#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 4.33 -0.23 1.12 2.07 -1.26 -1.78 121.20 125.45 2hr9 s ILE 2 Ca 0.00 -0.40 -0.06 0.00 -1.41 0.00 0.00 60.65 58.78 2hr9 s ILE 2 Cb 0.00 -2.88 -0.02 0.00 0.13 0.00 0.00 42.46 39.68 2hr9 s ILE 2 CO 0.00 0.48 0.03 -0.63 -1.91 0.00 0.00 174.94 172.92 2hr9 s ILE 3 N -1.01 4.05 -0.11 2.00 -1.09 0.11 -0.80 121.20 124.36 2hr9 s ILE 3 Ca 0.17 -0.26 -0.19 0.00 -2.23 0.00 0.00 60.65 58.14 2hr9 s ILE 3 Cb -0.11 -2.87 -0.04 0.00 -1.58 0.00 0.00 42.46 37.85 2hr9 s ILE 3 CO 0.07 0.38 0.50 -0.31 -1.23 0.00 0.00 174.94 174.35 2hr9 s TYR 4 N 1.45 3.53 0.01 3.97 1.51 0.39 -1.29 117.35 126.91 2hr9 s TYR 4 Ca 0.05 0.94 0.00 0.00 -1.01 0.00 0.00 57.07 57.06 2hr9 s TYR 4 Cb -0.15 -2.58 -0.01 0.00 -0.11 0.00 0.00 41.96 39.12 2hr9 s TYR 4 CO 0.02 0.17 -0.02 -0.98 -1.11 0.00 0.00 175.55 173.63 2hr9 s ARG 5 N 0.59 0.17 0.65 -0.62 1.70 0.30 -0.63 118.95 121.12 2hr9 s ARG 5 Ca 0.27 -0.24 -0.17 0.00 -0.47 0.00 0.00 55.73 55.13 2hr9 s ARG 5 Cb -0.15 -0.04 -0.06 0.00 -0.57 0.00 0.00 34.95 34.12 2hr9 s ARG 5 CO 0.11 0.00 0.56 -3.47 -1.08 0.00 0.00 175.30 171.42 2hr9 n ASP 6 N 2.56 -0.99 0.13 -2.89 2.03 -1.08 -0.03 116.55 116.28 2hr9 n ASP 6 Ca -0.16 0.67 0.01 0.00 0.52 0.00 0.00 54.79 55.83 2hr9 n ASP 6 Cb 0.58 -1.21 0.00 0.00 -0.72 0.00 0.00 41.12 39.78 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 0.07 -2.67 5.85 -1.39 0.45 115.31 117.59 2hr9 h LEU 7 Ca -0.46 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 57.93 2hr9 h LEU 7 Cb 1.37 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.37 2hr9 h LEU 7 CO 0.45 0.55 -1.83 -0.38 -0.34 0.00 0.00 178.44 176.89 2hr9 n ILE 8 N -3.21 1.68 -0.02 4.05 -0.00 -1.26 -4.48 119.36 116.11 2hr9 n ILE 8 Ca 0.01 -0.44 -0.10 0.00 -0.00 0.00 0.00 62.75 62.22 2hr9 n ILE 8 Cb 0.76 -1.82 -0.14 0.00 -0.00 0.00 0.00 39.64 38.44 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 -3.80 0.94 -1.59 4.38 2.88 -1.26 -4.98 113.62 110.20 2hr9 n SER 9 Ca -0.34 0.38 -0.14 0.00 -1.33 0.00 0.00 58.87 57.44 2hr9 n SER 9 Cb 0.92 -0.09 -0.01 0.00 -0.75 0.00 0.00 64.21 64.29 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 -3.07 -0.63 -3.99 0.66 8.25 0.15 -4.94 115.22 111.64 2hr9 n HIS 10 Ca -0.19 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 56.92 2hr9 n HIS 10 Cb 1.06 -2.99 -0.11 0.00 1.12 0.00 0.00 29.99 29.06 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 -2.39 5.41 -0.63 0.41 -1.08 -1.26 -4.77 116.67 112.36 2hr9 s ASP 11 Ca 0.00 -0.02 -0.26 0.00 -0.52 0.00 0.00 52.55 51.75 2hr9 s ASP 11 Cb 0.00 -1.93 -0.11 0.00 -1.46 0.00 0.00 42.92 39.42 2hr9 s ASP 11 CO 0.00 0.12 2.44 -1.84 0.52 0.00 0.00 175.17 176.41 2hr9 n GLU 12 N 3.92 0.79 0.10 4.34 0.00 -1.26 -2.64 120.64 125.89 2hr9 n GLU 12 Ca -0.16 -0.19 0.12 0.00 0.00 0.00 0.00 57.16 56.93 2hr9 n GLU 12 Cb 0.52 -3.22 0.27 0.00 0.00 0.00 0.00 31.44 29.01 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 17.09 0.00 -1.12 3.44 2.86 -1.23 -3.48 114.93 132.49 2hr9 h MET 13 Ca -0.16 0.00 0.33 0.00 -2.06 0.00 0.00 59.70 57.81 2hr9 h MET 13 Cb 1.21 0.00 -0.20 0.00 0.06 0.00 0.00 31.60 32.68 2hr9 h MET 13 CO 1.17 0.00 0.95 -0.59 1.06 0.00 0.00 176.91 179.50 2hr9 s PHE 14 N -3.15 -0.03 0.00 -0.22 -0.71 -1.00 -4.95 117.98 107.92 2hr9 s PHE 14 Ca 0.08 0.01 0.00 0.00 -1.04 0.00 0.00 56.93 55.99 2hr9 s PHE 14 Cb 0.12 0.50 0.00 0.00 -1.21 0.00 0.00 43.02 42.43 2hr9 s PHE 14 CO 0.66 -0.05 0.00 0.43 -1.34 0.00 0.00 175.22 174.92 2hr9 n SER 15 N -0.09 1.36 -1.85 1.98 7.64 -1.26 0.15 113.62 121.55 2hr9 n SER 15 Ca 0.03 -0.98 -0.17 0.00 1.01 0.00 0.00 58.87 58.76 2hr9 n SER 15 Cb 0.58 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 63.90 2hr9 n SER 15 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2hr9 n ASP 16 N -1.61 3.61 0.00 6.43 2.03 0.02 -4.05 116.55 122.99 2hr9 n ASP 16 Ca 0.00 -3.12 0.12 0.00 0.52 0.00 0.00 54.79 52.31 2hr9 n ASP 16 Cb 0.00 -0.74 0.15 0.00 -0.72 0.00 0.00 41.12 39.81 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 -0.63 0.02 -3.28 5.18 -5.35 -1.26 -4.87 119.36 109.18 2hr9 n ILE 17 Ca 0.41 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.87 2hr9 n ILE 17 Cb 1.30 0.39 0.00 0.00 -1.74 0.00 0.00 39.64 39.59 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 -1.56 -0.89 -3.24 4.28 4.01 -1.26 -5.06 117.16 113.45 2hr9 n TYR 18 Ca 0.05 0.00 -0.46 0.00 -0.16 0.00 0.00 57.90 57.33 2hr9 n TYR 18 Cb 0.35 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.36 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 -0.85 3.75 -0.01 -0.72 1.02 -1.14 -4.96 119.74 116.83 2hr9 s LYS 19 Ca 0.00 -2.49 -0.21 0.00 0.02 0.00 0.00 55.97 53.28 2hr9 s LYS 19 Cb 0.00 -4.58 -0.05 0.00 -0.52 0.00 0.00 37.83 32.68 2hr9 s LYS 19 CO 0.00 -1.40 0.63 0.42 -0.92 0.00 0.00 175.35 174.09 2hr9 s ILE 20 N 0.42 4.91 0.11 2.17 1.09 -1.26 -1.56 121.20 127.08 2hr9 s ILE 20 Ca 0.24 1.32 0.07 0.00 -1.10 0.00 0.00 60.65 61.18 2hr9 s ILE 20 Cb -0.09 -3.97 -0.04 0.00 -1.06 0.00 0.00 42.46 37.31 2hr9 s ILE 20 CO -0.08 0.39 -0.16 -0.13 -0.10 0.00 0.00 174.94 174.85 2hr9 s ARG 21 N -0.02 1.03 -0.26 2.79 0.52 0.13 -4.94 118.95 118.21 2hr9 s ARG 21 Ca 0.33 -1.18 -0.13 0.00 -0.52 0.00 0.00 55.73 54.23 2hr9 s ARG 21 Cb -0.18 -1.04 -0.04 0.00 0.52 0.00 0.00 34.95 34.20 2hr9 s ARG 21 CO 0.18 0.22 0.28 -1.21 0.02 0.00 0.00 175.30 174.78 2hr9 s GLU 22 N -2.32 4.03 0.36 3.54 8.01 -1.26 0.11 118.70 131.18 2hr9 s GLU 22 Ca 0.07 -0.11 0.09 0.00 0.01 0.00 0.00 54.97 55.03 2hr9 s GLU 22 Cb -0.07 -3.61 -0.07 0.00 -4.31 0.00 0.00 34.13 26.07 2hr9 s GLU 22 CO 0.04 -0.14 -0.04 0.96 0.01 0.00 0.00 175.26 176.09 2hr9 s ILE 23 N 1.64 2.25 -1.58 -1.63 -4.36 0.19 -4.68 121.20 113.04 2hr9 s ILE 23 Ca 0.12 -2.10 -0.00 0.00 -0.26 0.00 0.00 60.65 58.40 2hr9 s ILE 23 Cb -0.15 -2.77 0.00 0.00 1.25 0.00 0.00 42.46 40.79 2hr9 s ILE 23 CO 0.09 -0.15 0.04 0.00 0.24 0.00 0.00 174.94 175.15 2hr9 n ALA 24 N -0.88 -0.68 -3.41 2.27 0.00 -1.26 -1.57 120.51 114.98 2hr9 n ALA 24 Ca -0.05 0.16 -0.20 0.00 0.00 0.00 0.00 53.44 53.35 2hr9 n ALA 24 Cb 0.64 -2.11 0.07 0.00 0.00 0.00 0.00 19.45 18.05 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 -1.99 -5.42 0.00 0.00 8.00 -1.26 -2.30 116.55 113.57 2hr9 n ASP 25 Ca -0.21 -0.46 0.00 0.00 0.71 0.00 0.00 54.79 54.83 2hr9 n ASP 25 Cb 0.66 -4.32 0.00 0.00 -0.02 0.00 0.00 41.12 37.44 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 -1.73 2.51 0.37 0.44 0.00 -0.61 -4.90 105.19 101.28 2hr9 n GLY 26 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.15 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 0.40 -7.92 0.99 7.12 -1.12 -3.40 115.31 111.38 2hr9 h LEU 27 Ca 0.00 0.02 -0.09 0.00 0.13 0.00 0.00 57.88 57.93 2hr9 h LEU 27 Cb 0.00 -0.06 -0.14 0.00 -0.53 0.00 0.00 40.66 39.93 2hr9 h LEU 27 CO 0.00 0.22 -0.39 0.00 -0.13 0.00 0.00 178.44 178.13 2hr9 s LEU 29 N -2.89 1.75 -0.27 0.00 1.02 0.30 0.57 118.68 119.15 2hr9 s LEU 29 Ca 0.08 -0.36 -0.16 0.00 0.02 0.00 0.00 54.13 53.70 2hr9 s LEU 29 Cb 0.05 -0.97 -0.03 0.00 0.02 0.00 0.00 46.19 45.26 2hr9 s LEU 29 CO -0.08 0.06 0.44 -1.61 0.02 0.00 0.00 176.35 175.18 2hr9 s GLU 30 N 0.61 4.04 -0.37 1.70 2.02 0.31 -0.10 118.70 126.91 2hr9 s GLU 30 Ca -0.15 0.17 -0.12 0.00 0.02 0.00 0.00 54.97 54.89 2hr9 s GLU 30 Cb -0.16 -3.66 0.01 0.00 0.10 0.00 0.00 34.13 30.42 2hr9 s GLU 30 CO 0.05 -0.32 0.23 0.08 0.02 0.00 0.00 175.26 175.32 2hr9 s VAL 31 N 2.19 4.94 -0.33 2.63 1.01 0.21 0.21 120.40 131.26 2hr9 s VAL 31 Ca 0.18 -0.59 -0.19 0.00 0.00 0.00 0.00 61.98 61.38 2hr9 s VAL 31 Cb -0.16 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.55 2hr9 s VAL 31 CO 0.10 -0.16 0.59 -1.61 0.00 0.00 0.00 175.10 174.02 2hr9 s GLU 32 N 1.64 3.77 0.00 2.72 2.02 -0.60 0.06 118.70 128.31 2hr9 s GLU 32 Ca 0.04 0.10 0.00 0.00 0.02 0.00 0.00 54.97 55.13 2hr9 s GLU 32 Cb -0.18 -3.77 0.00 0.00 0.10 0.00 0.00 34.13 30.28 2hr9 s GLU 32 CO 0.08 -0.62 0.00 0.41 0.02 0.00 0.00 175.26 175.15 2hr9 n GLY 33 N 4.60 0.59 3.39 -1.39 0.00 0.06 -2.89 105.19 109.55 2hr9 n GLY 33 Ca -0.02 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.02 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 2.75 0.17 -0.04 1.61 -2.85 -1.26 -4.72 119.74 115.40 2hr9 s LYS 34 Ca 0.00 0.39 -0.30 0.00 -1.00 0.00 0.00 55.97 55.06 2hr9 s LYS 34 Cb 0.00 0.19 -0.05 0.00 -2.06 0.00 0.00 37.83 35.91 2hr9 s LYS 34 CO 0.00 -0.05 1.43 -1.64 0.10 0.00 0.00 175.35 175.18 2hr9 s MET 35 N 1.96 4.26 -0.13 1.78 -1.94 -1.26 -0.69 119.30 123.28 2hr9 s MET 35 Ca -0.03 1.96 0.02 0.00 -1.71 0.00 0.00 55.69 55.92 2hr9 s MET 35 Cb -0.03 -3.68 -0.00 0.00 2.01 0.00 0.00 34.83 33.12 2hr9 s MET 35 CO -0.16 -0.65 -0.19 0.14 -0.01 0.00 0.00 175.02 174.16 2hr9 s VAL 36 N 2.89 2.41 0.34 -6.03 -7.23 0.14 -4.90 120.40 108.02 2hr9 s VAL 36 Ca 0.64 -0.88 0.04 0.00 -1.81 0.00 0.00 61.98 59.97 2hr9 s VAL 36 Cb -0.30 -1.98 -0.02 0.00 0.56 0.00 0.00 36.38 34.65 2hr9 s VAL 36 CO 0.25 0.54 0.50 -0.94 -0.31 0.00 0.00 175.10 175.14 2hr9 s SER 37 N 0.57 6.06 -0.11 4.85 1.04 -1.26 -2.00 113.70 122.85 2hr9 s SER 37 Ca -0.11 0.08 -0.03 0.00 0.48 0.00 0.00 55.95 56.36 2hr9 s SER 37 Cb -0.16 -1.56 0.05 0.00 0.10 0.00 0.00 66.02 64.45 2hr9 s SER 37 CO 0.04 -0.40 0.12 -0.60 0.98 0.00 0.00 173.24 173.38 2hr9 s ARG 38 N -4.24 0.02 0.00 4.02 3.52 0.39 -4.92 118.95 117.74 2hr9 s ARG 38 Ca 0.43 0.28 0.23 0.00 -0.13 0.00 0.00 55.73 56.54 2hr9 s ARG 38 Cb -0.10 -0.89 0.38 0.00 -1.56 0.00 0.00 34.95 32.78 2hr9 s ARG 38 CO 0.33 -0.46 1.15 2.41 -0.81 0.00 0.00 175.30 177.92 2hr9 n THR 39 N 5.30 0.00 0.08 4.11 -1.04 -1.26 -1.71 114.28 119.76 2hr9 n THR 39 Ca -0.05 -0.88 0.00 0.00 -2.04 0.00 0.00 64.05 61.08 2hr9 n THR 39 Cb 0.50 0.94 0.00 0.00 -1.82 0.00 0.00 70.33 69.94 2hr9 n THR 39 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2hr9 n GLU 40 N 0.44 0.00 0.00 -2.82 4.07 -1.26 -5.06 120.64 116.01 2hr9 n GLU 40 Ca 0.04 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 2hr9 n GLU 40 Cb 1.09 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 32.47 2hr9 n GLU 40 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2hr9 n GLY 41 N -0.59 1.15 0.00 8.31 0.00 -1.26 -4.89 105.19 107.91 2hr9 n GLY 41 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 0.00 0.00 -2.22 1.61 5.03 -1.26 -5.07 115.26 113.35 2hr9 n ASN 42 Ca 0.00 0.00 -0.00 0.00 0.87 0.00 0.00 54.58 55.45 2hr9 n ASN 42 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 2hr9 n ASN 42 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 2hr9 n ILE 43 N -0.54 -5.22 0.00 2.41 5.41 -1.26 -4.92 119.36 115.24 2hr9 n ILE 43 Ca 0.00 -0.13 0.00 0.00 1.00 0.00 0.00 62.75 63.62 2hr9 n ILE 43 Cb 0.00 -5.07 0.00 0.00 -0.71 0.00 0.00 39.64 33.86 2hr9 n ILE 43 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 2hr9 n ASP 44 N -1.38 0.00 -2.59 4.38 9.92 -1.26 -5.10 116.55 120.52 2hr9 n ASP 44 Ca -0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 54.79 54.24 2hr9 n ASP 44 Cb 0.50 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.98 2hr9 n ASP 44 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2hr9 n ASP 45 N -0.58 -7.24 -0.06 -2.24 8.00 -1.26 -5.03 116.55 108.14 2hr9 n ASP 45 Ca 0.00 1.01 -0.06 0.00 0.71 0.00 0.00 54.79 56.44 2hr9 n ASP 45 Cb 0.00 -4.80 -0.02 0.00 -0.02 0.00 0.00 41.12 36.28 2hr9 n ASP 45 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2hr9 n SER 46 N 0.32 1.44 -0.03 -2.24 2.88 -1.26 -4.94 113.62 109.79 2hr9 n SER 46 Ca 0.03 0.31 -0.05 0.00 -1.33 0.00 0.00 58.87 57.83 2hr9 n SER 46 Cb 0.13 -0.70 -0.02 0.00 -0.75 0.00 0.00 64.21 62.87 2hr9 n SER 46 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2hr9 n LEU 47 N -3.99 1.36 0.00 2.46 4.77 -1.26 -4.98 117.00 115.36 2hr9 n LEU 47 Ca -0.09 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 2hr9 n LEU 47 Cb 0.35 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 2hr9 n LEU 47 CO 0.14 -0.45 0.00 -0.38 -1.33 0.00 0.00 177.39 175.37 2hr9 n ILE 48 N -3.84 0.00 0.00 -0.08 2.08 -1.26 -4.82 119.36 111.44 2hr9 n ILE 48 Ca -0.07 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.24 2hr9 n ILE 48 Cb 0.28 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.17 2hr9 n ILE 48 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2hr9 n GLY 49 N 0.00 0.71 0.00 7.39 0.00 -1.26 -5.07 105.19 106.96 2hr9 n GLY 49 Ca 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.58 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 1.33 -2.23 2.62 -0.02 0.00 -1.26 -5.05 105.19 100.58 2hr9 n GLY 50 Ca 0.00 -1.40 -0.29 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.52 3.73 -0.13 1.61 -0.87 -1.26 -4.97 114.94 111.54 2hr9 s ASN 51 Ca 0.00 -1.45 0.18 0.00 -1.57 0.00 0.00 52.86 50.02 2hr9 s ASN 51 Cb 0.00 -0.56 0.44 0.00 -0.02 0.00 0.00 41.25 41.10 2hr9 s ASN 51 CO 0.00 -0.43 1.19 0.00 -2.57 0.00 0.00 177.10 175.29 2hr9 n ALA 52 N 5.06 3.10 -0.12 0.60 0.00 -1.26 -4.81 120.51 123.08 2hr9 n ALA 52 Ca -0.04 -2.87 -0.25 0.00 0.00 0.00 0.00 53.44 50.28 2hr9 n ALA 52 Cb 0.42 -0.57 -0.09 0.00 0.00 0.00 0.00 19.45 19.21 2hr9 n ALA 52 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2hr9 n SER 53 N -0.32 1.85 -1.45 0.00 3.41 -1.26 -5.12 113.62 110.72 2hr9 n SER 53 Ca 0.14 0.21 0.13 0.00 -0.26 0.00 0.00 58.87 59.10 2hr9 n SER 53 Cb 0.93 -0.66 -0.07 0.00 -0.26 0.00 0.00 64.21 64.15 2hr9 n SER 53 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hr9 n ALA 54 N -3.92 -3.30 -3.64 7.33 0.00 -1.26 -5.07 120.51 110.65 2hr9 n ALA 54 Ca -0.48 0.82 -0.04 0.00 0.00 0.00 0.00 53.44 53.74 2hr9 n ALA 54 Cb 0.87 -1.54 -0.06 0.00 0.00 0.00 0.00 19.45 18.72 2hr9 n ALA 54 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2hr9 s GLU 55 N -4.58 0.17 0.00 0.00 2.12 -1.26 -5.11 118.70 110.04 2hr9 s GLU 55 Ca 0.00 0.16 0.00 0.00 0.36 0.00 0.00 54.97 55.49 2hr9 s GLU 55 Cb 0.00 0.08 0.00 0.00 0.26 0.00 0.00 34.13 34.47 2hr9 s GLU 55 CO 0.00 -0.03 0.11 0.41 -0.54 0.00 0.00 175.26 175.21 2hr9 n GLY 56 N 1.47 0.51 3.11 -1.50 0.00 -1.26 -4.36 105.19 103.17 2hr9 n GLY 56 Ca -0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 2hr9 n GLY 56 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2hr9 n PRO 57 N -0.82 0.95 -0.97 1.61 -0.02 -1.26 -3.61 135.00 130.89 2hr9 n PRO 57 Ca 0.00 -1.34 -0.06 0.00 -2.02 0.00 0.00 63.50 60.08 2hr9 n PRO 57 Cb 0.00 -2.58 -0.06 0.00 -0.02 0.00 0.00 33.50 30.84 2hr9 n PRO 57 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2hr9 n GLU 58 N 6.51 0.02 -2.11 -0.52 -0.58 -1.26 -5.01 120.64 117.70 2hr9 n GLU 58 Ca 0.41 -0.89 -0.38 0.00 -0.42 0.00 0.00 57.16 55.88 2hr9 n GLU 58 Cb 0.30 0.50 0.01 0.00 -0.57 0.00 0.00 31.44 31.68 2hr9 n GLU 58 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2hr9 n GLY 59 N -0.02 5.48 0.34 0.62 0.00 -1.24 -4.69 105.19 105.67 2hr9 n GLY 59 Ca -0.25 -2.33 -0.01 0.00 0.00 0.00 0.00 46.02 43.43 2hr9 n GLY 59 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2hr9 h GLU 60 N 3.74 0.99 0.00 1.61 4.81 -1.94 -3.48 114.58 120.31 2hr9 h GLU 60 Ca 0.56 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.67 2hr9 h GLU 60 Cb 0.30 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.49 2hr9 h GLU 60 CO 1.26 0.74 0.00 0.41 -0.73 0.00 0.00 179.01 180.69 2hr9 n GLY 61 N -1.18 -0.39 1.47 1.92 0.00 -1.26 -5.06 105.19 100.69 2hr9 n GLY 61 Ca 0.07 -1.11 0.14 0.00 0.00 0.00 0.00 46.02 45.12 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 0.00 -1.38 -0.01 2.61 -1.04 -1.26 -4.96 114.28 108.24 2hr9 n THR 62 Ca 0.00 1.07 -0.01 0.00 -2.04 0.00 0.00 64.05 63.07 2hr9 n THR 62 Cb 0.00 -1.66 -0.00 0.00 -1.82 0.00 0.00 70.33 66.85 2hr9 n THR 62 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2hr9 n GLU 63 N -3.98 0.08 -1.56 -2.82 1.02 -1.26 -4.83 120.64 107.28 2hr9 n GLU 63 Ca -0.08 0.03 -0.13 0.00 -0.02 0.00 0.00 57.16 56.96 2hr9 n GLU 63 Cb 0.65 -0.56 -0.08 0.00 -0.02 0.00 0.00 31.44 31.43 2hr9 n GLU 63 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2hr9 n SER 64 N -2.82 1.69 -4.88 1.62 7.64 -1.26 -4.90 113.62 110.71 2hr9 n SER 64 Ca -0.02 -1.67 -0.29 0.00 1.01 0.00 0.00 58.87 57.91 2hr9 n SER 64 Cb 0.08 -1.67 -0.04 0.00 -1.01 0.00 0.00 64.21 61.56 2hr9 n SER 64 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2hr9 s THR 65 N 15.23 5.05 0.03 0.44 2.01 -1.26 -5.12 115.64 132.02 2hr9 s THR 65 Ca 0.91 -0.67 0.07 0.00 0.31 0.00 0.00 61.69 62.32 2hr9 s THR 65 Cb -0.12 -3.52 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 2hr9 s THR 65 CO 0.10 0.03 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.16 2hr9 s VAL 66 N -1.59 1.67 -0.03 3.82 1.01 -1.26 -4.66 120.40 119.36 2hr9 s VAL 66 Ca 0.33 -1.13 -0.00 0.00 0.00 0.00 0.00 61.98 61.18 2hr9 s VAL 66 Cb -0.12 -1.44 0.03 0.00 0.00 0.00 0.00 36.38 34.85 2hr9 s VAL 66 CO 0.26 0.27 0.01 0.27 0.00 0.00 0.00 175.10 175.91 2hr9 s ILE 67 N -0.73 0.16 -0.03 2.22 -0.00 -0.69 -4.95 121.20 117.17 2hr9 s ILE 67 Ca 0.08 0.13 -0.01 0.00 -0.00 0.00 0.00 60.65 60.85 2hr9 s ILE 67 Cb -0.09 -0.28 0.03 0.00 -0.00 0.00 0.00 42.46 42.13 2hr9 s ILE 67 CO 0.01 0.16 0.04 -0.89 -0.00 0.00 0.00 174.94 174.25 2hr9 s THR 68 N 1.23 -0.02 0.25 8.37 2.01 -1.26 0.15 115.64 126.36 2hr9 s THR 68 Ca -0.07 0.27 -0.12 0.00 0.31 0.00 0.00 61.69 62.09 2hr9 s THR 68 Cb -0.13 -0.16 0.04 0.00 0.01 0.00 0.00 72.50 72.26 2hr9 s THR 68 CO -0.02 0.14 0.60 0.61 -0.69 0.00 0.00 174.62 175.26 2hr9 n GLY 69 N 4.65 1.17 3.77 4.40 0.00 -0.85 -4.94 105.19 113.39 2hr9 n GLY 69 Ca -0.17 -1.16 -0.38 0.00 0.00 0.00 0.00 46.02 44.31 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 -2.33 3.06 -0.02 1.61 1.01 -1.26 0.24 120.40 122.71 2hr9 s VAL 70 Ca 0.12 0.85 -0.21 0.00 0.00 0.00 0.00 61.98 62.75 2hr9 s VAL 70 Cb -0.03 -3.46 -0.13 0.00 0.00 0.00 0.00 36.38 32.75 2hr9 s VAL 70 CO 0.07 0.05 0.92 -0.78 0.00 0.00 0.00 175.10 175.36 2hr9 h ASP 71 N 2.37 -0.40 -0.78 3.32 3.58 -1.27 -2.41 116.42 120.84 2hr9 h ASP 71 Ca -0.49 -0.14 0.17 0.00 0.42 0.00 0.00 57.03 56.99 2hr9 h ASP 71 Cb 1.24 0.10 -0.05 0.00 1.72 0.00 0.00 39.33 42.35 2hr9 h ASP 71 CO 0.61 0.04 0.53 0.16 -2.88 0.00 0.00 179.24 177.70 2hr9 h ILE 72 N -0.98 0.74 -0.10 2.25 3.07 -1.94 0.15 117.51 120.70 2hr9 h ILE 72 Ca -0.05 -0.12 -0.17 0.00 1.55 0.00 0.00 64.86 66.08 2hr9 h ILE 72 Cb 0.51 0.36 -0.01 0.00 -0.27 0.00 0.00 36.82 37.42 2hr9 h ILE 72 CO 0.08 0.06 -0.64 0.58 -1.05 0.00 0.00 178.15 177.18 2hr9 h VAL 73 N 0.35 1.37 0.11 0.16 2.07 -1.94 -0.55 116.25 117.81 2hr9 h VAL 73 Ca 0.39 -2.00 -0.28 0.00 0.82 0.00 0.00 66.70 65.63 2hr9 h VAL 73 Cb 1.01 1.99 0.02 0.00 -1.52 0.00 0.00 31.29 32.78 2hr9 h VAL 73 CO -0.12 0.60 -1.19 0.24 0.02 0.00 0.00 177.57 177.12 2hr9 h MET 74 N 0.28 0.45 0.04 1.57 2.86 -0.34 -0.01 114.93 119.78 2hr9 h MET 74 Ca -0.01 -0.62 -0.25 0.00 -2.06 0.00 0.00 59.70 56.76 2hr9 h MET 74 Cb 1.18 0.21 -0.02 0.00 0.06 0.00 0.00 31.60 33.03 2hr9 h MET 74 CO 0.11 1.26 -1.22 -2.95 1.06 0.00 0.00 176.91 175.18 2hr9 h ASN 75 N 0.19 0.12 0.07 1.22 7.08 -0.86 -3.28 115.58 120.12 2hr9 h ASN 75 Ca -0.15 -0.15 0.00 0.00 -3.08 0.00 0.00 56.30 52.92 2hr9 h ASN 75 Cb 1.87 -0.04 0.00 0.00 -2.08 0.00 0.00 38.32 38.07 2hr9 h ASN 75 CO 0.21 1.12 -0.18 1.41 -2.08 0.00 0.00 177.43 177.91 2hr9 n HIS 76 N -3.35 0.00 -3.14 4.14 8.25 -0.22 -4.95 115.22 115.96 2hr9 n HIS 76 Ca -0.06 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.18 2hr9 n HIS 76 Cb 0.98 -0.04 0.05 0.00 1.12 0.00 0.00 29.99 32.10 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 0.03 -2.13 -1.08 4.41 8.25 -0.75 -4.21 115.22 119.73 2hr9 n HIS 77 Ca 0.14 0.64 -0.34 0.00 -0.26 0.00 0.00 57.72 57.90 2hr9 n HIS 77 Cb 0.41 -4.50 0.12 0.00 1.12 0.00 0.00 29.99 27.14 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 -4.13 3.25 -3.98 2.41 4.77 -0.09 -3.66 117.00 115.56 2hr9 n LEU 78 Ca -0.08 0.55 -0.20 0.00 -0.03 0.00 0.00 56.01 56.26 2hr9 n LEU 78 Cb 0.60 -1.42 -0.16 0.00 -2.33 0.00 0.00 43.42 40.11 2hr9 n LEU 78 CO 0.50 -2.17 -0.43 -1.10 -1.33 0.00 0.00 177.39 172.85 2hr9 s GLN 79 N -3.85 0.92 -0.25 3.23 -1.52 0.24 -4.91 119.66 113.51 2hr9 s GLN 79 Ca 0.70 -0.27 -0.10 0.00 -1.95 0.00 0.00 55.36 53.74 2hr9 s GLN 79 Cb -0.29 -0.86 -0.05 0.00 -0.22 0.00 0.00 33.01 31.59 2hr9 s GLN 79 CO 0.54 0.09 0.15 -2.00 -0.25 0.00 0.00 175.29 173.82 2hr9 s GLU 80 N 0.27 3.95 0.16 2.91 2.12 -1.26 0.90 118.70 127.75 2hr9 s GLU 80 Ca -0.04 -0.33 0.09 0.00 0.36 0.00 0.00 54.97 55.05 2hr9 s GLU 80 Cb -0.09 -3.53 -0.04 0.00 0.26 0.00 0.00 34.13 30.72 2hr9 s GLU 80 CO 0.00 -0.06 -0.12 -0.08 -0.54 0.00 0.00 175.26 174.46 2hr9 s THR 81 N 1.39 3.07 0.48 -1.70 -1.32 -0.85 -5.01 115.64 111.71 2hr9 s THR 81 Ca 0.07 -1.63 -0.04 0.00 -1.21 0.00 0.00 61.69 58.88 2hr9 s THR 81 Cb -0.15 -2.49 -0.02 0.00 -1.51 0.00 0.00 72.50 68.33 2hr9 s THR 81 CO 0.07 -0.05 0.77 -0.94 -2.21 0.00 0.00 174.62 172.25 2hr9 s SER 82 N -2.64 6.08 -0.02 8.08 1.04 -1.26 -4.34 113.70 120.63 2hr9 s SER 82 Ca 0.23 0.75 -0.28 0.00 0.48 0.00 0.00 55.95 57.13 2hr9 s SER 82 Cb -0.09 -2.03 0.10 0.00 0.10 0.00 0.00 66.02 64.10 2hr9 s SER 82 CO 0.14 -0.66 0.83 0.12 0.98 0.00 0.00 173.24 174.65 2hr9 s PHE 83 N -2.72 -0.43 0.50 5.02 5.36 -1.26 -5.10 117.98 119.35 2hr9 s PHE 83 Ca 0.48 0.47 0.08 0.00 -0.96 0.00 0.00 56.93 57.00 2hr9 s PHE 83 Cb -0.10 0.50 0.05 0.00 -0.34 0.00 0.00 43.02 43.13 2hr9 s PHE 83 CO 0.43 -0.56 0.69 0.95 -1.46 0.00 0.00 175.22 175.27 2hr9 s THR 84 N -2.47 2.59 -0.03 0.12 -4.23 -1.26 -4.98 115.64 105.37 2hr9 s THR 84 Ca 0.00 -0.98 -0.24 0.00 -1.18 0.00 0.00 61.69 59.29 2hr9 s THR 84 Cb -0.01 -2.60 -0.18 0.00 1.34 0.00 0.00 72.50 71.05 2hr9 s THR 84 CO -0.04 0.00 1.13 0.11 -0.54 0.00 0.00 174.62 175.27 2hr9 h LYS 85 N 0.39 -0.15 -0.53 3.99 6.56 -2.00 -2.04 116.57 122.79 2hr9 h LYS 85 Ca -0.35 0.01 -0.04 0.00 -1.06 0.00 0.00 60.65 59.21 2hr9 h LYS 85 Cb 1.28 0.03 -0.02 0.00 -0.57 0.00 0.00 32.23 32.96 2hr9 h LYS 85 CO 0.43 0.29 0.17 1.49 -2.06 0.00 0.00 179.45 179.77 2hr9 h GLU 86 N -0.67 0.82 -0.75 3.15 4.22 -2.01 -2.86 114.58 116.48 2hr9 h GLU 86 Ca -0.02 -0.18 0.02 0.00 0.08 0.00 0.00 59.36 59.27 2hr9 h GLU 86 Cb 0.51 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 2hr9 h GLU 86 CO 0.03 0.76 0.48 0.00 -2.18 0.00 0.00 179.01 178.10 2hr9 h ALA 87 N 1.03 0.97 -0.54 2.92 0.00 -1.97 -1.82 119.26 119.85 2hr9 h ALA 87 Ca 0.17 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.07 2hr9 h ALA 87 Cb 0.27 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2hr9 h ALA 87 CO -0.01 0.31 0.36 -0.92 0.00 0.00 0.00 179.25 178.99 2hr9 h TYR 88 N 0.96 0.62 -0.40 0.00 3.20 -1.15 0.41 116.97 120.61 2hr9 h TYR 88 Ca 0.29 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.19 2hr9 h TYR 88 Cb -0.03 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 2hr9 h TYR 88 CO -0.03 0.37 0.25 0.87 -1.64 0.00 0.00 178.16 177.98 2hr9 h LYS 89 N 0.65 0.50 0.00 1.82 1.57 -1.12 0.44 116.57 120.42 2hr9 h LYS 89 Ca 0.21 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.82 2hr9 h LYS 89 Cb 0.06 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 2hr9 h LYS 89 CO -0.05 0.33 -0.67 -0.22 -0.57 0.00 0.00 179.45 178.27 2hr9 h LYS 90 N 0.51 0.00 -0.31 3.15 3.64 -1.25 -3.07 116.57 119.24 2hr9 h LYS 90 Ca 0.15 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.46 2hr9 h LYS 90 Cb -0.03 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 2hr9 h LYS 90 CO -0.05 0.67 -0.10 -0.92 -2.27 0.00 0.00 179.45 176.78 2hr9 h TYR 91 N 0.00 0.69 -0.57 1.91 3.20 0.57 -1.90 116.97 120.87 2hr9 h TYR 91 Ca -0.01 -0.16 -0.04 0.00 3.14 0.00 0.00 58.73 61.67 2hr9 h TYR 91 Cb 1.37 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 2hr9 h TYR 91 CO 0.00 0.81 0.20 0.97 -1.64 0.00 0.00 178.16 178.49 2hr9 h ILE 92 N 0.37 1.23 -0.59 1.81 6.09 -0.18 0.27 117.51 126.52 2hr9 h ILE 92 Ca 0.07 -0.77 -0.05 0.00 -1.37 0.00 0.00 64.86 62.75 2hr9 h ILE 92 Cb 0.60 0.66 -0.03 0.00 0.47 0.00 0.00 36.82 38.52 2hr9 h ILE 92 CO 0.04 0.29 0.18 0.50 -3.07 0.00 0.00 178.15 176.08 2hr9 h LYS 93 N 0.80 0.89 0.06 2.19 3.64 -1.49 0.81 116.57 123.47 2hr9 h LYS 93 Ca 0.19 -0.17 -0.24 0.00 -1.27 0.00 0.00 60.65 59.15 2hr9 h LYS 93 Cb 0.25 -0.14 0.02 0.00 -0.41 0.00 0.00 32.23 31.96 2hr9 h LYS 93 CO -0.01 0.77 -0.99 0.22 -2.27 0.00 0.00 179.45 177.17 2hr9 h ASP 94 N 0.86 0.77 0.09 4.20 1.82 -1.00 -2.30 116.42 120.85 2hr9 h ASP 94 Ca 0.19 -0.80 -0.29 0.00 -0.39 0.00 0.00 57.03 55.75 2hr9 h ASP 94 Cb 0.26 -0.24 0.03 0.00 0.68 0.00 0.00 39.33 40.06 2hr9 h ASP 94 CO -0.01 1.48 -1.19 0.10 -1.61 0.00 0.00 179.24 178.01 2hr9 h TYR 95 N 0.15 1.03 -0.11 0.28 -0.00 -0.34 -2.89 116.97 115.10 2hr9 h TYR 95 Ca -0.14 -0.62 -0.09 0.00 0.00 0.00 0.00 58.73 57.88 2hr9 h TYR 95 Cb 1.69 -0.09 -0.01 0.00 0.00 0.00 0.00 36.73 38.31 2hr9 h TYR 95 CO 0.13 1.46 -0.33 0.00 -0.00 0.00 0.00 178.16 179.42 2hr9 h MET 96 N 0.30 0.22 -0.16 0.10 -0.00 0.53 -2.68 114.93 113.23 2hr9 h MET 96 Ca -0.17 -0.09 -0.13 0.00 -0.00 0.00 0.00 59.70 59.31 2hr9 h MET 96 Cb 1.86 -0.01 -0.01 0.00 -0.00 0.00 0.00 31.60 33.44 2hr9 h MET 96 CO 0.23 0.53 -0.48 1.57 -0.00 0.00 0.00 176.91 178.76 2hr9 h LYS 97 N 0.19 0.41 -0.93 -0.10 2.10 -1.44 0.25 116.57 117.05 2hr9 h LYS 97 Ca 0.02 -0.23 -0.01 0.00 -2.00 0.00 0.00 60.65 58.44 2hr9 h LYS 97 Cb 0.68 0.01 -0.04 0.00 -0.90 0.00 0.00 32.23 31.98 2hr9 h LYS 97 CO 0.05 0.80 0.55 0.77 -2.00 0.00 0.00 179.45 179.62 2hr9 h SER 98 N 0.33 1.12 0.19 7.07 0.02 -1.25 0.33 113.55 121.36 2hr9 h SER 98 Ca 0.02 -0.08 -0.26 0.00 -0.84 0.00 0.00 61.79 60.64 2hr9 h SER 98 Cb 0.96 -0.28 0.03 0.00 0.14 0.00 0.00 62.40 63.25 2hr9 h SER 98 CO 0.08 0.87 -1.12 0.40 -1.14 0.00 0.00 176.83 175.92 2hr9 h ILE 99 N 1.28 1.40 0.11 3.27 2.04 -1.37 -2.82 117.51 121.41 2hr9 h ILE 99 Ca 0.33 -2.60 0.02 0.00 1.00 0.00 0.00 64.86 63.61 2hr9 h ILE 99 Cb -0.04 3.10 -0.04 0.00 -0.74 0.00 0.00 36.82 39.11 2hr9 h ILE 99 CO -0.06 0.76 -0.30 0.50 0.00 0.00 0.00 178.15 179.04 2hr9 h LYS 100 N -0.11 -0.50 -0.50 2.37 3.11 -0.28 0.58 116.57 121.24 2hr9 h LYS 100 Ca -0.19 0.03 -0.00 0.00 -2.81 0.00 0.00 60.65 57.68 2hr9 h LYS 100 Cb 1.88 0.11 -0.02 0.00 -1.00 0.00 0.00 32.23 33.20 2hr9 h LYS 100 CO 0.21 -0.33 0.30 0.78 -2.81 0.00 0.00 179.45 177.60 2hr9 h GLY 101 N -0.52 0.72 1.01 5.01 0.00 -1.07 0.65 103.07 108.88 2hr9 h GLY 101 Ca 0.03 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 2hr9 h GLY 101 CO -0.19 0.29 0.46 1.70 0.00 0.00 0.00 176.54 178.81 2hr9 h LYS 102 N 0.67 1.12 -0.14 4.80 1.63 -1.19 -1.80 116.57 121.65 2hr9 h LYS 102 Ca 0.18 -0.12 -0.10 0.00 -0.85 0.00 0.00 60.65 59.76 2hr9 h LYS 102 Cb -0.01 -0.23 -0.01 0.00 -0.60 0.00 0.00 32.23 31.38 2hr9 h LYS 102 CO -0.03 0.81 -0.36 1.25 -3.45 0.00 0.00 179.45 177.67 2hr9 h LEU 103 N 1.12 0.29 -2.01 5.20 5.85 0.54 -2.46 115.31 123.84 2hr9 h LEU 103 Ca 0.29 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 2hr9 h LEU 103 Cb -0.00 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 40.95 2hr9 h LEU 103 CO -0.05 0.64 -0.01 -0.33 -0.34 0.00 0.00 178.44 178.35 2hr9 h GLU 104 N 0.25 0.00 0.00 1.25 5.08 0.00 1.51 114.58 122.66 2hr9 h GLU 104 Ca 0.03 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2hr9 h GLU 104 Cb 0.75 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.00 2hr9 h GLU 104 CO 0.06 0.01 -0.87 1.05 -1.00 0.00 0.00 179.01 178.26 2hr9 h GLU 105 N 0.00 0.00 0.00 2.33 4.11 -1.17 -3.31 114.58 116.54 2hr9 h GLU 105 Ca -0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.34 2hr9 h GLU 105 Cb 0.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 2hr9 h GLU 105 CO 0.00 0.05 -1.14 1.04 0.07 0.00 0.00 179.01 179.03 2hr9 n GLN 106 N -2.79 0.44 -3.20 1.06 6.02 -0.55 -4.89 117.38 113.48 2hr9 n GLN 106 Ca -0.00 0.18 -0.23 0.00 -0.01 0.00 0.00 57.00 56.94 2hr9 n GLN 106 Cb 0.59 -1.27 -0.06 0.00 1.02 0.00 0.00 30.24 30.52 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 -4.22 0.83 0.26 -1.09 1.74 0.50 -4.96 116.66 109.73 2hr9 n ARG 107 Ca -0.19 -3.31 0.15 0.00 -0.77 0.00 0.00 57.85 53.73 2hr9 n ARG 107 Cb 0.51 -1.34 0.67 0.00 -1.02 0.00 0.00 32.46 31.28 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 3.82 0.00 0.00 5.56 0.13 -1.18 0.21 132.00 140.53 2hr9 h PRO 108 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 2hr9 h PRO 108 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2hr9 h PRO 108 CO 0.48 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.40 2hr9 n GLU 109 N -3.01 0.00 0.00 0.86 0.28 -1.26 -2.16 120.64 115.35 2hr9 n GLU 109 Ca 0.01 0.28 0.05 0.00 -0.16 0.00 0.00 57.16 57.33 2hr9 n GLU 109 Cb 0.57 -1.50 0.01 0.00 1.43 0.00 0.00 31.44 31.96 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 -1.50 1.50 0.19 3.44 5.12 0.72 -4.54 116.66 121.58 2hr9 n ARG 110 Ca 0.03 -0.75 0.05 0.00 -1.93 0.00 0.00 57.85 55.25 2hr9 n ARG 110 Cb 0.15 -1.10 0.34 0.00 -1.16 0.00 0.00 32.46 30.69 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 1.32 0.97 0.31 1.55 -1.51 -1.50 -3.03 116.25 114.36 2hr9 h VAL 111 Ca 0.00 -1.51 -0.02 0.00 -1.23 0.00 0.00 66.70 63.94 2hr9 h VAL 111 Cb 0.34 1.90 0.00 0.00 -2.13 0.00 0.00 31.29 31.40 2hr9 h VAL 111 CO 0.00 0.38 -0.15 0.11 -1.23 0.00 0.00 177.57 176.68 2hr9 h LYS 112 N 0.00 -0.41 -0.84 5.19 1.79 -1.80 -2.03 116.57 118.48 2hr9 h LYS 112 Ca -0.00 0.03 0.08 0.00 -2.18 0.00 0.00 60.65 58.57 2hr9 h LYS 112 Cb 0.86 0.09 -0.06 0.00 -1.58 0.00 0.00 32.23 31.55 2hr9 h LYS 112 CO 0.05 -0.07 0.55 -1.35 -1.08 0.00 0.00 179.45 177.54 2hr9 h PRO 113 N -0.89 0.86 -0.45 3.15 0.11 -1.85 -1.58 132.00 131.34 2hr9 h PRO 113 Ca -0.04 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.92 2hr9 h PRO 113 Cb 0.52 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.42 2hr9 h PRO 113 CO 0.07 0.57 -0.12 0.35 -0.21 0.00 0.00 178.00 178.66 2hr9 h PHE 114 N 0.88 0.90 0.26 0.65 3.57 -1.56 0.41 116.94 122.04 2hr9 h PHE 114 Ca 0.37 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.71 2hr9 h PHE 114 Cb 0.30 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 2hr9 h PHE 114 CO -0.00 0.88 -0.26 0.52 -2.23 0.00 0.00 178.31 177.23 2hr9 h MET 115 N 0.74 -0.53 -0.10 1.11 2.86 -0.51 0.95 114.93 119.45 2hr9 h MET 115 Ca 0.12 0.04 -0.11 0.00 -2.06 0.00 0.00 59.70 57.68 2hr9 h MET 115 Cb 0.61 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.39 2hr9 h MET 115 CO 0.04 -0.35 -0.38 1.15 1.06 0.00 0.00 176.91 178.43 2hr9 h THR 116 N -0.55 1.39 -0.78 2.22 2.02 -1.49 -3.09 112.91 112.63 2hr9 h THR 116 Ca -0.01 -1.72 -0.01 0.00 0.77 0.00 0.00 66.41 65.44 2hr9 h THR 116 Cb 0.50 2.20 -0.04 0.00 -1.74 0.00 0.00 68.15 69.08 2hr9 h THR 116 CO -0.06 0.51 0.46 1.23 0.37 0.00 0.00 175.52 178.03 2hr9 h GLY 117 N 0.00 1.14 1.00 2.16 0.00 -0.10 0.24 103.07 107.50 2hr9 h GLY 117 Ca -0.02 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 46.82 2hr9 h GLY 117 CO 0.08 0.46 -0.08 0.00 0.00 0.00 0.00 176.54 177.00 2hr9 h ALA 118 N 1.42 -0.23 0.00 3.60 0.00 0.93 0.52 119.26 125.50 2hr9 h ALA 118 Ca 0.28 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 2hr9 h ALA 118 Cb -0.02 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2hr9 h ALA 118 CO -0.05 -0.63 -0.49 0.00 0.00 0.00 0.00 179.25 178.08 2hr9 h ALA 119 N 0.60 1.01 -0.02 0.00 0.00 -1.43 -1.35 119.26 118.08 2hr9 h ALA 119 Ca -0.02 -0.45 -0.23 0.00 0.00 0.00 0.00 54.91 54.21 2hr9 h ALA 119 Cb 0.18 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 17.91 2hr9 h ALA 119 CO 0.04 0.61 -0.89 1.49 0.00 0.00 0.00 179.25 180.50 2hr9 h GLU 120 N 0.00 0.63 -0.05 0.00 4.81 -0.19 -2.06 114.58 117.72 2hr9 h GLU 120 Ca -0.00 -0.66 -0.19 0.00 -0.13 0.00 0.00 59.36 58.37 2hr9 h GLU 120 Cb 0.98 0.18 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 2hr9 h GLU 120 CO 0.06 1.26 -0.80 0.37 -0.73 0.00 0.00 179.01 179.17 2hr9 h GLN 121 N 0.27 0.37 -0.15 1.92 5.75 0.06 -2.86 115.11 120.48 2hr9 h GLN 121 Ca -0.11 -0.34 -0.07 0.00 -0.15 0.00 0.00 58.65 57.99 2hr9 h GLN 121 Cb 1.56 0.08 -0.00 0.00 1.07 0.00 0.00 27.48 30.19 2hr9 h GLN 121 CO 0.18 1.00 -0.17 0.97 -2.65 0.00 0.00 178.83 178.16 2hr9 h ILE 122 N 0.24 1.35 -0.17 2.39 -0.00 -1.31 -2.39 117.51 117.61 2hr9 h ILE 122 Ca -0.04 -1.34 -0.01 0.00 -0.00 0.00 0.00 64.86 63.47 2hr9 h ILE 122 Cb 1.39 1.87 -0.01 0.00 -0.00 0.00 0.00 36.82 40.07 2hr9 h ILE 122 CO 0.13 0.40 0.06 0.07 -0.00 0.00 0.00 178.15 178.81 2hr9 h LYS 123 N 0.02 0.24 0.22 2.19 2.10 -1.43 0.31 116.57 120.22 2hr9 h LYS 123 Ca 0.02 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 2hr9 h LYS 123 Cb 0.71 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.99 2hr9 h LYS 123 CO 0.04 0.21 -0.11 1.25 -2.00 0.00 0.00 179.45 178.85 2hr9 h HIS 124 N 0.24 -0.28 -0.69 0.07 2.76 -1.38 -2.87 115.15 113.00 2hr9 h HIS 124 Ca 0.06 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.20 2hr9 h HIS 124 Cb 0.07 0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.09 2hr9 h HIS 124 CO 0.00 0.07 0.35 -0.84 -1.30 0.00 0.00 177.93 176.21 2hr9 h ILE 125 N -0.68 1.22 -0.81 6.26 3.07 -1.13 -2.40 117.51 123.04 2hr9 h ILE 125 Ca -0.03 -0.61 0.15 0.00 1.55 0.00 0.00 64.86 65.92 2hr9 h ILE 125 Cb 0.47 0.36 -0.06 0.00 -0.27 0.00 0.00 36.82 37.32 2hr9 h ILE 125 CO 0.05 0.26 0.54 -0.07 -1.05 0.00 0.00 178.15 177.87 2hr9 h LEU 126 N 0.96 0.47 -0.19 0.16 3.38 -0.96 0.71 115.31 119.83 2hr9 h LEU 126 Ca 0.24 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2hr9 h LEU 126 Cb 0.09 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2hr9 h LEU 126 CO -0.03 0.24 0.00 0.00 0.09 0.00 0.00 178.44 178.73 2hr9 n ALA 127 N -2.49 1.67 -2.56 1.53 0.00 -0.91 -3.00 120.51 114.75 2hr9 n ALA 127 Ca 0.16 -0.01 0.02 0.00 0.00 0.00 0.00 53.44 53.60 2hr9 n ALA 127 Cb 0.53 -1.28 0.03 0.00 0.00 0.00 0.00 19.45 18.73 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 -1.70 0.90 -0.06 0.00 3.02 0.19 -4.90 115.26 112.70 2hr9 n ASN 128 Ca 0.03 -2.01 0.25 0.00 -0.03 0.00 0.00 54.58 52.82 2hr9 n ASN 128 Cb 0.19 -0.26 0.69 0.00 -0.61 0.00 0.00 39.78 39.79 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 1.38 0.00 0.00 3.10 3.57 0.13 0.41 116.94 125.53 2hr9 h PHE 129 Ca -0.24 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.25 2hr9 h PHE 129 Cb 1.65 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.39 2hr9 h PHE 129 CO 0.23 0.00 -0.04 -0.22 -2.23 0.00 0.00 178.31 176.05 2hr9 h LYS 130 N 0.00 0.00 0.00 1.11 3.64 -1.88 -2.60 116.57 116.84 2hr9 h LYS 130 Ca 0.33 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.39 2hr9 h LYS 130 Cb 1.67 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 33.43 2hr9 h LYS 130 CO -0.00 0.04 -1.98 0.09 -2.27 0.00 0.00 179.45 175.33 2hr9 n ASN 131 N -4.40 0.51 -4.85 4.20 3.02 0.14 -4.91 115.26 108.98 2hr9 n ASN 131 Ca -0.03 0.25 -0.37 0.00 -0.03 0.00 0.00 54.58 54.40 2hr9 n ASN 131 Cb 0.13 0.38 -0.06 0.00 -0.61 0.00 0.00 39.78 39.62 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 -2.57 3.60 0.04 3.10 1.51 -0.98 -4.57 117.35 117.48 2hr9 s TYR 132 Ca -0.07 0.60 0.08 0.00 -1.01 0.00 0.00 57.07 56.67 2hr9 s TYR 132 Cb 0.07 -2.05 -0.03 0.00 -0.11 0.00 0.00 41.96 39.84 2hr9 s TYR 132 CO 0.83 0.65 -0.23 -0.65 -1.11 0.00 0.00 175.55 175.04 2hr9 s GLN 133 N -0.81 1.56 -0.15 -0.62 -1.52 -1.20 -4.71 119.66 112.21 2hr9 s GLN 133 Ca 0.16 -0.97 -0.27 0.00 -1.95 0.00 0.00 55.36 52.33 2hr9 s GLN 133 Cb -0.13 -1.67 -0.01 0.00 -0.22 0.00 0.00 33.01 30.98 2hr9 s GLN 133 CO 0.05 0.43 0.93 -0.06 -0.25 0.00 0.00 175.29 176.39 2hr9 s PHE 134 N -0.76 3.44 -0.00 0.91 0.08 -1.26 -2.08 117.98 118.30 2hr9 s PHE 134 Ca 0.09 1.41 0.05 0.00 0.12 0.00 0.00 56.93 58.60 2hr9 s PHE 134 Cb -0.09 -3.12 -0.01 0.00 -0.57 0.00 0.00 43.02 39.23 2hr9 s PHE 134 CO 0.02 -0.27 -0.16 -0.06 -0.10 0.00 0.00 175.22 174.64 2hr9 s PHE 135 N 2.26 1.42 0.16 0.36 0.40 0.25 -2.00 117.98 120.83 2hr9 s PHE 135 Ca 0.43 -0.28 0.04 0.00 -0.60 0.00 0.00 56.93 56.52 2hr9 s PHE 135 Cb -0.17 -0.91 -0.05 0.00 0.51 0.00 0.00 43.02 42.41 2hr9 s PHE 135 CO 0.13 -0.01 -0.09 0.42 0.70 0.00 0.00 175.22 176.38 2hr9 s ILE 136 N -0.43 1.17 0.00 0.64 1.01 0.26 0.11 121.20 123.96 2hr9 s ILE 136 Ca 0.06 -2.06 0.00 0.00 0.00 0.00 0.00 60.65 58.64 2hr9 s ILE 136 Cb -0.06 -1.94 0.00 0.00 0.01 0.00 0.00 42.46 40.46 2hr9 s ILE 136 CO -0.00 -0.67 0.00 0.61 0.00 0.00 0.00 174.94 174.88 2hr9 n GLY 137 N -0.24 -3.23 0.00 6.18 0.00 -1.26 0.83 105.19 107.47 2hr9 n GLY 137 Ca -0.09 -1.07 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 -1.66 0.07 -0.05 1.61 0.28 -1.24 -2.73 120.64 116.91 2hr9 n GLU 138 Ca 0.00 0.18 -0.09 0.00 -0.16 0.00 0.00 57.16 57.08 2hr9 n GLU 138 Cb 0.00 -1.50 -0.15 0.00 1.43 0.00 0.00 31.44 31.22 2hr9 n GLU 138 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2hr9 n ASN 139 N -1.45 0.55 -3.72 -1.84 3.02 -1.26 -5.00 115.26 105.57 2hr9 n ASN 139 Ca 0.05 0.24 -0.24 0.00 -0.03 0.00 0.00 54.58 54.60 2hr9 n ASN 139 Cb 0.19 0.35 0.05 0.00 -0.61 0.00 0.00 39.78 39.76 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 -2.93 -6.02 -2.08 3.52 2.81 -1.11 -4.89 117.12 106.42 2hr9 n MET 140 Ca -0.24 0.69 -0.43 0.00 -1.81 0.00 0.00 57.70 55.91 2hr9 n MET 140 Cb 1.10 -5.53 -0.03 0.00 -0.71 0.00 0.00 33.22 28.05 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 -3.78 6.52 0.58 7.83 0.01 -1.26 -4.87 114.94 119.96 2hr9 s ASN 141 Ca 0.35 1.90 0.33 0.00 -0.71 0.00 0.00 52.86 54.73 2hr9 s ASN 141 Cb -0.17 -2.53 1.76 0.00 0.41 0.00 0.00 41.25 40.72 2hr9 s ASN 141 CO 0.79 -1.09 2.18 -0.65 -1.51 0.00 0.00 177.10 176.81 2hr9 h PRO 142 N 10.13 0.00 0.00 -0.60 0.11 -1.95 -0.63 132.00 139.06 2hr9 h PRO 142 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2hr9 h PRO 142 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2hr9 h PRO 142 CO 0.98 0.05 -0.36 0.22 -0.21 0.00 0.00 178.00 178.68 2hr9 h ASP 143 N 0.00 0.00 0.00 -2.05 3.58 -1.97 -3.46 116.42 112.51 2hr9 h ASP 143 Ca -0.00 -0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.34 2hr9 h ASP 143 Cb 0.20 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.25 2hr9 h ASP 143 CO 0.01 0.05 0.00 0.61 -2.88 0.00 0.00 179.24 177.03 2hr9 n GLY 144 N 1.30 -1.01 1.77 -0.78 0.00 -0.25 -4.80 105.19 101.44 2hr9 n GLY 144 Ca 0.04 -1.58 -0.09 0.00 0.00 0.00 0.00 46.02 44.39 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 0.00 0.73 -4.23 1.61 0.00 -1.26 -4.79 117.12 109.17 2hr9 n MET 145 Ca 0.00 -1.39 -0.19 0.00 0.00 0.00 0.00 57.70 56.12 2hr9 n MET 145 Cb 0.00 -0.14 -0.12 0.00 0.00 0.00 0.00 33.22 32.96 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 -0.74 1.35 -0.21 3.17 1.01 -1.26 -4.85 120.40 118.87 2hr9 s VAL 146 Ca 0.28 -1.57 -0.02 0.00 0.00 0.00 0.00 61.98 60.67 2hr9 s VAL 146 Cb -0.02 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.95 2hr9 s VAL 146 CO 0.18 -0.29 -0.09 0.00 0.00 0.00 0.00 175.10 174.90 2hr9 s ALA 147 N -1.71 2.66 -0.50 5.51 0.00 0.31 -4.79 121.76 123.26 2hr9 s ALA 147 Ca 0.05 -1.23 -0.20 0.00 0.00 0.00 0.00 51.96 50.59 2hr9 s ALA 147 Cb -0.07 -1.56 0.05 0.00 0.00 0.00 0.00 23.12 21.54 2hr9 s ALA 147 CO 0.03 -0.47 0.64 -0.51 0.00 0.00 0.00 175.76 175.45 2hr9 s LEU 148 N 1.40 4.84 -0.27 0.00 1.43 -1.08 0.87 118.68 125.87 2hr9 s LEU 148 Ca 0.05 -0.79 -0.19 0.00 -1.03 0.00 0.00 54.13 52.16 2hr9 s LEU 148 Cb -0.14 -2.51 -0.02 0.00 0.03 0.00 0.00 46.19 43.55 2hr9 s LEU 148 CO -0.06 -0.89 0.59 -0.22 0.23 0.00 0.00 176.35 176.00 2hr9 s LEU 149 N 2.72 4.09 0.21 1.79 2.96 -0.88 0.10 118.68 129.67 2hr9 s LEU 149 Ca 0.17 0.55 0.08 0.00 -0.22 0.00 0.00 54.13 54.71 2hr9 s LEU 149 Cb -0.18 -2.77 -0.05 0.00 0.50 0.00 0.00 46.19 43.69 2hr9 s LEU 149 CO 0.13 -0.38 -0.15 -1.81 -1.32 0.00 0.00 176.35 172.83 2hr9 s ASP 150 N 1.55 2.65 -0.09 3.68 1.11 0.19 -3.23 116.67 122.53 2hr9 s ASP 150 Ca 0.24 -1.00 -0.00 0.00 0.18 0.00 0.00 52.55 51.96 2hr9 s ASP 150 Cb -0.15 -0.15 -0.03 0.00 1.07 0.00 0.00 42.92 43.66 2hr9 s ASP 150 CO 0.10 -0.14 -0.05 -0.31 1.18 0.00 0.00 175.17 175.94 2hr9 s TYR 151 N -2.84 2.99 0.57 4.23 2.02 -1.26 0.65 117.35 123.69 2hr9 s TYR 151 Ca 0.22 -0.01 -0.09 0.00 -0.37 0.00 0.00 57.07 56.81 2hr9 s TYR 151 Cb -0.02 -1.77 0.15 0.00 -0.40 0.00 0.00 41.96 39.92 2hr9 s TYR 151 CO 0.07 0.28 0.35 0.54 -1.57 0.00 0.00 175.55 175.22 2hr9 n ARG 152 N 2.45 -3.02 -0.33 -0.62 3.00 -0.96 -4.66 116.66 112.51 2hr9 n ARG 152 Ca -0.18 -0.58 -0.00 0.00 -0.01 0.00 0.00 57.85 57.08 2hr9 n ARG 152 Cb 0.53 -0.73 0.13 0.00 0.00 0.00 0.00 32.46 32.39 2hr9 n ARG 152 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 2hr9 h GLU 153 N 0.00 1.09 0.00 5.56 4.81 -2.00 0.15 114.58 124.19 2hr9 h GLU 153 Ca -0.15 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.01 2hr9 h GLU 153 Cb 0.52 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.65 2hr9 h GLU 153 CO 0.09 0.72 0.00 0.22 -0.73 0.00 0.00 179.01 179.31 2hr9 h ASP 154 N 1.12 0.00 -0.57 1.04 3.58 -1.96 -3.46 116.42 116.18 2hr9 h ASP 154 Ca 0.37 0.00 -0.24 0.00 0.42 0.00 0.00 57.03 57.58 2hr9 h ASP 154 Cb 0.05 0.00 -0.10 0.00 1.72 0.00 0.00 39.33 41.00 2hr9 h ASP 154 CO -0.13 0.00 -0.22 0.61 -2.88 0.00 0.00 179.24 176.62 2hr9 n GLY 155 N -0.27 1.29 0.64 -0.78 0.00 0.04 -4.88 105.19 101.23 2hr9 n GLY 155 Ca 0.01 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.66 0.00 -1.56 1.61 0.31 -1.26 -4.88 118.33 109.89 2hr9 n VAL 156 Ca -0.12 0.18 -0.44 0.00 -0.01 0.00 0.00 64.34 63.95 2hr9 n VAL 156 Cb 0.39 -1.18 -0.04 0.00 -0.91 0.00 0.00 33.84 32.10 2hr9 n VAL 156 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2hr9 n THR 157 N -2.49 0.26 -3.04 2.52 -1.04 -1.26 -4.62 114.28 104.61 2hr9 n THR 157 Ca 0.00 -0.45 -0.40 0.00 -2.04 0.00 0.00 64.05 61.16 2hr9 n THR 157 Cb 0.00 -2.35 -0.05 0.00 -1.82 0.00 0.00 70.33 66.11 2hr9 n THR 157 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2hr9 s PRO 158 N 6.57 4.38 -0.08 -2.82 0.04 -1.26 -2.26 135.00 139.57 2hr9 s PRO 158 Ca 1.03 0.85 0.04 0.00 0.04 0.00 0.00 61.00 62.97 2hr9 s PRO 158 Cb -0.45 -3.49 -0.00 0.00 0.04 0.00 0.00 34.50 30.60 2hr9 s PRO 158 CO 0.38 -0.05 -0.22 1.52 0.04 0.00 0.00 177.00 178.67 2hr9 s TYR 159 N 1.20 2.30 -0.10 0.56 1.13 0.21 -0.76 117.35 121.90 2hr9 s TYR 159 Ca 0.36 -0.83 -0.05 0.00 -1.41 0.00 0.00 57.07 55.14 2hr9 s TYR 159 Cb -0.17 -1.54 -0.04 0.00 -1.10 0.00 0.00 41.96 39.11 2hr9 s TYR 159 CO 0.16 -0.32 0.11 -1.64 -2.51 0.00 0.00 175.55 171.35 2hr9 s MET 160 N 0.19 3.31 -0.26 -3.49 -1.94 0.11 0.54 119.30 117.77 2hr9 s MET 160 Ca -0.12 -0.23 -0.14 0.00 -1.71 0.00 0.00 55.69 53.49 2hr9 s MET 160 Cb -0.16 -3.07 -0.04 0.00 2.01 0.00 0.00 34.83 33.57 2hr9 s MET 160 CO 0.06 0.75 0.32 0.42 -0.01 0.00 0.00 175.02 176.55 2hr9 s ILE 161 N -1.03 5.23 0.23 2.53 1.01 0.28 0.64 121.20 130.08 2hr9 s ILE 161 Ca 0.16 0.47 0.11 0.00 0.00 0.00 0.00 60.65 61.40 2hr9 s ILE 161 Cb -0.12 -3.65 -0.05 0.00 0.01 0.00 0.00 42.46 38.66 2hr9 s ILE 161 CO 0.06 0.22 -0.21 -0.36 0.00 0.00 0.00 174.94 174.64 2hr9 s PHE 162 N 1.75 2.32 -0.29 3.97 0.08 0.86 -2.62 117.98 124.05 2hr9 s PHE 162 Ca 0.13 -0.34 -0.10 0.00 0.12 0.00 0.00 56.93 56.74 2hr9 s PHE 162 Cb -0.15 -1.09 -0.03 0.00 -0.57 0.00 0.00 43.02 41.17 2hr9 s PHE 162 CO 0.09 0.58 0.16 -0.06 -0.10 0.00 0.00 175.22 175.90 2hr9 s PHE 163 N -2.00 3.18 0.08 0.36 0.40 -1.26 0.11 117.98 118.85 2hr9 s PHE 163 Ca 0.25 -0.17 -0.23 0.00 -0.60 0.00 0.00 56.93 56.18 2hr9 s PHE 163 Cb -0.07 -2.36 -0.16 0.00 0.51 0.00 0.00 43.02 40.95 2hr9 s PHE 163 CO 0.12 -0.28 1.69 -0.22 0.70 0.00 0.00 175.22 177.22 2hr9 h LYS 164 N 8.35 0.00 -0.98 0.44 3.64 -1.77 -1.88 116.57 124.37 2hr9 h LYS 164 Ca -0.35 -0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.14 2hr9 h LYS 164 Cb 1.17 -0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.91 2hr9 h LYS 164 CO 0.58 0.06 0.62 -0.44 -2.27 0.00 0.00 179.45 177.99 2hr9 h ASP 165 N -0.05 0.92 -0.63 4.20 3.32 -1.85 -0.45 116.42 121.88 2hr9 h ASP 165 Ca 0.00 0.04 -0.21 0.00 0.02 0.00 0.00 57.03 56.88 2hr9 h ASP 165 Cb 0.06 -0.15 -0.13 0.00 0.22 0.00 0.00 39.33 39.33 2hr9 h ASP 165 CO -0.00 0.52 0.27 0.61 -1.72 0.00 0.00 179.24 178.91 2hr9 n GLY 166 N -1.35 3.35 3.26 2.75 0.00 -1.07 -4.89 105.19 107.23 2hr9 n GLY 166 Ca 0.18 -0.80 -0.14 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.40 0.74 0.06 0.99 0.20 -0.18 -1.02 118.68 117.07 2hr9 s LEU 167 Ca 0.44 0.20 0.03 0.00 0.69 0.00 0.00 54.13 55.50 2hr9 s LEU 167 Cb 0.36 1.33 -0.03 0.00 -0.43 0.00 0.00 46.19 47.42 2hr9 s LEU 167 CO 0.11 -0.42 -0.10 -1.61 -0.29 0.00 0.00 176.35 174.04 2hr9 s GLU 168 N -1.13 0.66 0.11 1.98 0.41 0.95 -4.76 118.70 116.92 2hr9 s GLU 168 Ca -0.12 -0.87 0.02 0.00 -0.41 0.00 0.00 54.97 53.59 2hr9 s GLU 168 Cb -0.05 -0.49 -0.04 0.00 -1.78 0.00 0.00 34.13 31.77 2hr9 s GLU 168 CO 0.04 0.10 -0.06 0.00 -0.49 0.00 0.00 175.26 174.84 2hr9 s MET 169 N -1.77 0.86 -0.05 1.61 0.23 -1.26 0.11 119.30 119.03 2hr9 s MET 169 Ca -0.06 -1.35 -0.10 0.00 -1.03 0.00 0.00 55.69 53.15 2hr9 s MET 169 Cb -0.09 -0.24 0.02 0.00 -1.53 0.00 0.00 34.83 32.99 2hr9 s MET 169 CO 0.01 -0.02 0.23 -1.83 -2.03 0.00 0.00 175.02 171.38 2hr9 s GLU 170 N -3.83 0.42 -0.50 3.16 -1.05 -0.41 -4.89 118.70 111.59 2hr9 s GLU 170 Ca 0.13 0.04 -0.28 0.00 -0.15 0.00 0.00 54.97 54.71 2hr9 s GLU 170 Cb 0.05 0.19 0.03 0.00 -0.44 0.00 0.00 34.13 33.96 2hr9 s GLU 170 CO -0.04 -0.09 1.08 0.15 0.95 0.00 0.00 175.26 177.31 2hr9 s LYS 171 N -0.56 3.61 0.25 -4.83 1.02 -1.26 0.04 119.74 118.01 2hr9 s LYS 171 Ca -0.07 0.34 0.00 0.00 0.02 0.00 0.00 55.97 56.27 2hr9 s LYS 171 Cb -0.04 -3.94 0.00 0.00 -0.52 0.00 0.00 37.83 33.33 2hr9 s LYS 171 CO 0.01 -1.40 0.00 0.00 -0.92 0.00 0.00 175.35 173.04 2hr9 s LEU 173 N -1.13 3.59 0.00 0.00 1.43 -1.26 -5.04 118.68 116.27 2hr9 s LEU 173 Ca 0.00 0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.34 2hr9 s LEU 173 Cb 0.00 -3.12 0.00 0.00 0.03 0.00 0.00 46.19 43.10 2hr9 s LEU 173 CO 0.00 -0.77 0.44 1.21 0.23 0.00 0.00 176.35 177.46