#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hr9 s ILE 2 N 0.00 4.13 0.21 1.12 2.07 -1.26 -2.32 121.20 125.14 2hr9 s ILE 2 Ca 0.00 -0.80 0.05 0.00 -1.41 0.00 0.00 60.65 58.49 2hr9 s ILE 2 Cb 0.00 -2.91 -0.03 0.00 0.13 0.00 0.00 42.46 39.64 2hr9 s ILE 2 CO 0.00 0.23 0.28 -0.63 -1.91 0.00 0.00 174.94 172.91 2hr9 s ILE 3 N -1.22 5.03 -0.39 2.00 -1.09 0.11 -1.33 121.20 124.31 2hr9 s ILE 3 Ca 0.23 -0.99 0.02 0.00 -2.23 0.00 0.00 60.65 57.69 2hr9 s ILE 3 Cb -0.12 -3.67 0.12 0.00 -1.58 0.00 0.00 42.46 37.21 2hr9 s ILE 3 CO 0.15 -0.24 0.16 -0.31 -1.23 0.00 0.00 174.94 173.47 2hr9 s TYR 4 N -1.91 2.51 0.07 3.97 1.51 0.39 -2.56 117.35 121.32 2hr9 s TYR 4 Ca 0.34 -2.48 0.05 0.00 -1.01 0.00 0.00 57.07 53.97 2hr9 s TYR 4 Cb -0.10 -2.23 -0.04 0.00 -0.11 0.00 0.00 41.96 39.49 2hr9 s TYR 4 CO 0.27 -0.84 -0.05 -0.98 -1.11 0.00 0.00 175.55 172.84 2hr9 s ARG 5 N 0.75 2.40 0.69 -0.62 1.70 -0.68 0.77 118.95 123.97 2hr9 s ARG 5 Ca 0.14 -0.87 -0.16 0.00 -0.47 0.00 0.00 55.73 54.36 2hr9 s ARG 5 Cb -0.21 -2.45 -0.00 0.00 -0.57 0.00 0.00 34.95 31.71 2hr9 s ARG 5 CO -0.09 0.54 1.03 -3.47 -1.08 0.00 0.00 175.30 172.24 2hr9 n ASP 6 N 0.85 0.82 0.14 -2.89 2.03 -0.66 0.55 116.55 117.38 2hr9 n ASP 6 Ca -0.13 0.71 0.04 0.00 0.52 0.00 0.00 54.79 55.94 2hr9 n ASP 6 Cb 0.52 -1.43 0.04 0.00 -0.72 0.00 0.00 41.12 39.53 2hr9 n ASP 6 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 2hr9 h LEU 7 N -0.04 0.00 0.06 -2.67 5.85 -1.60 0.66 115.31 117.58 2hr9 h LEU 7 Ca -0.48 0.00 -0.32 0.00 0.84 0.00 0.00 57.88 57.92 2hr9 h LEU 7 Cb 1.34 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.34 2hr9 h LEU 7 CO 0.48 0.41 -1.78 -0.38 -0.34 0.00 0.00 178.44 176.83 2hr9 n ILE 8 N -3.15 1.65 0.05 4.05 -0.00 -1.26 -4.46 119.36 116.23 2hr9 n ILE 8 Ca 0.01 -0.39 0.09 0.00 -0.00 0.00 0.00 62.75 62.47 2hr9 n ILE 8 Cb 0.70 -1.85 -0.08 0.00 -0.00 0.00 0.00 39.64 38.42 2hr9 n ILE 8 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 2hr9 n SER 9 N -3.89 0.50 -1.88 4.38 2.88 -1.26 -4.97 113.62 109.38 2hr9 n SER 9 Ca -0.34 0.20 -0.19 0.00 -1.33 0.00 0.00 58.87 57.21 2hr9 n SER 9 Cb 0.89 1.01 -0.03 0.00 -0.75 0.00 0.00 64.21 65.32 2hr9 n SER 9 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2hr9 n HIS 10 N -2.55 -0.59 -3.75 0.66 8.25 0.23 -4.92 115.22 112.54 2hr9 n HIS 10 Ca -0.04 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.06 2hr9 n HIS 10 Cb 0.62 -3.48 -0.10 0.00 1.12 0.00 0.00 29.99 28.14 2hr9 n HIS 10 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2hr9 s ASP 11 N -2.38 5.81 -0.42 0.41 -1.08 -1.25 -4.71 116.67 113.05 2hr9 s ASP 11 Ca 0.00 0.03 -0.28 0.00 -0.52 0.00 0.00 52.55 51.78 2hr9 s ASP 11 Cb 0.00 -2.04 -0.08 0.00 -1.46 0.00 0.00 42.92 39.34 2hr9 s ASP 11 CO 0.00 0.06 2.36 -1.84 0.52 0.00 0.00 175.17 176.26 2hr9 n GLU 12 N 4.33 1.27 0.16 4.34 0.00 -1.26 -1.66 120.64 127.83 2hr9 n GLU 12 Ca -0.15 0.19 0.12 0.00 0.00 0.00 0.00 57.16 57.31 2hr9 n GLU 12 Cb 0.52 -3.19 0.17 0.00 0.00 0.00 0.00 31.44 28.94 2hr9 n GLU 12 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.13 177.65 2hr9 h MET 13 N 17.17 0.00 -1.76 3.44 2.86 0.02 -3.46 114.93 133.19 2hr9 h MET 13 Ca -0.29 0.00 0.39 0.00 -2.06 0.00 0.00 59.70 57.74 2hr9 h MET 13 Cb 1.27 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 32.83 2hr9 h MET 13 CO 1.10 0.00 0.97 -0.59 1.06 0.00 0.00 176.91 179.45 2hr9 s PHE 14 N -3.22 0.00 0.03 -0.22 -0.71 -0.84 -4.82 117.98 108.20 2hr9 s PHE 14 Ca 0.06 -0.05 0.00 0.00 -1.04 0.00 0.00 56.93 55.91 2hr9 s PHE 14 Cb 0.08 0.52 -0.00 0.00 -1.21 0.00 0.00 43.02 42.41 2hr9 s PHE 14 CO 0.69 -0.10 0.01 -1.13 -1.34 0.00 0.00 175.22 173.35 2hr9 n SER 15 N -0.86 0.85 -1.93 1.98 3.41 -1.26 0.15 113.62 115.95 2hr9 n SER 15 Ca 0.01 -1.17 -0.15 0.00 -0.26 0.00 0.00 58.87 57.30 2hr9 n SER 15 Cb 0.60 0.08 0.17 0.00 -0.26 0.00 0.00 64.21 64.80 2hr9 n SER 15 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2hr9 n ASP 16 N -2.12 3.78 0.02 4.04 2.03 -0.44 -4.14 116.55 119.71 2hr9 n ASP 16 Ca -0.00 -3.20 0.12 0.00 0.52 0.00 0.00 54.79 52.22 2hr9 n ASP 16 Cb 0.05 -0.75 0.24 0.00 -0.72 0.00 0.00 41.12 39.93 2hr9 n ASP 16 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2hr9 n ILE 17 N -0.62 0.09 -3.52 5.18 -5.35 -1.26 -4.90 119.36 108.98 2hr9 n ILE 17 Ca 0.44 -0.07 -0.03 0.00 -0.27 0.00 0.00 62.75 62.82 2hr9 n ILE 17 Cb 1.38 0.12 0.00 0.00 -1.74 0.00 0.00 39.64 39.40 2hr9 n ILE 17 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2hr9 n TYR 18 N -1.66 -1.48 -3.11 4.28 4.01 -1.26 -5.06 117.16 112.89 2hr9 n TYR 18 Ca 0.05 -0.26 -0.45 0.00 -0.16 0.00 0.00 57.90 57.08 2hr9 n TYR 18 Cb 0.36 -0.05 -0.02 0.00 -0.31 0.00 0.00 39.34 39.33 2hr9 n TYR 18 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 2hr9 s LYS 19 N -2.25 3.77 -0.14 -0.72 1.02 -1.21 -4.95 119.74 115.26 2hr9 s LYS 19 Ca 0.04 -2.32 -0.21 0.00 0.02 0.00 0.00 55.97 53.50 2hr9 s LYS 19 Cb -0.00 -4.75 -0.03 0.00 -0.52 0.00 0.00 37.83 32.53 2hr9 s LYS 19 CO 0.02 -1.55 0.63 0.42 -0.92 0.00 0.00 175.35 173.95 2hr9 s ILE 20 N 1.19 5.06 0.10 2.17 1.09 -1.26 -1.99 121.20 127.57 2hr9 s ILE 20 Ca 0.30 1.24 0.10 0.00 -1.10 0.00 0.00 60.65 61.19 2hr9 s ILE 20 Cb -0.07 -3.96 -0.04 0.00 -1.06 0.00 0.00 42.46 37.34 2hr9 s ILE 20 CO -0.07 0.20 -0.27 -0.13 -0.10 0.00 0.00 174.94 174.57 2hr9 s ARG 21 N 1.27 1.53 -0.31 2.79 0.52 0.62 -4.92 118.95 120.45 2hr9 s ARG 21 Ca 0.31 -1.28 -0.17 0.00 -0.52 0.00 0.00 55.73 54.08 2hr9 s ARG 21 Cb -0.16 -1.93 -0.02 0.00 0.52 0.00 0.00 34.95 33.36 2hr9 s ARG 21 CO 0.13 0.47 0.47 -1.21 0.02 0.00 0.00 175.30 175.17 2hr9 s GLU 22 N -1.83 3.79 0.36 3.54 2.02 -1.26 0.13 118.70 125.45 2hr9 s GLU 22 Ca 0.13 -0.05 0.08 0.00 0.02 0.00 0.00 54.97 55.16 2hr9 s GLU 22 Cb -0.10 -3.74 -0.05 0.00 0.10 0.00 0.00 34.13 30.34 2hr9 s GLU 22 CO 0.05 -0.49 0.12 0.96 0.02 0.00 0.00 175.26 175.91 2hr9 s ILE 23 N 2.26 2.66 -1.58 -1.63 -4.36 0.87 -4.59 121.20 114.84 2hr9 s ILE 23 Ca 0.18 -1.78 0.00 0.00 -0.26 0.00 0.00 60.65 58.79 2hr9 s ILE 23 Cb -0.16 -2.93 0.00 0.00 1.25 0.00 0.00 42.46 40.62 2hr9 s ILE 23 CO 0.12 -0.13 0.00 0.00 0.24 0.00 0.00 174.94 175.17 2hr9 n ALA 24 N -1.12 -0.67 -3.31 2.27 0.00 -1.26 -1.47 120.51 114.94 2hr9 n ALA 24 Ca -0.03 0.15 -0.18 0.00 0.00 0.00 0.00 53.44 53.38 2hr9 n ALA 24 Cb 0.63 -2.00 0.06 0.00 0.00 0.00 0.00 19.45 18.14 2hr9 n ALA 24 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2hr9 n ASP 25 N -1.96 -5.39 0.00 0.00 8.00 -1.26 -2.41 116.55 113.54 2hr9 n ASP 25 Ca -0.22 -0.40 0.00 0.00 0.71 0.00 0.00 54.79 54.88 2hr9 n ASP 25 Cb 0.67 -4.00 0.00 0.00 -0.02 0.00 0.00 41.12 37.76 2hr9 n ASP 25 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2hr9 n GLY 26 N -1.65 2.38 0.38 0.44 0.00 -0.54 -4.90 105.19 101.29 2hr9 n GLY 26 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.22 2hr9 n GLY 26 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2hr9 h LEU 27 N 0.00 0.01 -7.96 0.99 7.12 -1.14 -3.39 115.31 110.94 2hr9 h LEU 27 Ca 0.00 0.00 -0.08 0.00 0.13 0.00 0.00 57.88 57.93 2hr9 h LEU 27 Cb 0.00 -0.00 -0.12 0.00 -0.53 0.00 0.00 40.66 40.01 2hr9 h LEU 27 CO 0.00 0.01 -0.24 0.00 -0.13 0.00 0.00 178.44 178.07 2hr9 s LEU 29 N -2.94 1.57 -0.31 0.00 1.02 0.27 -0.09 118.68 118.21 2hr9 s LEU 29 Ca 0.14 -0.28 -0.19 0.00 0.02 0.00 0.00 54.13 53.81 2hr9 s LEU 29 Cb 0.02 -0.79 -0.01 0.00 0.02 0.00 0.00 46.19 45.43 2hr9 s LEU 29 CO -0.02 0.01 0.59 -1.61 0.02 0.00 0.00 176.35 175.34 2hr9 s GLU 30 N 0.79 3.87 -0.39 1.70 2.02 0.34 -1.19 118.70 125.83 2hr9 s GLU 30 Ca -0.12 0.21 -0.15 0.00 0.02 0.00 0.00 54.97 54.92 2hr9 s GLU 30 Cb -0.15 -3.73 0.01 0.00 0.10 0.00 0.00 34.13 30.35 2hr9 s GLU 30 CO 0.02 -0.56 0.33 0.08 0.02 0.00 0.00 175.26 175.16 2hr9 s VAL 31 N 2.53 5.21 -0.33 2.63 1.01 -0.51 -0.27 120.40 130.67 2hr9 s VAL 31 Ca 0.23 -0.38 -0.20 0.00 0.00 0.00 0.00 61.98 61.63 2hr9 s VAL 31 Cb -0.15 -3.89 -0.00 0.00 0.00 0.00 0.00 36.38 32.33 2hr9 s VAL 31 CO 0.12 -0.24 0.62 -1.61 0.00 0.00 0.00 175.10 173.99 2hr9 s GLU 32 N 1.85 3.81 0.00 2.72 2.02 -0.84 -0.40 118.70 127.85 2hr9 s GLU 32 Ca 0.08 0.18 0.00 0.00 0.02 0.00 0.00 54.97 55.25 2hr9 s GLU 32 Cb -0.18 -3.76 0.00 0.00 0.10 0.00 0.00 34.13 30.29 2hr9 s GLU 32 CO 0.11 -0.63 0.00 0.41 0.02 0.00 0.00 175.26 175.17 2hr9 n GLY 33 N 4.54 0.66 3.50 -1.39 0.00 0.17 -3.30 105.19 109.37 2hr9 n GLY 33 Ca -0.01 -0.09 0.01 0.00 0.00 0.00 0.00 46.02 45.93 2hr9 n GLY 33 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hr9 s LYS 34 N 4.05 0.18 -0.03 1.61 -2.85 -1.26 -4.53 119.74 116.91 2hr9 s LYS 34 Ca 0.00 0.37 -0.30 0.00 -1.00 0.00 0.00 55.97 55.04 2hr9 s LYS 34 Cb 0.00 0.12 -0.05 0.00 -2.06 0.00 0.00 37.83 35.84 2hr9 s LYS 34 CO 0.00 -0.05 1.44 -1.64 0.10 0.00 0.00 175.35 175.20 2hr9 s MET 35 N 1.61 4.25 -0.09 1.78 -1.94 -1.26 -0.78 119.30 122.87 2hr9 s MET 35 Ca -0.05 1.98 0.01 0.00 -1.71 0.00 0.00 55.69 55.92 2hr9 s MET 35 Cb -0.03 -3.68 -0.02 0.00 2.01 0.00 0.00 34.83 33.11 2hr9 s MET 35 CO -0.14 -0.65 -0.14 0.14 -0.01 0.00 0.00 175.02 174.22 2hr9 s VAL 36 N 2.87 3.06 0.53 -6.03 -7.23 0.19 -4.90 120.40 108.89 2hr9 s VAL 36 Ca 0.65 -0.69 -0.02 0.00 -1.81 0.00 0.00 61.98 60.11 2hr9 s VAL 36 Cb -0.31 -2.25 0.01 0.00 0.56 0.00 0.00 36.38 34.39 2hr9 s VAL 36 CO 0.26 0.55 0.79 -0.94 -0.31 0.00 0.00 175.10 175.45 2hr9 s SER 37 N -0.13 5.62 -0.08 4.85 1.04 -1.26 -1.80 113.70 121.94 2hr9 s SER 37 Ca -0.01 0.42 -0.04 0.00 0.48 0.00 0.00 55.95 56.81 2hr9 s SER 37 Cb -0.14 -1.50 0.04 0.00 0.10 0.00 0.00 66.02 64.53 2hr9 s SER 37 CO 0.03 -0.94 0.18 -0.60 0.98 0.00 0.00 173.24 172.90 2hr9 s ARG 38 N -4.78 0.12 -0.02 4.02 3.52 0.39 -4.90 118.95 117.29 2hr9 s ARG 38 Ca 0.52 0.46 0.16 0.00 -0.13 0.00 0.00 55.73 56.73 2hr9 s ARG 38 Cb -0.10 -0.17 0.28 0.00 -1.56 0.00 0.00 34.95 33.39 2hr9 s ARG 38 CO 0.41 -0.19 1.11 0.25 -0.81 0.00 0.00 175.30 176.07 2hr9 n THR 39 N 4.41 0.21 -1.47 4.11 -2.24 -1.26 -1.74 114.28 116.30 2hr9 n THR 39 Ca -0.23 -0.84 0.18 0.00 -2.27 0.00 0.00 64.05 60.89 2hr9 n THR 39 Cb 0.52 0.70 -0.10 0.00 -2.10 0.00 0.00 70.33 69.35 2hr9 n THR 39 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2hr9 n GLU 40 N 0.15 -3.39 0.00 -0.78 -0.58 -1.26 -5.00 120.64 109.78 2hr9 n GLU 40 Ca 0.05 2.78 0.00 0.00 -0.42 0.00 0.00 57.16 59.57 2hr9 n GLU 40 Cb 0.95 -3.97 0.00 0.00 -0.57 0.00 0.00 31.44 27.84 2hr9 n GLU 40 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2hr9 n GLY 41 N -4.39 -0.63 0.05 0.62 0.00 -1.26 -4.52 105.19 95.05 2hr9 n GLY 41 Ca -0.10 -1.80 0.02 0.00 0.00 0.00 0.00 46.02 44.15 2hr9 n GLY 41 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2hr9 n ASN 42 N 0.08 0.03 -1.01 1.61 3.02 -1.26 -5.10 115.26 112.63 2hr9 n ASN 42 Ca 0.00 0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 2hr9 n ASN 42 Cb 0.00 1.54 0.00 0.00 -0.61 0.00 0.00 39.78 40.71 2hr9 n ASN 42 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2hr9 n ILE 43 N -2.48 -3.62 -3.94 2.41 -0.00 -1.26 -4.94 119.36 105.52 2hr9 n ILE 43 Ca -0.16 1.46 -0.35 0.00 -0.00 0.00 0.00 62.75 63.70 2hr9 n ILE 43 Cb 0.82 -2.23 -0.10 0.00 -0.00 0.00 0.00 39.64 38.13 2hr9 n ILE 43 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 2hr9 s ASP 44 N -1.99 5.68 0.00 4.38 -1.08 -1.26 -4.48 116.67 117.91 2hr9 s ASP 44 Ca 0.00 0.07 0.00 0.00 -0.52 0.00 0.00 52.55 52.10 2hr9 s ASP 44 Cb 0.00 -1.98 0.00 0.00 -1.46 0.00 0.00 42.92 39.48 2hr9 s ASP 44 CO 0.00 0.15 0.00 0.47 0.52 0.00 0.00 175.17 176.31 2hr9 n ASP 45 N 3.70 0.00 0.10 -0.34 9.92 -1.05 -5.01 116.55 123.86 2hr9 n ASP 45 Ca -0.16 -0.82 -0.15 0.00 -0.53 0.00 0.00 54.79 53.13 2hr9 n ASP 45 Cb 0.52 0.00 -0.14 0.00 -0.64 0.00 0.00 41.12 40.86 2hr9 n ASP 45 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 2hr9 h SER 46 N 0.00 0.38 0.48 -2.24 0.87 -1.97 -3.34 113.55 107.73 2hr9 h SER 46 Ca 0.00 -0.41 -0.30 0.00 -1.23 0.00 0.00 61.79 59.85 2hr9 h SER 46 Cb 0.00 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 2hr9 h SER 46 CO 0.00 1.32 -1.53 0.17 -0.53 0.00 0.00 176.83 176.27 2hr9 h LEU 47 N 0.07 0.34 -9.90 2.23 -0.00 -2.00 -3.47 115.31 102.56 2hr9 h LEU 47 Ca -0.12 -0.48 -0.57 0.00 -0.00 0.00 0.00 57.88 56.70 2hr9 h LEU 47 Cb 1.95 -0.11 -0.09 0.00 -0.00 0.00 0.00 40.66 42.42 2hr9 h LEU 47 CO 0.20 1.40 -0.50 0.27 -0.00 0.00 0.00 178.44 179.81 2hr9 s ILE 48 N -2.62 2.23 0.00 0.15 -4.36 -1.25 -5.03 121.20 110.32 2hr9 s ILE 48 Ca -0.08 -1.72 0.00 0.00 -0.26 0.00 0.00 60.65 58.59 2hr9 s ILE 48 Cb 0.07 -2.94 0.00 0.00 1.25 0.00 0.00 42.46 40.84 2hr9 s ILE 48 CO 0.85 0.00 0.00 0.61 0.24 0.00 0.00 174.94 176.64 2hr9 n GLY 49 N -1.24 -0.35 0.05 6.27 0.00 -1.26 -2.55 105.19 106.11 2hr9 n GLY 49 Ca -0.02 -0.75 -0.05 0.00 0.00 0.00 0.00 46.02 45.21 2hr9 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hr9 n GLY 50 N 0.82 -0.57 3.63 -0.02 0.00 -1.26 -4.91 105.19 102.88 2hr9 n GLY 50 Ca 0.00 -0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 2hr9 n GLY 50 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2hr9 s ASN 51 N -4.32 4.31 0.04 1.61 -0.87 -1.26 -5.05 114.94 109.41 2hr9 s ASN 51 Ca -0.06 -0.83 0.07 0.00 -1.57 0.00 0.00 52.86 50.48 2hr9 s ASN 51 Cb 0.04 -0.66 -0.23 0.00 -0.02 0.00 0.00 41.25 40.38 2hr9 s ASN 51 CO 0.48 -0.11 1.00 0.00 -2.57 0.00 0.00 177.10 175.89 2hr9 h ALA 52 N 1.87 0.48 -2.29 0.60 0.00 -2.01 -3.46 119.26 114.44 2hr9 h ALA 52 Ca -0.43 -1.13 -0.49 0.00 0.00 0.00 0.00 54.91 52.86 2hr9 h ALA 52 Cb 1.25 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 2hr9 h ALA 52 CO 0.63 1.34 0.12 0.45 0.00 0.00 0.00 179.25 181.79 2hr9 s SER 53 N -6.56 6.71 -0.48 0.00 0.15 -1.26 -4.98 113.70 107.28 2hr9 s SER 53 Ca -0.03 1.27 0.02 0.00 0.70 0.00 0.00 55.95 57.91 2hr9 s SER 53 Cb 0.09 -2.37 0.55 0.00 -1.71 0.00 0.00 66.02 62.58 2hr9 s SER 53 CO 0.83 -0.28 1.91 0.00 1.20 0.00 0.00 173.24 176.90 2hr9 n ALA 54 N -0.67 5.61 -2.33 5.45 0.00 -1.26 -4.96 120.51 122.35 2hr9 n ALA 54 Ca 0.04 -2.83 -0.23 0.00 0.00 0.00 0.00 53.44 50.41 2hr9 n ALA 54 Cb 0.53 -1.51 0.01 0.00 0.00 0.00 0.00 19.45 18.49 2hr9 n ALA 54 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2hr9 s GLU 55 N -3.19 3.08 0.00 0.00 8.01 -1.26 -4.82 118.70 120.52 2hr9 s GLU 55 Ca 0.55 -0.48 0.00 0.00 0.01 0.00 0.00 54.97 55.05 2hr9 s GLU 55 Cb 0.45 -2.56 0.00 0.00 -4.31 0.00 0.00 34.13 27.71 2hr9 s GLU 55 CO 0.07 -0.26 0.00 0.41 0.01 0.00 0.00 175.26 175.49 2hr9 n GLY 56 N -2.07 -1.07 1.93 -1.39 0.00 -1.26 -4.97 105.19 96.36 2hr9 n GLY 56 Ca 0.01 0.39 -0.14 0.00 0.00 0.00 0.00 46.02 46.28 2hr9 n GLY 56 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2hr9 n PRO 57 N 0.00 1.76 -2.25 1.61 -0.04 -1.26 -4.90 135.00 129.92 2hr9 n PRO 57 Ca 0.00 -1.26 0.00 0.00 -0.04 0.00 0.00 63.50 62.20 2hr9 n PRO 57 Cb 0.00 -1.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 2hr9 n PRO 57 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2hr9 n GLU 58 N 1.04 -5.32 -3.68 0.54 2.13 -1.26 -5.05 120.64 109.05 2hr9 n GLU 58 Ca 0.28 3.83 -0.17 0.00 0.66 0.00 0.00 57.16 61.76 2hr9 n GLU 58 Cb 0.60 -4.56 -0.16 0.00 0.27 0.00 0.00 31.44 27.60 2hr9 n GLU 58 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2hr9 s GLY 59 N -0.57 0.07 0.00 8.31 0.00 -1.26 -5.01 107.32 108.86 2hr9 s GLY 59 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 44.72 45.23 2hr9 s GLY 59 CO 0.00 1.56 0.00 -2.21 0.00 0.00 0.00 173.10 172.45 2hr9 n GLU 60 N 5.20 0.00 0.00 2.90 4.07 -1.26 -5.05 120.64 126.50 2hr9 n GLU 60 Ca -0.07 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.03 2hr9 n GLU 60 Cb 0.50 -0.34 0.00 0.00 -0.06 0.00 0.00 31.44 31.54 2hr9 n GLU 60 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2hr9 n GLY 61 N 2.27 -0.10 0.05 8.31 0.00 -1.26 -4.97 105.19 109.49 2hr9 n GLY 61 Ca 0.00 -1.60 -0.06 0.00 0.00 0.00 0.00 46.02 44.36 2hr9 n GLY 61 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2hr9 n THR 62 N 0.26 0.56 -4.10 2.61 -1.04 -1.26 -5.06 114.28 106.25 2hr9 n THR 62 Ca 0.00 -0.26 -0.10 0.00 -2.04 0.00 0.00 64.05 61.65 2hr9 n THR 62 Cb 0.00 -0.83 -0.10 0.00 -1.82 0.00 0.00 70.33 67.57 2hr9 n THR 62 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2hr9 s GLU 63 N -2.20 0.64 -0.64 -2.82 2.12 -1.26 -5.11 118.70 109.43 2hr9 s GLU 63 Ca -0.10 -1.09 -0.03 0.00 0.36 0.00 0.00 54.97 54.11 2hr9 s GLU 63 Cb 0.03 -0.07 0.16 0.00 0.26 0.00 0.00 34.13 34.51 2hr9 s GLU 63 CO 0.26 -0.03 0.46 -1.12 -0.54 0.00 0.00 175.26 174.29 2hr9 s SER 64 N -2.50 5.27 -0.09 -1.70 0.01 -1.26 -5.05 113.70 108.39 2hr9 s SER 64 Ca 0.02 -2.89 0.01 0.00 1.31 0.00 0.00 55.95 54.40 2hr9 s SER 64 Cb 0.01 -1.86 0.02 0.00 0.21 0.00 0.00 66.02 64.40 2hr9 s SER 64 CO -0.05 -0.36 -0.10 0.28 0.41 0.00 0.00 173.24 173.42 2hr9 s THR 65 N -0.11 1.07 -0.08 1.44 -1.32 -1.26 -5.13 115.64 110.25 2hr9 s THR 65 Ca 0.17 -0.38 -0.17 0.00 -1.21 0.00 0.00 61.69 60.11 2hr9 s THR 65 Cb -0.20 -1.04 -0.05 0.00 -1.51 0.00 0.00 72.50 69.71 2hr9 s THR 65 CO -0.03 0.36 0.44 -0.69 -2.21 0.00 0.00 174.62 172.49 2hr9 s VAL 66 N 1.21 5.14 -0.09 5.08 1.01 -1.26 -4.76 120.40 126.73 2hr9 s VAL 66 Ca -0.04 0.89 0.04 0.00 0.00 0.00 0.00 61.98 62.87 2hr9 s VAL 66 Cb -0.14 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.47 2hr9 s VAL 66 CO -0.03 0.41 -0.21 0.27 0.00 0.00 0.00 175.10 175.54 2hr9 s ILE 67 N 0.08 1.81 -0.03 2.22 -0.00 -0.71 -4.94 121.20 119.62 2hr9 s ILE 67 Ca 0.24 -0.88 -0.00 0.00 -0.00 0.00 0.00 60.65 60.01 2hr9 s ILE 67 Cb -0.15 -1.57 0.03 0.00 -0.00 0.00 0.00 42.46 40.76 2hr9 s ILE 67 CO 0.11 0.50 0.03 -0.89 -0.00 0.00 0.00 174.94 174.69 2hr9 s THR 68 N 0.36 0.02 0.25 8.37 2.01 -1.26 0.15 115.64 125.53 2hr9 s THR 68 Ca -0.16 0.21 -0.08 0.00 0.31 0.00 0.00 61.69 61.97 2hr9 s THR 68 Cb -0.17 -0.17 0.03 0.00 0.01 0.00 0.00 72.50 72.21 2hr9 s THR 68 CO 0.07 0.13 0.47 0.61 -0.69 0.00 0.00 174.62 175.21 2hr9 n GLY 69 N 4.41 1.55 3.77 4.40 0.00 -0.74 -4.94 105.19 113.63 2hr9 n GLY 69 Ca -0.22 -1.23 -0.39 0.00 0.00 0.00 0.00 46.02 44.18 2hr9 n GLY 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hr9 s VAL 70 N -2.48 3.36 -0.01 1.61 1.01 -1.26 0.55 120.40 123.17 2hr9 s VAL 70 Ca 0.11 1.21 -0.22 0.00 0.00 0.00 0.00 61.98 63.08 2hr9 s VAL 70 Cb -0.03 -3.71 -0.14 0.00 0.00 0.00 0.00 36.38 32.50 2hr9 s VAL 70 CO 0.09 0.17 1.01 -0.78 0.00 0.00 0.00 175.10 175.59 2hr9 h ASP 71 N 3.08 -0.42 -0.78 3.32 3.58 -1.31 -2.57 116.42 121.32 2hr9 h ASP 71 Ca -0.48 -0.14 0.17 0.00 0.42 0.00 0.00 57.03 57.00 2hr9 h ASP 71 Cb 1.22 0.11 -0.05 0.00 1.72 0.00 0.00 39.33 42.33 2hr9 h ASP 71 CO 0.64 0.00 0.52 0.16 -2.88 0.00 0.00 179.24 177.69 2hr9 h ILE 72 N -0.95 0.75 -0.09 2.25 3.07 -1.94 0.16 117.51 120.76 2hr9 h ILE 72 Ca -0.05 -0.12 -0.14 0.00 1.55 0.00 0.00 64.86 66.10 2hr9 h ILE 72 Cb 0.53 0.36 -0.01 0.00 -0.27 0.00 0.00 36.82 37.43 2hr9 h ILE 72 CO 0.08 0.07 -0.55 0.58 -1.05 0.00 0.00 178.15 177.28 2hr9 h VAL 73 N 0.36 1.36 0.15 0.16 2.07 -1.92 0.19 116.25 118.62 2hr9 h VAL 73 Ca 0.39 -1.86 -0.31 0.00 0.82 0.00 0.00 66.70 65.74 2hr9 h VAL 73 Cb 0.98 1.90 0.03 0.00 -1.52 0.00 0.00 31.29 32.68 2hr9 h VAL 73 CO -0.12 0.55 -1.29 0.24 0.02 0.00 0.00 177.57 176.97 2hr9 h MET 74 N 0.21 0.60 0.00 1.57 2.86 -0.36 0.11 114.93 119.93 2hr9 h MET 74 Ca 0.00 -0.84 -0.19 0.00 -2.06 0.00 0.00 59.70 56.61 2hr9 h MET 74 Cb 1.04 0.29 -0.03 0.00 0.06 0.00 0.00 31.60 32.96 2hr9 h MET 74 CO 0.09 1.39 -0.99 -2.95 1.06 0.00 0.00 176.91 175.51 2hr9 h ASN 75 N 0.25 0.00 -0.07 1.22 7.08 -0.97 -3.23 115.58 119.86 2hr9 h ASN 75 Ca -0.20 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.02 2hr9 h ASN 75 Cb 1.97 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 38.21 2hr9 h ASN 75 CO 0.25 0.82 0.00 1.41 -2.08 0.00 0.00 177.43 177.83 2hr9 n HIS 76 N -3.24 0.06 -2.28 4.14 8.25 0.68 -4.93 115.22 117.91 2hr9 n HIS 76 Ca -0.02 -0.03 -0.17 0.00 -0.26 0.00 0.00 57.72 57.23 2hr9 n HIS 76 Cb 0.89 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.98 2hr9 n HIS 76 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2hr9 n HIS 77 N 0.58 -1.02 -1.69 4.41 8.25 -0.82 -4.15 115.22 120.77 2hr9 n HIS 77 Ca 0.17 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 57.19 2hr9 n HIS 77 Cb 0.43 -3.43 -0.04 0.00 1.12 0.00 0.00 29.99 28.08 2hr9 n HIS 77 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2hr9 n LEU 78 N -2.82 3.45 -4.41 2.41 4.77 -0.04 -3.85 117.00 116.51 2hr9 n LEU 78 Ca -0.20 1.06 -0.33 0.00 -0.03 0.00 0.00 56.01 56.51 2hr9 n LEU 78 Cb 0.64 -1.48 -0.14 0.00 -2.33 0.00 0.00 43.42 40.12 2hr9 n LEU 78 CO 0.24 -0.10 -0.42 -1.10 -1.33 0.00 0.00 177.39 174.68 2hr9 s GLN 79 N 1.29 3.41 -0.05 3.23 -0.21 0.19 -4.86 119.66 122.67 2hr9 s GLN 79 Ca 0.79 -0.64 -0.26 0.00 0.02 0.00 0.00 55.36 55.26 2hr9 s GLN 79 Cb -0.61 -2.69 -0.03 0.00 1.00 0.00 0.00 33.01 30.68 2hr9 s GLN 79 CO 0.37 0.25 0.82 -2.00 -2.12 0.00 0.00 175.29 172.60 2hr9 s GLU 80 N 0.28 4.48 0.53 2.91 2.12 -1.26 0.21 118.70 127.97 2hr9 s GLU 80 Ca -0.08 1.10 0.02 0.00 0.36 0.00 0.00 54.97 56.37 2hr9 s GLU 80 Cb -0.15 -3.46 0.02 0.00 0.26 0.00 0.00 34.13 30.80 2hr9 s GLU 80 CO 0.05 -0.00 0.14 -2.37 -0.54 0.00 0.00 175.26 172.54 2hr9 n THR 81 N 3.88 0.00 -4.53 -1.70 5.66 0.35 -4.98 114.28 112.96 2hr9 n THR 81 Ca 0.02 -2.35 -0.25 0.00 -3.05 0.00 0.00 64.05 58.42 2hr9 n THR 81 Cb 0.51 0.32 -0.11 0.00 -1.55 0.00 0.00 70.33 69.50 2hr9 n THR 81 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 2hr9 s SER 82 N -3.97 3.51 -0.16 1.09 0.01 -1.26 -4.40 113.70 108.52 2hr9 s SER 82 Ca 0.11 -1.22 -0.31 0.00 1.31 0.00 0.00 55.95 55.83 2hr9 s SER 82 Cb -0.01 -0.31 0.14 0.00 0.21 0.00 0.00 66.02 66.05 2hr9 s SER 82 CO 0.07 -0.27 1.09 -0.36 0.41 0.00 0.00 173.24 174.17 2hr9 s PHE 83 N -2.72 -0.25 0.37 2.43 0.08 -1.26 -5.08 117.98 111.53 2hr9 s PHE 83 Ca 0.32 0.34 0.07 0.00 0.12 0.00 0.00 56.93 57.78 2hr9 s PHE 83 Cb 0.04 0.49 -0.01 0.00 -0.57 0.00 0.00 43.02 42.97 2hr9 s PHE 83 CO 0.16 -0.29 0.46 0.99 -0.10 0.00 0.00 175.22 176.44 2hr9 s THR 84 N -1.74 3.56 0.10 0.64 2.01 -1.26 -4.90 115.64 114.05 2hr9 s THR 84 Ca 0.04 -1.09 -0.25 0.00 0.31 0.00 0.00 61.69 60.70 2hr9 s THR 84 Cb -0.01 -3.22 -0.11 0.00 0.01 0.00 0.00 72.50 69.17 2hr9 s THR 84 CO -0.03 -0.10 1.68 0.11 -0.69 0.00 0.00 174.62 175.59 2hr9 h LYS 85 N 0.89 -0.29 -0.28 4.92 1.57 -1.99 0.48 116.57 121.87 2hr9 h LYS 85 Ca -0.44 0.02 -0.14 0.00 -1.87 0.00 0.00 60.65 58.22 2hr9 h LYS 85 Cb 1.26 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.63 2hr9 h LYS 85 CO 0.52 -0.19 -0.41 1.05 -0.57 0.00 0.00 179.45 179.85 2hr9 h GLU 86 N -0.30 0.68 -0.38 3.15 4.11 -2.00 -2.86 114.58 116.97 2hr9 h GLU 86 Ca 0.01 -0.36 -0.05 0.00 0.07 0.00 0.00 59.36 59.04 2hr9 h GLU 86 Cb 0.30 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2hr9 h GLU 86 CO -0.06 0.97 0.05 0.00 0.07 0.00 0.00 179.01 180.04 2hr9 h ALA 87 N 0.99 0.51 -0.28 1.06 0.00 -1.89 -2.73 119.26 116.92 2hr9 h ALA 87 Ca 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2hr9 h ALA 87 Cb 0.94 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2hr9 h ALA 87 CO 0.09 0.23 0.13 -0.92 0.00 0.00 0.00 179.25 178.78 2hr9 h TYR 88 N 0.48 0.37 -0.58 0.00 3.20 -0.01 0.24 116.97 120.67 2hr9 h TYR 88 Ca 0.12 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.97 2hr9 h TYR 88 Cb 0.38 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 2hr9 h TYR 88 CO 0.03 0.28 0.30 0.87 -1.64 0.00 0.00 178.16 178.00 2hr9 h LYS 89 N 0.38 0.83 0.00 1.82 1.57 -1.25 0.16 116.57 120.08 2hr9 h LYS 89 Ca 0.10 -0.11 -0.15 0.00 -1.87 0.00 0.00 60.65 58.62 2hr9 h LYS 89 Cb 0.05 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 2hr9 h LYS 89 CO -0.01 0.65 -0.73 0.87 -0.57 0.00 0.00 179.45 179.66 2hr9 h LYS 90 N 0.79 0.00 -0.17 3.15 1.57 -1.25 -3.08 116.57 117.57 2hr9 h LYS 90 Ca 0.20 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.96 2hr9 h LYS 90 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 2hr9 h LYS 90 CO -0.03 0.73 0.02 -0.92 -0.57 0.00 0.00 179.45 178.68 2hr9 h TYR 91 N 0.00 0.31 -0.38 -1.35 3.20 0.07 -2.05 116.97 116.77 2hr9 h TYR 91 Ca -0.01 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.81 2hr9 h TYR 91 Cb 1.46 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.63 2hr9 h TYR 91 CO 0.00 0.47 0.22 0.97 -1.64 0.00 0.00 178.16 178.18 2hr9 h ILE 92 N 0.07 1.13 -0.87 1.81 6.09 -0.75 0.26 117.51 125.25 2hr9 h ILE 92 Ca 0.05 -0.33 0.04 0.00 -1.37 0.00 0.00 64.86 63.26 2hr9 h ILE 92 Cb 0.33 0.66 -0.05 0.00 0.47 0.00 0.00 36.82 38.23 2hr9 h ILE 92 CO 0.00 0.14 0.57 0.50 -3.07 0.00 0.00 178.15 176.29 2hr9 h LYS 93 N 0.50 1.02 -0.03 2.19 3.64 -1.48 0.76 116.57 123.16 2hr9 h LYS 93 Ca 0.14 -0.06 -0.16 0.00 -1.27 0.00 0.00 60.65 59.29 2hr9 h LYS 93 Cb 0.03 -0.23 0.01 0.00 -0.41 0.00 0.00 32.23 31.63 2hr9 h LYS 93 CO -0.02 0.67 -0.61 0.22 -2.27 0.00 0.00 179.45 177.44 2hr9 h ASP 94 N 1.05 0.59 -0.04 4.20 3.58 -0.96 -2.22 116.42 122.62 2hr9 h ASP 94 Ca 0.35 -0.72 -0.25 0.00 0.42 0.00 0.00 57.03 56.83 2hr9 h ASP 94 Cb 0.08 -0.18 0.02 0.00 1.72 0.00 0.00 39.33 40.97 2hr9 h ASP 94 CO -0.11 1.23 -0.97 0.10 -2.88 0.00 0.00 179.24 176.61 2hr9 h TYR 95 N 0.01 1.06 -0.12 0.28 -0.00 -0.67 -2.89 116.97 114.64 2hr9 h TYR 95 Ca -0.07 -0.54 -0.09 0.00 0.00 0.00 0.00 58.73 58.03 2hr9 h TYR 95 Cb 1.29 -0.13 -0.01 0.00 0.00 0.00 0.00 36.73 37.88 2hr9 h TYR 95 CO 0.13 1.38 -0.33 0.00 -0.00 0.00 0.00 178.16 179.34 2hr9 h MET 96 N 0.43 0.23 -0.18 0.10 -0.00 0.42 -2.74 114.93 113.20 2hr9 h MET 96 Ca -0.11 -0.09 -0.12 0.00 -0.00 0.00 0.00 59.70 59.38 2hr9 h MET 96 Cb 1.61 -0.01 -0.01 0.00 -0.00 0.00 0.00 31.60 33.19 2hr9 h MET 96 CO 0.19 0.55 -0.40 1.57 -0.00 0.00 0.00 176.91 178.82 2hr9 h LYS 97 N 0.20 0.42 -0.73 -0.10 2.10 -1.40 0.37 116.57 117.43 2hr9 h LYS 97 Ca 0.03 -0.21 -0.03 0.00 -2.00 0.00 0.00 60.65 58.44 2hr9 h LYS 97 Cb 0.69 -0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.99 2hr9 h LYS 97 CO 0.05 0.76 0.33 0.77 -2.00 0.00 0.00 179.45 179.36 2hr9 h SER 98 N 0.35 0.98 0.32 7.07 0.02 -1.27 -0.81 113.55 120.20 2hr9 h SER 98 Ca 0.03 -0.15 -0.33 0.00 -0.84 0.00 0.00 61.79 60.51 2hr9 h SER 98 Cb 0.86 -0.25 0.03 0.00 0.14 0.00 0.00 62.40 63.18 2hr9 h SER 98 CO 0.07 0.85 -1.43 0.40 -1.14 0.00 0.00 176.83 175.58 2hr9 h ILE 99 N 1.03 1.32 0.34 3.27 2.04 -1.38 -2.91 117.51 121.22 2hr9 h ILE 99 Ca 0.25 -2.75 -0.00 0.00 1.00 0.00 0.00 64.86 63.35 2hr9 h ILE 99 Cb 0.15 3.01 -0.03 0.00 -0.74 0.00 0.00 36.82 39.22 2hr9 h ILE 99 CO -0.03 0.82 -0.42 0.50 0.00 0.00 0.00 178.15 179.03 2hr9 h LYS 100 N 0.14 -0.77 -0.66 2.37 3.11 -0.07 0.75 116.57 121.43 2hr9 h LYS 100 Ca -0.23 0.05 0.02 0.00 -2.81 0.00 0.00 60.65 57.67 2hr9 h LYS 100 Cb 2.13 0.17 -0.04 0.00 -1.00 0.00 0.00 32.23 33.50 2hr9 h LYS 100 CO 0.26 -0.51 0.43 0.78 -2.81 0.00 0.00 179.45 177.60 2hr9 h GLY 101 N -0.80 0.94 1.01 5.01 0.00 -1.28 0.87 103.07 108.81 2hr9 h GLY 101 Ca -0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 2hr9 h GLY 101 CO -0.11 0.31 0.40 1.70 0.00 0.00 0.00 176.54 178.84 2hr9 h LYS 102 N 0.86 1.00 -0.20 4.80 3.11 -1.26 -1.85 116.57 123.04 2hr9 h LYS 102 Ca 0.25 -0.11 -0.08 0.00 -2.81 0.00 0.00 60.65 57.90 2hr9 h LYS 102 Cb -0.05 -0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 30.97 2hr9 h LYS 102 CO -0.07 0.74 -0.24 1.25 -2.81 0.00 0.00 179.45 178.32 2hr9 h LEU 103 N 0.99 0.35 -2.05 5.20 5.85 0.11 -2.12 115.31 123.65 2hr9 h LEU 103 Ca 0.25 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 2hr9 h LEU 103 Cb 0.03 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 2hr9 h LEU 103 CO -0.04 0.60 -0.02 -0.33 -0.34 0.00 0.00 178.44 178.31 2hr9 h GLU 104 N 0.32 0.00 0.00 1.25 5.08 -0.00 1.52 114.58 122.75 2hr9 h GLU 104 Ca 0.05 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2hr9 h GLU 104 Cb 0.60 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 2hr9 h GLU 104 CO 0.04 0.02 -0.74 0.93 -1.00 0.00 0.00 179.01 178.26 2hr9 h GLU 105 N 0.00 0.00 0.00 2.33 5.08 -1.10 -3.31 114.58 117.59 2hr9 h GLU 105 Ca -0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2hr9 h GLU 105 Cb 0.04 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2hr9 h GLU 105 CO 0.00 0.02 -0.91 1.04 -1.00 0.00 0.00 179.01 178.16 2hr9 n GLN 106 N -2.80 0.40 -3.21 2.33 6.02 -0.39 -4.89 117.38 114.84 2hr9 n GLN 106 Ca 0.01 0.16 -0.23 0.00 -0.01 0.00 0.00 57.00 56.93 2hr9 n GLN 106 Cb 0.56 -1.20 -0.06 0.00 1.02 0.00 0.00 30.24 30.55 2hr9 n GLN 106 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2hr9 n ARG 107 N -4.19 1.13 0.24 -1.09 1.74 0.51 -4.95 116.66 110.04 2hr9 n ARG 107 Ca -0.14 -3.52 0.15 0.00 -0.77 0.00 0.00 57.85 53.57 2hr9 n ARG 107 Cb 0.44 -1.50 0.66 0.00 -1.02 0.00 0.00 32.46 31.04 2hr9 n ARG 107 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2hr9 h PRO 108 N 3.76 0.00 0.00 5.56 0.13 -1.31 0.34 132.00 140.48 2hr9 h PRO 108 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2hr9 h PRO 108 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 2hr9 h PRO 108 CO 0.54 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.46 2hr9 n GLU 109 N -3.05 0.05 0.00 0.86 0.28 -1.26 -2.36 120.64 115.15 2hr9 n GLU 109 Ca 0.02 0.20 0.04 0.00 -0.16 0.00 0.00 57.16 57.27 2hr9 n GLU 109 Cb 0.59 -1.50 0.01 0.00 1.43 0.00 0.00 31.44 31.97 2hr9 n GLU 109 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2hr9 n ARG 110 N -1.46 1.65 0.18 3.44 5.12 0.12 -4.55 116.66 121.16 2hr9 n ARG 110 Ca 0.05 -0.69 0.04 0.00 -1.93 0.00 0.00 57.85 55.32 2hr9 n ARG 110 Cb 0.18 -1.07 0.31 0.00 -1.16 0.00 0.00 32.46 30.71 2hr9 n ARG 110 CO 0.00 0.00 0.00 -0.39 -1.93 0.00 0.00 177.63 175.31 2hr9 h VAL 111 N 1.18 1.02 0.32 1.55 -1.51 -1.51 -2.96 116.25 114.35 2hr9 h VAL 111 Ca 0.00 -1.61 -0.02 0.00 -1.23 0.00 0.00 66.70 63.84 2hr9 h VAL 111 Cb 0.31 1.95 0.00 0.00 -2.13 0.00 0.00 31.29 31.42 2hr9 h VAL 111 CO 0.00 0.41 -0.15 0.11 -1.23 0.00 0.00 177.57 176.71 2hr9 h LYS 112 N 0.00 -0.41 -0.19 5.19 1.79 -1.80 -1.77 116.57 119.37 2hr9 h LYS 112 Ca -0.00 0.03 0.01 0.00 -2.18 0.00 0.00 60.65 58.50 2hr9 h LYS 112 Cb 0.91 0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.65 2hr9 h LYS 112 CO 0.05 -0.08 0.13 -1.35 -1.08 0.00 0.00 179.45 177.12 2hr9 h PRO 113 N -0.86 0.24 -0.36 3.15 0.11 -1.86 -2.21 132.00 130.22 2hr9 h PRO 113 Ca -0.04 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.96 2hr9 h PRO 113 Cb 0.52 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 2hr9 h PRO 113 CO 0.07 0.16 -0.15 0.35 -0.21 0.00 0.00 178.00 178.22 2hr9 h PHE 114 N 0.25 0.84 -0.04 0.65 3.57 -1.50 0.89 116.94 121.59 2hr9 h PHE 114 Ca 0.07 -0.20 0.03 0.00 3.53 0.00 0.00 57.97 61.40 2hr9 h PHE 114 Cb -0.01 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.50 2hr9 h PHE 114 CO -0.00 0.92 -0.14 0.52 -2.23 0.00 0.00 178.31 177.38 2hr9 h MET 115 N 0.52 -0.20 0.03 1.11 2.86 -0.68 0.29 114.93 118.85 2hr9 h MET 115 Ca 0.08 0.01 -0.17 0.00 -2.06 0.00 0.00 59.70 57.56 2hr9 h MET 115 Cb 0.69 0.05 0.02 0.00 0.06 0.00 0.00 31.60 32.41 2hr9 h MET 115 CO 0.05 -0.13 -0.69 1.15 1.06 0.00 0.00 176.91 178.34 2hr9 h THR 116 N -0.21 1.42 0.06 2.22 2.02 -1.52 -3.06 112.91 113.85 2hr9 h THR 116 Ca 0.06 -2.18 0.02 0.00 0.77 0.00 0.00 66.41 65.09 2hr9 h THR 116 Cb 0.29 2.68 -0.04 0.00 -1.74 0.00 0.00 68.15 69.35 2hr9 h THR 116 CO -0.17 0.63 -0.23 1.23 0.37 0.00 0.00 175.52 177.35 2hr9 h GLY 117 N -0.09 -0.39 0.67 2.16 0.00 0.94 0.29 103.07 106.64 2hr9 h GLY 117 Ca -0.09 0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.53 2hr9 h GLY 117 CO 0.13 -0.20 -0.12 0.00 0.00 0.00 0.00 176.54 176.35 2hr9 h ALA 118 N 0.40 -0.13 0.00 3.60 0.00 -0.54 0.11 119.26 122.70 2hr9 h ALA 118 Ca 0.04 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2hr9 h ALA 118 Cb 0.45 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2hr9 h ALA 118 CO -0.17 -0.61 -0.07 0.00 0.00 0.00 0.00 179.25 178.40 2hr9 h ALA 119 N 0.77 1.69 0.18 0.00 0.00 -1.40 -0.18 119.26 120.33 2hr9 h ALA 119 Ca 0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2hr9 h ALA 119 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2hr9 h ALA 119 CO -0.14 0.09 -0.09 1.49 0.00 0.00 0.00 179.25 180.61 2hr9 h GLU 120 N 0.00 -0.23 -0.97 0.00 4.81 0.66 -3.02 114.58 115.83 2hr9 h GLU 120 Ca -0.00 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.25 2hr9 h GLU 120 Cb 0.14 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.53 2hr9 h GLU 120 CO 0.01 0.01 0.63 0.37 -0.73 0.00 0.00 179.01 179.30 2hr9 h GLN 121 N -1.02 1.28 -0.41 1.92 4.15 -0.75 -2.49 115.11 117.79 2hr9 h GLN 121 Ca -0.02 -0.08 0.03 0.00 0.77 0.00 0.00 58.65 59.34 2hr9 h GLN 121 Cb 0.35 -0.29 -0.03 0.00 0.21 0.00 0.00 27.48 27.72 2hr9 h GLN 121 CO 0.04 0.85 0.22 0.97 -1.93 0.00 0.00 178.83 178.98 2hr9 h ILE 122 N 1.32 1.00 0.00 2.39 -0.00 -1.15 0.16 117.51 121.22 2hr9 h ILE 122 Ca 0.35 -0.15 -0.02 0.00 -0.00 0.00 0.00 64.86 65.04 2hr9 h ILE 122 Cb -0.14 0.52 -0.00 0.00 -0.00 0.00 0.00 36.82 37.20 2hr9 h ILE 122 CO -0.08 0.08 -0.10 0.11 -0.00 0.00 0.00 178.15 178.16 2hr9 h LYS 123 N 0.44 0.00 0.22 2.19 1.57 -1.34 0.45 116.57 120.10 2hr9 h LYS 123 Ca 0.17 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 2hr9 h LYS 123 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2hr9 h LYS 123 CO -0.11 0.10 -0.11 1.25 -0.57 0.00 0.00 179.45 180.02 2hr9 h HIS 124 N 0.00 -0.28 -0.61 -1.35 2.76 -0.77 -2.91 115.15 111.99 2hr9 h HIS 124 Ca -0.00 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 2hr9 h HIS 124 Cb 0.18 0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.20 2hr9 h HIS 124 CO 0.00 0.11 0.39 -0.84 -1.30 0.00 0.00 177.93 176.29 2hr9 h ILE 125 N -0.84 1.17 -0.90 6.26 3.07 -0.80 -2.30 117.51 123.17 2hr9 h ILE 125 Ca -0.03 -0.34 0.13 0.00 1.55 0.00 0.00 64.86 66.18 2hr9 h ILE 125 Cb 0.51 0.30 -0.07 0.00 -0.27 0.00 0.00 36.82 37.29 2hr9 h ILE 125 CO 0.05 0.17 0.58 -0.07 -1.05 0.00 0.00 178.15 177.83 2hr9 h LEU 126 N 0.83 0.70 0.00 0.16 3.38 -0.99 1.07 115.31 120.45 2hr9 h LEU 126 Ca 0.22 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2hr9 h LEU 126 Cb -0.06 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2hr9 h LEU 126 CO -0.05 0.36 0.00 0.00 0.09 0.00 0.00 178.44 178.85 2hr9 n ALA 127 N -2.42 1.85 -2.50 1.53 0.00 -0.87 -3.18 120.51 114.92 2hr9 n ALA 127 Ca 0.17 -0.07 0.02 0.00 0.00 0.00 0.00 53.44 53.57 2hr9 n ALA 127 Cb 0.44 -1.30 0.02 0.00 0.00 0.00 0.00 19.45 18.61 2hr9 n ALA 127 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2hr9 n ASN 128 N -1.48 0.83 0.18 0.00 3.02 0.15 -4.89 115.26 113.07 2hr9 n ASN 128 Ca 0.05 -2.01 0.19 0.00 -0.03 0.00 0.00 54.58 52.78 2hr9 n ASN 128 Cb 0.21 -0.24 0.79 0.00 -0.61 0.00 0.00 39.78 39.93 2hr9 n ASN 128 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2hr9 h PHE 129 N 1.13 0.00 -0.08 3.10 3.57 0.95 0.57 116.94 126.19 2hr9 h PHE 129 Ca -0.26 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.27 2hr9 h PHE 129 Cb 1.74 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.48 2hr9 h PHE 129 CO 0.18 0.00 0.12 0.87 -2.23 0.00 0.00 178.31 177.26 2hr9 h LYS 130 N 0.00 0.00 0.01 1.11 1.57 -1.88 -2.88 116.57 114.50 2hr9 h LYS 130 Ca 0.12 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.56 2hr9 h LYS 130 Cb 0.82 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.08 2hr9 h LYS 130 CO -0.00 0.00 -1.85 0.09 -0.57 0.00 0.00 179.45 177.12 2hr9 n ASN 131 N -3.56 1.92 -4.88 0.86 3.02 0.19 -4.97 115.26 107.84 2hr9 n ASN 131 Ca -0.01 0.36 -0.30 0.00 -0.03 0.00 0.00 54.58 54.60 2hr9 n ASN 131 Cb 0.21 -0.89 -0.04 0.00 -0.61 0.00 0.00 39.78 38.46 2hr9 n ASN 131 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2hr9 s TYR 132 N -2.44 3.46 0.02 3.10 2.02 -1.09 -4.75 117.35 117.67 2hr9 s TYR 132 Ca -0.33 0.93 0.04 0.00 -0.37 0.00 0.00 57.07 57.34 2hr9 s TYR 132 Cb 0.10 -2.34 -0.02 0.00 -0.40 0.00 0.00 41.96 39.30 2hr9 s TYR 132 CO 0.56 0.01 -0.12 -0.65 -1.57 0.00 0.00 175.55 173.78 2hr9 s GLN 133 N -3.63 0.87 -0.17 -0.62 -1.52 -1.14 -4.73 119.66 108.73 2hr9 s GLN 133 Ca 0.49 -0.58 -0.29 0.00 -1.95 0.00 0.00 55.36 53.03 2hr9 s GLN 133 Cb -0.10 -0.85 -0.01 0.00 -0.22 0.00 0.00 33.01 31.83 2hr9 s GLN 133 CO 0.29 0.22 1.14 -0.06 -0.25 0.00 0.00 175.29 176.63 2hr9 s PHE 134 N -0.60 3.17 -0.04 0.91 0.08 -1.26 -1.41 117.98 118.81 2hr9 s PHE 134 Ca 0.02 1.29 0.04 0.00 0.12 0.00 0.00 56.93 58.40 2hr9 s PHE 134 Cb -0.06 -3.36 -0.00 0.00 -0.57 0.00 0.00 43.02 39.02 2hr9 s PHE 134 CO 0.00 -0.99 -0.16 -0.06 -0.10 0.00 0.00 175.22 173.91 2hr9 s PHE 135 N 3.05 1.66 0.28 0.36 0.40 0.20 -0.49 117.98 123.43 2hr9 s PHE 135 Ca 0.50 -0.48 0.11 0.00 -0.60 0.00 0.00 56.93 56.45 2hr9 s PHE 135 Cb -0.19 -1.13 -0.05 0.00 0.51 0.00 0.00 43.02 42.16 2hr9 s PHE 135 CO 0.12 -0.17 -0.17 0.42 0.70 0.00 0.00 175.22 176.12 2hr9 s ILE 136 N 0.09 2.33 0.00 0.64 1.01 0.13 0.11 121.20 125.51 2hr9 s ILE 136 Ca -0.05 -2.34 0.00 0.00 0.00 0.00 0.00 60.65 58.26 2hr9 s ILE 136 Cb -0.12 -2.34 0.00 0.00 0.01 0.00 0.00 42.46 40.02 2hr9 s ILE 136 CO 0.02 -0.38 0.00 0.61 0.00 0.00 0.00 174.94 175.19 2hr9 n GLY 137 N -0.62 -3.31 0.00 6.18 0.00 -1.26 0.57 105.19 106.75 2hr9 n GLY 137 Ca -0.05 -1.11 0.09 0.00 0.00 0.00 0.00 46.02 44.95 2hr9 n GLY 137 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2hr9 n GLU 138 N -1.01 0.06 -0.08 1.61 0.00 -1.25 -3.04 120.64 116.94 2hr9 n GLU 138 Ca 0.00 0.17 -0.15 0.00 0.00 0.00 0.00 57.16 57.18 2hr9 n GLU 138 Cb 0.00 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 29.80 2hr9 n GLU 138 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2hr9 n ASN 139 N -1.45 1.22 -3.10 -1.84 3.02 -1.26 -5.00 115.26 106.84 2hr9 n ASN 139 Ca 0.05 0.04 -0.22 0.00 -0.03 0.00 0.00 54.58 54.43 2hr9 n ASN 139 Cb 0.20 0.01 0.05 0.00 -0.61 0.00 0.00 39.78 39.43 2hr9 n ASN 139 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2hr9 n MET 140 N -3.11 -5.79 -1.97 3.52 2.81 -1.17 -4.92 117.12 106.49 2hr9 n MET 140 Ca -0.35 0.85 -0.42 0.00 -1.81 0.00 0.00 57.70 55.97 2hr9 n MET 140 Cb 1.06 -5.70 -0.03 0.00 -0.71 0.00 0.00 33.22 27.85 2hr9 n MET 140 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 2hr9 s ASN 141 N -2.93 6.64 0.59 7.83 0.01 -1.26 -4.87 114.94 120.95 2hr9 s ASN 141 Ca 0.39 2.35 0.33 0.00 -0.71 0.00 0.00 52.86 55.22 2hr9 s ASN 141 Cb -0.17 -2.55 1.86 0.00 0.41 0.00 0.00 41.25 40.81 2hr9 s ASN 141 CO 0.48 -0.90 2.22 -0.65 -1.51 0.00 0.00 177.10 176.74 2hr9 h PRO 142 N 9.05 0.00 0.00 -0.60 0.11 -1.95 0.16 132.00 138.76 2hr9 h PRO 142 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2hr9 h PRO 142 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2hr9 h PRO 142 CO 0.94 0.03 -0.28 -3.47 -0.21 0.00 0.00 178.00 175.01 2hr9 n ASP 143 N -3.55 0.47 -2.99 -2.05 -0.08 -1.26 -4.84 116.55 102.26 2hr9 n ASP 143 Ca -0.02 0.23 0.00 0.00 -1.51 0.00 0.00 54.79 53.49 2hr9 n ASP 143 Cb 0.13 -0.21 0.00 0.00 2.34 0.00 0.00 41.12 43.39 2hr9 n ASP 143 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2hr9 n GLY 144 N 1.42 -0.87 2.98 0.27 0.00 0.04 -4.80 105.19 104.24 2hr9 n GLY 144 Ca 0.05 -1.62 -0.15 0.00 0.00 0.00 0.00 46.02 44.31 2hr9 n GLY 144 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2hr9 n MET 145 N -0.05 0.70 -4.32 1.61 0.00 -1.26 -4.77 117.12 109.04 2hr9 n MET 145 Ca 0.00 -2.39 -0.23 0.00 0.00 0.00 0.00 57.70 55.08 2hr9 n MET 145 Cb 0.00 -0.17 -0.13 0.00 0.00 0.00 0.00 33.22 32.92 2hr9 n MET 145 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 2hr9 s VAL 146 N -1.76 1.52 -0.28 3.17 1.01 -1.26 -4.81 120.40 118.00 2hr9 s VAL 146 Ca 0.46 -1.40 -0.00 0.00 0.00 0.00 0.00 61.98 61.04 2hr9 s VAL 146 Cb -0.04 -1.39 0.05 0.00 0.00 0.00 0.00 36.38 35.00 2hr9 s VAL 146 CO 0.29 -0.05 -0.04 0.00 0.00 0.00 0.00 175.10 175.30 2hr9 s ALA 147 N -1.11 2.73 -0.35 5.51 0.00 0.30 -4.73 121.76 124.11 2hr9 s ALA 147 Ca 0.04 -1.73 -0.25 0.00 0.00 0.00 0.00 51.96 50.02 2hr9 s ALA 147 Cb -0.10 -1.81 0.01 0.00 0.00 0.00 0.00 23.12 21.23 2hr9 s ALA 147 CO 0.03 -1.20 0.89 -0.51 0.00 0.00 0.00 175.76 174.98 2hr9 s LEU 148 N 1.22 4.03 -0.19 0.00 1.43 -1.08 0.60 118.68 124.69 2hr9 s LEU 148 Ca -0.06 0.63 -0.22 0.00 -1.03 0.00 0.00 54.13 53.45 2hr9 s LEU 148 Cb -0.19 -3.22 -0.02 0.00 0.03 0.00 0.00 46.19 42.78 2hr9 s LEU 148 CO -0.03 -0.79 0.67 -0.22 0.23 0.00 0.00 176.35 176.21 2hr9 s LEU 149 N 3.33 4.15 0.18 1.79 2.96 -0.50 0.11 118.68 130.69 2hr9 s LEU 149 Ca 0.37 0.90 0.07 0.00 -0.22 0.00 0.00 54.13 55.25 2hr9 s LEU 149 Cb -0.13 -2.95 -0.04 0.00 0.50 0.00 0.00 46.19 43.56 2hr9 s LEU 149 CO 0.17 -0.29 -0.14 -1.81 -1.32 0.00 0.00 176.35 172.95 2hr9 s ASP 150 N 1.18 2.36 0.10 3.68 1.11 0.32 -2.86 116.67 122.56 2hr9 s ASP 150 Ca 0.31 -0.97 0.09 0.00 0.18 0.00 0.00 52.55 52.16 2hr9 s ASP 150 Cb -0.16 -0.11 -0.04 0.00 1.07 0.00 0.00 42.92 43.69 2hr9 s ASP 150 CO 0.11 -0.18 -0.20 -0.31 1.18 0.00 0.00 175.17 175.76 2hr9 s TYR 151 N -2.81 2.48 1.08 4.23 2.02 -1.26 0.10 117.35 123.19 2hr9 s TYR 151 Ca 0.19 -0.29 -0.18 0.00 -0.37 0.00 0.00 57.07 56.41 2hr9 s TYR 151 Cb -0.01 -1.35 0.25 0.00 -0.40 0.00 0.00 41.96 40.45 2hr9 s TYR 151 CO 0.05 0.34 1.24 1.03 -1.57 0.00 0.00 175.55 176.64 2hr9 s ARG 152 N -1.95 -0.30 0.31 -0.62 1.81 -1.10 -4.85 118.95 112.24 2hr9 s ARG 152 Ca 0.16 -0.30 -0.01 0.00 -1.72 0.00 0.00 55.73 53.86 2hr9 s ARG 152 Cb -0.10 -1.73 0.48 0.00 -0.45 0.00 0.00 34.95 33.15 2hr9 s ARG 152 CO 0.08 -3.06 1.97 0.93 -0.68 0.00 0.00 175.30 174.54 2hr9 h GLU 153 N -2.11 1.04 0.00 3.54 5.08 -2.01 -0.66 114.58 119.47 2hr9 h GLU 153 Ca -0.44 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 2hr9 h GLU 153 Cb 1.25 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 30.27 2hr9 h GLU 153 CO 0.34 0.69 0.00 0.22 -1.00 0.00 0.00 179.01 179.26 2hr9 h ASP 154 N 1.08 0.00 -1.39 1.42 3.58 -1.96 -3.47 116.42 115.69 2hr9 h ASP 154 Ca 0.30 0.00 -0.34 0.00 0.42 0.00 0.00 57.03 57.41 2hr9 h ASP 154 Cb -0.10 0.00 -0.09 0.00 1.72 0.00 0.00 39.33 40.86 2hr9 h ASP 154 CO -0.07 0.00 -0.36 0.61 -2.88 0.00 0.00 179.24 176.55 2hr9 n GLY 155 N 0.73 0.94 0.05 -0.78 0.00 -0.25 -4.84 105.19 101.03 2hr9 n GLY 155 Ca 0.04 -0.21 -0.07 0.00 0.00 0.00 0.00 46.02 45.79 2hr9 n GLY 155 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2hr9 n VAL 156 N -3.07 0.59 -3.30 1.61 0.31 -1.26 -4.91 118.33 108.30 2hr9 n VAL 156 Ca -0.18 -0.25 -0.45 0.00 -0.01 0.00 0.00 64.34 63.46 2hr9 n VAL 156 Cb 0.59 -0.85 -0.06 0.00 -0.91 0.00 0.00 33.84 32.60 2hr9 n VAL 156 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2hr9 s THR 157 N -2.21 5.13 -0.03 2.52 2.01 -1.26 -3.98 115.64 117.82 2hr9 s THR 157 Ca -0.12 -1.11 -0.30 0.00 0.31 0.00 0.00 61.69 60.46 2hr9 s THR 157 Cb 0.03 -4.26 -0.03 0.00 0.01 0.00 0.00 72.50 68.25 2hr9 s THR 157 CO 0.25 -0.77 1.08 -2.16 -0.69 0.00 0.00 174.62 172.34 2hr9 s PRO 158 N 1.89 4.45 -0.06 4.92 0.04 -1.26 -2.69 135.00 142.28 2hr9 s PRO 158 Ca 0.06 1.53 0.04 0.00 0.04 0.00 0.00 61.00 62.67 2hr9 s PRO 158 Cb -0.25 -3.49 -0.00 0.00 0.04 0.00 0.00 34.50 30.80 2hr9 s PRO 158 CO 0.06 -0.26 -0.19 1.52 0.04 0.00 0.00 177.00 178.18 2hr9 s TYR 159 N 1.59 1.92 0.40 0.56 1.13 0.28 0.42 117.35 123.66 2hr9 s TYR 159 Ca 0.53 -0.64 0.08 0.00 -1.41 0.00 0.00 57.07 55.63 2hr9 s TYR 159 Cb -0.23 -1.30 0.01 0.00 -1.10 0.00 0.00 41.96 39.34 2hr9 s TYR 159 CO 0.24 -0.25 0.55 -1.64 -2.51 0.00 0.00 175.55 171.94 2hr9 s MET 160 N 0.20 2.89 -0.24 -3.49 -1.94 0.46 0.12 119.30 117.30 2hr9 s MET 160 Ca -0.09 -1.19 0.01 0.00 -1.71 0.00 0.00 55.69 52.71 2hr9 s MET 160 Cb -0.14 -2.77 0.06 0.00 2.01 0.00 0.00 34.83 33.99 2hr9 s MET 160 CO 0.04 -0.20 -0.08 0.42 -0.01 0.00 0.00 175.02 175.19 2hr9 s ILE 161 N -2.31 1.72 0.22 2.53 1.01 0.30 -1.43 121.20 123.23 2hr9 s ILE 161 Ca 0.53 -1.30 0.09 0.00 0.00 0.00 0.00 60.65 59.97 2hr9 s ILE 161 Cb -0.10 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 2hr9 s ILE 161 CO 0.33 -0.04 -0.07 -0.36 0.00 0.00 0.00 174.94 174.79 2hr9 s PHE 162 N 1.32 2.63 -0.25 3.97 0.40 -0.34 -2.63 117.98 123.08 2hr9 s PHE 162 Ca -0.06 -0.23 -0.11 0.00 -0.60 0.00 0.00 56.93 55.93 2hr9 s PHE 162 Cb -0.19 -1.23 -0.05 0.00 0.51 0.00 0.00 43.02 42.06 2hr9 s PHE 162 CO -0.06 0.57 0.20 -0.06 0.70 0.00 0.00 175.22 176.57 2hr9 s PHE 163 N -1.98 3.29 0.05 0.36 0.40 -1.26 0.95 117.98 119.80 2hr9 s PHE 163 Ca 0.27 0.25 -0.29 0.00 -0.60 0.00 0.00 56.93 56.56 2hr9 s PHE 163 Cb -0.08 -2.34 -0.17 0.00 0.51 0.00 0.00 43.02 40.94 2hr9 s PHE 163 CO 0.17 -0.01 1.50 -0.22 0.70 0.00 0.00 175.22 177.36 2hr9 h LYS 164 N 7.74 -0.62 -0.94 0.44 3.64 -1.75 -2.61 116.57 122.47 2hr9 h LYS 164 Ca -0.37 0.04 0.22 0.00 -1.27 0.00 0.00 60.65 59.28 2hr9 h LYS 164 Cb 1.17 0.14 -0.07 0.00 -0.41 0.00 0.00 32.23 33.06 2hr9 h LYS 164 CO 0.64 -0.36 0.62 -0.44 -2.27 0.00 0.00 179.45 177.64 2hr9 h ASP 165 N -0.76 0.39 -0.77 4.20 5.19 -1.83 0.35 116.42 123.19 2hr9 h ASP 165 Ca -0.07 0.05 -0.35 0.00 -0.62 0.00 0.00 57.03 56.05 2hr9 h ASP 165 Cb 0.55 -0.02 -0.21 0.00 0.18 0.00 0.00 39.33 39.83 2hr9 h ASP 165 CO 0.11 0.14 0.44 0.61 -3.12 0.00 0.00 179.24 177.41 2hr9 n GLY 166 N -1.52 3.83 3.14 2.75 0.00 -1.07 -4.88 105.19 107.44 2hr9 n GLY 166 Ca 0.21 -0.89 -0.12 0.00 0.00 0.00 0.00 46.02 45.21 2hr9 n GLY 166 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2hr9 s LEU 167 N -2.69 1.16 0.21 0.99 0.20 0.12 -1.58 118.68 117.10 2hr9 s LEU 167 Ca 0.48 0.25 0.09 0.00 0.69 0.00 0.00 54.13 55.63 2hr9 s LEU 167 Cb 0.39 0.86 -0.04 0.00 -0.43 0.00 0.00 46.19 46.97 2hr9 s LEU 167 CO 0.10 -0.21 -0.03 -1.61 -0.29 0.00 0.00 176.35 174.31 2hr9 s GLU 168 N -0.48 2.25 0.13 1.98 0.41 0.19 -4.78 118.70 118.40 2hr9 s GLU 168 Ca -0.06 -1.29 0.11 0.00 -0.41 0.00 0.00 54.97 53.32 2hr9 s GLU 168 Cb -0.04 -2.21 -0.04 0.00 -1.78 0.00 0.00 34.13 30.06 2hr9 s GLU 168 CO 0.01 0.41 -0.26 -1.64 -0.49 0.00 0.00 175.26 173.29 2hr9 s MET 169 N -3.22 1.37 -0.26 1.61 -1.94 -1.26 -1.69 119.30 113.92 2hr9 s MET 169 Ca 0.28 -1.33 -0.12 0.00 -1.71 0.00 0.00 55.69 52.81 2hr9 s MET 169 Cb -0.08 -1.85 0.09 0.00 2.01 0.00 0.00 34.83 35.01 2hr9 s MET 169 CO 0.18 0.44 0.60 -1.83 -0.01 0.00 0.00 175.02 174.40 2hr9 s GLU 170 N -2.04 0.58 -0.27 2.03 -1.05 -1.06 -4.93 118.70 111.95 2hr9 s GLU 170 Ca 0.13 1.22 -0.20 0.00 -0.15 0.00 0.00 54.97 55.98 2hr9 s GLU 170 Cb -0.10 0.38 -0.02 0.00 -0.44 0.00 0.00 34.13 33.95 2hr9 s GLU 170 CO 0.06 -0.18 0.59 0.15 0.95 0.00 0.00 175.26 176.83 2hr9 s LYS 171 N 2.13 4.04 -0.28 -4.83 -0.14 -1.26 0.07 119.74 119.48 2hr9 s LYS 171 Ca -0.08 0.41 -0.25 0.00 -1.36 0.00 0.00 55.97 54.69 2hr9 s LYS 171 Cb -0.09 -3.67 0.14 0.00 -1.68 0.00 0.00 37.83 32.54 2hr9 s LYS 171 CO -0.18 -0.43 1.15 0.00 -0.76 0.00 0.00 175.35 175.13 2hr9 n LEU 173 N 1.91 1.76 -0.19 0.00 4.32 -1.26 -4.83 117.00 118.70 2hr9 n LEU 173 Ca -0.11 0.18 0.15 0.00 -0.02 0.00 0.00 56.01 56.21 2hr9 n LEU 173 Cb 0.56 -0.44 0.78 0.00 -1.62 0.00 0.00 43.42 42.70 2hr9 n LEU 173 CO 0.03 0.67 1.01 -1.84 -1.22 0.00 0.00 177.39 176.05