#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h1r n MET 1 N 0.00 2.80 -0.22 1.43 0.00 -1.26 -4.50 117.12 115.38 1h1r n MET 1 Ca 0.00 -2.34 0.08 0.00 0.00 0.00 0.00 57.70 55.44 1h1r n MET 1 Cb 0.00 -1.61 0.35 0.00 0.00 0.00 0.00 33.22 31.96 1h1r n MET 1 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 1h1r h GLU 2 N 3.61 0.74 -0.05 0.03 4.57 -2.06 -2.04 114.58 119.38 1h1r h GLU 2 Ca 0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1h1r h GLU 2 Cb 1.01 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.44 1h1r h GLU 2 CO 0.08 0.49 0.00 0.09 -1.18 0.00 0.00 179.01 178.49 1h1r n ASN 3 N -4.50 1.24 -4.85 1.04 3.02 -1.26 -4.84 115.26 105.12 1h1r n ASN 3 Ca 0.13 -1.47 -0.37 0.00 -0.03 0.00 0.00 54.58 52.84 1h1r n ASN 3 Cb 0.30 -0.02 -0.07 0.00 -0.61 0.00 0.00 39.78 39.38 1h1r n ASN 3 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1h1r s PHE 4 N -1.95 3.53 -0.24 3.10 0.08 -0.77 0.05 117.98 121.77 1h1r s PHE 4 Ca 0.38 0.47 0.00 0.00 0.12 0.00 0.00 56.93 57.90 1h1r s PHE 4 Cb 0.20 -1.92 0.04 0.00 -0.57 0.00 0.00 43.02 40.77 1h1r s PHE 4 CO 0.32 0.69 -0.09 -1.14 -0.10 0.00 0.00 175.22 174.89 1h1r s GLN 5 N -1.00 2.68 0.32 0.44 2.00 -0.08 -4.93 119.66 119.10 1h1r s GLN 5 Ca 0.15 -1.07 -0.29 0.00 -2.00 0.00 0.00 55.36 52.15 1h1r s GLN 5 Cb -0.12 -2.90 -0.10 0.00 0.80 0.00 0.00 33.01 30.69 1h1r s GLN 5 CO 0.04 -0.42 1.31 0.15 -0.50 0.00 0.00 175.29 175.86 1h1r s LYS 6 N 1.26 4.35 -0.20 1.67 1.02 -1.26 -1.09 119.74 125.50 1h1r s LYS 6 Ca -0.02 2.21 -0.11 0.00 0.02 0.00 0.00 55.97 58.08 1h1r s LYS 6 Cb -0.17 -3.08 -0.08 0.00 -0.52 0.00 0.00 37.83 33.98 1h1r s LYS 6 CO -0.06 -0.20 -0.27 0.28 -0.92 0.00 0.00 175.35 174.19 1h1r n VAL 7 N 0.92 1.16 -3.77 3.17 0.31 0.82 -4.90 118.33 116.04 1h1r n VAL 7 Ca 0.00 -0.24 -0.03 0.00 -0.01 0.00 0.00 64.34 64.06 1h1r n VAL 7 Cb 0.42 -1.82 -0.01 0.00 -0.91 0.00 0.00 33.84 31.52 1h1r n VAL 7 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1h1r s GLU 8 N -2.41 1.20 -0.02 5.55 -1.05 -1.19 -5.00 118.70 115.79 1h1r s GLU 8 Ca -0.28 -0.68 -0.22 0.00 -0.15 0.00 0.00 54.97 53.65 1h1r s GLU 8 Cb 0.10 0.40 -0.05 0.00 -0.44 0.00 0.00 34.13 34.14 1h1r s GLU 8 CO 0.36 -0.55 0.63 0.21 0.95 0.00 0.00 175.26 176.86 1h1r s LYS 9 N -3.14 4.37 -0.18 -4.83 2.20 -1.26 -0.54 119.74 116.36 1h1r s LYS 9 Ca 0.13 0.79 -0.16 0.00 -0.36 0.00 0.00 55.97 56.37 1h1r s LYS 9 Cb -0.01 -3.38 -0.11 0.00 -1.51 0.00 0.00 37.83 32.82 1h1r s LYS 9 CO 0.03 0.27 -0.00 -0.89 -0.36 0.00 0.00 175.35 174.39 1h1r n ILE 10 N 3.07 1.48 -2.39 5.43 5.41 0.16 -4.83 119.36 127.69 1h1r n ILE 10 Ca -0.05 0.08 0.00 0.00 1.00 0.00 0.00 62.75 63.78 1h1r n ILE 10 Cb 0.51 -2.20 0.00 0.00 -0.71 0.00 0.00 39.64 37.24 1h1r n ILE 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1h1r n GLY 11 N 1.51 -1.43 3.03 7.39 0.00 -0.86 -5.02 105.19 109.80 1h1r n GLY 11 Ca -0.21 -1.01 -0.26 0.00 0.00 0.00 0.00 46.02 44.54 1h1r n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h1r s GLU 12 N -1.11 1.91 0.00 1.61 2.02 -1.26 -0.76 118.70 121.12 1h1r s GLU 12 Ca 0.00 -0.47 0.00 0.00 0.02 0.00 0.00 54.97 54.52 1h1r s GLU 12 Cb 0.00 -1.62 0.00 0.00 0.10 0.00 0.00 34.13 32.61 1h1r s GLU 12 CO 0.00 -0.02 0.00 0.41 0.02 0.00 0.00 175.26 175.67 1h1r n GLY 13 N 4.04 2.75 0.25 -1.39 0.00 -1.26 -4.99 105.19 104.58 1h1r n GLY 13 Ca -0.20 -1.24 -0.10 0.00 0.00 0.00 0.00 46.02 44.48 1h1r n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1h1r h THR 14 N 0.00 0.48 -3.96 2.61 2.02 -1.96 -3.43 112.91 108.67 1h1r h THR 14 Ca 0.00 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.87 1h1r h THR 14 Cb 0.00 0.48 -0.15 0.00 -1.74 0.00 0.00 68.15 66.75 1h1r h THR 14 CO 0.00 0.00 -0.63 -0.72 0.37 0.00 0.00 175.52 174.54 1h1r s TYR 15 N -6.10 1.38 0.00 3.16 -0.85 -1.26 -5.12 117.35 108.56 1h1r s TYR 15 Ca -0.15 -1.19 0.00 0.00 -0.52 0.00 0.00 57.07 55.21 1h1r s TYR 15 Cb 0.10 -0.78 0.00 0.00 0.38 0.00 0.00 41.96 41.66 1h1r s TYR 15 CO 0.67 -0.38 0.00 0.41 -1.52 0.00 0.00 175.55 174.73 1h1r n GLY 16 N -0.37 -0.53 3.08 5.49 0.00 -1.26 -4.93 105.19 106.66 1h1r n GLY 16 Ca -0.01 -0.95 -0.21 0.00 0.00 0.00 0.00 46.02 44.86 1h1r n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h1r s VAL 17 N 0.00 0.94 -0.12 1.61 1.01 -0.87 -4.16 120.40 118.82 1h1r s VAL 17 Ca 0.00 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.42 1h1r s VAL 17 Cb 0.00 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.56 1h1r s VAL 17 CO 0.00 0.24 -0.09 -0.69 0.00 0.00 0.00 175.10 174.56 1h1r s VAL 18 N -0.33 3.46 0.24 2.92 1.01 0.06 -0.28 120.40 127.48 1h1r s VAL 18 Ca 0.04 -0.53 0.12 0.00 0.00 0.00 0.00 61.98 61.60 1h1r s VAL 18 Cb -0.05 -2.46 -0.05 0.00 0.00 0.00 0.00 36.38 33.83 1h1r s VAL 18 CO -0.00 0.54 -0.21 -0.31 0.00 0.00 0.00 175.10 175.11 1h1r s TYR 19 N 0.01 2.27 -0.09 5.22 1.51 0.45 0.38 117.35 127.09 1h1r s TYR 19 Ca -0.02 -0.35 -0.17 0.00 -1.01 0.00 0.00 57.07 55.52 1h1r s TYR 19 Cb -0.14 -1.04 -0.05 0.00 -0.11 0.00 0.00 41.96 40.63 1h1r s TYR 19 CO 0.03 0.62 0.46 0.21 -1.11 0.00 0.00 175.55 175.77 1h1r s LYS 20 N -3.19 4.27 0.19 -0.62 2.20 0.30 -0.45 119.74 122.43 1h1r s LYS 20 Ca 0.26 0.44 -0.01 0.00 -0.36 0.00 0.00 55.97 56.30 1h1r s LYS 20 Cb -0.06 -3.39 -0.04 0.00 -1.51 0.00 0.00 37.83 32.83 1h1r s LYS 20 CO 0.13 0.27 0.11 0.00 -0.36 0.00 0.00 175.35 175.49 1h1r s ALA 21 N 0.27 1.14 -0.05 3.13 0.00 0.28 -0.13 121.76 126.40 1h1r s ALA 21 Ca 0.25 -1.66 0.03 0.00 0.00 0.00 0.00 51.96 50.58 1h1r s ALA 21 Cb -0.15 1.25 0.01 0.00 0.00 0.00 0.00 23.12 24.22 1h1r s ALA 21 CO 0.11 -0.56 -0.13 0.50 0.00 0.00 0.00 175.76 175.68 1h1r s ARG 22 N -4.13 1.65 -0.19 0.00 3.52 -0.25 -0.20 118.95 119.36 1h1r s ARG 22 Ca 0.36 -0.46 -0.28 0.00 -0.13 0.00 0.00 55.73 55.22 1h1r s ARG 22 Cb 0.07 -1.39 -0.00 0.00 -1.56 0.00 0.00 34.95 32.07 1h1r s ARG 22 CO 0.10 0.10 0.95 1.21 -0.81 0.00 0.00 175.30 176.85 1h1r s ASN 23 N 0.41 7.05 0.32 -2.12 3.84 0.12 -0.91 114.94 123.66 1h1r s ASN 23 Ca -0.10 1.31 0.08 0.00 0.21 0.00 0.00 52.86 54.36 1h1r s ASN 23 Cb -0.14 -2.51 0.54 0.00 -0.55 0.00 0.00 41.25 38.60 1h1r s ASN 23 CO 0.03 -0.54 1.74 0.11 -2.79 0.00 0.00 177.10 175.66 1h1r h LYS 24 N 7.39 0.17 0.02 0.43 1.57 -0.71 -0.27 116.57 125.18 1h1r h LYS 24 Ca -0.24 -0.08 -0.31 0.00 -1.87 0.00 0.00 60.65 58.15 1h1r h LYS 24 Cb 1.10 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.36 1h1r h LYS 24 CO 0.90 0.54 -1.77 1.28 -0.57 0.00 0.00 179.45 179.83 1h1r n LEU 25 N -4.05 1.20 -0.01 2.94 4.77 -1.26 -4.39 117.00 116.20 1h1r n LEU 25 Ca -0.01 0.37 0.06 0.00 -0.03 0.00 0.00 56.01 56.40 1h1r n LEU 25 Cb 0.45 -0.07 -0.09 0.00 -2.33 0.00 0.00 43.42 41.38 1h1r n LEU 25 CO 0.41 0.48 -0.64 0.35 -1.33 0.00 0.00 177.39 176.66 1h1r n THR 26 N -3.12 0.00 0.00 -5.08 -2.24 -1.24 -5.01 114.28 97.59 1h1r n THR 26 Ca -0.20 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 1h1r n THR 26 Cb 1.05 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 69.52 1h1r n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h1r n GLY 27 N 1.82 2.03 3.71 3.38 0.00 -0.11 -5.02 105.19 111.00 1h1r n GLY 27 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1h1r n GLY 27 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1h1r s GLU 28 N -0.54 4.17 0.07 1.61 2.12 -1.25 -4.60 118.70 120.27 1h1r s GLU 28 Ca 0.00 2.48 -0.26 0.00 0.36 0.00 0.00 54.97 57.55 1h1r s GLU 28 Cb 0.00 -3.31 -0.06 0.00 0.26 0.00 0.00 34.13 31.02 1h1r s GLU 28 CO 0.00 -0.73 0.82 0.08 -0.54 0.00 0.00 175.26 174.89 1h1r s VAL 29 N 1.79 4.66 0.18 3.70 1.01 -1.26 0.12 120.40 130.59 1h1r s VAL 29 Ca 0.75 1.75 0.01 0.00 0.00 0.00 0.00 61.98 64.49 1h1r s VAL 29 Cb -0.45 -4.17 -0.05 0.00 0.00 0.00 0.00 36.38 31.71 1h1r s VAL 29 CO 0.33 0.36 0.04 0.68 0.00 0.00 0.00 175.10 176.50 1h1r s VAL 30 N -0.08 0.48 -0.14 2.92 -7.23 0.73 -3.73 120.40 113.35 1h1r s VAL 30 Ca 0.41 -1.97 -0.05 0.00 -1.81 0.00 0.00 61.98 58.56 1h1r s VAL 30 Cb -0.21 -2.21 -0.04 0.00 0.56 0.00 0.00 36.38 34.48 1h1r s VAL 30 CO 0.25 -0.36 0.04 0.00 -0.31 0.00 0.00 175.10 174.72 1h1r s ALA 31 N -3.80 3.38 -0.21 1.32 0.00 0.56 -0.56 121.76 122.46 1h1r s ALA 31 Ca 0.27 -0.76 -0.04 0.00 0.00 0.00 0.00 51.96 51.43 1h1r s ALA 31 Cb 0.07 -1.73 -0.02 0.00 0.00 0.00 0.00 23.12 21.44 1h1r s ALA 31 CO 0.06 0.39 -0.03 -0.51 0.00 0.00 0.00 175.76 175.67 1h1r s LEU 32 N -0.26 3.05 -0.33 0.00 1.43 0.41 -0.99 118.68 121.98 1h1r s LEU 32 Ca 0.07 -0.31 -0.11 0.00 -1.03 0.00 0.00 54.13 52.76 1h1r s LEU 32 Cb -0.12 -1.77 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 1h1r s LEU 32 CO 0.02 0.02 0.19 -0.75 0.23 0.00 0.00 176.35 176.06 1h1r s LYS 33 N 1.24 3.32 -0.13 1.70 2.20 -0.17 -0.41 119.74 127.49 1h1r s LYS 33 Ca 0.03 -0.74 -0.18 0.00 -0.36 0.00 0.00 55.97 54.72 1h1r s LYS 33 Cb -0.14 -3.68 -0.04 0.00 -1.51 0.00 0.00 37.83 32.46 1h1r s LYS 33 CO -0.00 -0.47 0.46 0.21 -0.36 0.00 0.00 175.35 175.20 1h1r s LYS 34 N 1.65 4.33 -0.23 4.03 2.20 0.62 -0.64 119.74 131.68 1h1r s LYS 34 Ca 0.05 0.42 0.01 0.00 -0.36 0.00 0.00 55.97 56.09 1h1r s LYS 34 Cb -0.17 -3.44 0.04 0.00 -1.51 0.00 0.00 37.83 32.74 1h1r s LYS 34 CO 0.08 0.14 -0.13 0.42 -0.36 0.00 0.00 175.35 175.51 1h1r s ILE 35 N 0.67 2.31 -0.08 5.43 1.01 0.32 -2.04 121.20 128.83 1h1r s ILE 35 Ca 0.25 -1.26 -0.30 0.00 0.00 0.00 0.00 60.65 59.35 1h1r s ILE 35 Cb -0.15 -2.19 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 1h1r s ILE 35 CO 0.10 0.21 1.15 -0.13 0.00 0.00 0.00 174.94 176.28 1h1r s ARG 36 N 1.22 4.36 0.00 2.79 0.52 -1.26 -1.02 118.95 125.55 1h1r s ARG 36 Ca -0.02 1.60 0.00 0.00 -0.52 0.00 0.00 55.73 56.79 1h1r s ARG 36 Cb -0.17 -3.57 0.00 0.00 0.52 0.00 0.00 34.95 31.74 1h1r s ARG 36 CO -0.08 -0.43 0.00 1.28 0.02 0.00 0.00 175.30 176.09 1h1r n LEU 37 N 5.25 0.00 0.00 2.53 4.77 -0.92 -4.96 117.00 123.67 1h1r n LEU 37 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 1h1r n LEU 37 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1h1r n LEU 37 CO 0.54 0.00 0.00 0.47 -1.33 0.00 0.00 177.39 177.07 1h1r n ASP 38 N 0.00 0.00 0.00 -1.43 8.00 -1.24 -4.95 116.55 116.92 1h1r n ASP 38 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1h1r n ASP 38 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1h1r n ASP 38 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1h1r n THR 39 N 0.00 0.00 -2.77 -3.53 -1.04 -1.26 -4.79 114.28 100.89 1h1r n THR 39 Ca 0.00 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 1h1r n THR 39 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1h1r n THR 39 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 1h1r n GLU 40 N -0.40 -0.31 0.00 -2.82 -0.00 -1.26 -4.81 120.64 111.04 1h1r n GLU 40 Ca 0.00 0.14 0.00 0.00 -0.00 0.00 0.00 57.16 57.30 1h1r n GLU 40 Cb 0.00 -0.43 0.00 0.00 -0.00 0.00 0.00 31.44 31.01 1h1r n GLU 40 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1h1r n THR 41 N -0.93 0.00 1.18 3.84 -1.04 -1.26 -5.03 114.28 111.04 1h1r n THR 41 Ca -0.06 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 62.07 1h1r n THR 41 Cb 0.14 0.00 0.27 0.00 -1.82 0.00 0.00 70.33 68.92 1h1r n THR 41 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1h1r n GLU 42 N 0.00 0.97 0.00 -2.82 -0.58 -1.26 -5.07 120.64 111.87 1h1r n GLU 42 Ca 0.00 -0.65 0.00 0.00 -0.42 0.00 0.00 57.16 56.09 1h1r n GLU 42 Cb 0.00 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.38 1h1r n GLU 42 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1h1r n GLY 43 N 1.36 -0.40 3.65 0.62 0.00 -1.26 -4.78 105.19 104.37 1h1r n GLY 43 Ca 0.11 -1.12 -0.42 0.00 0.00 0.00 0.00 46.02 44.59 1h1r n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h1r s VAL 44 N 0.00 3.65 0.34 1.61 1.01 -1.26 -4.90 120.40 120.85 1h1r s VAL 44 Ca 0.00 0.77 -0.28 0.00 0.00 0.00 0.00 61.98 62.47 1h1r s VAL 44 Cb 0.00 -3.55 -0.12 0.00 0.00 0.00 0.00 36.38 32.71 1h1r s VAL 44 CO 0.00 -0.13 1.21 -0.81 0.00 0.00 0.00 175.10 175.37 1h1r n PRO 45 N 7.27 1.89 0.21 2.72 -0.04 -1.26 -4.84 135.00 140.96 1h1r n PRO 45 Ca 0.18 0.67 0.09 0.00 -0.04 0.00 0.00 63.50 64.39 1h1r n PRO 45 Cb 0.44 -2.21 0.62 0.00 -0.04 0.00 0.00 33.50 32.31 1h1r n PRO 45 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1h1r h SER 46 N 2.32 0.04 -0.51 3.54 4.64 -1.95 -0.97 113.55 120.67 1h1r h SER 46 Ca -0.45 -0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.88 1h1r h SER 46 Cb 1.30 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 63.35 1h1r h SER 46 CO 0.61 0.03 0.34 0.71 -0.87 0.00 0.00 176.83 177.66 1h1r h THR 47 N 0.05 1.12 0.19 2.95 1.35 -1.90 -1.06 112.91 115.61 1h1r h THR 47 Ca 0.04 -0.23 -0.31 0.00 -0.55 0.00 0.00 66.41 65.36 1h1r h THR 47 Cb 0.08 0.38 0.02 0.00 -1.73 0.00 0.00 68.15 66.91 1h1r h THR 47 CO -0.00 0.12 -1.38 0.00 -0.25 0.00 0.00 175.52 174.00 1h1r h ALA 48 N 1.68 -0.01 -0.38 6.62 0.00 -1.54 -0.41 119.26 125.23 1h1r h ALA 48 Ca 0.19 -0.90 0.03 0.00 0.00 0.00 0.00 54.91 54.24 1h1r h ALA 48 Cb -0.05 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1h1r h ALA 48 CO -0.04 0.86 0.18 0.82 0.00 0.00 0.00 179.25 181.07 1h1r h ILE 49 N 0.11 0.96 -0.09 0.00 2.04 -1.27 -0.46 117.51 118.79 1h1r h ILE 49 Ca -0.20 -0.13 -0.09 0.00 1.00 0.00 0.00 64.86 65.44 1h1r h ILE 49 Cb 2.07 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 38.71 1h1r h ILE 49 CO 0.23 0.07 -0.29 0.03 0.00 0.00 0.00 178.15 178.19 1h1r h ARG 50 N 0.37 0.36 -0.17 2.37 3.08 -1.19 -2.73 114.38 116.47 1h1r h ARG 50 Ca 0.16 -0.27 0.03 0.00 0.07 0.00 0.00 59.98 59.98 1h1r h ARG 50 Cb 0.09 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 1h1r h ARG 50 CO -0.13 0.89 -0.02 1.49 -1.07 0.00 0.00 179.97 181.13 1h1r h GLU 51 N -0.10 0.02 0.01 0.04 4.81 -0.82 -0.96 114.58 117.58 1h1r h GLU 51 Ca -0.01 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1h1r h GLU 51 Cb 0.92 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.29 1h1r h GLU 51 CO 0.06 0.01 -0.00 0.82 -0.73 0.00 0.00 179.01 179.17 1h1r h ILE 52 N 0.02 1.19 -0.37 2.32 2.04 -1.18 0.19 117.51 121.73 1h1r h ILE 52 Ca 0.08 -0.61 -0.05 0.00 1.00 0.00 0.00 64.86 65.28 1h1r h ILE 52 Cb 0.11 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1h1r h ILE 52 CO -0.16 0.16 0.01 0.77 0.00 0.00 0.00 178.15 178.93 1h1r h SER 53 N -0.28 0.53 0.17 1.72 4.64 -1.31 -0.69 113.55 118.34 1h1r h SER 53 Ca -0.00 -0.10 -0.29 0.00 -0.47 0.00 0.00 61.79 60.93 1h1r h SER 53 Cb 0.27 -0.14 0.03 0.00 -0.31 0.00 0.00 62.40 62.25 1h1r h SER 53 CO 0.00 0.60 -1.23 -0.07 -0.87 0.00 0.00 176.83 175.26 1h1r h LEU 54 N 0.55 0.78 -1.43 5.97 3.38 -1.14 -3.23 115.31 120.19 1h1r h LEU 54 Ca 0.12 -0.88 -0.04 0.00 0.09 0.00 0.00 57.88 57.16 1h1r h LEU 54 Cb 0.34 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1h1r h LEU 54 CO 0.01 1.59 -0.20 -0.07 0.09 0.00 0.00 178.44 179.86 1h1r h LEU 55 N 0.08 0.00 -1.23 1.67 4.07 -0.74 -0.41 115.31 118.75 1h1r h LEU 55 Ca -0.20 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.72 1h1r h LEU 55 Cb 1.94 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.67 1h1r h LEU 55 CO 0.23 0.20 -0.20 0.11 -1.08 0.00 0.00 178.44 177.71 1h1r h LYS 56 N 0.00 0.00 0.00 1.13 1.57 -1.17 -2.69 116.57 115.40 1h1r h LYS 56 Ca -0.00 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.53 1h1r h LYS 56 Cb 0.59 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.86 1h1r h LYS 56 CO 0.03 0.20 -1.36 0.93 -0.57 0.00 0.00 179.45 178.67 1h1r h GLU 57 N 0.00 0.00 -4.31 3.15 5.08 -1.11 -3.42 114.58 113.98 1h1r h GLU 57 Ca -0.00 -0.01 -0.73 0.00 -1.00 0.00 0.00 59.36 57.62 1h1r h GLU 57 Cb 0.68 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.81 1h1r h GLU 57 CO 0.03 0.75 2.08 1.28 -1.00 0.00 0.00 179.01 182.15 1h1r n LEU 58 N -3.20 6.04 -4.50 1.33 4.77 -0.84 -4.95 117.00 115.65 1h1r n LEU 58 Ca -0.09 -4.39 -0.43 0.00 -0.03 0.00 0.00 56.01 51.08 1h1r n LEU 58 Cb 1.00 -1.59 -0.06 0.00 -2.33 0.00 0.00 43.42 40.44 1h1r n LEU 58 CO 0.46 0.96 0.50 0.21 -1.33 0.00 0.00 177.39 178.18 1h1r s ASN 59 N 2.37 6.31 -0.19 -1.43 3.04 -1.26 -4.90 114.94 118.87 1h1r s ASN 59 Ca 0.44 -0.49 -0.23 0.00 0.04 0.00 0.00 52.86 52.62 1h1r s ASN 59 Cb 0.06 -2.35 0.06 0.00 -1.54 0.00 0.00 41.25 37.48 1h1r s ASN 59 CO -0.00 -0.96 0.62 -2.28 -3.04 0.00 0.00 177.10 171.43 1h1r s HIS 60 N 3.14 -0.65 0.55 0.43 2.46 -1.26 -5.05 115.29 114.91 1h1r s HIS 60 Ca 0.23 1.49 0.31 0.00 0.47 0.00 0.00 55.06 57.57 1h1r s HIS 60 Cb -0.15 0.26 1.48 0.00 -0.13 0.00 0.00 32.58 34.04 1h1r s HIS 60 CO 0.17 -0.39 1.88 -1.35 -2.47 0.00 0.00 174.74 172.59 1h1r h PRO 61 N 4.68 0.00 -0.38 2.88 0.10 -1.99 -2.58 132.00 134.71 1h1r h PRO 61 Ca -0.28 0.00 -0.09 0.00 0.10 0.00 0.00 66.00 65.72 1h1r h PRO 61 Cb 1.16 0.00 -0.06 0.00 0.10 0.00 0.00 31.00 32.21 1h1r h PRO 61 CO 0.18 0.00 0.04 0.09 0.10 0.00 0.00 178.00 178.40 1h1r n ASN 62 N -4.18 3.67 -3.91 -2.05 4.13 -1.26 -4.87 115.26 106.79 1h1r n ASN 62 Ca 0.18 -3.27 -0.24 0.00 1.68 0.00 0.00 54.58 52.92 1h1r n ASN 62 Cb 0.94 -0.61 -0.17 0.00 -1.54 0.00 0.00 39.78 38.41 1h1r n ASN 62 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1h1r s ILE 63 N -2.98 0.85 0.16 2.41 1.01 -0.97 -0.55 121.20 121.13 1h1r s ILE 63 Ca 0.45 -0.24 -0.34 0.00 0.00 0.00 0.00 60.65 60.53 1h1r s ILE 63 Cb 0.38 -0.87 -0.15 0.00 0.01 0.00 0.00 42.46 41.83 1h1r s ILE 63 CO 0.07 0.32 1.43 1.33 0.00 0.00 0.00 174.94 178.10 1h1r n VAL 64 N 4.52 0.30 -3.05 2.92 0.24 -0.73 -4.55 118.33 117.98 1h1r n VAL 64 Ca -0.17 -0.07 -0.41 0.00 -2.04 0.00 0.00 64.34 61.65 1h1r n VAL 64 Cb 0.51 -1.26 -0.05 0.00 -1.47 0.00 0.00 33.84 31.56 1h1r n VAL 64 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1h1r s LYS 65 N 0.38 4.19 -0.44 7.34 2.20 -1.26 -4.98 119.74 127.16 1h1r s LYS 65 Ca 0.77 0.70 -0.27 0.00 -0.36 0.00 0.00 55.97 56.82 1h1r s LYS 65 Cb -0.76 -3.61 0.03 0.00 -1.51 0.00 0.00 37.83 31.97 1h1r s LYS 65 CO 0.44 -0.35 1.03 -1.17 -0.36 0.00 0.00 175.35 174.94 1h1r s LEU 66 N 2.26 3.84 0.03 5.43 2.96 -1.26 -2.33 118.68 129.61 1h1r s LEU 66 Ca 0.30 0.42 -0.04 0.00 -0.22 0.00 0.00 54.13 54.59 1h1r s LEU 66 Cb -0.16 -3.39 -0.28 0.00 0.50 0.00 0.00 46.19 42.86 1h1r s LEU 66 CO 0.10 -1.09 0.97 -0.07 -1.32 0.00 0.00 176.35 174.93 1h1r h LEU 67 N 10.73 0.43 -7.62 -0.68 3.38 -0.50 -3.48 115.31 117.57 1h1r h LEU 67 Ca -0.23 -0.54 0.08 0.00 0.09 0.00 0.00 57.88 57.28 1h1r h LEU 67 Cb 1.07 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 41.60 1h1r h LEU 67 CO 1.06 1.44 0.30 -0.62 0.09 0.00 0.00 178.44 180.71 1h1r s ASP 68 N -7.08 -0.32 -0.06 -0.43 -1.08 -1.06 -5.00 116.67 101.64 1h1r s ASP 68 Ca -0.07 -0.38 -0.01 0.00 -0.52 0.00 0.00 52.55 51.57 1h1r s ASP 68 Cb 0.07 0.62 0.03 0.00 -1.46 0.00 0.00 42.92 42.18 1h1r s ASP 68 CO 0.87 -1.11 0.01 -0.69 0.52 0.00 0.00 175.17 174.77 1h1r s VAL 69 N -3.68 0.29 -0.32 1.11 1.01 -1.26 -0.97 120.40 116.58 1h1r s VAL 69 Ca 0.08 0.16 -0.03 0.00 0.00 0.00 0.00 61.98 62.20 1h1r s VAL 69 Cb -0.03 -0.46 0.06 0.00 0.00 0.00 0.00 36.38 35.94 1h1r s VAL 69 CO 0.00 0.24 0.04 -0.63 0.00 0.00 0.00 175.10 174.75 1h1r s ILE 70 N 1.90 3.16 -0.36 2.22 1.01 0.04 -4.98 121.20 124.19 1h1r s ILE 70 Ca 0.03 -1.42 0.01 0.00 0.00 0.00 0.00 60.65 59.27 1h1r s ILE 70 Cb -0.12 -2.86 0.10 0.00 0.01 0.00 0.00 42.46 39.59 1h1r s ILE 70 CO -0.04 -0.19 0.11 -2.28 0.00 0.00 0.00 174.94 172.53 1h1r s HIS 71 N 1.26 3.64 0.41 3.97 2.46 -1.26 -0.24 115.29 125.54 1h1r s HIS 71 Ca -0.03 -2.66 0.08 0.00 0.47 0.00 0.00 55.06 52.92 1h1r s HIS 71 Cb -0.20 -2.96 -0.02 0.00 -0.13 0.00 0.00 32.58 29.27 1h1r s HIS 71 CO -0.01 -0.95 0.38 0.99 -2.47 0.00 0.00 174.74 172.69 1h1r s THR 72 N 1.03 2.76 0.34 0.89 2.01 0.05 -5.03 115.64 117.70 1h1r s THR 72 Ca 0.08 -1.32 0.10 0.00 0.31 0.00 0.00 61.69 60.86 1h1r s THR 72 Cb -0.21 -3.02 0.08 0.00 0.01 0.00 0.00 72.50 69.36 1h1r s THR 72 CO -0.06 -0.02 1.78 -0.08 -0.69 0.00 0.00 174.62 175.56 1h1r h GLU 73 N 1.02 0.13 0.00 4.92 4.81 -1.98 -3.34 114.58 120.14 1h1r h GLU 73 Ca -0.42 -0.05 -0.18 0.00 -0.13 0.00 0.00 59.36 58.58 1h1r h GLU 73 Cb 1.27 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.61 1h1r h GLU 73 CO 0.57 0.48 -1.15 0.27 -0.73 0.00 0.00 179.01 178.44 1h1r n ASN 74 N -4.09 1.86 -4.39 1.04 2.04 -1.26 -4.70 115.26 105.76 1h1r n ASN 74 Ca -0.02 0.47 -0.20 0.00 -0.44 0.00 0.00 54.58 54.40 1h1r n ASN 74 Cb 0.42 -0.92 -0.10 0.00 -2.53 0.00 0.00 39.78 36.65 1h1r n ASN 74 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1h1r s LYS 75 N -2.36 1.47 -0.05 -3.83 1.02 -1.25 -2.17 119.74 112.56 1h1r s LYS 75 Ca -0.26 -1.74 0.03 0.00 0.02 0.00 0.00 55.97 54.02 1h1r s LYS 75 Cb 0.06 -0.96 0.01 0.00 -0.52 0.00 0.00 37.83 36.41 1h1r s LYS 75 CO 0.47 -0.01 -0.12 -1.17 -0.92 0.00 0.00 175.35 173.59 1h1r s LEU 76 N -3.39 1.71 -0.15 3.17 2.96 -0.19 -0.77 118.68 122.02 1h1r s LEU 76 Ca 0.29 -0.28 0.02 0.00 -0.22 0.00 0.00 54.13 53.93 1h1r s LEU 76 Cb 0.04 -0.79 0.01 0.00 0.50 0.00 0.00 46.19 45.95 1h1r s LEU 76 CO 0.11 0.06 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.68 1h1r s TYR 77 N 0.48 2.62 -0.24 5.38 2.02 0.67 0.12 117.35 128.40 1h1r s TYR 77 Ca -0.11 -1.39 -0.14 0.00 -0.37 0.00 0.00 57.07 55.06 1h1r s TYR 77 Cb -0.14 -1.80 -0.04 0.00 -0.40 0.00 0.00 41.96 39.58 1h1r s TYR 77 CO 0.03 -0.66 0.32 -0.51 -1.57 0.00 0.00 175.55 173.16 1h1r s LEU 78 N 0.99 4.10 -0.27 -1.29 1.43 0.19 -0.78 118.68 123.05 1h1r s LEU 78 Ca -0.03 0.32 -0.13 0.00 -1.03 0.00 0.00 54.13 53.25 1h1r s LEU 78 Cb -0.15 -2.37 -0.04 0.00 0.03 0.00 0.00 46.19 43.66 1h1r s LEU 78 CO -0.05 -0.08 0.28 -0.69 0.23 0.00 0.00 176.35 176.05 1h1r s VAL 79 N 1.52 5.24 0.12 -1.59 1.01 -0.15 -1.00 120.40 125.56 1h1r s VAL 79 Ca 0.14 0.39 0.08 0.00 0.00 0.00 0.00 61.98 62.59 1h1r s VAL 79 Cb -0.15 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1h1r s VAL 79 CO 0.08 0.21 -0.19 -0.36 0.00 0.00 0.00 175.10 174.84 1h1r s PHE 80 N 1.84 1.72 0.40 5.22 0.40 -0.17 0.30 117.98 127.70 1h1r s PHE 80 Ca 0.11 -0.44 -0.24 0.00 -0.60 0.00 0.00 56.93 55.76 1h1r s PHE 80 Cb -0.16 -0.92 -0.12 0.00 0.51 0.00 0.00 43.02 42.34 1h1r s PHE 80 CO 0.10 0.22 0.87 -0.85 0.70 0.00 0.00 175.22 176.26 1h1r n GLU 81 N 0.85 1.09 -3.19 0.44 0.28 -0.99 -0.32 120.64 118.80 1h1r n GLU 81 Ca -0.18 0.39 -0.39 0.00 -0.16 0.00 0.00 57.16 56.82 1h1r n GLU 81 Cb 0.55 -1.85 -0.06 0.00 1.43 0.00 0.00 31.44 31.51 1h1r n GLU 81 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 1h1r s PHE 82 N -1.30 3.46 0.07 -1.84 5.36 -1.24 -4.24 117.98 118.25 1h1r s PHE 82 Ca 0.63 0.96 0.04 0.00 -0.96 0.00 0.00 56.93 57.59 1h1r s PHE 82 Cb -0.59 -2.70 -0.04 0.00 -0.34 0.00 0.00 43.02 39.35 1h1r s PHE 82 CO 0.57 0.01 0.02 -0.51 -1.46 0.00 0.00 175.22 173.85 1h1r s LEU 83 N 1.21 3.58 0.17 6.12 1.02 -1.26 -4.98 118.68 124.53 1h1r s LEU 83 Ca 0.29 -0.09 0.09 0.00 0.02 0.00 0.00 54.13 54.44 1h1r s LEU 83 Cb -0.16 -2.25 -0.11 0.00 0.02 0.00 0.00 46.19 43.69 1h1r s LEU 83 CO 0.12 0.19 1.34 0.45 0.02 0.00 0.00 176.35 178.47 1h1r h HIS 84 N 3.56 0.00 -2.55 0.29 3.86 -1.66 -3.48 115.15 115.17 1h1r h HIS 84 Ca -0.48 0.00 0.14 0.00 -1.16 0.00 0.00 60.37 58.87 1h1r h HIS 84 Cb 1.17 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 29.57 1h1r h HIS 84 CO 0.61 0.85 0.42 -1.14 0.86 0.00 0.00 177.93 179.53 1h1r s GLN 85 N -2.82 1.41 0.20 2.45 0.74 -1.03 -5.01 119.66 115.59 1h1r s GLN 85 Ca 0.02 -0.79 0.05 0.00 0.05 0.00 0.00 55.36 54.68 1h1r s GLN 85 Cb 0.10 0.47 -0.03 0.00 1.10 0.00 0.00 33.01 34.64 1h1r s GLN 85 CO 0.80 -0.65 0.24 0.16 -0.55 0.00 0.00 175.29 175.29 1h1r s ASP 86 N -2.97 5.93 0.22 6.67 1.47 -1.26 -0.23 116.67 126.49 1h1r s ASP 86 Ca 0.13 -0.03 -0.07 0.00 1.18 0.00 0.00 52.55 53.76 1h1r s ASP 86 Cb -0.03 -1.66 0.17 0.00 -0.34 0.00 0.00 42.92 41.07 1h1r s ASP 86 CO 0.04 0.01 1.74 0.25 0.68 0.00 0.00 175.17 177.89 1h1r h LEU 87 N 1.85 1.03 -0.10 2.11 5.85 -0.99 -1.87 115.31 123.20 1h1r h LEU 87 Ca -0.49 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.04 1h1r h LEU 87 Cb 1.21 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 1h1r h LEU 87 CO 0.64 0.99 -0.06 0.50 -0.34 0.00 0.00 178.44 180.16 1h1r h LYS 88 N 1.04 -0.06 -0.53 1.25 3.64 -1.83 0.16 116.57 120.24 1h1r h LYS 88 Ca 0.22 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 1h1r h LYS 88 Cb 0.35 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 1h1r h LYS 88 CO -0.00 -0.04 0.28 0.87 -2.27 0.00 0.00 179.45 178.29 1h1r h LYS 89 N -0.06 0.72 -0.44 1.90 1.57 -1.85 -0.72 116.57 117.69 1h1r h LYS 89 Ca 0.06 -0.07 -0.15 0.00 -1.87 0.00 0.00 60.65 58.62 1h1r h LYS 89 Cb 0.15 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1h1r h LYS 89 CO -0.14 0.54 -0.29 0.35 -0.57 0.00 0.00 179.45 179.34 1h1r h PHE 90 N 0.73 1.15 -0.45 -1.35 3.57 -0.93 -1.08 116.94 118.57 1h1r h PHE 90 Ca 0.19 -0.31 -0.10 0.00 3.53 0.00 0.00 57.97 61.28 1h1r h PHE 90 Cb 0.03 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.50 1h1r h PHE 90 CO 0.00 1.14 -0.13 0.52 -2.23 0.00 0.00 178.31 177.62 1h1r h MET 91 N 0.82 0.89 0.43 1.11 2.86 -0.64 -1.19 114.93 119.20 1h1r h MET 91 Ca 0.09 -0.35 -0.01 0.00 -2.06 0.00 0.00 59.70 57.37 1h1r h MET 91 Cb 0.88 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.47 1h1r h MET 91 CO 0.08 0.99 -0.45 -0.44 1.06 0.00 0.00 176.91 178.16 1h1r h ASP 92 N 0.72 -1.22 0.00 1.22 3.32 -0.97 -0.31 116.42 119.18 1h1r h ASP 92 Ca 0.11 0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1h1r h ASP 92 Cb 0.68 0.41 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1h1r h ASP 92 CO 0.05 -0.60 0.17 0.00 -1.72 0.00 0.00 179.24 177.14 1h1r h ALA 93 N -0.61 1.17 -0.02 3.45 0.00 -1.07 0.28 119.26 122.46 1h1r h ALA 93 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1h1r h ALA 93 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1h1r h ALA 93 CO -0.07 -0.17 -0.28 0.43 0.00 0.00 0.00 179.25 179.16 1h1r n SER 94 N -2.89 2.37 0.00 0.00 7.64 -0.41 -4.73 113.62 115.60 1h1r n SER 94 Ca -0.02 -1.69 0.08 0.00 1.01 0.00 0.00 58.87 58.25 1h1r n SER 94 Cb 0.23 0.28 0.44 0.00 -1.01 0.00 0.00 64.21 64.15 1h1r n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1h1r n ALA 95 N 0.51 2.03 -0.06 -0.43 0.00 0.09 0.34 120.51 122.99 1h1r n ALA 95 Ca 0.11 -0.09 -0.19 0.00 0.00 0.00 0.00 53.44 53.26 1h1r n ALA 95 Cb 0.51 -1.24 -0.13 0.00 0.00 0.00 0.00 19.45 18.58 1h1r n ALA 95 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1h1r n LEU 96 N -1.04 2.73 -0.01 0.00 4.77 -1.26 -4.60 117.00 117.60 1h1r n LEU 96 Ca 0.11 0.04 -0.18 0.00 -0.03 0.00 0.00 56.01 55.95 1h1r n LEU 96 Cb 0.06 -0.97 -0.14 0.00 -2.33 0.00 0.00 43.42 40.04 1h1r n LEU 96 CO 0.09 0.88 -0.76 0.41 -1.33 0.00 0.00 177.39 176.68 1h1r n THR 97 N -3.35 1.73 0.00 -5.08 -1.04 -0.81 -5.11 114.28 100.62 1h1r n THR 97 Ca -0.39 -0.69 0.00 0.00 -2.04 0.00 0.00 64.05 60.93 1h1r n THR 97 Cb 1.02 -1.54 0.00 0.00 -1.82 0.00 0.00 70.33 68.00 1h1r n THR 97 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1h1r n GLY 98 N 1.89 1.21 3.66 3.41 0.00 1.05 -4.90 105.19 111.51 1h1r n GLY 98 Ca -0.29 -1.74 -0.40 0.00 0.00 0.00 0.00 46.02 43.59 1h1r n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h1r s ILE 99 N -2.75 5.05 0.28 -0.61 1.01 -1.26 -4.95 121.20 117.96 1h1r s ILE 99 Ca 0.00 1.11 -0.30 0.00 0.00 0.00 0.00 60.65 61.46 1h1r s ILE 99 Cb 0.00 -3.91 -0.13 0.00 0.01 0.00 0.00 42.46 38.43 1h1r s ILE 99 CO 0.00 0.13 1.27 -0.81 0.00 0.00 0.00 174.94 175.53 1h1r n PRO 100 N 4.96 1.86 -0.24 2.79 -0.04 -1.26 -4.78 135.00 138.29 1h1r n PRO 100 Ca -0.02 0.66 0.02 0.00 -0.04 0.00 0.00 63.50 64.11 1h1r n PRO 100 Cb 0.50 -2.22 0.10 0.00 -0.04 0.00 0.00 33.50 31.84 1h1r n PRO 100 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1h1r h LEU 101 N 3.18 -0.53 -1.56 1.53 6.46 -1.99 -1.44 115.31 120.96 1h1r h LEU 101 Ca -0.44 0.20 0.03 0.00 -0.12 0.00 0.00 57.88 57.55 1h1r h LEU 101 Cb 1.30 0.39 -0.03 0.00 -0.73 0.00 0.00 40.66 41.59 1h1r h LEU 101 CO 0.68 -0.21 0.34 -0.65 -0.62 0.00 0.00 178.44 177.99 1h1r h PRO 102 N 0.04 0.56 -0.21 5.25 0.11 -1.99 -0.55 132.00 135.20 1h1r h PRO 102 Ca 0.35 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 66.23 1h1r h PRO 102 Cb 0.57 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.55 1h1r h PRO 102 CO -0.68 0.37 -0.67 1.25 -0.21 0.00 0.00 178.00 178.06 1h1r h LEU 103 N 0.57 0.91 0.21 2.35 5.85 -1.64 -1.66 115.31 121.90 1h1r h LEU 103 Ca 0.21 -0.54 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 1h1r h LEU 103 Cb 0.12 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.88 1h1r h LEU 103 CO -0.05 1.33 -0.13 0.40 -0.34 0.00 0.00 178.44 179.65 1h1r h ILE 104 N 0.57 0.72 -0.46 4.05 2.04 -0.95 0.25 117.51 123.74 1h1r h ILE 104 Ca -0.02 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 1h1r h ILE 104 Cb 1.28 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 1h1r h ILE 104 CO 0.14 0.00 0.16 0.50 0.00 0.00 0.00 178.15 178.95 1h1r h LYS 105 N -0.33 0.70 -0.23 2.37 3.64 -1.12 -0.38 116.57 121.22 1h1r h LYS 105 Ca -0.02 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1h1r h LYS 105 Cb 0.28 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 1h1r h LYS 105 CO 0.02 0.66 0.15 1.03 -2.27 0.00 0.00 179.45 179.04 1h1r h SER 106 N 0.60 0.26 -0.22 4.20 0.87 -1.23 -0.63 113.55 117.41 1h1r h SER 106 Ca 0.15 -0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.73 1h1r h SER 106 Cb 0.24 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.11 1h1r h SER 106 CO -0.01 0.19 0.06 1.88 -0.53 0.00 0.00 176.83 178.43 1h1r h TYR 107 N 0.31 0.11 -0.69 2.24 0.05 -0.80 -1.48 116.97 116.72 1h1r h TYR 107 Ca 0.08 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.86 1h1r h TYR 107 Cb -0.03 -0.02 -0.03 0.00 1.01 0.00 0.00 36.73 37.65 1h1r h TYR 107 CO -0.06 0.05 0.35 1.25 -1.05 0.00 0.00 178.16 178.69 1h1r h LEU 108 N 0.16 0.87 0.04 3.88 5.85 -0.86 0.22 115.31 125.47 1h1r h LEU 108 Ca 0.10 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1h1r h LEU 108 Cb 0.08 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.89 1h1r h LEU 108 CO -0.11 0.73 -0.02 0.15 -0.34 0.00 0.00 178.44 178.84 1h1r h PHE 109 N 0.97 -0.06 -0.45 1.25 3.57 -0.96 0.24 116.94 121.49 1h1r h PHE 109 Ca 0.24 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.79 1h1r h PHE 109 Cb 0.08 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 38.79 1h1r h PHE 109 CO 0.01 0.07 0.17 1.96 -2.23 0.00 0.00 178.31 178.29 1h1r h GLN 110 N -0.17 0.35 -0.62 1.11 4.20 -1.20 -1.55 115.11 117.23 1h1r h GLN 110 Ca -0.01 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 1h1r h GLN 110 Cb 0.15 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 1h1r h GLN 110 CO 0.01 0.23 0.35 -0.07 -0.67 0.00 0.00 178.83 178.68 1h1r h LEU 111 N 0.36 0.76 -1.21 1.46 3.38 -0.57 -1.79 115.31 117.70 1h1r h LEU 111 Ca 0.21 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1h1r h LEU 111 Cb 0.19 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1h1r h LEU 111 CO -0.20 0.63 0.20 -0.07 0.09 0.00 0.00 178.44 179.09 1h1r h LEU 112 N 0.84 0.69 -0.33 1.67 3.38 -0.27 -0.72 115.31 120.56 1h1r h LEU 112 Ca 0.22 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1h1r h LEU 112 Cb 0.03 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1h1r h LEU 112 CO -0.04 0.63 0.08 1.56 0.09 0.00 0.00 178.44 180.76 1h1r h GLN 113 N 0.75 0.54 -0.28 1.13 4.20 -0.98 0.00 115.11 120.46 1h1r h GLN 113 Ca 0.18 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 1h1r h GLN 113 Cb 0.16 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 1h1r h GLN 113 CO -0.02 0.60 0.15 0.78 -0.67 0.00 0.00 178.83 179.67 1h1r h GLY 114 N 0.39 0.41 0.93 3.46 0.00 -1.06 -2.43 103.07 104.77 1h1r h GLY 114 Ca 0.10 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.22 1h1r h GLY 114 CO 0.00 0.18 0.13 -2.00 0.00 0.00 0.00 176.54 174.85 1h1r h LEU 115 N 0.33 0.50 -1.37 3.11 5.85 -1.06 -1.77 115.31 120.91 1h1r h LEU 115 Ca 0.10 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.67 1h1r h LEU 115 Cb 0.06 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 1h1r h LEU 115 CO -0.02 0.55 0.46 0.00 -0.34 0.00 0.00 178.44 179.09 1h1r h ALA 116 N 0.97 1.63 -0.39 1.25 0.00 -0.91 -0.84 119.26 120.96 1h1r h ALA 116 Ca 0.12 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1h1r h ALA 116 Cb 0.22 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1h1r h ALA 116 CO -0.01 0.30 -0.00 0.35 0.00 0.00 0.00 179.25 179.89 1h1r h PHE 117 N 0.81 0.75 0.04 0.00 3.57 -1.30 0.12 116.94 120.94 1h1r h PHE 117 Ca 0.28 -0.13 0.02 0.00 3.53 0.00 0.00 57.97 61.67 1h1r h PHE 117 Cb 0.09 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.61 1h1r h PHE 117 CO -0.00 0.78 -0.17 0.00 -2.23 0.00 0.00 178.31 176.69 1h1r h HIS 119 N -0.30 0.77 0.00 0.00 3.86 -1.09 0.24 115.15 118.63 1h1r h HIS 119 Ca 0.04 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 1h1r h HIS 119 Cb 0.34 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.60 1h1r h HIS 119 CO -0.20 0.72 0.00 0.43 0.86 0.00 0.00 177.93 179.74 1h1r n SER 120 N -4.23 0.17 -1.25 2.45 7.64 0.39 -1.84 113.62 116.96 1h1r n SER 120 Ca 0.02 0.54 -0.02 0.00 1.01 0.00 0.00 58.87 60.42 1h1r n SER 120 Cb 0.29 -0.57 0.23 0.00 -1.01 0.00 0.00 64.21 63.15 1h1r n SER 120 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1h1r n HIS 121 N -1.68 1.36 -3.95 1.43 8.25 -0.66 -4.97 115.22 115.00 1h1r n HIS 121 Ca 0.04 -1.33 -0.30 0.00 -0.26 0.00 0.00 57.72 55.87 1h1r n HIS 121 Cb 0.22 -0.49 0.01 0.00 1.12 0.00 0.00 29.99 30.85 1h1r n HIS 121 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1h1r n ARG 122 N -0.82 -4.85 -5.08 -0.41 -4.01 -0.76 -4.95 116.66 95.78 1h1r n ARG 122 Ca 0.32 0.54 -0.31 0.00 -1.04 0.00 0.00 57.85 57.37 1h1r n ARG 122 Cb 1.08 -5.30 -0.17 0.00 -3.04 0.00 0.00 32.46 25.03 1h1r n ARG 122 CO 0.00 0.00 0.00 0.08 -3.04 0.00 0.00 177.63 174.67 1h1r s VAL 123 N -3.40 1.89 -0.12 8.89 1.01 -0.01 -0.74 120.40 127.91 1h1r s VAL 123 Ca 0.54 -0.92 -0.14 0.00 0.00 0.00 0.00 61.98 61.46 1h1r s VAL 123 Cb -0.27 -1.64 -0.05 0.00 0.00 0.00 0.00 36.38 34.41 1h1r s VAL 123 CO 0.85 0.52 0.33 -0.76 0.00 0.00 0.00 175.10 176.04 1h1r s LEU 124 N 0.42 4.31 -0.14 3.92 1.43 -0.22 -3.49 118.68 124.91 1h1r s LEU 124 Ca -0.18 0.64 -0.22 0.00 -1.03 0.00 0.00 54.13 53.35 1h1r s LEU 124 Cb -0.17 -2.44 -0.19 0.00 0.03 0.00 0.00 46.19 43.42 1h1r s LEU 124 CO 0.08 0.16 0.52 -0.74 0.23 0.00 0.00 176.35 176.59 1h1r h HIS 125 N 6.13 0.00 0.00 0.29 -0.00 -1.91 -1.63 115.15 118.03 1h1r h HIS 125 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.93 1h1r h HIS 125 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.59 1h1r h HIS 125 CO 0.64 0.82 0.00 0.54 -0.00 0.00 0.00 177.93 179.93 1h1r n ARG 126 N -4.62 -0.55 -2.50 5.26 1.74 -1.26 -3.04 116.66 111.69 1h1r n ARG 126 Ca -0.11 0.14 -0.01 0.00 -0.77 0.00 0.00 57.85 57.10 1h1r n ARG 126 Cb 0.40 -3.56 0.07 0.00 -1.02 0.00 0.00 32.46 28.35 1h1r n ARG 126 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1h1r n ASP 127 N -0.27 -0.13 -4.70 0.55 2.03 -1.26 -2.02 116.55 110.74 1h1r n ASP 127 Ca 0.00 -2.11 -0.42 0.00 0.52 0.00 0.00 54.79 52.78 1h1r n ASP 127 Cb 0.14 0.15 -0.03 0.00 -0.72 0.00 0.00 41.12 40.66 1h1r n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1h1r s LEU 128 N -3.36 4.35 0.11 -2.67 1.43 -1.26 -4.81 118.68 112.47 1h1r s LEU 128 Ca 0.17 2.23 -0.25 0.00 -1.03 0.00 0.00 54.13 55.24 1h1r s LEU 128 Cb 0.36 -3.57 0.08 0.00 0.03 0.00 0.00 46.19 43.08 1h1r s LEU 128 CO -0.09 -0.69 0.75 -1.59 0.23 0.00 0.00 176.35 174.96 1h1r s LYS 129 N 1.78 1.14 0.48 1.70 -2.85 -1.26 -4.84 119.74 115.90 1h1r s LYS 129 Ca 0.65 -0.47 0.15 0.00 -1.00 0.00 0.00 55.97 55.30 1h1r s LYS 129 Cb -0.34 0.50 1.15 0.00 -2.06 0.00 0.00 37.83 37.07 1h1r s LYS 129 CO 0.29 -0.50 2.08 -1.35 0.10 0.00 0.00 175.35 175.96 1h1r h PRO 130 N 2.00 0.20 0.00 1.78 0.11 -1.93 -0.89 132.00 133.26 1h1r h PRO 130 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1h1r h PRO 130 Cb 1.27 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1h1r h PRO 130 CO 0.33 0.13 0.00 0.00 -0.21 0.00 0.00 178.00 178.25 1h1r n GLN 131 N -4.49 0.21 -0.31 1.05 0.00 -1.26 -2.40 117.38 110.18 1h1r n GLN 131 Ca 0.02 0.33 0.10 0.00 0.00 0.00 0.00 57.00 57.46 1h1r n GLN 131 Cb 0.20 -1.83 0.27 0.00 0.00 0.00 0.00 30.24 28.88 1h1r n GLN 131 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1h1r n ASN 132 N -2.22 3.68 -4.22 2.61 3.02 -0.35 -4.85 115.26 112.93 1h1r n ASN 132 Ca 0.04 -1.99 -0.36 0.00 -0.03 0.00 0.00 54.58 52.24 1h1r n ASN 132 Cb 0.31 -0.41 -0.13 0.00 -0.61 0.00 0.00 39.78 38.94 1h1r n ASN 132 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1h1r s LEU 133 N -1.05 3.74 -0.11 3.41 1.43 -1.01 -0.78 118.68 124.31 1h1r s LEU 133 Ca 0.42 -1.04 -0.02 0.00 -1.03 0.00 0.00 54.13 52.46 1h1r s LEU 133 Cb 0.22 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.66 1h1r s LEU 133 CO 0.29 -0.22 -0.02 -0.76 0.23 0.00 0.00 176.35 175.88 1h1r s LEU 134 N 1.34 3.43 0.24 1.79 1.43 -0.44 -1.31 118.68 125.16 1h1r s LEU 134 Ca -0.02 0.03 0.08 0.00 -1.03 0.00 0.00 54.13 53.20 1h1r s LEU 134 Cb -0.18 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 44.20 1h1r s LEU 134 CO -0.01 0.30 0.06 0.27 0.23 0.00 0.00 176.35 177.20 1h1r s ILE 135 N -0.45 3.81 0.50 -0.59 -4.36 0.68 -0.77 121.20 120.03 1h1r s ILE 135 Ca 0.08 -1.66 0.01 0.00 -0.26 0.00 0.00 60.65 58.81 1h1r s ILE 135 Cb -0.12 -3.02 -0.00 0.00 1.25 0.00 0.00 42.46 40.56 1h1r s ILE 135 CO 0.02 -0.32 0.02 -0.46 0.24 0.00 0.00 174.94 174.45 1h1r n ASN 136 N -0.83 3.13 -0.24 4.36 0.23 -0.97 -1.54 115.26 119.40 1h1r n ASN 136 Ca -0.07 -3.25 0.10 0.00 -0.53 0.00 0.00 54.58 50.83 1h1r n ASN 136 Cb 0.58 0.45 0.48 0.00 -2.08 0.00 0.00 39.78 39.21 1h1r n ASN 136 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1h1r n THR 137 N -1.24 0.09 0.02 5.53 -2.24 -1.26 -3.19 114.28 112.00 1h1r n THR 137 Ca -0.19 -0.15 0.10 0.00 -2.27 0.00 0.00 64.05 61.54 1h1r n THR 137 Cb 0.65 -0.00 0.22 0.00 -2.10 0.00 0.00 70.33 69.09 1h1r n THR 137 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1h1r n GLU 138 N -0.31 2.48 -0.29 -0.78 1.02 -1.26 -4.59 120.64 116.91 1h1r n GLU 138 Ca 0.15 -2.25 0.00 0.00 -0.02 0.00 0.00 57.16 55.04 1h1r n GLU 138 Cb 0.18 -1.45 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 1h1r n GLU 138 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h1r n GLY 139 N 1.26 0.74 3.81 0.62 0.00 -1.19 -4.61 105.19 105.81 1h1r n GLY 139 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 1h1r n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h1r s ALA 140 N -2.33 2.73 -0.01 4.61 0.00 -1.26 -4.85 121.76 120.65 1h1r s ALA 140 Ca 0.00 0.28 -0.00 0.00 0.00 0.00 0.00 51.96 52.24 1h1r s ALA 140 Cb 0.00 -3.21 0.02 0.00 0.00 0.00 0.00 23.12 19.93 1h1r s ALA 140 CO 0.00 -0.93 0.02 -1.50 0.00 0.00 0.00 175.76 173.35 1h1r s ILE 141 N -2.66 -0.03 -0.01 0.00 2.07 -1.26 -2.28 121.20 117.03 1h1r s ILE 141 Ca 0.62 0.12 0.02 0.00 -1.41 0.00 0.00 60.65 59.99 1h1r s ILE 141 Cb -0.15 -0.05 -0.00 0.00 0.13 0.00 0.00 42.46 42.39 1h1r s ILE 141 CO 0.43 0.05 -0.05 -0.54 -1.91 0.00 0.00 174.94 172.91 1h1r s LYS 142 N 0.58 0.48 0.31 3.50 1.02 0.05 -4.61 119.74 121.06 1h1r s LYS 142 Ca -0.05 -0.18 -0.29 0.00 0.02 0.00 0.00 55.97 55.47 1h1r s LYS 142 Cb -0.07 -0.47 -0.11 0.00 -0.52 0.00 0.00 37.83 36.66 1h1r s LYS 142 CO -0.02 0.09 1.46 -0.51 -0.92 0.00 0.00 175.35 175.45 1h1r s LEU 143 N 0.02 4.37 0.29 3.17 1.43 0.28 -1.33 118.68 126.91 1h1r s LEU 143 Ca 0.00 2.84 0.03 0.00 -1.03 0.00 0.00 54.13 55.98 1h1r s LEU 143 Cb -0.04 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.51 1h1r s LEU 143 CO -0.00 -0.76 0.26 0.00 0.23 0.00 0.00 176.35 176.08 1h1r s ALA 144 N -0.53 1.48 -0.43 4.21 0.00 0.04 -1.77 121.76 124.76 1h1r s ALA 144 Ca 0.56 -1.87 -0.24 0.00 0.00 0.00 0.00 51.96 50.41 1h1r s ALA 144 Cb -0.44 1.41 0.03 0.00 0.00 0.00 0.00 23.12 24.12 1h1r s ALA 144 CO 0.52 -0.66 0.60 -3.47 0.00 0.00 0.00 175.76 172.75 1h1r n ASP 145 N -1.14 -7.04 -1.43 0.00 -0.08 -1.26 -4.81 116.55 100.79 1h1r n ASP 145 Ca 0.05 0.30 0.02 0.00 -1.51 0.00 0.00 54.79 53.66 1h1r n ASP 145 Cb 0.63 -3.98 0.24 0.00 2.34 0.00 0.00 41.12 40.36 1h1r n ASP 145 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1h1r n PHE 146 N -0.21 1.39 0.32 -0.67 3.01 -1.26 -4.39 117.46 115.65 1h1r n PHE 146 Ca 0.04 -0.55 0.21 0.00 1.01 0.00 0.00 57.45 58.16 1h1r n PHE 146 Cb 0.53 -0.40 1.10 0.00 -0.01 0.00 0.00 39.48 40.71 1h1r n PHE 146 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1h1r h GLY 147 N 4.17 0.00 -0.90 1.37 0.00 -1.91 -2.09 103.07 103.70 1h1r h GLY 147 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1h1r h GLY 147 CO 0.35 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.93 1h1r n LEU 148 N -3.17 2.43 -4.83 3.11 7.99 -1.26 -4.71 117.00 116.57 1h1r n LEU 148 Ca -0.02 -1.71 -0.30 0.00 -0.01 0.00 0.00 56.01 53.97 1h1r n LEU 148 Cb 0.11 -0.13 0.07 0.00 -0.11 0.00 0.00 43.42 43.37 1h1r n LEU 148 CO 0.22 0.58 0.72 0.00 -1.51 0.00 0.00 177.39 177.40 1h1r s ALA 149 N -0.92 2.49 0.13 -1.18 0.00 -0.79 -4.64 121.76 116.85 1h1r s ALA 149 Ca 0.16 -0.18 -0.20 0.00 0.00 0.00 0.00 51.96 51.74 1h1r s ALA 149 Cb 0.09 -3.10 0.05 0.00 0.00 0.00 0.00 23.12 20.16 1h1r s ALA 149 CO 0.12 -1.48 0.51 -0.98 0.00 0.00 0.00 175.76 173.93 1h1r s ARG 150 N -5.18 1.16 0.10 0.00 1.70 -0.61 -4.87 118.95 111.25 1h1r s ARG 150 Ca 0.60 -0.53 -0.25 0.00 -0.47 0.00 0.00 55.73 55.08 1h1r s ARG 150 Cb -0.13 0.52 -0.07 0.00 -0.57 0.00 0.00 34.95 34.70 1h1r s ARG 150 CO 0.54 -0.47 0.77 0.00 -1.08 0.00 0.00 175.30 175.05 1h1r s ALA 151 N -3.56 3.41 0.46 7.88 0.00 -1.26 -1.06 121.76 127.63 1h1r s ALA 151 Ca 0.01 0.32 0.06 0.00 0.00 0.00 0.00 51.96 52.35 1h1r s ALA 151 Cb 0.00 -2.97 -0.02 0.00 0.00 0.00 0.00 23.12 20.13 1h1r s ALA 151 CO -0.11 0.18 0.26 -0.59 0.00 0.00 0.00 175.76 175.50 1h1r s PHE 152 N -0.60 2.31 0.34 0.00 -0.71 0.08 -4.95 117.98 114.46 1h1r s PHE 152 Ca 0.37 -0.67 0.07 0.00 -1.04 0.00 0.00 56.93 55.66 1h1r s PHE 152 Cb -0.22 -1.96 -0.07 0.00 -1.21 0.00 0.00 43.02 39.57 1h1r s PHE 152 CO 0.24 -0.04 -0.02 0.20 -1.34 0.00 0.00 175.22 174.26 1h1r s GLY 153 N -4.04 2.18 -0.12 1.99 0.00 -1.26 -4.90 107.32 101.17 1h1r s GLY 153 Ca 0.38 -2.11 -0.02 0.00 0.00 0.00 0.00 44.72 42.97 1h1r s GLY 153 CO 0.22 -1.97 -0.04 0.14 0.00 0.00 0.00 173.10 171.45 1h1r s VAL 154 N -2.87 3.90 0.86 1.40 1.01 -1.26 -2.38 120.40 121.06 1h1r s VAL 154 Ca 0.33 -0.38 -0.16 0.00 0.00 0.00 0.00 61.98 61.78 1h1r s VAL 154 Cb 0.06 -2.66 -0.09 0.00 0.00 0.00 0.00 36.38 33.69 1h1r s VAL 154 CO 0.16 0.54 -0.23 -0.81 0.00 0.00 0.00 175.10 174.77 1h1r n PRO 155 N 2.90 -0.01 -1.68 2.72 -0.04 -1.26 -5.11 135.00 132.53 1h1r n PRO 155 Ca -0.18 0.01 -0.34 0.00 -0.04 0.00 0.00 63.50 62.96 1h1r n PRO 155 Cb 0.53 -1.31 0.06 0.00 -0.04 0.00 0.00 33.50 32.74 1h1r n PRO 155 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1h1r s VAL 156 N -2.07 2.84 0.53 0.52 -7.23 -1.00 -5.07 120.40 108.93 1h1r s VAL 156 Ca 0.50 0.41 0.07 0.00 -1.81 0.00 0.00 61.98 61.16 1h1r s VAL 156 Cb -0.27 -2.96 0.07 0.00 0.56 0.00 0.00 36.38 33.78 1h1r s VAL 156 CO 0.73 -0.22 0.61 0.54 -0.31 0.00 0.00 175.10 176.44 1h1r n ARG 157 N -2.42 0.67 -1.88 4.82 1.74 -1.26 -5.00 116.66 113.33 1h1r n ARG 157 Ca 0.12 -3.02 -0.42 0.00 -0.77 0.00 0.00 57.85 53.75 1h1r n ARG 157 Cb 0.51 -0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.92 1h1r n ARG 157 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1h1r s THR 158 N -2.43 2.57 0.00 0.55 2.01 -1.26 -4.76 115.64 112.32 1h1r s THR 158 Ca 0.46 0.34 0.00 0.00 0.31 0.00 0.00 61.69 62.80 1h1r s THR 158 Cb -0.04 -3.22 0.00 0.00 0.01 0.00 0.00 72.50 69.25 1h1r s THR 158 CO 0.29 0.02 0.00 -1.22 -0.69 0.00 0.00 174.62 173.02 1h1r n TYR 159 N 4.36 0.00 0.00 4.92 4.01 -1.26 -5.11 117.16 124.07 1h1r n TYR 159 Ca 0.15 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.89 1h1r n TYR 159 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 1h1r n TYR 159 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1h1r n HIS 161 N -2.10 0.00 -2.51 -0.72 -0.00 -1.26 -5.04 115.22 103.59 1h1r n HIS 161 Ca 0.00 0.00 -0.43 0.00 0.46 0.00 0.00 57.72 57.75 1h1r n HIS 161 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1h1r n HIS 161 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 1h1r n GLU 162 N -1.60 3.33 -4.04 1.57 4.71 -1.26 -4.89 120.64 118.46 1h1r n GLU 162 Ca 0.00 -3.45 -0.12 0.00 -0.01 0.00 0.00 57.16 53.58 1h1r n GLU 162 Cb 0.35 -3.14 -0.12 0.00 -1.01 0.00 0.00 31.44 27.52 1h1r n GLU 162 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1h1r s VAL 163 N 1.99 0.36 0.04 2.62 0.11 -1.26 -5.08 120.40 119.18 1h1r s VAL 163 Ca 0.45 -0.78 0.00 0.00 -2.93 0.00 0.00 61.98 58.71 1h1r s VAL 163 Cb 0.05 -0.42 0.00 0.00 -1.53 0.00 0.00 36.38 34.48 1h1r s VAL 163 CO 0.00 -0.29 0.00 0.52 -3.33 0.00 0.00 175.10 172.01 1h1r n VAL 164 N 1.91 -1.98 -1.66 2.04 0.31 -0.86 -4.90 118.33 113.19 1h1r n VAL 164 Ca -0.20 0.31 -0.41 0.00 -0.01 0.00 0.00 64.34 64.02 1h1r n VAL 164 Cb 0.56 -1.57 0.01 0.00 -0.91 0.00 0.00 33.84 31.93 1h1r n VAL 164 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1h1r n THR 165 N -0.23 2.50 -0.29 2.52 -1.04 -1.26 -4.72 114.28 111.76 1h1r n THR 165 Ca 0.00 -0.50 0.06 0.00 -2.04 0.00 0.00 64.05 61.57 1h1r n THR 165 Cb 0.00 -1.38 0.21 0.00 -1.82 0.00 0.00 70.33 67.34 1h1r n THR 165 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1h1r h LEU 166 N 1.87 0.55 -2.08 -4.42 5.85 -1.96 -1.79 115.31 113.31 1h1r h LEU 166 Ca -0.46 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.34 1h1r h LEU 166 Cb 1.31 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.34 1h1r h LEU 166 CO 0.59 0.25 0.00 -0.50 -0.34 0.00 0.00 178.44 178.44 1h1r h TRP 167 N 0.65 0.00 -0.11 1.25 6.55 -1.87 -2.57 115.95 119.85 1h1r h TRP 167 Ca 0.44 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.28 1h1r h TRP 167 Cb 0.59 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.89 1h1r h TRP 167 CO -0.09 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 177.96 1h1r n TYR 168 N -2.99 0.14 -2.52 0.49 4.01 -0.70 -4.56 117.16 111.02 1h1r n TYR 168 Ca -0.01 -0.15 -0.42 0.00 -0.16 0.00 0.00 57.90 57.16 1h1r n TYR 168 Cb 0.18 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.18 1h1r n TYR 168 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1h1r s ARG 169 N -0.95 4.36 0.71 -0.72 3.52 -0.97 -3.87 118.95 121.03 1h1r s ARG 169 Ca 0.16 1.59 -0.15 0.00 -0.13 0.00 0.00 55.73 57.21 1h1r s ARG 169 Cb 0.10 -3.56 0.03 0.00 -1.56 0.00 0.00 34.95 29.96 1h1r s ARG 169 CO 0.15 -0.43 1.17 0.00 -0.81 0.00 0.00 175.30 175.38 1h1r s ALA 170 N 2.23 2.21 0.25 6.12 0.00 -1.26 -4.86 121.76 126.45 1h1r s ALA 170 Ca 0.54 0.76 -0.05 0.00 0.00 0.00 0.00 51.96 53.21 1h1r s ALA 170 Cb -0.23 -3.42 0.28 0.00 0.00 0.00 0.00 23.12 19.75 1h1r s ALA 170 CO 0.20 -1.71 1.89 -1.00 0.00 0.00 0.00 175.76 175.14 1h1r h PRO 171 N -0.24 1.21 0.00 0.00 0.13 -1.96 -1.01 132.00 130.13 1h1r h PRO 171 Ca -0.47 -0.12 -0.02 0.00 -0.87 0.00 0.00 66.00 64.52 1h1r h PRO 171 Cb 1.28 -0.25 -0.00 0.00 0.13 0.00 0.00 31.00 32.16 1h1r h PRO 171 CO 0.51 0.86 -0.08 1.05 -0.23 0.00 0.00 178.00 180.11 1h1r h GLU 172 N 1.22 0.00 0.02 0.86 9.09 -1.92 0.22 114.58 124.07 1h1r h GLU 172 Ca 0.31 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.69 1h1r h GLU 172 Cb -0.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.09 1h1r h GLU 172 CO -0.05 0.08 -0.12 0.82 0.05 0.00 0.00 179.01 179.78 1h1r h ILE 173 N 0.00 1.74 -0.84 -1.06 2.04 -1.56 -0.66 117.51 117.17 1h1r h ILE 173 Ca -0.00 -2.34 0.17 0.00 1.00 0.00 0.00 64.86 63.69 1h1r h ILE 173 Cb 0.29 3.33 -0.06 0.00 -0.74 0.00 0.00 36.82 39.64 1h1r h ILE 173 CO 0.01 0.62 0.56 -0.07 0.00 0.00 0.00 178.15 179.26 1h1r h LEU 174 N -0.88 0.48 -0.80 1.44 3.38 -0.88 -0.67 115.31 117.37 1h1r h LEU 174 Ca -0.02 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1h1r h LEU 174 Cb 1.08 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1h1r h LEU 174 CO 0.02 0.23 0.00 0.18 0.09 0.00 0.00 178.44 178.96 1h1r n LEU 175 N -4.52 1.20 -0.17 1.67 4.77 0.73 -4.84 117.00 115.85 1h1r n LEU 175 Ca 0.17 -0.50 -0.02 0.00 -0.03 0.00 0.00 56.01 55.63 1h1r n LEU 175 Cb 0.57 -0.08 -0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1h1r n LEU 175 CO 0.31 0.25 -0.02 0.61 -1.33 0.00 0.00 177.39 177.21 1h1r n GLY 176 N 1.03 0.42 3.71 -0.72 0.00 -0.26 -1.26 105.19 108.11 1h1r n GLY 176 Ca 0.15 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.86 1h1r n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h1r h LYS 178 N 1.63 0.76 -4.96 0.00 3.64 -1.95 -3.42 116.57 112.28 1h1r h LYS 178 Ca -0.49 -0.17 -0.63 0.00 -1.27 0.00 0.00 60.65 58.08 1h1r h LYS 178 Cb 1.31 -0.11 -0.35 0.00 -0.41 0.00 0.00 32.23 32.67 1h1r h LYS 178 CO 0.58 0.73 -0.85 0.71 -2.27 0.00 0.00 179.45 178.34 1h1r s TYR 179 N -5.10 2.37 0.28 1.91 2.02 -1.26 -4.10 117.35 113.48 1h1r s TYR 179 Ca -0.09 -1.21 0.08 0.00 -0.37 0.00 0.00 57.07 55.48 1h1r s TYR 179 Cb 0.15 -1.66 -0.06 0.00 -0.40 0.00 0.00 41.96 40.00 1h1r s TYR 179 CO 0.80 -0.59 -0.11 1.52 -1.57 0.00 0.00 175.55 175.60 1h1r s TYR 180 N 1.01 2.06 0.00 2.71 -0.85 -1.26 -5.01 117.35 116.00 1h1r s TYR 180 Ca -0.04 -0.56 0.00 0.00 -0.52 0.00 0.00 57.07 55.94 1h1r s TYR 180 Cb -0.15 -1.08 0.00 0.00 0.38 0.00 0.00 41.96 41.11 1h1r s TYR 180 CO -0.04 0.44 0.00 0.45 -1.52 0.00 0.00 175.55 174.88 1h1r n SER 181 N -0.59 0.49 0.25 -0.18 2.88 -1.26 -4.93 113.62 110.27 1h1r n SER 181 Ca -0.06 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.57 1h1r n SER 181 Cb 0.62 0.00 0.62 0.00 -0.75 0.00 0.00 64.21 64.70 1h1r n SER 181 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1h1r h THR 182 N 0.00 0.91 -0.01 2.46 1.35 -1.99 -1.55 112.91 114.09 1h1r h THR 182 Ca 0.00 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 1h1r h THR 182 Cb 0.00 1.27 -0.00 0.00 -1.73 0.00 0.00 68.15 67.69 1h1r h THR 182 CO 0.00 0.13 0.19 0.00 -0.25 0.00 0.00 175.52 175.59 1h1r h ALA 183 N 1.87 1.21 0.00 6.62 0.00 -1.93 -1.00 119.26 126.03 1h1r h ALA 183 Ca -0.00 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1h1r h ALA 183 Cb 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1h1r h ALA 183 CO 0.02 -0.20 -0.48 -0.39 0.00 0.00 0.00 179.25 178.20 1h1r h VAL 184 N 0.00 1.29 0.00 0.00 -1.51 -1.69 -1.44 116.25 112.91 1h1r h VAL 184 Ca 0.00 -1.66 -0.18 0.00 -1.23 0.00 0.00 66.70 63.63 1h1r h VAL 184 Cb 0.39 1.91 -0.03 0.00 -2.13 0.00 0.00 31.29 31.43 1h1r h VAL 184 CO -0.00 0.47 -0.86 0.44 -1.23 0.00 0.00 177.57 176.38 1h1r h ASP 185 N 0.00 0.00 -0.36 4.19 3.32 -1.38 -2.71 116.42 119.48 1h1r h ASP 185 Ca -0.00 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 1h1r h ASP 185 Cb 0.87 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.41 1h1r h ASP 185 CO 0.06 0.86 0.01 0.40 -1.72 0.00 0.00 179.24 178.85 1h1r h ILE 186 N 0.00 1.26 -0.60 0.35 1.08 -1.48 -1.53 117.51 116.58 1h1r h ILE 186 Ca -0.01 -0.97 0.05 0.00 -0.39 0.00 0.00 64.86 63.54 1h1r h ILE 186 Cb 1.58 1.18 -0.05 0.00 -3.07 0.00 0.00 36.82 36.46 1h1r h ILE 186 CO 0.11 0.32 0.33 -0.25 -0.69 0.00 0.00 178.15 177.97 1h1r h TRP 187 N 0.45 0.60 -0.14 1.37 2.91 -1.14 -1.08 115.95 118.91 1h1r h TRP 187 Ca 0.10 0.02 0.03 0.00 1.13 0.00 0.00 58.89 60.18 1h1r h TRP 187 Cb 0.45 -0.18 -0.03 0.00 -0.51 0.00 0.00 29.16 28.88 1h1r h TRP 187 CO 0.04 0.30 -0.07 0.77 -1.03 0.00 0.00 178.44 178.45 1h1r h SER 188 N 0.62 -0.22 -0.42 2.65 0.02 -1.31 -1.38 113.55 113.51 1h1r h SER 188 Ca 0.26 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.26 1h1r h SER 188 Cb 0.14 0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 1h1r h SER 188 CO -0.16 -0.09 0.25 -0.07 -1.14 0.00 0.00 176.83 175.62 1h1r h LEU 189 N -0.05 0.53 -0.69 5.07 3.38 -0.75 0.86 115.31 123.66 1h1r h LEU 189 Ca 0.08 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1h1r h LEU 189 Cb 0.17 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1h1r h LEU 189 CO -0.18 0.42 0.10 1.23 0.09 0.00 0.00 178.44 180.11 1h1r h GLY 190 N 0.67 1.20 1.62 0.83 0.00 -0.89 0.24 103.07 106.73 1h1r h GLY 190 Ca 0.16 -0.80 -0.10 0.00 0.00 0.00 0.00 47.33 46.59 1h1r h GLY 190 CO -0.03 0.74 -0.27 0.00 0.00 0.00 0.00 176.54 176.98 1h1r h ILE 192 N 0.39 1.31 -0.19 0.00 2.04 -0.36 -1.47 117.51 119.23 1h1r h ILE 192 Ca 0.06 -1.58 0.03 0.00 1.00 0.00 0.00 64.86 64.36 1h1r h ILE 192 Cb 0.68 1.70 -0.03 0.00 -0.74 0.00 0.00 36.82 38.44 1h1r h ILE 192 CO 0.05 0.50 0.01 0.15 0.00 0.00 0.00 178.15 178.87 1h1r h PHE 193 N 0.44 0.02 -0.57 1.37 3.57 -0.18 -0.71 116.94 120.87 1h1r h PHE 193 Ca 0.02 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.59 1h1r h PHE 193 Cb 0.97 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.69 1h1r h PHE 193 CO 0.08 -0.01 0.30 0.00 -2.23 0.00 0.00 178.31 176.45 1h1r h ALA 194 N 1.16 0.74 -0.33 2.41 0.00 -1.29 -2.61 119.26 119.34 1h1r h ALA 194 Ca 0.09 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1h1r h ALA 194 Cb 0.10 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1h1r h ALA 194 CO -0.14 -0.04 0.01 1.49 0.00 0.00 0.00 179.25 180.57 1h1r h GLU 195 N 0.57 0.50 -0.56 0.00 4.81 -0.99 -0.08 114.58 118.84 1h1r h GLU 195 Ca 0.25 -0.10 -0.06 0.00 -0.13 0.00 0.00 59.36 59.33 1h1r h GLU 195 Cb 0.15 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 1h1r h GLU 195 CO -0.17 0.52 0.12 0.52 -0.73 0.00 0.00 179.01 179.28 1h1r h MET 196 N 0.48 0.87 0.01 1.92 2.86 -0.75 0.31 114.93 120.64 1h1r h MET 196 Ca 0.11 -0.19 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1h1r h MET 196 Cb 0.30 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.84 1h1r h MET 196 CO 0.01 0.79 -0.01 0.28 1.06 0.00 0.00 176.91 179.04 1h1r h VAL 197 N 0.83 1.52 0.00 -2.22 2.07 -1.35 -3.38 116.25 113.73 1h1r h VAL 197 Ca 0.18 -1.91 0.00 0.00 0.82 0.00 0.00 66.70 65.79 1h1r h VAL 197 Cb 0.32 2.77 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 1h1r h VAL 197 CO 0.00 0.47 -0.66 0.71 0.02 0.00 0.00 177.57 178.11 1h1r h THR 198 N -0.88 0.00 -1.58 2.57 1.35 -1.08 -3.48 112.91 109.82 1h1r h THR 198 Ca -0.00 -0.56 -0.37 0.00 -0.55 0.00 0.00 66.41 64.92 1h1r h THR 198 Cb 0.79 1.14 -0.10 0.00 -1.73 0.00 0.00 68.15 68.26 1h1r h THR 198 CO 0.00 0.00 -0.39 0.54 -0.25 0.00 0.00 175.52 175.42 1h1r n ARG 199 N -2.20 -1.35 -4.00 4.72 1.74 0.11 -4.99 116.66 110.68 1h1r n ARG 199 Ca 0.03 1.04 -0.11 0.00 -0.77 0.00 0.00 57.85 58.04 1h1r n ARG 199 Cb 0.45 -5.42 -0.12 0.00 -1.02 0.00 0.00 32.46 26.36 1h1r n ARG 199 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1h1r s ARG 200 N -4.10 0.33 0.31 5.56 1.70 -1.24 -5.01 118.95 116.51 1h1r s ARG 200 Ca 0.00 -0.53 -0.29 0.00 -0.47 0.00 0.00 55.73 54.44 1h1r s ARG 200 Cb 0.00 -0.06 -0.11 0.00 -0.57 0.00 0.00 34.95 34.21 1h1r s ARG 200 CO 0.00 -0.00 1.56 0.00 -1.08 0.00 0.00 175.30 175.78 1h1r s ALA 201 N -1.11 3.70 0.15 7.88 0.00 -1.26 -4.18 121.76 126.94 1h1r s ALA 201 Ca -0.10 1.57 -0.14 0.00 0.00 0.00 0.00 51.96 53.28 1h1r s ALA 201 Cb -0.08 -3.64 0.03 0.00 0.00 0.00 0.00 23.12 19.44 1h1r s ALA 201 CO -0.00 -1.00 1.72 1.25 0.00 0.00 0.00 175.76 177.72 1h1r h LEU 202 N 4.37 0.66 -6.25 0.00 5.85 -1.91 -3.38 115.31 114.65 1h1r h LEU 202 Ca -0.48 -0.15 -0.58 0.00 0.84 0.00 0.00 57.88 57.50 1h1r h LEU 202 Cb 1.23 -0.17 -0.40 0.00 0.37 0.00 0.00 40.66 41.68 1h1r h LEU 202 CO 0.75 0.63 -0.86 0.49 -0.34 0.00 0.00 178.44 179.12 1h1r n PHE 203 N -4.58 1.24 -1.92 1.25 3.72 -1.26 -5.01 117.46 110.89 1h1r n PHE 203 Ca 0.02 -3.80 -0.42 0.00 -0.05 0.00 0.00 57.45 53.20 1h1r n PHE 203 Cb 0.14 -0.35 0.00 0.00 -0.94 0.00 0.00 39.48 38.33 1h1r n PHE 203 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1h1r n PRO 204 N 1.53 2.98 -2.05 -1.08 -0.04 -1.26 -4.45 135.00 130.63 1h1r n PRO 204 Ca 0.25 -2.80 -0.30 0.00 -0.04 0.00 0.00 63.50 60.61 1h1r n PRO 204 Cb 0.46 -3.28 0.02 0.00 -0.04 0.00 0.00 33.50 30.66 1h1r n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1h1r s GLY 205 N 3.13 1.62 0.00 0.55 0.00 -1.26 -4.98 107.32 106.37 1h1r s GLY 205 Ca 0.47 -0.29 0.17 0.00 0.00 0.00 0.00 44.72 45.07 1h1r s GLY 205 CO -0.06 -0.01 0.97 2.09 0.00 0.00 0.00 173.10 176.09 1h1r n ASP 206 N -2.73 2.11 -3.27 1.64 5.68 -1.26 -4.79 116.55 113.94 1h1r n ASP 206 Ca 0.05 -1.56 -0.09 0.00 -0.50 0.00 0.00 54.79 52.69 1h1r n ASP 206 Cb 0.55 0.17 0.00 0.00 -1.14 0.00 0.00 41.12 40.71 1h1r n ASP 206 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1h1r s SER 207 N -1.58 0.04 0.08 -1.12 1.04 -1.26 -5.02 113.70 105.88 1h1r s SER 207 Ca 0.17 -1.04 -0.20 0.00 0.48 0.00 0.00 55.95 55.36 1h1r s SER 207 Cb 0.14 0.78 -0.09 0.00 0.10 0.00 0.00 66.02 66.95 1h1r s SER 207 CO 0.28 -1.52 1.56 -0.33 0.98 0.00 0.00 173.24 174.20 1h1r h GLU 208 N 2.03 0.35 -0.38 4.02 5.08 -1.99 -0.38 114.58 123.32 1h1r h GLU 208 Ca -0.28 -0.09 -0.12 0.00 -1.00 0.00 0.00 59.36 57.87 1h1r h GLU 208 Cb 1.25 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 1h1r h GLU 208 CO 0.36 0.49 -0.25 0.97 -1.00 0.00 0.00 179.01 179.57 1h1r h ILE 209 N 0.15 1.27 -0.87 3.13 6.09 -1.97 -1.99 117.51 123.33 1h1r h ILE 209 Ca 0.07 -1.38 0.06 0.00 -1.37 0.00 0.00 64.86 62.24 1h1r h ILE 209 Cb 0.30 1.26 -0.06 0.00 0.47 0.00 0.00 36.82 38.79 1h1r h ILE 209 CO 0.00 0.46 0.55 -0.78 -3.07 0.00 0.00 178.15 175.31 1h1r h ASP 210 N 0.66 0.87 -0.22 2.19 3.58 -1.92 -0.63 116.42 120.95 1h1r h ASP 210 Ca 0.09 0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.53 1h1r h ASP 210 Cb 0.77 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.64 1h1r h ASP 210 CO 0.06 0.56 0.05 -0.61 -2.88 0.00 0.00 179.24 176.42 1h1r h GLN 211 N 1.01 0.35 -0.21 0.28 5.75 -0.87 -0.34 115.11 121.08 1h1r h GLN 211 Ca 0.38 -0.09 0.02 0.00 -0.15 0.00 0.00 58.65 58.81 1h1r h GLN 211 Cb 0.15 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 1h1r h GLN 211 CO -0.17 0.47 0.06 -0.07 -2.65 0.00 0.00 178.83 176.47 1h1r h LEU 212 N 0.17 0.05 -0.69 -2.39 3.38 -1.12 -1.15 115.31 113.57 1h1r h LEU 212 Ca 0.07 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 1h1r h LEU 212 Cb 0.28 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 1h1r h LEU 212 CO 0.00 0.06 0.08 -0.26 0.09 0.00 0.00 178.44 178.41 1h1r h PHE 213 N 0.15 1.17 -0.52 1.13 0.04 -0.93 0.19 116.94 118.17 1h1r h PHE 213 Ca 0.09 -0.17 0.06 0.00 2.80 0.00 0.00 57.97 60.75 1h1r h PHE 213 Cb 0.07 -0.32 -0.05 0.00 2.20 0.00 0.00 35.95 37.85 1h1r h PHE 213 CO -0.13 0.99 0.23 0.00 -0.60 0.00 0.00 178.31 178.80 1h1r h ARG 214 N 1.02 0.43 -0.23 1.51 3.08 -0.85 -0.22 114.38 119.13 1h1r h ARG 214 Ca 0.20 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.18 1h1r h ARG 214 Cb 0.47 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 1h1r h ARG 214 CO 0.02 0.29 -0.00 0.82 -1.07 0.00 0.00 179.97 180.02 1h1r h ILE 215 N 0.44 1.26 -0.67 2.04 2.04 -0.73 -2.91 117.51 118.97 1h1r h ILE 215 Ca 0.24 -0.89 -0.00 0.00 1.00 0.00 0.00 64.86 65.21 1h1r h ILE 215 Cb 0.20 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 1h1r h ILE 215 CO -0.20 0.28 0.41 -0.26 0.00 0.00 0.00 178.15 178.38 1h1r h PHE 216 N 0.17 0.88 0.00 1.37 0.04 -0.46 -0.15 116.94 118.79 1h1r h PHE 216 Ca 0.06 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.84 1h1r h PHE 216 Cb 0.41 -0.29 0.00 0.00 2.20 0.00 0.00 35.95 38.27 1h1r h PHE 216 CO 0.04 0.58 0.00 0.54 -0.60 0.00 0.00 178.31 178.86 1h1r n ARG 217 N -4.40 0.19 -0.12 1.51 1.74 -0.11 -0.06 116.66 115.40 1h1r n ARG 217 Ca 0.07 0.35 -0.18 0.00 -0.77 0.00 0.00 57.85 57.32 1h1r n ARG 217 Cb 0.06 -1.82 -0.12 0.00 -1.02 0.00 0.00 32.46 29.56 1h1r n ARG 217 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1h1r n THR 218 N -2.17 1.51 0.44 0.55 -1.04 -0.58 -4.59 114.28 108.39 1h1r n THR 218 Ca 0.03 -0.59 0.07 0.00 -2.04 0.00 0.00 64.05 61.53 1h1r n THR 218 Cb 0.27 -1.41 0.09 0.00 -1.82 0.00 0.00 70.33 67.47 1h1r n THR 218 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1h1r n LEU 219 N -3.26 2.45 0.00 -4.42 4.77 -0.17 -2.52 117.00 113.85 1h1r n LEU 219 Ca -0.44 -1.21 0.00 0.00 -0.03 0.00 0.00 56.01 54.32 1h1r n LEU 219 Cb 1.00 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 42.03 1h1r n LEU 219 CO 0.28 0.49 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 1h1r n GLY 220 N 0.84 0.04 3.70 -0.72 0.00 0.91 -4.55 105.19 105.41 1h1r n GLY 220 Ca 0.10 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 1h1r n GLY 220 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1h1r s THR 221 N -1.92 3.73 0.37 2.61 2.01 -0.58 -4.51 115.64 117.36 1h1r s THR 221 Ca 0.00 1.16 -0.26 0.00 0.31 0.00 0.00 61.69 62.90 1h1r s THR 221 Cb 0.00 -3.75 -0.09 0.00 0.01 0.00 0.00 72.50 68.67 1h1r s THR 221 CO 0.00 0.03 1.20 -2.16 -0.69 0.00 0.00 174.62 173.00 1h1r s PRO 222 N 1.94 4.17 0.32 4.92 0.04 -1.26 -4.83 135.00 140.30 1h1r s PRO 222 Ca 0.62 1.95 0.01 0.00 0.04 0.00 0.00 61.00 63.62 1h1r s PRO 222 Cb -0.31 -2.82 -0.00 0.00 0.04 0.00 0.00 34.50 31.40 1h1r s PRO 222 CO 0.27 -0.26 0.03 -0.40 0.04 0.00 0.00 177.00 176.69 1h1r n ASP 223 N 0.35 2.39 0.10 6.66 5.68 -1.26 -4.95 116.55 125.52 1h1r n ASP 223 Ca 0.03 -2.50 0.02 0.00 -0.50 0.00 0.00 54.79 51.84 1h1r n ASP 223 Cb 0.45 0.38 0.37 0.00 -1.14 0.00 0.00 41.12 41.19 1h1r n ASP 223 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1h1r h GLU 224 N 0.00 0.29 0.67 0.11 4.39 -1.97 0.11 114.58 118.18 1h1r h GLU 224 Ca -0.26 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.34 1h1r h GLU 224 Cb 0.85 -0.04 0.01 0.00 -0.10 0.00 0.00 28.75 29.47 1h1r h GLU 224 CO 0.43 0.41 -0.32 0.28 -1.16 0.00 0.00 179.01 178.65 1h1r h VAL 225 N 0.28 0.20 -0.33 3.13 2.07 -1.98 -1.92 116.25 117.69 1h1r h VAL 225 Ca 0.06 -0.25 -0.06 0.00 0.82 0.00 0.00 66.70 67.27 1h1r h VAL 225 Cb 0.37 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1h1r h VAL 225 CO 0.02 0.02 -0.05 1.62 0.02 0.00 0.00 177.57 179.20 1h1r h VAL 226 N -1.10 1.21 -2.08 2.57 3.04 -1.86 -3.39 116.25 114.64 1h1r h VAL 226 Ca -0.09 -0.89 -0.47 0.00 -1.01 0.00 0.00 66.70 64.23 1h1r h VAL 226 Cb 0.73 1.02 -0.33 0.00 -2.01 0.00 0.00 31.29 30.69 1h1r h VAL 226 CO 0.15 0.30 -0.82 0.86 -1.01 0.00 0.00 177.57 177.05 1h1r s TRP 227 N -4.88 0.30 0.21 3.17 -0.11 0.36 -4.56 118.94 113.44 1h1r s TRP 227 Ca -0.08 -1.63 -0.31 0.00 1.22 0.00 0.00 56.10 55.31 1h1r s TRP 227 Cb 0.15 -0.60 -0.15 0.00 -1.50 0.00 0.00 33.47 31.36 1h1r s TRP 227 CO 0.77 -0.93 1.04 -2.30 -4.62 0.00 0.00 176.95 170.91 1h1r n PRO 228 N 3.32 1.09 0.00 5.86 -0.02 -0.73 -1.35 135.00 143.16 1h1r n PRO 228 Ca 0.22 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1h1r n PRO 228 Cb 0.47 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.17 1h1r n PRO 228 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h1r n GLY 229 N 1.71 2.71 0.22 -1.23 0.00 -1.26 -4.94 105.19 102.40 1h1r n GLY 229 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1h1r n GLY 229 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1h1r h VAL 230 N 0.00 0.54 0.00 1.61 2.07 -1.53 -1.94 116.25 117.00 1h1r h VAL 230 Ca 0.00 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1h1r h VAL 230 Cb 0.00 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 1h1r h VAL 230 CO 0.00 0.03 0.00 0.35 0.02 0.00 0.00 177.57 177.97 1h1r n THR 231 N -5.24 1.05 0.99 2.57 -2.24 -1.26 -1.55 114.28 108.59 1h1r n THR 231 Ca 0.08 0.48 0.11 0.00 -2.27 0.00 0.00 64.05 62.46 1h1r n THR 231 Cb 0.33 -1.44 0.01 0.00 -2.10 0.00 0.00 70.33 67.13 1h1r n THR 231 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1h1r n SER 232 N -2.12 2.15 -4.70 3.42 7.64 -0.74 -4.91 113.62 114.35 1h1r n SER 232 Ca 0.00 -1.57 -0.38 0.00 1.01 0.00 0.00 58.87 57.93 1h1r n SER 232 Cb 0.12 0.41 0.06 0.00 -1.01 0.00 0.00 64.21 63.79 1h1r n SER 232 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1h1r n MET 233 N 0.16 1.26 -0.27 1.43 2.81 -0.59 -4.90 117.12 117.01 1h1r n MET 233 Ca 0.10 0.48 0.01 0.00 -1.81 0.00 0.00 57.70 56.47 1h1r n MET 233 Cb 0.48 -2.45 0.13 0.00 -0.71 0.00 0.00 33.22 30.68 1h1r n MET 233 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1h1r h PRO 234 N 0.84 0.75 -0.50 0.03 0.11 -1.77 -2.58 132.00 128.87 1h1r h PRO 234 Ca -0.50 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1h1r h PRO 234 Cb 1.33 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1h1r h PRO 234 CO 0.54 0.50 0.00 -0.25 -0.21 0.00 0.00 178.00 178.57 1h1r n ASP 235 N -4.74 4.48 -4.73 -2.05 8.00 -0.39 -4.94 116.55 112.19 1h1r n ASP 235 Ca 0.11 -2.61 -0.41 0.00 0.71 0.00 0.00 54.79 52.59 1h1r n ASP 235 Cb 0.22 -0.54 -0.04 0.00 -0.02 0.00 0.00 41.12 40.74 1h1r n ASP 235 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1h1r s TYR 236 N -2.12 3.72 -0.04 1.24 6.14 -0.97 -4.88 117.35 120.43 1h1r s TYR 236 Ca 0.46 1.71 0.04 0.00 0.64 0.00 0.00 57.07 59.91 1h1r s TYR 236 Cb 0.32 -3.14 -0.00 0.00 0.42 0.00 0.00 41.96 39.56 1h1r s TYR 236 CO 0.18 -0.12 -0.15 0.15 0.64 0.00 0.00 175.55 176.25 1h1r s LYS 237 N 0.08 1.58 0.61 4.97 -0.14 -1.26 -4.91 119.74 120.67 1h1r s LYS 237 Ca 0.49 -0.53 0.38 0.00 -1.36 0.00 0.00 55.97 54.95 1h1r s LYS 237 Cb -0.25 -1.39 1.97 0.00 -1.68 0.00 0.00 37.83 36.48 1h1r s LYS 237 CO 0.31 0.21 2.23 -1.35 -0.76 0.00 0.00 175.35 175.98 1h1r h PRO 238 N 6.30 0.00 0.00 -1.68 0.11 -1.97 -1.39 132.00 133.36 1h1r h PRO 238 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1h1r h PRO 238 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1h1r h PRO 238 CO 0.48 0.02 0.00 -1.13 -0.21 0.00 0.00 178.00 177.16 1h1r n SER 239 N -3.26 0.00 -4.66 -2.05 3.41 -1.26 -4.85 113.62 100.95 1h1r n SER 239 Ca -0.02 0.40 -0.46 0.00 -0.26 0.00 0.00 58.87 58.54 1h1r n SER 239 Cb 0.15 -0.46 -0.03 0.00 -0.26 0.00 0.00 64.21 63.61 1h1r n SER 239 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1h1r n PHE 240 N -1.46 2.09 -1.76 7.33 3.72 -0.53 -4.91 117.46 121.95 1h1r n PHE 240 Ca 0.05 0.42 -0.40 0.00 -0.05 0.00 0.00 57.45 57.48 1h1r n PHE 240 Cb 0.20 -2.46 0.03 0.00 -0.94 0.00 0.00 39.48 36.31 1h1r n PHE 240 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1h1r n PRO 241 N 2.33 2.10 -3.32 -1.08 -0.02 -1.26 -4.95 135.00 128.79 1h1r n PRO 241 Ca 0.13 0.75 -0.47 0.00 -2.02 0.00 0.00 63.50 61.90 1h1r n PRO 241 Cb 0.30 -2.61 -0.03 0.00 -0.02 0.00 0.00 33.50 31.14 1h1r n PRO 241 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1h1r s LYS 242 N -2.56 3.46 0.16 -0.52 1.02 -1.26 -4.79 119.74 115.25 1h1r s LYS 242 Ca 0.64 -2.28 -0.15 0.00 0.02 0.00 0.00 55.97 54.20 1h1r s LYS 242 Cb -0.44 -4.40 -0.07 0.00 -0.52 0.00 0.00 37.83 32.40 1h1r s LYS 242 CO 0.55 -1.30 0.58 -1.58 -0.92 0.00 0.00 175.35 172.68 1h1r s TRP 243 N 0.51 3.60 0.29 3.18 0.51 -1.26 -4.88 118.94 120.90 1h1r s TRP 243 Ca 0.14 1.11 -0.29 0.00 -2.12 0.00 0.00 56.10 54.94 1h1r s TRP 243 Cb -0.15 -2.41 -0.10 0.00 -0.81 0.00 0.00 33.47 30.01 1h1r s TRP 243 CO -0.06 0.40 1.11 0.00 -0.51 0.00 0.00 176.95 177.89 1h1r s ALA 244 N -1.49 3.40 0.25 0.98 0.00 -1.26 -1.52 121.76 122.11 1h1r s ALA 244 Ca 0.39 0.91 -0.30 0.00 0.00 0.00 0.00 51.96 52.97 1h1r s ALA 244 Cb -0.15 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.54 1h1r s ALA 244 CO 0.19 -0.19 1.28 0.50 0.00 0.00 0.00 175.76 177.54 1h1r s ARG 245 N -1.52 4.41 0.16 0.00 3.52 -1.26 -4.12 118.95 120.14 1h1r s ARG 245 Ca 0.45 2.07 -0.21 0.00 -0.13 0.00 0.00 55.73 57.90 1h1r s ARG 245 Cb -0.32 -3.16 -0.08 0.00 -1.56 0.00 0.00 34.95 29.84 1h1r s ARG 245 CO 0.41 -0.17 0.69 -0.65 -0.81 0.00 0.00 175.30 174.78 1h1r s GLN 246 N -0.78 4.34 -0.07 5.12 -0.21 -1.05 -4.87 119.66 122.14 1h1r s GLN 246 Ca 0.53 0.92 -0.30 0.00 0.02 0.00 0.00 55.36 56.53 1h1r s GLN 246 Cb -0.37 -3.12 -0.08 0.00 1.00 0.00 0.00 33.01 30.43 1h1r s GLN 246 CO 0.43 0.53 2.04 -3.47 -2.12 0.00 0.00 175.29 172.70 1h1r n ASP 247 N 1.33 3.72 -0.25 5.90 2.03 -1.26 -4.87 116.55 123.14 1h1r n ASP 247 Ca -0.06 0.70 0.32 0.00 0.52 0.00 0.00 54.79 56.27 1h1r n ASP 247 Cb 0.50 -1.50 0.74 0.00 -0.72 0.00 0.00 41.12 40.14 1h1r n ASP 247 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 1h1r h PHE 248 N 11.72 0.00 0.00 -0.67 -1.00 -1.94 0.21 116.94 125.26 1h1r h PHE 248 Ca -0.46 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.31 1h1r h PHE 248 Cb 1.25 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.81 1h1r h PHE 248 CO 0.94 0.00 -0.02 0.66 -1.61 0.00 0.00 178.31 178.29 1h1r h SER 249 N 0.00 0.00 0.82 2.17 4.64 -1.89 -1.58 113.55 117.71 1h1r h SER 249 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 1h1r h SER 249 Cb 2.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.10 1h1r h SER 249 CO -0.01 0.02 -1.05 0.29 -0.87 0.00 0.00 176.83 175.21 1h1r n LYS 250 N -3.23 0.53 -0.05 4.77 5.02 0.72 -3.43 118.16 122.49 1h1r n LYS 250 Ca -0.02 0.08 -0.14 0.00 -2.02 0.00 0.00 58.31 56.21 1h1r n LYS 250 Cb 0.14 -1.76 -0.07 0.00 -0.02 0.00 0.00 35.03 33.32 1h1r n LYS 250 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1h1r h VAL 251 N 0.00 1.36 -2.55 -0.18 2.07 -1.21 -3.38 116.25 112.36 1h1r h VAL 251 Ca 0.00 -1.43 -0.59 0.00 0.82 0.00 0.00 66.70 65.50 1h1r h VAL 251 Cb 0.94 1.93 -0.39 0.00 -1.52 0.00 0.00 31.29 32.25 1h1r h VAL 251 CO 0.00 0.42 -0.88 -0.69 0.02 0.00 0.00 177.57 176.44 1h1r s VAL 252 N -4.16 0.58 0.34 2.57 1.01 -1.18 -5.04 120.40 114.52 1h1r s VAL 252 Ca -0.14 -2.49 0.08 0.00 0.00 0.00 0.00 61.98 59.43 1h1r s VAL 252 Cb 0.05 -1.41 0.32 0.00 0.00 0.00 0.00 36.38 35.34 1h1r s VAL 252 CO 0.77 -1.11 1.83 -0.65 0.00 0.00 0.00 175.10 175.94 1h1r h PRO 253 N 6.13 0.71 0.00 2.72 0.11 -1.75 -1.46 132.00 138.46 1h1r h PRO 253 Ca 0.17 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1h1r h PRO 253 Cb 0.92 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1h1r h PRO 253 CO 0.38 0.47 0.00 -2.30 -0.21 0.00 0.00 178.00 176.34 1h1r n PRO 254 N -4.62 0.18 -2.57 1.05 -0.02 -1.26 -4.83 135.00 122.93 1h1r n PRO 254 Ca 0.20 0.10 -0.39 0.00 -2.02 0.00 0.00 63.50 61.38 1h1r n PRO 254 Cb 0.51 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.44 1h1r n PRO 254 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1h1r s LEU 255 N -2.75 4.51 0.92 2.45 2.96 -0.55 -5.06 118.68 121.16 1h1r s LEU 255 Ca 0.16 2.13 -0.14 0.00 -0.22 0.00 0.00 54.13 56.06 1h1r s LEU 255 Cb 0.14 -3.73 0.16 0.00 0.50 0.00 0.00 46.19 43.26 1h1r s LEU 255 CO 0.35 -0.11 1.24 1.51 -1.32 0.00 0.00 176.35 178.02 1h1r s ASP 256 N -1.10 3.49 0.22 3.68 3.84 -1.26 -4.75 116.67 120.79 1h1r s ASP 256 Ca 0.46 0.55 -0.08 0.00 -0.00 0.00 0.00 52.55 53.48 1h1r s ASP 256 Cb -0.28 -0.83 0.32 0.00 -1.38 0.00 0.00 42.92 40.75 1h1r s ASP 256 CO 0.36 -2.52 1.77 -0.08 -0.00 0.00 0.00 175.17 174.70 1h1r h GLU 257 N -1.49 0.55 -0.35 2.11 4.81 -1.99 -1.89 114.58 116.33 1h1r h GLU 257 Ca -0.46 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 58.73 1h1r h GLU 257 Cb 1.28 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 1h1r h GLU 257 CO 0.50 0.36 0.19 -0.44 -0.73 0.00 0.00 179.01 178.90 1h1r h ASP 258 N 0.56 0.43 -0.79 1.04 3.32 -1.97 -1.53 116.42 117.48 1h1r h ASP 258 Ca 0.34 -0.08 0.02 0.00 0.02 0.00 0.00 57.03 57.33 1h1r h ASP 258 Cb 0.36 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.76 1h1r h ASP 258 CO -0.27 0.39 0.51 1.23 -1.72 0.00 0.00 179.24 179.38 1h1r h GLY 259 N 0.44 1.14 1.24 2.75 0.00 -1.85 -0.74 103.07 106.04 1h1r h GLY 259 Ca 0.12 -0.40 -0.11 0.00 0.00 0.00 0.00 47.33 46.94 1h1r h GLY 259 CO -0.02 0.35 -0.17 3.21 0.00 0.00 0.00 176.54 179.91 1h1r h ARG 260 N 1.02 0.88 -0.30 4.80 3.08 -1.23 0.86 114.38 123.49 1h1r h ARG 260 Ca 0.31 -0.34 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1h1r h ARG 260 Cb -0.03 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1h1r h ARG 260 CO -0.10 0.98 0.12 1.03 -1.07 0.00 0.00 179.97 180.93 1h1r h SER 261 N 0.77 0.41 0.13 7.04 0.87 -0.84 -0.40 113.55 121.54 1h1r h SER 261 Ca 0.11 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.50 1h1r h SER 261 Cb 0.71 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 1h1r h SER 261 CO 0.05 0.47 -0.06 0.25 -0.53 0.00 0.00 176.83 177.01 1h1r h LEU 262 N 0.33 -0.15 -0.85 2.23 5.85 -0.72 -2.51 115.31 119.50 1h1r h LEU 262 Ca 0.10 -0.13 0.10 0.00 0.84 0.00 0.00 57.88 58.78 1h1r h LEU 262 Cb 0.19 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.18 1h1r h LEU 262 CO -0.01 0.05 0.49 0.25 -0.34 0.00 0.00 178.44 178.88 1h1r h LEU 263 N -0.34 0.70 -1.58 2.25 5.85 -0.81 -1.94 115.31 119.43 1h1r h LEU 263 Ca -0.02 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 1h1r h LEU 263 Cb 0.27 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1h1r h LEU 263 CO 0.03 0.39 -0.21 0.77 -0.34 0.00 0.00 178.44 179.08 1h1r h SER 264 N 0.81 0.00 1.21 1.25 4.64 -0.95 -1.22 113.55 119.30 1h1r h SER 264 Ca 0.41 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.57 1h1r h SER 264 Cb 0.39 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 1h1r h SER 264 CO -0.25 0.21 -0.76 1.56 -0.87 0.00 0.00 176.83 176.72 1h1r h GLN 265 N 0.00 0.00 0.00 4.77 4.20 -0.94 -2.75 115.11 120.39 1h1r h GLN 265 Ca -0.00 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 1h1r h GLN 265 Cb 0.50 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 1h1r h GLN 265 CO 0.03 0.76 -0.19 0.52 -0.67 0.00 0.00 178.83 179.27 1h1r h MET 266 N 0.00 0.00 -0.42 1.46 2.86 -0.72 -2.36 114.93 115.75 1h1r h MET 266 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1h1r h MET 266 Cb 1.57 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.23 1h1r h MET 266 CO 0.10 0.19 0.00 1.28 1.06 0.00 0.00 176.91 179.54 1h1r n LEU 267 N -3.18 4.63 -4.74 1.22 4.77 -0.52 -3.90 117.00 115.27 1h1r n LEU 267 Ca 0.02 -2.88 -0.39 0.00 -0.03 0.00 0.00 56.01 52.74 1h1r n LEU 267 Cb 0.55 -0.59 0.04 0.00 -2.33 0.00 0.00 43.42 41.09 1h1r n LEU 267 CO 0.35 0.67 0.99 1.57 -1.33 0.00 0.00 177.39 179.65 1h1r n HIS 268 N 0.13 2.37 -0.03 -1.77 -0.00 -1.05 -4.92 115.22 109.95 1h1r n HIS 268 Ca 0.24 0.44 -0.13 0.00 0.46 0.00 0.00 57.72 58.73 1h1r n HIS 268 Cb 0.99 -2.38 -0.08 0.00 -0.12 0.00 0.00 29.99 28.39 1h1r n HIS 268 CO 0.00 0.00 0.00 1.88 0.46 0.00 0.00 176.34 178.68 1h1r h TYR 269 N 1.66 0.21 -3.00 1.57 0.05 -1.91 -3.42 116.97 112.14 1h1r h TYR 269 Ca -0.51 -0.05 -0.57 0.00 0.05 0.00 0.00 58.73 57.66 1h1r h TYR 269 Cb 1.30 -0.05 -0.04 0.00 1.01 0.00 0.00 36.73 38.94 1h1r h TYR 269 CO 0.46 0.53 1.00 0.34 -1.05 0.00 0.00 178.16 179.44 1h1r s ASP 270 N -5.81 6.66 0.52 3.88 -1.08 -1.26 -4.81 116.67 114.77 1h1r s ASP 270 Ca -0.15 1.42 0.17 0.00 -0.52 0.00 0.00 52.55 53.48 1h1r s ASP 270 Cb 0.04 -2.54 1.30 0.00 -1.46 0.00 0.00 42.92 40.26 1h1r s ASP 270 CO 0.71 -1.06 2.14 -0.65 0.52 0.00 0.00 175.17 176.84 1h1r h PRO 271 N 9.42 0.00 -0.77 4.34 0.11 -1.95 -0.36 132.00 142.78 1h1r h PRO 271 Ca -0.28 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.78 1h1r h PRO 271 Cb 1.11 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1h1r h PRO 271 CO 1.01 0.02 0.32 -0.91 -0.21 0.00 0.00 178.00 178.23 1h1r h ASN 272 N 0.00 1.06 1.31 -2.05 2.35 -1.96 -3.09 115.58 113.21 1h1r h ASN 272 Ca -0.00 -0.17 -0.13 0.00 -0.55 0.00 0.00 56.30 55.45 1h1r h ASN 272 Cb 0.03 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.11 1h1r h ASN 272 CO 0.00 0.94 -0.70 0.11 -1.65 0.00 0.00 177.43 176.13 1h1r h LYS 273 N 1.12 0.00 -6.46 0.81 1.79 -1.56 -3.46 116.57 108.81 1h1r h LYS 273 Ca 0.26 0.00 -0.61 0.00 -2.18 0.00 0.00 60.65 58.12 1h1r h LYS 273 Cb 0.20 0.00 0.07 0.00 -1.58 0.00 0.00 32.23 30.92 1h1r h LYS 273 CO -0.02 0.56 0.55 -2.13 -1.08 0.00 0.00 179.45 177.33 1h1r n ARG 274 N -3.20 1.72 -1.83 3.15 0.63 -0.29 -4.90 116.66 111.93 1h1r n ARG 274 Ca 0.00 0.62 -0.41 0.00 -0.92 0.00 0.00 57.85 57.14 1h1r n ARG 274 Cb 0.78 -2.26 -0.00 0.00 0.45 0.00 0.00 32.46 31.43 1h1r n ARG 274 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 1h1r s ILE 275 N 0.24 2.11 0.53 5.15 2.07 -0.89 -5.00 121.20 125.40 1h1r s ILE 275 Ca 0.75 0.11 -0.09 0.00 -1.41 0.00 0.00 60.65 60.00 1h1r s ILE 275 Cb -0.75 -3.07 -0.04 0.00 0.13 0.00 0.00 42.46 38.73 1h1r s ILE 275 CO 0.47 0.03 0.90 -0.94 -1.91 0.00 0.00 174.94 173.48 1h1r s SER 276 N -0.15 6.30 0.24 4.50 1.04 -1.26 -4.88 113.70 119.48 1h1r s SER 276 Ca 0.53 1.19 -0.07 0.00 0.48 0.00 0.00 55.95 58.08 1h1r s SER 276 Cb -0.46 -2.36 0.26 0.00 0.10 0.00 0.00 66.02 63.56 1h1r s SER 276 CO 0.62 -0.68 1.88 0.00 0.98 0.00 0.00 173.24 176.04 1h1r h ALA 277 N 0.16 1.15 -0.36 5.32 0.00 -1.94 -2.28 119.26 121.31 1h1r h ALA 277 Ca -0.46 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.46 1h1r h ALA 277 Cb 1.20 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1h1r h ALA 277 CO 0.62 0.42 0.12 -0.22 0.00 0.00 0.00 179.25 180.19 1h1r h LYS 278 N 1.11 0.26 -0.35 0.00 3.64 -1.92 -2.82 116.57 116.49 1h1r h LYS 278 Ca 0.35 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.63 1h1r h LYS 278 Cb -0.01 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1h1r h LYS 278 CO -0.11 0.17 -0.10 0.00 -2.27 0.00 0.00 179.45 177.14 1h1r h ALA 279 N 1.24 1.16 0.00 5.00 0.00 -1.94 -2.91 119.26 121.80 1h1r h ALA 279 Ca 0.17 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1h1r h ALA 279 Cb 0.15 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1h1r h ALA 279 CO -0.17 0.53 -0.16 0.00 0.00 0.00 0.00 179.25 179.45 1h1r h ALA 280 N 1.33 1.51 0.00 0.00 0.00 -1.20 -1.59 119.26 119.31 1h1r h ALA 280 Ca 0.10 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1h1r h ALA 280 Cb 0.51 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1h1r h ALA 280 CO 0.03 0.20 -0.05 -0.07 0.00 0.00 0.00 179.25 179.37 1h1r h LEU 281 N 0.00 0.00 -3.70 0.00 3.38 -1.29 -0.78 115.31 112.93 1h1r h LEU 281 Ca -0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1h1r h LEU 281 Cb 0.33 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.99 1h1r h LEU 281 CO 0.02 0.05 0.21 0.00 0.09 0.00 0.00 178.44 178.80 1h1r n ALA 282 N -2.15 4.42 -1.77 1.53 0.00 -0.60 -4.86 120.51 117.08 1h1r n ALA 282 Ca -0.01 -2.26 -0.38 0.00 0.00 0.00 0.00 53.44 50.78 1h1r n ALA 282 Cb 0.22 -1.21 -0.06 0.00 0.00 0.00 0.00 19.45 18.40 1h1r n ALA 282 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1h1r s HIS 283 N -2.95 3.71 0.65 0.00 5.04 -0.30 -4.89 115.29 116.55 1h1r s HIS 283 Ca 0.55 1.79 0.32 0.00 -1.54 0.00 0.00 55.06 56.19 1h1r s HIS 283 Cb 0.44 -3.01 1.76 0.00 0.04 0.00 0.00 32.58 31.80 1h1r s HIS 283 CO 0.14 0.07 1.99 -1.35 -2.34 0.00 0.00 174.74 173.25 1h1r h PRO 284 N 3.46 0.00 0.00 2.88 0.10 -1.92 0.45 132.00 136.96 1h1r h PRO 284 Ca -0.46 0.00 -0.01 0.00 0.10 0.00 0.00 66.00 65.63 1h1r h PRO 284 Cb 1.20 0.00 -0.00 0.00 0.10 0.00 0.00 31.00 32.30 1h1r h PRO 284 CO 0.66 0.00 -0.05 0.35 0.10 0.00 0.00 178.00 179.06 1h1r h PHE 285 N 0.00 0.00 -0.54 0.65 3.57 -1.90 -1.21 116.94 117.51 1h1r h PHE 285 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1h1r h PHE 285 Cb 0.54 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.28 1h1r h PHE 285 CO 0.00 0.05 0.00 1.19 -2.23 0.00 0.00 178.31 177.32 1h1r n PHE 286 N -4.43 0.95 0.00 0.41 3.72 0.15 -4.47 117.46 113.79 1h1r n PHE 286 Ca -0.03 -0.42 0.04 0.00 -0.05 0.00 0.00 57.45 56.99 1h1r n PHE 286 Cb 0.13 -0.09 0.42 0.00 -0.94 0.00 0.00 39.48 39.00 1h1r n PHE 286 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1h1r h GLN 287 N 3.28 0.54 -0.62 -1.08 3.07 -1.35 0.34 115.11 119.29 1h1r h GLN 287 Ca 0.00 -0.03 -0.21 0.00 0.09 0.00 0.00 58.65 58.49 1h1r h GLN 287 Cb 0.96 -0.12 -0.13 0.00 0.08 0.00 0.00 27.48 28.27 1h1r h GLN 287 CO 0.08 0.36 0.21 -0.40 0.09 0.00 0.00 178.83 179.17 1h1r n ASP 288 N -4.47 4.08 -4.77 0.06 5.75 -1.26 -5.03 116.55 110.90 1h1r n ASP 288 Ca 0.03 -3.35 -0.41 0.00 -0.01 0.00 0.00 54.79 51.05 1h1r n ASP 288 Cb 0.06 -0.70 -0.02 0.00 -1.03 0.00 0.00 41.12 39.43 1h1r n ASP 288 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1h1r s VAL 289 N -3.06 2.54 0.00 2.12 0.11 0.11 -5.00 120.40 117.22 1h1r s VAL 289 Ca 0.51 0.53 0.00 0.00 -2.93 0.00 0.00 61.98 60.09 1h1r s VAL 289 Cb 0.42 -3.33 0.00 0.00 -1.53 0.00 0.00 36.38 31.94 1h1r s VAL 289 CO 0.10 0.12 0.00 0.35 -3.33 0.00 0.00 175.10 172.33 1h1r n THR 290 N 1.02 0.00 -3.48 5.04 -2.24 -1.26 -5.08 114.28 108.28 1h1r n THR 290 Ca 0.02 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.53 1h1r n THR 290 Cb 0.41 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.54 1h1r n THR 290 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1h1r n LYS 291 N 0.00 1.03 -0.91 -0.78 4.81 -1.26 -4.34 118.16 116.70 1h1r n LYS 291 Ca 0.00 -3.72 -0.29 0.00 -0.87 0.00 0.00 58.31 53.43 1h1r n LYS 291 Cb 0.00 -1.81 0.19 0.00 0.02 0.00 0.00 35.03 33.43 1h1r n LYS 291 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1h1r s PRO 292 N -0.93 0.29 0.00 1.64 0.04 -1.26 -4.90 135.00 129.88 1h1r s PRO 292 Ca 0.32 0.84 0.00 0.00 0.04 0.00 0.00 61.00 62.21 1h1r s PRO 292 Cb 0.06 -1.70 0.00 0.00 0.04 0.00 0.00 34.50 32.91 1h1r s PRO 292 CO -0.15 -2.91 0.00 0.28 0.04 0.00 0.00 177.00 174.26 1h1r n VAL 293 N -4.35 0.00 0.00 -0.36 0.31 -1.26 -4.39 118.33 108.28 1h1r n VAL 293 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1h1r n VAL 293 Cb 0.55 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.48 1h1r n VAL 293 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1h1r n PRO 294 N 0.00 0.00 -0.99 5.55 -0.04 -1.26 -4.70 135.00 133.57 1h1r n PRO 294 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1h1r n PRO 294 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1h1r n PRO 294 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1h1r n HIS 295 N -1.37 -2.72 -0.09 0.54 1.44 -1.26 -5.10 115.22 106.66 1h1r n HIS 295 Ca 0.00 1.46 0.00 0.00 -2.01 0.00 0.00 57.72 57.17 1h1r n HIS 295 Cb 0.00 -2.53 0.00 0.00 0.12 0.00 0.00 29.99 27.58 1h1r n HIS 295 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81