#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mh0 n PRO 6 N 0.00 -1.95 -2.91 -0.14 -0.04 -1.26 -4.96 135.00 123.74 3mh0 n PRO 6 Ca 0.00 -0.53 -0.41 0.00 -0.04 0.00 0.00 63.50 62.52 3mh0 n PRO 6 Cb 0.00 -2.19 -0.04 0.00 -0.04 0.00 0.00 33.50 31.23 3mh0 n PRO 6 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3mh0 s THR 7 N -2.45 4.96 0.32 0.52 2.01 -1.26 -5.00 115.64 114.74 3mh0 s THR 7 Ca 0.68 1.68 -0.00 0.00 0.31 0.00 0.00 61.69 64.35 3mh0 s THR 7 Cb -0.24 -4.15 -0.04 0.00 0.01 0.00 0.00 72.50 68.08 3mh0 s THR 7 CO 0.64 0.17 0.53 -0.36 -0.69 0.00 0.00 174.62 174.91 3mh0 s PHE 8 N 1.16 3.50 0.07 4.92 0.40 -1.26 -1.45 117.98 125.31 3mh0 s PHE 8 Ca 0.42 0.39 0.02 0.00 -0.60 0.00 0.00 56.93 57.16 3mh0 s PHE 8 Cb -0.18 -1.92 -0.03 0.00 0.51 0.00 0.00 43.02 41.39 3mh0 s PHE 8 CO 0.20 0.16 -0.07 1.52 0.70 0.00 0.00 175.22 177.72 3mh0 s TYR 9 N -2.24 0.79 0.00 0.36 -0.85 0.11 -4.86 117.35 110.66 3mh0 s TYR 9 Ca 0.40 -0.70 0.01 0.00 -0.52 0.00 0.00 57.07 56.27 3mh0 s TYR 9 Cb -0.10 -0.46 -0.04 0.00 0.38 0.00 0.00 41.96 41.74 3mh0 s TYR 9 CO 0.34 -0.11 0.01 1.03 -1.52 0.00 0.00 175.55 175.30 3mh0 s ARG 10 N -2.66 2.80 -0.01 -3.49 0.52 -1.26 -1.37 118.95 113.49 3mh0 s ARG 10 Ca 0.01 -0.61 -0.23 0.00 -0.52 0.00 0.00 55.73 54.37 3mh0 s ARG 10 Cb -0.03 -2.68 0.05 0.00 0.52 0.00 0.00 34.95 32.81 3mh0 s ARG 10 CO -0.02 0.62 0.51 -1.14 0.02 0.00 0.00 175.30 175.30 3mh0 s GLN 11 N -1.59 0.94 -0.18 3.54 0.74 -0.32 -5.00 119.66 117.78 3mh0 s GLN 11 Ca 0.20 -0.05 -0.03 0.00 0.05 0.00 0.00 55.36 55.53 3mh0 s GLN 11 Cb -0.12 0.43 -0.02 0.00 1.10 0.00 0.00 33.01 34.41 3mh0 s GLN 11 CO 0.11 -0.30 -0.06 -2.00 -0.55 0.00 0.00 175.29 172.49 3mh0 s GLU 12 N -1.66 3.50 -0.15 1.67 2.12 -1.26 -0.88 118.70 122.03 3mh0 s GLU 12 Ca -0.10 -0.59 0.00 0.00 0.36 0.00 0.00 54.97 54.64 3mh0 s GLU 12 Cb -0.02 -2.90 0.03 0.00 0.26 0.00 0.00 34.13 31.50 3mh0 s GLU 12 CO 0.04 0.06 -0.11 -0.51 -0.54 0.00 0.00 175.26 174.21 3mh0 s LEU 13 N 0.81 1.69 -1.14 2.70 2.01 0.81 -4.80 118.68 120.75 3mh0 s LEU 13 Ca -0.02 -0.56 -0.22 0.00 0.01 0.00 0.00 54.13 53.34 3mh0 s LEU 13 Cb -0.15 -1.08 -0.00 0.00 0.01 0.00 0.00 46.19 44.97 3mh0 s LEU 13 CO 0.02 -0.11 0.79 0.59 1.01 0.00 0.00 176.35 178.64 3mh0 n ASN 14 N 4.81 -5.22 -1.54 2.29 5.03 -1.26 -1.13 115.26 118.24 3mh0 n ASN 14 Ca -0.15 -1.05 -0.05 0.00 0.87 0.00 0.00 54.58 54.20 3mh0 n ASN 14 Cb 0.49 -3.21 -0.02 0.00 -1.02 0.00 0.00 39.78 36.02 3mh0 n ASN 14 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3mh0 n LYS 15 N -4.27 -1.57 -4.69 3.52 5.02 -1.26 -4.93 118.16 109.97 3mh0 n LYS 15 Ca -0.09 0.29 -0.32 0.00 -2.02 0.00 0.00 58.31 56.17 3mh0 n LYS 15 Cb 0.59 -4.52 -0.12 0.00 -0.02 0.00 0.00 35.03 30.95 3mh0 n LYS 15 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3mh0 s THR 16 N -1.69 3.07 -0.16 -0.18 -4.23 -0.28 -5.10 115.64 107.07 3mh0 s THR 16 Ca 0.00 -0.95 -0.18 0.00 -1.18 0.00 0.00 61.69 59.37 3mh0 s THR 16 Cb 0.00 -2.27 -0.04 0.00 1.34 0.00 0.00 72.50 71.53 3mh0 s THR 16 CO 0.00 0.43 0.51 -0.63 -0.54 0.00 0.00 174.62 174.38 3mh0 s ILE 17 N -0.88 5.14 -0.17 2.99 -1.09 -1.26 -0.14 121.20 125.79 3mh0 s ILE 17 Ca 0.14 0.97 -0.02 0.00 -2.23 0.00 0.00 60.65 59.52 3mh0 s ILE 17 Cb -0.11 -3.84 -0.01 0.00 -1.58 0.00 0.00 42.46 36.93 3mh0 s ILE 17 CO 0.04 0.25 -0.10 0.26 -1.23 0.00 0.00 174.94 174.16 3mh0 s TRP 18 N 1.14 2.87 -0.25 3.97 0.52 -0.06 -4.99 118.94 122.14 3mh0 s TRP 18 Ca 0.25 -0.83 0.03 0.00 0.02 0.00 0.00 56.10 55.57 3mh0 s TRP 18 Cb -0.15 -1.95 0.06 0.00 -1.15 0.00 0.00 33.47 30.27 3mh0 s TRP 18 CO 0.10 -0.38 -0.11 -2.00 0.02 0.00 0.00 176.95 174.58 3mh0 s GLU 19 N 0.85 2.22 0.11 4.98 2.12 -1.26 -1.18 118.70 126.54 3mh0 s GLU 19 Ca -0.03 -1.27 0.04 0.00 0.36 0.00 0.00 54.97 54.07 3mh0 s GLU 19 Cb -0.15 -2.83 -0.04 0.00 0.26 0.00 0.00 34.13 31.37 3mh0 s GLU 19 CO 0.00 -0.55 -0.10 0.14 -0.54 0.00 0.00 175.26 174.22 3mh0 s VAL 20 N 1.15 0.97 0.63 3.70 -7.23 -0.47 -4.62 120.40 114.54 3mh0 s VAL 20 Ca -0.08 -1.76 -0.18 0.00 -1.81 0.00 0.00 61.98 58.15 3mh0 s VAL 20 Cb -0.19 -1.50 -0.01 0.00 0.56 0.00 0.00 36.38 35.23 3mh0 s VAL 20 CO -0.06 -0.63 1.23 -2.84 -0.31 0.00 0.00 175.10 172.49 3mh0 s PRO 21 N -3.10 2.71 0.49 4.82 0.02 -1.26 0.05 135.00 138.73 3mh0 s PRO 21 Ca 0.09 1.86 0.22 0.00 0.02 0.00 0.00 61.00 63.19 3mh0 s PRO 21 Cb -0.01 -1.89 1.28 0.00 0.02 0.00 0.00 34.50 33.90 3mh0 s PRO 21 CO -0.00 -1.42 2.04 1.05 -0.33 0.00 0.00 177.00 178.34 3mh0 h GLU 22 N 0.56 0.00 -0.84 5.54 4.11 -1.58 -1.70 114.58 120.67 3mh0 h GLU 22 Ca -0.50 0.00 0.24 0.00 0.07 0.00 0.00 59.36 59.17 3mh0 h GLU 22 Cb 1.31 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.52 3mh0 h GLU 22 CO 0.54 0.15 0.64 0.07 0.07 0.00 0.00 179.01 180.47 3mh0 h ARG 23 N 0.00 0.00 -5.08 1.06 0.11 -1.92 -3.37 114.38 105.18 3mh0 h ARG 23 Ca -0.00 0.00 -0.67 0.00 0.10 0.00 0.00 59.98 59.40 3mh0 h ARG 23 Cb 0.32 0.00 -0.17 0.00 1.11 0.00 0.00 29.97 31.23 3mh0 h ARG 23 CO 0.02 0.00 -0.09 0.71 0.10 0.00 0.00 179.97 180.71 3mh0 s TYR 24 N -4.90 3.14 0.35 4.08 1.51 -0.64 -0.06 117.35 120.83 3mh0 s TYR 24 Ca -0.05 -0.19 0.09 0.00 -1.01 0.00 0.00 57.07 55.92 3mh0 s TYR 24 Cb 0.20 -3.02 -0.06 0.00 -0.11 0.00 0.00 41.96 38.97 3mh0 s TYR 24 CO 0.73 -0.72 -0.06 -0.65 -1.11 0.00 0.00 175.55 173.75 3mh0 s GLN 25 N 2.37 1.90 -0.94 -0.62 -1.52 0.30 -4.84 119.66 116.31 3mh0 s GLN 25 Ca 0.16 -1.91 -0.05 0.00 -1.95 0.00 0.00 55.36 51.62 3mh0 s GLN 25 Cb -0.16 -1.76 0.01 0.00 -0.22 0.00 0.00 33.01 30.88 3mh0 s GLN 25 CO 0.15 0.12 0.82 0.09 -0.25 0.00 0.00 175.29 176.21 3mh0 n ASN 26 N -0.86 -4.34 -4.74 5.90 3.02 -1.26 0.38 115.26 113.36 3mh0 n ASN 26 Ca -0.05 -0.40 -0.41 0.00 -0.03 0.00 0.00 54.58 53.69 3mh0 n ASN 26 Cb 0.64 -3.76 -0.02 0.00 -0.61 0.00 0.00 39.78 36.02 3mh0 n ASN 26 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3mh0 s LEU 27 N -5.41 4.39 -0.05 3.41 2.01 -1.26 -4.50 118.68 117.27 3mh0 s LEU 27 Ca 0.31 2.63 -0.02 0.00 0.01 0.00 0.00 54.13 57.06 3mh0 s LEU 27 Cb -0.14 -3.62 0.04 0.00 0.01 0.00 0.00 46.19 42.48 3mh0 s LEU 27 CO 0.52 -0.67 0.09 -0.55 1.01 0.00 0.00 176.35 176.76 3mh0 s SER 28 N 0.32 0.80 0.17 2.29 0.15 0.81 -4.96 113.70 113.28 3mh0 s SER 28 Ca 0.58 0.17 -0.32 0.00 0.70 0.00 0.00 55.95 57.09 3mh0 s SER 28 Cb -0.41 0.02 -0.11 0.00 -1.71 0.00 0.00 66.02 63.82 3mh0 s SER 28 CO 0.43 -0.23 1.62 -2.84 1.20 0.00 0.00 173.24 173.42 3mh0 s PRO 29 N 2.01 4.19 0.00 5.44 0.02 -1.26 0.34 135.00 145.74 3mh0 s PRO 29 Ca 0.02 2.43 0.00 0.00 0.02 0.00 0.00 61.00 63.47 3mh0 s PRO 29 Cb -0.12 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.26 3mh0 s PRO 29 CO -0.04 -0.65 0.00 1.33 -0.33 0.00 0.00 177.00 177.31 3mh0 n VAL 30 N 4.00 0.00 0.00 3.83 0.24 -0.69 -4.83 118.33 120.87 3mh0 n VAL 30 Ca 0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.44 3mh0 n VAL 30 Cb 0.38 -0.88 0.00 0.00 -1.47 0.00 0.00 33.84 31.87 3mh0 n VAL 30 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3mh0 n GLY 31 N 3.03 -0.28 0.00 7.63 0.00 -1.10 -4.98 105.19 109.49 3mh0 n GLY 31 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 46.02 46.61 3mh0 n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mh0 n GLY 36 N 0.00 0.00 3.76 -0.02 0.00 -1.25 -3.81 105.19 103.87 3mh0 n GLY 36 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 3mh0 n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mh0 s SER 37 N 0.00 5.33 -0.09 1.61 0.01 -0.32 -4.85 113.70 115.38 3mh0 s SER 37 Ca 0.00 -0.18 0.01 0.00 1.31 0.00 0.00 55.95 57.09 3mh0 s SER 37 Cb 0.00 -1.34 -0.02 0.00 0.21 0.00 0.00 66.02 64.87 3mh0 s SER 37 CO 0.00 0.09 -0.12 -0.69 0.41 0.00 0.00 173.24 172.93 3mh0 s VAL 38 N -1.69 3.24 -0.09 3.43 1.01 -1.25 -1.24 120.40 123.81 3mh0 s VAL 38 Ca 0.30 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.68 3mh0 s VAL 38 Cb -0.10 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 3mh0 s VAL 38 CO 0.22 0.56 -0.19 0.00 0.00 0.00 0.00 175.10 175.69 3mh0 s ALA 40 N -0.03 3.27 0.16 0.00 0.00 0.15 -0.08 121.76 125.24 3mh0 s ALA 40 Ca -0.05 1.03 -0.08 0.00 0.00 0.00 0.00 51.96 52.85 3mh0 s ALA 40 Cb -0.14 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.57 3mh0 s ALA 40 CO 0.05 -0.50 0.27 0.00 0.00 0.00 0.00 175.76 175.57 3mh0 s ALA 41 N -1.31 0.05 -0.23 0.00 0.00 0.02 -0.14 121.76 120.16 3mh0 s ALA 41 Ca 0.53 -0.92 -0.07 0.00 0.00 0.00 0.00 51.96 51.51 3mh0 s ALA 41 Cb -0.33 0.85 -0.03 0.00 0.00 0.00 0.00 23.12 23.62 3mh0 s ALA 41 CO 0.42 -0.63 0.05 0.12 0.00 0.00 0.00 175.76 175.72 3mh0 s PHE 42 N -3.97 3.08 -0.65 0.00 5.36 0.16 -0.54 117.98 121.42 3mh0 s PHE 42 Ca 0.17 -0.40 -0.21 0.00 -0.96 0.00 0.00 56.93 55.53 3mh0 s PHE 42 Cb 0.04 -2.19 0.08 0.00 -0.34 0.00 0.00 43.02 40.61 3mh0 s PHE 42 CO -0.00 -0.29 0.89 0.34 -1.46 0.00 0.00 175.22 174.69 3mh0 s ASP 43 N 1.36 6.19 0.00 6.13 2.15 -0.10 -0.54 116.67 131.87 3mh0 s ASP 43 Ca 0.05 -1.18 0.02 0.00 0.43 0.00 0.00 52.55 51.87 3mh0 s ASP 43 Cb -0.15 -2.38 0.09 0.00 -0.30 0.00 0.00 42.92 40.18 3mh0 s ASP 43 CO 0.03 -1.32 0.96 0.35 -0.17 0.00 0.00 175.17 175.02 3mh0 n THR 44 N 5.78 1.47 0.05 1.71 -2.24 0.91 -0.96 114.28 121.00 3mh0 n THR 44 Ca -0.05 0.37 -0.15 0.00 -2.27 0.00 0.00 64.05 61.95 3mh0 n THR 44 Cb 0.45 -1.34 -0.14 0.00 -2.10 0.00 0.00 70.33 67.20 3mh0 n THR 44 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3mh0 h LYS 45 N 0.00 0.21 -0.00 -0.78 3.11 -1.90 -3.37 116.57 113.83 3mh0 h LYS 45 Ca 0.00 -0.36 0.00 0.00 -2.81 0.00 0.00 60.65 57.48 3mh0 h LYS 45 Cb 0.02 0.13 0.00 0.00 -1.00 0.00 0.00 32.23 31.39 3mh0 h LYS 45 CO 0.00 1.06 -0.15 0.25 -2.81 0.00 0.00 179.45 177.79 3mh0 n THR 46 N -3.41 0.00 -2.46 1.00 -2.24 -1.01 -5.02 114.28 101.14 3mh0 n THR 46 Ca -0.16 -0.42 -0.21 0.00 -2.27 0.00 0.00 64.05 60.99 3mh0 n THR 46 Cb 1.04 1.03 -0.00 0.00 -2.10 0.00 0.00 70.33 70.29 3mh0 n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mh0 n GLY 47 N 0.88 -0.48 3.58 3.38 0.00 -0.14 -5.03 105.19 107.38 3mh0 n GLY 47 Ca 0.01 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3mh0 n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mh0 s LEU 48 N -5.97 2.88 0.23 0.99 1.43 -1.23 -4.92 118.68 112.10 3mh0 s LEU 48 Ca 0.03 -0.98 -0.28 0.00 -1.03 0.00 0.00 54.13 51.88 3mh0 s LEU 48 Cb -0.01 -1.29 -0.09 0.00 0.03 0.00 0.00 46.19 44.82 3mh0 s LEU 48 CO 0.04 -0.13 0.89 -0.13 0.23 0.00 0.00 176.35 177.25 3mh0 s ARG 49 N -3.64 4.71 0.09 1.70 1.81 -1.26 -0.93 118.95 121.44 3mh0 s ARG 49 Ca 0.33 1.35 0.02 0.00 -1.72 0.00 0.00 55.73 55.70 3mh0 s ARG 49 Cb -0.02 -3.19 -0.04 0.00 -0.45 0.00 0.00 34.95 31.25 3mh0 s ARG 49 CO 0.18 0.49 -0.06 0.14 -0.68 0.00 0.00 175.30 175.37 3mh0 s VAL 50 N -1.25 0.66 -0.11 3.52 -7.23 0.29 -3.39 120.40 112.90 3mh0 s VAL 50 Ca 0.41 -1.92 -0.02 0.00 -1.81 0.00 0.00 61.98 58.64 3mh0 s VAL 50 Cb -0.24 -1.66 -0.03 0.00 0.56 0.00 0.00 36.38 35.01 3mh0 s VAL 50 CO 0.29 -0.88 -0.02 0.00 -0.31 0.00 0.00 175.10 174.18 3mh0 s ALA 51 N -3.62 3.15 -0.17 1.32 0.00 -0.13 -0.80 121.76 121.51 3mh0 s ALA 51 Ca 0.11 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.26 3mh0 s ALA 51 Cb 0.05 -1.48 0.01 0.00 0.00 0.00 0.00 23.12 21.71 3mh0 s ALA 51 CO -0.05 0.45 -0.19 0.08 0.00 0.00 0.00 175.76 176.06 3mh0 s VAL 52 N -0.44 2.21 -0.25 0.00 1.01 0.89 -0.79 120.40 123.02 3mh0 s VAL 52 Ca 0.08 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 61.11 3mh0 s VAL 52 Cb -0.12 -1.93 0.01 0.00 0.00 0.00 0.00 36.38 34.34 3mh0 s VAL 52 CO 0.02 0.53 -0.01 -0.75 0.00 0.00 0.00 175.10 174.90 3mh0 s LYS 53 N 1.19 3.16 -0.29 2.72 2.20 -0.26 0.18 119.74 128.63 3mh0 s LYS 53 Ca 0.02 -0.78 -0.22 0.00 -0.36 0.00 0.00 55.97 54.63 3mh0 s LYS 53 Cb -0.14 -3.13 -0.01 0.00 -1.51 0.00 0.00 37.83 33.05 3mh0 s LYS 53 CO -0.09 -0.33 0.71 0.21 -0.36 0.00 0.00 175.35 175.49 3mh0 s LYS 54 N 1.45 4.00 0.47 4.03 2.20 -0.37 -0.92 119.74 130.60 3mh0 s LYS 54 Ca 0.03 0.54 -0.23 0.00 -0.36 0.00 0.00 55.97 55.95 3mh0 s LYS 54 Cb -0.16 -3.70 -0.07 0.00 -1.51 0.00 0.00 37.83 32.39 3mh0 s LYS 54 CO -0.02 -0.57 1.23 -0.51 -0.36 0.00 0.00 175.35 175.13 3mh0 s LEU 55 N 2.74 4.01 0.00 5.43 1.43 -0.83 -1.17 118.68 130.29 3mh0 s LEU 55 Ca 0.29 2.47 0.00 0.00 -1.03 0.00 0.00 54.13 55.87 3mh0 s LEU 55 Cb -0.15 -4.19 0.00 0.00 0.03 0.00 0.00 46.19 41.89 3mh0 s LEU 55 CO 0.11 -1.06 0.00 -1.20 0.23 0.00 0.00 176.35 174.43 3mh0 n SER 56 N -0.50 0.00 -3.78 2.29 7.64 -1.26 -4.59 113.62 113.42 3mh0 n SER 56 Ca 0.07 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.60 3mh0 n SER 56 Cb 0.46 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.63 3mh0 n SER 56 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3mh0 n ARG 57 N -0.32 3.48 -0.16 1.43 5.12 -1.26 -4.89 116.66 120.06 3mh0 n ARG 57 Ca 0.00 -4.60 0.04 0.00 -1.93 0.00 0.00 57.85 51.36 3mh0 n ARG 57 Cb 0.00 -2.40 0.33 0.00 -1.16 0.00 0.00 32.46 29.23 3mh0 n ARG 57 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 3mh0 h PRO 58 N 5.00 0.78 -0.08 5.56 0.11 -1.82 -2.76 132.00 138.79 3mh0 h PRO 58 Ca 0.20 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.26 3mh0 h PRO 58 Cb 0.66 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.59 3mh0 h PRO 58 CO 1.08 0.52 0.00 1.19 -0.21 0.00 0.00 178.00 180.58 3mh0 n PHE 59 N -4.46 0.22 -0.01 0.65 3.72 -1.26 -3.04 117.46 113.27 3mh0 n PHE 59 Ca 0.08 -0.82 0.00 0.00 -0.05 0.00 0.00 57.45 56.67 3mh0 n PHE 59 Cb 0.13 -0.15 0.30 0.00 -0.94 0.00 0.00 39.48 38.82 3mh0 n PHE 59 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 3mh0 h GLN 60 N 0.52 0.55 -4.83 -1.08 4.15 -1.84 -3.44 115.11 109.14 3mh0 h GLN 60 Ca 0.00 -0.11 -0.34 0.00 0.77 0.00 0.00 58.65 58.98 3mh0 h GLN 60 Cb 0.94 -0.09 -0.14 0.00 0.21 0.00 0.00 27.48 28.40 3mh0 h GLN 60 CO 0.04 0.55 -0.61 -1.54 -1.93 0.00 0.00 178.83 175.34 3mh0 s SER 61 N -6.72 1.03 0.14 -0.69 1.04 -1.26 -4.99 113.70 102.25 3mh0 s SER 61 Ca -0.08 -1.41 -0.18 0.00 0.48 0.00 0.00 55.95 54.76 3mh0 s SER 61 Cb 0.16 0.23 -0.01 0.00 0.10 0.00 0.00 66.02 66.50 3mh0 s SER 61 CO 0.76 -0.77 1.77 0.40 0.98 0.00 0.00 173.24 176.38 3mh0 h ILE 62 N 2.41 0.99 -0.78 -1.02 2.04 -1.91 0.14 117.51 119.38 3mh0 h ILE 62 Ca -0.37 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 65.42 3mh0 h ILE 62 Cb 1.25 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.96 3mh0 h ILE 62 CO 0.58 0.05 0.50 0.40 0.00 0.00 0.00 178.15 179.68 3mh0 h ILE 63 N 0.28 1.14 -0.47 -0.67 1.08 -1.95 -0.13 117.51 116.79 3mh0 h ILE 63 Ca 0.11 -0.34 -0.12 0.00 -0.39 0.00 0.00 64.86 64.12 3mh0 h ILE 63 Cb 0.04 0.07 -0.01 0.00 -3.07 0.00 0.00 36.82 33.84 3mh0 h ILE 63 CO -0.08 0.18 -0.19 0.45 -0.69 0.00 0.00 178.15 177.82 3mh0 h HIS 64 N 0.99 1.10 -0.68 1.37 3.86 -1.77 -2.12 115.15 117.89 3mh0 h HIS 64 Ca 0.30 -0.26 -0.04 0.00 -1.16 0.00 0.00 60.37 59.22 3mh0 h HIS 64 Cb -0.03 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 28.16 3mh0 h HIS 64 CO -0.03 1.07 0.27 0.00 0.86 0.00 0.00 177.93 180.10 3mh0 h ALA 65 N 0.86 1.20 -0.29 2.45 0.00 -0.25 -1.02 119.26 122.22 3mh0 h ALA 65 Ca 0.11 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 3mh0 h ALA 65 Cb 0.76 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 3mh0 h ALA 65 CO 0.06 0.58 -0.40 -0.22 0.00 0.00 0.00 179.25 179.28 3mh0 h LYS 66 N 0.98 0.78 -0.07 0.00 3.64 -0.85 -2.36 116.57 118.69 3mh0 h LYS 66 Ca 0.23 -0.45 -0.11 0.00 -1.27 0.00 0.00 60.65 59.04 3mh0 h LYS 66 Cb 0.19 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 3mh0 h LYS 66 CO -0.02 1.08 -0.47 0.07 -2.27 0.00 0.00 179.45 177.84 3mh0 h ARG 67 N 0.54 0.17 -0.42 1.90 -0.00 -1.18 0.21 114.38 115.59 3mh0 h ARG 67 Ca 0.03 -0.09 -0.00 0.00 -0.00 0.00 0.00 59.98 59.92 3mh0 h ARG 67 Cb 0.99 0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 30.94 3mh0 h ARG 67 CO 0.09 0.61 0.25 1.15 -0.00 0.00 0.00 179.97 182.07 3mh0 h THR 68 N 0.14 1.14 0.07 0.08 2.02 -1.06 0.70 112.91 115.99 3mh0 h THR 68 Ca 0.01 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 66.87 3mh0 h THR 68 Cb 0.89 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 67.89 3mh0 h THR 68 CO 0.07 0.14 -0.04 0.22 0.37 0.00 0.00 175.52 176.28 3mh0 h TYR 69 N 0.55 -0.09 -0.59 3.16 5.03 -0.99 -2.34 116.97 121.70 3mh0 h TYR 69 Ca 0.15 -0.00 0.12 0.00 2.58 0.00 0.00 58.73 61.58 3mh0 h TYR 69 Cb 0.01 0.03 -0.11 0.00 1.55 0.00 0.00 36.73 38.20 3mh0 h TYR 69 CO -0.03 0.15 -0.15 -0.09 -1.32 0.00 0.00 178.16 176.72 3mh0 h ARG 70 N -0.33 -0.00 -0.57 1.82 2.43 -0.55 0.07 114.38 117.24 3mh0 h ARG 70 Ca -0.01 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 3mh0 h ARG 70 Cb 0.28 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.80 3mh0 h ARG 70 CO 0.02 -0.00 0.36 1.49 -1.51 0.00 0.00 179.97 180.32 3mh0 h GLU 71 N -0.00 0.69 -0.23 0.20 4.81 -0.55 -0.46 114.58 119.02 3mh0 h GLU 71 Ca 0.28 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.42 3mh0 h GLU 71 Cb 0.43 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 3mh0 h GLU 71 CO -0.61 0.45 -0.06 1.25 -0.73 0.00 0.00 179.01 179.31 3mh0 h LEU 72 N 0.71 0.46 -0.51 1.64 6.46 -1.01 -1.24 115.31 121.82 3mh0 h LEU 72 Ca 0.23 -0.37 0.01 0.00 -0.12 0.00 0.00 57.88 57.63 3mh0 h LEU 72 Cb 0.00 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 39.78 3mh0 h LEU 72 CO -0.09 0.73 0.33 0.03 -0.62 0.00 0.00 178.44 178.82 3mh0 h ARG 73 N 0.19 0.65 0.15 1.25 2.47 -0.78 -0.91 114.38 117.41 3mh0 h ARG 73 Ca 0.06 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.73 3mh0 h ARG 73 Cb 0.53 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.70 3mh0 h ARG 73 CO 0.02 0.43 -0.07 -0.07 0.56 0.00 0.00 179.97 180.84 3mh0 h LEU 74 N 0.67 -0.17 -1.19 3.04 3.38 -1.01 -2.25 115.31 117.76 3mh0 h LEU 74 Ca 0.19 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 3mh0 h LEU 74 Cb -0.05 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 3mh0 h LEU 74 CO -0.05 -0.05 0.32 -0.07 0.09 0.00 0.00 178.44 178.68 3mh0 h LEU 75 N -0.28 0.79 -1.85 1.67 3.38 -1.12 -0.90 115.31 117.00 3mh0 h LEU 75 Ca -0.02 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 3mh0 h LEU 75 Cb 0.22 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3mh0 h LEU 75 CO 0.03 0.66 -0.08 0.11 0.09 0.00 0.00 178.44 179.25 3mh0 h LYS 76 N 0.88 0.00 0.10 1.13 1.57 -1.07 -3.07 116.57 116.11 3mh0 h LYS 76 Ca 0.22 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.73 3mh0 h LYS 76 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3mh0 h LYS 76 CO -0.03 0.08 -1.34 1.25 -0.57 0.00 0.00 179.45 178.84 3mh0 h HIS 77 N 0.00 0.38 -2.72 -1.35 2.76 -0.55 -3.46 115.15 110.21 3mh0 h HIS 77 Ca -0.00 -0.27 -0.58 0.00 -2.20 0.00 0.00 60.37 57.32 3mh0 h HIS 77 Cb 0.39 -0.02 -0.03 0.00 1.55 0.00 0.00 27.41 29.31 3mh0 h HIS 77 CO 0.00 1.26 1.26 -1.64 -1.30 0.00 0.00 177.93 177.51 3mh0 s MET 78 N -2.65 3.37 -0.48 5.26 -1.94 -1.06 -4.91 119.30 116.89 3mh0 s MET 78 Ca -0.05 1.41 0.04 0.00 -1.71 0.00 0.00 55.69 55.38 3mh0 s MET 78 Cb 0.07 -4.18 0.18 0.00 2.01 0.00 0.00 34.83 32.91 3mh0 s MET 78 CO 0.86 -1.81 0.39 1.63 -0.01 0.00 0.00 175.02 176.08 3mh0 n LYS 79 N 8.38 0.62 -3.66 2.03 5.02 -1.26 -4.31 118.16 124.99 3mh0 n LYS 79 Ca 0.22 -3.50 -0.15 0.00 -2.02 0.00 0.00 58.31 52.86 3mh0 n LYS 79 Cb 0.47 -1.79 -0.08 0.00 -0.02 0.00 0.00 35.03 33.61 3mh0 n LYS 79 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3mh0 s HIS 80 N -0.40 -0.39 0.46 2.13 2.46 -1.26 -5.03 115.29 113.27 3mh0 s HIS 80 Ca 0.31 0.66 0.15 0.00 0.47 0.00 0.00 55.06 56.65 3mh0 s HIS 80 Cb 0.03 0.23 1.06 0.00 -0.13 0.00 0.00 32.58 33.77 3mh0 s HIS 80 CO -0.19 -0.47 2.03 0.93 -2.47 0.00 0.00 174.74 174.57 3mh0 h GLU 81 N 3.57 0.01 -0.33 2.88 5.08 -1.98 -2.57 114.58 121.24 3mh0 h GLU 81 Ca -0.28 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 3mh0 h GLU 81 Cb 1.16 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 3mh0 h GLU 81 CO 0.39 0.14 0.00 0.09 -1.00 0.00 0.00 179.01 178.63 3mh0 n ASN 82 N -4.38 3.89 -4.05 1.42 4.13 -1.26 -4.76 115.26 110.25 3mh0 n ASN 82 Ca -0.03 -2.74 -0.25 0.00 1.68 0.00 0.00 54.58 53.24 3mh0 n ASN 82 Cb 0.20 -0.49 -0.16 0.00 -1.54 0.00 0.00 39.78 37.79 3mh0 n ASN 82 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3mh0 s VAL 83 N -2.34 1.22 0.20 2.41 1.01 -0.97 -1.11 120.40 120.81 3mh0 s VAL 83 Ca 0.40 -0.54 -0.30 0.00 0.00 0.00 0.00 61.98 61.53 3mh0 s VAL 83 Cb 0.30 -1.10 -0.09 0.00 0.00 0.00 0.00 36.38 35.49 3mh0 s VAL 83 CO 0.12 0.37 1.40 -0.51 0.00 0.00 0.00 175.10 176.48 3mh0 s ILE 84 N 0.52 2.97 0.49 2.22 1.10 -0.55 -4.44 121.20 123.50 3mh0 s ILE 84 Ca -0.13 0.77 0.03 0.00 -0.51 0.00 0.00 60.65 60.81 3mh0 s ILE 84 Cb -0.15 -3.49 -0.03 0.00 0.15 0.00 0.00 42.46 38.94 3mh0 s ILE 84 CO 0.04 0.10 0.01 -0.83 -2.11 0.00 0.00 174.94 172.14 3mh0 s GLY 85 N 0.57 2.90 -0.28 1.50 0.00 -1.26 -4.80 107.32 105.96 3mh0 s GLY 85 Ca 0.60 -0.84 -0.16 0.00 0.00 0.00 0.00 44.72 44.33 3mh0 s GLY 85 CO 0.38 -2.17 0.40 -2.27 0.00 0.00 0.00 173.10 169.44 3mh0 s LEU 86 N -3.83 4.09 0.05 0.66 0.20 -1.16 -4.65 118.68 114.03 3mh0 s LEU 86 Ca 0.13 0.27 -0.05 0.00 0.69 0.00 0.00 54.13 55.17 3mh0 s LEU 86 Cb 0.04 -2.47 -0.29 0.00 -0.43 0.00 0.00 46.19 43.04 3mh0 s LEU 86 CO 0.07 -0.23 1.06 -0.07 -0.29 0.00 0.00 176.35 176.89 3mh0 h LEU 87 N 8.67 0.44 -7.00 -0.68 4.07 -0.79 -3.43 115.31 116.59 3mh0 h LEU 87 Ca -0.31 -0.50 0.02 0.00 0.08 0.00 0.00 57.88 57.18 3mh0 h LEU 87 Cb 1.16 -0.14 -0.15 0.00 1.08 0.00 0.00 40.66 42.61 3mh0 h LEU 87 CO 0.67 1.40 0.32 -0.62 -1.08 0.00 0.00 178.44 179.12 3mh0 s ASP 88 N -7.13 -0.50 -0.06 -0.43 3.68 -1.03 -4.63 116.67 106.58 3mh0 s ASP 88 Ca -0.05 0.11 -0.04 0.00 2.13 0.00 0.00 52.55 54.70 3mh0 s ASP 88 Cb 0.07 0.50 0.02 0.00 -1.45 0.00 0.00 42.92 42.07 3mh0 s ASP 88 CO 0.88 -0.77 0.14 0.54 0.13 0.00 0.00 175.17 176.09 3mh0 s VAL 89 N -3.08 -0.02 0.15 1.11 0.11 -1.26 0.25 120.40 117.66 3mh0 s VAL 89 Ca 0.01 0.07 -0.13 0.00 -2.93 0.00 0.00 61.98 58.99 3mh0 s VAL 89 Cb -0.01 -0.21 0.02 0.00 -1.53 0.00 0.00 36.38 34.64 3mh0 s VAL 89 CO -0.08 0.03 0.36 0.72 -3.33 0.00 0.00 175.10 172.80 3mh0 s PHE 90 N 0.51 0.03 0.01 1.54 -0.12 -0.94 -5.00 117.98 114.02 3mh0 s PHE 90 Ca -0.04 -0.39 0.01 0.00 -0.05 0.00 0.00 56.93 56.47 3mh0 s PHE 90 Cb -0.05 0.16 -0.01 0.00 -0.63 0.00 0.00 43.02 42.48 3mh0 s PHE 90 CO -0.02 -0.73 -0.05 -0.08 -0.05 0.00 0.00 175.22 174.29 3mh0 s THR 91 N -3.87 0.33 0.40 -4.49 -1.32 -1.26 -1.69 115.64 103.74 3mh0 s THR 91 Ca 0.08 -0.53 0.11 0.00 -1.21 0.00 0.00 61.69 60.14 3mh0 s THR 91 Cb 0.02 -0.35 0.32 0.00 -1.51 0.00 0.00 72.50 70.99 3mh0 s THR 91 CO -0.06 -0.14 1.94 -0.65 -2.21 0.00 0.00 174.62 173.50 3mh0 h PRO 92 N 5.39 0.53 -6.25 7.08 0.11 -1.84 -3.44 132.00 133.59 3mh0 h PRO 92 Ca -0.30 -0.03 -0.67 0.00 0.11 0.00 0.00 66.00 65.10 3mh0 h PRO 92 Cb 1.20 -0.12 0.03 0.00 0.11 0.00 0.00 31.00 32.22 3mh0 h PRO 92 CO 0.46 0.35 0.87 0.00 -0.21 0.00 0.00 178.00 179.48 3mh0 n ALA 93 N -2.49 0.18 -2.26 -0.75 0.00 -1.26 -5.03 120.51 108.90 3mh0 n ALA 93 Ca 0.12 0.39 -0.29 0.00 0.00 0.00 0.00 53.44 53.66 3mh0 n ALA 93 Cb 0.38 -2.30 -0.02 0.00 0.00 0.00 0.00 19.45 17.51 3mh0 n ALA 93 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3mh0 s ARG 94 N 2.86 3.68 0.44 0.00 0.52 -1.26 -4.92 118.95 120.26 3mh0 s ARG 94 Ca 0.92 0.32 0.00 0.00 -0.52 0.00 0.00 55.73 56.45 3mh0 s ARG 94 Cb -0.89 -2.42 0.00 0.00 0.52 0.00 0.00 34.95 32.16 3mh0 s ARG 94 CO 0.55 -0.06 0.00 -1.13 0.02 0.00 0.00 175.30 174.67 3mh0 n SER 95 N -1.59 -6.96 -0.34 0.23 3.41 -1.26 -4.16 113.62 102.95 3mh0 n SER 95 Ca 0.01 1.08 0.16 0.00 -0.26 0.00 0.00 58.87 59.86 3mh0 n SER 95 Cb 0.54 -4.40 0.38 0.00 -0.26 0.00 0.00 64.21 60.48 3mh0 n SER 95 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3mh0 h LEU 96 N 1.42 0.68 -1.11 1.04 5.85 -1.97 -2.81 115.31 118.41 3mh0 h LEU 96 Ca 0.00 0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.75 3mh0 h LEU 96 Cb 0.09 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 3mh0 h LEU 96 CO 0.00 0.19 -0.12 -0.33 -0.34 0.00 0.00 178.44 177.84 3mh0 h GLU 97 N 0.63 0.49 -0.01 1.25 3.07 -2.01 -2.18 114.58 115.82 3mh0 h GLU 97 Ca 0.59 -0.14 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 3mh0 h GLU 97 Cb 1.11 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.96 3mh0 h GLU 97 CO -0.38 0.61 -0.06 0.39 -1.40 0.00 0.00 179.01 178.17 3mh0 n GLU 98 N -4.21 1.22 -2.01 2.33 1.02 -1.07 -4.89 120.64 113.03 3mh0 n GLU 98 Ca 0.01 -0.56 -0.43 0.00 -0.02 0.00 0.00 57.16 56.16 3mh0 n GLU 98 Cb 0.32 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.22 3mh0 n GLU 98 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 3mh0 s PHE 99 N -2.16 1.85 0.00 -0.32 5.36 -0.82 -4.62 117.98 117.27 3mh0 s PHE 99 Ca 0.36 0.56 0.00 0.00 -0.96 0.00 0.00 56.93 56.89 3mh0 s PHE 99 Cb 0.21 -4.08 0.00 0.00 -0.34 0.00 0.00 43.02 38.80 3mh0 s PHE 99 CO 0.39 -3.08 0.00 0.09 -1.46 0.00 0.00 175.22 171.16 3mh0 n ASN 100 N 9.68 0.23 -4.28 6.13 5.03 -1.26 -5.06 115.26 125.73 3mh0 n ASN 100 Ca 0.22 0.00 -0.25 0.00 0.87 0.00 0.00 54.58 55.42 3mh0 n ASN 100 Cb 0.46 0.05 -0.13 0.00 -1.02 0.00 0.00 39.78 39.14 3mh0 n ASN 100 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 3mh0 s ASP 101 N -0.12 2.56 -0.04 6.41 1.01 -1.26 -4.64 116.67 120.59 3mh0 s ASP 101 Ca 0.00 -0.64 0.01 0.00 0.71 0.00 0.00 52.55 52.63 3mh0 s ASP 101 Cb 0.00 -0.16 0.02 0.00 1.01 0.00 0.00 42.92 43.78 3mh0 s ASP 101 CO 0.00 0.09 -0.06 -0.69 0.21 0.00 0.00 175.17 174.72 3mh0 s VAL 102 N -1.05 0.64 0.01 -1.27 1.01 -1.26 -4.64 120.40 113.83 3mh0 s VAL 102 Ca 0.07 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 61.92 3mh0 s VAL 102 Cb -0.10 -0.62 -0.02 0.00 0.00 0.00 0.00 36.38 35.64 3mh0 s VAL 102 CO 0.04 0.24 -0.25 -0.31 0.00 0.00 0.00 175.10 174.81 3mh0 s TYR 103 N 0.68 2.20 -0.09 5.22 1.51 -0.68 -1.97 117.35 124.22 3mh0 s TYR 103 Ca -0.10 -0.41 0.03 0.00 -1.01 0.00 0.00 57.07 55.58 3mh0 s TYR 103 Cb -0.13 -1.37 0.01 0.00 -0.11 0.00 0.00 41.96 40.35 3mh0 s TYR 103 CO 0.01 0.02 -0.17 -0.51 -1.11 0.00 0.00 175.55 173.79 3mh0 s LEU 104 N -0.83 1.84 -0.19 -1.29 1.43 -0.10 -2.20 118.68 117.33 3mh0 s LEU 104 Ca 0.10 -0.43 -0.05 0.00 -1.03 0.00 0.00 54.13 52.72 3mh0 s LEU 104 Cb -0.10 -1.11 -0.03 0.00 0.03 0.00 0.00 46.19 44.99 3mh0 s LEU 104 CO 0.00 0.08 0.01 -0.69 0.23 0.00 0.00 176.35 175.99 3mh0 s VAL 105 N 0.59 4.19 0.19 -1.59 1.01 0.14 -1.10 120.40 123.83 3mh0 s VAL 105 Ca -0.15 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.61 3mh0 s VAL 105 Cb -0.16 -2.88 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 3mh0 s VAL 105 CO 0.05 0.44 0.03 0.28 0.00 0.00 0.00 175.10 175.90 3mh0 s THR 106 N 0.73 0.61 0.21 3.92 -1.32 0.03 -0.01 115.64 119.80 3mh0 s THR 106 Ca 0.01 -1.98 -0.32 0.00 -1.21 0.00 0.00 61.69 58.18 3mh0 s THR 106 Cb -0.14 -2.25 -0.12 0.00 -1.51 0.00 0.00 72.50 68.48 3mh0 s THR 106 CO 0.02 -0.35 1.72 -1.00 -2.21 0.00 0.00 174.62 172.81 3mh0 s HIS 107 N -3.71 2.89 -0.44 9.09 3.76 -1.26 -0.96 115.29 124.66 3mh0 s HIS 107 Ca 0.28 0.34 -0.26 0.00 -0.15 0.00 0.00 55.06 55.27 3mh0 s HIS 107 Cb 0.07 -4.14 0.02 0.00 1.11 0.00 0.00 32.58 29.64 3mh0 s HIS 107 CO 0.06 -4.32 0.93 -1.17 -0.85 0.00 0.00 174.74 169.39 3mh0 s LEU 108 N 1.22 3.99 0.26 0.89 2.96 -1.22 -4.59 118.68 122.19 3mh0 s LEU 108 Ca 0.75 0.24 0.18 0.00 -0.22 0.00 0.00 54.13 55.08 3mh0 s LEU 108 Cb -0.50 -3.22 0.07 0.00 0.50 0.00 0.00 46.19 43.04 3mh0 s LEU 108 CO 0.32 -1.01 1.28 0.24 -1.32 0.00 0.00 176.35 175.86 3mh0 h MET 109 N 8.94 0.00 0.00 1.98 2.86 -1.94 -3.46 114.93 123.31 3mh0 h MET 109 Ca -0.24 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.40 3mh0 h MET 109 Cb 1.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.74 3mh0 h MET 109 CO 1.02 0.26 0.00 0.41 1.06 0.00 0.00 176.91 179.66 3mh0 n GLY 110 N 1.23 2.83 3.21 8.32 0.00 -1.26 -4.35 105.19 115.17 3mh0 n GLY 110 Ca -0.00 -0.05 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 3mh0 n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mh0 s ALA 111 N -2.74 -0.43 0.30 4.61 0.00 -1.24 -5.06 121.76 117.20 3mh0 s ALA 111 Ca 0.00 -0.30 0.08 0.00 0.00 0.00 0.00 51.96 51.74 3mh0 s ALA 111 Cb 0.00 0.37 -0.03 0.00 0.00 0.00 0.00 23.12 23.46 3mh0 s ALA 111 CO 0.00 -0.43 0.19 0.16 0.00 0.00 0.00 175.76 175.68 3mh0 s ASP 112 N -2.34 5.13 0.56 0.00 3.84 -1.26 -1.33 116.67 121.27 3mh0 s ASP 112 Ca -0.02 -0.50 0.25 0.00 -0.00 0.00 0.00 52.55 52.29 3mh0 s ASP 112 Cb 0.01 -1.04 1.53 0.00 -1.38 0.00 0.00 42.92 42.04 3mh0 s ASP 112 CO -0.06 -0.20 2.09 0.25 -0.00 0.00 0.00 175.17 177.25 3mh0 h LEU 113 N 1.47 0.00 0.10 2.11 5.85 -0.36 -1.48 115.31 123.01 3mh0 h LEU 113 Ca -0.46 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 3mh0 h LEU 113 Cb 1.25 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.28 3mh0 h LEU 113 CO 0.60 0.00 -0.05 -1.13 -0.34 0.00 0.00 178.44 177.52 3mh0 h ASN 114 N 0.00 -0.12 -0.87 1.25 -0.73 -1.84 -2.23 115.58 111.05 3mh0 h ASN 114 Ca 0.11 -0.11 0.05 0.00 1.87 0.00 0.00 56.30 58.21 3mh0 h ASN 114 Cb 0.50 0.03 -0.06 0.00 0.27 0.00 0.00 38.32 39.06 3mh0 h ASN 114 CO -0.00 0.04 0.55 0.78 -0.37 0.00 0.00 177.43 178.43 3mh0 h ASN 115 N -0.27 0.88 -0.54 1.15 4.21 -1.66 -3.15 115.58 116.20 3mh0 h ASN 115 Ca -0.01 0.01 -0.04 0.00 1.21 0.00 0.00 56.30 57.47 3mh0 h ASN 115 Cb 0.22 -0.18 -0.02 0.00 -1.12 0.00 0.00 38.32 37.22 3mh0 h ASN 115 CO 0.02 0.58 0.20 0.40 -1.29 0.00 0.00 177.43 177.35 3mh0 h ILE 116 N 1.03 1.23 -0.20 2.81 1.08 -1.30 -3.16 117.51 118.98 3mh0 h ILE 116 Ca 0.36 -0.72 -0.09 0.00 -0.39 0.00 0.00 64.86 64.02 3mh0 h ILE 116 Cb 0.10 0.68 -0.01 0.00 -3.07 0.00 0.00 36.82 34.51 3mh0 h ILE 116 CO -0.15 0.27 -0.25 0.58 -0.69 0.00 0.00 178.15 177.92 3mh0 h VAL 117 N 0.74 1.26 0.00 1.67 2.07 -1.38 -2.98 116.25 117.62 3mh0 h VAL 117 Ca 0.18 -1.21 0.00 0.00 0.82 0.00 0.00 66.70 66.49 3mh0 h VAL 117 Cb 0.23 1.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 3mh0 h VAL 117 CO -0.01 0.38 0.00 0.29 0.02 0.00 0.00 177.57 178.24 3mh0 n LYS 118 N -4.14 0.11 0.00 1.57 5.02 -1.19 -4.50 118.16 115.04 3mh0 n LYS 118 Ca -0.01 0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 3mh0 n LYS 118 Cb 0.39 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 3mh0 n LYS 118 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3mh0 n GLN 120 N -0.17 0.45 -2.25 0.00 6.02 -1.13 -4.94 117.38 115.35 3mh0 n GLN 120 Ca 0.00 0.16 -0.43 0.00 -0.01 0.00 0.00 57.00 56.73 3mh0 n GLN 120 Cb 0.00 -1.73 -0.02 0.00 1.02 0.00 0.00 30.24 29.51 3mh0 n GLN 120 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3mh0 s LYS 121 N 1.79 4.18 0.20 -1.09 2.47 -1.26 -4.50 119.74 121.52 3mh0 s LYS 121 Ca 0.96 1.84 -0.29 0.00 -1.56 0.00 0.00 55.97 56.92 3mh0 s LYS 121 Cb -1.24 -3.86 -0.08 0.00 -1.46 0.00 0.00 37.83 31.18 3mh0 s LYS 121 CO 0.65 -0.81 0.90 -0.51 0.16 0.00 0.00 175.35 175.74 3mh0 s LEU 122 N 3.82 4.62 0.88 5.43 1.43 -1.26 -5.06 118.68 128.54 3mh0 s LEU 122 Ca 0.62 1.85 -0.12 0.00 -1.03 0.00 0.00 54.13 55.45 3mh0 s LEU 122 Cb -0.26 -3.52 0.12 0.00 0.03 0.00 0.00 46.19 42.56 3mh0 s LEU 122 CO 0.21 0.14 1.14 0.42 0.23 0.00 0.00 176.35 178.50 3mh0 s THR 123 N -1.02 2.07 0.34 5.49 -4.23 -1.26 -4.87 115.64 112.16 3mh0 s THR 123 Ca 0.40 0.02 0.04 0.00 -1.18 0.00 0.00 61.69 60.97 3mh0 s THR 123 Cb -0.25 -2.82 0.18 0.00 1.34 0.00 0.00 72.50 70.95 3mh0 s THR 123 CO 0.30 -0.03 1.89 -0.78 -0.54 0.00 0.00 174.62 175.47 3mh0 h ASP 124 N -1.38 0.55 -0.30 3.99 3.58 -1.97 -2.17 116.42 118.72 3mh0 h ASP 124 Ca -0.49 -0.09 -0.07 0.00 0.42 0.00 0.00 57.03 56.79 3mh0 h ASP 124 Cb 1.33 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 42.22 3mh0 h ASP 124 CO 0.63 0.57 -0.06 -0.78 -2.88 0.00 0.00 179.24 176.72 3mh0 h ASP 125 N 0.58 0.66 -0.23 2.28 1.82 -2.00 -1.07 116.42 118.46 3mh0 h ASP 125 Ca 0.13 -0.17 -0.04 0.00 -0.39 0.00 0.00 57.03 56.56 3mh0 h ASP 125 Cb 0.25 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.08 3mh0 h ASP 125 CO -0.00 0.77 -0.02 0.45 -1.61 0.00 0.00 179.24 178.83 3mh0 h HIS 126 N 0.64 0.47 -0.65 0.28 3.86 -1.83 -1.70 115.15 116.22 3mh0 h HIS 126 Ca 0.12 -0.09 -0.03 0.00 -1.16 0.00 0.00 60.37 59.21 3mh0 h HIS 126 Cb 0.48 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.80 3mh0 h HIS 126 CO 0.02 0.62 0.27 -0.39 0.86 0.00 0.00 177.93 179.32 3mh0 h VAL 127 N 0.18 1.22 -0.47 2.45 -1.51 -1.10 -0.09 116.25 116.94 3mh0 h VAL 127 Ca 0.06 -0.68 0.04 0.00 -1.23 0.00 0.00 66.70 64.89 3mh0 h VAL 127 Cb 0.45 0.43 -0.04 0.00 -2.13 0.00 0.00 31.29 30.00 3mh0 h VAL 127 CO 0.02 0.27 0.24 1.56 -1.23 0.00 0.00 177.57 178.43 3mh0 h GLN 128 N 0.93 0.47 -0.12 5.19 4.20 -0.95 -0.58 115.11 124.25 3mh0 h GLN 128 Ca 0.22 -0.03 -0.07 0.00 0.06 0.00 0.00 58.65 58.84 3mh0 h GLN 128 Cb 0.16 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.83 3mh0 h GLN 128 CO -0.02 0.31 -0.18 0.35 -0.67 0.00 0.00 178.83 178.61 3mh0 h PHE 129 N 0.48 0.41 0.03 2.96 3.57 -1.04 0.01 116.94 123.37 3mh0 h PHE 129 Ca 0.20 -0.14 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 3mh0 h PHE 129 Cb 0.09 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 38.75 3mh0 h PHE 129 CO -0.10 0.79 -0.01 -0.07 -2.23 0.00 0.00 178.31 176.69 3mh0 h LEU 130 N -0.08 -0.03 -0.64 0.59 4.07 -0.98 -1.49 115.31 116.74 3mh0 h LEU 130 Ca 0.01 -0.20 -0.11 0.00 0.08 0.00 0.00 57.88 57.66 3mh0 h LEU 130 Cb 0.75 0.01 -0.02 0.00 1.08 0.00 0.00 40.66 42.48 3mh0 h LEU 130 CO 0.04 0.18 -0.14 0.40 -1.08 0.00 0.00 178.44 177.85 3mh0 h ILE 131 N -0.25 1.27 -0.46 1.22 1.08 -1.17 -1.88 117.51 117.32 3mh0 h ILE 131 Ca -0.00 -1.27 0.07 0.00 -0.39 0.00 0.00 64.86 63.27 3mh0 h ILE 131 Cb 0.23 1.03 -0.06 0.00 -3.07 0.00 0.00 36.82 34.95 3mh0 h ILE 131 CO 0.01 0.44 0.11 0.22 -0.69 0.00 0.00 178.15 178.24 3mh0 h TYR 132 N 0.82 0.18 -0.39 1.37 3.20 -0.93 -0.22 116.97 121.01 3mh0 h TYR 132 Ca 0.13 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.91 3mh0 h TYR 132 Cb 0.67 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 3mh0 h TYR 132 CO 0.04 0.03 -0.21 1.96 -1.64 0.00 0.00 178.16 178.34 3mh0 h GLN 133 N 0.25 0.77 -0.46 1.82 4.20 -0.89 -0.98 115.11 119.82 3mh0 h GLN 133 Ca 0.22 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 3mh0 h GLN 133 Cb 0.27 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 3mh0 h GLN 133 CO -0.28 0.91 0.24 0.82 -0.67 0.00 0.00 178.83 179.86 3mh0 h ILE 134 N 0.67 1.17 -0.37 2.54 2.04 -0.68 -2.19 117.51 120.69 3mh0 h ILE 134 Ca 0.10 -0.46 -0.07 0.00 1.00 0.00 0.00 64.86 65.42 3mh0 h ILE 134 Cb 0.72 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 3mh0 h ILE 134 CO 0.06 0.19 -0.08 -0.07 0.00 0.00 0.00 178.15 178.24 3mh0 h LEU 135 N 0.61 0.61 -0.40 1.44 3.38 -0.72 0.98 115.31 121.20 3mh0 h LEU 135 Ca 0.16 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 3mh0 h LEU 135 Cb 0.08 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3mh0 h LEU 135 CO -0.02 0.73 -0.23 -0.09 0.09 0.00 0.00 178.44 178.92 3mh0 h ARG 136 N 0.58 0.87 -0.39 1.13 2.43 -0.99 0.18 114.38 118.19 3mh0 h ARG 136 Ca 0.11 -0.39 -0.03 0.00 -0.81 0.00 0.00 59.98 58.85 3mh0 h ARG 136 Cb 0.48 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 3mh0 h ARG 136 CO 0.03 1.04 0.12 0.78 -1.51 0.00 0.00 179.97 180.42 3mh0 h GLY 137 N 0.68 0.66 1.22 2.80 0.00 -1.24 -2.86 103.07 104.33 3mh0 h GLY 137 Ca 0.09 -0.40 -0.09 0.00 0.00 0.00 0.00 47.33 46.93 3mh0 h GLY 137 CO 0.07 0.37 -0.05 -2.00 0.00 0.00 0.00 176.54 174.93 3mh0 h LEU 138 N 0.49 0.91 -0.82 3.11 5.85 -0.38 -1.26 115.31 123.20 3mh0 h LEU 138 Ca 0.13 -0.26 0.08 0.00 0.84 0.00 0.00 57.88 58.67 3mh0 h LEU 138 Cb 0.27 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 40.99 3mh0 h LEU 138 CO -0.00 0.99 0.49 0.50 -0.34 0.00 0.00 178.44 180.08 3mh0 h LYS 139 N 0.84 0.83 -0.02 1.25 3.64 -0.53 0.66 116.57 123.25 3mh0 h LYS 139 Ca 0.15 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3mh0 h LYS 139 Cb 0.56 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 3mh0 h LYS 139 CO 0.03 0.55 -0.00 -0.92 -2.27 0.00 0.00 179.45 176.83 3mh0 h TYR 140 N 0.85 0.03 0.13 1.91 3.20 -1.24 -1.34 116.97 120.52 3mh0 h TYR 140 Ca 0.38 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.25 3mh0 h TYR 140 Cb 0.28 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 3mh0 h TYR 140 CO -0.05 0.40 -0.14 0.82 -1.64 0.00 0.00 178.16 177.56 3mh0 h ILE 141 N -0.35 0.69 0.00 1.81 2.04 -0.98 -2.76 117.51 117.97 3mh0 h ILE 141 Ca 0.00 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.85 3mh0 h ILE 141 Cb 0.39 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 3mh0 h ILE 141 CO 0.00 0.00 -0.09 0.45 0.00 0.00 0.00 178.15 178.51 3mh0 h HIS 142 N -0.30 0.00 0.00 1.37 3.86 -0.88 -0.98 115.15 118.22 3mh0 h HIS 142 Ca 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 3mh0 h HIS 142 Cb 0.29 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.76 3mh0 h HIS 142 CO -0.13 0.09 0.00 0.66 0.86 0.00 0.00 177.93 179.41 3mh0 h SER 143 N 0.00 0.00 -0.54 2.45 4.64 -0.95 -2.27 113.55 116.89 3mh0 h SER 143 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3mh0 h SER 143 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3mh0 h SER 143 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 3mh0 n ALA 144 N -1.80 2.41 -3.39 5.18 0.00 -0.40 -4.72 120.51 117.80 3mh0 n ALA 144 Ca 0.02 -0.97 -0.20 0.00 0.00 0.00 0.00 53.44 52.29 3mh0 n ALA 144 Cb 0.25 -0.96 0.06 0.00 0.00 0.00 0.00 19.45 18.81 3mh0 n ALA 144 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3mh0 n ASP 145 N 1.15 -5.68 -4.57 0.00 4.64 -0.85 -4.23 116.55 107.02 3mh0 n ASP 145 Ca 0.19 -0.44 -0.33 0.00 -1.38 0.00 0.00 54.79 52.83 3mh0 n ASP 145 Cb 0.48 -4.30 -0.11 0.00 -1.04 0.00 0.00 41.12 36.15 3mh0 n ASP 145 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 3mh0 s ILE 146 N -3.26 3.54 -0.11 5.18 1.01 -1.06 -5.03 121.20 121.47 3mh0 s ILE 146 Ca 0.48 -0.67 -0.00 0.00 0.00 0.00 0.00 60.65 60.46 3mh0 s ILE 146 Cb -0.21 -2.48 -0.02 0.00 0.01 0.00 0.00 42.46 39.76 3mh0 s ILE 146 CO 0.59 0.50 -0.09 -0.63 0.00 0.00 0.00 174.94 175.31 3mh0 s ILE 147 N -0.88 3.42 0.02 2.92 1.01 -1.26 -3.76 121.20 122.67 3mh0 s ILE 147 Ca 0.14 -0.55 -0.25 0.00 0.00 0.00 0.00 60.65 59.99 3mh0 s ILE 147 Cb -0.11 -2.43 -0.18 0.00 0.01 0.00 0.00 42.46 39.75 3mh0 s ILE 147 CO 0.04 0.55 1.42 -0.74 0.00 0.00 0.00 174.94 176.21 3mh0 h HIS 148 N 6.14 -0.08 0.00 3.97 -0.00 -1.92 -2.90 115.15 120.36 3mh0 h HIS 148 Ca -0.36 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.01 3mh0 h HIS 148 Cb 1.19 0.03 0.00 0.00 -0.00 0.00 0.00 27.41 28.63 3mh0 h HIS 148 CO 0.52 0.22 0.00 0.54 -0.00 0.00 0.00 177.93 179.21 3mh0 n ARG 149 N -4.99 0.00 -2.74 5.26 1.74 -1.26 -3.32 116.66 111.35 3mh0 n ARG 149 Ca -0.08 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.90 3mh0 n ARG 149 Cb 0.18 -1.03 0.04 0.00 -1.02 0.00 0.00 32.46 30.64 3mh0 n ARG 149 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3mh0 n ASP 150 N 0.02 0.67 -4.72 0.55 4.64 -1.26 -4.99 116.55 111.47 3mh0 n ASP 150 Ca 0.00 -2.74 -0.42 0.00 -1.38 0.00 0.00 54.79 50.26 3mh0 n ASP 150 Cb 0.00 -0.20 -0.03 0.00 -1.04 0.00 0.00 41.12 39.85 3mh0 n ASP 150 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 3mh0 s LEU 151 N -3.02 4.40 -0.08 -2.67 2.96 -1.26 -4.86 118.68 114.15 3mh0 s LEU 151 Ca 0.28 2.03 -0.30 0.00 -0.22 0.00 0.00 54.13 55.92 3mh0 s LEU 151 Cb 0.43 -3.59 0.11 0.00 0.50 0.00 0.00 46.19 43.65 3mh0 s LEU 151 CO 0.00 -0.39 0.97 -1.59 -1.32 0.00 0.00 176.35 174.01 3mh0 s LYS 152 N 0.61 0.68 0.37 1.98 -2.85 -1.26 -4.78 119.74 114.49 3mh0 s LYS 152 Ca 0.56 -0.15 0.12 0.00 -1.00 0.00 0.00 55.97 55.50 3mh0 s LYS 152 Cb -0.29 0.31 0.90 0.00 -2.06 0.00 0.00 37.83 36.69 3mh0 s LYS 152 CO 0.31 -0.28 1.86 -1.35 0.10 0.00 0.00 175.35 175.99 3mh0 h PRO 153 N 2.16 0.58 0.00 1.78 0.11 -1.94 0.75 132.00 135.44 3mh0 h PRO 153 Ca -0.19 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.88 3mh0 h PRO 153 Cb 1.21 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3mh0 h PRO 153 CO 0.30 0.38 0.00 0.66 -0.21 0.00 0.00 178.00 179.13 3mh0 h SER 154 N 0.60 0.00 -0.44 -2.05 4.64 -1.95 -2.15 113.55 112.20 3mh0 h SER 154 Ca 0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 3mh0 h SER 154 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 3mh0 h SER 154 CO -0.21 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.34 3mh0 n ASN 155 N -2.60 3.01 -3.91 4.97 5.03 0.25 -4.83 115.26 117.18 3mh0 n ASN 155 Ca -0.00 -2.19 -0.30 0.00 0.87 0.00 0.00 54.58 52.96 3mh0 n ASN 155 Cb 0.17 -0.41 -0.15 0.00 -1.02 0.00 0.00 39.78 38.37 3mh0 n ASN 155 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3mh0 s LEU 156 N -1.24 3.22 -0.05 3.41 1.43 -0.82 0.04 118.68 124.67 3mh0 s LEU 156 Ca 0.33 -1.63 -0.21 0.00 -1.03 0.00 0.00 54.13 51.59 3mh0 s LEU 156 Cb 0.20 -1.25 -0.05 0.00 0.03 0.00 0.00 46.19 45.12 3mh0 s LEU 156 CO 0.18 -0.33 0.62 0.00 0.23 0.00 0.00 176.35 177.05 3mh0 s ALA 157 N 1.29 3.42 -0.02 4.21 0.00 -0.32 -0.10 121.76 130.23 3mh0 s ALA 157 Ca 0.04 0.04 0.01 0.00 0.00 0.00 0.00 51.96 52.04 3mh0 s ALA 157 Cb -0.18 -2.81 0.02 0.00 0.00 0.00 0.00 23.12 20.14 3mh0 s ALA 157 CO -0.12 0.03 -0.01 0.08 0.00 0.00 0.00 175.76 175.75 3mh0 s VAL 158 N 0.33 0.21 0.42 0.00 1.01 -0.44 -0.17 120.40 121.75 3mh0 s VAL 158 Ca 0.33 0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.38 3mh0 s VAL 158 Cb -0.18 -0.27 0.07 0.00 0.00 0.00 0.00 36.38 36.01 3mh0 s VAL 158 CO 0.16 0.13 0.58 -0.46 0.00 0.00 0.00 175.10 175.52 3mh0 n ASN 159 N 3.86 1.28 0.02 3.32 0.23 -0.83 -3.59 115.26 119.56 3mh0 n ASN 159 Ca -0.24 -1.97 0.22 0.00 -0.53 0.00 0.00 54.58 52.07 3mh0 n ASN 159 Cb 0.52 -0.33 0.73 0.00 -2.08 0.00 0.00 39.78 38.62 3mh0 n ASN 159 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3mh0 h GLU 160 N 0.00 0.00 -0.66 -3.83 4.11 -1.90 0.74 114.58 113.04 3mh0 h GLU 160 Ca -0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.24 3mh0 h GLU 160 Cb 0.84 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.09 3mh0 h GLU 160 CO 0.26 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 179.09 3mh0 n ASP 161 N -3.94 4.34 -2.15 3.06 10.43 -1.26 -4.92 116.55 122.10 3mh0 n ASP 161 Ca 0.10 -2.35 -0.16 0.00 2.57 0.00 0.00 54.79 54.95 3mh0 n ASP 161 Cb 0.69 -0.54 -0.02 0.00 1.84 0.00 0.00 41.12 43.08 3mh0 n ASP 161 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3mh0 s GLU 163 N -4.57 4.58 0.03 0.00 2.02 -1.26 -4.73 118.70 114.77 3mh0 s GLU 163 Ca 0.00 1.79 0.07 0.00 0.02 0.00 0.00 54.97 56.86 3mh0 s GLU 163 Cb 0.00 -3.24 -0.02 0.00 0.10 0.00 0.00 34.13 30.97 3mh0 s GLU 163 CO 0.00 0.07 -0.22 -1.17 0.02 0.00 0.00 175.26 173.96 3mh0 s LEU 164 N -0.68 2.14 -0.04 1.80 0.20 -1.26 -1.97 118.68 118.87 3mh0 s LEU 164 Ca 0.49 -0.50 0.03 0.00 0.69 0.00 0.00 54.13 54.83 3mh0 s LEU 164 Cb -0.31 -1.05 0.01 0.00 -0.43 0.00 0.00 46.19 44.40 3mh0 s LEU 164 CO 0.37 0.20 -0.12 -0.54 -0.29 0.00 0.00 176.35 175.98 3mh0 s LYS 165 N -1.03 1.40 -0.15 1.98 1.02 0.76 -4.39 119.74 119.34 3mh0 s LYS 165 Ca 0.08 -0.40 -0.28 0.00 0.02 0.00 0.00 55.97 55.39 3mh0 s LYS 165 Cb -0.09 -1.22 -0.01 0.00 -0.52 0.00 0.00 37.83 35.99 3mh0 s LYS 165 CO 0.01 0.10 0.94 0.42 -0.92 0.00 0.00 175.35 175.91 3mh0 s ILE 166 N 0.37 4.81 0.20 2.17 1.01 -0.27 -1.18 121.20 128.31 3mh0 s ILE 166 Ca -0.08 1.89 -0.05 0.00 0.00 0.00 0.00 60.65 62.41 3mh0 s ILE 166 Cb -0.12 -4.25 -0.05 0.00 0.01 0.00 0.00 42.46 38.05 3mh0 s ILE 166 CO 0.02 -0.01 0.44 -0.76 0.00 0.00 0.00 174.94 174.63 3mh0 s LEU 167 N 2.21 4.20 -1.08 2.97 1.02 0.11 -1.48 118.68 126.62 3mh0 s LEU 167 Ca 0.44 0.63 0.00 0.00 0.02 0.00 0.00 54.13 55.22 3mh0 s LEU 167 Cb -0.17 -3.39 0.00 0.00 0.02 0.00 0.00 46.19 42.65 3mh0 s LEU 167 CO 0.14 -0.04 0.00 0.47 0.02 0.00 0.00 176.35 176.95 3mh0 n ASP 168 N -0.31 -4.60 -4.66 2.29 8.00 -1.26 -4.87 116.55 111.14 3mh0 n ASP 168 Ca -0.02 0.25 -0.49 0.00 0.71 0.00 0.00 54.79 55.24 3mh0 n ASP 168 Cb 0.53 -3.00 -0.05 0.00 -0.02 0.00 0.00 41.12 38.58 3mh0 n ASP 168 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3mh0 n ALA 169 N 1.19 0.50 -0.66 2.24 0.00 -1.26 -2.22 120.51 120.29 3mh0 n ALA 169 Ca -0.10 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.76 3mh0 n ALA 169 Cb 0.40 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.54 3mh0 n ALA 169 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mh0 n GLY 170 N 3.51 0.80 0.08 0.00 0.00 -1.10 -4.91 105.19 103.57 3mh0 n GLY 170 Ca 0.20 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 3mh0 n GLY 170 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3mh0 h LEU 171 N 0.00 0.00 0.00 0.99 5.85 -1.62 -3.48 115.31 117.04 3mh0 h LEU 171 Ca 0.00 -0.68 0.00 0.00 0.84 0.00 0.00 57.88 58.04 3mh0 h LEU 171 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 3mh0 h LEU 171 CO 0.00 1.11 0.00 0.00 -0.34 0.00 0.00 178.44 179.21 3mh0 n ALA 172 N -2.96 0.00 0.00 1.25 0.00 -1.26 -5.04 120.51 112.50 3mh0 n ALA 172 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 3mh0 n ALA 172 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 3mh0 n ALA 172 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3mh0 n THR 185 N 0.00 0.00 -0.04 0.00 -2.24 -1.26 -5.08 114.28 105.66 3mh0 n THR 185 Ca 0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 3mh0 n THR 185 Cb 0.00 0.00 0.25 0.00 -2.10 0.00 0.00 70.33 68.48 3mh0 n THR 185 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 3mh0 n ARG 186 N 0.00 2.59 0.31 -0.78 0.00 -1.26 -4.70 116.66 112.81 3mh0 n ARG 186 Ca 0.00 -2.41 0.18 0.00 -0.00 0.00 0.00 57.85 55.62 3mh0 n ARG 186 Cb 0.00 -1.51 1.02 0.00 -0.00 0.00 0.00 32.46 31.97 3mh0 n ARG 186 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.63 176.14 3mh0 h TRP 187 N 4.12 0.00 -0.16 2.89 6.55 -1.94 -2.88 115.95 124.53 3mh0 h TRP 187 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 3mh0 h TRP 187 Cb 0.95 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.25 3mh0 h TRP 187 CO 0.35 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 178.40 3mh0 n TYR 188 N -3.52 0.21 -2.94 0.49 4.02 -1.26 -4.55 117.16 109.60 3mh0 n TYR 188 Ca -0.03 -0.28 -0.40 0.00 -0.01 0.00 0.00 57.90 57.18 3mh0 n TYR 188 Cb 0.11 -0.02 -0.05 0.00 -0.02 0.00 0.00 39.34 39.36 3mh0 n TYR 188 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 3mh0 s ARG 189 N -0.88 4.56 0.44 -0.72 0.52 -1.09 -3.56 118.95 118.23 3mh0 s ARG 189 Ca 0.15 1.16 -0.24 0.00 -0.52 0.00 0.00 55.73 56.28 3mh0 s ARG 189 Cb 0.09 -3.33 -0.08 0.00 0.52 0.00 0.00 34.95 32.15 3mh0 s ARG 189 CO 0.12 0.39 1.22 0.00 0.02 0.00 0.00 175.30 177.05 3mh0 s ALA 190 N -0.48 3.06 0.32 2.13 0.00 -1.26 -4.85 121.76 120.68 3mh0 s ALA 190 Ca 0.39 1.06 0.08 0.00 0.00 0.00 0.00 51.96 53.49 3mh0 s ALA 190 Cb -0.22 -3.43 0.82 0.00 0.00 0.00 0.00 23.12 20.29 3mh0 s ALA 190 CO 0.25 -0.76 1.77 -1.00 0.00 0.00 0.00 175.76 176.02 3mh0 h PRO 191 N 2.26 0.65 -0.71 0.00 0.13 -1.95 -1.09 132.00 131.29 3mh0 h PRO 191 Ca -0.49 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 64.55 3mh0 h PRO 191 Cb 1.25 -0.15 -0.03 0.00 0.13 0.00 0.00 31.00 32.20 3mh0 h PRO 191 CO 0.61 0.43 0.26 1.05 -0.23 0.00 0.00 178.00 180.12 3mh0 h GLU 192 N 0.67 1.06 -0.19 0.86 9.09 -1.91 -1.00 114.58 123.17 3mh0 h GLU 192 Ca 0.59 -0.19 -0.14 0.00 0.05 0.00 0.00 59.36 59.67 3mh0 h GLU 192 Cb 1.04 -0.17 -0.01 0.00 -1.65 0.00 0.00 28.75 27.96 3mh0 h GLU 192 CO -0.39 0.88 -0.47 0.82 0.05 0.00 0.00 179.01 179.90 3mh0 h ILE 193 N 1.03 1.32 -0.08 -1.06 2.04 -1.45 -2.65 117.51 116.66 3mh0 h ILE 193 Ca 0.24 -1.68 -0.03 0.00 1.00 0.00 0.00 64.86 64.39 3mh0 h ILE 193 Cb 0.23 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 3mh0 h ILE 193 CO -0.02 0.52 -0.08 -0.03 0.00 0.00 0.00 178.15 178.55 3mh0 h MET 194 N 0.39 0.12 -0.67 2.37 4.05 -0.80 -1.43 114.93 118.96 3mh0 h MET 194 Ca 0.02 -0.02 -0.20 0.00 -0.28 0.00 0.00 59.70 59.23 3mh0 h MET 194 Cb 0.97 -0.02 -0.12 0.00 -0.80 0.00 0.00 31.60 31.63 3mh0 h MET 194 CO 0.09 0.20 0.23 1.28 0.23 0.00 0.00 176.91 178.94 3mh0 n LEU 195 N -4.38 5.75 0.00 3.39 7.99 -0.45 -4.99 117.00 124.31 3mh0 n LEU 195 Ca -0.02 -3.26 0.00 0.00 -0.01 0.00 0.00 56.01 52.72 3mh0 n LEU 195 Cb 0.19 -0.72 0.00 0.00 -0.11 0.00 0.00 43.42 42.78 3mh0 n LEU 195 CO 0.36 0.84 0.00 -3.20 -1.51 0.00 0.00 177.39 173.88 3mh0 n ASN 196 N -0.29 0.00 -2.12 -1.43 4.05 -0.54 -4.86 115.26 110.06 3mh0 n ASN 196 Ca 0.39 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.42 3mh0 n ASN 196 Cb 1.32 0.00 0.00 0.00 1.23 0.00 0.00 39.78 42.33 3mh0 n ASN 196 CO 0.00 0.00 0.00 1.87 -3.05 0.00 0.00 177.26 176.08 3mh0 n TRP 197 N 0.00 -3.93 -1.67 1.20 -0.00 -1.21 -4.50 117.44 107.33 3mh0 n TRP 197 Ca 0.00 2.36 -0.42 0.00 -0.00 0.00 0.00 57.50 59.44 3mh0 n TRP 197 Cb 0.00 -3.12 -0.03 0.00 -0.00 0.00 0.00 31.31 28.16 3mh0 n TRP 197 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 177.69 176.05 3mh0 s MET 198 N -0.44 4.14 0.19 5.87 -1.94 -1.26 -4.52 119.30 121.33 3mh0 s MET 198 Ca 0.00 2.62 0.00 0.00 -1.71 0.00 0.00 55.69 56.60 3mh0 s MET 198 Cb 0.00 -4.09 0.00 0.00 2.01 0.00 0.00 34.83 32.75 3mh0 s MET 198 CO 0.00 -0.94 0.00 -2.39 -0.01 0.00 0.00 175.02 171.68 3mh0 n HIS 199 N 7.31 -2.79 -4.32 -0.03 -0.00 -1.26 -5.06 115.22 109.07 3mh0 n HIS 199 Ca 0.20 1.53 -0.18 0.00 -0.00 0.00 0.00 57.72 59.26 3mh0 n HIS 199 Cb 0.41 -2.30 -0.09 0.00 -0.00 0.00 0.00 29.99 28.01 3mh0 n HIS 199 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.34 177.86 3mh0 s TYR 200 N -1.15 1.57 0.25 -1.40 1.13 -1.26 -5.12 117.35 111.36 3mh0 s TYR 200 Ca 0.00 -1.40 0.01 0.00 -1.41 0.00 0.00 57.07 54.27 3mh0 s TYR 200 Cb 0.00 -0.82 -0.00 0.00 -1.10 0.00 0.00 41.96 40.04 3mh0 s TYR 200 CO 0.00 -0.57 0.05 0.27 -2.51 0.00 0.00 175.55 172.79 3mh0 n ASN 201 N -0.92 1.82 0.33 -0.18 6.94 -1.26 -5.04 115.26 116.94 3mh0 n ASN 201 Ca 0.02 -2.21 0.21 0.00 -0.02 0.00 0.00 54.58 52.58 3mh0 n ASN 201 Cb 0.65 0.41 1.13 0.00 -2.36 0.00 0.00 39.78 39.60 3mh0 n ASN 201 CO 0.00 0.00 0.00 1.56 -1.03 0.00 0.00 177.26 177.79 3mh0 h GLN 202 N 0.00 0.00 0.00 -3.83 4.20 -2.00 -2.43 115.11 111.06 3mh0 h GLN 202 Ca -0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.51 3mh0 h GLN 202 Cb 0.68 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.46 3mh0 h GLN 202 CO 0.32 0.00 0.05 1.79 -0.67 0.00 0.00 178.83 180.33 3mh0 h THR 203 N 0.00 0.00 -0.15 -0.54 1.35 -1.96 -0.99 112.91 110.63 3mh0 h THR 203 Ca -0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.82 3mh0 h THR 203 Cb 0.01 0.59 -0.01 0.00 -1.73 0.00 0.00 68.15 67.01 3mh0 h THR 203 CO 0.00 0.00 -0.11 -0.37 -0.25 0.00 0.00 175.52 174.79 3mh0 h VAL 204 N 0.00 1.16 -0.54 6.82 -1.51 -1.82 -2.12 116.25 118.24 3mh0 h VAL 204 Ca 0.00 -0.70 -0.04 0.00 -1.23 0.00 0.00 66.70 64.73 3mh0 h VAL 204 Cb 0.11 1.17 -0.03 0.00 -2.13 0.00 0.00 31.29 30.41 3mh0 h VAL 204 CO 0.00 0.22 0.16 0.44 -1.23 0.00 0.00 177.57 177.16 3mh0 h ASP 205 N 0.22 0.74 -0.26 4.19 3.45 -1.44 -2.73 116.42 120.59 3mh0 h ASP 205 Ca 0.05 -0.11 -0.09 0.00 0.43 0.00 0.00 57.03 57.30 3mh0 h ASP 205 Cb 0.33 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 38.89 3mh0 h ASP 205 CO 0.02 0.70 -0.15 0.40 -1.57 0.00 0.00 179.24 178.65 3mh0 h ILE 206 N 0.78 1.26 -0.30 0.35 1.08 -1.52 -1.00 117.51 118.16 3mh0 h ILE 206 Ca 0.18 -1.18 0.05 0.00 -0.39 0.00 0.00 64.86 63.52 3mh0 h ILE 206 Cb 0.24 1.13 -0.05 0.00 -3.07 0.00 0.00 36.82 35.06 3mh0 h ILE 206 CO -0.01 0.39 0.01 -0.25 -0.69 0.00 0.00 178.15 177.60 3mh0 h TRP 207 N 0.62 -0.00 -0.30 1.37 2.91 -1.28 -0.79 115.95 118.48 3mh0 h TRP 207 Ca 0.10 0.02 0.05 0.00 1.13 0.00 0.00 58.89 60.19 3mh0 h TRP 207 Cb 0.60 0.05 -0.04 0.00 -0.51 0.00 0.00 29.16 29.25 3mh0 h TRP 207 CO 0.03 -0.04 0.02 0.77 -1.03 0.00 0.00 178.44 178.18 3mh0 h SER 208 N 0.10 -0.08 -0.62 2.65 0.02 -1.19 -2.03 113.55 112.40 3mh0 h SER 208 Ca 0.14 0.06 0.11 0.00 -0.84 0.00 0.00 61.79 61.27 3mh0 h SER 208 Cb 0.19 0.10 -0.09 0.00 0.14 0.00 0.00 62.40 62.74 3mh0 h SER 208 CO -0.23 -0.01 0.16 0.58 -1.14 0.00 0.00 176.83 176.19 3mh0 h VAL 209 N 0.11 0.66 -0.38 2.27 2.07 -0.89 -0.59 116.25 119.49 3mh0 h VAL 209 Ca 0.14 -0.10 0.06 0.00 0.82 0.00 0.00 66.70 67.62 3mh0 h VAL 209 Cb 0.18 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 30.23 3mh0 h VAL 209 CO -0.22 0.05 0.05 1.23 0.02 0.00 0.00 177.57 178.70 3mh0 h GLY 210 N 0.30 0.42 0.84 2.17 0.00 -0.47 0.29 103.07 106.63 3mh0 h GLY 210 Ca 0.32 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.68 3mh0 h GLY 210 CO -0.39 -0.05 0.19 0.00 0.00 0.00 0.00 176.54 176.28 3mh0 h ILE 212 N 0.39 0.93 -0.26 0.00 2.04 -0.63 -2.60 117.51 117.37 3mh0 h ILE 212 Ca 0.15 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 3mh0 h ILE 212 Cb 0.05 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 3mh0 h ILE 212 CO -0.10 0.04 0.16 -0.03 0.00 0.00 0.00 178.15 178.22 3mh0 h MET 213 N -0.23 0.35 -0.58 2.37 4.05 -0.26 -0.00 114.93 120.64 3mh0 h MET 213 Ca -0.02 -0.03 0.12 0.00 -0.28 0.00 0.00 59.70 59.49 3mh0 h MET 213 Cb 0.18 -0.07 -0.10 0.00 -0.80 0.00 0.00 31.60 30.81 3mh0 h MET 213 CO 0.03 0.27 -0.01 0.00 0.23 0.00 0.00 176.91 177.43 3mh0 h ALA 214 N 1.06 0.54 -0.21 0.39 0.00 -1.00 -1.50 119.26 118.54 3mh0 h ALA 214 Ca 0.09 0.18 -0.11 0.00 0.00 0.00 0.00 54.91 55.07 3mh0 h ALA 214 Cb 0.01 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3mh0 h ALA 214 CO -0.02 -0.40 -0.36 1.49 0.00 0.00 0.00 179.25 179.97 3mh0 h GLU 215 N 0.10 0.46 0.00 0.00 4.81 -0.92 -0.93 114.58 118.10 3mh0 h GLU 215 Ca 0.30 -0.21 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 3mh0 h GLU 215 Cb 0.47 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 3mh0 h GLU 215 CO -0.50 0.76 -0.29 -0.07 -0.73 0.00 0.00 179.01 178.17 3mh0 h LEU 216 N 0.39 0.00 0.01 1.64 3.38 -0.30 0.20 115.31 120.63 3mh0 h LEU 216 Ca 0.04 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3mh0 h LEU 216 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 3mh0 h LEU 216 CO 0.07 0.29 -0.12 -0.07 0.09 0.00 0.00 178.44 178.70 3mh0 h LEU 217 N 0.00 0.09 0.00 1.67 3.38 -0.69 -3.39 115.31 116.37 3mh0 h LEU 217 Ca -0.00 -0.85 0.00 0.00 0.09 0.00 0.00 57.88 57.11 3mh0 h LEU 217 Cb 0.62 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3mh0 h LEU 217 CO 0.04 0.93 -0.75 0.35 0.09 0.00 0.00 178.44 179.10 3mh0 n THR 218 N -4.59 0.14 -0.45 0.22 -2.24 -0.41 -4.93 114.28 102.02 3mh0 n THR 218 Ca -0.10 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 3mh0 n THR 218 Cb 0.47 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 3mh0 n THR 218 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mh0 n GLY 219 N 1.42 0.78 3.61 3.38 0.00 0.70 -5.02 105.19 110.05 3mh0 n GLY 219 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3mh0 n GLY 219 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mh0 s ARG 220 N -0.35 2.48 0.06 1.61 0.52 -1.25 -4.97 118.95 117.05 3mh0 s ARG 220 Ca 0.00 -0.79 -0.33 0.00 -0.52 0.00 0.00 55.73 54.09 3mh0 s ARG 220 Cb 0.00 -2.47 -0.11 0.00 0.52 0.00 0.00 34.95 32.88 3mh0 s ARG 220 CO 0.00 0.58 1.81 2.41 0.02 0.00 0.00 175.30 180.12 3mh0 n THR 221 N 1.25 0.40 0.15 0.02 -1.04 -1.26 -4.12 114.28 109.69 3mh0 n THR 221 Ca -0.14 -0.07 -0.14 0.00 -2.04 0.00 0.00 64.05 61.66 3mh0 n THR 221 Cb 0.52 -1.95 -0.07 0.00 -1.82 0.00 0.00 70.33 67.02 3mh0 n THR 221 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 3mh0 h LEU 222 N 8.45 -0.54 -6.22 -4.42 6.46 -1.92 -3.37 115.31 113.75 3mh0 h LEU 222 Ca -0.47 0.05 -0.59 0.00 -0.12 0.00 0.00 57.88 56.75 3mh0 h LEU 222 Cb 1.25 0.19 -0.41 0.00 -0.73 0.00 0.00 40.66 40.95 3mh0 h LEU 222 CO 0.93 -0.30 -0.74 0.49 -0.62 0.00 0.00 178.44 178.20 3mh0 n PHE 223 N -5.33 2.43 -1.47 1.25 0.99 -1.26 -5.03 117.46 109.05 3mh0 n PHE 223 Ca -0.08 -3.99 -0.43 0.00 -0.00 0.00 0.00 57.45 52.95 3mh0 n PHE 223 Cb 0.24 -0.48 -0.03 0.00 -1.00 0.00 0.00 39.48 38.21 3mh0 n PHE 223 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 3mh0 n PRO 224 N 1.15 2.20 -2.07 -1.08 -0.04 -1.26 -4.64 135.00 129.26 3mh0 n PRO 224 Ca 0.27 -2.25 -0.33 0.00 -0.04 0.00 0.00 63.50 61.15 3mh0 n PRO 224 Cb 0.44 -3.12 0.01 0.00 -0.04 0.00 0.00 33.50 30.79 3mh0 n PRO 224 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3mh0 s GLY 225 N 4.10 2.24 0.08 0.55 0.00 -1.26 -4.95 107.32 108.08 3mh0 s GLY 225 Ca 0.52 0.51 0.01 0.00 0.00 0.00 0.00 44.72 45.76 3mh0 s GLY 225 CO 0.01 0.84 1.15 -0.91 0.00 0.00 0.00 173.10 174.19 3mh0 h THR 226 N 0.59 1.53 -1.23 0.90 1.35 -1.93 -3.46 112.91 110.67 3mh0 h THR 226 Ca -0.48 -3.17 0.00 0.00 -0.55 0.00 0.00 66.41 62.21 3mh0 h THR 226 Cb 1.23 2.87 0.00 0.00 -1.73 0.00 0.00 68.15 70.53 3mh0 h THR 226 CO 0.57 0.91 0.00 -0.90 -0.25 0.00 0.00 175.52 175.84 3mh0 n ASP 227 N -3.44 0.00 -0.03 5.36 3.85 -1.26 -5.03 116.55 115.99 3mh0 n ASP 227 Ca -0.06 -0.23 -0.14 0.00 -0.71 0.00 0.00 54.79 53.65 3mh0 n ASP 227 Cb 0.99 0.00 -0.09 0.00 -1.35 0.00 0.00 41.12 40.67 3mh0 n ASP 227 CO 0.00 0.00 0.00 -0.74 -1.01 0.00 0.00 177.20 175.45 3mh0 h HIS 228 N 0.23 0.23 -0.28 2.11 2.76 -2.00 -1.18 115.15 117.02 3mh0 h HIS 228 Ca 0.00 -0.09 -0.09 0.00 -2.20 0.00 0.00 60.37 57.99 3mh0 h HIS 228 Cb 0.00 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 28.91 3mh0 h HIS 228 CO 0.00 0.73 -0.16 0.82 -1.30 0.00 0.00 177.93 178.02 3mh0 h ILE 229 N -0.34 1.30 -1.01 6.26 2.04 -1.98 -2.71 117.51 121.08 3mh0 h ILE 229 Ca -0.00 -1.27 0.10 0.00 1.00 0.00 0.00 64.86 64.69 3mh0 h ILE 229 Cb 0.73 1.51 -0.08 0.00 -0.74 0.00 0.00 36.82 38.25 3mh0 h ILE 229 CO 0.03 0.40 0.64 -0.78 0.00 0.00 0.00 178.15 178.44 3mh0 h ASP 230 N 0.35 0.98 0.28 1.72 -0.00 -1.96 -0.40 116.42 117.39 3mh0 h ASP 230 Ca 0.06 0.03 -0.01 0.00 -0.00 0.00 0.00 57.03 57.12 3mh0 h ASP 230 Cb 0.69 -0.17 -0.01 0.00 -0.00 0.00 0.00 39.33 39.84 3mh0 h ASP 230 CO 0.05 0.57 -0.18 -0.61 -0.00 0.00 0.00 179.24 179.06 3mh0 h GLN 231 N 1.07 -0.44 -0.60 0.28 5.75 -1.11 -1.78 115.11 118.29 3mh0 h GLN 231 Ca 0.47 0.03 0.04 0.00 -0.15 0.00 0.00 58.65 59.04 3mh0 h GLN 231 Cb 0.36 0.10 -0.05 0.00 1.07 0.00 0.00 27.48 28.96 3mh0 h GLN 231 CO -0.23 -0.29 0.34 1.25 -2.65 0.00 0.00 178.83 177.25 3mh0 h LEU 232 N -0.45 0.52 -0.49 -2.39 5.85 -1.14 -2.17 115.31 115.05 3mh0 h LEU 232 Ca -0.02 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.77 3mh0 h LEU 232 Cb 0.38 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 3mh0 h LEU 232 CO 0.02 0.36 0.20 0.11 -0.34 0.00 0.00 178.44 178.78 3mh0 h LYS 233 N 0.65 0.38 -0.79 1.25 1.57 -0.90 -1.67 116.57 117.07 3mh0 h LYS 233 Ca 0.26 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 59.08 3mh0 h LYS 233 Cb 0.10 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.28 3mh0 h LYS 233 CO -0.14 0.25 0.51 -0.07 -0.57 0.00 0.00 179.45 179.43 3mh0 h LEU 234 N 0.39 0.75 -0.04 2.94 3.38 -0.98 -1.80 115.31 119.94 3mh0 h LEU 234 Ca 0.23 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 3mh0 h LEU 234 Cb 0.22 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 3mh0 h LEU 234 CO -0.21 0.49 -0.04 0.40 0.09 0.00 0.00 178.44 179.16 3mh0 h ILE 235 N 0.85 1.38 -0.15 1.22 2.04 -1.01 -2.73 117.51 119.11 3mh0 h ILE 235 Ca 0.34 -1.20 -0.01 0.00 1.00 0.00 0.00 64.86 64.99 3mh0 h ILE 235 Cb 0.23 2.09 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 3mh0 h ILE 235 CO -0.12 0.32 0.06 -0.07 0.00 0.00 0.00 178.15 178.35 3mh0 h LEU 236 N -0.36 0.18 -0.80 1.44 3.38 -1.20 -1.47 115.31 116.48 3mh0 h LEU 236 Ca 0.01 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3mh0 h LEU 236 Cb 0.54 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 3mh0 h LEU 236 CO 0.01 0.17 0.35 0.03 0.09 0.00 0.00 178.44 179.09 3mh0 h ARG 237 N 0.21 1.18 0.36 1.13 3.08 -1.02 0.11 114.38 119.44 3mh0 h ARG 237 Ca 0.06 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 3mh0 h ARG 237 Cb 0.05 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.90 3mh0 h ARG 237 CO -0.01 0.94 -0.17 1.25 -1.07 0.00 0.00 179.97 180.91 3mh0 h LEU 238 N 1.16 -0.41 0.00 3.04 5.85 -1.24 -3.39 115.31 120.32 3mh0 h LEU 238 Ca 0.27 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3mh0 h LEU 238 Cb 0.18 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.32 3mh0 h LEU 238 CO -0.03 0.04 -0.79 1.33 -0.34 0.00 0.00 178.44 178.64 3mh0 n VAL 239 N -5.11 0.04 0.00 1.05 0.24 -0.61 -0.54 118.33 113.40 3mh0 n VAL 239 Ca -0.08 -0.06 0.00 0.00 -2.04 0.00 0.00 64.34 62.16 3mh0 n VAL 239 Cb 0.26 0.49 0.00 0.00 -1.47 0.00 0.00 33.84 33.11 3mh0 n VAL 239 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3mh0 n GLY 240 N 1.47 0.02 3.71 7.63 0.00 0.39 -4.11 105.19 114.30 3mh0 n GLY 240 Ca 0.04 -1.62 -0.38 0.00 0.00 0.00 0.00 46.02 44.06 3mh0 n GLY 240 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3mh0 n THR 241 N 0.33 4.00 -1.57 2.61 -2.24 -0.68 -4.80 114.28 111.92 3mh0 n THR 241 Ca 0.00 -0.50 -0.45 0.00 -2.27 0.00 0.00 64.05 60.83 3mh0 n THR 241 Cb 0.00 -1.52 -0.02 0.00 -2.10 0.00 0.00 70.33 66.69 3mh0 n THR 241 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3mh0 n PRO 242 N -1.15 1.20 -2.08 -0.78 -0.02 -1.26 -4.92 135.00 125.99 3mh0 n PRO 242 Ca 0.12 0.42 -0.27 0.00 -2.02 0.00 0.00 63.50 61.75 3mh0 n PRO 242 Cb 0.45 -1.76 0.10 0.00 -0.02 0.00 0.00 33.50 32.27 3mh0 n PRO 242 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3mh0 s GLY 243 N -0.58 1.68 0.37 -1.23 0.00 -1.26 -4.85 107.32 101.45 3mh0 s GLY 243 Ca 0.60 -0.93 0.08 0.00 0.00 0.00 0.00 44.72 44.46 3mh0 s GLY 243 CO 0.59 -0.43 1.90 0.00 0.00 0.00 0.00 173.10 175.17 3mh0 h ALA 244 N -0.93 1.46 -0.51 3.20 0.00 -1.99 0.89 119.26 121.39 3mh0 h ALA 244 Ca -0.44 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.22 3mh0 h ALA 244 Cb 1.30 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 3mh0 h ALA 244 CO 0.57 0.38 0.13 1.49 0.00 0.00 0.00 179.25 181.82 3mh0 h GLU 245 N 0.33 0.76 0.00 0.00 4.57 -2.01 -2.06 114.58 116.17 3mh0 h GLU 245 Ca 0.07 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 58.11 3mh0 h GLU 245 Cb 0.35 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 3mh0 h GLU 245 CO 0.02 0.68 -0.00 1.25 -1.18 0.00 0.00 179.01 179.78 3mh0 h LEU 246 N 0.74 -0.00 -0.98 1.64 5.85 -1.21 -3.28 115.31 118.07 3mh0 h LEU 246 Ca 0.17 -0.76 0.27 0.00 0.84 0.00 0.00 57.88 58.40 3mh0 h LEU 246 Cb 0.26 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.15 3mh0 h LEU 246 CO -0.00 0.76 0.53 -0.07 -0.34 0.00 0.00 178.44 179.31 3mh0 h LEU 247 N -0.76 0.51 -1.99 2.25 3.38 -1.38 0.05 115.31 117.37 3mh0 h LEU 247 Ca -0.00 0.17 0.15 0.00 0.09 0.00 0.00 57.88 58.29 3mh0 h LEU 247 Cb 0.76 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 3mh0 h LEU 247 CO 0.00 -0.03 0.47 0.11 0.09 0.00 0.00 178.44 179.08 3mh0 h LYS 248 N 0.43 0.00 -0.02 1.13 1.57 -1.43 -2.69 116.57 115.56 3mh0 h LYS 248 Ca 0.66 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.44 3mh0 h LYS 248 Cb 1.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.68 3mh0 h LYS 248 CO -0.55 0.00 -0.07 1.63 -0.57 0.00 0.00 179.45 179.89 3mh0 n LYS 249 N -3.99 1.59 -3.37 3.15 5.02 0.00 -4.85 118.16 115.71 3mh0 n LYS 249 Ca 0.10 -1.02 -0.43 0.00 -2.02 0.00 0.00 58.31 54.95 3mh0 n LYS 249 Cb 0.68 -1.48 -0.09 0.00 -0.02 0.00 0.00 35.03 34.12 3mh0 n LYS 249 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3mh0 s ILE 250 N -2.11 5.15 -0.17 -0.18 -1.09 -1.02 -4.91 121.20 116.87 3mh0 s ILE 250 Ca 0.33 -0.44 0.19 0.00 -2.23 0.00 0.00 60.65 58.50 3mh0 s ILE 250 Cb 0.20 -3.99 -0.07 0.00 -1.58 0.00 0.00 42.46 37.03 3mh0 s ILE 250 CO 0.37 -0.37 0.95 -1.28 -1.23 0.00 0.00 174.94 173.39 3mh0 h SER 251 N 8.68 0.00 -3.40 3.58 0.87 -1.88 -3.45 113.55 117.95 3mh0 h SER 251 Ca -0.27 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 59.75 3mh0 h SER 251 Cb 1.12 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.05 3mh0 h SER 251 CO 0.77 0.38 0.30 -0.55 -0.53 0.00 0.00 176.83 177.19 3mh0 s SER 252 N -5.70 7.28 0.15 6.23 0.15 -1.26 -4.96 113.70 115.58 3mh0 s SER 252 Ca -0.01 1.55 -0.10 0.00 0.70 0.00 0.00 55.95 58.08 3mh0 s SER 252 Cb 0.09 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 61.84 3mh0 s SER 252 CO 0.80 -0.23 1.49 -0.08 1.20 0.00 0.00 173.24 176.42 3mh0 h GLU 253 N 6.79 0.95 -0.13 5.44 4.81 -2.00 -2.65 114.58 127.79 3mh0 h GLU 253 Ca -0.41 -0.48 -0.10 0.00 -0.13 0.00 0.00 59.36 58.24 3mh0 h GLU 253 Cb 1.21 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.60 3mh0 h GLU 253 CO 0.75 1.14 -0.30 0.66 -0.73 0.00 0.00 179.01 180.53 3mh0 h SER 254 N 0.78 0.48 -1.00 1.04 4.64 -1.99 -2.63 113.55 114.88 3mh0 h SER 254 Ca 0.07 -0.57 0.18 0.00 -0.47 0.00 0.00 61.79 61.00 3mh0 h SER 254 Cb 0.95 -0.14 -0.10 0.00 -0.31 0.00 0.00 62.40 62.80 3mh0 h SER 254 CO 0.09 0.97 0.62 0.00 -0.87 0.00 0.00 176.83 177.63 3mh0 h ALA 255 N 0.53 1.71 -0.27 5.18 0.00 -1.98 0.07 119.26 124.49 3mh0 h ALA 255 Ca -0.00 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.03 3mh0 h ALA 255 Cb 0.90 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3mh0 h ALA 255 CO 0.07 -0.05 0.19 -0.09 0.00 0.00 0.00 179.25 179.36 3mh0 h ARG 256 N 0.77 0.10 0.00 0.00 2.43 -1.09 -2.41 114.38 114.17 3mh0 h ARG 256 Ca 0.56 -0.01 -0.33 0.00 -0.81 0.00 0.00 59.98 59.39 3mh0 h ARG 256 Cb 0.86 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.33 3mh0 h ARG 256 CO -0.34 0.07 -2.25 0.27 -1.51 0.00 0.00 179.97 176.20 3mh0 n ASN 257 N -4.48 0.47 0.29 -3.80 0.23 -0.38 -3.16 115.26 104.43 3mh0 n ASN 257 Ca 0.03 0.00 0.11 0.00 -0.53 0.00 0.00 54.58 54.19 3mh0 n ASN 257 Cb 0.27 0.97 0.54 0.00 -2.08 0.00 0.00 39.78 39.48 3mh0 n ASN 257 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 3mh0 h TYR 258 N 0.00 0.00 0.00 -2.53 3.20 -0.99 0.28 116.97 116.93 3mh0 h TYR 258 Ca -0.49 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.38 3mh0 h TYR 258 Cb 2.11 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.38 3mh0 h TYR 258 CO 0.00 0.00 -0.00 0.82 -1.64 0.00 0.00 178.16 177.34 3mh0 h ILE 259 N 0.00 0.00 0.00 1.81 1.08 -1.56 -3.10 117.51 115.74 3mh0 h ILE 259 Ca 0.03 -0.01 0.00 0.00 -0.39 0.00 0.00 64.86 64.49 3mh0 h ILE 259 Cb 1.22 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.97 3mh0 h ILE 259 CO -0.00 0.00 0.00 1.67 -0.69 0.00 0.00 178.15 179.13 3mh0 n GLN 260 N -2.25 0.00 0.00 2.37 7.27 -1.08 -0.41 117.38 123.28 3mh0 n GLN 260 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 3mh0 n GLN 260 Cb 0.00 -1.18 0.00 0.00 2.41 0.00 0.00 30.24 31.47 3mh0 n GLN 260 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 3mh0 n SER 261 N -0.57 0.10 -4.81 1.69 7.64 0.97 -4.97 113.62 113.66 3mh0 n SER 261 Ca 0.00 -0.51 -0.33 0.00 1.01 0.00 0.00 58.87 59.04 3mh0 n SER 261 Cb 0.00 0.80 -0.06 0.00 -1.01 0.00 0.00 64.21 63.94 3mh0 n SER 261 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3mh0 s LEU 262 N -1.60 3.90 -0.02 -3.43 1.43 0.45 -4.98 118.68 114.45 3mh0 s LEU 262 Ca 0.00 1.79 -0.37 0.00 -1.03 0.00 0.00 54.13 54.53 3mh0 s LEU 262 Cb 0.00 -4.54 -0.15 0.00 0.03 0.00 0.00 46.19 41.53 3mh0 s LEU 262 CO 0.00 -0.53 1.57 0.41 0.23 0.00 0.00 176.35 178.03 3mh0 n THR 263 N -0.77 0.17 -1.68 5.49 -1.04 -1.26 -4.91 114.28 110.28 3mh0 n THR 263 Ca 0.08 -0.03 -0.47 0.00 -2.04 0.00 0.00 64.05 61.59 3mh0 n THR 263 Cb 0.53 -1.23 -0.04 0.00 -1.82 0.00 0.00 70.33 67.77 3mh0 n THR 263 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 3mh0 n GLN 264 N 4.05 2.27 -3.92 -2.82 0.00 -1.26 -4.80 117.38 110.91 3mh0 n GLN 264 Ca 0.21 0.83 -0.10 0.00 -0.00 0.00 0.00 57.00 57.93 3mh0 n GLN 264 Cb 0.21 -2.67 -0.11 0.00 0.00 0.00 0.00 30.24 27.67 3mh0 n GLN 264 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.06 175.42 3mh0 s MET 265 N 3.16 0.28 0.41 3.69 -1.94 -1.26 -4.98 119.30 118.66 3mh0 s MET 265 Ca 0.88 -0.36 -0.08 0.00 -1.71 0.00 0.00 55.69 54.42 3mh0 s MET 265 Cb -0.65 0.11 -0.05 0.00 2.01 0.00 0.00 34.83 36.25 3mh0 s MET 265 CO 0.46 -0.05 0.73 -1.25 -0.01 0.00 0.00 175.02 174.90 3mh0 s PRO 266 N -1.02 3.67 0.15 2.03 0.04 -1.26 -1.69 135.00 136.92 3mh0 s PRO 266 Ca -0.11 0.28 -0.31 0.00 0.04 0.00 0.00 61.00 60.90 3mh0 s PRO 266 Cb -0.07 -2.44 -0.10 0.00 0.04 0.00 0.00 34.50 31.93 3mh0 s PRO 266 CO -0.00 -0.04 1.71 0.21 0.04 0.00 0.00 177.00 178.91 3mh0 s LYS 267 N -4.09 4.16 0.58 4.56 2.20 -1.26 -4.02 119.74 121.87 3mh0 s LYS 267 Ca 0.48 2.50 -0.18 0.00 -0.36 0.00 0.00 55.97 58.42 3mh0 s LYS 267 Cb -0.10 -3.33 -0.04 0.00 -1.51 0.00 0.00 37.83 32.84 3mh0 s LYS 267 CO 0.35 -0.74 1.11 -1.64 -0.36 0.00 0.00 175.35 174.07 3mh0 s MET 268 N 1.86 3.23 -0.38 4.03 -1.94 0.30 -4.93 119.30 121.47 3mh0 s MET 268 Ca 0.75 1.48 -0.26 0.00 -1.71 0.00 0.00 55.69 55.95 3mh0 s MET 268 Cb -0.46 -2.00 0.02 0.00 2.01 0.00 0.00 34.83 34.40 3mh0 s MET 268 CO 0.33 -0.92 0.93 1.21 -0.01 0.00 0.00 175.02 176.56 3mh0 s ASN 269 N -2.14 6.66 0.50 3.03 3.04 -1.26 -4.92 114.94 119.84 3mh0 s ASN 269 Ca 0.69 0.53 0.17 0.00 0.04 0.00 0.00 52.86 54.29 3mh0 s ASN 269 Cb -0.21 -2.47 1.21 0.00 -1.54 0.00 0.00 41.25 38.25 3mh0 s ASN 269 CO 0.32 -0.89 2.09 -0.26 -3.04 0.00 0.00 177.10 175.31 3mh0 h PHE 270 N 8.56 0.00 -0.73 0.43 0.05 -1.94 0.31 116.94 123.63 3mh0 h PHE 270 Ca -0.23 0.00 0.15 0.00 3.82 0.00 0.00 57.97 61.71 3mh0 h PHE 270 Cb 1.08 0.00 -0.05 0.00 2.00 0.00 0.00 35.95 38.98 3mh0 h PHE 270 CO 0.84 0.08 0.49 0.00 -0.18 0.00 0.00 178.31 179.54 3mh0 h ALA 271 N 1.92 2.17 0.00 2.45 0.00 -1.91 -0.48 119.26 123.40 3mh0 h ALA 271 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3mh0 h ALA 271 Cb 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3mh0 h ALA 271 CO 0.01 -0.36 -0.40 -0.91 0.00 0.00 0.00 179.25 177.59 3mh0 h ASN 272 N 0.36 0.00 0.04 0.00 2.35 -0.79 -3.34 115.58 114.20 3mh0 h ASN 272 Ca 0.35 -0.13 -0.36 0.00 -0.55 0.00 0.00 56.30 55.61 3mh0 h ASN 272 Cb 0.87 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.19 3mh0 h ASN 272 CO -0.10 0.07 -2.08 0.52 -1.65 0.00 0.00 177.43 174.18 3mh0 n VAL 273 N -2.19 1.59 -2.22 2.81 0.31 -0.54 -4.50 118.33 113.59 3mh0 n VAL 273 Ca 0.04 -0.43 -0.39 0.00 -0.01 0.00 0.00 64.34 63.55 3mh0 n VAL 273 Cb 0.44 -1.76 0.02 0.00 -0.91 0.00 0.00 33.84 31.63 3mh0 n VAL 273 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3mh0 n PHE 274 N -3.82 2.73 -1.68 3.52 3.01 -0.30 -5.02 117.46 115.90 3mh0 n PHE 274 Ca -0.41 -2.45 -0.46 0.00 1.01 0.00 0.00 57.45 55.15 3mh0 n PHE 274 Cb 0.91 -1.27 -0.04 0.00 -0.01 0.00 0.00 39.48 39.07 3mh0 n PHE 274 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 3mh0 n ILE 275 N 0.01 0.18 -0.29 4.37 -0.00 -1.25 -1.69 119.36 120.68 3mh0 n ILE 275 Ca 0.51 -0.03 0.00 0.00 -0.00 0.00 0.00 62.75 63.23 3mh0 n ILE 275 Cb 0.27 -1.71 0.00 0.00 -0.00 0.00 0.00 39.64 38.20 3mh0 n ILE 275 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 3mh0 n GLY 276 N 3.77 0.97 3.77 7.39 0.00 -1.26 -5.04 105.19 114.78 3mh0 n GLY 276 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 3mh0 n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mh0 s ALA 277 N -2.76 2.95 0.03 4.61 0.00 -0.68 -5.01 121.76 120.90 3mh0 s ALA 277 Ca 0.00 0.96 -0.37 0.00 0.00 0.00 0.00 51.96 52.55 3mh0 s ALA 277 Cb 0.00 -3.40 -0.17 0.00 0.00 0.00 0.00 23.12 19.56 3mh0 s ALA 277 CO 0.00 -0.72 1.39 -1.71 0.00 0.00 0.00 175.76 174.72 3mh0 n ASN 278 N -0.57 1.66 -0.14 0.00 2.85 -1.26 -4.87 115.26 112.92 3mh0 n ASN 278 Ca 0.08 1.12 0.12 0.00 -0.11 0.00 0.00 54.58 55.78 3mh0 n ASN 278 Cb 0.48 -1.17 0.46 0.00 1.24 0.00 0.00 39.78 40.79 3mh0 n ASN 278 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3mh0 h PRO 279 N 4.85 0.49 -0.25 1.20 0.11 -1.97 -1.01 132.00 135.43 3mh0 h PRO 279 Ca -0.48 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 3mh0 h PRO 279 Cb 1.34 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3mh0 h PRO 279 CO 0.80 0.32 -0.10 -0.07 -0.21 0.00 0.00 178.00 178.74 3mh0 h LEU 280 N 0.50 0.38 -0.37 2.35 3.38 -1.99 -0.46 115.31 119.11 3mh0 h LEU 280 Ca 0.33 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 3mh0 h LEU 280 Cb 0.60 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 3mh0 h LEU 280 CO -0.11 0.53 0.04 0.00 0.09 0.00 0.00 178.44 178.99 3mh0 h ALA 281 N 1.52 0.49 -0.38 1.53 0.00 -1.57 -1.89 119.26 118.96 3mh0 h ALA 281 Ca 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3mh0 h ALA 281 Cb 0.42 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3mh0 h ALA 281 CO 0.02 0.22 0.19 0.28 0.00 0.00 0.00 179.25 179.96 3mh0 h VAL 282 N 0.45 1.17 -0.35 0.00 2.07 -1.28 -0.83 116.25 117.49 3mh0 h VAL 282 Ca 0.11 -0.47 0.04 0.00 0.82 0.00 0.00 66.70 67.20 3mh0 h VAL 282 Cb 0.39 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 3mh0 h VAL 282 CO 0.01 0.18 0.11 -0.78 0.02 0.00 0.00 177.57 177.11 3mh0 h ASP 283 N 0.48 0.12 -0.54 0.57 3.58 -1.04 -0.56 116.42 119.02 3mh0 h ASP 283 Ca 0.13 0.04 -0.08 0.00 0.42 0.00 0.00 57.03 57.54 3mh0 h ASP 283 Cb 0.11 0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.17 3mh0 h ASP 283 CO -0.02 0.10 0.03 0.25 -2.88 0.00 0.00 179.24 176.72 3mh0 h LEU 284 N 0.26 0.91 -0.69 2.28 5.85 -1.16 -2.34 115.31 120.41 3mh0 h LEU 284 Ca 0.16 -0.29 0.12 0.00 0.84 0.00 0.00 57.88 58.71 3mh0 h LEU 284 Cb 0.14 -0.24 -0.09 0.00 0.37 0.00 0.00 40.66 40.84 3mh0 h LEU 284 CO -0.17 0.98 0.27 -0.07 -0.34 0.00 0.00 178.44 179.11 3mh0 h LEU 285 N 0.81 0.26 -2.07 2.25 3.38 -0.93 -0.56 115.31 118.45 3mh0 h LEU 285 Ca 0.16 0.10 0.05 0.00 0.09 0.00 0.00 57.88 58.28 3mh0 h LEU 285 Cb 0.49 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 3mh0 h LEU 285 CO 0.02 0.12 0.14 -0.33 0.09 0.00 0.00 178.44 178.49 3mh0 h GLU 286 N 0.44 0.00 0.00 1.13 4.39 -0.59 0.07 114.58 120.02 3mh0 h GLU 286 Ca 0.37 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.07 3mh0 h GLU 286 Cb 0.51 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 3mh0 h GLU 286 CO -0.36 0.00 -0.93 1.63 -1.16 0.00 0.00 179.01 178.19 3mh0 n LYS 287 N -4.33 0.41 -0.01 2.33 5.02 -0.39 -4.19 118.16 116.99 3mh0 n LYS 287 Ca 0.02 0.06 -0.22 0.00 -2.02 0.00 0.00 58.31 56.15 3mh0 n LYS 287 Cb 0.28 -1.70 -0.13 0.00 -0.02 0.00 0.00 35.03 33.46 3mh0 n LYS 287 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 3mh0 h MET 288 N 0.00 0.22 -2.80 1.97 2.86 -0.42 -0.77 114.93 115.98 3mh0 h MET 288 Ca 0.00 -0.37 -0.73 0.00 -2.06 0.00 0.00 59.70 56.54 3mh0 h MET 288 Cb 0.83 0.14 -0.11 0.00 0.06 0.00 0.00 31.60 32.53 3mh0 h MET 288 CO 0.00 1.18 2.58 1.28 1.06 0.00 0.00 176.91 183.00 3mh0 n LEU 289 N -3.72 7.96 -4.36 1.22 4.77 -0.06 -4.34 117.00 118.47 3mh0 n LEU 289 Ca -0.31 -4.78 -0.33 0.00 -0.03 0.00 0.00 56.01 50.56 3mh0 n LEU 289 Cb 0.96 -1.41 -0.15 0.00 -2.33 0.00 0.00 43.42 40.50 3mh0 n LEU 289 CO 0.38 1.96 -0.47 -0.69 -1.33 0.00 0.00 177.39 177.24 3mh0 s VAL 290 N -0.44 2.86 0.16 4.08 1.01 -1.26 -4.93 120.40 121.87 3mh0 s VAL 290 Ca 0.54 -0.74 -0.16 0.00 0.00 0.00 0.00 61.98 61.62 3mh0 s VAL 290 Cb 0.17 -2.17 0.03 0.00 0.00 0.00 0.00 36.38 34.42 3mh0 s VAL 290 CO -0.08 0.54 1.76 -0.07 0.00 0.00 0.00 175.10 177.25 3mh0 h LEU 291 N 6.43 0.17 -8.96 3.92 4.07 -1.93 -3.42 115.31 115.59 3mh0 h LEU 291 Ca -0.29 0.04 -0.57 0.00 0.08 0.00 0.00 57.88 57.14 3mh0 h LEU 291 Cb 1.20 0.02 -0.04 0.00 1.08 0.00 0.00 40.66 42.92 3mh0 h LEU 291 CO 0.53 0.13 1.07 -0.62 -1.08 0.00 0.00 178.44 178.47 3mh0 s ASP 292 N -5.38 6.45 0.43 -0.43 -1.08 -1.26 -4.88 116.67 110.53 3mh0 s ASP 292 Ca -0.13 1.34 0.12 0.00 -0.52 0.00 0.00 52.55 53.35 3mh0 s ASP 292 Cb 0.12 -2.54 0.95 0.00 -1.46 0.00 0.00 42.92 40.00 3mh0 s ASP 292 CO 0.72 -1.24 2.00 0.77 0.52 0.00 0.00 175.17 177.93 3mh0 h SER 293 N 10.31 0.15 0.49 -0.34 4.64 -1.98 -2.18 113.55 124.64 3mh0 h SER 293 Ca -0.30 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 3mh0 h SER 293 Cb 1.13 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 3mh0 h SER 293 CO 1.03 0.25 0.00 0.44 -0.87 0.00 0.00 176.83 177.67 3mh0 h ASP 294 N 0.16 0.00 -0.01 4.97 3.45 -1.96 -2.27 116.42 120.76 3mh0 h ASP 294 Ca 0.04 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.50 3mh0 h ASP 294 Cb 0.23 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.00 3mh0 h ASP 294 CO 0.01 0.00 -0.17 0.29 -1.57 0.00 0.00 179.24 177.80 3mh0 n LYS 295 N -2.76 1.51 -2.36 3.56 4.76 -0.82 -4.99 118.16 117.06 3mh0 n LYS 295 Ca -0.00 -0.96 -0.37 0.00 -2.87 0.00 0.00 58.31 54.11 3mh0 n LYS 295 Cb 0.17 -1.22 -0.02 0.00 -1.84 0.00 0.00 35.03 32.12 3mh0 n LYS 295 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3mh0 s ARG 296 N -1.46 3.97 0.56 1.97 3.00 -0.86 -4.95 118.95 121.18 3mh0 s ARG 296 Ca 0.13 1.70 -0.20 0.00 0.00 0.00 0.00 55.73 57.36 3mh0 s ARG 296 Cb 0.11 -2.52 -0.05 0.00 0.00 0.00 0.00 34.95 32.49 3mh0 s ARG 296 CO 0.27 -0.35 1.21 -1.50 0.00 0.00 0.00 175.30 174.93 3mh0 s ILE 297 N -1.55 2.71 0.65 1.52 2.07 -0.30 -5.02 121.20 121.28 3mh0 s ILE 297 Ca 0.60 0.47 -0.08 0.00 -1.41 0.00 0.00 60.65 60.22 3mh0 s ILE 297 Cb -0.27 -3.20 0.01 0.00 0.13 0.00 0.00 42.46 39.13 3mh0 s ILE 297 CO 0.33 -0.07 0.99 0.42 -1.91 0.00 0.00 174.94 174.71 3mh0 s THR 298 N -1.57 3.50 0.09 4.00 -4.23 -1.26 -4.92 115.64 111.25 3mh0 s THR 298 Ca 0.74 0.20 -0.27 0.00 -1.18 0.00 0.00 61.69 61.17 3mh0 s THR 298 Cb -0.31 -3.44 -0.14 0.00 1.34 0.00 0.00 72.50 69.96 3mh0 s THR 298 CO 0.34 -0.51 1.67 0.00 -0.54 0.00 0.00 174.62 175.59 3mh0 h ALA 299 N -0.41 -0.42 -0.54 3.99 0.00 -1.93 -1.41 119.26 118.54 3mh0 h ALA 299 Ca -0.45 -0.07 0.11 0.00 0.00 0.00 0.00 54.91 54.49 3mh0 h ALA 299 Cb 1.26 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 19.20 3mh0 h ALA 299 CO 0.62 -0.75 0.02 0.00 0.00 0.00 0.00 179.25 179.15 3mh0 h ALA 300 N 0.29 0.54 -0.64 0.00 0.00 -1.93 -1.80 119.26 115.72 3mh0 h ALA 300 Ca -0.02 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.06 3mh0 h ALA 300 Cb 0.38 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 3mh0 h ALA 300 CO -0.00 -0.37 0.42 1.96 0.00 0.00 0.00 179.25 181.25 3mh0 h GLN 301 N 0.14 0.82 -0.59 0.00 4.20 -1.94 -2.86 115.11 114.88 3mh0 h GLN 301 Ca 0.28 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.92 3mh0 h GLN 301 Cb 0.42 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 3mh0 h GLN 301 CO -0.43 0.54 0.30 0.00 -0.67 0.00 0.00 178.83 178.57 3mh0 h ALA 302 N 1.24 1.42 0.00 3.87 0.00 -0.65 -1.96 119.26 123.18 3mh0 h ALA 302 Ca 0.24 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 3mh0 h ALA 302 Cb -0.07 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 3mh0 h ALA 302 CO -0.06 0.47 -0.15 -0.07 0.00 0.00 0.00 179.25 179.44 3mh0 h LEU 303 N 0.83 0.00 -0.52 0.00 3.38 -1.12 -1.19 115.31 116.70 3mh0 h LEU 303 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3mh0 h LEU 303 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3mh0 h LEU 303 CO -0.03 0.15 -0.08 0.00 0.09 0.00 0.00 178.44 178.57 3mh0 n ALA 304 N -2.41 2.73 -1.77 1.53 0.00 -0.75 -4.73 120.51 115.11 3mh0 n ALA 304 Ca -0.02 -0.35 -0.39 0.00 0.00 0.00 0.00 53.44 52.68 3mh0 n ALA 304 Cb 0.23 -1.26 -0.02 0.00 0.00 0.00 0.00 19.45 18.40 3mh0 n ALA 304 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3mh0 s HIS 305 N -2.22 3.05 0.61 0.00 5.04 -0.45 -4.93 115.29 116.39 3mh0 s HIS 305 Ca 0.35 1.51 0.31 0.00 -1.54 0.00 0.00 55.06 55.69 3mh0 s HIS 305 Cb 0.21 -3.50 1.75 0.00 0.04 0.00 0.00 32.58 31.08 3mh0 s HIS 305 CO 0.41 -1.53 2.11 0.00 -2.34 0.00 0.00 174.74 173.40 3mh0 h ALA 306 N 2.89 1.65 -0.43 1.58 0.00 -1.91 -1.83 119.26 121.20 3mh0 h ALA 306 Ca -0.49 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.44 3mh0 h ALA 306 Cb 1.23 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 3mh0 h ALA 306 CO 0.63 -0.26 0.29 -0.92 0.00 0.00 0.00 179.25 178.99 3mh0 h TYR 307 N 0.00 0.49 -0.63 0.00 3.20 -1.92 -2.90 116.97 115.21 3mh0 h TYR 307 Ca 0.07 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.88 3mh0 h TYR 307 Cb 0.45 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.52 3mh0 h TYR 307 CO 0.00 0.29 0.08 1.19 -1.64 0.00 0.00 178.16 178.09 3mh0 n PHE 308 N -4.48 2.22 0.06 -3.82 3.01 -0.69 -4.66 117.46 109.11 3mh0 n PHE 308 Ca 0.04 -0.87 0.15 0.00 1.01 0.00 0.00 57.45 57.79 3mh0 n PHE 308 Cb 0.11 -0.57 0.64 0.00 -0.01 0.00 0.00 39.48 39.65 3mh0 n PHE 308 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3mh0 h ALA 309 N 3.64 2.27 0.00 4.37 0.00 -1.63 0.54 119.26 128.45 3mh0 h ALA 309 Ca 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3mh0 h ALA 309 Cb 2.10 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.90 3mh0 h ALA 309 CO 0.57 -0.38 -0.06 1.96 0.00 0.00 0.00 179.25 181.34 3mh0 h GLN 310 N 0.07 0.00 0.00 0.00 7.50 -1.86 -3.36 115.11 117.46 3mh0 h GLN 310 Ca 0.19 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.32 3mh0 h GLN 310 Cb 0.64 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.17 3mh0 h GLN 310 CO -0.01 0.06 -1.06 0.66 -1.50 0.00 0.00 178.83 176.98 3mh0 n TYR 311 N -3.21 0.00 -1.67 2.96 4.02 0.16 -5.03 117.16 114.39 3mh0 n TYR 311 Ca 0.00 0.00 -0.49 0.00 -0.01 0.00 0.00 57.90 57.40 3mh0 n TYR 311 Cb 0.31 -0.04 -0.05 0.00 -0.02 0.00 0.00 39.34 39.54 3mh0 n TYR 311 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 176.86 177.43 3mh0 n HIS 312 N -2.10 2.22 -3.79 -0.72 -0.00 0.45 -4.99 115.22 106.28 3mh0 n HIS 312 Ca -0.02 0.18 -0.29 0.00 0.46 0.00 0.00 57.72 58.06 3mh0 n HIS 312 Cb 0.53 -2.58 -0.16 0.00 -0.12 0.00 0.00 29.99 27.66 3mh0 n HIS 312 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 3mh0 s ASP 313 N 2.75 3.43 0.51 0.26 -1.08 -1.26 -4.99 116.67 116.29 3mh0 s ASP 313 Ca 0.88 -1.11 0.34 0.00 -0.52 0.00 0.00 52.55 52.14 3mh0 s ASP 313 Cb -0.75 -0.82 1.83 0.00 -1.46 0.00 0.00 42.92 41.72 3mh0 s ASP 313 CO 0.48 -0.31 2.03 1.55 0.52 0.00 0.00 175.17 179.44 3mh0 h PRO 314 N 8.13 0.00 -0.01 4.34 0.13 -1.98 0.26 132.00 142.87 3mh0 h PRO 314 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 3mh0 h PRO 314 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 3mh0 h PRO 314 CO 0.39 0.00 -0.26 -0.25 -0.23 0.00 0.00 178.00 177.64 3mh0 n ASP 315 N -2.69 1.42 -2.58 1.44 10.43 -1.26 -4.09 116.55 119.21 3mh0 n ASP 315 Ca -0.02 -1.17 -0.12 0.00 2.57 0.00 0.00 54.79 56.05 3mh0 n ASP 315 Cb 0.07 0.19 0.03 0.00 1.84 0.00 0.00 41.12 43.26 3mh0 n ASP 315 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 3mh0 n ASP 316 N -0.30 2.61 -3.35 -2.24 4.64 0.90 -4.86 116.55 113.94 3mh0 n ASP 316 Ca 0.12 -2.84 -0.26 0.00 -1.38 0.00 0.00 54.79 50.44 3mh0 n ASP 316 Cb 0.39 -0.47 -0.08 0.00 -1.04 0.00 0.00 41.12 39.92 3mh0 n ASP 316 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 3mh0 n GLU 317 N -0.41 1.33 -1.05 -0.67 1.02 -1.19 -4.84 120.64 114.84 3mh0 n GLU 317 Ca 0.19 -3.80 -0.31 0.00 -0.02 0.00 0.00 57.16 53.22 3mh0 n GLU 317 Cb 0.81 -1.71 0.12 0.00 -0.02 0.00 0.00 31.44 30.64 3mh0 n GLU 317 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3mh0 s PRO 318 N -1.47 1.77 0.27 3.49 0.04 -1.26 -4.95 135.00 132.88 3mh0 s PRO 318 Ca 0.35 1.34 0.08 0.00 0.04 0.00 0.00 61.00 62.81 3mh0 s PRO 318 Cb 0.13 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.80 3mh0 s PRO 318 CO -0.10 -2.04 0.14 0.14 0.04 0.00 0.00 177.00 175.19 3mh0 s VAL 319 N -2.77 3.99 0.51 -0.36 -7.23 -1.26 -4.18 120.40 109.09 3mh0 s VAL 319 Ca 0.64 -1.58 -0.16 0.00 -1.81 0.00 0.00 61.98 59.07 3mh0 s VAL 319 Cb -0.20 -3.19 -0.08 0.00 0.56 0.00 0.00 36.38 33.48 3mh0 s VAL 319 CO 0.56 -0.34 0.97 0.00 -0.31 0.00 0.00 175.10 175.99 3mh0 s ALA 320 N -2.22 3.09 0.85 1.32 0.00 -1.25 -5.04 121.76 118.51 3mh0 s ALA 320 Ca 0.33 0.13 -0.11 0.00 0.00 0.00 0.00 51.96 52.32 3mh0 s ALA 320 Cb -0.07 -3.08 0.10 0.00 0.00 0.00 0.00 23.12 20.07 3mh0 s ALA 320 CO 0.23 -0.24 1.10 -0.51 0.00 0.00 0.00 175.76 176.34 3mh0 s ASP 321 N -3.14 3.79 0.46 0.00 1.01 -1.26 -4.76 116.67 112.78 3mh0 s ASP 321 Ca 0.58 1.72 -0.24 0.00 0.71 0.00 0.00 52.55 55.32 3mh0 s ASP 321 Cb -0.10 -2.38 -0.07 0.00 1.01 0.00 0.00 42.92 41.38 3mh0 s ASP 321 CO 0.32 -2.47 1.23 -2.16 0.21 0.00 0.00 175.17 172.30 3mh0 s PRO 322 N -4.87 3.72 -0.23 8.23 0.04 -1.26 -4.74 135.00 135.89 3mh0 s PRO 322 Ca 0.63 1.94 -0.03 0.00 0.04 0.00 0.00 61.00 63.58 3mh0 s PRO 322 Cb -0.18 -2.48 0.01 0.00 0.04 0.00 0.00 34.50 31.89 3mh0 s PRO 322 CO 0.57 -0.63 -0.06 -0.47 0.04 0.00 0.00 177.00 176.44 3mh0 s TYR 323 N -1.43 2.97 -0.74 0.56 5.04 -1.26 -5.05 117.35 117.44 3mh0 s TYR 323 Ca 0.63 -1.22 -0.27 0.00 -2.44 0.00 0.00 57.07 53.78 3mh0 s TYR 323 Cb -0.33 -2.07 0.02 0.00 0.35 0.00 0.00 41.96 39.93 3mh0 s TYR 323 CO 0.40 -0.64 1.43 0.34 -1.34 0.00 0.00 175.55 175.74 3mh0 s ASP 324 N 1.41 5.97 -0.37 4.32 2.15 -1.26 -4.86 116.67 124.03 3mh0 s ASP 324 Ca 0.04 -0.36 0.06 0.00 0.43 0.00 0.00 52.55 52.72 3mh0 s ASP 324 Cb -0.15 -2.55 0.56 0.00 -0.30 0.00 0.00 42.92 40.47 3mh0 s ASP 324 CO -0.05 -1.95 1.65 0.00 -0.17 0.00 0.00 175.17 174.65 3mh0 n GLN 325 N 9.29 2.12 0.24 4.34 10.64 -1.26 -4.58 117.38 138.17 3mh0 n GLN 325 Ca 0.10 -3.20 0.08 0.00 -1.83 0.00 0.00 57.00 52.15 3mh0 n GLN 325 Cb 0.50 -2.00 0.59 0.00 -0.86 0.00 0.00 30.24 28.47 3mh0 n GLN 325 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3mh0 h SER 326 N 1.14 0.00 -0.40 2.61 4.64 -2.04 -1.60 113.55 117.90 3mh0 h SER 326 Ca 0.40 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.84 3mh0 h SER 326 Cb 2.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 64.07 3mh0 h SER 326 CO 0.74 0.14 0.32 2.19 -0.87 0.00 0.00 176.83 179.35 3mh0 h PHE 327 N 0.00 0.00 -0.12 4.77 -5.15 -1.97 -0.89 116.94 113.57 3mh0 h PHE 327 Ca -0.00 0.00 0.04 0.00 -0.20 0.00 0.00 57.97 57.80 3mh0 h PHE 327 Cb 0.27 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.44 3mh0 h PHE 327 CO 0.00 0.00 0.09 0.93 -2.00 0.00 0.00 178.31 177.33 3mh0 h GLU 328 N 0.00 0.00 0.00 6.09 4.39 -1.66 0.04 114.58 123.44 3mh0 h GLU 328 Ca 0.19 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.85 3mh0 h GLU 328 Cb 0.82 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.47 3mh0 h GLU 328 CO -0.00 0.00 -0.25 0.77 -1.16 0.00 0.00 179.01 178.37 3mh0 h SER 329 N 0.00 0.00 -3.91 1.42 0.02 -1.36 -3.47 113.55 106.24 3mh0 h SER 329 Ca 0.06 0.00 -0.47 0.00 -0.84 0.00 0.00 61.79 60.54 3mh0 h SER 329 Cb 0.24 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 3mh0 h SER 329 CO -0.00 0.17 0.23 -0.13 -1.14 0.00 0.00 176.83 175.96 3mh0 s ARG 330 N -3.13 4.10 -0.34 3.45 0.52 -0.00 -5.05 118.95 118.50 3mh0 s ARG 330 Ca 0.05 0.89 0.04 0.00 -0.52 0.00 0.00 55.73 56.19 3mh0 s ARG 330 Cb 0.06 -2.29 0.10 0.00 0.52 0.00 0.00 34.95 33.34 3mh0 s ARG 330 CO 0.70 0.03 0.05 -0.51 0.02 0.00 0.00 175.30 175.60 3mh0 s ASP 331 N -2.32 4.71 0.34 0.23 1.01 -1.26 -5.05 116.67 114.33 3mh0 s ASP 331 Ca 0.58 -2.11 0.09 0.00 0.71 0.00 0.00 52.55 51.83 3mh0 s ASP 331 Cb -0.10 -1.57 -0.06 0.00 1.01 0.00 0.00 42.92 42.20 3mh0 s ASP 331 CO 0.17 -0.38 -0.06 -0.76 0.21 0.00 0.00 175.17 174.35 3mh0 s LEU 332 N 0.96 2.81 0.57 1.23 1.43 -1.26 -5.13 118.68 119.28 3mh0 s LEU 332 Ca 0.11 -1.12 -0.14 0.00 -1.03 0.00 0.00 54.13 51.94 3mh0 s LEU 332 Cb -0.19 -1.12 -0.06 0.00 0.03 0.00 0.00 46.19 44.85 3mh0 s LEU 332 CO -0.09 -0.21 1.01 -0.76 0.23 0.00 0.00 176.35 176.53 3mh0 s LEU 333 N -3.64 3.44 0.22 1.79 2.01 -1.26 -4.86 118.68 116.38 3mh0 s LEU 333 Ca 0.33 1.53 -0.07 0.00 0.01 0.00 0.00 54.13 55.92 3mh0 s LEU 333 Cb 0.01 -4.49 0.29 0.00 0.01 0.00 0.00 46.19 42.01 3mh0 s LEU 333 CO 0.17 -0.77 1.82 0.40 1.01 0.00 0.00 176.35 178.99 3mh0 h ILE 334 N 0.33 0.99 -0.67 -0.59 2.04 -1.92 -1.23 117.51 116.46 3mh0 h ILE 334 Ca -0.46 -0.27 0.04 0.00 1.00 0.00 0.00 64.86 65.17 3mh0 h ILE 334 Cb 1.19 0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 3mh0 h ILE 334 CO 0.61 0.15 0.44 0.44 0.00 0.00 0.00 178.15 179.79 3mh0 h ASP 335 N 0.80 0.66 0.22 1.72 3.45 -1.95 0.88 116.42 122.19 3mh0 h ASP 335 Ca 0.33 -0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.78 3mh0 h ASP 335 Cb 0.20 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 38.82 3mh0 h ASP 335 CO -0.18 0.45 -0.11 -0.33 -1.57 0.00 0.00 179.24 177.50 3mh0 h GLU 336 N 0.76 -0.28 -1.08 3.56 5.08 -1.60 -1.55 114.58 119.46 3mh0 h GLU 336 Ca 0.27 0.02 0.33 0.00 -1.00 0.00 0.00 59.36 58.98 3mh0 h GLU 336 Cb 0.13 0.06 -0.13 0.00 0.50 0.00 0.00 28.75 29.31 3mh0 h GLU 336 CO -0.08 0.10 0.65 -1.49 -1.00 0.00 0.00 179.01 177.19 3mh0 h TRP 337 N -0.85 0.80 -0.11 4.33 -0.00 -1.41 0.78 115.95 119.48 3mh0 h TRP 337 Ca -0.03 0.03 -0.21 0.00 -0.00 0.00 0.00 58.89 58.68 3mh0 h TRP 337 Cb 0.51 -0.21 0.00 0.00 -0.00 0.00 0.00 29.16 29.46 3mh0 h TRP 337 CO 0.06 -0.12 -0.78 1.57 -0.00 0.00 0.00 178.44 179.17 3mh0 h LYS 338 N 0.30 0.63 -0.16 0.49 2.10 -0.64 -1.15 116.57 118.14 3mh0 h LYS 338 Ca 0.72 -0.53 -0.12 0.00 -2.00 0.00 0.00 60.65 58.72 3mh0 h LYS 338 Cb 1.80 0.11 -0.01 0.00 -0.90 0.00 0.00 32.23 33.24 3mh0 h LYS 338 CO -0.50 1.15 -0.43 1.03 -2.00 0.00 0.00 179.45 178.70 3mh0 h SER 339 N 0.42 0.40 -0.71 7.07 0.87 -0.21 -1.02 113.55 120.36 3mh0 h SER 339 Ca -0.05 -0.18 -0.05 0.00 -1.23 0.00 0.00 61.79 60.28 3mh0 h SER 339 Cb 1.39 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 63.21 3mh0 h SER 339 CO 0.15 0.78 0.25 -0.07 -0.53 0.00 0.00 176.83 177.41 3mh0 h LEU 340 N 0.31 1.02 -0.21 2.23 3.38 -0.70 0.25 115.31 121.59 3mh0 h LEU 340 Ca 0.02 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 3mh0 h LEU 340 Cb 0.89 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3mh0 h LEU 340 CO 0.07 0.94 -0.01 0.74 0.09 0.00 0.00 178.44 180.27 3mh0 h THR 341 N 1.04 1.26 -0.97 0.22 2.02 -1.08 -2.30 112.91 113.11 3mh0 h THR 341 Ca 0.23 -0.92 0.04 0.00 0.77 0.00 0.00 66.41 66.53 3mh0 h THR 341 Cb 0.27 1.45 -0.06 0.00 -1.74 0.00 0.00 68.15 68.07 3mh0 h THR 341 CO -0.01 0.28 0.63 0.22 0.37 0.00 0.00 175.52 177.01 3mh0 h TYR 342 N 0.13 1.18 -0.78 3.16 3.20 -0.97 -1.30 116.97 121.60 3mh0 h TYR 342 Ca 0.06 0.03 0.05 0.00 3.14 0.00 0.00 58.73 62.01 3mh0 h TYR 342 Cb 0.43 -0.39 -0.05 0.00 1.54 0.00 0.00 36.73 38.25 3mh0 h TYR 342 CO 0.04 0.67 0.48 -0.44 -1.64 0.00 0.00 178.16 177.27 3mh0 h ASP 343 N 1.21 0.76 -0.45 -2.11 3.32 -0.75 -1.98 116.42 116.43 3mh0 h ASP 343 Ca 0.39 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.40 3mh0 h ASP 343 Cb 0.01 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 3mh0 h ASP 343 CO -0.13 0.50 0.12 -0.33 -1.72 0.00 0.00 179.24 177.69 3mh0 h GLU 344 N 0.90 0.77 -0.07 3.56 4.39 -0.78 -1.83 114.58 121.52 3mh0 h GLU 344 Ca 0.33 -0.15 -0.01 0.00 0.34 0.00 0.00 59.36 59.88 3mh0 h GLU 344 Cb 0.12 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3mh0 h GLU 344 CO -0.15 0.70 0.02 0.28 -1.16 0.00 0.00 179.01 178.69 3mh0 h VAL 345 N 0.75 1.19 -0.75 3.13 2.07 -0.53 -2.84 116.25 119.27 3mh0 h VAL 345 Ca 0.17 -0.57 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 3mh0 h VAL 345 Cb 0.28 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 3mh0 h VAL 345 CO -0.00 0.16 0.40 0.40 0.02 0.00 0.00 177.57 178.55 3mh0 h ILE 346 N -0.10 1.22 0.00 4.57 5.03 -1.41 -3.04 117.51 123.78 3mh0 h ILE 346 Ca 0.02 -0.56 0.00 0.00 -0.12 0.00 0.00 64.86 64.20 3mh0 h ILE 346 Cb 0.24 0.22 0.00 0.00 -3.03 0.00 0.00 36.82 34.25 3mh0 h ILE 346 CO 0.00 0.25 -0.02 -1.54 -0.68 0.00 0.00 178.15 176.16 3mh0 n SER 347 N -4.35 0.03 -4.72 1.72 3.41 -0.69 -4.90 113.62 104.11 3mh0 n SER 347 Ca 0.07 0.47 -0.42 0.00 -0.26 0.00 0.00 58.87 58.73 3mh0 n SER 347 Cb 0.10 -0.47 -0.03 0.00 -0.26 0.00 0.00 64.21 63.56 3mh0 n SER 347 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3mh0 s PHE 348 N -3.00 2.88 -0.16 7.33 5.36 -1.08 -5.00 117.98 124.30 3mh0 s PHE 348 Ca 0.14 0.42 0.01 0.00 -0.96 0.00 0.00 56.93 56.54 3mh0 s PHE 348 Cb 0.19 -4.12 0.01 0.00 -0.34 0.00 0.00 43.02 38.75 3mh0 s PHE 348 CO 0.54 -4.18 -0.19 0.08 -1.46 0.00 0.00 175.22 170.01 3mh0 s VAL 349 N 0.98 2.28 0.68 3.12 1.01 -1.26 -5.09 120.40 122.11 3mh0 s VAL 349 Ca 0.73 -0.89 -0.12 0.00 0.00 0.00 0.00 61.98 61.69 3mh0 s VAL 349 Cb -0.49 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 33.95 3mh0 s VAL 349 CO 0.35 0.53 1.07 -2.16 0.00 0.00 0.00 175.10 174.89 3mh0 s PRO 350 N 1.01 2.92 0.44 2.72 0.04 -1.26 -4.99 135.00 135.87 3mh0 s PRO 350 Ca -0.02 1.09 -0.24 0.00 0.04 0.00 0.00 61.00 61.87 3mh0 s PRO 350 Cb -0.15 -1.98 -0.08 0.00 0.04 0.00 0.00 34.50 32.33 3mh0 s PRO 350 CO -0.05 -1.12 1.23 -2.14 0.04 0.00 0.00 177.00 174.96 3mh0 s PRO 351 N -4.69 3.82 0.00 0.56 0.02 -1.26 -5.17 135.00 128.28 3mh0 s PRO 351 Ca 0.61 1.97 0.00 0.00 0.02 0.00 0.00 61.00 63.60 3mh0 s PRO 351 Cb -0.16 -2.57 0.00 0.00 0.02 0.00 0.00 34.50 31.80 3mh0 s PRO 351 CO 0.49 -0.56 0.00 -0.35 -0.33 0.00 0.00 177.00 176.26