#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d9k s VAL 4 N 0.00 5.28 0.06 0.00 1.01 -1.26 -0.47 120.40 125.02 1d9k s VAL 4 Ca 0.00 0.48 0.09 0.00 0.00 0.00 0.00 61.98 62.54 1d9k s VAL 4 Cb 0.00 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 1d9k s VAL 4 CO 0.00 0.32 -0.22 -0.89 0.00 0.00 0.00 175.10 174.31 1d9k s THR 5 N 1.01 2.49 -0.19 3.92 2.01 -0.14 -4.46 115.64 120.28 1d9k s THR 5 Ca 0.14 -1.36 0.01 0.00 0.31 0.00 0.00 61.69 60.79 1d9k s THR 5 Cb -0.14 -2.03 0.04 0.00 0.01 0.00 0.00 72.50 70.38 1d9k s THR 5 CO 0.05 0.30 -0.11 -1.10 -0.69 0.00 0.00 174.62 173.08 1d9k s GLN 6 N -1.49 2.04 0.00 4.92 -0.21 -1.26 -2.37 119.66 121.29 1d9k s GLN 6 Ca 0.14 -0.76 0.00 0.00 0.02 0.00 0.00 55.36 54.76 1d9k s GLN 6 Cb -0.10 -2.32 0.00 0.00 1.00 0.00 0.00 33.01 31.59 1d9k s GLN 6 CO 0.04 -0.39 0.13 0.45 -2.12 0.00 0.00 175.29 173.41 1d9k n SER 7 N 4.72 0.00 -4.70 5.90 2.88 -1.13 -4.42 113.62 116.87 1d9k n SER 7 Ca -0.15 0.13 -0.42 0.00 -1.33 0.00 0.00 58.87 57.10 1d9k n SER 7 Cb 0.47 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.90 1d9k n SER 7 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1d9k s PRO 8 N -0.26 4.50 0.00 -1.46 0.05 -1.26 -4.85 135.00 131.73 1d9k s PRO 8 Ca 0.00 1.38 0.07 0.00 0.05 0.00 0.00 61.00 62.50 1d9k s PRO 8 Cb 0.00 -3.49 0.24 0.00 0.05 0.00 0.00 34.50 31.30 1d9k s PRO 8 CO 0.00 -0.15 1.19 0.54 0.05 0.00 0.00 177.00 178.63 1d9k n ARG 9 N 4.32 1.45 0.00 4.56 5.12 -1.26 -4.63 116.66 126.22 1d9k n ARG 9 Ca 0.07 -0.69 0.00 0.00 -1.93 0.00 0.00 57.85 55.29 1d9k n ARG 9 Cb 0.50 -1.17 0.00 0.00 -1.16 0.00 0.00 32.46 30.63 1d9k n ARG 9 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1d9k n ASN 10 N 0.05 0.00 -4.04 0.55 2.85 -1.26 -3.60 115.26 109.81 1d9k n ASN 10 Ca 0.07 0.00 -0.08 0.00 -0.11 0.00 0.00 54.58 54.46 1d9k n ASN 10 Cb 0.17 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 41.08 1d9k n ASN 10 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 1d9k s LYS 11 N 0.00 0.48 0.04 1.20 2.20 -0.35 -4.94 119.74 118.37 1d9k s LYS 11 Ca 0.00 -0.94 0.04 0.00 -0.36 0.00 0.00 55.97 54.72 1d9k s LYS 11 Cb 0.00 0.15 -0.02 0.00 -1.51 0.00 0.00 37.83 36.45 1d9k s LYS 11 CO 0.00 -0.08 -0.12 0.08 -0.36 0.00 0.00 175.35 174.87 1d9k s VAL 12 N -2.74 0.96 -0.07 4.02 1.01 -1.26 -1.93 120.40 120.38 1d9k s VAL 12 Ca -0.04 -1.02 -0.21 0.00 0.00 0.00 0.00 61.98 60.72 1d9k s VAL 12 Cb -0.01 -0.90 0.05 0.00 0.00 0.00 0.00 36.38 35.52 1d9k s VAL 12 CO -0.06 -0.10 0.49 0.00 0.00 0.00 0.00 175.10 175.43 1d9k s ALA 13 N -0.97 -1.24 0.21 5.51 0.00 -0.89 -4.96 121.76 119.42 1d9k s ALA 13 Ca -0.01 0.96 -0.24 0.00 0.00 0.00 0.00 51.96 52.66 1d9k s ALA 13 Cb -0.08 -0.20 -0.08 0.00 0.00 0.00 0.00 23.12 22.75 1d9k s ALA 13 CO 0.01 -0.29 0.79 0.08 0.00 0.00 0.00 175.76 176.36 1d9k s VAL 14 N -0.84 4.39 0.19 0.00 1.01 -1.26 0.26 120.40 124.14 1d9k s VAL 14 Ca -0.09 1.62 -0.15 0.00 0.00 0.00 0.00 61.98 63.36 1d9k s VAL 14 Cb -0.03 -4.05 -0.10 0.00 0.00 0.00 0.00 36.38 32.20 1d9k s VAL 14 CO 0.05 0.38 0.19 0.41 0.00 0.00 0.00 175.10 176.13 1d9k n THR 15 N 1.19 0.83 -4.08 3.92 -1.04 -1.26 -2.42 114.28 111.41 1d9k n THR 15 Ca -0.03 -0.31 -0.27 0.00 -2.04 0.00 0.00 64.05 61.39 1d9k n THR 15 Cb 0.49 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.96 1d9k n THR 15 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1d9k n GLY 16 N 1.35 -0.19 0.14 3.41 0.00 -0.96 -4.77 105.19 104.17 1d9k n GLY 16 Ca 0.09 0.16 0.01 0.00 0.00 0.00 0.00 46.02 46.28 1d9k n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d9k n GLY 17 N -2.16 1.32 2.07 -0.02 0.00 -1.02 -4.35 105.19 101.03 1d9k n GLY 17 Ca -0.31 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1d9k n GLY 17 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1d9k n LYS 18 N -0.10 -4.75 -4.50 1.61 4.81 -1.15 -4.77 118.16 109.31 1d9k n LYS 18 Ca 0.02 3.47 -0.21 0.00 -0.87 0.00 0.00 58.31 60.72 1d9k n LYS 18 Cb 0.21 -4.05 -0.14 0.00 0.02 0.00 0.00 35.03 31.06 1d9k n LYS 18 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1d9k s VAL 19 N -0.50 1.13 0.02 3.15 1.01 -1.07 -4.89 120.40 119.24 1d9k s VAL 19 Ca 0.00 -0.81 0.08 0.00 0.00 0.00 0.00 61.98 61.25 1d9k s VAL 19 Cb 0.00 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 35.37 1d9k s VAL 19 CO 0.00 0.16 -0.23 -0.89 0.00 0.00 0.00 175.10 174.14 1d9k s THR 20 N -0.59 2.38 -0.14 3.92 2.01 -1.26 -0.55 115.64 121.40 1d9k s THR 20 Ca 0.04 -1.19 0.00 0.00 0.31 0.00 0.00 61.69 60.85 1d9k s THR 20 Cb -0.07 -1.92 0.02 0.00 0.01 0.00 0.00 72.50 70.55 1d9k s THR 20 CO 0.00 0.44 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.48 1d9k s LEU 21 N -1.06 1.62 -0.21 4.42 1.02 0.02 -4.96 118.68 119.54 1d9k s LEU 21 Ca 0.12 -0.47 -0.07 0.00 0.02 0.00 0.00 54.13 53.73 1d9k s LEU 21 Cb -0.10 -1.14 -0.04 0.00 0.02 0.00 0.00 46.19 44.94 1d9k s LEU 21 CO 0.02 -0.07 0.06 -0.55 0.02 0.00 0.00 176.35 175.83 1d9k s SER 22 N 1.52 5.40 -0.13 2.29 0.15 -1.26 -0.47 113.70 121.20 1d9k s SER 22 Ca 0.05 -0.04 0.02 0.00 0.70 0.00 0.00 55.95 56.68 1d9k s SER 22 Cb -0.13 -1.94 0.00 0.00 -1.71 0.00 0.00 66.02 62.24 1d9k s SER 22 CO -0.10 0.09 -0.20 0.00 1.20 0.00 0.00 173.24 174.23 1d9k s ASN 24 N 0.57 2.59 -0.12 0.00 0.01 -1.00 -0.48 114.94 116.51 1d9k s ASN 24 Ca -0.12 -0.60 -0.01 0.00 -0.71 0.00 0.00 52.86 51.43 1d9k s ASN 24 Cb -0.16 -0.19 0.03 0.00 0.41 0.00 0.00 41.25 41.34 1d9k s ASN 24 CO 0.04 0.13 -0.05 0.00 -1.51 0.00 0.00 177.10 175.71 1d9k s GLN 25 N -1.49 1.29 0.17 -0.60 -2.07 0.51 -0.97 119.66 116.50 1d9k s GLN 25 Ca 0.08 -0.24 -0.22 0.00 -1.82 0.00 0.00 55.36 53.16 1d9k s GLN 25 Cb -0.09 -1.57 -0.08 0.00 -1.09 0.00 0.00 33.01 30.18 1d9k s GLN 25 CO 0.03 -0.32 0.71 0.99 -1.32 0.00 0.00 175.29 175.38 1d9k s THR 26 N 1.75 4.53 -0.54 3.63 2.01 0.38 -4.08 115.64 123.33 1d9k s THR 26 Ca 0.04 1.43 -0.00 0.00 0.31 0.00 0.00 61.69 63.47 1d9k s THR 26 Cb -0.13 -3.98 -0.00 0.00 0.01 0.00 0.00 72.50 68.40 1d9k s THR 26 CO -0.08 0.40 0.50 0.59 -0.69 0.00 0.00 174.62 175.35 1d9k n ASN 27 N 1.26 -6.14 -3.70 3.53 3.02 -1.26 -0.28 115.26 111.69 1d9k n ASN 27 Ca -0.05 -0.06 -0.35 0.00 -0.03 0.00 0.00 54.58 54.08 1d9k n ASN 27 Cb 0.50 -4.09 0.03 0.00 -0.61 0.00 0.00 39.78 35.61 1d9k n ASN 27 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1d9k n ASN 28 N -1.58 -3.64 -3.62 6.41 0.23 -1.26 -4.47 115.26 107.33 1d9k n ASN 28 Ca -0.00 0.05 -0.16 0.00 -0.53 0.00 0.00 54.58 53.94 1d9k n ASN 28 Cb 0.50 -0.54 -0.07 0.00 -2.08 0.00 0.00 39.78 37.59 1d9k n ASN 28 CO 0.00 0.00 0.00 -1.00 -0.93 0.00 0.00 177.26 175.33 1d9k s HIS 29 N -1.85 -0.50 0.15 -2.53 3.76 -1.26 -4.96 115.29 108.10 1d9k s HIS 29 Ca 0.34 0.89 -0.11 0.00 -0.15 0.00 0.00 55.06 56.03 1d9k s HIS 29 Cb 0.02 0.28 -0.00 0.00 1.11 0.00 0.00 32.58 33.99 1d9k s HIS 29 CO 0.66 -0.50 1.54 -0.91 -0.85 0.00 0.00 174.74 174.68 1d9k h ASN 30 N 3.55 0.95 -4.37 1.40 4.21 -1.86 -3.45 115.58 116.01 1d9k h ASN 30 Ca -0.28 -0.38 -0.67 0.00 1.21 0.00 0.00 56.30 56.18 1d9k h ASN 30 Cb 1.16 -0.26 -0.27 0.00 -1.12 0.00 0.00 38.32 37.82 1d9k h ASN 30 CO 0.36 1.12 -0.87 0.54 -1.29 0.00 0.00 177.43 177.29 1d9k s ASN 31 N -6.61 2.95 0.38 5.81 2.20 -1.15 -2.46 114.94 116.07 1d9k s ASN 31 Ca -0.12 -0.54 0.08 0.00 -0.94 0.00 0.00 52.86 51.35 1d9k s ASN 31 Cb 0.12 -0.28 -0.07 0.00 -2.00 0.00 0.00 41.25 39.02 1d9k s ASN 31 CO 0.85 0.25 -0.02 -0.04 -2.94 0.00 0.00 177.10 175.21 1d9k s MET 32 N -1.05 1.93 0.03 3.55 -1.94 -0.96 -2.04 119.30 118.83 1d9k s MET 32 Ca 0.10 -1.98 -0.07 0.00 -1.71 0.00 0.00 55.69 52.03 1d9k s MET 32 Cb -0.10 -1.72 -0.00 0.00 2.01 0.00 0.00 34.83 35.02 1d9k s MET 32 CO 0.01 0.04 0.13 0.71 -0.01 0.00 0.00 175.02 175.90 1d9k s TYR 33 N -2.64 0.12 0.00 -0.03 1.51 0.19 -2.34 117.35 114.16 1d9k s TYR 33 Ca 0.34 -0.35 0.07 0.00 -1.01 0.00 0.00 57.07 56.13 1d9k s TYR 33 Cb 0.05 -0.09 -0.03 0.00 -0.11 0.00 0.00 41.96 41.79 1d9k s TYR 33 CO 0.18 -0.36 -0.23 -1.58 -1.11 0.00 0.00 175.55 172.45 1d9k s TRP 34 N -2.27 2.43 0.09 2.71 0.52 -1.16 -0.07 118.94 121.20 1d9k s TRP 34 Ca -0.08 -0.35 0.01 0.00 0.02 0.00 0.00 56.10 55.70 1d9k s TRP 34 Cb -0.03 -1.49 -0.00 0.00 -1.15 0.00 0.00 33.47 30.80 1d9k s TRP 34 CO -0.03 0.09 0.04 0.66 0.02 0.00 0.00 176.95 177.73 1d9k n TYR 35 N 2.10 0.02 -3.20 -1.98 4.01 0.26 -1.66 117.16 116.70 1d9k n TYR 35 Ca -0.16 -0.61 -0.00 0.00 -0.16 0.00 0.00 57.90 56.96 1d9k n TYR 35 Cb 0.52 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.53 1d9k n TYR 35 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1d9k s ARG 36 N -2.36 0.51 0.21 -0.72 3.52 -1.15 -2.84 118.95 116.12 1d9k s ARG 36 Ca 0.05 0.41 -0.30 0.00 -0.13 0.00 0.00 55.73 55.76 1d9k s ARG 36 Cb 0.00 0.06 -0.08 0.00 -1.56 0.00 0.00 34.95 33.37 1d9k s ARG 36 CO 0.04 -1.04 1.18 -0.65 -0.81 0.00 0.00 175.30 174.02 1d9k s GLN 37 N 2.73 4.51 -0.07 5.12 -1.52 -0.21 -4.18 119.66 126.04 1d9k s GLN 37 Ca 0.10 1.87 -0.03 0.00 -1.95 0.00 0.00 55.36 55.35 1d9k s GLN 37 Cb -0.11 -3.23 0.04 0.00 -0.22 0.00 0.00 33.01 29.50 1d9k s GLN 37 CO -0.27 -0.04 0.16 -0.51 -0.25 0.00 0.00 175.29 174.38 1d9k s ASP 38 N -0.06 -0.12 0.00 5.90 1.01 -1.26 -2.02 116.67 120.13 1d9k s ASP 38 Ca 0.51 0.33 0.00 0.00 0.71 0.00 0.00 52.55 54.11 1d9k s ASP 38 Cb -0.33 0.22 0.01 0.00 1.01 0.00 0.00 42.92 43.83 1d9k s ASP 38 CO 0.38 -0.15 0.12 0.41 0.21 0.00 0.00 175.17 176.13 1d9k n THR 39 N 4.23 0.00 0.00 -1.27 -1.04 -1.26 -2.72 114.28 112.21 1d9k n THR 39 Ca -0.26 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 61.74 1d9k n THR 39 Cb 0.52 -0.46 -0.00 0.00 -1.82 0.00 0.00 70.33 68.56 1d9k n THR 39 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1d9k n GLY 40 N -0.41 -0.13 3.13 3.41 0.00 -1.26 -4.93 105.19 105.00 1d9k n GLY 40 Ca 0.00 -0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 1d9k n GLY 40 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1d9k s HIS 41 N -1.37 3.48 0.19 1.61 3.76 -1.10 -5.07 115.29 116.78 1d9k s HIS 41 Ca -0.03 -2.49 -0.30 0.00 -0.15 0.00 0.00 55.06 52.09 1d9k s HIS 41 Cb 0.00 -3.29 -0.17 0.00 1.11 0.00 0.00 32.58 30.24 1d9k s HIS 41 CO 0.04 -0.90 0.74 0.41 -0.85 0.00 0.00 174.74 174.18 1d9k n GLY 42 N 3.94 -1.12 7.00 -2.22 0.00 -1.21 -4.02 105.19 107.56 1d9k n GLY 42 Ca 0.04 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.47 1d9k n GLY 42 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1d9k n LEU 43 N 1.80 0.00 -0.75 0.99 4.77 -1.26 -4.88 117.00 117.67 1d9k n LEU 43 Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1d9k n LEU 43 Cb 0.24 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1d9k n LEU 43 CO 0.58 0.00 0.00 -2.11 -1.33 0.00 0.00 177.39 174.53 1d9k n ARG 44 N 14.00 0.00 -1.79 3.23 1.85 -1.26 -3.86 116.66 128.83 1d9k n ARG 44 Ca 0.00 0.29 -0.42 0.00 -1.00 0.00 0.00 57.85 56.72 1d9k n ARG 44 Cb 0.00 -0.46 -0.03 0.00 -1.05 0.00 0.00 32.46 30.92 1d9k n ARG 44 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1d9k s LEU 45 N 0.00 4.39 0.00 2.89 2.96 -1.26 -2.94 118.68 124.72 1d9k s LEU 45 Ca 0.00 2.69 0.00 0.00 -0.22 0.00 0.00 54.13 56.60 1d9k s LEU 45 Cb 0.00 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.12 1d9k s LEU 45 CO 0.00 -0.96 0.00 -0.38 -1.32 0.00 0.00 176.35 173.69 1d9k n ILE 46 N 4.60 0.00 -3.13 6.68 5.41 -0.66 -2.03 119.36 130.23 1d9k n ILE 46 Ca 0.17 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.92 1d9k n ILE 46 Cb 0.38 -0.04 0.00 0.00 -0.71 0.00 0.00 39.64 39.27 1d9k n ILE 46 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1d9k n HIS 47 N 0.00 -1.80 0.00 1.39 8.25 -1.26 -0.63 115.22 121.17 1d9k n HIS 47 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1d9k n HIS 47 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1d9k n HIS 47 CO 0.00 0.00 0.00 2.48 0.64 0.00 0.00 176.34 179.46 1d9k n TYR 48 N -0.60 0.00 -3.59 4.41 0.18 -0.85 -3.01 117.16 113.70 1d9k n TYR 48 Ca 0.00 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.68 1d9k n TYR 48 Cb 0.00 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.90 1d9k n TYR 48 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 1d9k s SER 49 N 0.00 -0.39 0.00 9.48 1.04 -0.99 0.31 113.70 123.15 1d9k s SER 49 Ca 0.00 0.54 0.19 0.00 0.48 0.00 0.00 55.95 57.15 1d9k s SER 49 Cb 0.00 0.47 1.11 0.00 0.10 0.00 0.00 66.02 67.70 1d9k s SER 49 CO 0.00 -0.29 1.64 -1.22 0.98 0.00 0.00 173.24 174.36 1d9k n TYR 50 N 1.17 0.00 0.00 5.02 4.02 -1.26 -2.27 117.16 123.83 1d9k n TYR 50 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.78 1d9k n TYR 50 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.89 1d9k n TYR 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1d9k n GLY 51 N 0.65 0.98 0.00 2.72 0.00 -1.03 -4.20 105.19 104.31 1d9k n GLY 51 Ca 0.14 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1d9k n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d9k n ALA 52 N -1.00 0.00 0.05 4.61 0.00 -1.26 -0.88 120.51 122.03 1d9k n ALA 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1d9k n ALA 52 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 1d9k n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d9k n GLY 53 N 0.00 -0.12 3.86 0.00 0.00 -1.26 -4.67 105.19 103.00 1d9k n GLY 53 Ca 0.00 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1d9k n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1d9k s SER 54 N -2.18 6.68 -0.02 1.61 1.04 -0.06 -4.97 113.70 115.80 1d9k s SER 54 Ca 0.01 0.83 0.00 0.00 0.48 0.00 0.00 55.95 57.28 1d9k s SER 54 Cb 0.01 -2.20 0.02 0.00 0.10 0.00 0.00 66.02 63.95 1d9k s SER 54 CO 0.01 0.22 0.00 -0.89 0.98 0.00 0.00 173.24 173.56 1d9k s THR 55 N -1.31 0.15 -0.04 2.02 2.01 -1.26 -4.55 115.64 112.66 1d9k s THR 55 Ca 0.30 0.07 0.01 0.00 0.31 0.00 0.00 61.69 62.39 1d9k s THR 55 Cb -0.15 -0.23 0.02 0.00 0.01 0.00 0.00 72.50 72.16 1d9k s THR 55 CO 0.16 0.12 -0.05 -1.61 -0.69 0.00 0.00 174.62 172.55 1d9k s GLU 56 N 0.84 0.84 0.48 4.92 0.41 0.15 -4.98 118.70 121.36 1d9k s GLU 56 Ca -0.08 -0.14 -0.23 0.00 -0.41 0.00 0.00 54.97 54.10 1d9k s GLU 56 Cb -0.11 -0.82 -0.07 0.00 -1.78 0.00 0.00 34.13 31.34 1d9k s GLU 56 CO -0.02 -0.04 1.31 0.15 -0.49 0.00 0.00 175.26 176.17 1d9k s LYS 57 N 0.75 3.53 0.00 1.61 1.02 -1.26 -2.00 119.74 123.39 1d9k s LYS 57 Ca -0.10 2.14 0.00 0.00 0.02 0.00 0.00 55.97 58.03 1d9k s LYS 57 Cb -0.13 -2.45 0.00 0.00 -0.52 0.00 0.00 37.83 34.72 1d9k s LYS 57 CO 0.00 -0.85 0.00 0.41 -0.92 0.00 0.00 175.35 174.00 1d9k n GLY 58 N 0.63 2.26 0.96 -3.33 0.00 0.20 -4.84 105.19 101.06 1d9k n GLY 58 Ca 0.07 -1.03 0.10 0.00 0.00 0.00 0.00 46.02 45.16 1d9k n GLY 58 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1d9k n ASP 59 N 0.00 3.17 -2.53 1.61 8.00 -0.86 -4.32 116.55 121.62 1d9k n ASP 59 Ca 0.00 -1.91 -0.00 0.00 0.71 0.00 0.00 54.79 53.58 1d9k n ASP 59 Cb 0.00 -0.22 0.06 0.00 -0.02 0.00 0.00 41.12 40.94 1d9k n ASP 59 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1d9k n ILE 60 N 1.19 0.75 -0.34 0.53 5.41 -1.13 -4.97 119.36 120.81 1d9k n ILE 60 Ca 0.16 -2.08 0.12 0.00 1.00 0.00 0.00 62.75 61.95 1d9k n ILE 60 Cb 0.53 1.16 0.32 0.00 -0.71 0.00 0.00 39.64 40.94 1d9k n ILE 60 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1d9k h PRO 61 N 1.90 0.76 -6.12 0.38 0.11 -1.75 -3.43 132.00 123.84 1d9k h PRO 61 Ca -0.24 -0.05 -0.71 0.00 0.11 0.00 0.00 66.00 65.11 1d9k h PRO 61 Cb 1.37 -0.17 0.07 0.00 0.11 0.00 0.00 31.00 32.38 1d9k h PRO 61 CO 0.06 0.51 0.00 -0.25 -0.21 0.00 0.00 178.00 178.11 1d9k n ASP 62 N -4.68 0.21 0.00 -2.05 9.92 -1.26 -1.53 116.55 117.16 1d9k n ASP 62 Ca 0.21 1.14 0.00 0.00 -0.53 0.00 0.00 54.79 55.62 1d9k n ASP 62 Cb 0.52 -1.04 0.00 0.00 -0.64 0.00 0.00 41.12 39.96 1d9k n ASP 62 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1d9k n GLY 63 N 1.84 1.67 3.43 0.44 0.00 -1.26 -4.99 105.19 106.32 1d9k n GLY 63 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.98 1d9k n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1d9k s TYR 65 N -2.83 2.08 -0.19 1.61 1.51 -0.58 -4.76 117.35 114.19 1d9k s TYR 65 Ca 0.00 -0.48 -0.04 0.00 -1.01 0.00 0.00 57.07 55.55 1d9k s TYR 65 Cb 0.00 -0.99 0.09 0.00 -0.11 0.00 0.00 41.96 40.95 1d9k s TYR 65 CO 0.00 0.53 0.24 0.15 -1.11 0.00 0.00 175.55 175.37 1d9k s LYS 66 N -3.59 0.20 0.40 -0.62 1.02 -0.80 -4.98 119.74 111.36 1d9k s LYS 66 Ca 0.28 0.34 -0.00 0.00 0.02 0.00 0.00 55.97 56.61 1d9k s LYS 66 Cb -0.02 -0.90 -0.03 0.00 -0.52 0.00 0.00 37.83 36.37 1d9k s LYS 66 CO 0.12 -0.58 0.62 0.00 -0.92 0.00 0.00 175.35 174.59 1d9k s ALA 67 N 2.37 3.66 -0.26 5.17 0.00 -1.26 -0.12 121.76 131.32 1d9k s ALA 67 Ca 0.07 -0.88 -0.16 0.00 0.00 0.00 0.00 51.96 50.98 1d9k s ALA 67 Cb -0.15 -2.19 0.07 0.00 0.00 0.00 0.00 23.12 20.85 1d9k s ALA 67 CO -0.12 -0.17 0.64 0.45 0.00 0.00 0.00 175.76 176.56 1d9k s SER 68 N -4.10 -0.84 -0.22 0.00 0.15 0.25 -4.94 113.70 104.00 1d9k s SER 68 Ca 0.43 1.39 0.01 0.00 0.70 0.00 0.00 55.95 58.48 1d9k s SER 68 Cb -0.10 1.28 0.06 0.00 -1.71 0.00 0.00 66.02 65.55 1d9k s SER 68 CO 0.38 -0.23 -0.06 -0.60 1.20 0.00 0.00 173.24 173.93 1d9k s ARG 69 N 1.40 1.63 0.02 5.44 3.52 -1.26 0.21 118.95 129.91 1d9k s ARG 69 Ca -0.08 -0.92 0.26 0.00 -0.13 0.00 0.00 55.73 54.86 1d9k s ARG 69 Cb -0.06 -2.51 0.74 0.00 -1.56 0.00 0.00 34.95 31.56 1d9k s ARG 69 CO -0.16 -0.57 1.58 -0.35 -0.81 0.00 0.00 175.30 175.00 1d9k n PRO 70 N 4.70 0.03 0.00 5.12 -0.04 -1.25 -4.52 135.00 139.05 1d9k n PRO 70 Ca -0.12 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1d9k n PRO 70 Cb 0.45 -1.52 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 1d9k n PRO 70 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1d9k n SER 71 N -1.57 0.00 0.00 3.54 3.41 -1.26 -4.90 113.62 112.84 1d9k n SER 71 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 1d9k n SER 71 Cb 0.35 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 1d9k n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1d9k n GLN 72 N 0.00 0.00 0.00 4.33 6.02 -1.26 -3.41 117.38 123.06 1d9k n GLN 72 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1d9k n GLN 72 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 1d9k n GLN 72 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1d9k n GLU 73 N 10.06 0.00 -3.88 -1.09 -0.58 -1.26 -4.26 120.64 119.62 1d9k n GLU 73 Ca 0.00 0.00 -0.33 0.00 -0.42 0.00 0.00 57.16 56.41 1d9k n GLU 73 Cb 0.00 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 30.82 1d9k n GLU 73 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1d9k s ASN 74 N 0.00 6.39 -0.27 1.62 3.84 -1.22 -0.37 114.94 124.93 1d9k s ASN 74 Ca 0.00 0.36 0.00 0.00 0.21 0.00 0.00 52.86 53.43 1d9k s ASN 74 Cb 0.00 -2.00 0.16 0.00 -0.55 0.00 0.00 41.25 38.85 1d9k s ASN 74 CO 0.00 0.23 0.43 0.12 -2.79 0.00 0.00 177.10 175.09 1d9k s PHE 75 N -1.38 -1.06 0.04 0.43 5.36 0.36 -3.81 117.98 117.92 1d9k s PHE 75 Ca 0.30 0.69 0.01 0.00 -0.96 0.00 0.00 56.93 56.97 1d9k s PHE 75 Cb -0.13 0.01 -0.04 0.00 -0.34 0.00 0.00 43.02 42.52 1d9k s PHE 75 CO 0.21 -0.89 0.11 -1.12 -1.46 0.00 0.00 175.22 172.08 1d9k s SER 76 N 2.59 5.81 -0.15 6.13 0.01 0.13 -2.23 113.70 126.00 1d9k s SER 76 Ca 0.12 0.12 -0.03 0.00 1.31 0.00 0.00 55.95 57.47 1d9k s SER 76 Cb -0.14 -1.67 -0.03 0.00 0.21 0.00 0.00 66.02 64.40 1d9k s SER 76 CO -0.24 0.21 -0.05 -0.22 0.41 0.00 0.00 173.24 173.35 1d9k s LEU 77 N -2.16 3.19 -0.03 2.44 2.96 0.38 -0.59 118.68 124.87 1d9k s LEU 77 Ca 0.28 -0.14 0.07 0.00 -0.22 0.00 0.00 54.13 54.12 1d9k s LEU 77 Cb -0.12 -1.76 -0.02 0.00 0.50 0.00 0.00 46.19 44.79 1d9k s LEU 77 CO 0.20 0.18 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.54 1d9k s ILE 78 N 0.28 2.21 -0.52 6.68 1.01 0.82 -0.80 121.20 130.90 1d9k s ILE 78 Ca -0.04 -1.04 0.07 0.00 0.00 0.00 0.00 60.65 59.64 1d9k s ILE 78 Cb -0.14 -1.79 0.30 0.00 0.01 0.00 0.00 42.46 40.85 1d9k s ILE 78 CO 0.03 0.58 0.78 0.18 0.00 0.00 0.00 174.94 176.51 1d9k n LEU 79 N 2.52 2.76 -4.67 2.97 4.77 0.28 -1.91 117.00 123.72 1d9k n LEU 79 Ca -0.16 -5.31 -0.42 0.00 -0.03 0.00 0.00 56.01 50.09 1d9k n LEU 79 Cb 0.51 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.48 1d9k n LEU 79 CO 0.24 2.22 1.47 -1.83 -1.33 0.00 0.00 177.39 178.16 1d9k s GLU 80 N -2.61 4.16 -0.35 3.23 -1.05 -1.26 -2.37 118.70 118.45 1d9k s GLU 80 Ca 0.42 2.48 -0.01 0.00 -0.15 0.00 0.00 54.97 57.72 1d9k s GLU 80 Cb 0.25 -3.87 -0.01 0.00 -0.44 0.00 0.00 34.13 30.06 1d9k s GLU 80 CO -0.09 -0.86 0.31 1.28 0.95 0.00 0.00 175.26 176.85 1d9k n LEU 81 N 6.58 -3.70 0.00 1.83 4.77 -1.26 -4.76 117.00 120.45 1d9k n LEU 81 Ca 0.18 -0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 1d9k n LEU 81 Cb 0.40 -1.77 0.00 0.00 -2.33 0.00 0.00 43.42 39.73 1d9k n LEU 81 CO 0.65 -0.23 0.00 0.00 -1.33 0.00 0.00 177.39 176.48 1d9k n ALA 82 N -1.69 0.00 0.00 -1.18 0.00 -1.00 -4.45 120.51 112.20 1d9k n ALA 82 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1d9k n ALA 82 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1d9k n ALA 82 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1d9k n THR 83 N -1.45 0.00 -0.54 0.00 -1.04 -1.26 -2.25 114.28 107.73 1d9k n THR 83 Ca 0.00 0.00 0.43 0.00 -2.04 0.00 0.00 64.05 62.44 1d9k n THR 83 Cb 0.00 0.00 0.69 0.00 -1.82 0.00 0.00 70.33 69.20 1d9k n THR 83 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1d9k n PRO 84 N -0.10 -0.02 0.19 -2.82 -0.02 -1.26 0.20 135.00 131.17 1d9k n PRO 84 Ca 0.00 1.11 0.18 0.00 -2.02 0.00 0.00 63.50 62.77 1d9k n PRO 84 Cb 0.00 -2.33 0.81 0.00 -0.02 0.00 0.00 33.50 31.96 1d9k n PRO 84 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1d9k h SER 85 N 0.00 0.00 -0.93 2.55 4.64 -1.92 0.11 113.55 118.00 1d9k h SER 85 Ca 0.85 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 61.69 1d9k h SER 85 Cb 3.05 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 64.85 1d9k h SER 85 CO -0.25 0.00 0.58 0.00 -0.87 0.00 0.00 176.83 176.29 1d9k n GLN 86 N -3.55 2.24 -1.10 4.77 6.02 0.52 -4.68 117.38 121.60 1d9k n GLN 86 Ca 0.03 -3.03 -0.20 0.00 -0.01 0.00 0.00 57.00 53.79 1d9k n GLN 86 Cb 0.44 -2.15 -0.00 0.00 1.02 0.00 0.00 30.24 29.55 1d9k n GLN 86 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1d9k n THR 87 N -1.13 2.98 -0.63 5.09 -1.04 0.39 -4.72 114.28 115.21 1d9k n THR 87 Ca 0.57 -2.11 0.00 0.00 -2.04 0.00 0.00 64.05 60.47 1d9k n THR 87 Cb 1.61 -1.45 0.00 0.00 -1.82 0.00 0.00 70.33 68.68 1d9k n THR 87 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1d9k n SER 88 N 0.59 0.00 -3.69 8.00 3.41 -1.21 -4.73 113.62 115.99 1d9k n SER 88 Ca 0.37 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.69 1d9k n SER 88 Cb 0.58 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.39 1d9k n SER 88 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1d9k s VAL 89 N 1.15 1.04 0.10 -3.33 1.01 -0.85 -1.67 120.40 117.84 1d9k s VAL 89 Ca 0.00 -2.00 -0.31 0.00 0.00 0.00 0.00 61.98 59.67 1d9k s VAL 89 Cb 0.00 -1.75 -0.07 0.00 0.00 0.00 0.00 36.38 34.56 1d9k s VAL 89 CO 0.00 -0.82 1.34 -0.31 0.00 0.00 0.00 175.10 175.31 1d9k s TYR 90 N 0.94 3.29 -0.11 5.22 1.51 0.49 -1.04 117.35 127.65 1d9k s TYR 90 Ca 0.15 1.04 0.02 0.00 -1.01 0.00 0.00 57.07 57.27 1d9k s TYR 90 Cb -0.22 -3.62 -0.01 0.00 -0.11 0.00 0.00 41.96 38.01 1d9k s TYR 90 CO -0.09 -2.11 -0.18 -0.06 -1.11 0.00 0.00 175.55 172.00 1d9k s PHE 91 N 1.08 2.68 0.13 2.71 0.40 -1.13 -0.67 117.98 123.19 1d9k s PHE 91 Ca 0.63 -0.78 0.04 0.00 -0.60 0.00 0.00 56.93 56.22 1d9k s PHE 91 Cb -0.35 -1.77 -0.04 0.00 0.51 0.00 0.00 43.02 41.38 1d9k s PHE 91 CO 0.30 -0.27 0.14 0.00 0.70 0.00 0.00 175.22 176.08 1d9k s ALA 93 N -1.63 -0.69 0.09 0.00 0.00 0.90 0.64 121.76 121.07 1d9k s ALA 93 Ca 0.31 0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.34 1d9k s ALA 93 Cb -0.11 0.29 -0.03 0.00 0.00 0.00 0.00 23.12 23.27 1d9k s ALA 93 CO 0.24 -0.40 -0.10 0.45 0.00 0.00 0.00 175.76 175.95 1d9k s SER 94 N -1.98 1.34 0.13 0.00 0.15 0.31 0.54 113.70 114.19 1d9k s SER 94 Ca -0.06 -0.77 -0.25 0.00 0.70 0.00 0.00 55.95 55.57 1d9k s SER 94 Cb -0.01 0.02 0.07 0.00 -1.71 0.00 0.00 66.02 64.39 1d9k s SER 94 CO -0.03 -0.26 0.73 -0.83 1.20 0.00 0.00 173.24 174.06 1d9k s GLY 95 N -2.30 -0.47 0.00 9.45 0.00 -0.86 0.13 107.32 113.26 1d9k s GLY 95 Ca 0.03 0.50 0.00 0.00 0.00 0.00 0.00 44.72 45.25 1d9k s GLY 95 CO -0.00 0.16 0.00 0.61 0.00 0.00 0.00 173.10 173.87 1d9k n GLY 96 N -0.36 1.00 3.65 0.20 0.00 -1.26 -2.91 105.19 105.51 1d9k n GLY 96 Ca -0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 1d9k n GLY 96 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1d9k s GLN 97 N 0.00 2.43 -0.52 1.61 -0.21 -1.26 -4.84 119.66 116.88 1d9k s GLN 97 Ca 0.00 -0.88 -0.28 0.00 0.02 0.00 0.00 55.36 54.22 1d9k s GLN 97 Cb 0.00 -2.48 0.01 0.00 1.00 0.00 0.00 33.01 31.55 1d9k s GLN 97 CO 0.00 0.54 1.38 0.20 -2.12 0.00 0.00 175.29 175.28 1d9k s GLY 98 N -2.23 0.99 0.00 3.09 0.00 -1.26 -3.08 107.32 104.82 1d9k s GLY 98 Ca 0.24 -0.54 0.00 0.00 0.00 0.00 0.00 44.72 44.42 1d9k s GLY 98 CO 0.16 2.74 0.00 0.54 0.00 0.00 0.00 173.10 176.55 1d9k n ARG 99 N 8.43 0.00 -0.48 2.90 1.74 -1.26 -4.92 116.66 123.07 1d9k n ARG 99 Ca 0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 1d9k n ARG 99 Cb 0.49 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.93 1d9k n ARG 99 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1d9k n ALA 104 N 0.00 0.00 -1.51 7.54 0.00 -1.18 -5.01 120.51 120.36 1d9k n ALA 104 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 52.97 1d9k n ALA 104 Cb 0.00 -0.22 -0.06 0.00 0.00 0.00 0.00 19.45 19.18 1d9k n ALA 104 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1d9k n GLU 105 N -2.26 1.35 -4.42 0.00 -0.58 -1.26 -4.90 120.64 108.58 1d9k n GLU 105 Ca 0.00 0.34 -0.34 0.00 -0.42 0.00 0.00 57.16 56.75 1d9k n GLU 105 Cb 0.03 -2.78 -0.12 0.00 -0.57 0.00 0.00 31.44 27.99 1d9k n GLU 105 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1d9k s GLN 106 N 6.51 3.65 -0.19 3.49 -0.21 -1.26 -4.40 119.66 127.25 1d9k s GLN 106 Ca 1.07 -0.53 -0.08 0.00 0.02 0.00 0.00 55.36 55.84 1d9k s GLN 106 Cb -0.64 -2.90 -0.04 0.00 1.00 0.00 0.00 33.01 30.43 1d9k s GLN 106 CO 0.42 0.23 0.07 -0.06 -2.12 0.00 0.00 175.29 173.84 1d9k s PHE 107 N 0.38 3.25 0.29 0.91 0.40 0.34 -4.89 117.98 118.66 1d9k s PHE 107 Ca -0.04 0.05 0.03 0.00 -0.60 0.00 0.00 56.93 56.37 1d9k s PHE 107 Cb -0.14 -2.10 -0.03 0.00 0.51 0.00 0.00 43.02 41.25 1d9k s PHE 107 CO 0.03 0.12 0.45 -0.06 0.70 0.00 0.00 175.22 176.46 1d9k s PHE 108 N 0.50 3.48 0.62 0.36 0.08 -1.26 0.11 117.98 121.87 1d9k s PHE 108 Ca 0.04 0.17 -0.00 0.00 0.12 0.00 0.00 56.93 57.25 1d9k s PHE 108 Cb -0.13 -1.74 0.07 0.00 -0.57 0.00 0.00 43.02 40.66 1d9k s PHE 108 CO 0.01 0.29 0.88 0.20 -0.10 0.00 0.00 175.22 176.49 1d9k s GLY 109 N -3.97 1.79 0.47 4.36 0.00 0.21 -4.67 107.32 105.51 1d9k s GLY 109 Ca 0.37 -1.41 0.32 0.00 0.00 0.00 0.00 44.72 43.99 1d9k s GLY 109 CO 0.32 -1.02 1.95 -2.55 0.00 0.00 0.00 173.10 171.80 1d9k h PRO 110 N -0.21 0.00 0.00 2.90 0.11 -1.88 -3.44 132.00 129.48 1d9k h PRO 110 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1d9k h PRO 110 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1d9k h PRO 110 CO 0.49 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.69 1d9k n GLY 111 N -0.40 2.27 2.97 -0.55 0.00 -1.26 -5.06 105.19 103.15 1d9k n GLY 111 Ca -0.00 -1.90 -0.14 0.00 0.00 0.00 0.00 46.02 43.98 1d9k n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1d9k s THR 112 N -2.99 -0.38 -0.32 2.61 2.01 0.16 -4.64 115.64 112.08 1d9k s THR 112 Ca 0.00 0.29 -0.20 0.00 0.31 0.00 0.00 61.69 62.10 1d9k s THR 112 Cb 0.00 -0.41 -0.01 0.00 0.01 0.00 0.00 72.50 72.09 1d9k s THR 112 CO 0.00 0.12 0.60 -0.60 -0.69 0.00 0.00 174.62 174.05 1d9k s ARG 113 N 2.39 3.81 -0.17 4.92 3.52 -1.24 -0.38 118.95 131.81 1d9k s ARG 113 Ca 0.02 0.16 -0.05 0.00 -0.13 0.00 0.00 55.73 55.73 1d9k s ARG 113 Cb -0.12 -3.76 -0.03 0.00 -1.56 0.00 0.00 34.95 29.48 1d9k s ARG 113 CO -0.08 -0.61 0.00 -1.17 -0.81 0.00 0.00 175.30 172.63 1d9k s LEU 114 N 2.58 3.42 -0.31 -0.88 2.96 -0.67 -1.21 118.68 124.56 1d9k s LEU 114 Ca 0.24 -0.08 0.03 0.00 -0.22 0.00 0.00 54.13 54.09 1d9k s LEU 114 Cb -0.15 -1.85 0.09 0.00 0.50 0.00 0.00 46.19 44.78 1d9k s LEU 114 CO 0.13 0.15 0.02 -0.89 -1.32 0.00 0.00 176.35 174.43 1d9k s THR 115 N 0.51 2.07 -0.42 3.68 2.01 -0.81 -3.33 115.64 119.35 1d9k s THR 115 Ca -0.01 -2.04 -0.28 0.00 0.31 0.00 0.00 61.69 59.67 1d9k s THR 115 Cb -0.14 -2.45 0.02 0.00 0.01 0.00 0.00 72.50 69.95 1d9k s THR 115 CO 0.02 -0.46 1.08 -0.69 -0.69 0.00 0.00 174.62 173.88 1d9k s VAL 116 N 1.04 4.36 0.00 3.82 1.01 -1.26 -2.10 120.40 127.27 1d9k s VAL 116 Ca 0.06 1.31 -0.25 0.00 0.00 0.00 0.00 61.98 63.10 1d9k s VAL 116 Cb -0.19 -4.51 -0.19 0.00 0.00 0.00 0.00 36.38 31.50 1d9k s VAL 116 CO -0.09 -0.80 1.34 -0.07 0.00 0.00 0.00 175.10 175.49 1d9k h LEU 116 N 10.72 -0.06 0.00 3.92 3.38 -0.53 -3.39 115.31 129.35 1d9k h LEU 116 Ca -0.22 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.40 1d9k h LEU 116 Cb 1.06 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1d9k h LEU 116 CO 1.08 0.32 0.00 0.61 0.09 0.00 0.00 178.44 180.53 1d9k n GLY 116 N -0.10 0.00 0.00 0.83 0.00 -1.26 -4.85 105.19 99.81 1d9k n GLY 116 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1d9k n GLY 116 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18