45 0.15 -4.42 119.30 117.69 2g9k s MET 13 Ca 0.04 -0.97 0.03 0.00 -1.25 0.00 0.00 55.69 53.54 2g9k s MET 13 Cb -0.14 -1.02 0.00 0.00 1.25 0.00 0.00 34.83 34.92 2g9k s MET 13 CO -0.08 0.24 -0.15 0.08 1.05 0.00 0.00 175.02 176.15 2g9k s VAL 14 N -1.15 1.35 -0.05 10.11 1.01 -0.77 -0.23 120.40 130.67 2g9k s VAL 14 Ca 0.01 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.39 2g9k s VAL 14 Cb -0.10 -1.19 0.00 0.00 0.00 0.00 0.00 36.38 35.10 2g9k s VAL 14 CO 0.03 0.40 -0.15 -0.75 0.00 0.00 0.00 175.10 174.62 2g9k s LYS 15 N 0.37 1.76 -0.07 2.72 2.20 0.02 -0.66 119.74 126.08 2g9k s LYS 15 Ca -0.11 -0.52 0.01 0.00 -0.36 0.00 0.00 55.97 54.99 2g9k s LYS 15 Cb -0.14 -1.49 0.02 0.00 -1.51 0.00 0.00 37.83 34.71 2g9k s LYS 15 CO 0.04 0.14 -0.06 0.08 -0.36 0.00 0.00 175.35 175.19 2g9k s VAL 16 N 0.31 0.74 0.17 4.02 1.01 0.05 -0.14 120.40 126.57 2g9k s VAL 16 Ca -0.09 -0.20 0.10 0.00 0.00 0.00 0.00 61.98 61.79 2g9k s VAL 16 Cb -0.13 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 2g9k s VAL 16 CO 0.03 0.29 -0.19 -0.76 0.00 0.00 0.00 175.10 174.47 2g9k s LEU 17 N 1.16 2.64 -0.29 3.92 1.43 -0.21 -0.86 118.68 126.47 2g9k s LEU 17 Ca -0.07 -0.72 -0.07 0.00 -1.03 0.00 0.00 54.13 52.25 2g9k s LEU 17 Cb -0.14 -1.39 0.01 0.00 0.03 0.00 0.00 46.19 44.70 2g9k s LEU 17 CO -0.01 0.13 0.08 -0.62 0.23 0.00 0.00 176.35 176.15 2g9k s ASP 18 N -2.59 5.10 0.00 2.29 3.68 0.94 -1.06 116.67 125.03 2g9k s ASP 18 Ca 0.21 -0.66 0.29 0.00 2.13 0.00 0.00 52.55 54.52 2g9k s ASP 18 Cb -0.09 -1.88 1.22 0.00 -1.45 0.00 0.00 42.92 40.72 2g9k s ASP 18 CO 0.11 -0.17 1.92 0.00 0.13 0.00 0.00 175.17 177.15 2g9k n ALA 19 N 4.87 2.36 0.03 3.66 0.00 0.18 -1.57 120.51 130.04 2g9k n ALA 19 Ca -0.15 -0.11 -0.21 0.00 0.00 0.00 0.00 53.44 52.98 2g9k n ALA 19 Cb 0.48 -1.46 -0.14 0.00 0.00 0.00 0.00 19.45 18.33 2g9k n ALA 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2g9k h VAL 20 N 0.00 0.79 0.00 0.00 2.07 -1.94 -3.38 116.25 113.79 2g9k h VAL 20 Ca 0.00 -2.46 0.00 0.00 0.82 0.00 0.00 66.70 65.06 2g9k h VAL 20 Cb 0.50 2.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.89 2g9k h VAL 20 CO 0.00 0.86 -1.05 0.54 0.02 0.00 0.00 177.57 177.94 2g9k n ARG 21 N -3.49 0.23 -3.26 1.57 1.74 -1.23 -5.00 116.66 107.22 2g9k n ARG 21 Ca -0.27 -0.02 -0.15 0.00 -0.77 0.00 0.00 57.85 56.64 2g9k n ARG 21 Cb 1.06 -1.47 0.08 0.00 -1.02 0.00 0.00 32.46 31.10 2g9k n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2g9k n GLY 22 N 1.47 -0.37 3.44 -0.13 0.00 -0.61 -5.02 105.19 103.98 2g9k n GLY 22 Ca 0.03 0.10 -0.10 0.00 0.00 0.00 0.00 46.02 46.06 2g9k n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2g9k s SER 23 N -4.11 -0.14 0.65 1.61 1.04 -1.10 -5.01 113.70 106.63 2g9k s SER 23 Ca 0.05 -0.61 -0.18 0.00 0.48 0.00 0.00 55.95 55.70 2g9k s SER 23 Cb -0.01 0.52 -0.01 0.00 0.10 0.00 0.00 66.02 66.62 2g9k s SER 23 CO 0.66 -0.98 1.24 -2.84 0.98 0.00 0.00 173.24 172.30 2g9k s PRO 24 N -3.90 2.58 -0.49 4.02 0.02 -1.26 -0.04 135.00 135.93 2g9k s PRO 24 Ca 0.12 1.91 -0.21 0.00 0.02 0.00 0.00 61.00 62.84 2g9k s PRO 24 Cb 0.01 -1.87 0.04 0.00 0.02 0.00 0.00 34.50 32.70 2g9k s PRO 24 CO -0.02 -1.53 0.69 0.00 -0.33 0.00 0.00 177.00 175.80 2g9k s ALA 25 N -1.61 3.33 0.04 -1.55 0.00 -0.03 -4.54 121.76 117.39 2g9k s ALA 25 Ca 0.79 -1.46 -0.11 0.00 0.00 0.00 0.00 51.96 51.18 2g9k s ALA 25 Cb -0.33 -3.40 -0.06 0.00 0.00 0.00 0.00 23.12 19.33 2g9k s ALA 25 CO 0.39 -2.00 0.37 0.42 0.00 0.00 0.00 175.76 174.94 2g9k s ILE 26 N 2.94 5.12 -1.36 0.00 1.01 -1.26 -4.28 121.20 123.36 2g9k s ILE 26 Ca 0.21 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.39 2g9k s ILE 26 Cb -0.16 -3.64 0.00 0.00 0.01 0.00 0.00 42.46 38.67 2g9k s ILE 26 CO 0.16 0.41 0.00 0.59 0.00 0.00 0.00 174.94 176.10 2g9k n ASN 27 N 1.28 -4.75 -4.69 3.58 3.02 -0.35 -4.94 115.26 108.41 2g9k n ASN 27 Ca -0.11 -0.01 -0.41 0.00 -0.03 0.00 0.00 54.58 54.02 2g9k n ASN 27 Cb 0.53 -3.87 -0.04 0.00 -0.61 0.00 0.00 39.78 35.79 2g9k n ASN 27 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2g9k s VAL 28 N -2.79 4.92 0.25 2.41 1.01 -1.26 -4.74 120.40 120.19 2g9k s VAL 28 Ca 0.00 1.70 -0.30 0.00 0.00 0.00 0.00 61.98 63.38 2g9k s VAL 28 Cb 0.00 -4.16 -0.09 0.00 0.00 0.00 0.00 36.38 32.13 2g9k s VAL 28 CO 0.00 0.11 1.03 0.00 0.00 0.00 0.00 175.10 176.25 2g9k s ALA 29 N 1.53 3.37 -0.05 5.51 0.00 -1.26 -0.99 121.76 129.88 2g9k s ALA 29 Ca 0.42 0.77 0.01 0.00 0.00 0.00 0.00 51.96 53.15 2g9k s ALA 29 Cb -0.18 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.68 2g9k s ALA 29 CO 0.17 -0.02 -0.04 0.08 0.00 0.00 0.00 175.76 175.96 2g9k s VAL 30 N -1.02 0.49 -0.06 0.00 1.01 1.00 -0.95 120.40 120.88 2g9k s VAL 30 Ca 0.44 -0.07 0.06 0.00 0.00 0.00 0.00 61.98 62.40 2g9k s VAL 30 Cb -0.29 -0.54 -0.01 0.00 0.00 0.00 0.00 36.38 35.54 2g9k s VAL 30 CO 0.37 0.22 -0.24 -1.00 0.00 0.00 0.00 175.10 174.45 2g9k s HIS 31 N 1.08 2.46 -0.04 5.22 3.76 -0.18 -0.81 115.29 126.78 2g9k s HIS 31 Ca -0.09 -0.66 0.05 0.00 -0.15 0.00 0.00 55.06 54.22 2g9k s HIS 31 Cb -0.14 -1.60 -0.02 0.00 1.11 0.00 0.00 32.58 31.93 2g9k s HIS 31 CO -0.01 -0.18 -0.19 0.08 -0.85 0.00 0.00 174.74 173.59 2g9k s VAL 32 N -0.22 2.65 0.10 -0.90 1.01 0.17 0.02 120.40 123.22 2g9k s VAL 32 Ca -0.02 -0.88 0.06 0.00 0.00 0.00 0.00 61.98 61.14 2g9k s VAL 32 Cb -0.13 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.22 2g9k s VAL 32 CO 0.03 0.59 -0.16 -0.36 0.00 0.00 0.00 175.10 175.20 2g9k s PHE 33 N -0.68 1.44 -0.08 5.22 0.40 0.59 -0.05 117.98 124.82 2g9k s PHE 33 Ca 0.11 -0.48 0.05 0.00 -0.60 0.00 0.00 56.93 56.00 2g9k s PHE 33 Cb -0.10 -0.78 -0.00 0.00 0.51 0.00 0.00 43.02 42.65 2g9k s PHE 33 CO -0.00 0.13 -0.24 0.50 0.70 0.00 0.00 175.22 176.32 2g9k s ARG 34 N -2.15 2.73 -0.04 0.44 3.52 0.45 -0.73 118.95 123.17 2g9k s ARG 34 Ca 0.05 -0.86 -0.30 0.00 -0.13 0.00 0.00 55.73 54.49 2g9k s ARG 34 Cb -0.08 -2.17 -0.05 0.00 -1.56 0.00 0.00 34.95 31.09 2g9k s ARG 34 CO 0.03 0.25 1.44 0.21 -0.81 0.00 0.00 175.30 176.42 2g9k s LYS 35 N 0.14 4.25 0.67 5.12 2.20 0.23 -0.61 119.74 131.75 2g9k s LYS 35 Ca -0.12 1.97 -0.05 0.00 -0.36 0.00 0.00 55.97 57.41 2g9k s LYS 35 Cb -0.16 -3.70 0.05 0.00 -1.51 0.00 0.00 37.83 32.52 2g9k s LYS 35 CO 0.06 -0.66 0.96 0.00 -0.36 0.00 0.00 175.35 175.35 2g9k s ALA 36 N 2.95 3.31 -1.22 3.13 0.00 0.38 -4.69 121.76 125.63 2g9k s ALA 36 Ca 0.65 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 51.61 2g9k s ALA 36 Cb -0.30 -2.49 0.00 0.00 0.00 0.00 0.00 23.12 20.32 2g9k s ALA 36 CO 0.25 -1.17 0.54 0.00 0.00 0.00 0.00 175.76 175.38 2g9k n ALA 37 N -2.79 0.98 0.00 0.00 0.00 -1.26 -0.58 120.51 116.86 2g9k n ALA 37 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2g9k n ALA 37 Cb 0.60 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 19.31 2g9k n ALA 37 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2g9k n ASP 38 N -1.04 0.31 -0.07 0.00 5.75 -1.26 -5.02 116.55 115.21 2g9k n ASP 38 Ca 0.00 -0.42 0.00 0.00 -0.01 0.00 0.00 54.79 54.36 2g9k n ASP 38 Cb 0.05 0.90 0.00 0.00 -1.03 0.00 0.00 41.12 41.03 2g9k n ASP 38 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2g9k n ASP 39 N -0.93 -0.69 -4.73 -1.12 9.92 0.26 -5.09 116.55 114.17 2g9k n ASP 39 Ca 0.00 0.00 -0.34 0.00 -0.53 0.00 0.00 54.79 53.92 2g9k n ASP 39 Cb 0.00 -0.27 -0.08 0.00 -0.64 0.00 0.00 41.12 40.13 2g9k n ASP 39 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2g9k s THR 40 N -2.14 4.52 -0.40 -3.53 2.01 -1.26 -4.90 115.64 109.94 2g9k s THR 40 Ca 0.00 -0.36 -0.28 0.00 0.31 0.00 0.00 61.69 61.36 2g9k s THR 40 Cb 0.00 -3.00 0.02 0.00 0.01 0.00 0.00 72.50 69.54 2g9k s THR 40 CO 0.00 0.45 1.07 0.26 -0.69 0.00 0.00 174.62 175.71 2g9k s TRP 41 N -1.06 2.98 0.05 4.92 0.52 -1.26 -0.47 118.94 124.63 2g9k s TRP 41 Ca 0.19 0.87 -0.10 0.00 0.02 0.00 0.00 56.10 57.08 2g9k s TRP 41 Cb -0.12 -4.01 -0.06 0.00 -1.15 0.00 0.00 33.47 28.14 2g9k s TRP 41 CO 0.09 -1.01 0.37 -1.83 0.02 0.00 0.00 176.95 174.59 2g9k s GLU 42 N 3.96 3.74 0.34 4.98 -1.05 0.22 -4.86 118.70 126.04 2g9k s GLU 42 Ca 0.45 0.15 -0.28 0.00 -0.15 0.00 0.00 54.97 55.14 2g9k s GLU 42 Cb -0.10 -3.04 -0.12 0.00 -0.44 0.00 0.00 34.13 30.43 2g9k s GLU 42 CO 0.23 0.60 1.33 -2.30 0.95 0.00 0.00 175.26 176.06 2g9k n PRO 43 N 1.07 2.21 0.00 -4.83 -0.02 -1.26 -0.41 135.00 131.76 2g9k n PRO 43 Ca -0.09 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2g9k n PRO 43 Cb 0.52 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 2g9k n PRO 43 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2g9k n PHE 44 N 0.41 0.00 -3.53 6.00 7.35 0.93 -4.71 117.46 123.91 2g9k n PHE 44 Ca 0.04 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.65 2g9k n PHE 44 Cb 0.36 0.02 -0.03 0.00 0.35 0.00 0.00 39.48 40.18 2g9k n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2g9k s ALA 45 N -1.93 -1.87 0.20 3.13 0.00 -0.98 -4.99 121.76 115.31 2g9k s ALA 45 Ca 0.00 1.22 -0.14 0.00 0.00 0.00 0.00 51.96 53.04 2g9k s ALA 45 Cb 0.00 0.07 0.01 0.00 0.00 0.00 0.00 23.12 23.20 2g9k s ALA 45 CO 0.00 -0.58 0.45 -1.54 0.00 0.00 0.00 175.76 174.09 2g9k s SER 46 N -2.08 -0.13 0.00 0.00 1.04 -1.26 0.42 113.70 111.70 2g9k s SER 46 Ca 0.03 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 55.75 2g9k s SER 46 Cb -0.01 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.65 2g9k s SER 46 CO -0.06 -1.04 0.00 0.61 0.98 0.00 0.00 173.24 173.74 2g9k n GLY 47 N -0.32 -1.18 3.09 7.32 0.00 0.01 -4.98 105.19 109.14 2g9k n GLY 47 Ca -0.07 -0.94 -0.21 0.00 0.00 0.00 0.00 46.02 44.80 2g9k n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g9k s LYS 48 N -1.27 0.97 0.57 1.61 1.02 -1.26 -0.00 119.74 121.38 2g9k s LYS 48 Ca 0.00 -0.53 -0.20 0.00 0.02 0.00 0.00 55.97 55.26 2g9k s LYS 48 Cb 0.00 -0.94 -0.04 0.00 -0.52 0.00 0.00 37.83 36.32 2g9k s LYS 48 CO 0.00 0.25 1.26 0.95 -0.92 0.00 0.00 175.35 176.89 2g9k s THR 49 N -0.46 2.44 0.43 2.17 -4.23 -0.16 -4.75 115.64 111.09 2g9k s THR 49 Ca 0.04 0.30 -0.04 0.00 -1.18 0.00 0.00 61.69 60.80 2g9k s THR 49 Cb -0.06 -3.14 0.09 0.00 1.34 0.00 0.00 72.50 70.74 2g9k s THR 49 CO 0.00 -0.03 0.59 -1.54 -0.54 0.00 0.00 174.62 173.10 2g9k n SER 50 N -1.30 0.39 0.16 3.99 3.41 0.52 -1.21 113.62 119.58 2g9k n SER 50 Ca 0.12 -1.43 0.17 0.00 -0.26 0.00 0.00 58.87 57.47 2g9k n SER 50 Cb 0.48 -0.42 0.77 0.00 -0.26 0.00 0.00 64.21 64.78 2g9k n SER 50 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2g9k h GLU 51 N 0.00 0.00 -0.16 4.33 4.39 -1.93 0.13 114.58 121.33 2g9k h GLU 51 Ca -0.19 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.51 2g9k h GLU 51 Cb 0.62 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 2g9k h GLU 51 CO 0.17 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 176.89 2g9k n SER 52 N -4.01 1.60 -0.11 1.42 3.41 -1.26 -4.78 113.62 109.89 2g9k n SER 52 Ca 0.03 -1.70 -0.01 0.00 -0.26 0.00 0.00 58.87 56.93 2g9k n SER 52 Cb 0.38 -0.10 -0.01 0.00 -0.26 0.00 0.00 64.21 64.22 2g9k n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2g9k n GLY 53 N 1.11 0.52 3.68 5.00 0.00 0.44 -4.78 105.19 111.17 2g9k n GLY 53 Ca 0.16 -0.45 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 2g9k n GLY 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2g9k s GLU 54 N -1.24 2.51 -0.15 1.61 2.02 -1.26 -0.77 118.70 121.42 2g9k s GLU 54 Ca 0.00 -0.93 -0.01 0.00 0.02 0.00 0.00 54.97 54.05 2g9k s GLU 54 Cb 0.00 -2.49 0.04 0.00 0.10 0.00 0.00 34.13 31.79 2g9k s GLU 54 CO 0.00 0.51 -0.03 -1.17 0.02 0.00 0.00 175.26 174.59 2g9k s LEU 55 N -2.55 1.37 0.38 1.80 2.96 0.17 -0.36 118.68 122.45 2g9k s LEU 55 Ca 0.26 -0.59 0.08 0.00 -0.22 0.00 0.00 54.13 53.66 2g9k s LEU 55 Cb -0.11 -0.78 -0.06 0.00 0.50 0.00 0.00 46.19 45.74 2g9k s LEU 55 CO 0.19 -0.21 0.03 -1.00 -1.32 0.00 0.00 176.35 174.04 2g9k s HIS 56 N 1.73 2.53 -0.59 5.38 3.76 -1.26 -1.84 115.29 125.00 2g9k s HIS 56 Ca 0.01 -0.56 0.00 0.00 -0.15 0.00 0.00 55.06 54.36 2g9k s HIS 56 Cb -0.15 -1.68 0.00 0.00 1.11 0.00 0.00 32.58 31.86 2g9k s HIS 56 CO -0.07 0.42 0.00 0.41 -0.85 0.00 0.00 174.74 174.65 2g9k n GLY 57 N -1.00 0.29 0.23 -2.22 0.00 -1.26 -4.91 105.19 96.32 2g9k n GLY 57 Ca -0.04 -0.65 -0.10 0.00 0.00 0.00 0.00 46.02 45.23 2g9k n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2g9k h LEU 58 N 0.00 0.69 0.00 0.99 3.38 -1.88 -3.48 115.31 115.01 2g9k h LEU 58 Ca -0.15 -0.34 -0.11 0.00 0.09 0.00 0.00 57.88 57.37 2g9k h LEU 58 Cb 0.95 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2g9k h LEU 58 CO 0.18 1.06 0.14 1.07 0.09 0.00 0.00 178.44 180.98 2g9k n THR 59 N -4.00 0.00 -4.47 0.22 5.66 -1.26 -4.80 114.28 105.63 2g9k n THR 59 Ca -0.03 -1.23 -0.23 0.00 -3.05 0.00 0.00 64.05 59.51 2g9k n THR 59 Cb 0.57 1.01 -0.10 0.00 -1.55 0.00 0.00 70.33 70.26 2g9k n THR 59 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2g9k s THR 60 N -2.34 2.21 0.31 1.09 -4.23 -1.26 -4.58 115.64 106.84 2g9k s THR 60 Ca 0.20 -2.29 0.01 0.00 -1.18 0.00 0.00 61.69 58.43 2g9k s THR 60 Cb -0.04 -2.37 0.28 0.00 1.34 0.00 0.00 72.50 71.71 2g9k s THR 60 CO 0.15 -0.36 1.93 -0.33 -0.54 0.00 0.00 174.62 175.47 2g9k h GLU 61 N 2.25 0.96 -0.72 3.99 5.08 -1.99 -0.17 114.58 123.98 2g9k h GLU 61 Ca -0.40 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 57.84 2g9k h GLU 61 Cb 1.25 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 2g9k h GLU 61 CO 0.64 0.63 0.21 1.49 -1.00 0.00 0.00 179.01 180.98 2g9k h GLU 62 N 0.99 1.12 0.00 2.33 4.81 -2.04 -3.11 114.58 118.68 2g9k h GLU 62 Ca 0.36 -0.25 -0.14 0.00 -0.13 0.00 0.00 59.36 59.20 2g9k h GLU 62 Cb 0.14 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 2g9k h GLU 62 CO -0.12 0.96 -1.05 0.93 -0.73 0.00 0.00 179.01 179.00 2g9k h GLU 63 N 1.07 0.00 -4.37 1.92 3.07 -1.83 -3.40 114.58 111.04 2g9k h GLU 63 Ca 0.23 0.00 -0.72 0.00 -0.50 0.00 0.00 59.36 58.37 2g9k h GLU 63 Cb 0.32 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 28.13 2g9k h GLU 63 CO -0.00 0.38 2.30 0.34 -1.40 0.00 0.00 179.01 180.63 2g9k n PHE 64 N -3.02 3.85 -2.15 4.33 7.35 -0.12 -4.95 117.46 122.74 2g9k n PHE 64 Ca -0.05 -2.96 -0.27 0.00 -0.76 0.00 0.00 57.45 53.41 2g9k n PHE 64 Cb 0.79 -2.33 0.14 0.00 0.35 0.00 0.00 39.48 38.44 2g9k n PHE 64 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 2g9k s VAL 65 N 2.28 2.08 0.49 -2.13 -7.23 -1.26 -4.93 120.40 109.70 2g9k s VAL 65 Ca 0.45 -0.20 -0.23 0.00 -1.81 0.00 0.00 61.98 60.19 2g9k s VAL 65 Cb 0.08 -2.87 -0.07 0.00 0.56 0.00 0.00 36.38 34.07 2g9k s VAL 65 CO -0.01 0.00 1.27 -0.62 -0.31 0.00 0.00 175.10 175.43 2g9k n GLU 66 N -3.35 1.74 -3.90 4.82 1.02 -1.26 -4.82 120.64 114.89 2g9k n GLU 66 Ca 0.14 0.63 0.00 0.00 -0.02 0.00 0.00 57.16 57.91 2g9k n GLU 66 Cb 0.60 -2.44 0.00 0.00 -0.02 0.00 0.00 31.44 29.58 2g9k n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2g9k n GLY 67 N 0.84 -2.03 3.52 0.62 0.00 -1.03 -5.00 105.19 102.11 2g9k n GLY 67 Ca 0.09 -1.24 -0.35 0.00 0.00 0.00 0.00 46.02 44.52 2g9k n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2g9k s ILE 68 N -2.53 4.22 0.15 -0.61 1.01 -1.26 -0.75 121.20 121.43 2g9k s ILE 68 Ca 0.00 -0.23 0.11 0.00 0.00 0.00 0.00 60.65 60.53 2g9k s ILE 68 Cb 0.00 -2.90 -0.04 0.00 0.01 0.00 0.00 42.46 39.53 2g9k s ILE 68 CO 0.00 0.45 -0.24 -0.31 0.00 0.00 0.00 174.94 174.84 2g9k s TYR 69 N 0.70 2.36 -0.12 3.97 1.51 -0.00 -0.60 117.35 125.16 2g9k s TYR 69 Ca 0.01 -0.35 0.02 0.00 -1.01 0.00 0.00 57.07 55.74 2g9k s TYR 69 Cb -0.14 -1.24 0.01 0.00 -0.11 0.00 0.00 41.96 40.49 2g9k s TYR 69 CO 0.02 0.40 -0.16 0.21 -1.11 0.00 0.00 175.55 174.90 2g9k s LYS 70 N -2.26 2.38 -0.26 -0.62 2.20 0.09 -1.19 119.74 120.08 2g9k s LYS 70 Ca 0.17 -0.62 -0.08 0.00 -0.36 0.00 0.00 55.97 55.08 2g9k s LYS 70 Cb -0.10 -2.02 -0.03 0.00 -1.51 0.00 0.00 37.83 34.18 2g9k s LYS 70 CO 0.08 -0.07 0.09 0.08 -0.36 0.00 0.00 175.35 175.17 2g9k s VAL 71 N 1.01 4.51 -0.18 4.02 1.01 0.62 -0.30 120.40 131.09 2g9k s VAL 71 Ca -0.05 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 61.80 2g9k s VAL 71 Cb -0.15 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.10 2g9k s VAL 71 CO -0.03 0.32 -0.09 -0.70 0.00 0.00 0.00 175.10 174.61 2g9k s GLU 72 N 1.64 3.39 -0.23 2.72 2.12 0.10 -0.80 118.70 127.65 2g9k s GLU 72 Ca 0.06 -0.65 -0.05 0.00 0.36 0.00 0.00 54.97 54.70 2g9k s GLU 72 Cb -0.15 -2.83 -0.02 0.00 0.26 0.00 0.00 34.13 31.39 2g9k s GLU 72 CO 0.05 0.00 -0.00 0.42 -0.54 0.00 0.00 175.26 175.19 2g9k s ILE 73 N 0.92 3.71 -1.35 -3.70 1.01 0.37 -1.02 121.20 121.15 2g9k s ILE 73 Ca -0.02 -0.38 -0.14 0.00 0.00 0.00 0.00 60.65 60.11 2g9k s ILE 73 Cb -0.15 -2.71 0.09 0.00 0.01 0.00 0.00 42.46 39.70 2g9k s ILE 73 CO 0.00 0.40 1.92 0.47 0.00 0.00 0.00 174.94 177.72 2g9k n ASP 74 N 4.81 4.58 0.16 3.58 8.00 -0.12 -1.30 116.55 136.26 2g9k n ASP 74 Ca -0.17 -2.93 0.01 0.00 0.71 0.00 0.00 54.79 52.41 2g9k n ASP 74 Cb 0.51 -1.65 0.25 0.00 -0.02 0.00 0.00 41.12 40.22 2g9k n ASP 74 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 2g9k h THR 75 N 4.54 1.32 0.04 -3.53 1.35 -1.87 -3.21 112.91 111.54 2g9k h THR 75 Ca 0.47 -1.77 -0.00 0.00 -0.55 0.00 0.00 66.41 64.56 2g9k h THR 75 Cb 0.74 1.97 0.00 0.00 -1.73 0.00 0.00 68.15 69.13 2g9k h THR 75 CO 1.63 0.50 -0.02 0.50 -0.25 0.00 0.00 175.52 177.88 2g9k h LYS 76 N 0.00 -0.05 -1.01 4.72 3.64 -1.73 -1.77 116.57 120.37 2g9k h LYS 76 Ca -0.01 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2g9k h LYS 76 Cb 0.93 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.71 2g9k h LYS 76 CO 0.07 -0.01 0.67 0.77 -2.27 0.00 0.00 179.45 178.68 2g9k h SER 77 N -0.08 1.16 0.00 4.20 0.02 -1.85 -0.92 113.55 116.07 2g9k h SER 77 Ca -0.01 -0.03 0.03 0.00 -0.84 0.00 0.00 61.79 60.94 2g9k h SER 77 Cb 0.07 -0.29 -0.04 0.00 0.14 0.00 0.00 62.40 62.28 2g9k h SER 77 CO 0.01 0.84 -0.18 0.22 -1.14 0.00 0.00 176.83 176.57 2g9k h TYR 78 N 1.37 -0.48 -0.18 3.45 3.20 -1.46 -1.85 116.97 121.01 2g9k h TYR 78 Ca 0.37 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 62.12 2g9k h TYR 78 Cb -0.15 0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.32 2g9k h TYR 78 CO -0.00 -0.27 -0.49 -1.49 -1.64 0.00 0.00 178.16 174.28 2g9k h TRP 79 N -0.30 0.58 -0.65 -3.82 4.06 -1.00 -3.09 115.95 111.74 2g9k h TRP 79 Ca 0.06 -0.19 -0.02 0.00 2.06 0.00 0.00 58.89 60.80 2g9k h TRP 79 Cb 0.37 -0.12 -0.03 0.00 -1.00 0.00 0.00 29.16 28.38 2g9k h TRP 79 CO -0.23 0.87 0.35 0.87 -3.56 0.00 0.00 178.44 176.74 2g9k h LYS 80 N 0.38 0.92 0.00 0.49 1.57 -1.03 -0.79 116.57 118.12 2g9k h LYS 80 Ca 0.02 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 2g9k h LYS 80 Cb 0.99 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.13 2g9k h LYS 80 CO 0.09 0.70 0.00 0.00 -0.57 0.00 0.00 179.45 179.67 2g9k h ALA 81 N 1.16 1.00 -0.13 3.86 0.00 -1.26 0.19 119.26 124.08 2g9k h ALA 81 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2g9k h ALA 81 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2g9k h ALA 81 CO -0.03 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.50 2g9k n LEU 82 N -2.93 2.66 0.00 0.00 4.77 -0.42 -4.95 117.00 116.12 2g9k n LEU 82 Ca -0.02 -0.99 0.00 0.00 -0.03 0.00 0.00 56.01 54.98 2g9k n LEU 82 Cb 0.12 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2g9k n LEU 82 CO 0.20 0.49 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 2g9k n GLY 83 N 1.33 0.52 3.66 -0.72 0.00 0.05 -5.03 105.19 105.01 2g9k n GLY 83 Ca 0.17 -0.26 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 2g9k n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2g9k s ILE 84 N -2.00 4.54 -0.49 -0.61 1.01 -0.47 -5.01 121.20 118.16 2g9k s ILE 84 Ca 0.00 -0.14 -0.19 0.00 0.00 0.00 0.00 60.65 60.32 2g9k s ILE 84 Cb 0.00 -2.97 0.06 0.00 0.01 0.00 0.00 42.46 39.55 2g9k s ILE 84 CO 0.00 0.54 0.58 -0.55 0.00 0.00 0.00 174.94 175.51 2g9k s SER 85 N -0.32 6.22 0.59 3.58 0.15 -1.26 -2.92 113.70 119.74 2g9k s SER 85 Ca 0.08 -0.92 0.00 0.00 0.70 0.00 0.00 55.95 55.81 2g9k s SER 85 Cb -0.12 -2.27 0.05 0.00 -1.71 0.00 0.00 66.02 61.97 2g9k s SER 85 CO 0.02 -0.83 0.83 -2.16 1.20 0.00 0.00 173.24 172.31 2g9k s PRO 86 N 2.46 2.37 -0.12 5.44 0.04 -1.26 -4.98 135.00 138.95 2g9k s PRO 86 Ca 0.14 -0.80 -0.23 0.00 0.04 0.00 0.00 61.00 60.15 2g9k s PRO 86 Cb -0.19 -2.44 -0.20 0.00 0.04 0.00 0.00 34.50 31.71 2g9k s PRO 86 CO 0.12 -0.88 0.67 0.35 0.04 0.00 0.00 177.00 177.30 2g9k h PHE 87 N -0.09 -0.02 -4.00 0.56 3.57 -1.64 -3.47 116.94 111.85 2g9k h PHE 87 Ca -0.41 -0.00 -0.45 0.00 3.53 0.00 0.00 57.97 60.64 2g9k h PHE 87 Cb 1.29 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 40.02 2g9k h PHE 87 CO 0.28 0.71 0.32 -1.01 -2.23 0.00 0.00 178.31 176.38 2g9k s HIS 88 N -2.36 3.39 0.14 0.41 3.76 -1.26 -4.98 115.29 114.40 2g9k s HIS 88 Ca -0.15 1.61 -0.09 0.00 -0.15 0.00 0.00 55.06 56.29 2g9k s HIS 88 Cb -0.02 -2.84 -0.05 0.00 1.11 0.00 0.00 32.58 30.78 2g9k s HIS 88 CO 0.54 -0.03 1.39 0.93 -0.85 0.00 0.00 174.74 176.73 2g9k h GLU 89 N 2.20 0.71 -2.25 1.40 4.39 -1.98 -3.37 114.58 115.67 2g9k h GLU 89 Ca -0.48 -0.52 0.19 0.00 0.34 0.00 0.00 59.36 58.89 2g9k h GLU 89 Cb 1.18 0.09 -0.08 0.00 -0.10 0.00 0.00 28.75 29.83 2g9k h GLU 89 CO 0.62 1.14 0.52 -3.38 -1.16 0.00 0.00 179.01 176.74 2g9k s HIS 90 N -3.89 -0.12 -0.10 4.33 -3.43 -1.26 -3.34 115.29 107.48 2g9k s HIS 90 Ca -0.09 -0.17 -0.03 0.00 -0.80 0.00 0.00 55.06 53.98 2g9k s HIS 90 Cb 0.10 0.63 -0.03 0.00 -1.43 0.00 0.00 32.58 31.85 2g9k s HIS 90 CO 0.88 -0.78 0.01 0.00 -2.00 0.00 0.00 174.74 172.85 2g9k s ALA 91 N -3.20 3.28 0.02 -1.38 0.00 -0.42 -4.89 121.76 115.17 2g9k s ALA 91 Ca 0.12 -0.80 0.03 0.00 0.00 0.00 0.00 51.96 51.31 2g9k s ALA 91 Cb -0.01 -1.54 -0.01 0.00 0.00 0.00 0.00 23.12 21.56 2g9k s ALA 91 CO 0.02 0.51 -0.08 -1.83 0.00 0.00 0.00 175.76 174.38 2g9k s GLU 92 N -0.64 0.59 -0.13 0.00 -1.05 -1.26 -0.48 118.70 115.74 2g9k s GLU 92 Ca 0.10 -0.51 -0.00 0.00 -0.15 0.00 0.00 54.97 54.41 2g9k s GLU 92 Cb -0.12 -0.51 0.03 0.00 -0.44 0.00 0.00 34.13 33.09 2g9k s GLU 92 CO 0.02 0.12 -0.10 0.08 0.95 0.00 0.00 175.26 176.34 2g9k s VAL 93 N -0.71 1.26 -0.13 1.83 1.01 0.02 -4.97 120.40 118.72 2g9k s VAL 93 Ca -0.02 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.50 2g9k s VAL 93 Cb -0.06 -1.25 -0.00 0.00 0.00 0.00 0.00 36.38 35.06 2g9k s VAL 93 CO 0.00 0.37 -0.19 -0.69 0.00 0.00 0.00 175.10 174.59 2g9k s VAL 94 N 1.61 2.39 -0.02 2.92 1.01 -1.26 -0.28 120.40 126.77 2g9k s VAL 94 Ca 0.04 -0.88 -0.17 0.00 0.00 0.00 0.00 61.98 60.97 2g9k s VAL 94 Cb -0.13 -1.97 0.03 0.00 0.00 0.00 0.00 36.38 34.31 2g9k s VAL 94 CO -0.09 0.54 0.36 0.72 0.00 0.00 0.00 175.10 176.63 2g9k s PHE 95 N 0.57 -0.25 0.05 5.22 -0.71 -0.34 -4.98 117.98 117.54 2g9k s PHE 95 Ca -0.11 0.40 -0.30 0.00 -1.04 0.00 0.00 56.93 55.87 2g9k s PHE 95 Cb -0.16 0.14 -0.04 0.00 -1.21 0.00 0.00 43.02 41.74 2g9k s PHE 95 CO 0.04 -0.42 1.04 0.99 -1.34 0.00 0.00 175.22 175.52 2g9k s THR 96 N -1.28 4.54 0.04 -4.49 2.01 -1.26 -0.82 115.64 114.37 2g9k s THR 96 Ca -0.13 1.89 0.08 0.00 0.31 0.00 0.00 61.69 63.84 2g9k s THR 96 Cb -0.04 -4.21 -0.03 0.00 0.01 0.00 0.00 72.50 68.22 2g9k s THR 96 CO 0.05 0.19 -0.22 0.00 -0.69 0.00 0.00 174.62 173.95 2g9k s ALA 97 N 0.75 2.43 -2.01 7.40 0.00 0.08 -4.79 121.76 125.61 2g9k s ALA 97 Ca 0.52 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 51.26 2g9k s ALA 97 Cb -0.24 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.26 2g9k s ALA 97 CO 0.29 0.55 0.00 0.09 0.00 0.00 0.00 175.76 176.69 2g9k n ASN 98 N 1.69 -5.51 0.14 0.00 3.02 -1.26 -2.46 115.26 110.87 2g9k n ASN 98 Ca -0.17 0.35 0.13 0.00 -0.03 0.00 0.00 54.58 54.86 2g9k n ASN 98 Cb 0.52 -4.71 0.46 0.00 -0.61 0.00 0.00 39.78 35.44 2g9k n ASN 98 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 2g9k h ASP 99 N 0.00 0.00 -1.32 6.41 2.03 -1.91 -2.84 116.42 118.78 2g9k h ASP 99 Ca -0.43 0.00 -0.49 0.00 -0.73 0.00 0.00 57.03 55.38 2g9k h ASP 99 Cb 1.32 0.00 -0.41 0.00 -0.83 0.00 0.00 39.33 39.41 2g9k h ASP 99 CO 0.59 0.00 -0.94 -1.54 -1.03 0.00 0.00 179.24 176.32 2g9k n SER 100 N -2.35 3.23 0.00 4.15 3.41 -1.26 -5.10 113.62 115.70 2g9k n SER 100 Ca 0.03 -3.27 0.00 0.00 -0.26 0.00 0.00 58.87 55.37 2g9k n SER 100 Cb 0.32 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 2g9k n SER 100 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2g9k n GLY 101 N -0.28 2.54 3.73 5.00 0.00 -1.07 -5.02 105.19 110.09 2g9k n GLY 101 Ca 0.26 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 2g9k n GLY 101 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2g9k n PRO 102 N 1.12 2.71 -4.35 1.61 -0.04 -1.26 -4.28 135.00 130.51 2g9k n PRO 102 Ca 0.00 0.97 -0.18 0.00 -0.04 0.00 0.00 63.50 64.26 2g9k n PRO 102 Cb 0.00 -2.78 -0.10 0.00 -0.04 0.00 0.00 33.50 30.57 2g9k n PRO 102 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2g9k s ARG 103 N 0.34 1.40 -0.13 0.54 1.81 -1.26 -4.89 118.95 116.75 2g9k s ARG 103 Ca 0.70 -1.72 -0.02 0.00 -1.72 0.00 0.00 55.73 52.96 2g9k s ARG 103 Cb -0.51 -0.61 -0.03 0.00 -0.45 0.00 0.00 34.95 33.35 2g9k s ARG 103 CO 0.40 -0.14 -0.05 1.03 -0.68 0.00 0.00 175.30 175.86 2g9k s ARG 104 N -3.89 3.42 -0.12 3.54 0.52 -0.14 -4.82 118.95 117.45 2g9k s ARG 104 Ca 0.31 -0.54 0.03 0.00 -0.52 0.00 0.00 55.73 55.00 2g9k s ARG 104 Cb 0.06 -2.81 0.00 0.00 0.52 0.00 0.00 34.95 32.73 2g9k s ARG 104 CO 0.10 0.35 -0.21 0.71 0.02 0.00 0.00 175.30 176.27 2g9k s TYR 105 N 0.06 2.65 -0.20 -0.53 1.51 0.96 -1.17 117.35 120.64 2g9k s TYR 105 Ca -0.01 -1.14 -0.03 0.00 -1.01 0.00 0.00 57.07 54.89 2g9k s TYR 105 Cb -0.14 -1.78 -0.01 0.00 -0.11 0.00 0.00 41.96 39.92 2g9k s TYR 105 CO 0.03 -0.49 -0.08 0.99 -1.11 0.00 0.00 175.55 174.89 2g9k s THR 106 N 0.59 3.18 -0.30 -0.71 2.01 0.23 -0.68 115.64 119.96 2g9k s THR 106 Ca -0.12 -0.57 -0.09 0.00 0.31 0.00 0.00 61.69 61.22 2g9k s THR 106 Cb -0.17 -2.41 -0.01 0.00 0.01 0.00 0.00 72.50 69.92 2g9k s THR 106 CO 0.03 0.46 0.12 -0.63 -0.69 0.00 0.00 174.62 173.91 2g9k s ILE 107 N 1.20 4.40 -0.05 1.82 -1.09 0.68 -0.98 121.20 127.18 2g9k s ILE 107 Ca 0.02 -0.45 0.00 0.00 -2.23 0.00 0.00 60.65 58.00 2g9k s ILE 107 Cb -0.14 -3.22 -0.03 0.00 -1.58 0.00 0.00 42.46 37.48 2g9k s ILE 107 CO -0.03 0.11 -0.03 0.00 -1.23 0.00 0.00 174.94 173.77 2g9k s ALA 108 N 1.59 3.16 -0.00 9.38 0.00 0.33 -0.80 121.76 135.42 2g9k s ALA 108 Ca 0.04 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.13 2g9k s ALA 108 Cb -0.17 -1.33 -0.01 0.00 0.00 0.00 0.00 23.12 21.62 2g9k s ALA 108 CO 0.05 0.60 -0.07 0.00 0.00 0.00 0.00 175.76 176.34 2g9k s ALA 109 N -0.93 0.55 -0.19 0.00 0.00 0.80 -1.07 121.76 120.93 2g9k s ALA 109 Ca 0.15 -0.30 -0.01 0.00 0.00 0.00 0.00 51.96 51.80 2g9k s ALA 109 Cb -0.11 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 22.88 2g9k s ALA 109 CO 0.05 0.13 -0.13 -1.17 0.00 0.00 0.00 175.76 174.64 2g9k s LEU 110 N -0.21 2.52 -0.11 0.00 2.96 0.24 -1.05 118.68 123.04 2g9k s LEU 110 Ca 0.02 -0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 2g9k s LEU 110 Cb -0.03 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 45.03 2g9k s LEU 110 CO -0.00 0.02 -0.06 -0.76 -1.32 0.00 0.00 176.35 174.23 2g9k s LEU 111 N 1.18 3.17 0.11 -0.68 1.43 -0.22 -1.21 118.68 122.46 2g9k s LEU 111 Ca 0.02 -0.09 0.03 0.00 -1.03 0.00 0.00 54.13 53.05 2g9k s LEU 111 Cb -0.14 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 2g9k s LEU 111 CO -0.05 0.26 -0.08 -0.44 0.23 0.00 0.00 176.35 176.27 2g9k s SER 112 N -0.19 1.37 0.31 2.29 0.01 0.66 -0.64 113.70 117.50 2g9k s SER 112 Ca 0.03 -0.97 0.04 0.00 1.31 0.00 0.00 55.95 56.36 2g9k s SER 112 Cb -0.13 0.05 0.65 0.00 0.21 0.00 0.00 66.02 66.80 2g9k s SER 112 CO 0.03 -0.39 1.85 -0.65 0.41 0.00 0.00 173.24 174.48 2g9k h PRO 113 N 3.04 0.86 -0.28 12.44 0.11 -1.99 -2.92 132.00 143.26 2g9k h PRO 113 Ca -0.36 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2g9k h PRO 113 Cb 1.18 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.09 2g9k h PRO 113 CO 0.62 0.57 0.00 0.66 -0.21 0.00 0.00 178.00 179.64 2g9k n TYR 114 N -4.60 0.59 -3.62 0.65 4.02 -1.26 -1.55 117.16 111.38 2g9k n TYR 114 Ca 0.18 -0.65 -0.15 0.00 -0.01 0.00 0.00 57.90 57.27 2g9k n TYR 114 Cb 0.40 -0.14 -0.07 0.00 -0.02 0.00 0.00 39.34 39.51 2g9k n TYR 114 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2g9k s SER 115 N -1.40 -0.57 0.04 7.72 0.15 -1.10 -4.96 113.70 113.57 2g9k s SER 115 Ca 0.29 0.83 -0.09 0.00 0.70 0.00 0.00 55.95 57.68 2g9k s SER 115 Cb 0.20 0.80 0.00 0.00 -1.71 0.00 0.00 66.02 65.31 2g9k s SER 115 CO 0.12 -0.41 0.18 -0.72 1.20 0.00 0.00 173.24 173.60 2g9k s TYR 116 N -0.58 0.08 0.07 3.44 -0.85 -1.26 -0.25 117.35 118.02 2g9k s TYR 116 Ca -0.07 -0.32 0.08 0.00 -0.52 0.00 0.00 57.07 56.24 2g9k s TYR 116 Cb -0.03 -0.05 -0.03 0.00 0.38 0.00 0.00 41.96 42.23 2g9k s TYR 116 CO 0.05 -0.42 -0.22 -1.12 -1.52 0.00 0.00 175.55 172.32 2g9k s SER 117 N -2.11 2.71 0.00 -0.18 0.01 -0.35 -4.96 113.70 108.82 2g9k s SER 117 Ca -0.05 -0.62 0.02 0.00 1.31 0.00 0.00 55.95 56.61 2g9k s SER 117 Cb -0.01 -0.20 -0.01 0.00 0.21 0.00 0.00 66.02 66.02 2g9k s SER 117 CO -0.04 0.14 -0.05 0.28 0.41 0.00 0.00 173.24 173.98 2g9k s THR 118 N -0.95 0.42 0.06 1.44 -1.32 -1.26 -0.59 115.64 113.45 2g9k s THR 118 Ca 0.09 -0.32 0.03 0.00 -1.21 0.00 0.00 61.69 60.28 2g9k s THR 118 Cb -0.10 -0.38 -0.03 0.00 -1.51 0.00 0.00 72.50 70.49 2g9k s THR 118 CO 0.03 0.06 -0.08 0.28 -2.21 0.00 0.00 174.62 172.70 2g9k s THR 119 N -0.26 0.68 -0.05 5.08 -1.32 -0.23 -4.99 115.64 114.54 2g9k s THR 119 Ca 0.01 -1.36 0.06 0.00 -1.21 0.00 0.00 61.69 59.19 2g9k s THR 119 Cb -0.03 -0.99 -0.01 0.00 -1.51 0.00 0.00 72.50 69.96 2g9k s THR 119 CO -0.00 -0.50 -0.25 0.00 -2.21 0.00 0.00 174.62 171.66 2g9k s ALA 120 N -2.01 2.14 -0.17 11.08 0.00 -1.26 -0.51 121.76 131.04 2g9k s ALA 120 Ca -0.02 -1.05 -0.01 0.00 0.00 0.00 0.00 51.96 50.87 2g9k s ALA 120 Cb -0.06 -0.65 -0.01 0.00 0.00 0.00 0.00 23.12 22.40 2g9k s ALA 120 CO -0.01 0.43 -0.10 0.08 0.00 0.00 0.00 175.76 176.16 2g9k s VAL 121 N -0.22 3.09 -0.12 0.00 1.01 -0.15 -4.97 120.40 119.03 2g9k s VAL 121 Ca -0.02 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.36 2g9k s VAL 121 Cb -0.13 -2.34 0.01 0.00 0.00 0.00 0.00 36.38 33.92 2g9k s VAL 121 CO 0.03 0.49 -0.17 -0.69 0.00 0.00 0.00 175.10 174.76 2g9k s VAL 122 N 0.83 1.66 0.18 2.92 1.01 -1.26 -0.60 120.40 125.14 2g9k s VAL 122 Ca -0.03 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.30 2g9k s VAL 122 Cb -0.15 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 2g9k s VAL 122 CO 0.01 0.47 -0.17 -0.89 0.00 0.00 0.00 175.10 174.52 2g9k s THR 123 N 1.00 1.81 -2.88 3.92 2.01 -0.32 -4.96 115.64 116.22 2g9k s THR 123 Ca -0.05 -2.01 0.25 0.00 0.31 0.00 0.00 61.69 60.19 2g9k s THR 123 Cb -0.15 -1.91 0.28 0.00 0.01 0.00 0.00 72.50 70.73 2g9k s THR 123 CO -0.03 -0.40 1.38 -3.20 -0.69 0.00 0.00 174.62 171.68