#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 1.97 0.14 3.17 2.07 -1.26 -1.86 121.20 125.42 2hr9 s ILE 2 Ca 0.00 -1.39 0.02 0.00 -1.41 0.00 0.00 60.65 57.87 2hr9 s ILE 2 Cb 0.00 -1.71 -0.04 0.00 0.13 0.00 0.00 42.46 40.85 2hr9 s ILE 2 CO 0.00 0.24 0.27 -0.63 -1.91 0.00 0.00 174.94 172.91 2hr9 s ILE 3 N -0.87 5.32 -0.23 2.00 -1.09 0.43 -1.23 121.20 125.53 2hr9 s ILE 3 Ca 0.10 -0.65 0.01 0.00 -2.23 0.00 0.00 60.65 57.89 2hr9 s ILE 3 Cb -0.10 -3.72 0.06 0.00 -1.58 0.00 0.00 42.46 37.12 2hr9 s ILE 3 CO 0.03 -0.06 -0.08 -0.31 -1.23 0.00 0.00 174.94 173.29 2hr9 s TYR 4 N -1.71 2.63 0.06 3.97 1.51 0.32 -2.72 117.35 121.41 2hr9 s TYR 4 Ca 0.35 -1.87 0.06 0.00 -1.01 0.00 0.00 57.07 54.60 2hr9 s TYR 4 Cb -0.11 -1.69 -0.03 0.00 -0.11 0.00 0.00 41.96 40.02 2hr9 s TYR 4 CO 0.28 -0.80 -0.18 -0.98 -1.11 0.00 0.00 175.55 172.77 2hr9 s ARG 5 N 1.32 1.12 0.68 -0.62 1.70 -0.81 0.10 118.95 122.45 2hr9 s ARG 5 Ca -0.06 -0.92 -0.17 0.00 -0.47 0.00 0.00 55.73 54.12 2hr9 s ARG 5 Cb -0.19 -1.22 -0.02 0.00 -0.57 0.00 0.00 34.95 32.95 2hr9 s ARG 5 CO -0.06 0.30 0.86 -3.47 -1.08 0.00 0.00 175.30 171.84 2hr9 n ASP 6 N 1.67 0.15 0.20 -2.89 2.03 -0.98 0.75 116.55 117.49 2hr9 n ASP 6 Ca -0.18 0.69 0.11 0.00 0.52 0.00 0.00 54.79 55.93 2hr9 n ASP 6 Cb 0.54 -1.35 0.15 0.00 -0.72 0.00 0.00 41.12 39.73 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 -0.06 0.00 0.02 -2.67 5.85 -0.85 0.47 115.31 118.08 2hr9 h LEU 7 Ca -0.47 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 57.96 2hr9 h LEU 7 Cb 1.35 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.34 2hr9 h LEU 7 CO 0.47 0.04 -1.56 -0.38 -0.34 0.00 0.00 178.44 176.67 2hr9 n ILE 8 N -3.07 1.57 0.04 4.05 -0.00 -1.26 -4.51 119.36 116.17 2hr9 n ILE 8 Ca 0.03 -0.18 0.07 0.00 -0.00 0.00 0.00 62.75 62.68 2hr9 n ILE 8 Cb 0.55 -1.96 -0.08 0.00 -0.00 0.00 0.00 39.64 38.14 2hr9 n ILE 8 CO 0.00 0.00 0.00 -1.20 -0.00 0.00 0.00 176.55 175.35 2hr9 n SER 9 N -4.24 0.54 -2.13 4.38 7.64 -1.26 -4.98 113.62 113.57 2hr9 n SER 9 Ca -0.35 0.22 -0.18 0.00 1.01 0.00 0.00 58.87 59.57 2hr9 n SER 9 Cb 0.77 0.89 0.00 0.00 -1.01 0.00 0.00 64.21 64.86 2hr9 n SER 9 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2hr9 n HIS 10 N -2.60 -1.04 -3.71 1.43 8.25 0.16 -4.94 115.22 112.77 2hr9 n HIS 10 Ca -0.06 0.12 -0.37 0.00 -0.26 0.00 0.00 57.72 57.15 2hr9 n HIS 10 Cb 0.66 -3.59 -0.11 0.00 1.12 0.00 0.00 29.99 28.07 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 -2.36 5.66 -0.60 0.41 2.15 -1.26 -4.74 116.67 115.93 2hr9 s ASP 11 Ca 0.07 -0.06 -0.26 0.00 0.43 0.00 0.00 52.55 52.73 2hr9 s ASP 11 Cb -0.03 -2.03 -0.10 0.00 -0.30 0.00 0.00 42.92 40.46 2hr9 s ASP 11 CO 0.08 -0.00 2.45 -1.84 -0.17 0.00 0.00 175.17 175.68 2hr9 n GLU 12 N 4.74 0.83 0.19 4.34 0.00 -1.26 -2.31 120.64 127.17 2hr9 n GLU 12 Ca -0.15 -0.12 0.13 0.00 0.00 0.00 0.00 57.16 57.01 2hr9 n GLU 12 Cb 0.52 -3.21 0.32 0.00 0.00 0.00 0.00 31.44 29.07 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 17.67 0.00 -1.91 3.44 2.86 0.35 -3.47 114.93 133.88 2hr9 h MET 13 Ca -0.18 0.00 0.36 0.00 -2.06 0.00 0.00 59.70 57.82 2hr9 h MET 13 Cb 1.23 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 32.81 2hr9 h MET 13 CO 1.18 0.00 0.92 -0.59 1.06 0.00 0.00 176.91 179.48 2hr9 s PHE 14 N -3.24 0.01 0.08 -0.22 -0.71 -0.79 -4.87 117.98 108.23 2hr9 s PHE 14 Ca 0.07 -0.09 0.01 0.00 -1.04 0.00 0.00 56.93 55.88 2hr9 s PHE 14 Cb 0.08 0.54 -0.00 0.00 -1.21 0.00 0.00 43.02 42.43 2hr9 s PHE 14 CO 0.61 -0.20 0.04 -1.13 -1.34 0.00 0.00 175.22 173.20 2hr9 n SER 15 N -0.92 0.61 -1.82 1.98 3.41 -1.26 0.12 113.62 115.73 2hr9 n SER 15 Ca 0.01 -1.44 -0.11 0.00 -0.26 0.00 0.00 58.87 57.07 2hr9 n SER 15 Cb 0.60 0.25 0.18 0.00 -0.26 0.00 0.00 64.21 64.98 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 -2.22 3.86 0.06 4.04 2.03 -0.36 -4.11 116.55 119.84 2hr9 n ASP 16 Ca -0.00 -3.06 0.12 0.00 0.52 0.00 0.00 54.79 52.37 2hr9 n ASP 16 Cb 0.12 -0.72 0.25 0.00 -0.72 0.00 0.00 41.12 40.05 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 -0.39 0.32 -3.32 5.18 -5.35 -1.26 -4.89 119.36 109.65 2hr9 n ILE 17 Ca 0.38 -0.22 -0.01 0.00 -0.27 0.00 0.00 62.75 62.64 2hr9 n ILE 17 Cb 1.27 -0.18 0.00 0.00 -1.74 0.00 0.00 39.64 38.99 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 -2.01 -2.05 -3.19 4.28 4.01 -1.26 -5.06 117.16 111.89 2hr9 n TYR 18 Ca 0.04 -0.08 -0.46 0.00 -0.16 0.00 0.00 57.90 57.25 2hr9 n TYR 18 Cb 0.42 -0.02 -0.02 0.00 -0.31 0.00 0.00 39.34 39.41 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 -2.08 3.69 -0.07 -0.72 3.01 -1.23 -4.95 119.74 117.38 2hr9 s LYS 19 Ca 0.01 -2.34 -0.22 0.00 -1.01 0.00 0.00 55.97 52.42 2hr9 s LYS 19 Cb -0.00 -4.62 -0.04 0.00 -1.01 0.00 0.00 37.83 32.16 2hr9 s LYS 19 CO 0.01 -1.45 0.64 0.42 0.51 0.00 0.00 175.35 175.48 2hr9 s ILE 20 N 0.83 5.06 -0.18 2.17 1.09 -1.26 -1.97 121.20 126.95 2hr9 s ILE 20 Ca 0.25 1.32 0.01 0.00 -1.10 0.00 0.00 60.65 61.12 2hr9 s ILE 20 Cb -0.08 -3.98 0.02 0.00 -1.06 0.00 0.00 42.46 37.36 2hr9 s ILE 20 CO -0.09 0.29 -0.17 -0.13 -0.10 0.00 0.00 174.94 174.74 2hr9 s ARG 21 N 0.63 2.66 -0.21 2.79 0.52 0.68 -4.89 118.95 121.13 2hr9 s ARG 21 Ca 0.34 -0.77 -0.29 0.00 -0.52 0.00 0.00 55.73 54.49 2hr9 s ARG 21 Cb -0.17 -2.43 -0.02 0.00 0.52 0.00 0.00 34.95 32.85 2hr9 s ARG 21 CO 0.16 -0.25 1.51 -1.83 0.02 0.00 0.00 175.30 174.91 2hr9 s GLU 22 N 1.35 3.91 0.45 3.54 -1.05 -1.26 0.90 118.70 126.55 2hr9 s GLU 22 Ca 0.04 1.63 0.07 0.00 -0.15 0.00 0.00 54.97 56.55 2hr9 s GLU 22 Cb -0.14 -3.96 -0.01 0.00 -0.44 0.00 0.00 34.13 29.58 2hr9 s GLU 22 CO -0.12 -1.14 0.33 0.96 0.95 0.00 0.00 175.26 176.25 2hr9 s ILE 23 N 4.70 2.27 -1.72 1.83 -4.36 0.32 -4.45 121.20 119.78 2hr9 s ILE 23 Ca 0.66 -1.48 0.00 0.00 -0.26 0.00 0.00 60.65 59.57 2hr9 s ILE 23 Cb -0.24 -2.75 0.00 0.00 1.25 0.00 0.00 42.46 40.72 2hr9 s ILE 23 CO 0.26 0.00 0.00 0.00 0.24 0.00 0.00 174.94 175.44 2hr9 n ALA 24 N -1.53 -0.58 -2.95 2.27 0.00 -1.26 -1.55 120.51 114.91 2hr9 n ALA 24 Ca 0.01 0.19 -0.12 0.00 0.00 0.00 0.00 53.44 53.51 2hr9 n ALA 24 Cb 0.63 -2.04 0.06 0.00 0.00 0.00 0.00 19.45 18.10 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 -1.83 -3.54 0.00 0.00 8.00 -1.26 -2.92 116.55 115.01 2hr9 n ASP 25 Ca -0.22 -0.49 0.00 0.00 0.71 0.00 0.00 54.79 54.79 2hr9 n ASP 25 Cb 0.67 -3.98 0.00 0.00 -0.02 0.00 0.00 41.12 37.79 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 -1.19 1.67 0.26 0.44 0.00 -1.00 -4.91 105.19 100.47 2hr9 n GLY 26 Ca -0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.50 -9.60 0.99 7.12 -1.25 -3.44 115.31 108.63 2hr9 h LEU 27 Ca 0.00 -0.10 -0.63 0.00 0.13 0.00 0.00 57.88 57.29 2hr9 h LEU 27 Cb 0.00 0.13 -0.13 0.00 -0.53 0.00 0.00 40.66 40.13 2hr9 h LEU 27 CO 0.00 -0.11 -0.62 0.00 -0.13 0.00 0.00 178.44 177.58 2hr9 s LEU 29 N -3.68 1.66 -0.38 0.00 1.02 0.33 0.12 118.68 117.74 2hr9 s LEU 29 Ca 0.34 -0.19 -0.15 0.00 0.02 0.00 0.00 54.13 54.15 2hr9 s LEU 29 Cb 0.08 -0.57 0.00 0.00 0.02 0.00 0.00 46.19 45.73 2hr9 s LEU 29 CO 0.18 0.03 0.34 -1.61 0.02 0.00 0.00 176.35 175.30 2hr9 s GLU 30 N 0.44 3.30 -0.40 1.70 2.02 0.26 0.06 118.70 126.08 2hr9 s GLU 30 Ca -0.07 -0.69 -0.19 0.00 0.02 0.00 0.00 54.97 54.04 2hr9 s GLU 30 Cb -0.11 -3.88 0.01 0.00 0.10 0.00 0.00 34.13 30.25 2hr9 s GLU 30 CO 0.01 -0.63 0.55 0.08 0.02 0.00 0.00 175.26 175.28 2hr9 s VAL 31 N 1.89 4.96 -0.16 2.63 1.01 0.15 -0.23 120.40 130.65 2hr9 s VAL 31 Ca 0.09 0.10 -0.23 0.00 0.00 0.00 0.00 61.98 61.94 2hr9 s VAL 31 Cb -0.17 -4.07 -0.02 0.00 0.00 0.00 0.00 36.38 32.11 2hr9 s VAL 31 CO 0.11 -0.41 0.72 -1.61 0.00 0.00 0.00 175.10 173.92 2hr9 s GLU 32 N 2.50 4.28 0.00 2.72 2.02 -0.83 -0.28 118.70 129.11 2hr9 s GLU 32 Ca 0.19 0.82 0.00 0.00 0.02 0.00 0.00 54.97 55.99 2hr9 s GLU 32 Cb -0.15 -3.55 0.00 0.00 0.10 0.00 0.00 34.13 30.52 2hr9 s GLU 32 CO 0.16 -0.22 0.00 0.41 0.02 0.00 0.00 175.26 175.63 2hr9 n GLY 33 N 3.54 2.07 3.45 -1.39 0.00 0.19 -3.57 105.19 109.48 2hr9 n GLY 33 Ca 0.01 -1.01 0.02 0.00 0.00 0.00 0.00 46.02 45.03 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 4.59 0.18 -0.06 1.61 -2.85 -1.26 -4.60 119.74 117.35 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 0.15 -0.05 0.00 -2.06 0.00 0.00 37.83 35.87 2hr9 s LYS 34 CO 0.00 -0.05 1.49 -1.64 0.10 0.00 0.00 175.35 175.26 2hr9 s MET 35 N 1.75 4.22 -0.17 1.78 -1.94 -1.26 -1.06 119.30 122.63 2hr9 s MET 35 Ca -0.04 2.02 -0.02 0.00 -1.71 0.00 0.00 55.69 55.93 2hr9 s MET 35 Cb -0.03 -3.79 -0.02 0.00 2.01 0.00 0.00 34.83 33.00 2hr9 s MET 35 CO -0.15 -0.73 -0.07 0.14 -0.01 0.00 0.00 175.02 174.20 2hr9 s VAL 36 N 3.35 3.45 0.60 -6.03 -7.23 0.13 -4.88 120.40 109.79 2hr9 s VAL 36 Ca 0.66 -0.50 -0.05 0.00 -1.81 0.00 0.00 61.98 60.28 2hr9 s VAL 36 Cb -0.31 -2.51 0.02 0.00 0.56 0.00 0.00 36.38 34.14 2hr9 s VAL 36 CO 0.25 0.48 0.90 -0.94 -0.31 0.00 0.00 175.10 175.49 2hr9 s SER 37 N 0.69 5.48 0.03 4.85 1.04 -1.26 -2.29 113.70 122.23 2hr9 s SER 37 Ca -0.04 0.63 -0.02 0.00 0.48 0.00 0.00 55.95 57.00 2hr9 s SER 37 Cb -0.15 -1.58 -0.02 0.00 0.10 0.00 0.00 66.02 64.37 2hr9 s SER 37 CO 0.02 -1.12 0.02 -0.60 0.98 0.00 0.00 173.24 172.53 2hr9 s ARG 38 N -5.00 0.45 -0.32 4.02 3.52 0.54 -4.89 118.95 117.27 2hr9 s ARG 38 Ca 0.55 -0.74 -0.06 0.00 -0.13 0.00 0.00 55.73 55.35 2hr9 s ARG 38 Cb -0.11 0.17 0.24 0.00 -1.56 0.00 0.00 34.95 33.69 2hr9 s ARG 38 CO 0.44 -0.09 1.18 -2.37 -0.81 0.00 0.00 175.30 173.66 2hr9 n THR 39 N 1.11 0.00 -3.15 4.11 5.66 -1.26 -2.55 114.28 118.21 2hr9 n THR 39 Ca -0.21 -0.30 0.04 0.00 -3.05 0.00 0.00 64.05 60.53 2hr9 n THR 39 Cb 0.57 0.75 -0.01 0.00 -1.55 0.00 0.00 70.33 70.09 2hr9 n THR 39 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 2hr9 s GLU 40 N 0.64 0.49 0.00 1.09 2.12 -1.26 -4.72 118.70 117.06 2hr9 s GLU 40 Ca 0.24 0.74 0.00 0.00 0.36 0.00 0.00 54.97 56.31 2hr9 s GLU 40 Cb 0.17 0.40 0.00 0.00 0.26 0.00 0.00 34.13 34.95 2hr9 s GLU 40 CO -0.10 -0.66 0.00 0.41 -0.54 0.00 0.00 175.26 174.38 2hr9 n GLY 41 N 5.41 4.04 3.92 -1.50 0.00 -1.01 -4.90 105.19 111.15 2hr9 n GLY 41 Ca 0.00 -1.24 -0.27 0.00 0.00 0.00 0.00 46.02 44.51 2hr9 n GLY 41 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2hr9 s ASN 42 N 0.00 6.39 -0.42 1.61 3.84 -1.26 -3.29 114.94 121.81 2hr9 s ASN 42 Ca 0.00 0.50 -0.22 0.00 0.21 0.00 0.00 52.86 53.35 2hr9 s ASN 42 Cb 0.00 -2.05 0.02 0.00 -0.55 0.00 0.00 41.25 38.67 2hr9 s ASN 42 CO 0.00 -0.12 0.73 -0.63 -2.79 0.00 0.00 177.10 174.29 2hr9 s ILE 43 N -1.99 4.74 0.04 -5.21 1.09 -1.26 -4.72 121.20 113.89 2hr9 s ILE 43 Ca 0.40 0.47 0.00 0.00 -1.10 0.00 0.00 60.65 60.42 2hr9 s ILE 43 Cb -0.11 -4.24 0.00 0.00 -1.06 0.00 0.00 42.46 37.06 2hr9 s ILE 43 CO 0.30 -0.57 0.00 0.47 -0.10 0.00 0.00 174.94 175.04 2hr9 n ASP 44 N 6.46 -9.49 -4.76 3.58 8.00 -1.26 -4.95 116.55 114.13 2hr9 n ASP 44 Ca 0.01 1.80 -0.31 0.00 0.71 0.00 0.00 54.79 57.00 2hr9 n ASP 44 Cb 0.48 -5.18 0.09 0.00 -0.02 0.00 0.00 41.12 36.49 2hr9 n ASP 44 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2hr9 s ASP 45 N -0.59 4.41 -0.05 -2.24 1.01 -1.26 -5.02 116.67 112.93 2hr9 s ASP 45 Ca 0.00 1.89 -0.06 0.00 0.71 0.00 0.00 52.55 55.09 2hr9 s ASP 45 Cb 0.00 -2.53 -0.02 0.00 1.01 0.00 0.00 42.92 41.38 2hr9 s ASP 45 CO 0.00 -2.10 -0.11 -0.24 0.21 0.00 0.00 175.17 172.93 2hr9 n SER 46 N -3.45 0.65 -0.01 0.27 2.88 -1.26 -4.80 113.62 107.90 2hr9 n SER 46 Ca 0.10 0.11 0.10 0.00 -1.33 0.00 0.00 58.87 57.84 2hr9 n SER 46 Cb 0.53 -0.53 -0.14 0.00 -0.75 0.00 0.00 64.21 63.32 2hr9 n SER 46 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hr9 n LEU 47 N -3.15 0.34 0.00 2.46 -0.00 -1.26 -5.00 117.00 110.40 2hr9 n LEU 47 Ca -0.04 -0.19 0.00 0.00 -0.00 0.00 0.00 56.01 55.78 2hr9 n LEU 47 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.58 2hr9 n LEU 47 CO 0.06 0.09 0.00 -0.38 -0.00 0.00 0.00 177.39 177.16 2hr9 n ILE 48 N -1.91 0.00 -3.89 1.47 5.41 -1.26 -4.78 119.36 114.40 2hr9 n ILE 48 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.74 2hr9 n ILE 48 Cb 0.43 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.36 2hr9 n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2hr9 n GLY 49 N 0.00 -1.13 3.92 7.39 0.00 -1.26 -5.13 105.19 108.99 2hr9 n GLY 49 Ca 0.00 -1.22 -0.26 0.00 0.00 0.00 0.00 46.02 44.53 2hr9 n GLY 49 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2hr9 s GLY 50 N 0.00 1.66 0.04 -0.02 0.00 -1.26 -4.85 107.32 102.89 2hr9 s GLY 50 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 43.89 2hr9 s GLY 50 CO 0.00 -0.45 0.00 0.70 0.00 0.00 0.00 173.10 173.35 2hr9 n ASN 51 N -2.85 -9.42 -4.02 1.64 3.02 -1.26 -5.00 115.26 97.37 2hr9 n ASN 51 Ca 0.07 1.78 -0.31 0.00 -0.03 0.00 0.00 54.58 56.09 2hr9 n ASN 51 Cb 0.60 -5.14 -0.15 0.00 -0.61 0.00 0.00 39.78 34.47 2hr9 n ASN 51 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2hr9 s ALA 52 N -0.58 2.25 0.34 5.41 0.00 -1.26 -5.11 121.76 122.81 2hr9 s ALA 52 Ca 0.00 -1.48 0.03 0.00 0.00 0.00 0.00 51.96 50.51 2hr9 s ALA 52 Cb 0.00 -1.44 -0.01 0.00 0.00 0.00 0.00 23.12 21.66 2hr9 s ALA 52 CO 0.00 -1.05 0.10 -1.13 0.00 0.00 0.00 175.76 173.68 2hr9 n SER 53 N 4.57 1.47 -0.02 0.00 3.41 -1.26 -5.08 113.62 116.71 2hr9 n SER 53 Ca -0.14 -2.77 -0.18 0.00 -0.26 0.00 0.00 58.87 55.52 2hr9 n SER 53 Cb 0.44 0.76 -0.14 0.00 -0.26 0.00 0.00 64.21 65.01 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 -1.47 1.10 -2.83 7.33 0.00 -1.26 -4.61 120.51 118.77 2hr9 n ALA 54 Ca -0.14 -0.73 -0.44 0.00 0.00 0.00 0.00 53.44 52.14 2hr9 n ALA 54 Cb 0.50 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.35 2hr9 n ALA 54 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2hr9 n GLU 55 N -3.34 3.33 -3.15 0.00 1.02 -1.26 -4.81 120.64 112.42 2hr9 n GLU 55 Ca -0.32 -3.68 0.05 0.00 -0.02 0.00 0.00 57.16 53.20 2hr9 n GLU 55 Cb 1.04 -3.16 -0.01 0.00 -0.02 0.00 0.00 31.44 29.29 2hr9 n GLU 55 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2hr9 s GLY 56 N 3.16 -0.76 0.66 0.62 0.00 -1.26 -5.18 107.32 104.56 2hr9 s GLY 56 Ca 0.46 2.25 -0.11 0.00 0.00 0.00 0.00 44.72 47.32 2hr9 s GLY 56 CO 0.02 3.97 0.53 -1.55 0.00 0.00 0.00 173.10 176.07 2hr9 n PRO 57 N 5.26 -2.42 -2.56 2.90 -0.04 -1.26 -5.02 135.00 131.86 2hr9 n PRO 57 Ca 0.03 -0.86 -0.27 0.00 -0.04 0.00 0.00 63.50 62.36 2hr9 n PRO 57 Cb 0.56 -0.87 0.01 0.00 -0.04 0.00 0.00 33.50 33.16 2hr9 n PRO 57 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2hr9 s GLU 58 N -4.22 3.40 0.00 0.54 8.01 -1.26 -5.07 118.70 120.10 2hr9 s GLU 58 Ca 0.36 0.16 0.00 0.00 0.01 0.00 0.00 54.97 55.50 2hr9 s GLU 58 Cb -0.04 -2.35 0.00 0.00 -4.31 0.00 0.00 34.13 27.43 2hr9 s GLU 58 CO 0.28 -0.33 0.00 0.41 0.01 0.00 0.00 175.26 175.63 2hr9 n GLY 59 N -2.35 0.37 2.81 -1.39 0.00 -1.26 -5.17 105.19 98.21 2hr9 n GLY 59 Ca 0.02 0.62 -0.17 0.00 0.00 0.00 0.00 46.02 46.49 2hr9 n GLY 59 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2hr9 s GLU 60 N 0.00 0.25 -1.15 1.61 2.56 -1.26 -5.08 118.70 115.63 2hr9 s GLU 60 Ca 0.00 0.09 -0.19 0.00 0.00 0.00 0.00 54.97 54.87 2hr9 s GLU 60 Cb 0.00 -0.45 0.08 0.00 2.00 0.00 0.00 34.13 35.77 2hr9 s GLU 60 CO 0.00 -0.14 1.53 0.20 -0.56 0.00 0.00 175.26 176.29 2hr9 s GLY 61 N 1.03 1.65 0.34 -1.50 0.00 -1.26 -4.59 107.32 103.00 2hr9 s GLY 61 Ca -0.10 -2.74 0.03 0.00 0.00 0.00 0.00 44.72 41.91 2hr9 s GLY 61 CO -0.02 2.54 0.12 2.41 0.00 0.00 0.00 173.10 178.15 2hr9 n THR 62 N 6.21 0.00 -3.83 0.90 -1.04 -1.26 -5.03 114.28 110.23 2hr9 n THR 62 Ca 0.39 -1.97 -0.28 0.00 -2.04 0.00 0.00 64.05 60.15 2hr9 n THR 62 Cb 0.48 0.69 -0.16 0.00 -1.82 0.00 0.00 70.33 69.51 2hr9 n THR 62 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2hr9 s GLU 63 N -3.30 1.11 -0.15 -2.82 2.02 -1.26 -2.40 118.70 111.90 2hr9 s GLU 63 Ca 0.16 -0.47 -0.30 0.00 0.02 0.00 0.00 54.97 54.38 2hr9 s GLU 63 Cb 0.01 -1.99 0.13 0.00 0.10 0.00 0.00 34.13 32.38 2hr9 s GLU 63 CO 0.12 -0.50 1.04 0.45 0.02 0.00 0.00 175.26 176.38 2hr9 s SER 64 N 1.72 -0.31 0.46 -0.19 0.15 -1.21 -4.89 113.70 109.44 2hr9 s SER 64 Ca -0.00 0.24 0.00 0.00 0.70 0.00 0.00 55.95 56.89 2hr9 s SER 64 Cb -0.16 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.42 2hr9 s SER 64 CO -0.07 -0.35 0.00 0.41 1.20 0.00 0.00 173.24 174.43 2hr9 n THR 65 N 0.43 -4.86 -4.06 6.45 -1.04 -1.26 -4.09 114.28 105.84 2hr9 n THR 65 Ca -0.08 2.15 -0.24 0.00 -2.04 0.00 0.00 64.05 63.84 2hr9 n THR 65 Cb 0.59 -2.96 -0.17 0.00 -1.82 0.00 0.00 70.33 65.97 2hr9 n THR 65 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2hr9 s VAL 66 N -3.18 0.84 -0.09 12.58 1.01 -1.26 -4.19 120.40 126.12 2hr9 s VAL 66 Ca 0.00 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 61.80 2hr9 s VAL 66 Cb 0.00 -0.86 -0.01 0.00 0.00 0.00 0.00 36.38 35.51 2hr9 s VAL 66 CO 0.00 0.32 -0.21 -0.63 0.00 0.00 0.00 175.10 174.58 2hr9 s ILE 67 N 1.41 2.39 0.00 2.22 -1.09 -1.06 -4.89 121.20 120.19 2hr9 s ILE 67 Ca -0.02 -0.92 0.00 0.00 -2.23 0.00 0.00 60.65 57.49 2hr9 s ILE 67 Cb -0.13 -1.93 -0.00 0.00 -1.58 0.00 0.00 42.46 38.82 2hr9 s ILE 67 CO -0.04 0.56 -0.01 -0.89 -1.23 0.00 0.00 174.94 173.33 2hr9 s THR 68 N 0.08 0.10 -0.00 2.92 2.01 -1.26 0.20 115.64 119.69 2hr9 s THR 68 Ca -0.09 -0.09 -0.28 0.00 0.31 0.00 0.00 61.69 61.54 2hr9 s THR 68 Cb -0.15 -0.10 0.10 0.00 0.01 0.00 0.00 72.50 72.36 2hr9 s THR 68 CO 0.06 0.01 1.27 -0.83 -0.69 0.00 0.00 174.62 174.43 2hr9 s GLY 69 N -0.09 -0.18 0.35 4.40 0.00 -0.97 -4.96 107.32 105.88 2hr9 s GLY 69 Ca -0.00 0.18 -0.28 0.00 0.00 0.00 0.00 44.72 44.63 2hr9 s GLY 69 CO -0.00 3.89 1.25 0.14 0.00 0.00 0.00 173.10 178.38 2hr9 s VAL 70 N -2.14 2.88 -0.00 1.40 1.01 -1.26 0.20 120.40 122.50 2hr9 s VAL 70 Ca 0.25 0.84 -0.24 0.00 0.00 0.00 0.00 61.98 62.83 2hr9 s VAL 70 Cb 0.01 -3.52 -0.14 0.00 0.00 0.00 0.00 36.38 32.73 2hr9 s VAL 70 CO -0.01 0.16 1.02 -0.78 0.00 0.00 0.00 175.10 175.50 2hr9 h ASP 71 N 3.15 -0.63 -0.77 3.32 1.82 -1.46 -2.06 116.42 119.79 2hr9 h ASP 71 Ca -0.49 -0.02 0.17 0.00 -0.39 0.00 0.00 57.03 56.29 2hr9 h ASP 71 Cb 1.23 0.16 -0.05 0.00 0.68 0.00 0.00 39.33 41.35 2hr9 h ASP 71 CO 0.64 -0.24 0.52 0.16 -1.61 0.00 0.00 179.24 178.71 2hr9 h ILE 72 N -1.13 0.75 -0.09 2.25 3.07 -1.93 0.14 117.51 120.58 2hr9 h ILE 72 Ca -0.08 -0.12 -0.16 0.00 1.55 0.00 0.00 64.86 66.05 2hr9 h ILE 72 Cb 0.62 0.36 -0.01 0.00 -0.27 0.00 0.00 36.82 37.52 2hr9 h ILE 72 CO 0.13 0.07 -0.63 0.58 -1.05 0.00 0.00 178.15 177.24 2hr9 h VAL 73 N 0.36 1.37 0.13 0.16 2.07 -1.92 0.12 116.25 118.54 2hr9 h VAL 73 Ca 0.38 -2.00 -0.29 0.00 0.82 0.00 0.00 66.70 65.61 2hr9 h VAL 73 Cb 0.97 1.99 0.03 0.00 -1.52 0.00 0.00 31.29 32.76 2hr9 h VAL 73 CO -0.12 0.60 -1.25 0.24 0.02 0.00 0.00 177.57 177.07 2hr9 h MET 74 N 0.24 0.55 0.00 1.57 2.86 -0.13 0.15 114.93 120.19 2hr9 h MET 74 Ca -0.01 -0.76 -0.20 0.00 -2.06 0.00 0.00 59.70 56.66 2hr9 h MET 74 Cb 1.16 0.26 -0.03 0.00 0.06 0.00 0.00 31.60 33.05 2hr9 h MET 74 CO 0.10 1.34 -1.04 -2.95 1.06 0.00 0.00 176.91 175.43 2hr9 h ASN 75 N 0.23 0.00 0.02 1.22 7.08 -0.87 -3.24 115.58 120.02 2hr9 h ASN 75 Ca -0.18 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.04 2hr9 h ASN 75 Cb 1.92 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 38.16 2hr9 h ASN 75 CO 0.23 0.89 -0.08 1.41 -2.08 0.00 0.00 177.43 177.81 2hr9 n HIS 76 N -3.26 0.00 -2.48 4.14 8.25 0.42 -4.93 115.22 117.36 2hr9 n HIS 76 Ca -0.03 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.24 2hr9 n HIS 76 Cb 0.92 -0.02 -0.01 0.00 1.12 0.00 0.00 29.99 32.00 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 0.35 -1.19 -1.72 4.41 8.25 -0.69 -4.08 115.22 120.55 2hr9 n HIS 77 Ca 0.16 0.05 -0.43 0.00 -0.26 0.00 0.00 57.72 57.24 2hr9 n HIS 77 Cb 0.43 -3.73 -0.02 0.00 1.12 0.00 0.00 29.99 27.78 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 -3.07 3.89 -4.30 2.41 4.77 -0.04 -3.97 117.00 116.69 2hr9 n LEU 78 Ca -0.21 1.14 -0.32 0.00 -0.03 0.00 0.00 56.01 56.59 2hr9 n LEU 78 Cb 0.66 -1.53 -0.16 0.00 -2.33 0.00 0.00 43.42 40.06 2hr9 n LEU 78 CO 0.28 -0.09 -0.53 -1.10 -1.33 0.00 0.00 177.39 174.62 2hr9 s GLN 79 N -0.44 2.73 -0.08 3.23 -0.21 0.19 -4.87 119.66 120.22 2hr9 s GLN 79 Ca 0.66 -0.85 -0.22 0.00 0.02 0.00 0.00 55.36 54.97 2hr9 s GLN 79 Cb -0.55 -2.27 -0.04 0.00 1.00 0.00 0.00 33.01 31.15 2hr9 s GLN 79 CO 0.49 0.36 0.66 -2.00 -2.12 0.00 0.00 175.29 172.67 2hr9 s GLU 80 N -0.09 4.41 -0.12 2.91 2.12 -1.26 0.11 118.70 126.79 2hr9 s GLU 80 Ca -0.05 0.79 0.02 0.00 0.36 0.00 0.00 54.97 56.10 2hr9 s GLU 80 Cb -0.14 -3.45 0.01 0.00 0.26 0.00 0.00 34.13 30.81 2hr9 s GLU 80 CO 0.04 0.07 -0.19 -0.08 -0.54 0.00 0.00 175.26 174.57 2hr9 s THR 81 N 0.80 1.76 0.78 -1.70 -1.32 -0.23 -4.97 115.64 110.76 2hr9 s THR 81 Ca 0.35 -0.81 -0.11 0.00 -1.21 0.00 0.00 61.69 59.91 2hr9 s THR 81 Cb -0.17 -1.57 0.06 0.00 -1.51 0.00 0.00 72.50 69.31 2hr9 s THR 81 CO 0.16 0.49 1.11 -0.44 -2.21 0.00 0.00 174.62 173.73 2hr9 s SER 82 N 0.80 4.33 -0.12 8.08 0.01 -1.26 -4.27 113.70 121.27 2hr9 s SER 82 Ca -0.09 1.93 -0.30 0.00 1.31 0.00 0.00 55.95 58.79 2hr9 s SER 82 Cb -0.16 -2.54 0.11 0.00 0.21 0.00 0.00 66.02 63.64 2hr9 s SER 82 CO 0.00 -2.15 0.88 0.12 0.41 0.00 0.00 173.24 172.50 2hr9 s PHE 83 N -2.74 -0.48 0.39 2.43 5.36 -1.26 -5.06 117.98 116.61 2hr9 s PHE 83 Ca 0.63 0.84 -0.04 0.00 -0.96 0.00 0.00 56.93 57.40 2hr9 s PHE 83 Cb -0.19 0.43 -0.04 0.00 -0.34 0.00 0.00 43.02 42.88 2hr9 s PHE 83 CO 0.54 -0.44 0.66 0.99 -1.46 0.00 0.00 175.22 175.50 2hr9 s THR 84 N -1.10 4.98 0.09 0.12 2.01 -1.26 -4.95 115.64 115.53 2hr9 s THR 84 Ca -0.05 0.00 -0.26 0.00 0.31 0.00 0.00 61.69 61.69 2hr9 s THR 84 Cb -0.00 -3.82 -0.15 0.00 0.01 0.00 0.00 72.50 68.53 2hr9 s THR 84 CO 0.05 -0.60 1.69 0.11 -0.69 0.00 0.00 174.62 175.18 2hr9 h LYS 85 N 0.84 -0.32 -0.49 4.92 6.56 -2.01 0.20 116.57 126.26 2hr9 h LYS 85 Ca -0.48 0.02 -0.02 0.00 -1.06 0.00 0.00 60.65 59.11 2hr9 h LYS 85 Cb 1.20 0.07 -0.02 0.00 -0.57 0.00 0.00 32.23 32.91 2hr9 h LYS 85 CO 0.63 -0.21 0.24 1.05 -2.06 0.00 0.00 179.45 179.09 2hr9 h GLU 86 N -0.33 0.70 -0.83 3.15 4.11 -2.01 -2.56 114.58 116.82 2hr9 h GLU 86 Ca -0.02 -0.10 0.04 0.00 0.07 0.00 0.00 59.36 59.34 2hr9 h GLU 86 Cb 0.27 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 2hr9 h GLU 86 CO 0.03 0.59 0.54 0.00 0.07 0.00 0.00 179.01 180.24 2hr9 h ALA 87 N 1.08 1.51 -0.87 1.06 0.00 -1.92 -1.63 119.26 118.48 2hr9 h ALA 87 Ca 0.17 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2hr9 h ALA 87 Cb 0.12 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 2hr9 h ALA 87 CO -0.02 0.41 0.58 -0.92 0.00 0.00 0.00 179.25 179.30 2hr9 h TYR 88 N 1.01 1.10 -0.17 0.00 3.20 -0.54 0.39 116.97 121.95 2hr9 h TYR 88 Ca 0.33 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.25 2hr9 h TYR 88 Cb 0.06 -0.37 -0.03 0.00 1.54 0.00 0.00 36.73 37.93 2hr9 h TYR 88 CO -0.00 0.69 0.00 0.87 -1.64 0.00 0.00 178.16 178.08 2hr9 h LYS 89 N 1.18 0.06 0.00 1.82 1.57 -1.12 0.34 116.57 120.42 2hr9 h LYS 89 Ca 0.32 -0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 59.00 2hr9 h LYS 89 Cb -0.13 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 2hr9 h LYS 89 CO -0.07 0.04 -0.49 0.87 -0.57 0.00 0.00 179.45 179.23 2hr9 h LYS 90 N 0.06 0.00 -0.22 3.15 1.57 -1.35 -3.07 116.57 116.72 2hr9 h LYS 90 Ca 0.08 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 2hr9 h LYS 90 Cb 0.10 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 2hr9 h LYS 90 CO -0.13 0.49 -0.03 -0.92 -0.57 0.00 0.00 179.45 178.29 2hr9 h TYR 91 N 0.00 0.45 -0.90 -1.35 3.20 0.89 -2.31 116.97 116.95 2hr9 h TYR 91 Ca -0.00 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.78 2hr9 h TYR 91 Cb 0.99 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 39.11 2hr9 h TYR 91 CO 0.00 0.62 0.57 0.97 -1.64 0.00 0.00 178.16 178.68 2hr9 h ILE 92 N 0.16 1.24 -0.34 1.81 6.09 -0.33 0.31 117.51 126.45 2hr9 h ILE 92 Ca 0.06 -0.48 -0.00 0.00 -1.37 0.00 0.00 64.86 63.06 2hr9 h ILE 92 Cb 0.46 -0.06 -0.02 0.00 0.47 0.00 0.00 36.82 37.67 2hr9 h ILE 92 CO 0.02 0.24 0.19 0.50 -3.07 0.00 0.00 178.15 176.03 2hr9 h LYS 93 N 1.24 0.47 -0.27 2.19 1.63 -1.45 0.62 116.57 121.00 2hr9 h LYS 93 Ca 0.33 -0.05 -0.18 0.00 -0.85 0.00 0.00 60.65 59.90 2hr9 h LYS 93 Cb -0.10 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 31.44 2hr9 h LYS 93 CO -0.07 0.38 -0.54 0.22 -3.45 0.00 0.00 179.45 175.99 2hr9 h ASP 94 N 0.43 0.89 -0.07 4.20 1.82 -1.01 -2.03 116.42 120.64 2hr9 h ASP 94 Ca 0.12 -0.47 -0.20 0.00 -0.39 0.00 0.00 57.03 56.08 2hr9 h ASP 94 Cb 0.04 -0.25 0.01 0.00 0.68 0.00 0.00 39.33 39.81 2hr9 h ASP 94 CO -0.02 1.25 -0.75 0.10 -1.61 0.00 0.00 179.24 178.21 2hr9 h TYR 95 N 0.62 0.90 -0.14 0.28 -0.00 -0.25 -2.95 116.97 115.42 2hr9 h TYR 95 Ca 0.01 -0.44 -0.06 0.00 0.00 0.00 0.00 58.73 58.25 2hr9 h TYR 95 Cb 1.13 -0.12 -0.01 0.00 0.00 0.00 0.00 36.73 37.73 2hr9 h TYR 95 CO 0.07 1.25 -0.16 0.00 -0.00 0.00 0.00 178.16 179.32 2hr9 h MET 96 N 0.29 0.23 -0.52 0.10 -0.00 0.21 -2.65 114.93 112.60 2hr9 h MET 96 Ca -0.07 -0.06 -0.05 0.00 -0.00 0.00 0.00 59.70 59.52 2hr9 h MET 96 Cb 1.40 -0.03 -0.02 0.00 -0.00 0.00 0.00 31.60 32.95 2hr9 h MET 96 CO 0.15 0.40 0.14 0.87 -0.00 0.00 0.00 176.91 178.47 2hr9 h LYS 97 N 0.22 0.82 -0.72 -0.10 1.79 -1.33 0.68 116.57 117.92 2hr9 h LYS 97 Ca 0.04 -0.19 0.06 0.00 -2.18 0.00 0.00 60.65 58.38 2hr9 h LYS 97 Cb 0.43 -0.11 -0.06 0.00 -1.58 0.00 0.00 32.23 30.91 2hr9 h LYS 97 CO 0.03 0.78 0.42 0.77 -1.08 0.00 0.00 179.45 180.37 2hr9 h SER 98 N 0.72 0.64 0.22 0.86 0.02 -1.30 0.18 113.55 114.89 2hr9 h SER 98 Ca 0.16 0.02 -0.30 0.00 -0.84 0.00 0.00 61.79 60.83 2hr9 h SER 98 Cb 0.32 -0.11 0.04 0.00 0.14 0.00 0.00 62.40 62.79 2hr9 h SER 98 CO -0.00 0.41 -1.33 0.40 -1.14 0.00 0.00 176.83 175.18 2hr9 h ILE 99 N 0.78 1.33 -0.06 3.27 2.04 -1.40 -2.73 117.51 120.74 2hr9 h ILE 99 Ca 0.32 -2.64 0.03 0.00 1.00 0.00 0.00 64.86 63.57 2hr9 h ILE 99 Cb 0.18 3.04 -0.04 0.00 -0.74 0.00 0.00 36.82 39.26 2hr9 h ILE 99 CO -0.18 0.78 -0.14 0.50 0.00 0.00 0.00 178.15 179.12 2hr9 h LYS 100 N 0.06 -0.20 -0.34 2.37 3.11 0.70 0.49 116.57 122.77 2hr9 h LYS 100 Ca -0.23 0.01 -0.03 0.00 -2.81 0.00 0.00 60.65 57.60 2hr9 h LYS 100 Cb 2.04 0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 33.30 2hr9 h LYS 100 CO 0.25 -0.13 0.09 0.78 -2.81 0.00 0.00 179.45 177.63 2hr9 h GLY 101 N -0.20 0.58 1.00 5.01 0.00 -0.77 -0.63 103.07 108.04 2hr9 h GLY 101 Ca 0.07 -0.35 0.01 0.00 0.00 0.00 0.00 47.33 47.06 2hr9 h GLY 101 CO -0.18 0.33 0.53 1.70 0.00 0.00 0.00 176.54 178.92 2hr9 h LYS 102 N 0.39 1.05 -0.43 4.80 1.63 -1.17 -1.75 116.57 121.10 2hr9 h LYS 102 Ca 0.11 -0.06 -0.08 0.00 -0.85 0.00 0.00 60.65 59.77 2hr9 h LYS 102 Cb 0.28 -0.24 -0.02 0.00 -0.60 0.00 0.00 32.23 31.65 2hr9 h LYS 102 CO -0.00 0.69 -0.05 1.25 -3.45 0.00 0.00 179.45 177.89 2hr9 h LEU 103 N 1.08 0.70 -2.11 5.20 5.85 0.18 -2.03 115.31 124.17 2hr9 h LEU 103 Ca 0.30 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.88 2hr9 h LEU 103 Cb -0.11 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.72 2hr9 h LEU 103 CO -0.07 0.80 0.11 -0.33 -0.34 0.00 0.00 178.44 178.61 2hr9 h GLU 104 N 0.67 0.00 0.00 1.25 5.08 -0.21 1.44 114.58 122.81 2hr9 h GLU 104 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2hr9 h GLU 104 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2hr9 h GLU 104 CO 0.03 0.00 -0.84 0.93 -1.00 0.00 0.00 179.01 178.13 2hr9 h GLU 105 N 0.00 0.00 0.00 2.33 5.08 -1.06 -3.33 114.58 117.60 2hr9 h GLU 105 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2hr9 h GLU 105 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2hr9 h GLU 105 CO -0.00 0.00 -0.43 1.04 -1.00 0.00 0.00 179.01 178.62 2hr9 n GLN 106 N -2.64 0.23 -3.12 2.33 6.02 -0.22 -4.89 117.38 115.10 2hr9 n GLN 106 Ca 0.01 0.09 -0.25 0.00 -0.01 0.00 0.00 57.00 56.84 2hr9 n GLN 106 Cb 0.53 -0.88 -0.05 0.00 1.02 0.00 0.00 30.24 30.86 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 -3.82 2.43 0.22 -1.09 1.74 0.48 -4.91 116.66 111.70 2hr9 n ARG 107 Ca -0.06 -4.40 0.16 0.00 -0.77 0.00 0.00 57.85 52.78 2hr9 n ARG 107 Cb 0.23 -2.05 0.68 0.00 -1.02 0.00 0.00 32.46 30.29 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 3.35 0.00 0.00 5.56 0.13 -1.23 0.49 132.00 140.30 2hr9 h PRO 108 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2hr9 h PRO 108 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 2hr9 h PRO 108 CO 0.73 0.00 0.00 1.49 -0.23 0.00 0.00 178.00 179.99 2hr9 h GLU 109 N 0.00 0.00 -0.06 0.86 4.81 -1.91 -2.88 114.58 115.40 2hr9 h GLU 109 Ca 0.10 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 2hr9 h GLU 109 Cb 1.11 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.49 2hr9 h GLU 109 CO -0.00 0.00 0.00 0.54 -0.73 0.00 0.00 179.01 178.82 2hr9 n ARG 110 N -2.33 1.39 -0.05 1.92 5.12 0.17 -4.52 116.66 118.36 2hr9 n ARG 110 Ca 0.03 -1.54 -0.07 0.00 -1.93 0.00 0.00 57.85 54.34 2hr9 n ARG 110 Cb 0.31 -1.32 0.11 0.00 -1.16 0.00 0.00 32.46 30.40 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 3.20 1.28 0.08 1.55 -1.51 -1.48 -2.98 116.25 116.40 2hr9 h VAL 111 Ca 0.00 -1.39 -0.00 0.00 -1.23 0.00 0.00 66.70 64.08 2hr9 h VAL 111 Cb 0.69 1.33 0.00 0.00 -2.13 0.00 0.00 31.29 31.18 2hr9 h VAL 111 CO 0.00 0.45 -0.04 0.11 -1.23 0.00 0.00 177.57 176.86 2hr9 h LYS 112 N 0.58 -0.11 -0.91 5.19 1.57 -1.79 -1.55 116.57 119.56 2hr9 h LYS 112 Ca 0.07 0.01 0.14 0.00 -1.87 0.00 0.00 60.65 59.00 2hr9 h LYS 112 Cb 0.77 0.02 -0.09 0.00 0.08 0.00 0.00 32.23 33.02 2hr9 h LYS 112 CO 0.06 0.22 0.52 -1.35 -0.57 0.00 0.00 179.45 178.34 2hr9 h PRO 113 N -0.45 0.75 -0.38 3.15 0.11 -1.84 -0.93 132.00 132.41 2hr9 h PRO 113 Ca -0.01 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.93 2hr9 h PRO 113 Cb 0.38 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 2hr9 h PRO 113 CO 0.02 0.50 -0.27 0.35 -0.21 0.00 0.00 178.00 178.39 2hr9 h PHE 114 N 0.78 0.91 -0.32 0.65 3.57 -1.48 0.56 116.94 121.60 2hr9 h PHE 114 Ca 0.48 -0.23 0.06 0.00 3.53 0.00 0.00 57.97 61.81 2hr9 h PHE 114 Cb 0.59 -0.21 -0.06 0.00 2.79 0.00 0.00 35.95 39.06 2hr9 h PHE 114 CO -0.05 0.97 -0.06 0.52 -2.23 0.00 0.00 178.31 177.46 2hr9 h MET 115 N 0.68 0.02 0.03 1.11 2.86 -0.11 0.75 114.93 120.26 2hr9 h MET 115 Ca 0.08 -0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.56 2hr9 h MET 115 Cb 0.80 -0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.47 2hr9 h MET 115 CO 0.07 0.01 -0.64 1.15 1.06 0.00 0.00 176.91 178.56 2hr9 h THR 116 N 0.02 1.44 -0.61 2.22 2.02 -1.45 -3.04 112.91 113.50 2hr9 h THR 116 Ca 0.15 -2.16 0.02 0.00 0.77 0.00 0.00 66.41 65.19 2hr9 h THR 116 Cb 0.23 2.71 -0.04 0.00 -1.74 0.00 0.00 68.15 69.31 2hr9 h THR 116 CO -0.31 0.63 0.39 1.23 0.37 0.00 0.00 175.52 177.82 2hr9 h GLY 117 N -0.15 0.87 0.97 2.16 0.00 -0.63 0.71 103.07 107.00 2hr9 h GLY 117 Ca -0.09 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 46.94 2hr9 h GLY 117 CO 0.12 0.26 0.20 0.00 0.00 0.00 0.00 176.54 177.13 2hr9 h ALA 118 N 1.25 0.47 -0.05 3.60 0.00 0.42 0.64 119.26 125.59 2hr9 h ALA 118 Ca 0.24 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 2hr9 h ALA 118 Cb -0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2hr9 h ALA 118 CO -0.08 -0.00 -0.66 0.00 0.00 0.00 0.00 179.25 178.51 2hr9 h ALA 119 N 1.07 0.79 0.10 0.00 0.00 -1.36 -2.13 119.26 117.74 2hr9 h ALA 119 Ca 0.13 -0.58 -0.21 0.00 0.00 0.00 0.00 54.91 54.25 2hr9 h ALA 119 Cb 0.05 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 17.78 2hr9 h ALA 119 CO -0.02 0.77 -0.90 1.05 0.00 0.00 0.00 179.25 180.14 2hr9 h GLU 120 N 0.15 0.43 -0.58 0.00 4.11 0.72 -2.98 114.58 116.43 2hr9 h GLU 120 Ca -0.01 -0.60 -0.10 0.00 0.07 0.00 0.00 59.36 58.72 2hr9 h GLU 120 Cb 1.18 0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.62 2hr9 h GLU 120 CO 0.10 1.25 -0.02 0.37 0.07 0.00 0.00 179.01 180.78 2hr9 h GLN 121 N -0.10 1.03 -0.41 1.06 5.75 0.23 -2.73 115.11 119.95 2hr9 h GLN 121 Ca -0.14 -0.33 -0.02 0.00 -0.15 0.00 0.00 58.65 58.00 2hr9 h GLN 121 Cb 1.65 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 30.09 2hr9 h GLN 121 CO 0.17 1.02 0.17 0.97 -2.65 0.00 0.00 178.83 178.51 2hr9 h ILE 122 N 0.94 1.19 -0.16 2.39 -0.00 -1.48 -1.99 117.51 118.41 2hr9 h ILE 122 Ca 0.16 -0.59 0.01 0.00 -0.00 0.00 0.00 64.86 64.45 2hr9 h ILE 122 Cb 0.57 0.83 -0.01 0.00 -0.00 0.00 0.00 36.82 38.21 2hr9 h ILE 122 CO 0.03 0.22 0.11 0.11 -0.00 0.00 0.00 178.15 178.62 2hr9 h LYS 123 N 0.51 0.14 0.25 2.19 1.57 -1.42 0.73 116.57 120.54 2hr9 h LYS 123 Ca 0.14 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 2hr9 h LYS 123 Cb 0.18 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2hr9 h LYS 123 CO -0.01 0.10 -0.12 1.25 -0.57 0.00 0.00 179.45 180.09 2hr9 h HIS 124 N 0.15 -0.31 -0.76 -1.35 2.76 -1.08 -2.96 115.15 111.59 2hr9 h HIS 124 Ca 0.06 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.21 2hr9 h HIS 124 Cb 0.07 0.10 -0.04 0.00 1.55 0.00 0.00 27.41 29.10 2hr9 h HIS 124 CO -0.00 0.05 0.39 -0.84 -1.30 0.00 0.00 177.93 176.23 2hr9 h ILE 125 N -0.74 1.23 -0.99 6.26 3.07 -0.97 -2.37 117.51 123.00 2hr9 h ILE 125 Ca -0.03 -0.61 0.14 0.00 1.55 0.00 0.00 64.86 65.90 2hr9 h ILE 125 Cb 0.50 0.23 -0.09 0.00 -0.27 0.00 0.00 36.82 37.18 2hr9 h ILE 125 CO 0.06 0.27 0.61 -0.07 -1.05 0.00 0.00 178.15 177.96 2hr9 h LEU 126 N 1.07 0.86 -2.60 0.16 3.38 -0.87 0.66 115.31 117.97 2hr9 h LEU 126 Ca 0.27 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2hr9 h LEU 126 Cb 0.07 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2hr9 h LEU 126 CO -0.04 0.41 0.00 0.00 0.09 0.00 0.00 178.44 178.91 2hr9 h ALA 127 N 1.56 1.00 0.00 1.53 0.00 -1.25 -1.57 119.26 120.53 2hr9 h ALA 127 Ca 0.51 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.35 2hr9 h ALA 127 Cb 0.60 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.24 2hr9 h ALA 127 CO -0.30 0.00 -0.69 0.09 0.00 0.00 0.00 179.25 178.35 2hr9 n ASN 128 N -2.94 1.38 -0.31 0.00 3.02 0.19 -4.85 115.26 111.75 2hr9 n ASN 128 Ca -0.02 -3.01 0.13 0.00 -0.03 0.00 0.00 54.58 51.64 2hr9 n ASN 128 Cb 0.09 -0.42 0.30 0.00 -0.61 0.00 0.00 39.78 39.14 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 0.89 0.73 0.00 3.10 3.04 0.70 0.83 116.94 126.23 2hr9 h PHE 129 Ca -0.09 0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.90 2hr9 h PHE 129 Cb 1.38 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 39.71 2hr9 h PHE 129 CO 0.45 0.01 0.00 -0.22 -2.02 0.00 0.00 178.31 176.54 2hr9 h LYS 130 N 0.47 0.00 0.07 1.11 3.64 -1.86 -3.03 116.57 116.97 2hr9 h LYS 130 Ca 0.55 0.00 -0.37 0.00 -1.27 0.00 0.00 60.65 59.56 2hr9 h LYS 130 Cb 1.00 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.78 2hr9 h LYS 130 CO -0.49 0.00 -2.15 0.09 -2.27 0.00 0.00 179.45 174.63 2hr9 n ASN 131 N -2.36 1.85 -4.93 4.20 4.13 0.27 -4.96 115.26 113.47 2hr9 n ASN 131 Ca 0.01 0.10 -0.28 0.00 1.68 0.00 0.00 54.58 56.10 2hr9 n ASN 131 Cb 0.21 -0.54 -0.03 0.00 -1.54 0.00 0.00 39.78 37.88 2hr9 n ASN 131 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 2hr9 s TYR 132 N -2.55 3.49 0.18 3.10 2.02 -0.20 -4.88 117.35 118.52 2hr9 s TYR 132 Ca -0.24 0.30 0.10 0.00 -0.37 0.00 0.00 57.07 56.85 2hr9 s TYR 132 Cb 0.07 -1.81 -0.04 0.00 -0.40 0.00 0.00 41.96 39.78 2hr9 s TYR 132 CO 0.72 0.44 -0.20 -0.65 -1.57 0.00 0.00 175.55 174.29 2hr9 s GLN 133 N -3.16 1.37 -0.08 -0.62 -1.52 -1.20 -4.79 119.66 109.66 2hr9 s GLN 133 Ca 0.37 -1.47 -0.16 0.00 -1.95 0.00 0.00 55.36 52.16 2hr9 s GLN 133 Cb -0.11 -1.50 -0.05 0.00 -0.22 0.00 0.00 33.01 31.13 2hr9 s GLN 133 CO 0.28 0.31 0.41 -0.06 -0.25 0.00 0.00 175.29 175.99 2hr9 s PHE 134 N -1.99 3.59 0.06 0.91 0.08 -1.26 -2.05 117.98 117.31 2hr9 s PHE 134 Ca 0.18 0.87 0.03 0.00 0.12 0.00 0.00 56.93 58.14 2hr9 s PHE 134 Cb -0.06 -2.41 -0.03 0.00 -0.57 0.00 0.00 43.02 39.95 2hr9 s PHE 134 CO 0.08 0.37 -0.10 -0.06 -0.10 0.00 0.00 175.22 175.41 2hr9 s PHE 135 N -0.06 0.87 0.13 0.36 0.40 0.17 -1.06 117.98 118.79 2hr9 s PHE 135 Ca 0.23 -0.53 0.02 0.00 -0.60 0.00 0.00 56.93 56.05 2hr9 s PHE 135 Cb -0.15 -0.50 -0.04 0.00 0.51 0.00 0.00 43.02 42.83 2hr9 s PHE 135 CO 0.10 -0.04 -0.05 0.42 0.70 0.00 0.00 175.22 176.35 2hr9 s ILE 136 N -1.63 0.79 0.00 0.64 1.01 0.31 0.11 121.20 122.43 2hr9 s ILE 136 Ca -0.05 -1.98 0.00 0.00 0.00 0.00 0.00 60.65 58.63 2hr9 s ILE 136 Cb -0.08 -1.86 0.00 0.00 0.01 0.00 0.00 42.46 40.53 2hr9 s ILE 136 CO 0.01 -0.72 0.00 0.61 0.00 0.00 0.00 174.94 174.84 2hr9 n GLY 137 N -0.14 -3.29 0.00 6.18 0.00 -1.26 0.57 105.19 107.24 2hr9 n GLY 137 Ca -0.10 -1.25 0.10 0.00 0.00 0.00 0.00 46.02 44.77 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 -0.83 0.07 -0.07 1.61 0.28 -1.25 -2.94 120.64 117.50 2hr9 n GLU 138 Ca 0.00 0.15 -0.07 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 0.18 -3.76 -1.84 3.02 -1.26 -5.00 115.26 105.15 2hr9 n ASN 139 Ca 0.06 0.08 -0.26 0.00 -0.03 0.00 0.00 54.58 54.43 2hr9 n ASN 139 Cb 0.21 0.90 0.05 0.00 -0.61 0.00 0.00 39.78 40.32 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 -2.75 -6.20 -1.88 3.52 2.81 -1.15 -4.87 117.12 106.60 2hr9 n MET 140 Ca -0.26 0.68 -0.43 0.00 -1.81 0.00 0.00 57.70 55.89 2hr9 n MET 140 Cb 1.06 -5.58 -0.03 0.00 -0.71 0.00 0.00 33.22 27.97 2hr9 n MET 140 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2hr9 s ASN 141 N -3.56 6.15 0.49 7.83 4.22 -1.26 -4.87 114.94 123.94 2hr9 s ASN 141 Ca 0.49 1.93 0.17 0.00 -2.14 0.00 0.00 52.86 53.31 2hr9 s ASN 141 Cb -0.24 -2.53 1.19 0.00 1.28 0.00 0.00 41.25 40.96 2hr9 s ASN 141 CO 0.79 -1.40 2.07 -0.65 -2.04 0.00 0.00 177.10 175.88 2hr9 h PRO 142 N 11.84 0.00 -0.00 3.55 0.11 -1.94 -0.95 132.00 144.61 2hr9 h PRO 142 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 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 0.98 0.10 -0.18 -3.47 -0.21 0.00 0.00 178.00 175.22 2hr9 n ASP 143 N -4.32 0.34 -2.01 -2.05 -0.08 -1.26 -4.88 116.55 102.30 2hr9 n ASP 143 Ca -0.03 -0.17 0.00 0.00 -1.51 0.00 0.00 54.79 53.08 2hr9 n ASP 143 Cb 0.18 -0.12 0.00 0.00 2.34 0.00 0.00 41.12 43.52 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 1.40 -0.09 1.75 0.27 0.00 -0.36 -4.81 105.19 103.35 2hr9 n GLY 144 Ca 0.10 -1.80 -0.12 0.00 0.00 0.00 0.00 46.02 44.19 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 -0.77 -0.24 -4.23 1.61 0.00 -1.26 -4.84 117.12 107.39 2hr9 n MET 145 Ca 0.00 -1.05 -0.17 0.00 0.00 0.00 0.00 57.70 56.48 2hr9 n MET 145 Cb 0.00 -0.49 -0.11 0.00 0.00 0.00 0.00 33.22 32.62 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 -1.89 1.25 -0.28 3.17 1.01 -1.26 -4.90 120.40 117.50 2hr9 s VAL 146 Ca 0.32 -1.76 -0.00 0.00 0.00 0.00 0.00 61.98 60.54 2hr9 s VAL 146 Cb -0.01 -1.55 0.05 0.00 0.00 0.00 0.00 36.38 34.86 2hr9 s VAL 146 CO 0.22 -0.49 -0.05 0.00 0.00 0.00 0.00 175.10 174.78 2hr9 s ALA 147 N -2.38 2.71 -0.54 5.51 0.00 0.30 -4.72 121.76 122.64 2hr9 s ALA 147 Ca 0.10 -1.71 -0.24 0.00 0.00 0.00 0.00 51.96 50.10 2hr9 s ALA 147 Cb -0.03 -1.78 0.04 0.00 0.00 0.00 0.00 23.12 21.35 2hr9 s ALA 147 CO 0.02 -1.17 0.93 -0.51 0.00 0.00 0.00 175.76 175.03 2hr9 s LEU 148 N 1.21 4.12 -0.26 0.00 1.43 -1.13 0.44 118.68 124.49 2hr9 s LEU 148 Ca -0.06 -0.34 -0.20 0.00 -1.03 0.00 0.00 54.13 52.50 2hr9 s LEU 148 Cb -0.19 -2.84 -0.02 0.00 0.03 0.00 0.00 46.19 43.17 2hr9 s LEU 148 CO -0.03 -1.21 0.63 -0.22 0.23 0.00 0.00 176.35 175.75 2hr9 s LEU 149 N 3.90 4.07 0.17 1.79 2.96 -0.87 0.50 118.68 131.20 2hr9 s LEU 149 Ca 0.30 0.69 0.04 0.00 -0.22 0.00 0.00 54.13 54.94 2hr9 s LEU 149 Cb -0.13 -2.85 -0.05 0.00 0.50 0.00 0.00 46.19 43.67 2hr9 s LEU 149 CO 0.19 -0.38 -0.07 -1.81 -1.32 0.00 0.00 176.35 172.96 2hr9 s ASP 150 N 1.49 1.73 0.02 3.68 1.01 0.14 -3.23 116.67 121.51 2hr9 s ASP 150 Ca 0.26 -1.07 0.01 0.00 0.71 0.00 0.00 52.55 52.46 2hr9 s ASP 150 Cb -0.15 0.01 -0.04 0.00 1.01 0.00 0.00 42.92 43.75 2hr9 s ASP 150 CO 0.09 -0.40 0.07 -0.31 0.21 0.00 0.00 175.17 174.83 2hr9 s TYR 151 N -3.39 3.22 0.92 4.23 2.02 -1.26 0.12 117.35 123.21 2hr9 s TYR 151 Ca 0.20 0.15 -0.15 0.00 -0.37 0.00 0.00 57.07 56.89 2hr9 s TYR 151 Cb 0.04 -1.69 0.24 0.00 -0.40 0.00 0.00 41.96 40.14 2hr9 s TYR 151 CO 0.03 0.53 0.54 0.54 -1.57 0.00 0.00 175.55 175.61 2hr9 n ARG 152 N 1.01 -3.75 -0.33 -0.62 5.12 -0.44 -4.64 116.66 113.01 2hr9 n ARG 152 Ca -0.12 -0.90 0.03 0.00 -1.93 0.00 0.00 57.85 54.92 2hr9 n ARG 152 Cb 0.52 -1.19 0.17 0.00 -1.16 0.00 0.00 32.46 30.80 2hr9 n ARG 152 CO 0.00 0.00 0.00 1.49 -1.93 0.00 0.00 177.63 177.19 2hr9 h GLU 153 N 0.00 0.95 0.00 5.56 4.22 -2.00 0.97 114.58 124.28 2hr9 h GLU 153 Ca -0.24 -0.06 0.00 0.00 0.08 0.00 0.00 59.36 59.14 2hr9 h GLU 153 Cb 0.82 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2hr9 h GLU 153 CO 0.15 0.63 0.00 0.22 -2.18 0.00 0.00 179.01 177.82 2hr9 h ASP 154 N 0.97 0.00 -0.14 1.04 1.82 -1.96 -3.46 116.42 114.69 2hr9 h ASP 154 Ca 0.41 0.00 -0.05 0.00 -0.39 0.00 0.00 57.03 57.00 2hr9 h ASP 154 Cb 0.26 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.25 2hr9 h ASP 154 CO -0.20 0.00 -0.04 0.61 -1.61 0.00 0.00 179.24 177.99 2hr9 n GLY 155 N 0.34 0.51 0.47 -0.78 0.00 0.33 -4.94 105.19 101.13 2hr9 n GLY 155 Ca 0.03 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 -3.10 0.00 -1.51 1.61 0.31 -1.26 -4.82 118.33 109.55 2hr9 n VAL 156 Ca -0.02 0.12 -0.41 0.00 -0.01 0.00 0.00 64.34 64.01 2hr9 n VAL 156 Cb 0.15 -1.01 -0.07 0.00 -0.91 0.00 0.00 33.84 31.99 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 -2.10 0.03 -2.56 2.52 -1.04 -1.26 -4.71 114.28 105.16 2hr9 n THR 157 Ca 0.00 -0.46 -0.42 0.00 -2.04 0.00 0.00 64.05 61.13 2hr9 n THR 157 Cb 0.00 -1.96 -0.03 0.00 -1.82 0.00 0.00 70.33 66.52 2hr9 n THR 157 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2hr9 s PRO 158 N 7.80 4.44 -0.05 -2.82 0.02 -1.26 -1.33 135.00 141.80 2hr9 s PRO 158 Ca 1.10 1.58 0.04 0.00 0.02 0.00 0.00 61.00 63.74 2hr9 s PRO 158 Cb -0.61 -3.47 0.00 0.00 0.02 0.00 0.00 34.50 30.44 2hr9 s PRO 158 CO 0.38 -0.26 -0.16 1.52 -0.33 0.00 0.00 177.00 178.15 2hr9 s TYR 159 N 1.53 1.68 -0.10 6.54 1.13 0.32 0.58 117.35 129.02 2hr9 s TYR 159 Ca 0.54 -0.54 -0.04 0.00 -1.41 0.00 0.00 57.07 55.61 2hr9 s TYR 159 Cb -0.24 -1.16 -0.04 0.00 -1.10 0.00 0.00 41.96 39.43 2hr9 s TYR 159 CO 0.25 -0.22 0.07 -1.64 -2.51 0.00 0.00 175.55 171.50 2hr9 s MET 160 N 0.26 3.21 -0.37 -3.49 -1.94 0.62 0.27 119.30 117.86 2hr9 s MET 160 Ca -0.08 -0.27 -0.17 0.00 -1.71 0.00 0.00 55.69 53.46 2hr9 s MET 160 Cb -0.13 -2.99 -0.00 0.00 2.01 0.00 0.00 34.83 33.72 2hr9 s MET 160 CO 0.03 0.74 0.44 0.42 -0.01 0.00 0.00 175.02 176.65 2hr9 s ILE 161 N -0.96 5.08 -0.08 2.53 1.01 0.18 0.31 121.20 129.27 2hr9 s ILE 161 Ca 0.14 0.07 0.04 0.00 0.00 0.00 0.00 60.65 60.90 2hr9 s ILE 161 Cb -0.12 -3.94 -0.01 0.00 0.01 0.00 0.00 42.46 38.40 2hr9 s ILE 161 CO 0.03 -0.23 -0.20 -0.36 0.00 0.00 0.00 174.94 174.18 2hr9 s PHE 162 N 2.21 2.60 -0.02 3.97 0.08 0.11 -2.83 117.98 124.10 2hr9 s PHE 162 Ca 0.15 -0.66 -0.30 0.00 0.12 0.00 0.00 56.93 56.24 2hr9 s PHE 162 Cb -0.16 -1.69 -0.03 0.00 -0.57 0.00 0.00 43.02 40.57 2hr9 s PHE 162 CO 0.13 -0.18 1.01 -0.06 -0.10 0.00 0.00 175.22 176.02 2hr9 s PHE 163 N -0.05 3.60 -0.02 0.36 0.40 -1.26 0.12 117.98 121.12 2hr9 s PHE 163 Ca -0.05 1.63 -0.24 0.00 -0.60 0.00 0.00 56.93 57.66 2hr9 s PHE 163 Cb -0.14 -3.17 -0.18 0.00 0.51 0.00 0.00 43.02 40.04 2hr9 s PHE 163 CO 0.04 -0.21 1.12 -0.22 0.70 0.00 0.00 175.22 176.65 2hr9 h LYS 164 N 6.88 -0.18 -1.02 0.44 3.64 -1.60 -3.05 116.57 121.68 2hr9 h LYS 164 Ca -0.39 0.01 0.25 0.00 -1.27 0.00 0.00 60.65 59.25 2hr9 h LYS 164 Cb 1.20 0.04 -0.10 0.00 -0.41 0.00 0.00 32.23 32.96 2hr9 h LYS 164 CO 0.78 0.24 0.64 -0.44 -2.27 0.00 0.00 179.45 178.40 2hr9 h ASP 165 N -0.70 0.56 -0.78 4.20 3.32 -1.88 0.45 116.42 121.58 2hr9 h ASP 165 Ca -0.02 0.10 -0.38 0.00 0.02 0.00 0.00 57.03 56.75 2hr9 h ASP 165 Cb 0.51 0.01 -0.22 0.00 0.22 0.00 0.00 39.33 39.84 2hr9 h ASP 165 CO 0.03 0.12 0.48 0.61 -1.72 0.00 0.00 179.24 178.76 2hr9 n GLY 166 N -1.41 3.90 3.15 2.75 0.00 -1.21 -4.89 105.19 107.48 2hr9 n GLY 166 Ca 0.25 -0.89 -0.12 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 -2.68 1.18 0.14 0.99 2.96 0.16 -0.15 118.68 121.28 2hr9 s LEU 167 Ca 0.47 0.15 0.06 0.00 -0.22 0.00 0.00 54.13 54.59 2hr9 s LEU 167 Cb 0.39 0.89 -0.04 0.00 0.50 0.00 0.00 46.19 47.93 2hr9 s LEU 167 CO 0.10 -0.27 0.00 -1.61 -1.32 0.00 0.00 176.35 173.25 2hr9 s GLU 168 N -0.75 2.47 -0.02 1.98 0.41 0.23 -4.78 118.70 118.23 2hr9 s GLU 168 Ca -0.08 -0.98 0.06 0.00 -0.41 0.00 0.00 54.97 53.55 2hr9 s GLU 168 Cb -0.05 -2.44 -0.01 0.00 -1.78 0.00 0.00 34.13 29.85 2hr9 s GLU 168 CO 0.02 0.49 -0.20 -1.64 -0.49 0.00 0.00 175.26 173.44 2hr9 s MET 169 N -2.67 1.76 -0.15 1.61 -1.94 -1.26 -1.92 119.30 114.74 2hr9 s MET 169 Ca 0.27 -0.72 -0.08 0.00 -1.71 0.00 0.00 55.69 53.44 2hr9 s MET 169 Cb -0.10 -1.64 0.05 0.00 2.01 0.00 0.00 34.83 35.15 2hr9 s MET 169 CO 0.18 0.40 0.36 -1.83 -0.01 0.00 0.00 175.02 174.12 2hr9 s GLU 170 N -0.35 0.34 -0.32 2.03 -1.05 -1.10 -4.95 118.70 113.30 2hr9 s GLU 170 Ca 0.05 0.69 -0.26 0.00 -0.15 0.00 0.00 54.97 55.30 2hr9 s GLU 170 Cb -0.09 -0.04 0.01 0.00 -0.44 0.00 0.00 34.13 33.57 2hr9 s GLU 170 CO 0.00 -0.15 0.92 0.15 0.95 0.00 0.00 175.26 177.12 2hr9 s LYS 171 N 1.27 3.99 0.47 -4.83 1.02 -1.26 -0.43 119.74 119.97 2hr9 s LYS 171 Ca -0.09 0.78 0.00 0.00 0.02 0.00 0.00 55.97 56.68 2hr9 s LYS 171 Cb -0.09 -3.74 0.00 0.00 -0.52 0.00 0.00 37.83 33.49 2hr9 s LYS 171 CO -0.11 -0.79 0.69 0.00 -0.92 0.00 0.00 175.35 174.22 2hr9 n LEU 173 N -2.12 1.07 0.00 0.00 -0.00 -1.26 -4.03 117.00 110.66 2hr9 n LEU 173 Ca 0.02 -0.02 0.00 0.00 -0.00 0.00 0.00 56.01 56.02 2hr9 n LEU 173 Cb 0.58 -0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.00 2hr9 n LEU 173 CO 0.47 0.36 0.00 1.21 -0.00 0.00 0.00 177.39 179.43