#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h26 n MET 1 N 0.00 2.08 -0.40 -1.46 0.00 -1.26 -4.50 117.12 111.58 1h26 n MET 1 Ca 0.00 -1.62 0.34 0.00 0.00 0.00 0.00 57.70 56.43 1h26 n MET 1 Cb 0.00 -1.45 0.67 0.00 0.00 0.00 0.00 33.22 32.43 1h26 n MET 1 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 1h26 h GLU 2 N 3.34 0.13 0.00 0.03 4.81 -2.07 -1.53 114.58 119.29 1h26 h GLU 2 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1h26 h GLU 2 Cb 0.73 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.08 1h26 h GLU 2 CO 0.00 0.09 0.00 0.09 -0.73 0.00 0.00 179.01 178.46 1h26 n ASN 3 N -4.41 0.00 -4.51 1.04 3.02 -1.26 -4.80 115.26 104.34 1h26 n ASN 3 Ca 0.31 -0.26 -0.34 0.00 -0.03 0.00 0.00 54.58 54.26 1h26 n ASN 3 Cb 1.29 -0.24 -0.12 0.00 -0.61 0.00 0.00 39.78 40.10 1h26 n ASN 3 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1h26 s PHE 4 N -2.49 2.99 -0.19 3.10 0.08 -0.58 -0.57 117.98 120.33 1h26 s PHE 4 Ca 0.31 -0.25 -0.05 0.00 0.12 0.00 0.00 56.93 57.05 1h26 s PHE 4 Cb 0.20 -1.90 -0.03 0.00 -0.57 0.00 0.00 43.02 40.73 1h26 s PHE 4 CO 0.44 0.03 -0.00 -1.14 -0.10 0.00 0.00 175.22 174.45 1h26 s GLN 5 N 0.10 3.64 0.31 0.44 2.00 -0.08 -4.90 119.66 121.17 1h26 s GLN 5 Ca -0.01 -0.51 -0.29 0.00 -2.00 0.00 0.00 55.36 52.54 1h26 s GLN 5 Cb -0.14 -3.06 -0.10 0.00 0.80 0.00 0.00 33.01 30.51 1h26 s GLN 5 CO 0.03 0.06 1.38 0.15 -0.50 0.00 0.00 175.29 176.40 1h26 s LYS 6 N 0.88 4.29 -0.11 1.67 3.01 -1.26 -0.59 119.74 127.62 1h26 s LYS 6 Ca 0.01 2.30 -0.05 0.00 -1.01 0.00 0.00 55.97 57.22 1h26 s LYS 6 Cb -0.14 -3.07 -0.05 0.00 -1.01 0.00 0.00 37.83 33.56 1h26 s LYS 6 CO 0.02 -0.32 -0.14 0.28 0.51 0.00 0.00 175.35 175.70 1h26 n VAL 7 N 1.24 0.62 -3.60 3.17 0.31 0.20 -4.89 118.33 115.38 1h26 n VAL 7 Ca 0.02 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 1h26 n VAL 7 Cb 0.41 -1.52 -0.01 0.00 -0.91 0.00 0.00 33.84 31.81 1h26 n VAL 7 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1h26 s GLU 8 N -2.21 0.26 0.05 5.55 -1.05 -1.16 -5.02 118.70 115.13 1h26 s GLU 8 Ca -0.16 -0.13 -0.30 0.00 -0.15 0.00 0.00 54.97 54.23 1h26 s GLU 8 Cb 0.06 0.10 -0.05 0.00 -0.44 0.00 0.00 34.13 33.80 1h26 s GLU 8 CO 0.21 -0.12 1.06 0.15 0.95 0.00 0.00 175.26 177.51 1h26 s LYS 9 N -2.30 4.54 -0.10 -4.83 1.02 -1.26 -0.77 119.74 116.04 1h26 s LYS 9 Ca 0.13 1.57 -0.08 0.00 0.02 0.00 0.00 55.97 57.61 1h26 s LYS 9 Cb 0.04 -3.39 -0.03 0.00 -0.52 0.00 0.00 37.83 33.93 1h26 s LYS 9 CO -0.04 -0.07 -0.15 -0.89 -0.92 0.00 0.00 175.35 173.28 1h26 n ILE 10 N 3.58 0.92 -3.55 2.17 5.41 -0.18 -4.88 119.36 122.83 1h26 n ILE 10 Ca 0.06 0.30 -0.02 0.00 1.00 0.00 0.00 62.75 64.10 1h26 n ILE 10 Cb 0.49 -2.06 -0.00 0.00 -0.71 0.00 0.00 39.64 37.36 1h26 n ILE 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1h26 n GLY 11 N 1.60 2.85 2.78 7.39 0.00 -1.09 -5.04 105.19 113.68 1h26 n GLY 11 Ca -0.06 -1.36 -0.16 0.00 0.00 0.00 0.00 46.02 44.44 1h26 n GLY 11 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1h26 s GLU 12 N -2.09 0.32 -0.09 1.61 2.12 -1.26 -1.80 118.70 117.51 1h26 s GLU 12 Ca 0.03 -0.04 -0.00 0.00 0.36 0.00 0.00 54.97 55.32 1h26 s GLU 12 Cb -0.00 -0.66 0.02 0.00 0.26 0.00 0.00 34.13 33.75 1h26 s GLU 12 CO 0.02 -0.97 -0.05 0.20 -0.54 0.00 0.00 175.26 173.92 1h26 s GLY 13 N 2.39 0.67 0.00 -1.50 0.00 -1.26 -4.95 107.32 102.66 1h26 s GLY 13 Ca 0.09 -0.34 0.00 0.00 0.00 0.00 0.00 44.72 44.47 1h26 s GLY 13 CO -0.30 0.82 0.00 2.41 0.00 0.00 0.00 173.10 176.03 1h26 n THR 14 N 4.81 0.00 -4.22 0.90 -1.04 -1.26 -4.89 114.28 108.57 1h26 n THR 14 Ca -0.13 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.75 1h26 n THR 14 Cb 0.50 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.91 1h26 n THR 14 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1h26 s TYR 15 N -0.21 1.14 0.46 -1.42 1.51 -1.26 -5.07 117.35 112.51 1h26 s TYR 15 Ca 0.00 -1.02 -0.24 0.00 -1.01 0.00 0.00 57.07 54.80 1h26 s TYR 15 Cb 0.00 -0.65 -0.09 0.00 -0.11 0.00 0.00 41.96 41.11 1h26 s TYR 15 CO 0.00 -0.23 1.13 0.41 -1.11 0.00 0.00 175.55 175.75 1h26 n GLY 16 N -0.21 0.13 0.51 0.71 0.00 -1.25 -4.69 105.19 100.39 1h26 n GLY 16 Ca -0.07 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1h26 n GLY 16 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1h26 n VAL 17 N -0.62 0.00 -4.47 1.61 0.31 -1.26 -3.87 118.33 110.03 1h26 n VAL 17 Ca 0.09 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.09 1h26 n VAL 17 Cb 0.41 -0.08 -0.15 0.00 -0.91 0.00 0.00 33.84 33.11 1h26 n VAL 17 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1h26 s VAL 18 N -0.18 2.70 0.29 2.52 1.01 -0.75 -1.67 120.40 124.32 1h26 s VAL 18 Ca 0.00 -0.75 0.08 0.00 0.00 0.00 0.00 61.98 61.31 1h26 s VAL 18 Cb 0.00 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1h26 s VAL 18 CO 0.00 0.51 0.12 -0.31 0.00 0.00 0.00 175.10 175.42 1h26 s TYR 19 N 0.87 2.84 -0.20 5.22 1.51 0.18 -1.01 117.35 126.77 1h26 s TYR 19 Ca -0.04 -0.24 -0.09 0.00 -1.01 0.00 0.00 57.07 55.69 1h26 s TYR 19 Cb -0.15 -1.43 -0.05 0.00 -0.11 0.00 0.00 41.96 40.22 1h26 s TYR 19 CO -0.01 0.47 0.12 0.21 -1.11 0.00 0.00 175.55 175.23 1h26 s LYS 20 N -3.80 4.14 0.25 -0.62 2.20 0.05 0.27 119.74 122.22 1h26 s LYS 20 Ca 0.34 -0.25 0.00 0.00 -0.36 0.00 0.00 55.97 55.71 1h26 s LYS 20 Cb -0.06 -3.38 -0.03 0.00 -1.51 0.00 0.00 37.83 32.85 1h26 s LYS 20 CO 0.23 0.28 0.22 0.00 -0.36 0.00 0.00 175.35 175.71 1h26 s ALA 21 N 0.41 1.22 -0.04 3.13 0.00 0.10 -0.63 121.76 125.95 1h26 s ALA 21 Ca 0.07 -1.72 0.00 0.00 0.00 0.00 0.00 51.96 50.31 1h26 s ALA 21 Cb -0.11 1.38 0.03 0.00 0.00 0.00 0.00 23.12 24.41 1h26 s ALA 21 CO -0.01 -0.64 -0.01 0.50 0.00 0.00 0.00 175.76 175.59 1h26 s ARG 22 N -3.90 0.51 -0.22 0.00 3.52 0.25 -0.46 118.95 118.65 1h26 s ARG 22 Ca 0.38 0.03 -0.29 0.00 -0.13 0.00 0.00 55.73 55.71 1h26 s ARG 22 Cb 0.05 -0.67 -0.02 0.00 -1.56 0.00 0.00 34.95 32.75 1h26 s ARG 22 CO 0.16 -0.14 1.46 1.21 -0.81 0.00 0.00 175.30 177.18 1h26 s ASN 23 N 1.14 6.59 0.50 -2.12 3.84 -0.26 -0.90 114.94 123.72 1h26 s ASN 23 Ca -0.08 1.55 0.29 0.00 0.21 0.00 0.00 52.86 54.83 1h26 s ASN 23 Cb -0.14 -2.54 1.18 0.00 -0.55 0.00 0.00 41.25 39.21 1h26 s ASN 23 CO -0.02 -1.09 1.93 0.11 -2.79 0.00 0.00 177.10 175.24 1h26 h LYS 24 N 9.76 0.00 0.06 0.43 1.57 -1.17 -1.11 116.57 126.10 1h26 h LYS 24 Ca -0.31 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.16 1h26 h LYS 24 Cb 1.13 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.41 1h26 h LYS 24 CO 1.00 0.12 -1.72 -0.07 -0.57 0.00 0.00 179.45 178.21 1h26 h LEU 25 N 0.00 0.20 0.00 2.94 3.38 -1.90 -3.40 115.31 116.53 1h26 h LEU 25 Ca -0.00 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1h26 h LEU 25 Cb 0.60 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1h26 h LEU 25 CO 0.02 1.35 -1.56 0.35 0.09 0.00 0.00 178.44 178.69 1h26 n THR 26 N -3.27 0.00 -0.40 0.22 -2.24 -1.20 -4.97 114.28 102.42 1h26 n THR 26 Ca -0.20 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 1h26 n THR 26 Cb 1.04 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.58 1h26 n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h26 n GLY 27 N 1.50 2.13 3.76 3.38 0.00 -0.43 -5.01 105.19 110.53 1h26 n GLY 27 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1h26 n GLY 27 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1h26 s GLU 28 N -0.03 4.20 -0.17 1.61 2.12 -1.25 -4.69 118.70 120.49 1h26 s GLU 28 Ca 0.00 2.44 -0.09 0.00 0.36 0.00 0.00 54.97 57.68 1h26 s GLU 28 Cb 0.00 -3.03 -0.05 0.00 0.26 0.00 0.00 34.13 31.31 1h26 s GLU 28 CO 0.00 -0.45 0.14 0.08 -0.54 0.00 0.00 175.26 174.49 1h26 s VAL 29 N -0.70 5.44 0.23 3.70 1.01 -1.26 -1.10 120.40 127.72 1h26 s VAL 29 Ca 0.55 0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.78 1h26 s VAL 29 Cb -0.44 -3.45 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 1h26 s VAL 29 CO 0.54 0.51 0.01 0.68 0.00 0.00 0.00 175.10 176.83 1h26 s VAL 30 N -0.16 0.97 -0.23 2.92 -7.23 0.39 -3.56 120.40 113.49 1h26 s VAL 30 Ca 0.11 -2.02 -0.05 0.00 -1.81 0.00 0.00 61.98 58.21 1h26 s VAL 30 Cb -0.11 -2.37 -0.01 0.00 0.56 0.00 0.00 36.38 34.45 1h26 s VAL 30 CO 0.01 -0.30 -0.02 0.00 -0.31 0.00 0.00 175.10 174.48 1h26 s ALA 31 N -3.47 2.89 -0.25 1.32 0.00 -0.28 -0.72 121.76 121.25 1h26 s ALA 31 Ca 0.29 -1.19 -0.08 0.00 0.00 0.00 0.00 51.96 50.98 1h26 s ALA 31 Cb 0.06 -1.80 -0.03 0.00 0.00 0.00 0.00 23.12 21.35 1h26 s ALA 31 CO 0.09 -0.49 0.09 -0.51 0.00 0.00 0.00 175.76 174.93 1h26 s LEU 32 N 1.50 3.52 -0.35 0.00 1.43 0.14 -0.99 118.68 123.93 1h26 s LEU 32 Ca 0.05 -0.18 -0.13 0.00 -1.03 0.00 0.00 54.13 52.85 1h26 s LEU 32 Cb -0.15 -1.95 -0.01 0.00 0.03 0.00 0.00 46.19 44.11 1h26 s LEU 32 CO -0.02 -0.04 0.23 -0.75 0.23 0.00 0.00 176.35 176.01 1h26 s LYS 33 N 1.64 3.37 -0.18 1.70 2.20 -0.20 -0.65 119.74 127.62 1h26 s LYS 33 Ca 0.06 -0.73 -0.15 0.00 -0.36 0.00 0.00 55.97 54.80 1h26 s LYS 33 Cb -0.15 -3.79 -0.04 0.00 -1.51 0.00 0.00 37.83 32.33 1h26 s LYS 33 CO 0.05 -0.49 0.34 0.21 -0.36 0.00 0.00 175.35 175.09 1h26 s LYS 34 N 1.69 4.21 -0.23 4.03 2.36 -0.67 -0.75 119.74 130.39 1h26 s LYS 34 Ca 0.06 0.13 -0.00 0.00 -2.55 0.00 0.00 55.97 53.60 1h26 s LYS 34 Cb -0.18 -3.49 0.06 0.00 -1.05 0.00 0.00 37.83 33.18 1h26 s LYS 34 CO 0.10 0.09 -0.02 0.42 1.55 0.00 0.00 175.35 177.49 1h26 s ILE 35 N 0.92 1.18 0.27 5.43 1.01 0.14 -3.94 121.20 126.21 1h26 s ILE 35 Ca 0.17 -1.02 -0.29 0.00 0.00 0.00 0.00 60.65 59.51 1h26 s ILE 35 Cb -0.14 -1.55 -0.09 0.00 0.01 0.00 0.00 42.46 40.69 1h26 s ILE 35 CO 0.06 -0.17 1.03 -0.13 0.00 0.00 0.00 174.94 175.74 1h26 s ARG 36 N 1.55 4.71 -0.18 2.79 0.52 -1.26 -0.13 118.95 126.95 1h26 s ARG 36 Ca -0.03 1.66 -0.02 0.00 -0.52 0.00 0.00 55.73 56.82 1h26 s ARG 36 Cb -0.18 -3.20 -0.22 0.00 0.52 0.00 0.00 34.95 31.87 1h26 s ARG 36 CO -0.07 0.33 0.09 1.28 0.02 0.00 0.00 175.30 176.94 1h26 n LEU 37 N 1.26 2.76 0.00 2.53 4.77 -0.78 -4.87 117.00 122.67 1h26 n LEU 37 Ca -0.01 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1h26 n LEU 37 Cb 0.46 -1.00 0.00 0.00 -2.33 0.00 0.00 43.42 40.55 1h26 n LEU 37 CO 0.52 0.89 0.00 0.47 -1.33 0.00 0.00 177.39 177.94 1h26 n ASP 38 N -3.37 0.00 0.10 -1.43 8.00 -1.26 -4.32 116.55 114.28 1h26 n ASP 38 Ca -0.38 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 54.98 1h26 n ASP 38 Cb 1.02 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 42.04 1h26 n ASP 38 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1h26 h THR 39 N 0.00 0.91 0.00 -3.53 2.02 -1.92 -3.35 112.91 107.04 1h26 h THR 39 Ca 0.00 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1h26 h THR 39 Cb 0.00 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1h26 h THR 39 CO 0.00 0.06 0.00 -0.62 0.37 0.00 0.00 175.52 175.33 1h26 n GLU 40 N -5.13 0.22 0.00 6.66 4.71 -1.26 -4.38 120.64 121.46 1h26 n GLU 40 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.06 1h26 n GLU 40 Cb 0.15 -1.03 0.00 0.00 -1.01 0.00 0.00 31.44 29.54 1h26 n GLU 40 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 1h26 n THR 41 N -0.22 0.00 -0.12 2.62 -1.04 -1.26 -5.02 114.28 109.25 1h26 n THR 41 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1h26 n THR 41 Cb 0.02 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.53 1h26 n THR 41 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1h26 n GLU 42 N 0.00 -0.28 0.00 -2.82 -0.58 -1.26 -5.11 120.64 110.59 1h26 n GLU 42 Ca 0.00 -0.60 0.00 0.00 -0.42 0.00 0.00 57.16 56.14 1h26 n GLU 42 Cb 0.00 -0.94 0.00 0.00 -0.57 0.00 0.00 31.44 29.93 1h26 n GLU 42 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1h26 n GLY 43 N -0.07 0.84 3.69 0.62 0.00 -1.25 -4.75 105.19 104.26 1h26 n GLY 43 Ca 0.00 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 1h26 n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h26 s VAL 44 N 0.00 4.01 0.41 1.61 1.01 -1.26 -4.85 120.40 121.34 1h26 s VAL 44 Ca 0.00 1.35 -0.26 0.00 0.00 0.00 0.00 61.98 63.07 1h26 s VAL 44 Cb 0.00 -3.87 -0.09 0.00 0.00 0.00 0.00 36.38 32.42 1h26 s VAL 44 CO 0.00 -0.01 1.42 -2.84 0.00 0.00 0.00 175.10 173.67 1h26 s PRO 45 N 2.42 3.90 0.40 2.72 0.02 -1.26 -4.87 135.00 138.33 1h26 s PRO 45 Ca 0.59 2.41 0.10 0.00 0.02 0.00 0.00 61.00 64.13 1h26 s PRO 45 Cb -0.27 -2.80 0.89 0.00 0.02 0.00 0.00 34.50 32.34 1h26 s PRO 45 CO 0.23 -0.64 1.96 0.66 -0.33 0.00 0.00 177.00 178.89 1h26 h SER 46 N 2.66 0.52 -0.49 2.53 4.64 -1.94 -1.46 113.55 120.00 1h26 h SER 46 Ca -0.51 0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 60.76 1h26 h SER 46 Cb 1.25 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.22 1h26 h SER 46 CO 0.63 0.32 0.07 0.71 -0.87 0.00 0.00 176.83 177.68 1h26 h THR 47 N 0.58 1.24 -0.14 2.95 1.35 -1.91 -2.01 112.91 114.98 1h26 h THR 47 Ca 0.30 -0.95 -0.23 0.00 -0.55 0.00 0.00 66.41 64.98 1h26 h THR 47 Cb 0.43 0.75 0.01 0.00 -1.73 0.00 0.00 68.15 67.61 1h26 h THR 47 CO -0.10 0.35 -0.81 0.00 -0.25 0.00 0.00 175.52 174.71 1h26 h ALA 48 N 1.24 0.30 -0.92 6.62 0.00 -1.60 -1.91 119.26 122.98 1h26 h ALA 48 Ca 0.17 -0.61 0.13 0.00 0.00 0.00 0.00 54.91 54.59 1h26 h ALA 48 Cb 0.40 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.09 1h26 h ALA 48 CO 0.01 0.69 0.54 0.82 0.00 0.00 0.00 179.25 181.31 1h26 h ILE 49 N 0.53 0.85 -0.04 0.00 2.04 -1.26 -1.36 117.51 118.26 1h26 h ILE 49 Ca -0.06 -0.29 -0.05 0.00 1.00 0.00 0.00 64.86 65.46 1h26 h ILE 49 Cb 1.44 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1h26 h ILE 49 CO 0.17 0.15 -0.17 0.03 0.00 0.00 0.00 178.15 178.32 1h26 h ARG 50 N 0.84 0.20 0.07 2.37 3.08 -1.27 -1.90 114.38 117.76 1h26 h ARG 50 Ca 0.47 -0.15 0.01 0.00 0.07 0.00 0.00 59.98 60.38 1h26 h ARG 50 Cb 0.53 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.60 1h26 h ARG 50 CO -0.29 0.79 -0.09 1.49 -1.07 0.00 0.00 179.97 180.80 1h26 h GLU 51 N -0.36 -0.18 0.55 0.04 4.81 -1.14 0.29 114.58 118.60 1h26 h GLU 51 Ca -0.01 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1h26 h GLU 51 Cb 0.82 0.04 0.01 0.00 0.63 0.00 0.00 28.75 30.24 1h26 h GLU 51 CO 0.04 -0.12 -0.27 0.82 -0.73 0.00 0.00 179.01 178.75 1h26 h ILE 52 N -0.19 0.39 -0.72 2.32 2.04 -1.36 0.15 117.51 120.14 1h26 h ILE 52 Ca 0.01 -0.25 0.07 0.00 1.00 0.00 0.00 64.86 65.68 1h26 h ILE 52 Cb 0.19 0.49 -0.06 0.00 -0.74 0.00 0.00 36.82 36.70 1h26 h ILE 52 CO -0.04 0.04 0.40 0.77 0.00 0.00 0.00 178.15 179.32 1h26 h SER 53 N -0.92 0.59 -0.08 1.72 4.64 -1.16 -1.09 113.55 117.26 1h26 h SER 53 Ca -0.08 0.03 -0.23 0.00 -0.47 0.00 0.00 61.79 61.05 1h26 h SER 53 Cb 0.63 -0.08 0.01 0.00 -0.31 0.00 0.00 62.40 62.65 1h26 h SER 53 CO 0.12 0.37 -0.84 -0.07 -0.87 0.00 0.00 176.83 175.55 1h26 h LEU 54 N 0.73 0.88 -1.41 5.97 3.38 -0.39 -3.24 115.31 121.23 1h26 h LEU 54 Ca 0.33 -0.68 -0.03 0.00 0.09 0.00 0.00 57.88 57.59 1h26 h LEU 54 Cb 0.23 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1h26 h LEU 54 CO -0.20 1.43 -0.14 0.25 0.09 0.00 0.00 178.44 179.87 1h26 h LEU 55 N 0.40 0.00 -0.92 1.67 5.85 -0.29 -0.16 115.31 121.86 1h26 h LEU 55 Ca -0.08 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.59 1h26 h LEU 55 Cb 1.49 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.51 1h26 h LEU 55 CO 0.17 0.14 -0.24 0.11 -0.34 0.00 0.00 178.44 178.28 1h26 h LYS 56 N 0.00 0.00 -0.58 1.25 1.57 -1.24 -2.71 116.57 114.86 1h26 h LYS 56 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1h26 h LYS 56 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1h26 h LYS 56 CO 0.02 0.24 0.00 0.39 -0.57 0.00 0.00 179.45 179.53 1h26 n GLU 57 N -3.34 2.59 -3.66 3.15 1.02 -0.09 -4.75 120.64 115.57 1h26 n GLU 57 Ca 0.01 -2.06 -0.29 0.00 -0.02 0.00 0.00 57.16 54.79 1h26 n GLU 57 Cb 0.47 -1.55 -0.13 0.00 -0.02 0.00 0.00 31.44 30.21 1h26 n GLU 57 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1h26 s LEU 58 N -1.20 2.26 -0.31 -4.62 1.43 -1.02 -5.05 118.68 110.16 1h26 s LEU 58 Ca 0.38 -2.44 0.01 0.00 -1.03 0.00 0.00 54.13 51.05 1h26 s LEU 58 Cb 0.22 -0.87 0.07 0.00 0.03 0.00 0.00 46.19 45.63 1h26 s LEU 58 CO 0.23 -0.29 0.01 0.20 0.23 0.00 0.00 176.35 176.72 1h26 s ASN 59 N 0.63 4.79 -0.06 2.29 0.02 -1.26 -4.91 114.94 116.44 1h26 s ASN 59 Ca 0.17 -1.60 -0.17 0.00 -1.02 0.00 0.00 52.86 50.24 1h26 s ASN 59 Cb -0.24 -1.66 0.03 0.00 0.02 0.00 0.00 41.25 39.40 1h26 s ASN 59 CO -0.02 -0.30 0.38 -2.28 0.02 0.00 0.00 177.10 174.90 1h26 s HIS 60 N 1.12 -0.31 0.54 2.20 2.46 -1.26 -5.05 115.29 114.99 1h26 s HIS 60 Ca -0.01 0.60 0.35 0.00 0.47 0.00 0.00 55.06 56.48 1h26 s HIS 60 Cb -0.20 0.15 1.95 0.00 -0.13 0.00 0.00 32.58 34.35 1h26 s HIS 60 CO -0.04 -0.37 2.24 -1.35 -2.47 0.00 0.00 174.74 172.76 1h26 h PRO 61 N 4.22 0.00 -0.59 2.88 0.11 -1.98 -1.87 132.00 134.77 1h26 h PRO 61 Ca -0.29 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.57 1h26 h PRO 61 Cb 1.17 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.13 1h26 h PRO 61 CO 0.36 0.02 0.20 0.09 -0.21 0.00 0.00 178.00 178.46 1h26 n ASN 62 N -3.45 3.50 -4.01 -2.05 5.03 -1.26 -4.85 115.26 108.16 1h26 n ASN 62 Ca -0.02 -3.51 -0.24 0.00 0.87 0.00 0.00 54.58 51.68 1h26 n ASN 62 Cb 0.13 -0.70 -0.16 0.00 -1.02 0.00 0.00 39.78 38.02 1h26 n ASN 62 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1h26 s ILE 63 N -3.15 1.05 0.13 2.41 1.01 -0.71 -0.49 121.20 121.45 1h26 s ILE 63 Ca 0.50 -0.44 -0.34 0.00 0.00 0.00 0.00 60.65 60.37 1h26 s ILE 63 Cb 0.42 -0.96 -0.17 0.00 0.01 0.00 0.00 42.46 41.76 1h26 s ILE 63 CO 0.07 0.33 1.09 0.52 0.00 0.00 0.00 174.94 176.95 1h26 n VAL 64 N 3.75 0.73 -3.03 2.92 0.31 0.06 -4.61 118.33 118.46 1h26 n VAL 64 Ca -0.23 -0.18 -0.41 0.00 -0.01 0.00 0.00 64.34 63.51 1h26 n VAL 64 Cb 0.52 -0.57 -0.05 0.00 -0.91 0.00 0.00 33.84 32.83 1h26 n VAL 64 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1h26 s LYS 65 N -0.27 4.17 -0.35 5.55 2.20 -1.26 -4.98 119.74 124.81 1h26 s LYS 65 Ca 0.77 0.72 -0.26 0.00 -0.36 0.00 0.00 55.97 56.83 1h26 s LYS 65 Cb -0.96 -3.62 0.01 0.00 -1.51 0.00 0.00 37.83 31.75 1h26 s LYS 65 CO 0.53 -0.39 0.96 -1.17 -0.36 0.00 0.00 175.35 174.92 1h26 s LEU 66 N 2.40 3.98 -0.11 5.43 2.96 -1.26 -1.78 118.68 130.31 1h26 s LEU 66 Ca 0.30 0.73 0.10 0.00 -0.22 0.00 0.00 54.13 55.04 1h26 s LEU 66 Cb -0.16 -3.33 -0.24 0.00 0.50 0.00 0.00 46.19 42.97 1h26 s LEU 66 CO 0.09 -0.84 0.42 0.18 -1.32 0.00 0.00 176.35 174.88 1h26 n LEU 67 N 6.75 1.14 -3.55 -0.68 4.77 0.23 -4.99 117.00 120.66 1h26 n LEU 67 Ca 0.08 0.25 -0.09 0.00 -0.03 0.00 0.00 56.01 56.23 1h26 n LEU 67 Cb 0.48 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.49 1h26 n LEU 67 CO 0.58 0.53 0.58 -0.62 -1.33 0.00 0.00 177.39 177.13 1h26 s ASP 68 N -6.15 -0.39 -0.12 -1.43 2.15 -0.97 -4.99 116.67 104.76 1h26 s ASP 68 Ca -0.11 -0.13 -0.02 0.00 0.43 0.00 0.00 52.55 52.73 1h26 s ASP 68 Cb 0.07 0.51 0.04 0.00 -0.30 0.00 0.00 42.92 43.24 1h26 s ASP 68 CO 0.80 -0.85 0.00 -0.69 -0.17 0.00 0.00 175.17 174.26 1h26 s VAL 69 N -3.43 0.54 -0.31 1.11 1.01 -1.26 -0.49 120.40 117.57 1h26 s VAL 69 Ca 0.05 -0.19 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 1h26 s VAL 69 Cb -0.02 -0.80 0.03 0.00 0.00 0.00 0.00 36.38 35.60 1h26 s VAL 69 CO -0.07 0.11 0.06 -0.63 0.00 0.00 0.00 175.10 174.58 1h26 s ILE 70 N 1.89 3.57 -0.54 2.22 1.01 -0.30 -5.00 121.20 124.05 1h26 s ILE 70 Ca 0.03 -1.08 0.00 0.00 0.00 0.00 0.00 60.65 59.60 1h26 s ILE 70 Cb -0.14 -2.97 0.14 0.00 0.01 0.00 0.00 42.46 39.50 1h26 s ILE 70 CO -0.07 -0.07 0.32 -2.28 0.00 0.00 0.00 174.94 172.84 1h26 s HIS 71 N 1.38 3.39 0.65 3.97 2.46 -1.26 -2.16 115.29 123.72 1h26 s HIS 71 Ca -0.01 -2.86 0.02 0.00 0.47 0.00 0.00 55.06 52.68 1h26 s HIS 71 Cb -0.19 -3.05 0.10 0.00 -0.13 0.00 0.00 32.58 29.30 1h26 s HIS 71 CO 0.01 -0.84 0.90 0.99 -2.47 0.00 0.00 174.74 173.33 1h26 s THR 72 N 0.10 2.27 0.17 0.89 2.01 -0.96 -5.04 115.64 115.08 1h26 s THR 72 Ca 0.15 -0.70 -0.02 0.00 0.31 0.00 0.00 61.69 61.43 1h26 s THR 72 Cb -0.22 -2.57 -0.12 0.00 0.01 0.00 0.00 72.50 69.60 1h26 s THR 72 CO -0.03 0.00 1.42 -0.08 -0.69 0.00 0.00 174.62 175.24 1h26 h GLU 73 N -0.23 0.40 0.04 4.92 4.81 -2.04 -3.36 114.58 119.12 1h26 h GLU 73 Ca -0.36 -0.34 -0.38 0.00 -0.13 0.00 0.00 59.36 58.14 1h26 h GLU 73 Cb 1.28 0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.68 1h26 h GLU 73 CO 0.43 0.99 -2.30 0.27 -0.73 0.00 0.00 179.01 177.66 1h26 n ASN 74 N -3.82 2.02 -4.18 1.04 0.23 -1.26 -4.77 115.26 104.52 1h26 n ASN 74 Ca -0.05 0.01 -0.16 0.00 -0.53 0.00 0.00 54.58 53.85 1h26 n ASN 74 Cb 0.72 -0.59 -0.11 0.00 -2.08 0.00 0.00 39.78 37.72 1h26 n ASN 74 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 1h26 s LYS 75 N -2.53 0.85 -0.17 -3.83 3.01 -1.26 -1.87 119.74 113.95 1h26 s LYS 75 Ca -0.31 -1.07 0.00 0.00 -1.01 0.00 0.00 55.97 53.58 1h26 s LYS 75 Cb 0.08 -0.69 0.00 0.00 -1.01 0.00 0.00 37.83 36.21 1h26 s LYS 75 CO 0.65 0.13 -0.16 -1.17 0.51 0.00 0.00 175.35 175.31 1h26 s LEU 76 N -2.13 2.42 -0.20 3.17 2.96 0.82 -2.25 118.68 123.46 1h26 s LEU 76 Ca 0.02 -0.51 -0.02 0.00 -0.22 0.00 0.00 54.13 53.40 1h26 s LEU 76 Cb -0.06 -1.56 -0.00 0.00 0.50 0.00 0.00 46.19 45.07 1h26 s LEU 76 CO 0.01 0.05 -0.10 -0.31 -1.32 0.00 0.00 176.35 174.69 1h26 s TYR 77 N 1.01 2.89 -0.23 5.38 2.02 -0.92 0.24 117.35 127.74 1h26 s TYR 77 Ca -0.02 -1.12 -0.16 0.00 -0.37 0.00 0.00 57.07 55.41 1h26 s TYR 77 Cb -0.15 -2.02 -0.04 0.00 -0.40 0.00 0.00 41.96 39.36 1h26 s TYR 77 CO -0.04 -0.59 0.39 -0.51 -1.57 0.00 0.00 175.55 173.24 1h26 s LEU 78 N 1.29 4.10 -0.39 -1.29 1.43 0.07 -1.15 118.68 122.74 1h26 s LEU 78 Ca 0.04 0.42 -0.15 0.00 -1.03 0.00 0.00 54.13 53.41 1h26 s LEU 78 Cb -0.14 -2.48 0.01 0.00 0.03 0.00 0.00 46.19 43.61 1h26 s LEU 78 CO -0.05 -0.13 0.29 -0.69 0.23 0.00 0.00 176.35 176.00 1h26 s VAL 79 N 1.66 5.26 0.19 -1.59 1.01 0.36 -1.03 120.40 126.26 1h26 s VAL 79 Ca 0.17 -0.52 0.07 0.00 0.00 0.00 0.00 61.98 61.71 1h26 s VAL 79 Cb -0.15 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1h26 s VAL 79 CO 0.09 -0.23 0.04 -0.36 0.00 0.00 0.00 175.10 174.63 1h26 s PHE 80 N 1.71 2.90 0.44 5.22 0.40 -0.16 0.77 117.98 129.25 1h26 s PHE 80 Ca 0.06 -0.13 -0.25 0.00 -0.60 0.00 0.00 56.93 56.01 1h26 s PHE 80 Cb -0.18 -1.38 -0.08 0.00 0.51 0.00 0.00 43.02 41.88 1h26 s PHE 80 CO 0.10 0.53 1.38 -1.83 0.70 0.00 0.00 175.22 176.10 1h26 s GLU 81 N -3.13 3.78 -0.23 0.44 -1.05 -0.73 -1.13 118.70 116.65 1h26 s GLU 81 Ca 0.29 2.32 -0.21 0.00 -0.15 0.00 0.00 54.97 57.22 1h26 s GLU 81 Cb -0.09 -2.68 -0.02 0.00 -0.44 0.00 0.00 34.13 30.90 1h26 s GLU 81 CO 0.20 -0.71 0.67 0.12 0.95 0.00 0.00 175.26 176.49 1h26 s PHE 82 N -1.23 3.32 0.23 4.83 5.36 -1.23 -4.26 117.98 125.00 1h26 s PHE 82 Ca 0.60 0.92 0.06 0.00 -0.96 0.00 0.00 56.93 57.55 1h26 s PHE 82 Cb -0.42 -2.87 -0.04 0.00 -0.34 0.00 0.00 43.02 39.36 1h26 s PHE 82 CO 0.53 -0.28 0.18 -0.51 -1.46 0.00 0.00 175.22 173.68 1h26 s LEU 83 N 2.35 3.82 0.16 6.12 1.02 -1.26 -4.95 118.68 125.93 1h26 s LEU 83 Ca 0.29 -0.21 -0.26 0.00 0.02 0.00 0.00 54.13 53.96 1h26 s LEU 83 Cb -0.16 -2.37 0.01 0.00 0.02 0.00 0.00 46.19 43.69 1h26 s LEU 83 CO 0.09 -0.01 1.57 -0.74 0.02 0.00 0.00 176.35 177.29 1h26 h HIS 84 N 1.75 -1.25 -2.37 0.29 -0.00 -1.73 -3.47 115.15 108.38 1h26 h HIS 84 Ca -0.48 0.07 0.21 0.00 -0.00 0.00 0.00 60.37 60.17 1h26 h HIS 84 Cb 1.23 0.61 -0.05 0.00 -0.00 0.00 0.00 27.41 29.20 1h26 h HIS 84 CO 0.56 -0.43 0.65 1.14 -0.00 0.00 0.00 177.93 179.85 1h26 s GLN 85 N -5.85 1.08 0.64 5.26 -2.07 -1.13 -5.00 119.66 112.59 1h26 s GLN 85 Ca -0.14 -0.68 -0.05 0.00 -1.82 0.00 0.00 55.36 52.66 1h26 s GLN 85 Cb 0.12 0.31 0.04 0.00 -1.09 0.00 0.00 33.01 32.39 1h26 s GLN 85 CO 0.66 -0.50 0.94 0.16 -1.32 0.00 0.00 175.29 175.22 1h26 s ASP 86 N -3.40 5.14 0.26 12.60 1.47 -1.26 -1.08 116.67 130.41 1h26 s ASP 86 Ca 0.22 0.47 -0.03 0.00 1.18 0.00 0.00 52.55 54.39 1h26 s ASP 86 Cb -0.02 -1.28 0.34 0.00 -0.34 0.00 0.00 42.92 41.62 1h26 s ASP 86 CO 0.03 -1.35 1.83 0.25 0.68 0.00 0.00 175.17 176.61 1h26 h LEU 87 N -0.36 0.89 -0.98 2.11 5.85 -0.32 -2.68 115.31 119.82 1h26 h LEU 87 Ca -0.44 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.15 1h26 h LEU 87 Cb 1.29 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 42.04 1h26 h LEU 87 CO 0.59 0.82 0.65 0.50 -0.34 0.00 0.00 178.44 180.66 1h26 h LYS 88 N 0.93 1.27 0.00 1.25 3.64 -1.81 0.41 116.57 122.26 1h26 h LYS 88 Ca 0.21 -0.08 -0.08 0.00 -1.27 0.00 0.00 60.65 59.43 1h26 h LYS 88 Cb 0.23 -0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1h26 h LYS 88 CO -0.01 0.84 -0.40 0.87 -2.27 0.00 0.00 179.45 178.48 1h26 h LYS 89 N 1.31 0.00 0.02 1.90 1.57 -1.80 -1.61 116.57 117.95 1h26 h LYS 89 Ca 0.36 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.10 1h26 h LYS 89 Cb -0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.18 1h26 h LYS 89 CO -0.08 0.40 -0.20 0.35 -0.57 0.00 0.00 179.45 179.35 1h26 h PHE 90 N 0.00 0.16 0.02 -1.35 3.57 -1.06 -1.11 116.94 117.16 1h26 h PHE 90 Ca -0.00 -0.10 0.02 0.00 3.53 0.00 0.00 57.97 61.41 1h26 h PHE 90 Cb 0.97 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.64 1h26 h PHE 90 CO 0.00 0.98 -0.53 0.52 -2.23 0.00 0.00 178.31 177.05 1h26 h MET 91 N -0.71 -0.66 -0.74 1.11 2.86 -0.20 0.17 114.93 116.76 1h26 h MET 91 Ca -0.03 0.04 0.12 0.00 -2.06 0.00 0.00 59.70 57.77 1h26 h MET 91 Cb 1.05 0.15 -0.13 0.00 0.06 0.00 0.00 31.60 32.73 1h26 h MET 91 CO 0.04 -0.44 -0.38 -0.44 1.06 0.00 0.00 176.91 176.74 1h26 h ASP 92 N -0.68 -1.36 0.35 1.22 3.32 -1.35 1.15 116.42 119.06 1h26 h ASP 92 Ca 0.01 0.26 0.00 0.00 0.02 0.00 0.00 57.03 57.32 1h26 h ASP 92 Cb 0.73 0.67 0.00 0.00 0.22 0.00 0.00 39.33 40.95 1h26 h ASP 92 CO -0.34 -0.30 0.00 0.00 -1.72 0.00 0.00 179.24 176.87 1h26 n ALA 93 N -3.26 1.34 -1.21 3.45 0.00 -0.42 -0.38 120.51 120.03 1h26 n ALA 93 Ca 0.06 0.14 -0.07 0.00 0.00 0.00 0.00 53.44 53.57 1h26 n ALA 93 Cb 0.37 -1.35 0.24 0.00 0.00 0.00 0.00 19.45 18.70 1h26 n ALA 93 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1h26 n SER 94 N -2.24 3.66 0.26 0.00 7.64 0.39 -4.78 113.62 118.55 1h26 n SER 94 Ca 0.00 -3.45 -0.11 0.00 1.01 0.00 0.00 58.87 56.31 1h26 n SER 94 Cb 0.13 -0.70 -0.06 0.00 -1.01 0.00 0.00 64.21 62.58 1h26 n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1h26 h ALA 95 N 1.61 -1.13 0.01 -0.43 0.00 0.11 -1.89 119.26 117.55 1h26 h ALA 95 Ca 0.29 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1h26 h ALA 95 Cb 2.08 0.38 0.00 0.00 0.00 0.00 0.00 17.79 20.25 1h26 h ALA 95 CO 0.61 -1.10 -0.01 -0.07 0.00 0.00 0.00 179.25 178.69 1h26 h LEU 96 N -0.71 -0.02 -1.74 0.00 3.38 -1.86 -3.30 115.31 111.06 1h26 h LEU 96 Ca -0.06 0.00 0.34 0.00 0.09 0.00 0.00 57.88 58.24 1h26 h LEU 96 Cb 0.57 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.25 1h26 h LEU 96 CO 0.07 -0.01 0.82 0.74 0.09 0.00 0.00 178.44 180.16 1h26 h THR 97 N -0.03 0.40 -1.07 0.22 2.02 -1.88 -3.48 112.91 109.09 1h26 h THR 97 Ca -0.00 -0.05 0.13 0.00 0.77 0.00 0.00 66.41 67.26 1h26 h THR 97 Cb 0.01 0.25 -0.03 0.00 -1.74 0.00 0.00 68.15 66.65 1h26 h THR 97 CO 0.00 0.02 -0.17 0.61 0.37 0.00 0.00 175.52 176.36 1h26 n GLY 98 N -1.66 -2.13 2.90 2.16 0.00 -0.71 -4.93 105.19 100.82 1h26 n GLY 98 Ca 0.27 -1.40 -0.29 0.00 0.00 0.00 0.00 46.02 44.60 1h26 n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h26 s ILE 99 N -1.36 1.22 0.28 -0.61 1.01 -1.26 -4.87 121.20 115.62 1h26 s ILE 99 Ca 0.00 -0.82 -0.26 0.00 0.00 0.00 0.00 60.65 59.56 1h26 s ILE 99 Cb 0.00 -1.44 -0.15 0.00 0.01 0.00 0.00 42.46 40.88 1h26 s ILE 99 CO 0.00 0.03 0.65 -2.65 0.00 0.00 0.00 174.94 172.97 1h26 n PRO 100 N 4.82 0.53 0.11 2.79 -0.02 -1.26 -4.78 135.00 137.19 1h26 n PRO 100 Ca -0.12 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 1h26 n PRO 100 Cb 0.47 -1.36 0.31 0.00 -0.02 0.00 0.00 33.50 32.90 1h26 n PRO 100 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1h26 h LEU 101 N 1.22 0.22 0.50 2.45 3.38 -1.99 -2.96 115.31 118.13 1h26 h LEU 101 Ca -0.35 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.53 1h26 h LEU 101 Cb 1.40 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1h26 h LEU 101 CO 0.56 0.50 -0.24 -0.65 0.09 0.00 0.00 178.44 178.70 1h26 h PRO 102 N 0.20 -0.65 -0.94 1.13 0.11 -1.98 -0.16 132.00 129.71 1h26 h PRO 102 Ca 0.03 0.04 0.28 0.00 0.11 0.00 0.00 66.00 66.46 1h26 h PRO 102 Cb 0.59 0.15 -0.15 0.00 0.11 0.00 0.00 31.00 31.70 1h26 h PRO 102 CO 0.04 -0.43 0.36 1.25 -0.21 0.00 0.00 178.00 179.01 1h26 h LEU 103 N -0.67 0.17 -0.70 2.35 5.85 -1.87 1.40 115.31 121.84 1h26 h LEU 103 Ca -0.07 0.20 -0.12 0.00 0.84 0.00 0.00 57.88 58.73 1h26 h LEU 103 Cb 0.52 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 1h26 h LEU 103 CO 0.11 -0.17 -0.33 0.40 -0.34 0.00 0.00 178.44 178.11 1h26 h ILE 104 N 0.23 1.29 -0.25 4.05 2.04 -1.32 0.51 117.51 124.07 1h26 h ILE 104 Ca 0.63 -1.47 -0.17 0.00 1.00 0.00 0.00 64.86 64.85 1h26 h ILE 104 Cb 1.37 1.43 -0.00 0.00 -0.74 0.00 0.00 36.82 38.87 1h26 h ILE 104 CO -0.66 0.47 -0.55 0.50 0.00 0.00 0.00 178.15 177.92 1h26 h LYS 105 N 0.53 0.74 0.16 2.37 3.64 0.34 -0.66 116.57 123.68 1h26 h LYS 105 Ca 0.06 -0.46 -0.01 0.00 -1.27 0.00 0.00 60.65 58.97 1h26 h LYS 105 Cb 0.83 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.71 1h26 h LYS 105 CO 0.07 1.09 -0.08 1.03 -2.27 0.00 0.00 179.45 179.29 1h26 h SER 106 N 0.57 -0.19 -0.81 4.20 0.87 0.21 -1.96 113.55 116.43 1h26 h SER 106 Ca 0.01 0.01 0.19 0.00 -1.23 0.00 0.00 61.79 60.77 1h26 h SER 106 Cb 1.13 0.05 -0.12 0.00 -0.44 0.00 0.00 62.40 63.02 1h26 h SER 106 CO 0.11 -0.13 0.25 1.88 -0.53 0.00 0.00 176.83 178.41 1h26 h TYR 107 N -0.22 0.41 -0.39 2.24 0.05 -0.07 0.84 116.97 119.83 1h26 h TYR 107 Ca -0.02 0.04 -0.08 0.00 0.05 0.00 0.00 58.73 58.72 1h26 h TYR 107 Cb 0.17 -0.05 -0.02 0.00 1.01 0.00 0.00 36.73 37.84 1h26 h TYR 107 CO 0.16 -0.09 -0.08 1.25 -1.05 0.00 0.00 178.16 178.35 1h26 h LEU 108 N 0.31 0.65 -0.02 3.88 5.85 -1.09 0.06 115.31 124.95 1h26 h LEU 108 Ca 0.48 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 59.02 1h26 h LEU 108 Cb 0.87 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.73 1h26 h LEU 108 CO -0.54 0.78 -0.01 0.15 -0.34 0.00 0.00 178.44 178.48 1h26 h PHE 109 N 0.62 0.04 -0.49 1.25 3.57 0.15 -1.94 116.94 120.14 1h26 h PHE 109 Ca 0.11 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.69 1h26 h PHE 109 Cb 0.51 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 39.18 1h26 h PHE 109 CO 0.02 0.48 0.10 1.96 -2.23 0.00 0.00 178.31 178.64 1h26 h GLN 110 N -0.41 0.23 -0.42 1.11 4.20 -1.19 -1.04 115.11 117.60 1h26 h GLN 110 Ca 0.00 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 1h26 h GLN 110 Cb 0.47 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 1h26 h GLN 110 CO 0.00 0.15 0.25 -0.07 -0.67 0.00 0.00 178.83 178.49 1h26 h LEU 111 N 0.23 0.49 -0.17 1.46 3.38 -0.83 0.39 115.31 120.26 1h26 h LEU 111 Ca 0.25 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.13 1h26 h LEU 111 Cb 0.33 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1h26 h LEU 111 CO -0.32 0.38 -0.30 -0.07 0.09 0.00 0.00 178.44 178.21 1h26 h LEU 112 N 0.57 0.00 -0.32 1.67 3.38 -0.43 -1.61 115.31 118.57 1h26 h LEU 112 Ca 0.15 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.92 1h26 h LEU 112 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1h26 h LEU 112 CO -0.03 0.30 -0.75 1.56 0.09 0.00 0.00 178.44 179.61 1h26 h GLN 113 N 0.00 0.53 -0.01 1.13 4.20 0.82 -1.35 115.11 120.43 1h26 h GLN 113 Ca -0.00 -0.44 -0.00 0.00 0.06 0.00 0.00 58.65 58.27 1h26 h GLN 113 Cb 1.17 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 29.04 1h26 h GLN 113 CO 0.04 1.06 0.00 0.78 -0.67 0.00 0.00 178.83 180.05 1h26 h GLY 114 N 1.05 0.02 0.98 3.46 0.00 -1.01 -2.50 103.07 105.08 1h26 h GLY 114 Ca -0.04 -0.01 -0.05 0.00 0.00 0.00 0.00 47.33 47.22 1h26 h GLY 114 CO 0.14 0.01 0.11 -2.00 0.00 0.00 0.00 176.54 174.80 1h26 h LEU 115 N -0.23 0.79 -0.58 3.11 5.85 -1.25 0.41 115.31 123.41 1h26 h LEU 115 Ca 0.00 -0.24 -0.08 0.00 0.84 0.00 0.00 57.88 58.40 1h26 h LEU 115 Cb 0.25 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1h26 h LEU 115 CO 0.00 0.83 0.05 0.00 -0.34 0.00 0.00 178.44 178.98 1h26 h ALA 116 N 0.99 0.78 -0.49 1.25 0.00 -1.26 0.58 119.26 121.10 1h26 h ALA 116 Ca 0.16 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 54.84 1h26 h ALA 116 Cb 0.36 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1h26 h ALA 116 CO 0.01 0.57 0.23 0.35 0.00 0.00 0.00 179.25 180.40 1h26 h PHE 117 N 0.88 0.43 0.14 0.00 3.57 -1.10 0.67 116.94 121.53 1h26 h PHE 117 Ca 0.17 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.70 1h26 h PHE 117 Cb 0.48 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 1h26 h PHE 117 CO 0.04 0.20 -0.21 0.00 -2.23 0.00 0.00 178.31 176.11 1h26 h HIS 119 N -0.41 0.00 0.00 0.00 3.86 0.59 0.17 115.15 119.36 1h26 h HIS 119 Ca 0.02 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1h26 h HIS 119 Cb 0.42 -0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.88 1h26 h HIS 119 CO -0.19 0.38 -0.07 0.77 0.86 0.00 0.00 177.93 179.68 1h26 h SER 120 N 0.00 0.00 -0.44 2.45 0.02 0.64 -2.59 113.55 113.63 1h26 h SER 120 Ca -0.00 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.72 1h26 h SER 120 Cb 0.66 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.06 1h26 h SER 120 CO 0.05 0.07 0.01 1.41 -1.14 0.00 0.00 176.83 177.23 1h26 n HIS 121 N -4.27 1.35 -3.61 3.45 8.25 0.45 -4.91 115.22 115.93 1h26 n HIS 121 Ca -0.03 -1.66 -0.25 0.00 -0.26 0.00 0.00 57.72 55.53 1h26 n HIS 121 Cb 0.15 -0.56 0.07 0.00 1.12 0.00 0.00 29.99 30.78 1h26 n HIS 121 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1h26 n ARG 122 N -1.13 -7.44 -4.21 -0.41 -4.01 -0.98 -4.95 116.66 93.54 1h26 n ARG 122 Ca 0.37 0.80 -0.29 0.00 -1.04 0.00 0.00 57.85 57.69 1h26 n ARG 122 Cb 1.12 -5.82 -0.17 0.00 -3.04 0.00 0.00 32.46 24.55 1h26 n ARG 122 CO 0.00 0.00 0.00 0.08 -3.04 0.00 0.00 177.63 174.67 1h26 s VAL 123 N -3.31 1.47 -0.08 8.89 1.01 -0.35 -1.45 120.40 126.59 1h26 s VAL 123 Ca 0.58 -0.60 -0.17 0.00 0.00 0.00 0.00 61.98 61.80 1h26 s VAL 123 Cb -0.26 -1.38 -0.05 0.00 0.00 0.00 0.00 36.38 34.69 1h26 s VAL 123 CO 0.72 0.44 0.45 -0.76 0.00 0.00 0.00 175.10 175.95 1h26 s LEU 124 N 1.28 4.34 -0.15 3.92 1.43 -0.39 -3.69 118.68 125.41 1h26 s LEU 124 Ca -0.00 0.85 -0.20 0.00 -1.03 0.00 0.00 54.13 53.75 1h26 s LEU 124 Cb -0.14 -2.65 -0.17 0.00 0.03 0.00 0.00 46.19 43.26 1h26 s LEU 124 CO -0.06 0.11 0.39 -0.74 0.23 0.00 0.00 176.35 176.27 1h26 h HIS 125 N 6.10 0.00 0.00 0.29 -0.00 -1.90 -1.64 115.15 117.99 1h26 h HIS 125 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.93 1h26 h HIS 125 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.60 1h26 h HIS 125 CO 0.64 0.84 0.00 0.54 -0.00 0.00 0.00 177.93 179.95 1h26 n ARG 126 N -4.60 -0.35 -2.70 5.26 1.74 -1.26 -2.79 116.66 111.97 1h26 n ARG 126 Ca -0.13 0.09 -0.09 0.00 -0.77 0.00 0.00 57.85 56.95 1h26 n ARG 126 Cb 0.42 -3.41 0.07 0.00 -1.02 0.00 0.00 32.46 28.52 1h26 n ARG 126 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1h26 n ASP 127 N -0.17 -0.06 -4.68 0.55 2.03 -1.26 -2.16 116.55 110.79 1h26 n ASP 127 Ca 0.00 -2.65 -0.43 0.00 0.52 0.00 0.00 54.79 52.24 1h26 n ASP 127 Cb 0.09 0.17 -0.02 0.00 -0.72 0.00 0.00 41.12 40.64 1h26 n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1h26 s LEU 128 N -3.10 4.22 0.04 -2.67 1.43 -1.26 -4.82 118.68 112.52 1h26 s LEU 128 Ca 0.25 1.63 -0.27 0.00 -1.03 0.00 0.00 54.13 54.72 1h26 s LEU 128 Cb 0.43 -3.55 0.09 0.00 0.03 0.00 0.00 46.19 43.19 1h26 s LEU 128 CO -0.02 -0.58 0.79 -1.59 0.23 0.00 0.00 176.35 175.17 1h26 s LYS 129 N 2.52 0.98 0.53 1.70 -2.85 -1.26 -4.86 119.74 116.50 1h26 s LYS 129 Ca 0.51 -0.31 0.32 0.00 -1.00 0.00 0.00 55.97 55.50 1h26 s LYS 129 Cb -0.21 0.45 1.48 0.00 -2.06 0.00 0.00 37.83 37.49 1h26 s LYS 129 CO 0.17 -0.42 1.88 -1.35 0.10 0.00 0.00 175.35 175.73 1h26 h PRO 130 N 2.08 0.01 0.00 1.78 0.11 -1.94 0.63 132.00 134.68 1h26 h PRO 130 Ca -0.26 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1h26 h PRO 130 Cb 1.26 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1h26 h PRO 130 CO 0.34 0.01 -0.11 0.00 -0.21 0.00 0.00 178.00 178.02 1h26 n GLN 131 N -4.27 0.05 -0.62 1.05 0.00 -1.26 -1.85 117.38 110.49 1h26 n GLN 131 Ca 0.19 0.04 0.08 0.00 0.00 0.00 0.00 57.00 57.31 1h26 n GLN 131 Cb 0.99 -1.55 0.33 0.00 0.00 0.00 0.00 30.24 30.00 1h26 n GLN 131 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1h26 n ASN 132 N -1.64 4.66 -3.91 2.61 3.02 0.21 -4.86 115.26 115.35 1h26 n ASN 132 Ca 0.06 -2.71 -0.26 0.00 -0.03 0.00 0.00 54.58 51.65 1h26 n ASN 132 Cb 0.36 -0.57 -0.17 0.00 -0.61 0.00 0.00 39.78 38.79 1h26 n ASN 132 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1h26 s LEU 133 N -2.32 1.22 0.16 3.41 1.43 -1.17 -1.18 118.68 120.23 1h26 s LEU 133 Ca 0.47 -0.27 0.06 0.00 -1.03 0.00 0.00 54.13 53.36 1h26 s LEU 133 Cb 0.34 -0.78 -0.04 0.00 0.03 0.00 0.00 46.19 45.74 1h26 s LEU 133 CO 0.17 -0.09 0.05 -0.76 0.23 0.00 0.00 176.35 175.95 1h26 s LEU 134 N 1.49 3.52 0.09 1.79 1.43 -1.00 -1.03 118.68 124.96 1h26 s LEU 134 Ca 0.00 -0.26 0.04 0.00 -1.03 0.00 0.00 54.13 52.88 1h26 s LEU 134 Cb -0.13 -2.17 -0.03 0.00 0.03 0.00 0.00 46.19 43.89 1h26 s LEU 134 CO -0.05 0.09 -0.11 0.27 0.23 0.00 0.00 176.35 176.78 1h26 s ILE 135 N -1.68 0.99 0.53 -0.59 -4.36 -0.24 -0.70 121.20 115.15 1h26 s ILE 135 Ca 0.29 -1.49 0.06 0.00 -0.26 0.00 0.00 60.65 59.25 1h26 s ILE 135 Cb -0.10 -1.21 0.04 0.00 1.25 0.00 0.00 42.46 42.44 1h26 s ILE 135 CO 0.20 -0.42 0.45 0.54 0.24 0.00 0.00 174.94 175.95 1h26 s ASN 136 N -2.15 4.74 0.00 4.36 2.20 -0.74 -1.87 114.94 121.48 1h26 s ASN 136 Ca 0.02 -1.12 0.00 0.00 -0.94 0.00 0.00 52.86 50.81 1h26 s ASN 136 Cb -0.06 0.26 0.00 0.00 -2.00 0.00 0.00 41.25 39.45 1h26 s ASN 136 CO 0.01 -1.07 0.96 0.35 -2.94 0.00 0.00 177.10 174.41 1h26 n THR 137 N -1.80 0.00 -0.42 0.54 -2.24 -1.26 -3.62 114.28 105.48 1h26 n THR 137 Ca 0.02 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.81 1h26 n THR 137 Cb 0.64 -0.04 0.02 0.00 -2.10 0.00 0.00 70.33 68.85 1h26 n THR 137 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1h26 n GLU 138 N -0.47 2.05 -0.08 -0.78 1.02 -1.26 -4.68 120.64 116.45 1h26 n GLU 138 Ca 0.00 -1.42 0.00 0.00 -0.02 0.00 0.00 57.16 55.72 1h26 n GLU 138 Cb 0.02 -0.94 0.00 0.00 -0.02 0.00 0.00 31.44 30.49 1h26 n GLU 138 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h26 n GLY 139 N -0.50 0.59 3.86 0.62 0.00 -1.24 -4.65 105.19 103.88 1h26 n GLY 139 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 1h26 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h26 s ALA 140 N -2.13 3.25 -0.01 4.61 0.00 -1.26 -4.82 121.76 121.38 1h26 s ALA 140 Ca 0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 51.96 51.83 1h26 s ALA 140 Cb 0.00 -2.85 0.00 0.00 0.00 0.00 0.00 23.12 20.27 1h26 s ALA 140 CO 0.00 -0.09 0.13 -1.50 0.00 0.00 0.00 175.76 174.30 1h26 s ILE 141 N -2.46 0.06 0.05 0.00 2.07 -1.26 -1.80 121.20 117.86 1h26 s ILE 141 Ca 0.54 -0.50 0.02 0.00 -1.41 0.00 0.00 60.65 59.30 1h26 s ILE 141 Cb -0.10 -0.36 -0.03 0.00 0.13 0.00 0.00 42.46 42.10 1h26 s ILE 141 CO 0.31 -0.27 -0.07 -0.54 -1.91 0.00 0.00 174.94 172.46 1h26 s LYS 142 N -0.95 0.57 -0.01 3.50 1.02 0.12 -4.63 119.74 119.36 1h26 s LYS 142 Ca -0.10 -0.87 -0.30 0.00 0.02 0.00 0.00 55.97 54.71 1h26 s LYS 142 Cb -0.06 -0.24 -0.05 0.00 -0.52 0.00 0.00 37.83 36.97 1h26 s LYS 142 CO 0.01 0.03 1.34 -0.51 -0.92 0.00 0.00 175.35 175.29 1h26 s LEU 143 N -1.88 4.31 0.00 3.17 1.43 0.36 -2.38 118.68 123.68 1h26 s LEU 143 Ca -0.06 2.04 0.00 0.00 -1.03 0.00 0.00 54.13 55.08 1h26 s LEU 143 Cb -0.07 -3.56 -0.00 0.00 0.03 0.00 0.00 46.19 42.59 1h26 s LEU 143 CO -0.01 -0.67 0.01 0.00 0.23 0.00 0.00 176.35 175.92 1h26 n ALA 144 N 5.18 0.06 -2.96 4.21 0.00 -0.33 -0.76 120.51 125.90 1h26 n ALA 144 Ca 0.12 -0.22 -0.03 0.00 0.00 0.00 0.00 53.44 53.32 1h26 n ALA 144 Cb 0.44 0.14 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1h26 n ALA 144 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1h26 n ASP 145 N -1.91 -5.86 -1.48 0.00 -0.08 -1.26 -4.79 116.55 101.18 1h26 n ASP 145 Ca -0.01 0.32 0.07 0.00 -1.51 0.00 0.00 54.79 53.66 1h26 n ASP 145 Cb 0.06 -1.42 0.31 0.00 2.34 0.00 0.00 41.12 42.41 1h26 n ASP 145 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1h26 n PHE 146 N 1.11 1.43 -0.00 -0.67 3.01 -1.26 -4.47 117.46 116.60 1h26 n PHE 146 Ca -0.01 -0.53 0.23 0.00 1.01 0.00 0.00 57.45 58.15 1h26 n PHE 146 Cb 0.47 -0.30 0.72 0.00 -0.01 0.00 0.00 39.48 40.35 1h26 n PHE 146 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1h26 h GLY 147 N 4.36 0.00 -1.04 1.37 0.00 -1.91 -0.61 103.07 105.24 1h26 h GLY 147 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1h26 h GLY 147 CO 0.28 0.00 0.00 -0.10 0.00 0.00 0.00 176.54 176.72 1h26 n LEU 148 N -3.88 2.50 -4.76 3.11 7.94 -1.26 -4.65 117.00 116.00 1h26 n LEU 148 Ca 0.11 -1.66 -0.30 0.00 -1.11 0.00 0.00 56.01 53.06 1h26 n LEU 148 Cb 0.76 -0.14 0.11 0.00 0.53 0.00 0.00 43.42 44.69 1h26 n LEU 148 CO 0.31 0.59 0.69 0.00 -1.11 0.00 0.00 177.39 177.87 1h26 s ALA 149 N -0.94 1.92 0.14 1.96 0.00 -0.24 -4.63 121.76 119.97 1h26 s ALA 149 Ca 0.18 -0.07 -0.14 0.00 0.00 0.00 0.00 51.96 51.92 1h26 s ALA 149 Cb 0.10 -3.17 0.02 0.00 0.00 0.00 0.00 23.12 20.07 1h26 s ALA 149 CO 0.14 -2.02 0.38 -0.98 0.00 0.00 0.00 175.76 173.27 1h26 s ARG 150 N -5.01 1.12 -0.41 0.00 1.70 -0.62 -4.88 118.95 110.84 1h26 s ARG 150 Ca 0.62 -0.84 -0.17 0.00 -0.47 0.00 0.00 55.73 54.87 1h26 s ARG 150 Cb -0.16 0.45 0.02 0.00 -0.57 0.00 0.00 34.95 34.68 1h26 s ARG 150 CO 0.56 -0.43 0.40 0.00 -1.08 0.00 0.00 175.30 174.75 1h26 s ALA 151 N -3.85 3.44 0.68 7.88 0.00 -1.26 -1.26 121.76 127.39 1h26 s ALA 151 Ca 0.06 -1.51 -0.08 0.00 0.00 0.00 0.00 51.96 50.44 1h26 s ALA 151 Cb 0.02 -3.00 0.04 0.00 0.00 0.00 0.00 23.12 20.18 1h26 s ALA 151 CO -0.08 -1.50 1.01 -0.59 0.00 0.00 0.00 175.76 174.60 1h26 s PHE 152 N 2.04 3.09 0.38 0.00 -0.71 -0.53 -5.01 117.98 117.25 1h26 s PHE 152 Ca 0.11 0.64 0.08 0.00 -1.04 0.00 0.00 56.93 56.72 1h26 s PHE 152 Cb -0.17 -3.06 -0.06 0.00 -1.21 0.00 0.00 43.02 38.52 1h26 s PHE 152 CO 0.13 -1.23 0.07 0.20 -1.34 0.00 0.00 175.22 173.05 1h26 s GLY 153 N -4.43 2.23 -0.20 1.99 0.00 -1.26 -4.89 107.32 100.75 1h26 s GLY 153 Ca 0.58 -2.06 0.00 0.00 0.00 0.00 0.00 44.72 43.24 1h26 s GLY 153 CO 0.46 -1.93 -0.07 0.14 0.00 0.00 0.00 173.10 171.70 1h26 s VAL 154 N -2.57 1.47 0.83 1.40 1.01 -1.26 -2.41 120.40 118.86 1h26 s VAL 154 Ca 0.37 -1.00 -0.11 0.00 0.00 0.00 0.00 61.98 61.24 1h26 s VAL 154 Cb 0.03 -1.64 0.09 0.00 0.00 0.00 0.00 36.38 34.85 1h26 s VAL 154 CO 0.20 0.06 1.09 -2.16 0.00 0.00 0.00 175.10 174.29 1h26 s PRO 155 N 1.45 1.85 0.34 2.72 0.04 -1.26 -5.14 135.00 134.99 1h26 s PRO 155 Ca -0.03 0.75 -0.26 0.00 0.04 0.00 0.00 61.00 61.50 1h26 s PRO 155 Cb -0.17 -1.88 -0.10 0.00 0.04 0.00 0.00 34.50 32.39 1h26 s PRO 155 CO -0.07 -1.81 0.98 0.14 0.04 0.00 0.00 177.00 176.27 1h26 s VAL 156 N -3.06 4.05 0.81 -0.36 -7.23 -1.01 -5.07 120.40 108.53 1h26 s VAL 156 Ca 0.62 1.70 -0.06 0.00 -1.81 0.00 0.00 61.98 62.43 1h26 s VAL 156 Cb -0.16 -3.94 0.16 0.00 0.56 0.00 0.00 36.38 33.00 1h26 s VAL 156 CO 0.55 0.13 1.11 -0.13 -0.31 0.00 0.00 175.10 176.45 1h26 s ARG 157 N -2.10 1.29 0.05 4.82 0.52 -1.26 -4.98 118.95 117.29 1h26 s ARG 157 Ca 0.51 -0.93 -0.30 0.00 -0.52 0.00 0.00 55.73 54.49 1h26 s ARG 157 Cb -0.20 -2.17 -0.05 0.00 0.52 0.00 0.00 34.95 33.04 1h26 s ARG 157 CO 0.26 -1.80 1.17 0.99 0.02 0.00 0.00 175.30 175.94 1h26 s THR 158 N -3.40 4.14 0.04 0.02 2.01 -1.26 -4.58 115.64 112.61 1h26 s THR 158 Ca 0.69 1.53 0.00 0.00 0.31 0.00 0.00 61.69 64.23 1h26 s THR 158 Cb -0.04 -3.98 0.00 0.00 0.01 0.00 0.00 72.50 68.48 1h26 s THR 158 CO 0.47 0.11 0.00 -1.22 -0.69 0.00 0.00 174.62 173.30 1h26 n TYR 159 N 4.00 -0.03 0.00 4.92 4.01 -1.26 -5.10 117.16 123.70 1h26 n TYR 159 Ca 0.09 0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 1h26 n TYR 159 Cb 0.47 0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.51 1h26 n TYR 159 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1h26 n HIS 161 N -3.20 0.00 -1.79 -0.72 -0.00 -1.26 -5.06 115.22 103.19 1h26 n HIS 161 Ca 0.00 0.00 -0.26 0.00 0.46 0.00 0.00 57.72 57.92 1h26 n HIS 161 Cb 0.29 0.00 -0.08 0.00 -0.12 0.00 0.00 29.99 30.08 1h26 n HIS 161 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 1h26 n GLU 162 N -0.87 1.11 -3.65 1.57 4.71 -1.26 -4.85 120.64 117.40 1h26 n GLU 162 Ca 0.00 -2.15 -0.12 0.00 -0.01 0.00 0.00 57.16 54.88 1h26 n GLU 162 Cb 0.11 -3.67 -0.08 0.00 -1.01 0.00 0.00 31.44 26.78 1h26 n GLU 162 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1h26 s VAL 163 N 12.16 -0.00 0.00 2.62 0.11 -1.26 -5.08 120.40 128.95 1h26 s VAL 163 Ca 0.71 0.01 0.00 0.00 -2.93 0.00 0.00 61.98 59.77 1h26 s VAL 163 Cb 0.00 -0.91 0.00 0.00 -1.53 0.00 0.00 36.38 33.94 1h26 s VAL 163 CO 0.16 0.00 0.00 0.52 -3.33 0.00 0.00 175.10 172.45 1h26 n VAL 164 N 3.24 -1.88 -1.46 2.04 0.31 -0.92 -4.97 118.33 114.69 1h26 n VAL 164 Ca -0.16 0.00 -0.49 0.00 -0.01 0.00 0.00 64.34 63.68 1h26 n VAL 164 Cb 0.56 -1.88 -0.03 0.00 -0.91 0.00 0.00 33.84 31.58 1h26 n VAL 164 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1h26 n THR 165 N 0.10 1.69 0.00 2.52 -1.04 -1.26 -4.73 114.28 111.56 1h26 n THR 165 Ca 0.00 -0.42 0.00 0.00 -2.04 0.00 0.00 64.05 61.59 1h26 n THR 165 Cb 0.00 -0.24 0.00 0.00 -1.82 0.00 0.00 70.33 68.27 1h26 n THR 165 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1h26 n LEU 166 N 1.81 0.00 -0.54 -4.42 7.94 -1.26 -1.87 117.00 118.66 1h26 n LEU 166 Ca 0.17 0.95 0.44 0.00 -1.11 0.00 0.00 56.01 56.46 1h26 n LEU 166 Cb 0.24 -0.45 0.73 0.00 0.53 0.00 0.00 43.42 44.46 1h26 n LEU 166 CO 0.58 -0.45 1.33 -0.50 -1.11 0.00 0.00 177.39 177.23 1h26 h TRP 167 N 0.00 0.31 -0.43 1.96 4.06 -1.86 0.19 115.95 120.19 1h26 h TRP 167 Ca 0.00 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.96 1h26 h TRP 167 Cb 0.00 -0.07 0.00 0.00 -1.00 0.00 0.00 29.16 28.09 1h26 h TRP 167 CO -0.76 -0.15 0.00 0.66 -3.56 0.00 0.00 178.44 174.63 1h26 n TYR 168 N -4.42 0.56 -2.81 0.49 4.01 -0.78 -4.55 117.16 109.65 1h26 n TYR 168 Ca 0.40 -0.30 -0.41 0.00 -0.16 0.00 0.00 57.90 57.44 1h26 n TYR 168 Cb 1.67 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 40.66 1h26 n TYR 168 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1h26 s ARG 169 N -1.36 4.58 0.43 -0.72 3.52 0.67 -4.26 118.95 121.81 1h26 s ARG 169 Ca 0.39 1.29 -0.14 0.00 -0.13 0.00 0.00 55.73 57.14 1h26 s ARG 169 Cb 0.22 -3.41 -0.08 0.00 -1.56 0.00 0.00 34.95 30.12 1h26 s ARG 169 CO 0.30 0.12 0.84 0.00 -0.81 0.00 0.00 175.30 175.76 1h26 s ALA 170 N 0.44 3.23 0.31 6.12 0.00 -1.26 -4.86 121.76 125.74 1h26 s ALA 170 Ca 0.46 0.00 0.03 0.00 0.00 0.00 0.00 51.96 52.45 1h26 s ALA 170 Cb -0.21 -2.88 0.61 0.00 0.00 0.00 0.00 23.12 20.64 1h26 s ALA 170 CO 0.26 -0.01 1.89 -1.00 0.00 0.00 0.00 175.76 176.90 1h26 h PRO 171 N 1.37 0.90 -0.19 0.00 0.13 -1.95 0.51 132.00 132.77 1h26 h PRO 171 Ca -0.47 -0.05 0.06 0.00 -0.87 0.00 0.00 66.00 64.66 1h26 h PRO 171 Cb 1.18 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 32.10 1h26 h PRO 171 CO 0.63 0.60 0.17 1.05 -0.23 0.00 0.00 178.00 180.22 1h26 h GLU 172 N 0.93 0.00 0.00 0.86 9.09 -1.93 -0.94 114.58 122.59 1h26 h GLU 172 Ca 0.42 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.80 1h26 h GLU 172 Cb 0.37 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.47 1h26 h GLU 172 CO -0.18 0.00 -0.15 0.82 0.05 0.00 0.00 179.01 179.55 1h26 h ILE 173 N 0.00 1.61 -0.82 -1.06 2.04 -1.26 -2.22 117.51 115.80 1h26 h ILE 173 Ca 0.09 -2.26 0.23 0.00 1.00 0.00 0.00 64.86 63.91 1h26 h ILE 173 Cb 0.43 3.10 -0.04 0.00 -0.74 0.00 0.00 36.82 39.57 1h26 h ILE 173 CO -0.00 0.55 0.58 -0.07 0.00 0.00 0.00 178.15 179.21 1h26 h LEU 174 N -1.00 0.08 -1.17 1.44 3.38 -0.64 0.44 115.31 117.84 1h26 h LEU 174 Ca -0.04 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1h26 h LEU 174 Cb 0.99 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1h26 h LEU 174 CO -0.02 0.03 -0.17 0.18 0.09 0.00 0.00 178.44 178.55 1h26 n LEU 175 N -4.34 1.98 -2.48 1.67 4.77 -0.46 -4.95 117.00 113.19 1h26 n LEU 175 Ca 0.17 -0.66 -0.18 0.00 -0.03 0.00 0.00 56.01 55.30 1h26 n LEU 175 Cb 0.84 -0.02 0.03 0.00 -2.33 0.00 0.00 43.42 41.93 1h26 n LEU 175 CO 0.37 0.34 -0.02 0.61 -1.33 0.00 0.00 177.39 177.36 1h26 n GLY 176 N 1.32 -0.32 3.66 -0.72 0.00 0.15 -4.91 105.19 104.38 1h26 n GLY 176 Ca 0.14 -0.04 -0.49 0.00 0.00 0.00 0.00 46.02 45.62 1h26 n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h26 n LYS 178 N 4.07 -0.20 -4.17 0.00 4.81 -1.26 -4.60 118.16 116.82 1h26 n LYS 178 Ca 0.20 0.99 -0.28 0.00 -0.87 0.00 0.00 58.31 58.34 1h26 n LYS 178 Cb 0.24 -1.46 -0.08 0.00 0.02 0.00 0.00 35.03 33.76 1h26 n LYS 178 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1h26 s TYR 179 N -5.50 2.91 0.13 5.64 2.02 -1.26 -4.64 117.35 116.66 1h26 s TYR 179 Ca -0.08 -0.09 -0.14 0.00 -0.37 0.00 0.00 57.07 56.39 1h26 s TYR 179 Cb 0.11 -1.45 0.02 0.00 -0.40 0.00 0.00 41.96 40.24 1h26 s TYR 179 CO 0.44 0.49 0.37 1.52 -1.57 0.00 0.00 175.55 176.80 1h26 s TYR 180 N -1.52 -0.04 0.00 2.71 -0.85 -1.26 -4.97 117.35 111.42 1h26 s TYR 180 Ca 0.26 -0.31 0.00 0.00 -0.52 0.00 0.00 57.07 56.51 1h26 s TYR 180 Cb -0.10 0.18 0.00 0.00 0.38 0.00 0.00 41.96 42.42 1h26 s TYR 180 CO 0.18 -0.71 0.00 0.45 -1.52 0.00 0.00 175.55 173.95 1h26 n SER 181 N -0.21 1.34 -0.14 -0.18 2.88 -1.26 -4.90 113.62 111.15 1h26 n SER 181 Ca -0.14 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.57 1h26 n SER 181 Cb 0.63 0.00 0.55 0.00 -0.75 0.00 0.00 64.21 64.64 1h26 n SER 181 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1h26 h THR 182 N 0.00 0.76 -1.05 2.46 1.35 -1.99 0.49 112.91 114.94 1h26 h THR 182 Ca 0.00 -0.11 0.30 0.00 -0.55 0.00 0.00 66.41 66.05 1h26 h THR 182 Cb 0.00 0.41 -0.13 0.00 -1.73 0.00 0.00 68.15 66.70 1h26 h THR 182 CO 0.00 0.06 0.63 0.00 -0.25 0.00 0.00 175.52 175.96 1h26 h ALA 183 N 1.65 2.05 -0.09 6.62 0.00 -1.90 0.18 119.26 127.78 1h26 h ALA 183 Ca 0.36 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.35 1h26 h ALA 183 Cb 0.94 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1h26 h ALA 183 CO -0.10 -0.58 -0.18 -0.39 0.00 0.00 0.00 179.25 178.00 1h26 h VAL 184 N 0.39 1.18 -0.10 0.00 -1.51 -0.41 -1.51 116.25 114.29 1h26 h VAL 184 Ca 0.69 -0.82 -0.19 0.00 -1.23 0.00 0.00 66.70 65.15 1h26 h VAL 184 Cb 1.60 1.32 -0.00 0.00 -2.13 0.00 0.00 31.29 32.08 1h26 h VAL 184 CO -0.48 0.25 -0.73 0.44 -1.23 0.00 0.00 177.57 175.82 1h26 h ASP 185 N 0.13 0.58 -0.18 4.19 3.32 -0.79 -2.91 116.42 120.76 1h26 h ASP 185 Ca 0.03 -0.38 -0.01 0.00 0.02 0.00 0.00 57.03 56.69 1h26 h ASP 185 Cb 0.41 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1h26 h ASP 185 CO 0.03 1.12 0.09 0.40 -1.72 0.00 0.00 179.24 179.16 1h26 h ILE 186 N 0.34 1.13 -0.84 0.35 1.08 -1.14 -2.36 117.51 116.06 1h26 h ILE 186 Ca -0.03 -0.37 0.21 0.00 -0.39 0.00 0.00 64.86 64.28 1h26 h ILE 186 Cb 1.31 1.04 -0.15 0.00 -3.07 0.00 0.00 36.82 35.95 1h26 h ILE 186 CO 0.13 0.12 0.05 -0.25 -0.69 0.00 0.00 178.15 177.51 1h26 h TRP 187 N 0.16 0.02 0.11 1.37 2.91 -1.27 0.31 115.95 119.56 1h26 h TRP 187 Ca 0.06 0.06 -0.00 0.00 1.13 0.00 0.00 58.89 60.14 1h26 h TRP 187 Cb 0.11 0.12 -0.00 0.00 -0.51 0.00 0.00 29.16 28.89 1h26 h TRP 187 CO -0.03 -0.28 -0.07 0.77 -1.03 0.00 0.00 178.44 177.80 1h26 h SER 188 N 0.10 -0.18 -0.35 2.65 0.02 -1.24 0.28 113.55 114.83 1h26 h SER 188 Ca 0.49 0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.46 1h26 h SER 188 Cb 0.92 0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.49 1h26 h SER 188 CO -0.73 -0.12 0.23 -0.07 -1.14 0.00 0.00 176.83 175.01 1h26 h LEU 189 N -0.18 0.38 0.22 5.07 3.38 -0.68 0.44 115.31 123.95 1h26 h LEU 189 Ca -0.01 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1h26 h LEU 189 Cb 0.15 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1h26 h LEU 189 CO 0.01 0.27 -0.28 1.23 0.09 0.00 0.00 178.44 179.76 1h26 h GLY 190 N 0.45 -0.60 1.55 0.83 0.00 0.77 1.44 103.07 107.52 1h26 h GLY 190 Ca 0.13 0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.78 1h26 h GLY 190 CO -0.03 -0.24 0.23 0.00 0.00 0.00 0.00 176.54 176.49 1h26 h ILE 192 N 0.60 1.38 -0.65 0.00 2.04 0.17 -2.48 117.51 118.56 1h26 h ILE 192 Ca 0.15 -1.65 0.12 0.00 1.00 0.00 0.00 64.86 64.49 1h26 h ILE 192 Cb 0.04 2.12 -0.12 0.00 -0.74 0.00 0.00 36.82 38.11 1h26 h ILE 192 CO -0.02 0.49 -0.26 0.15 0.00 0.00 0.00 178.15 178.51 1h26 h PHE 193 N 0.03 -0.65 -0.90 1.37 -0.00 0.25 -1.31 116.94 115.73 1h26 h PHE 193 Ca -0.01 0.07 0.03 0.00 -0.00 0.00 0.00 57.97 58.06 1h26 h PHE 193 Cb 0.96 0.38 -0.05 0.00 -0.00 0.00 0.00 35.95 37.24 1h26 h PHE 193 CO 0.11 -0.34 0.59 0.00 -0.00 0.00 0.00 178.31 178.66 1h26 h ALA 194 N 1.36 1.18 -0.29 2.41 0.00 -1.31 -2.59 119.26 120.02 1h26 h ALA 194 Ca 0.29 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 1h26 h ALA 194 Cb 0.53 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1h26 h ALA 194 CO -0.71 0.47 -0.25 1.49 0.00 0.00 0.00 179.25 180.25 1h26 h GLU 195 N 1.15 0.56 -0.69 0.00 4.81 -0.79 -1.29 114.58 118.33 1h26 h GLU 195 Ca 0.35 -0.22 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 1h26 h GLU 195 Cb -0.03 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 1h26 h GLU 195 CO -0.11 0.76 0.14 0.52 -0.73 0.00 0.00 179.01 179.60 1h26 h MET 196 N 0.49 1.13 0.41 1.92 2.86 -0.99 1.92 114.93 122.67 1h26 h MET 196 Ca 0.07 -0.28 -0.02 0.00 -2.06 0.00 0.00 59.70 57.41 1h26 h MET 196 Cb 0.69 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.22 1h26 h MET 196 CO 0.05 1.01 -0.20 0.28 1.06 0.00 0.00 176.91 179.11 1h26 h VAL 197 N 1.06 0.50 0.00 -2.22 2.07 -1.17 -3.31 116.25 113.19 1h26 h VAL 197 Ca 0.21 -0.51 -0.14 0.00 0.82 0.00 0.00 66.70 67.09 1h26 h VAL 197 Cb 0.41 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1h26 h VAL 197 CO 0.01 0.08 -0.85 0.71 0.02 0.00 0.00 177.57 177.54 1h26 h THR 198 N -0.88 0.86 -0.01 2.57 1.35 -1.29 -3.46 112.91 112.05 1h26 h THR 198 Ca -0.06 -2.31 -0.00 0.00 -0.55 0.00 0.00 66.41 63.49 1h26 h THR 198 Cb 0.56 2.36 -0.00 0.00 -1.73 0.00 0.00 68.15 69.33 1h26 h THR 198 CO 0.09 0.49 -0.00 0.54 -0.25 0.00 0.00 175.52 176.39 1h26 n ARG 199 N -3.14 -0.02 -3.89 4.72 1.74 0.65 -5.03 116.66 111.69 1h26 n ARG 199 Ca -0.02 0.38 -0.11 0.00 -0.77 0.00 0.00 57.85 57.33 1h26 n ARG 199 Cb 0.80 -3.76 -0.11 0.00 -1.02 0.00 0.00 32.46 28.37 1h26 n ARG 199 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1h26 s ARG 200 N -1.49 0.39 -0.02 5.56 1.70 -1.15 -4.91 118.95 119.04 1h26 s ARG 200 Ca 0.00 -0.35 -0.40 0.00 -0.47 0.00 0.00 55.73 54.51 1h26 s ARG 200 Cb 0.00 0.16 -0.20 0.00 -0.57 0.00 0.00 34.95 34.34 1h26 s ARG 200 CO 0.00 -0.08 1.11 0.00 -1.08 0.00 0.00 175.30 175.24 1h26 n ALA 201 N 1.75 -3.43 -0.01 7.88 0.00 -1.26 -4.35 120.51 121.10 1h26 n ALA 201 Ca -0.21 0.59 -0.17 0.00 0.00 0.00 0.00 53.44 53.65 1h26 n ALA 201 Cb 0.56 -1.78 -0.09 0.00 0.00 0.00 0.00 19.45 18.13 1h26 n ALA 201 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1h26 h LEU 202 N 3.17 0.69 -6.47 0.00 5.85 -1.92 -3.39 115.31 113.23 1h26 h LEU 202 Ca -0.51 -0.69 -0.60 0.00 0.84 0.00 0.00 57.88 56.92 1h26 h LEU 202 Cb 1.42 -0.21 -0.41 0.00 0.37 0.00 0.00 40.66 41.83 1h26 h LEU 202 CO 0.67 1.28 -0.69 0.49 -0.34 0.00 0.00 178.44 179.85 1h26 n PHE 203 N -4.12 2.57 -1.59 1.25 0.99 -1.26 -5.04 117.46 110.25 1h26 n PHE 203 Ca -0.09 -4.05 -0.40 0.00 -0.00 0.00 0.00 57.45 52.91 1h26 n PHE 203 Cb 0.69 -0.48 -0.02 0.00 -1.00 0.00 0.00 39.48 38.68 1h26 n PHE 203 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 1h26 n PRO 204 N 1.47 3.71 -1.70 -1.08 -0.04 -1.26 -4.35 135.00 131.76 1h26 n PRO 204 Ca 0.26 -2.61 -0.34 0.00 -0.04 0.00 0.00 63.50 60.77 1h26 n PRO 204 Cb 0.41 -2.87 0.06 0.00 -0.04 0.00 0.00 33.50 31.06 1h26 n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1h26 s GLY 205 N 1.93 2.29 -0.25 0.55 0.00 -1.26 -4.97 107.32 105.61 1h26 s GLY 205 Ca 0.60 0.71 0.12 0.00 0.00 0.00 0.00 44.72 46.15 1h26 s GLY 205 CO -0.07 1.08 1.18 2.09 0.00 0.00 0.00 173.10 177.39 1h26 n ASP 206 N -2.39 3.36 0.00 1.64 5.68 -1.26 -4.76 116.55 118.82 1h26 n ASP 206 Ca 0.12 -3.39 0.00 0.00 -0.50 0.00 0.00 54.79 51.01 1h26 n ASP 206 Cb 0.51 -0.40 0.00 0.00 -1.14 0.00 0.00 41.12 40.09 1h26 n ASP 206 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1h26 n SER 207 N -0.71 0.00 0.22 -1.12 3.41 -1.26 -4.98 113.62 109.18 1h26 n SER 207 Ca 0.30 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.75 1h26 n SER 207 Cb 0.89 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.76 1h26 n SER 207 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1h26 h GLU 208 N 0.00 -0.49 -0.27 4.33 5.08 -2.00 -1.70 114.58 119.52 1h26 h GLU 208 Ca 0.00 0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1h26 h GLU 208 Cb 0.00 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1h26 h GLU 208 CO 0.00 -0.30 0.04 0.97 -1.00 0.00 0.00 179.01 178.72 1h26 h ILE 209 N -0.56 1.14 -0.14 3.13 6.09 -1.97 -2.19 117.51 123.02 1h26 h ILE 209 Ca -0.05 -0.53 -0.01 0.00 -1.37 0.00 0.00 64.86 62.90 1h26 h ILE 209 Cb 0.42 0.89 -0.01 0.00 0.47 0.00 0.00 36.82 38.60 1h26 h ILE 209 CO 0.09 0.18 0.03 -0.78 -3.07 0.00 0.00 178.15 174.60 1h26 h ASP 210 N 0.39 0.21 -0.41 2.19 3.58 -1.89 -1.65 116.42 118.85 1h26 h ASP 210 Ca 0.09 -0.24 0.08 0.00 0.42 0.00 0.00 57.03 57.38 1h26 h ASP 210 Cb 0.19 -0.06 -0.08 0.00 1.72 0.00 0.00 39.33 41.10 1h26 h ASP 210 CO -0.00 0.40 -0.16 -0.61 -2.88 0.00 0.00 179.24 176.00 1h26 h GLN 211 N 0.02 -0.07 -0.21 0.28 5.75 -0.70 -0.20 115.11 119.97 1h26 h GLN 211 Ca 0.04 0.00 0.06 0.00 -0.15 0.00 0.00 58.65 58.60 1h26 h GLN 211 Cb 0.28 0.02 -0.06 0.00 1.07 0.00 0.00 27.48 28.78 1h26 h GLN 211 CO 0.00 -0.05 -0.18 -0.07 -2.65 0.00 0.00 178.83 175.89 1h26 h LEU 212 N -0.07 -0.57 -0.77 -2.39 3.38 -1.23 -0.76 115.31 112.89 1h26 h LEU 212 Ca 0.20 0.11 -0.09 0.00 0.09 0.00 0.00 57.88 58.19 1h26 h LEU 212 Cb 0.38 0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1h26 h LEU 212 CO -0.46 -0.22 -0.07 -0.26 0.09 0.00 0.00 178.44 177.52 1h26 h PHE 213 N -0.19 0.94 -0.23 1.13 0.05 -0.31 0.98 116.94 119.31 1h26 h PHE 213 Ca 0.13 -0.16 -0.04 0.00 3.82 0.00 0.00 57.97 61.72 1h26 h PHE 213 Cb 0.37 -0.24 -0.01 0.00 2.00 0.00 0.00 35.95 38.07 1h26 h PHE 213 CO -0.33 0.89 -0.02 0.00 -0.18 0.00 0.00 178.31 178.67 1h26 h ARG 214 N 0.78 0.34 0.48 1.51 3.08 -0.55 0.22 114.38 120.24 1h26 h ARG 214 Ca 0.14 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 1h26 h ARG 214 Cb 0.56 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1h26 h ARG 214 CO 0.03 0.38 -0.23 0.82 -1.07 0.00 0.00 179.97 179.90 1h26 h ILE 215 N 0.33 0.00 -0.91 2.04 2.04 0.61 -3.00 117.51 118.62 1h26 h ILE 215 Ca 0.07 -0.51 0.23 0.00 1.00 0.00 0.00 64.86 65.65 1h26 h ILE 215 Cb 0.25 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.17 1h26 h ILE 215 CO 0.01 0.00 0.02 -0.26 0.00 0.00 0.00 178.15 177.91 1h26 h PHE 216 N -1.16 -0.05 -0.88 1.37 0.05 -1.05 -0.00 116.94 115.23 1h26 h PHE 216 Ca -0.07 0.07 0.11 0.00 3.82 0.00 0.00 57.97 61.90 1h26 h PHE 216 Cb 0.49 0.17 -0.06 0.00 2.00 0.00 0.00 35.95 38.55 1h26 h PHE 216 CO 0.00 -0.36 0.57 -0.09 -0.18 0.00 0.00 178.31 178.25 1h26 h ARG 217 N 0.05 0.79 -0.02 1.51 2.43 -0.56 0.83 114.38 119.41 1h26 h ARG 217 Ca 0.53 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.65 1h26 h ARG 217 Cb 1.03 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.40 1h26 h ARG 217 CO -0.83 0.52 -0.08 2.41 -1.51 0.00 0.00 179.97 180.49 1h26 n THR 218 N -4.54 0.00 0.00 0.20 -1.04 -0.19 -4.46 114.28 104.25 1h26 n THR 218 Ca 0.15 -0.46 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 1h26 n THR 218 Cb 0.35 1.39 0.00 0.00 -1.82 0.00 0.00 70.33 70.25 1h26 n THR 218 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1h26 n LEU 219 N 0.92 0.00 -0.15 -4.42 4.77 -0.21 -5.06 117.00 112.84 1h26 n LEU 219 Ca 0.11 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1h26 n LEU 219 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1h26 n LEU 219 CO 0.15 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.82 1h26 n GLY 220 N 0.61 0.20 0.00 -0.72 0.00 0.28 -4.98 105.19 100.58 1h26 n GLY 220 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1h26 n GLY 220 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1h26 n THR 221 N 2.39 0.00 0.00 2.61 -1.04 -1.24 -4.78 114.28 112.23 1h26 n THR 221 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1h26 n THR 221 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1h26 n THR 221 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1h26 n VAL 251 N 0.00 0.00 -3.95 12.58 0.31 -1.26 -5.08 118.33 120.93 1h26 n VAL 251 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.03 1h26 n VAL 251 Cb 0.00 0.00 -0.14 0.00 -0.91 0.00 0.00 33.84 32.79 1h26 n VAL 251 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1h26 s VAL 252 N 0.00 2.58 0.05 2.52 1.01 -1.26 -5.03 120.40 120.27 1h26 s VAL 252 Ca 0.00 -3.15 -0.24 0.00 0.00 0.00 0.00 61.98 58.59 1h26 s VAL 252 Cb 0.00 -2.81 -0.12 0.00 0.00 0.00 0.00 36.38 33.45 1h26 s VAL 252 CO 0.00 -0.77 1.36 -0.65 0.00 0.00 0.00 175.10 175.04 1h26 h PRO 253 N 6.70 -0.72 0.00 2.72 0.11 -1.99 -3.23 132.00 135.59 1h26 h PRO 253 Ca -0.07 0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1h26 h PRO 253 Cb 0.91 0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1h26 h PRO 253 CO 0.66 -0.48 0.00 -2.30 -0.21 0.00 0.00 178.00 175.67 1h26 n PRO 254 N -4.37 0.07 -3.00 1.05 -0.02 -1.26 -4.74 135.00 122.72 1h26 n PRO 254 Ca -0.09 0.26 -0.40 0.00 -2.02 0.00 0.00 63.50 61.25 1h26 n PRO 254 Cb 0.32 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.25 1h26 n PRO 254 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1h26 s LEU 255 N -2.68 4.43 0.00 2.45 2.96 -1.22 -5.06 118.68 119.56 1h26 s LEU 255 Ca 0.06 1.39 -0.10 0.00 -0.22 0.00 0.00 54.13 55.26 1h26 s LEU 255 Cb 0.04 -3.19 0.14 0.00 0.50 0.00 0.00 46.19 43.69 1h26 s LEU 255 CO 0.11 -0.00 0.60 -0.90 -1.32 0.00 0.00 176.35 174.83 1h26 n ASP 256 N 2.96 -1.09 0.26 3.68 3.85 -1.26 -4.73 116.55 120.23 1h26 n ASP 256 Ca -0.02 -0.96 -0.15 0.00 -0.71 0.00 0.00 54.79 52.95 1h26 n ASP 256 Cb 0.50 -0.52 -0.08 0.00 -1.35 0.00 0.00 41.12 39.68 1h26 n ASP 256 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1h26 h GLU 257 N 0.00 -0.65 -0.49 0.11 4.81 -1.99 -2.21 114.58 114.15 1h26 h GLU 257 Ca -0.21 0.04 0.10 0.00 -0.13 0.00 0.00 59.36 59.16 1h26 h GLU 257 Cb 0.63 0.15 -0.08 0.00 0.63 0.00 0.00 28.75 30.08 1h26 h GLU 257 CO 0.14 -0.35 -0.01 -0.44 -0.73 0.00 0.00 179.01 177.62 1h26 h ASP 258 N -0.91 -0.23 -0.28 1.04 3.32 -1.97 -2.82 116.42 114.57 1h26 h ASP 258 Ca -0.07 0.12 0.03 0.00 0.02 0.00 0.00 57.03 57.13 1h26 h ASP 258 Cb 0.60 0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.33 1h26 h ASP 258 CO 0.11 -0.08 -0.18 1.23 -1.72 0.00 0.00 179.24 178.61 1h26 h GLY 259 N 0.10 -2.13 0.36 2.75 0.00 -1.86 -0.04 103.07 102.25 1h26 h GLY 259 Ca 0.25 1.04 0.18 0.00 0.00 0.00 0.00 47.33 48.80 1h26 h GLY 259 CO -0.42 -0.70 0.59 3.21 0.00 0.00 0.00 176.54 179.21 1h26 h ARG 260 N -0.01 0.53 -0.29 4.80 3.08 -1.22 -0.29 114.38 120.97 1h26 h ARG 260 Ca 0.05 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 59.97 1h26 h ARG 260 Cb 0.13 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1h26 h ARG 260 CO -0.27 0.35 -0.19 1.03 -1.07 0.00 0.00 179.97 179.82 1h26 h SER 261 N 0.54 0.66 0.24 7.04 0.87 -0.79 0.38 113.55 122.50 1h26 h SER 261 Ca 0.48 -0.43 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 1h26 h SER 261 Cb 0.99 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.77 1h26 h SER 261 CO -0.21 0.95 -0.12 0.25 -0.53 0.00 0.00 176.83 177.17 1h26 h LEU 262 N 0.38 -0.28 -0.80 2.23 5.85 -0.38 -1.75 115.31 120.56 1h26 h LEU 262 Ca 0.06 -0.16 0.19 0.00 0.84 0.00 0.00 57.88 58.80 1h26 h LEU 262 Cb 0.73 0.07 -0.14 0.00 0.37 0.00 0.00 40.66 41.69 1h26 h LEU 262 CO 0.05 0.02 -0.01 0.25 -0.34 0.00 0.00 178.44 178.41 1h26 h LEU 263 N -0.58 -0.40 -1.02 2.25 5.85 -1.05 0.20 115.31 120.56 1h26 h LEU 263 Ca -0.03 0.21 -0.10 0.00 0.84 0.00 0.00 57.88 58.80 1h26 h LEU 263 Cb 0.42 0.38 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 1h26 h LEU 263 CO 0.05 -0.21 -0.41 -1.28 -0.34 0.00 0.00 178.44 176.25 1h26 h SER 264 N 0.08 0.16 1.73 1.25 0.87 -0.04 -1.40 113.55 116.21 1h26 h SER 264 Ca 0.44 -0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.91 1h26 h SER 264 Cb 0.80 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.71 1h26 h SER 264 CO -0.72 0.56 -0.27 1.56 -0.53 0.00 0.00 176.83 177.43 1h26 h GLN 265 N 0.13 0.00 0.00 2.24 4.20 0.11 -3.10 115.11 118.70 1h26 h GLN 265 Ca 0.01 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.59 1h26 h GLN 265 Cb 0.78 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.55 1h26 h GLN 265 CO 0.06 0.10 -0.63 0.52 -0.67 0.00 0.00 178.83 178.21 1h26 h MET 266 N 0.00 0.00 -0.76 1.46 2.86 0.04 -1.67 114.93 116.86 1h26 h MET 266 Ca -0.01 0.00 -0.46 0.00 -2.06 0.00 0.00 59.70 57.18 1h26 h MET 266 Cb 1.09 0.00 -0.26 0.00 0.06 0.00 0.00 31.60 32.49 1h26 h MET 266 CO 0.01 0.63 0.28 1.28 1.06 0.00 0.00 176.91 180.17 1h26 n LEU 267 N -3.30 5.92 -4.74 1.22 4.77 -0.60 -3.90 117.00 116.37 1h26 n LEU 267 Ca 0.01 -4.00 -0.41 0.00 -0.03 0.00 0.00 56.01 51.58 1h26 n LEU 267 Cb 0.77 -0.75 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1h26 n LEU 267 CO 0.42 1.38 1.02 -2.28 -1.33 0.00 0.00 177.39 176.59 1h26 s HIS 268 N -3.46 3.19 0.11 -1.77 2.46 -1.19 -4.94 115.29 109.68 1h26 s HIS 268 Ca 0.54 1.18 -0.27 0.00 0.47 0.00 0.00 55.06 56.99 1h26 s HIS 268 Cb 0.46 -3.66 -0.09 0.00 -0.13 0.00 0.00 32.58 29.15 1h26 s HIS 268 CO 0.03 -2.08 1.65 1.88 -2.47 0.00 0.00 174.74 173.75 1h26 h TYR 269 N 5.18 -0.63 -2.93 3.88 0.05 -1.95 -3.40 116.97 117.17 1h26 h TYR 269 Ca -0.45 0.01 -0.57 0.00 0.05 0.00 0.00 58.73 57.77 1h26 h TYR 269 Cb 1.22 0.26 -0.04 0.00 1.01 0.00 0.00 36.73 39.17 1h26 h TYR 269 CO 0.61 -0.34 0.88 0.34 -1.05 0.00 0.00 178.16 178.61 1h26 s ASP 270 N -4.83 6.96 0.15 3.88 -1.08 -1.26 -4.80 116.67 115.68 1h26 s ASP 270 Ca -0.15 1.69 -0.17 0.00 -0.52 0.00 0.00 52.55 53.40 1h26 s ASP 270 Cb 0.08 -2.54 -0.00 0.00 -1.46 0.00 0.00 42.92 38.99 1h26 s ASP 270 CO 0.65 -0.74 1.80 -0.65 0.52 0.00 0.00 175.17 176.75 1h26 h PRO 271 N 8.11 0.46 -0.09 4.34 0.11 -1.95 -0.97 132.00 142.01 1h26 h PRO 271 Ca -0.27 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.84 1h26 h PRO 271 Cb 1.11 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 1h26 h PRO 271 CO 0.96 0.30 0.14 -0.91 -0.21 0.00 0.00 178.00 178.29 1h26 h ASN 272 N 0.47 0.00 -0.01 -2.05 4.21 -1.95 -1.53 115.58 114.72 1h26 h ASN 272 Ca 0.13 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.64 1h26 h ASN 272 Cb -0.05 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.15 1h26 h ASN 272 CO -0.03 0.00 -0.19 0.29 -1.29 0.00 0.00 177.43 176.20 1h26 n LYS 273 N -3.50 1.54 -2.09 0.81 4.76 -0.98 -4.94 118.16 113.76 1h26 n LYS 273 Ca -0.01 -1.01 -0.39 0.00 -2.87 0.00 0.00 58.31 54.04 1h26 n LYS 273 Cb 0.24 -1.25 -0.00 0.00 -1.84 0.00 0.00 35.03 32.17 1h26 n LYS 273 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1h26 s ARG 274 N -1.59 3.82 0.38 1.97 3.52 -0.41 -4.90 118.95 121.73 1h26 s ARG 274 Ca 0.14 2.04 -0.28 0.00 -0.13 0.00 0.00 55.73 57.51 1h26 s ARG 274 Cb 0.12 -2.60 -0.11 0.00 -1.56 0.00 0.00 34.95 30.80 1h26 s ARG 274 CO 0.30 -0.58 1.49 1.51 -0.81 0.00 0.00 175.30 177.21 1h26 n ILE 275 N -0.17 1.97 -1.96 4.11 3.06 -0.63 -5.01 119.36 120.74 1h26 n ILE 275 Ca 0.05 -0.49 -0.30 0.00 -2.50 0.00 0.00 62.75 59.51 1h26 n ILE 275 Cb 0.45 -1.97 0.03 0.00 0.54 0.00 0.00 39.64 38.69 1h26 n ILE 275 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 1h26 s SER 276 N -0.12 5.86 0.05 9.51 1.04 -1.26 -4.88 113.70 123.90 1h26 s SER 276 Ca 0.53 1.22 -0.23 0.00 0.48 0.00 0.00 55.95 57.96 1h26 s SER 276 Cb -0.48 -2.17 -0.14 0.00 0.10 0.00 0.00 66.02 63.33 1h26 s SER 276 CO 0.63 -1.06 1.52 0.00 0.98 0.00 0.00 173.24 175.32 1h26 h ALA 277 N -0.42 0.11 -0.31 5.32 0.00 -1.95 -2.32 119.26 119.70 1h26 h ALA 277 Ca -0.45 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.38 1h26 h ALA 277 Cb 1.22 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.90 1h26 h ALA 277 CO 0.63 -0.25 -0.42 -0.22 0.00 0.00 0.00 179.25 178.99 1h26 h LYS 278 N -0.08 -0.37 -0.17 0.00 3.64 -1.92 -1.52 116.57 116.15 1h26 h LYS 278 Ca 0.03 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1h26 h LYS 278 Cb 0.27 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 1h26 h LYS 278 CO 0.00 -0.25 -0.18 0.00 -2.27 0.00 0.00 179.45 176.75 1h26 h ALA 279 N 0.32 -0.41 -1.24 5.00 0.00 -1.96 0.72 119.26 121.70 1h26 h ALA 279 Ca 0.12 0.01 0.36 0.00 0.00 0.00 0.00 54.91 55.39 1h26 h ALA 279 Cb 0.60 0.89 -0.05 0.00 0.00 0.00 0.00 17.79 19.23 1h26 h ALA 279 CO -0.51 -0.50 1.16 0.00 0.00 0.00 0.00 179.25 179.40 1h26 h ALA 280 N -0.82 3.14 0.00 0.00 0.00 -0.72 1.20 119.26 122.06 1h26 h ALA 280 Ca 0.03 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1h26 h ALA 280 Cb 0.18 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1h26 h ALA 280 CO -0.21 -1.80 -0.23 -0.07 0.00 0.00 0.00 179.25 176.94 1h26 h LEU 281 N 0.00 0.00 -0.40 0.00 3.38 -0.03 -2.88 115.31 115.38 1h26 h LEU 281 Ca 0.59 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.56 1h26 h LEU 281 Cb 2.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.65 1h26 h LEU 281 CO -0.01 0.23 -0.56 0.00 0.09 0.00 0.00 178.44 178.19 1h26 n ALA 282 N -2.35 3.75 -1.76 1.53 0.00 0.41 -4.93 120.51 117.16 1h26 n ALA 282 Ca -0.02 -0.51 -0.39 0.00 0.00 0.00 0.00 53.44 52.53 1h26 n ALA 282 Cb 0.33 -0.94 0.02 0.00 0.00 0.00 0.00 19.45 18.85 1h26 n ALA 282 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1h26 s HIS 283 N -2.73 2.53 0.53 0.00 5.04 -1.09 -4.92 115.29 114.65 1h26 s HIS 283 Ca 0.16 1.39 0.21 0.00 -1.54 0.00 0.00 55.06 55.28 1h26 s HIS 283 Cb 0.18 -3.72 1.34 0.00 0.04 0.00 0.00 32.58 30.42 1h26 s HIS 283 CO 0.66 -2.48 2.07 -1.35 -2.34 0.00 0.00 174.74 171.30 1h26 h PRO 284 N 1.96 0.00 -0.26 2.88 0.11 -1.92 -1.49 132.00 133.28 1h26 h PRO 284 Ca -0.50 0.00 0.07 0.00 0.11 0.00 0.00 66.00 65.68 1h26 h PRO 284 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1h26 h PRO 284 CO 0.60 0.00 0.54 0.35 -0.21 0.00 0.00 178.00 179.28 1h26 h PHE 285 N 0.00 0.00 -0.45 0.65 3.57 -1.91 -1.48 116.94 117.32 1h26 h PHE 285 Ca 0.13 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.63 1h26 h PHE 285 Cb 0.54 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.28 1h26 h PHE 285 CO 0.00 0.00 0.00 1.19 -2.23 0.00 0.00 178.31 177.27 1h26 n PHE 286 N -3.18 0.58 0.12 0.41 3.72 -0.56 -4.46 117.46 114.10 1h26 n PHE 286 Ca 0.04 -0.34 -0.01 0.00 -0.05 0.00 0.00 57.45 57.09 1h26 n PHE 286 Cb 0.66 -0.00 0.23 0.00 -0.94 0.00 0.00 39.48 39.42 1h26 n PHE 286 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1h26 h GLN 287 N 3.88 0.13 -0.73 -1.08 3.07 -1.44 -3.00 115.11 115.93 1h26 h GLN 287 Ca 0.00 -0.07 0.00 0.00 0.09 0.00 0.00 58.65 58.67 1h26 h GLN 287 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.47 1h26 h GLN 287 CO 0.00 0.58 0.00 -0.40 0.09 0.00 0.00 178.83 179.10 1h26 n ASP 288 N -3.96 4.09 -4.64 0.06 5.68 -1.26 -5.02 116.55 111.50 1h26 n ASP 288 Ca -0.02 -2.07 -0.46 0.00 -0.50 0.00 0.00 54.79 51.75 1h26 n ASP 288 Cb 0.52 -0.51 -0.03 0.00 -1.14 0.00 0.00 41.12 39.96 1h26 n ASP 288 CO 0.00 0.00 0.00 0.55 -1.33 0.00 0.00 177.20 176.42 1h26 n VAL 289 N 1.58 1.11 -4.31 2.12 3.14 -1.14 -5.01 118.33 115.82 1h26 n VAL 289 Ca 0.25 -0.28 -0.14 0.00 -2.96 0.00 0.00 64.34 61.21 1h26 n VAL 289 Cb 0.66 -1.28 -0.03 0.00 -1.06 0.00 0.00 33.84 32.13 1h26 n VAL 289 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 1h26 n THR 290 N 1.52 0.00 -3.69 1.55 -2.24 -1.26 -5.07 114.28 105.08 1h26 n THR 290 Ca 0.12 -1.19 -0.27 0.00 -2.27 0.00 0.00 64.05 60.43 1h26 n THR 290 Cb 0.30 0.34 -0.10 0.00 -2.10 0.00 0.00 70.33 68.77 1h26 n THR 290 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1h26 n LYS 291 N -0.54 1.89 -2.16 -0.78 4.81 -1.26 -4.25 118.16 115.88 1h26 n LYS 291 Ca -0.06 -4.41 -0.33 0.00 -0.87 0.00 0.00 58.31 52.64 1h26 n LYS 291 Cb 0.31 -2.20 0.00 0.00 0.02 0.00 0.00 35.03 33.17 1h26 n LYS 291 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1h26 s PRO 292 N -1.66 3.43 0.40 1.64 0.04 -1.26 -4.86 135.00 132.73 1h26 s PRO 292 Ca 0.30 1.24 -0.23 0.00 0.04 0.00 0.00 61.00 62.35 1h26 s PRO 292 Cb 0.03 -2.05 -0.10 0.00 0.04 0.00 0.00 34.50 32.42 1h26 s PRO 292 CO -0.12 -0.72 0.98 0.08 0.04 0.00 0.00 177.00 177.25 1h26 s VAL 293 N -2.35 4.16 0.22 -0.36 1.01 -1.26 -4.20 120.40 117.63 1h26 s VAL 293 Ca 0.64 1.51 -0.09 0.00 0.00 0.00 0.00 61.98 64.04 1h26 s VAL 293 Cb -0.16 -3.71 -0.07 0.00 0.00 0.00 0.00 36.38 32.44 1h26 s VAL 293 CO 0.33 -0.13 0.53 -2.16 0.00 0.00 0.00 175.10 173.67 1h26 s PRO 294 N -2.77 3.77 -0.84 2.72 0.04 -1.26 -4.96 135.00 131.71 1h26 s PRO 294 Ca 0.59 0.22 -0.25 0.00 0.04 0.00 0.00 61.00 61.60 1h26 s PRO 294 Cb -0.15 -2.67 0.02 0.00 0.04 0.00 0.00 34.50 31.75 1h26 s PRO 294 CO 0.19 0.32 1.49 -1.58 0.04 0.00 0.00 177.00 177.46 1h26 s HIS 295 N -1.82 2.23 0.47 0.56 5.65 -1.26 -4.96 115.29 116.16 1h26 s HIS 295 Ca 0.47 -0.13 0.07 0.00 0.25 0.00 0.00 55.06 55.71 1h26 s HIS 295 Cb -0.11 -4.52 0.03 0.00 -1.18 0.00 0.00 32.58 26.80 1h26 s HIS 295 CO 0.22 -2.03 0.64 -0.51 -0.65 0.00 0.00 174.74 172.42 1h26 s LEU 296 N 6.40 3.51 0.00 8.88 1.43 -1.26 -5.10 118.68 132.54 1h26 s LEU 296 Ca 0.47 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 1h26 s LEU 296 Cb -0.06 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.60 1h26 s LEU 296 CO 0.06 -0.92 0.00 -1.14 0.23 0.00 0.00 176.35 174.57