#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h6r s LYS 3 N 0.00 0.57 5.32 1.43 2.47 -1.26 -4.63 119.74 123.64 1h6r s LYS 3 Ca 0.00 -0.80 0.00 0.00 -1.56 0.00 0.00 55.97 53.61 1h6r s LYS 3 Cb 0.00 -0.34 0.00 0.00 -1.46 0.00 0.00 37.83 36.03 1h6r s LYS 3 CO 0.00 0.06 0.00 0.41 0.16 0.00 0.00 175.35 175.98 1h6r n GLY 4 N 1.37 2.76 0.38 5.54 0.00 -0.36 -2.90 105.19 111.98 1h6r n GLY 4 Ca -0.22 -0.36 0.20 0.00 0.00 0.00 0.00 46.02 45.64 1h6r n GLY 4 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1h6r h GLU 5 N 0.00 0.00 -0.04 1.61 4.11 -1.91 -1.07 114.58 117.28 1h6r h GLU 5 Ca 0.00 0.00 0.01 0.00 0.07 0.00 0.00 59.36 59.44 1h6r h GLU 5 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1h6r h GLU 5 CO 0.00 0.00 0.04 1.49 0.07 0.00 0.00 179.01 180.61 1h6r h GLU 6 N 0.00 0.00 0.00 1.06 4.57 -1.91 -0.49 114.58 117.81 1h6r h GLU 6 Ca 0.21 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.39 1h6r h GLU 6 Cb 0.97 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.56 1h6r h GLU 6 CO -0.00 0.00 0.00 1.28 -1.18 0.00 0.00 179.01 179.11 1h6r n LEU 7 N -4.00 0.00 -0.54 1.64 4.77 -0.41 -3.18 117.00 115.28 1h6r n LEU 7 Ca -0.02 0.48 0.07 0.00 -0.03 0.00 0.00 56.01 56.50 1h6r n LEU 7 Cb 0.14 -0.48 0.17 0.00 -2.33 0.00 0.00 43.42 40.92 1h6r n LEU 7 CO 0.29 -0.20 0.63 0.49 -1.33 0.00 0.00 177.39 177.27 1h6r n PHE 8 N -1.48 0.50 0.46 -1.77 3.01 -0.19 -4.69 117.46 113.30 1h6r n PHE 8 Ca 0.04 -0.73 0.12 0.00 1.01 0.00 0.00 57.45 57.89 1h6r n PHE 8 Cb 0.19 -0.16 0.47 0.00 -0.01 0.00 0.00 39.48 39.97 1h6r n PHE 8 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1h6r n THR 9 N -0.38 0.76 -3.20 4.37 -2.24 -1.19 -4.22 114.28 108.18 1h6r n THR 9 Ca 0.14 0.09 0.00 0.00 -2.27 0.00 0.00 64.05 62.01 1h6r n THR 9 Cb 0.62 -1.00 0.00 0.00 -2.10 0.00 0.00 70.33 67.85 1h6r n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h6r n GLY 10 N 0.36 6.15 3.70 3.38 0.00 -1.26 -4.82 105.19 112.70 1h6r n GLY 10 Ca 0.03 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 1h6r n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h6r s VAL 11 N -0.22 4.85 -0.16 1.61 1.01 -1.26 -4.47 120.40 121.76 1h6r s VAL 11 Ca 0.00 2.00 -0.00 0.00 0.00 0.00 0.00 61.98 63.98 1h6r s VAL 11 Cb 0.00 -4.29 -0.00 0.00 0.00 0.00 0.00 36.38 32.09 1h6r s VAL 11 CO 0.00 0.10 -0.14 -0.69 0.00 0.00 0.00 175.10 174.37 1h6r s VAL 12 N 1.43 2.72 0.47 2.92 1.01 0.20 -4.95 120.40 124.19 1h6r s VAL 12 Ca 0.49 -0.75 -0.23 0.00 0.00 0.00 0.00 61.98 61.49 1h6r s VAL 12 Cb -0.20 -2.16 -0.07 0.00 0.00 0.00 0.00 36.38 33.96 1h6r s VAL 12 CO 0.23 0.51 1.19 -2.84 0.00 0.00 0.00 175.10 174.18 1h6r s PRO 13 N 0.88 3.69 -0.01 2.72 0.02 -1.26 -0.77 135.00 140.28 1h6r s PRO 13 Ca -0.04 1.83 0.06 0.00 0.02 0.00 0.00 61.00 62.87 1h6r s PRO 13 Cb -0.15 -2.39 -0.02 0.00 0.02 0.00 0.00 34.50 31.96 1h6r s PRO 13 CO -0.01 -0.62 -0.20 0.42 -0.33 0.00 0.00 177.00 176.27 1h6r s ILE 14 N -1.52 1.55 -0.08 2.83 1.01 0.05 -1.12 121.20 123.93 1h6r s ILE 14 Ca 0.64 -0.89 0.03 0.00 0.00 0.00 0.00 60.65 60.44 1h6r s ILE 14 Cb -0.30 -1.30 0.01 0.00 0.01 0.00 0.00 42.46 40.88 1h6r s ILE 14 CO 0.36 0.39 -0.18 -0.22 0.00 0.00 0.00 174.94 175.30 1h6r s LEU 15 N -0.58 1.87 -0.05 2.97 2.96 -0.44 -2.28 118.68 123.13 1h6r s LEU 15 Ca 0.07 -0.41 0.05 0.00 -0.22 0.00 0.00 54.13 53.62 1h6r s LEU 15 Cb -0.08 -1.09 -0.01 0.00 0.50 0.00 0.00 46.19 45.52 1h6r s LEU 15 CO -0.00 0.10 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.24 1h6r s VAL 16 N 0.43 1.67 -0.04 1.68 1.01 0.03 -0.81 120.40 124.38 1h6r s VAL 16 Ca -0.15 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 60.99 1h6r s VAL 16 Cb -0.16 -1.43 0.02 0.00 0.00 0.00 0.00 36.38 34.81 1h6r s VAL 16 CO 0.06 0.47 -0.05 -1.61 0.00 0.00 0.00 175.10 173.97 1h6r s GLU 17 N -0.03 0.86 -0.07 2.72 0.41 -0.28 -0.34 118.70 121.97 1h6r s GLU 17 Ca -0.04 -0.12 0.02 0.00 -0.41 0.00 0.00 54.97 54.42 1h6r s GLU 17 Cb -0.12 -0.85 0.01 0.00 -1.78 0.00 0.00 34.13 31.39 1h6r s GLU 17 CO 0.03 -0.07 -0.12 -1.17 -0.49 0.00 0.00 175.26 173.44 1h6r s LEU 18 N 0.89 1.61 -0.21 1.80 0.20 0.10 -0.19 118.68 122.88 1h6r s LEU 18 Ca -0.11 -0.29 -0.05 0.00 0.69 0.00 0.00 54.13 54.36 1h6r s LEU 18 Cb -0.14 -0.81 -0.02 0.00 -0.43 0.00 0.00 46.19 44.79 1h6r s LEU 18 CO 0.00 0.02 0.01 -1.81 -0.29 0.00 0.00 176.35 174.28 1h6r s ASP 19 N 0.71 4.85 0.19 3.68 1.01 -0.49 -1.04 116.67 125.58 1h6r s ASP 19 Ca -0.14 -0.21 0.06 0.00 0.71 0.00 0.00 52.55 52.97 1h6r s ASP 19 Cb -0.16 -1.83 -0.05 0.00 1.01 0.00 0.00 42.92 41.89 1h6r s ASP 19 CO 0.03 0.05 -0.11 -0.83 0.21 0.00 0.00 175.17 174.53 1h6r s GLY 20 N 1.08 1.30 -0.23 0.21 0.00 0.84 -1.02 107.32 109.49 1h6r s GLY 20 Ca 0.02 -1.61 -0.04 0.00 0.00 0.00 0.00 44.72 43.10 1h6r s GLY 20 CO 0.02 -1.68 0.37 -0.35 0.00 0.00 0.00 173.10 171.45 1h6r s ASP 21 N -3.26 0.24 -0.20 1.64 -1.08 -0.64 -1.34 116.67 112.03 1h6r s ASP 21 Ca 0.21 0.33 0.01 0.00 -0.52 0.00 0.00 52.55 52.58 1h6r s ASP 21 Cb 0.02 1.09 0.03 0.00 -1.46 0.00 0.00 42.92 42.59 1h6r s ASP 21 CO 0.04 -0.29 -0.17 -0.69 0.52 0.00 0.00 175.17 174.58 1h6r s VAL 22 N 2.54 2.05 -1.40 1.11 1.01 -0.27 0.19 120.40 125.62 1h6r s VAL 22 Ca 0.10 -1.08 -0.08 0.00 0.00 0.00 0.00 61.98 60.92 1h6r s VAL 22 Cb -0.15 -1.93 0.05 0.00 0.00 0.00 0.00 36.38 34.35 1h6r s VAL 22 CO -0.15 0.40 0.57 0.59 0.00 0.00 0.00 175.10 176.51 1h6r n ASN 23 N 4.59 -4.70 0.00 3.32 4.13 -0.34 -0.65 115.26 121.61 1h6r n ASN 23 Ca -0.19 -0.37 0.00 0.00 1.68 0.00 0.00 54.58 55.70 1h6r n ASN 23 Cb 0.48 -3.84 0.00 0.00 -1.54 0.00 0.00 39.78 34.89 1h6r n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1h6r n GLY 24 N -1.34 1.78 3.62 7.41 0.00 -1.26 -5.00 105.19 110.38 1h6r n GLY 24 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1h6r n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1h6r s HIS 25 N -2.76 3.18 0.07 1.61 3.76 0.18 -5.03 115.29 116.31 1h6r s HIS 25 Ca 0.00 0.88 -0.10 0.00 -0.15 0.00 0.00 55.06 55.69 1h6r s HIS 25 Cb 0.00 -3.34 -0.06 0.00 1.11 0.00 0.00 32.58 30.29 1h6r s HIS 25 CO 0.00 -0.62 0.40 0.15 -0.85 0.00 0.00 174.74 173.82 1h6r s LYS 26 N 3.12 3.77 0.11 1.40 1.02 -1.26 -1.12 119.74 126.78 1h6r s LYS 26 Ca 0.35 0.20 -0.25 0.00 0.02 0.00 0.00 55.97 56.29 1h6r s LYS 26 Cb -0.14 -3.02 0.08 0.00 -0.52 0.00 0.00 37.83 34.24 1h6r s LYS 26 CO 0.13 0.57 0.68 -0.59 -0.92 0.00 0.00 175.35 175.23 1h6r s PHE 27 N -1.37 -0.49 0.05 3.18 -0.12 -0.45 -4.42 117.98 114.36 1h6r s PHE 27 Ca 0.32 0.32 0.03 0.00 -0.05 0.00 0.00 56.93 57.55 1h6r s PHE 27 Cb -0.14 0.55 -0.03 0.00 -0.63 0.00 0.00 43.02 42.77 1h6r s PHE 27 CO 0.18 -0.76 -0.09 -1.54 -0.05 0.00 0.00 175.22 172.96 1h6r s SER 28 N -2.62 0.99 -0.00 1.98 1.04 -0.62 -0.12 113.70 114.36 1h6r s SER 28 Ca 0.02 -0.59 0.02 0.00 0.48 0.00 0.00 55.95 55.88 1h6r s SER 28 Cb -0.01 0.03 -0.00 0.00 0.10 0.00 0.00 66.02 66.13 1h6r s SER 28 CO -0.11 -0.20 -0.05 -0.69 0.98 0.00 0.00 173.24 173.17 1h6r s VAL 29 N -1.49 0.42 -0.02 5.02 1.01 -0.21 -1.01 120.40 124.11 1h6r s VAL 29 Ca -0.08 -0.22 0.07 0.00 0.00 0.00 0.00 61.98 61.76 1h6r s VAL 29 Cb -0.09 -0.35 -0.02 0.00 0.00 0.00 0.00 36.38 35.92 1h6r s VAL 29 CO 0.00 0.12 -0.25 -0.44 0.00 0.00 0.00 175.10 174.54 1h6r s SER 30 N -0.10 2.92 0.08 3.32 0.01 -0.62 -0.73 113.70 118.58 1h6r s SER 30 Ca 0.02 -0.45 0.04 0.00 1.31 0.00 0.00 55.95 56.87 1h6r s SER 30 Cb -0.02 -0.37 -0.03 0.00 0.21 0.00 0.00 66.02 65.81 1h6r s SER 30 CO -0.00 0.30 -0.12 -0.83 0.41 0.00 0.00 173.24 173.00 1h6r s GLY 31 N -0.54 0.82 0.04 3.44 0.00 0.54 -0.60 107.32 111.02 1h6r s GLY 31 Ca 0.08 -1.06 -0.13 0.00 0.00 0.00 0.00 44.72 43.62 1h6r s GLY 31 CO -0.01 -1.11 0.28 -1.83 0.00 0.00 0.00 173.10 170.43 1h6r s GLU 32 N -2.19 0.76 0.00 2.90 -1.05 -0.62 -0.79 118.70 117.72 1h6r s GLU 32 Ca 0.01 -0.50 0.00 0.00 -0.15 0.00 0.00 54.97 54.33 1h6r s GLU 32 Cb -0.07 0.33 0.00 0.00 -0.44 0.00 0.00 34.13 33.95 1h6r s GLU 32 CO 0.01 -0.24 0.00 0.41 0.95 0.00 0.00 175.26 176.40 1h6r n GLY 33 N 0.69 -0.67 3.33 -3.83 0.00 -0.97 -1.00 105.19 102.74 1h6r n GLY 33 Ca -0.19 -0.47 -0.11 0.00 0.00 0.00 0.00 46.02 45.25 1h6r n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1h6r s GLU 34 N -1.02 1.06 0.03 1.61 -1.05 -0.24 -0.77 118.70 118.31 1h6r s GLU 34 Ca 0.00 -0.62 0.06 0.00 -0.15 0.00 0.00 54.97 54.26 1h6r s GLU 34 Cb 0.00 0.47 -0.02 0.00 -0.44 0.00 0.00 34.13 34.14 1h6r s GLU 34 CO 0.00 -0.41 -0.17 0.20 0.95 0.00 0.00 175.26 175.83 1h6r s GLY 35 N -2.64 0.91 -0.41 -3.83 0.00 0.05 -1.19 107.32 100.22 1h6r s GLY 35 Ca 0.01 -0.88 0.01 0.00 0.00 0.00 0.00 44.72 43.86 1h6r s GLY 35 CO -0.10 -0.81 0.22 -0.35 0.00 0.00 0.00 173.10 172.06 1h6r s ASP 36 N -0.97 3.47 0.59 1.64 3.68 0.71 -0.62 116.67 125.17 1h6r s ASP 36 Ca 0.05 -2.45 0.32 0.00 2.13 0.00 0.00 52.55 52.60 1h6r s ASP 36 Cb -0.08 -0.84 1.86 0.00 -1.45 0.00 0.00 42.92 42.41 1h6r s ASP 36 CO 0.01 -0.29 2.24 0.00 0.13 0.00 0.00 175.17 177.26 1h6r h ALA 37 N 6.88 1.38 -0.48 3.66 0.00 -1.73 -1.14 119.26 127.83 1h6r h ALA 37 Ca 0.00 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1h6r h ALA 37 Cb 0.94 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1h6r h ALA 37 CO 0.42 0.03 0.32 1.15 0.00 0.00 0.00 179.25 181.17 1h6r h THR 38 N 0.00 0.97 -0.12 0.00 2.02 -1.87 -2.17 112.91 111.73 1h6r h THR 38 Ca -0.00 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.04 1h6r h THR 38 Cb 0.07 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1h6r h THR 38 CO 0.00 0.07 0.00 -1.22 0.37 0.00 0.00 175.52 174.75 1h6r n TYR 39 N -4.47 0.15 -2.15 3.16 4.01 -0.53 -4.93 117.16 112.39 1h6r n TYR 39 Ca 0.06 -0.14 -0.17 0.00 -0.16 0.00 0.00 57.90 57.50 1h6r n TYR 39 Cb 0.26 -0.01 -0.02 0.00 -0.31 0.00 0.00 39.34 39.26 1h6r n TYR 39 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1h6r n GLY 40 N 0.71 0.08 3.67 2.72 0.00 -0.60 -4.74 105.19 107.04 1h6r n GLY 40 Ca 0.09 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1h6r n GLY 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1h6r s LYS 41 N -4.55 3.60 -0.05 1.61 2.20 -0.80 -0.27 119.74 121.49 1h6r s LYS 41 Ca 0.00 -0.35 0.04 0.00 -0.36 0.00 0.00 55.97 55.30 1h6r s LYS 41 Cb 0.00 -3.06 0.00 0.00 -1.51 0.00 0.00 37.83 33.26 1h6r s LYS 41 CO 0.00 0.46 -0.15 -0.51 -0.36 0.00 0.00 175.35 174.78 1h6r s LEU 42 N -0.16 1.86 -0.15 5.43 1.43 -0.00 -0.21 118.68 126.88 1h6r s LEU 42 Ca 0.07 -0.33 -0.01 0.00 -1.03 0.00 0.00 54.13 52.83 1h6r s LEU 42 Cb -0.12 -0.90 0.04 0.00 0.03 0.00 0.00 46.19 45.24 1h6r s LEU 42 CO 0.01 0.12 -0.05 0.28 0.23 0.00 0.00 176.35 176.95 1h6r s THR 43 N 0.17 1.00 0.05 5.49 -1.32 -0.34 -1.05 115.64 119.64 1h6r s THR 43 Ca -0.06 -0.50 0.01 0.00 -1.21 0.00 0.00 61.69 59.93 1h6r s THR 43 Cb -0.12 -1.17 -0.03 0.00 -1.51 0.00 0.00 72.50 69.68 1h6r s THR 43 CO 0.02 0.16 -0.06 -0.76 -2.21 0.00 0.00 174.62 171.77 1h6r s LEU 44 N 1.69 2.32 -0.06 9.08 1.43 -0.41 -1.08 118.68 131.66 1h6r s LEU 44 Ca 0.02 -0.66 0.01 0.00 -1.03 0.00 0.00 54.13 52.47 1h6r s LEU 44 Cb -0.15 -0.06 0.02 0.00 0.03 0.00 0.00 46.19 46.04 1h6r s LEU 44 CO -0.08 -0.31 -0.08 -0.75 0.23 0.00 0.00 176.35 175.37 1h6r s LYS 45 N -2.19 1.24 -0.04 1.70 2.20 -0.17 -0.46 119.74 122.03 1h6r s LYS 45 Ca -0.06 -0.24 0.04 0.00 -0.36 0.00 0.00 55.97 55.35 1h6r s LYS 45 Cb -0.06 -1.14 -0.03 0.00 -1.51 0.00 0.00 37.83 35.10 1h6r s LYS 45 CO -0.02 -0.05 -0.14 -0.06 -0.36 0.00 0.00 175.35 174.72 1h6r s PHE 46 N 0.89 2.70 -0.02 4.03 0.40 0.55 -1.59 117.98 124.94 1h6r s PHE 46 Ca -0.11 -0.16 0.02 0.00 -0.60 0.00 0.00 56.93 56.08 1h6r s PHE 46 Cb -0.15 -1.61 0.00 0.00 0.51 0.00 0.00 43.02 41.77 1h6r s PHE 46 CO 0.01 0.21 -0.07 0.42 0.70 0.00 0.00 175.22 176.48 1h6r s ILE 47 N -0.77 0.66 -0.03 0.64 1.01 0.24 -1.01 121.20 121.94 1h6r s ILE 47 Ca 0.12 -0.29 -0.30 0.00 0.00 0.00 0.00 60.65 60.18 1h6r s ILE 47 Cb -0.11 -0.60 -0.05 0.00 0.01 0.00 0.00 42.46 41.72 1h6r s ILE 47 CO 0.01 0.21 1.46 -0.69 0.00 0.00 0.00 174.94 175.94 1h6r s VAL 48 N 0.24 3.70 -0.19 2.92 1.01 -1.02 -1.59 120.40 125.47 1h6r s VAL 48 Ca -0.03 1.02 0.09 0.00 0.00 0.00 0.00 61.98 63.05 1h6r s VAL 48 Cb -0.08 -3.65 -0.22 0.00 0.00 0.00 0.00 36.38 32.42 1h6r s VAL 48 CO 0.00 -0.03 0.06 0.35 0.00 0.00 0.00 175.10 175.48 1h6r n THR 49 N 4.93 1.50 -3.99 3.92 -2.24 -0.18 -4.85 114.28 113.36 1h6r n THR 49 Ca 0.14 -0.72 -0.12 0.00 -2.27 0.00 0.00 64.05 61.08 1h6r n THR 49 Cb 0.43 -1.02 -0.13 0.00 -2.10 0.00 0.00 70.33 67.51 1h6r n THR 49 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1h6r s THR 50 N -2.52 0.19 0.00 4.28 -4.23 -1.16 -4.97 115.64 107.23 1h6r s THR 50 Ca -0.20 -0.38 0.00 0.00 -1.18 0.00 0.00 61.69 59.93 1h6r s THR 50 Cb 0.07 -0.22 0.00 0.00 1.34 0.00 0.00 72.50 73.69 1h6r s THR 50 CO 0.74 -0.13 0.00 0.61 -0.54 0.00 0.00 174.62 175.30 1h6r n GLY 51 N 2.53 -1.93 3.32 3.99 0.00 -1.26 -1.58 105.19 110.26 1h6r n GLY 51 Ca -0.16 -1.36 -0.32 0.00 0.00 0.00 0.00 46.02 44.18 1h6r n GLY 51 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1h6r s LYS 52 N -0.09 2.51 -0.17 1.61 2.20 -1.26 -4.92 119.74 119.61 1h6r s LYS 52 Ca 0.00 -0.86 -0.29 0.00 -0.36 0.00 0.00 55.97 54.46 1h6r s LYS 52 Cb 0.00 -2.21 -0.04 0.00 -1.51 0.00 0.00 37.83 34.07 1h6r s LYS 52 CO 0.00 0.45 1.81 -1.17 -0.36 0.00 0.00 175.35 176.08 1h6r s LEU 53 N -0.32 3.90 0.00 5.43 2.96 -1.26 -4.79 118.68 124.60 1h6r s LEU 53 Ca 0.01 1.88 0.27 0.00 -0.22 0.00 0.00 54.13 56.08 1h6r s LEU 53 Cb -0.13 -3.53 0.97 0.00 0.50 0.00 0.00 46.19 44.01 1h6r s LEU 53 CO 0.02 -1.37 1.73 -0.81 -1.32 0.00 0.00 176.35 174.60 1h6r n PRO 54 N 7.87 0.16 -4.33 0.98 -0.04 -1.26 -4.89 135.00 133.49 1h6r n PRO 54 Ca 0.21 -0.06 -0.17 0.00 -0.04 0.00 0.00 63.50 63.44 1h6r n PRO 54 Cb 0.44 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.30 1h6r n PRO 54 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1h6r s VAL 55 N -2.88 1.26 0.36 0.52 -7.23 -1.26 -4.50 120.40 106.66 1h6r s VAL 55 Ca 0.16 -2.08 -0.27 0.00 -1.81 0.00 0.00 61.98 57.99 1h6r s VAL 55 Cb 0.19 -2.22 -0.09 0.00 0.56 0.00 0.00 36.38 34.82 1h6r s VAL 55 CO 0.58 -0.44 1.15 -2.84 -0.31 0.00 0.00 175.10 173.23 1h6r s PRO 56 N -3.79 4.27 0.25 4.82 0.02 -1.26 -4.95 135.00 134.37 1h6r s PRO 56 Ca 0.25 1.82 -0.03 0.00 0.02 0.00 0.00 61.00 63.06 1h6r s PRO 56 Cb 0.04 -2.85 0.47 0.00 0.02 0.00 0.00 34.50 32.18 1h6r s PRO 56 CO 0.07 -0.12 1.75 -1.49 -0.33 0.00 0.00 177.00 176.88 1h6r h TRP 57 N 3.04 0.62 -0.11 6.54 4.06 -1.97 -1.33 115.95 126.80 1h6r h TRP 57 Ca -0.48 0.03 0.03 0.00 2.06 0.00 0.00 58.89 60.53 1h6r h TRP 57 Cb 1.22 -0.16 -0.00 0.00 -1.00 0.00 0.00 29.16 29.22 1h6r h TRP 57 CO 0.57 0.13 0.11 -1.35 -3.56 0.00 0.00 178.44 174.34 1h6r h PRO 58 N 0.53 0.00 0.00 0.49 0.11 -1.90 -1.03 132.00 130.21 1h6r h PRO 58 Ca 0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.53 1h6r h PRO 58 Cb 0.60 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.71 1h6r h PRO 58 CO -0.37 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.67 1h6r n THR 59 N -3.94 0.78 0.76 -1.15 -2.24 -0.50 -2.73 114.28 105.26 1h6r n THR 59 Ca -0.00 0.18 0.08 0.00 -2.27 0.00 0.00 64.05 62.04 1h6r n THR 59 Cb 0.22 -0.93 -0.02 0.00 -2.10 0.00 0.00 70.33 67.50 1h6r n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1h6r n LEU 60 N -1.67 1.49 -0.06 3.22 4.77 -0.39 -4.67 117.00 119.70 1h6r n LEU 60 Ca 0.04 -0.71 -0.08 0.00 -0.03 0.00 0.00 56.01 55.24 1h6r n LEU 60 Cb 0.22 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.30 1h6r n LEU 60 CO 0.18 0.29 0.74 0.58 -1.33 0.00 0.00 177.39 177.85 1h6r h VAL 61 N 1.49 0.50 0.00 4.08 2.07 -1.52 -0.75 116.25 122.12 1h6r h VAL 61 Ca 0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 1h6r h VAL 61 Cb 0.54 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1h6r h VAL 61 CO 0.00 0.00 -0.17 0.71 0.02 0.00 0.00 177.57 178.13 1h6r h THR 62 N -0.16 1.06 -0.12 2.57 1.35 -1.83 -2.82 112.91 112.96 1h6r h THR 62 Ca 0.14 -0.61 -0.16 0.00 -0.55 0.00 0.00 66.41 65.24 1h6r h THR 62 Cb 0.38 1.33 0.01 0.00 -1.73 0.00 0.00 68.15 68.14 1h6r h THR 62 CO -0.35 0.17 -0.54 0.74 -0.25 0.00 0.00 175.52 175.28 1h6r h THR 63 N 0.00 1.35 0.00 6.82 2.02 -1.58 -3.45 112.91 118.06 1h6r h THR 63 Ca -0.00 -1.84 -0.07 0.00 0.77 0.00 0.00 66.41 65.27 1h6r h THR 63 Cb 0.32 2.14 -0.03 0.00 -1.74 0.00 0.00 68.15 68.84 1h6r h THR 63 CO 0.02 0.56 0.13 0.49 0.37 0.00 0.00 175.52 177.09 1h6r n PHE 64 N -4.18 0.00 0.00 3.16 0.99 -0.39 -5.05 117.46 111.99 1h6r n PHE 64 Ca -0.08 -0.59 0.00 0.00 -0.00 0.00 0.00 57.45 56.79 1h6r n PHE 64 Cb 0.62 -0.84 0.00 0.00 -1.00 0.00 0.00 39.48 38.26 1h6r n PHE 64 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 1h6r n LEU 68 N 2.72 0.00 0.13 4.37 4.77 -1.26 -5.04 117.00 122.68 1h6r n LEU 68 Ca 0.16 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.24 1h6r n LEU 68 Cb 0.36 0.00 0.50 0.00 -2.33 0.00 0.00 43.42 41.94 1h6r n LEU 68 CO 0.18 0.00 0.82 0.00 -1.33 0.00 0.00 177.39 177.06 1h6r n GLN 69 N 0.00 0.15 0.12 3.23 6.02 -1.26 -1.56 117.38 124.08 1h6r n GLN 69 Ca 0.00 0.51 0.11 0.00 -0.01 0.00 0.00 57.00 57.61 1h6r n GLN 69 Cb 0.00 -1.87 0.47 0.00 1.02 0.00 0.00 30.24 29.86 1h6r n GLN 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1h6r n PHE 71 N -2.13 0.48 -2.04 0.00 3.72 -0.60 -4.68 117.46 112.21 1h6r n PHE 71 Ca 0.01 -0.24 -0.37 0.00 -0.05 0.00 0.00 57.45 56.80 1h6r n PHE 71 Cb 0.16 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.72 1h6r n PHE 71 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1h6r s ALA 72 N -1.52 2.81 -0.43 4.37 0.00 -0.75 -4.01 121.76 122.23 1h6r s ALA 72 Ca 0.32 1.08 -0.25 0.00 0.00 0.00 0.00 51.96 53.12 1h6r s ALA 72 Cb 0.17 -3.46 0.02 0.00 0.00 0.00 0.00 23.12 19.85 1h6r s ALA 72 CO 0.24 -1.02 0.87 0.50 0.00 0.00 0.00 175.76 176.34 1h6r s ARG 73 N -2.94 3.57 -0.21 0.00 3.52 -0.11 -4.75 118.95 118.03 1h6r s ARG 73 Ca 0.70 0.16 -0.15 0.00 -0.13 0.00 0.00 55.73 56.31 1h6r s ARG 73 Cb -0.33 -3.90 -0.04 0.00 -1.56 0.00 0.00 34.95 29.12 1h6r s ARG 73 CO 0.38 -1.11 0.36 0.71 -0.81 0.00 0.00 175.30 174.83 1h6r s TYR 74 N 3.50 3.36 1.04 5.12 1.51 -1.26 -0.79 117.35 129.84 1h6r s TYR 74 Ca 0.34 0.55 -0.12 0.00 -1.01 0.00 0.00 57.07 56.83 1h6r s TYR 74 Cb -0.11 -2.48 0.21 0.00 -0.11 0.00 0.00 41.96 39.47 1h6r s TYR 74 CO 0.23 -0.00 1.07 -1.25 -1.11 0.00 0.00 175.55 174.49 1h6r s PRO 75 N 1.28 0.06 0.50 -1.71 0.04 -1.26 -4.85 135.00 129.06 1h6r s PRO 75 Ca 0.17 0.90 0.23 0.00 0.04 0.00 0.00 61.00 62.34 1h6r s PRO 75 Cb -0.15 -1.66 1.31 0.00 0.04 0.00 0.00 34.50 34.04 1h6r s PRO 75 CO 0.07 -3.08 1.97 0.22 0.04 0.00 0.00 177.00 176.22 1h6r h ASP 76 N -2.17 0.11 -0.34 6.66 1.82 -1.99 -0.54 116.42 119.97 1h6r h ASP 76 Ca -0.55 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.10 1h6r h ASP 76 Cb 1.31 -0.02 0.00 0.00 0.68 0.00 0.00 39.33 41.31 1h6r h ASP 76 CO 0.51 0.06 0.00 0.00 -1.61 0.00 0.00 179.24 178.20 1h6r n HIS 77 N -4.40 0.45 -1.25 0.28 1.44 -1.26 -4.16 115.22 106.32 1h6r n HIS 77 Ca 0.12 -0.22 0.08 0.00 -2.01 0.00 0.00 57.72 55.68 1h6r n HIS 77 Cb 0.61 0.00 0.11 0.00 0.12 0.00 0.00 29.99 30.83 1h6r n HIS 77 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 1h6r n MET 78 N 0.78 1.05 0.19 -1.40 2.81 -0.21 -4.82 117.12 115.52 1h6r n MET 78 Ca 0.16 -2.30 0.05 0.00 -1.81 0.00 0.00 57.70 53.80 1h6r n MET 78 Cb 0.41 -1.32 0.49 0.00 -0.71 0.00 0.00 33.22 32.09 1h6r n MET 78 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1h6r h LYS 79 N 0.01 0.09 0.00 0.03 1.79 -1.72 -1.05 116.57 115.73 1h6r h LYS 79 Ca -0.00 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 1h6r h LYS 79 Cb 1.07 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.71 1h6r h LYS 79 CO 0.00 0.22 0.00 -2.13 -1.08 0.00 0.00 179.45 176.46 1h6r n ARG 80 N -4.35 0.49 -0.19 3.15 0.63 -1.26 -3.10 116.66 112.04 1h6r n ARG 80 Ca -0.02 0.04 0.05 0.00 -0.92 0.00 0.00 57.85 57.01 1h6r n ARG 80 Cb 0.22 -1.50 0.15 0.00 0.45 0.00 0.00 32.46 31.78 1h6r n ARG 80 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1h6r n HIS 81 N -1.15 0.46 -3.12 -0.14 8.25 -0.40 -4.59 115.22 114.54 1h6r n HIS 81 Ca 0.13 -0.55 -0.45 0.00 -0.26 0.00 0.00 57.72 56.59 1h6r n HIS 81 Cb 0.12 -0.06 -0.02 0.00 1.12 0.00 0.00 29.99 31.15 1h6r n HIS 81 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1h6r s ASP 82 N -1.12 6.70 0.16 0.41 -1.08 -1.18 -4.44 116.67 116.13 1h6r s ASP 82 Ca 0.23 -2.37 -0.12 0.00 -0.52 0.00 0.00 52.55 49.77 1h6r s ASP 82 Cb 0.13 -2.31 0.05 0.00 -1.46 0.00 0.00 42.92 39.33 1h6r s ASP 82 CO 0.13 -0.83 1.69 0.15 0.52 0.00 0.00 175.17 176.83 1h6r h PHE 83 N 8.31 0.89 -0.13 -5.34 3.57 -1.89 -3.00 116.94 119.35 1h6r h PHE 83 Ca 0.14 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1h6r h PHE 83 Cb 1.03 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.51 1h6r h PHE 83 CO 1.10 0.76 0.09 0.74 -2.23 0.00 0.00 178.31 178.77 1h6r h PHE 84 N 0.76 0.17 -0.02 0.41 -1.00 -1.89 -2.16 116.94 113.22 1h6r h PHE 84 Ca 0.18 0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.84 1h6r h PHE 84 Cb 0.29 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 39.78 1h6r h PHE 84 CO 0.02 0.12 -0.54 0.87 -1.61 0.00 0.00 178.31 177.17 1h6r h LYS 85 N 0.17 0.06 0.00 1.51 1.57 -1.83 -3.10 116.57 114.95 1h6r h LYS 85 Ca 0.05 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1h6r h LYS 85 Cb -0.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1h6r h LYS 85 CO -0.01 0.59 -0.04 0.66 -0.57 0.00 0.00 179.45 180.07 1h6r h SER 86 N 0.05 0.00 0.83 0.86 4.64 -1.24 -1.42 113.55 117.26 1h6r h SER 86 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h6r h SER 86 Cb 0.97 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 1h6r h SER 86 CO 0.07 0.04 -0.00 0.00 -0.87 0.00 0.00 176.83 176.07 1h6r n ALA 87 N -2.25 2.40 -2.24 5.18 0.00 -1.05 -4.59 120.51 117.96 1h6r n ALA 87 Ca -0.02 -0.12 -0.31 0.00 0.00 0.00 0.00 53.44 52.99 1h6r n ALA 87 Cb 0.15 -1.47 -0.04 0.00 0.00 0.00 0.00 19.45 18.08 1h6r n ALA 87 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1h6r s MET 88 N -2.84 3.82 0.20 0.00 1.00 -0.54 -0.71 119.30 120.23 1h6r s MET 88 Ca 0.20 0.43 0.26 0.00 0.00 0.00 0.00 55.69 56.58 1h6r s MET 88 Cb 0.19 -2.46 0.79 0.00 0.00 0.00 0.00 34.83 33.36 1h6r s MET 88 CO 0.50 0.08 1.75 -0.35 0.00 0.00 0.00 175.02 177.01 1h6r n PRO 89 N -0.89 0.25 -0.05 2.03 -0.04 -1.26 -1.22 135.00 133.82 1h6r n PRO 89 Ca 0.02 0.20 0.05 0.00 -0.04 0.00 0.00 63.50 63.73 1h6r n PRO 89 Cb 0.54 -1.79 0.41 0.00 -0.04 0.00 0.00 33.50 32.62 1h6r n PRO 89 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1h6r h GLU 90 N 0.00 0.58 0.00 0.54 4.81 -1.88 -2.50 114.58 116.12 1h6r h GLU 90 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1h6r h GLU 90 Cb 0.73 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.98 1h6r h GLU 90 CO 0.00 0.38 0.00 0.41 -0.73 0.00 0.00 179.01 179.07 1h6r n GLY 91 N -1.47 -3.70 3.15 1.92 0.00 0.11 -4.72 105.19 100.48 1h6r n GLY 91 Ca 0.06 -2.10 -0.09 0.00 0.00 0.00 0.00 46.02 43.88 1h6r n GLY 91 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1h6r s TYR 92 N -0.74 0.75 -0.16 1.61 -0.85 -0.49 -1.01 117.35 116.46 1h6r s TYR 92 Ca 0.00 -1.16 -0.06 0.00 -0.52 0.00 0.00 57.07 55.33 1h6r s TYR 92 Cb 0.00 -0.43 -0.04 0.00 0.38 0.00 0.00 41.96 41.88 1h6r s TYR 92 CO 0.00 -0.51 0.05 0.08 -1.52 0.00 0.00 175.55 173.65 1h6r s VAL 93 N -4.01 4.65 -0.18 -3.49 1.01 0.58 -1.12 120.40 117.83 1h6r s VAL 93 Ca 0.20 -0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.09 1h6r s VAL 93 Cb 0.07 -3.06 0.01 0.00 0.00 0.00 0.00 36.38 33.40 1h6r s VAL 93 CO -0.01 0.50 -0.16 -1.58 0.00 0.00 0.00 175.10 173.85 1h6r s GLN 94 N 0.06 3.10 -0.02 2.72 0.74 0.38 -1.31 119.66 125.33 1h6r s GLN 94 Ca 0.05 -0.78 0.08 0.00 0.05 0.00 0.00 55.36 54.75 1h6r s GLN 94 Cb -0.12 -2.67 -0.02 0.00 1.10 0.00 0.00 33.01 31.30 1h6r s GLN 94 CO 0.01 -0.18 -0.25 -1.21 -0.55 0.00 0.00 175.29 173.11 1h6r s GLU 95 N 1.26 2.11 0.04 1.67 2.02 0.11 -0.47 118.70 125.45 1h6r s GLU 95 Ca 0.04 -0.91 -0.03 0.00 0.02 0.00 0.00 54.97 54.09 1h6r s GLU 95 Cb -0.14 -2.01 -0.02 0.00 0.10 0.00 0.00 34.13 32.06 1h6r s GLU 95 CO -0.09 0.53 0.03 1.03 0.02 0.00 0.00 175.26 176.79 1h6r s ARG 96 N -0.55 0.57 -0.09 1.61 0.52 -0.62 -0.76 118.95 119.62 1h6r s ARG 96 Ca 0.08 -0.92 0.03 0.00 -0.52 0.00 0.00 55.73 54.41 1h6r s ARG 96 Cb -0.10 0.21 0.01 0.00 0.52 0.00 0.00 34.95 35.58 1h6r s ARG 96 CO -0.01 -0.13 -0.19 0.99 0.02 0.00 0.00 175.30 175.99 1h6r s THR 97 N -3.00 1.69 -0.24 0.02 2.01 -0.51 -0.98 115.64 114.63 1h6r s THR 97 Ca -0.02 -0.80 -0.00 0.00 0.31 0.00 0.00 61.69 61.18 1h6r s THR 97 Cb 0.01 -1.49 0.03 0.00 0.01 0.00 0.00 72.50 71.07 1h6r s THR 97 CO -0.07 0.48 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.62 1h6r s ILE 98 N 0.50 2.59 -0.34 1.82 1.01 0.48 -1.13 121.20 126.14 1h6r s ILE 98 Ca -0.17 -1.15 -0.15 0.00 0.00 0.00 0.00 60.65 59.18 1h6r s ILE 98 Cb -0.17 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 39.96 1h6r s ILE 98 CO 0.06 0.20 0.35 -0.36 0.00 0.00 0.00 174.94 175.19 1h6r s PHE 99 N 1.27 3.21 -0.34 3.97 0.40 0.83 -1.47 117.98 125.86 1h6r s PHE 99 Ca -0.01 -0.01 -0.23 0.00 -0.60 0.00 0.00 56.93 56.07 1h6r s PHE 99 Cb -0.17 -2.64 0.01 0.00 0.51 0.00 0.00 43.02 40.73 1h6r s PHE 99 CO -0.06 -0.41 0.79 -0.06 0.70 0.00 0.00 175.22 176.19 1h6r s PHE 100 N 1.99 3.15 0.11 0.36 0.40 -0.55 -0.44 117.98 123.00 1h6r s PHE 100 Ca 0.11 0.69 -0.36 0.00 -0.60 0.00 0.00 56.93 56.77 1h6r s PHE 100 Cb -0.17 -3.33 -0.16 0.00 0.51 0.00 0.00 43.02 39.87 1h6r s PHE 100 CO 0.11 -0.66 1.36 1.17 0.70 0.00 0.00 175.22 177.91 1h6r n LYS 101 N 6.34 1.33 -2.15 0.44 4.81 -0.66 -0.56 118.16 127.72 1h6r n LYS 101 Ca 0.04 0.48 -0.21 0.00 -0.87 0.00 0.00 58.31 57.75 1h6r n LYS 101 Cb 0.48 -2.13 -0.04 0.00 0.02 0.00 0.00 35.03 33.37 1h6r n LYS 101 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1h6r n ASP 102 N 2.61 -5.79 -0.32 3.14 10.43 -1.26 -4.82 116.55 120.55 1h6r n ASP 102 Ca 0.18 0.15 0.00 0.00 2.57 0.00 0.00 54.79 57.69 1h6r n ASP 102 Cb 0.21 -4.90 0.00 0.00 1.84 0.00 0.00 41.12 38.27 1h6r n ASP 102 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 1h6r n ASP 103 N -1.79 0.00 -2.31 -2.24 4.64 0.27 -4.92 116.55 110.20 1h6r n ASP 103 Ca -0.24 -0.32 0.00 0.00 -1.38 0.00 0.00 54.79 52.86 1h6r n ASP 103 Cb 0.69 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.77 1h6r n ASP 103 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1h6r n GLY 104 N 0.00 -1.38 3.07 0.27 0.00 -1.13 -4.59 105.19 101.44 1h6r n GLY 104 Ca 0.00 -1.61 -0.09 0.00 0.00 0.00 0.00 46.02 44.32 1h6r n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h6r s ASN 105 N -1.12 0.22 -0.02 1.61 2.20 -0.77 -1.48 114.94 115.58 1h6r s ASN 105 Ca 0.00 -0.54 0.01 0.00 -0.94 0.00 0.00 52.86 51.39 1h6r s ASN 105 Cb 0.00 0.18 -0.03 0.00 -2.00 0.00 0.00 41.25 39.40 1h6r s ASN 105 CO 0.00 -0.44 -0.01 -0.31 -2.94 0.00 0.00 177.10 173.40 1h6r s TYR 106 N -2.29 3.07 -0.10 1.54 2.02 -0.54 -1.37 117.35 119.69 1h6r s TYR 106 Ca -0.08 0.09 0.03 0.00 -0.37 0.00 0.00 57.07 56.74 1h6r s TYR 106 Cb -0.03 -1.69 0.01 0.00 -0.40 0.00 0.00 41.96 39.84 1h6r s TYR 106 CO -0.03 0.45 -0.19 0.15 -1.57 0.00 0.00 175.55 174.36 1h6r s LYS 107 N -1.40 2.52 0.08 -0.62 1.02 0.29 -0.39 119.74 121.24 1h6r s LYS 107 Ca 0.18 -0.69 0.06 0.00 0.02 0.00 0.00 55.97 55.54 1h6r s LYS 107 Cb -0.11 -2.00 -0.03 0.00 -0.52 0.00 0.00 37.83 35.17 1h6r s LYS 107 CO 0.08 0.06 -0.15 0.95 -0.92 0.00 0.00 175.35 175.37 1h6r s THR 108 N 0.62 1.23 -0.03 2.17 -4.23 -0.15 -0.90 115.64 114.35 1h6r s THR 108 Ca -0.14 -1.35 -0.01 0.00 -1.18 0.00 0.00 61.69 59.02 1h6r s THR 108 Cb -0.16 -1.16 0.03 0.00 1.34 0.00 0.00 72.50 72.54 1h6r s THR 108 CO 0.04 -0.19 0.03 -0.60 -0.54 0.00 0.00 174.62 173.36 1h6r s ARG 109 N -1.77 0.06 0.04 3.99 3.52 -0.44 -1.59 118.95 122.76 1h6r s ARG 109 Ca -0.00 0.21 0.03 0.00 -0.13 0.00 0.00 55.73 55.84 1h6r s ARG 109 Cb -0.10 -0.41 -0.02 0.00 -1.56 0.00 0.00 34.95 32.86 1h6r s ARG 109 CO 0.03 -0.21 -0.10 0.00 -0.81 0.00 0.00 175.30 174.20 1h6r s ALA 110 N 1.40 0.83 -0.16 6.12 0.00 0.38 -0.81 121.76 129.51 1h6r s ALA 110 Ca -0.05 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.19 1h6r s ALA 110 Cb -0.13 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 22.92 1h6r s ALA 110 CO -0.03 0.11 -0.18 -1.21 0.00 0.00 0.00 175.76 174.45 1h6r s GLU 111 N -1.21 3.12 -0.18 0.00 2.02 -0.11 -0.47 118.70 121.87 1h6r s GLU 111 Ca -0.03 -0.79 -0.01 0.00 0.02 0.00 0.00 54.97 54.16 1h6r s GLU 111 Cb -0.08 -2.58 -0.00 0.00 0.10 0.00 0.00 34.13 31.56 1h6r s GLU 111 CO 0.01 -0.06 -0.11 0.08 0.02 0.00 0.00 175.26 175.20 1h6r s VAL 112 N 0.97 2.93 0.22 2.63 1.01 -0.28 -1.45 120.40 126.44 1h6r s VAL 112 Ca -0.03 -0.66 -0.22 0.00 0.00 0.00 0.00 61.98 61.07 1h6r s VAL 112 Cb -0.15 -2.28 0.04 0.00 0.00 0.00 0.00 36.38 34.00 1h6r s VAL 112 CO -0.04 0.48 0.73 -1.59 0.00 0.00 0.00 175.10 174.69 1h6r s LYS 113 N 1.09 1.55 0.24 2.72 -2.85 -0.61 -1.40 119.74 120.48 1h6r s LYS 113 Ca 0.00 -0.80 -0.18 0.00 -1.00 0.00 0.00 55.97 53.99 1h6r s LYS 113 Cb -0.15 0.57 -0.08 0.00 -2.06 0.00 0.00 37.83 36.11 1h6r s LYS 113 CO -0.03 -0.71 0.71 -0.06 0.10 0.00 0.00 175.35 175.37 1h6r s PHE 114 N -3.76 3.59 -0.56 1.78 0.40 -0.94 -0.50 117.98 117.97 1h6r s PHE 114 Ca 0.09 1.33 0.04 0.00 -0.60 0.00 0.00 56.93 57.78 1h6r s PHE 114 Cb -0.04 -2.58 0.16 0.00 0.51 0.00 0.00 43.02 41.07 1h6r s PHE 114 CO 0.01 0.30 0.38 -1.21 0.70 0.00 0.00 175.22 175.40 1h6r s GLU 115 N -2.17 1.83 6.86 0.44 0.41 0.15 -4.92 118.70 121.30 1h6r s GLU 115 Ca 0.45 -2.71 0.00 0.00 -0.41 0.00 0.00 54.97 52.29 1h6r s GLU 115 Cb -0.15 -2.76 0.00 0.00 -1.78 0.00 0.00 34.13 29.44 1h6r s GLU 115 CO 0.20 -1.26 0.00 0.41 -0.49 0.00 0.00 175.26 174.12 1h6r n GLY 116 N 2.63 1.61 0.04 -1.39 0.00 -1.26 -2.92 105.19 103.91 1h6r n GLY 116 Ca 0.18 -0.47 0.13 0.00 0.00 0.00 0.00 46.02 45.86 1h6r n GLY 116 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h6r n ASP 117 N 6.76 0.35 -4.80 1.61 10.43 -1.26 -4.81 116.55 124.84 1h6r n ASP 117 Ca 0.00 0.49 -0.36 0.00 2.57 0.00 0.00 54.79 57.49 1h6r n ASP 117 Cb 0.00 -0.57 -0.07 0.00 1.84 0.00 0.00 41.12 42.32 1h6r n ASP 117 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1h6r s THR 118 N -3.04 5.40 -0.20 -3.53 2.01 -1.15 -4.10 115.64 111.03 1h6r s THR 118 Ca 0.12 0.31 -0.20 0.00 0.31 0.00 0.00 61.69 62.23 1h6r s THR 118 Cb 0.16 -3.49 -0.03 0.00 0.01 0.00 0.00 72.50 69.16 1h6r s THR 118 CO 0.57 0.52 0.61 -0.22 -0.69 0.00 0.00 174.62 175.40 1h6r s LEU 119 N -0.29 4.13 -0.11 4.42 1.98 -0.27 -0.67 118.68 127.86 1h6r s LEU 119 Ca 0.13 0.79 0.01 0.00 -2.89 0.00 0.00 54.13 52.18 1h6r s LEU 119 Cb -0.12 -2.86 -0.01 0.00 0.66 0.00 0.00 46.19 43.86 1h6r s LEU 119 CO 0.03 -0.27 -0.15 -0.69 -1.89 0.00 0.00 176.35 173.37 1h6r s VAL 120 N 1.94 2.88 -0.31 1.68 1.01 0.34 -1.33 120.40 126.60 1h6r s VAL 120 Ca 0.28 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1h6r s VAL 120 Cb -0.16 -2.18 0.07 0.00 0.00 0.00 0.00 36.38 34.12 1h6r s VAL 120 CO 0.10 0.54 0.00 0.21 0.00 0.00 0.00 175.10 175.95 1h6r s ASN 121 N 0.21 4.77 -0.23 3.32 2.47 0.01 -1.57 114.94 123.92 1h6r s ASN 121 Ca -0.09 -1.63 -0.07 0.00 0.42 0.00 0.00 52.86 51.48 1h6r s ASN 121 Cb -0.16 -1.66 -0.03 0.00 -1.45 0.00 0.00 41.25 37.96 1h6r s ASN 121 CO 0.06 -0.31 0.06 -0.13 -3.72 0.00 0.00 177.10 173.06 1h6r s ARG 122 N 1.10 3.71 0.04 0.43 0.52 -0.53 -1.12 118.95 123.11 1h6r s ARG 122 Ca -0.01 -0.46 0.06 0.00 -0.52 0.00 0.00 55.73 54.81 1h6r s ARG 122 Cb -0.20 -3.28 -0.02 0.00 0.52 0.00 0.00 34.95 31.97 1h6r s ARG 122 CO -0.04 -0.07 -0.17 0.42 0.02 0.00 0.00 175.30 175.45 1h6r s ILE 123 N 1.30 1.36 -0.07 1.52 1.01 0.73 -0.93 121.20 126.12 1h6r s ILE 123 Ca 0.05 -1.10 0.04 0.00 0.00 0.00 0.00 60.65 59.64 1h6r s ILE 123 Cb -0.15 -1.21 -0.00 0.00 0.01 0.00 0.00 42.46 41.11 1h6r s ILE 123 CO 0.03 0.08 -0.21 -1.61 0.00 0.00 0.00 174.94 173.24 1h6r s GLU 124 N -1.18 2.38 -0.05 2.79 2.02 0.01 -1.39 118.70 123.28 1h6r s GLU 124 Ca 0.04 -0.74 0.03 0.00 0.02 0.00 0.00 54.97 54.32 1h6r s GLU 124 Cb -0.08 -1.93 0.01 0.00 0.10 0.00 0.00 34.13 32.23 1h6r s GLU 124 CO 0.02 0.22 -0.11 -1.17 0.02 0.00 0.00 175.26 174.23 1h6r s LEU 125 N 0.20 1.70 -0.11 1.80 0.20 -0.19 -1.33 118.68 120.95 1h6r s LEU 125 Ca -0.11 -0.26 0.01 0.00 0.69 0.00 0.00 54.13 54.46 1h6r s LEU 125 Cb -0.15 -0.74 0.02 0.00 -0.43 0.00 0.00 46.19 44.89 1h6r s LEU 125 CO 0.05 0.05 -0.13 -0.75 -0.29 0.00 0.00 176.35 175.29 1h6r s LYS 126 N 0.44 1.97 -0.06 1.98 2.20 -0.08 -1.63 119.74 124.57 1h6r s LYS 126 Ca -0.09 -0.46 0.04 0.00 -0.36 0.00 0.00 55.97 55.10 1h6r s LYS 126 Cb -0.13 -1.76 -0.02 0.00 -1.51 0.00 0.00 37.83 34.41 1h6r s LYS 126 CO 0.02 -0.12 -0.16 0.20 -0.36 0.00 0.00 175.35 174.93 1h6r s GLY 127 N 1.18 1.49 0.09 5.54 0.00 0.13 -0.55 107.32 115.20 1h6r s GLY 127 Ca -0.03 -0.99 -0.01 0.00 0.00 0.00 0.00 44.72 43.69 1h6r s GLY 127 CO -0.04 -0.70 0.01 -0.26 0.00 0.00 0.00 173.10 172.12 1h6r s ILE 128 N -0.55 0.17 -1.88 0.90 -4.36 -0.47 -1.19 121.20 113.82 1h6r s ILE 128 Ca 0.07 -1.84 0.00 0.00 -0.26 0.00 0.00 60.65 58.63 1h6r s ILE 128 Cb -0.11 -1.75 0.00 0.00 1.25 0.00 0.00 42.46 41.85 1h6r s ILE 128 CO 0.01 -0.75 0.00 0.47 0.24 0.00 0.00 174.94 174.91 1h6r n ASP 129 N 0.02 -5.82 -4.79 4.36 8.00 -1.26 -1.85 116.55 115.20 1h6r n ASP 129 Ca -0.10 0.10 -0.36 0.00 0.71 0.00 0.00 54.79 55.14 1h6r n ASP 129 Cb 0.62 -4.90 -0.06 0.00 -0.02 0.00 0.00 41.12 36.76 1h6r n ASP 129 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1h6r s PHE 130 N -2.98 3.51 0.05 1.24 0.40 -1.26 -2.84 117.98 116.10 1h6r s PHE 130 Ca 0.00 1.71 -0.26 0.00 -0.60 0.00 0.00 56.93 57.78 1h6r s PHE 130 Cb 0.00 -2.93 -0.05 0.00 0.51 0.00 0.00 43.02 40.55 1h6r s PHE 130 CO 0.00 -0.01 0.80 0.15 0.70 0.00 0.00 175.22 176.86 1h6r s LYS 131 N -2.49 4.53 0.31 0.44 1.02 -1.26 -4.88 119.74 117.41 1h6r s LYS 131 Ca 0.55 1.13 0.01 0.00 0.02 0.00 0.00 55.97 57.69 1h6r s LYS 131 Cb -0.16 -3.37 0.56 0.00 -0.52 0.00 0.00 37.83 34.34 1h6r s LYS 131 CO 0.21 0.26 1.91 0.93 -0.92 0.00 0.00 175.35 177.74 1h6r h GLU 132 N 5.69 0.96 -0.58 1.68 5.08 -1.96 -1.04 114.58 124.41 1h6r h GLU 132 Ca -0.44 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 1h6r h GLU 132 Cb 1.21 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1h6r h GLU 132 CO 0.71 0.64 0.00 -0.40 -1.00 0.00 0.00 179.01 178.96 1h6r n ASP 133 N -4.50 5.45 -4.27 1.42 3.85 -1.26 -3.84 116.55 113.39 1h6r n ASP 133 Ca 0.14 -2.83 -0.30 0.00 -0.71 0.00 0.00 54.79 51.09 1h6r n ASP 133 Cb 0.22 -0.66 0.17 0.00 -1.35 0.00 0.00 41.12 39.50 1h6r n ASP 133 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 1h6r s GLY 134 N -0.88 1.72 0.48 6.12 0.00 -0.39 -4.79 107.32 109.58 1h6r s GLY 134 Ca 0.53 -1.05 0.26 0.00 0.00 0.00 0.00 44.72 44.46 1h6r s GLY 134 CO 0.18 -0.33 1.94 3.43 0.00 0.00 0.00 173.10 178.32 1h6r h ASN 135 N -1.61 0.00 0.00 1.64 2.35 -1.93 -0.21 115.58 115.83 1h6r h ASN 135 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 1h6r h ASN 135 Cb 1.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.63 1h6r h ASN 135 CO 0.44 0.17 -0.05 0.40 -1.65 0.00 0.00 177.43 176.74 1h6r h ILE 136 N 0.00 0.00 0.00 2.81 5.03 -1.93 -1.57 117.51 121.86 1h6r h ILE 136 Ca -0.00 -0.33 -0.02 0.00 -0.12 0.00 0.00 64.86 64.39 1h6r h ILE 136 Cb 0.56 0.00 -0.00 0.00 -3.03 0.00 0.00 36.82 34.35 1h6r h ILE 136 CO 0.02 0.00 -0.12 -0.07 -0.68 0.00 0.00 178.15 177.31 1h6r h LEU 137 N -0.33 0.00 -0.58 1.44 3.38 -1.74 -1.42 115.31 116.07 1h6r h LEU 137 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h6r h LEU 137 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1h6r h LEU 137 CO 0.00 0.12 0.00 0.61 0.09 0.00 0.00 178.44 179.26 1h6r n GLY 138 N -0.82 -0.37 3.82 0.83 0.00 -0.09 -4.95 105.19 103.61 1h6r n GLY 138 Ca -0.02 -0.32 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 1h6r n GLY 138 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1h6r n HIS 139 N -0.27 -1.76 -0.30 1.61 8.25 -0.53 -4.89 115.22 117.33 1h6r n HIS 139 Ca 0.19 0.47 0.08 0.00 -0.26 0.00 0.00 57.72 58.20 1h6r n HIS 139 Cb 0.23 -3.41 0.23 0.00 1.12 0.00 0.00 29.99 28.17 1h6r n HIS 139 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1h6r n LYS 140 N -4.38 2.86 -3.54 -0.41 5.02 -0.60 -4.99 118.16 112.13 1h6r n LYS 140 Ca -0.15 -2.36 -0.37 0.00 -2.02 0.00 0.00 58.31 53.40 1h6r n LYS 140 Cb 0.61 -1.44 -0.06 0.00 -0.02 0.00 0.00 35.03 34.13 1h6r n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1h6r s LEU 141 N -1.09 4.45 0.57 -0.35 1.43 -1.25 -4.17 118.68 118.26 1h6r s LEU 141 Ca 0.36 0.90 -0.18 0.00 -1.03 0.00 0.00 54.13 54.17 1h6r s LEU 141 Cb 0.19 -2.62 -0.04 0.00 0.03 0.00 0.00 46.19 43.75 1h6r s LEU 141 CO 0.23 0.30 1.10 -1.61 0.23 0.00 0.00 176.35 176.60 1h6r s GLU 142 N -1.23 3.28 -1.24 1.70 2.02 -0.28 -4.92 118.70 118.03 1h6r s GLU 142 Ca 0.25 1.45 -0.11 0.00 0.02 0.00 0.00 54.97 56.58 1h6r s GLU 142 Cb -0.16 -2.01 0.18 0.00 0.10 0.00 0.00 34.13 32.24 1h6r s GLU 142 CO 0.13 -0.88 1.66 0.98 0.02 0.00 0.00 175.26 177.18 1h6r n TYR 143 N -1.65 3.81 -3.74 1.61 9.36 -1.26 -4.79 117.16 120.51 1h6r n TYR 143 Ca 0.10 -3.04 -0.09 0.00 3.32 0.00 0.00 57.90 58.19 1h6r n TYR 143 Cb 0.52 -2.01 0.00 0.00 -0.63 0.00 0.00 39.34 37.22 1h6r n TYR 143 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 1h6r n ASN 144 N 4.47 -1.50 -3.61 2.98 0.23 -1.26 -4.82 115.26 111.75 1h6r n ASN 144 Ca 0.38 -2.32 -0.15 0.00 -0.53 0.00 0.00 54.58 51.96 1h6r n ASN 144 Cb 0.39 2.57 -0.07 0.00 -2.08 0.00 0.00 39.78 40.59 1h6r n ASN 144 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1h6r s TYR 145 N -3.63 -0.75 0.40 -2.53 5.04 -1.26 -4.88 117.35 109.75 1h6r s TYR 145 Ca 0.16 1.72 0.01 0.00 -2.44 0.00 0.00 57.07 56.51 1h6r s TYR 145 Cb -0.03 0.30 -0.02 0.00 0.35 0.00 0.00 41.96 42.56 1h6r s TYR 145 CO 0.12 -0.43 0.62 -0.80 -1.34 0.00 0.00 175.55 173.72 1h6r s ASN 146 N 0.01 6.03 -0.01 4.32 0.01 -1.26 -4.76 114.94 119.29 1h6r s ASN 146 Ca -0.03 0.35 0.00 0.00 -0.71 0.00 0.00 52.86 52.47 1h6r s ASN 146 Cb -0.04 -1.73 -0.04 0.00 0.41 0.00 0.00 41.25 39.85 1h6r s ASN 146 CO 0.03 -0.52 0.05 -0.44 -1.51 0.00 0.00 177.10 174.71 1h6r s SER 147 N -4.14 5.49 -0.01 -1.22 0.01 -1.26 -4.47 113.70 108.10 1h6r s SER 147 Ca 0.45 0.10 -0.30 0.00 1.31 0.00 0.00 55.95 57.52 1h6r s SER 147 Cb -0.10 -1.54 0.11 0.00 0.21 0.00 0.00 66.02 64.71 1h6r s SER 147 CO 0.37 0.28 1.28 -1.38 0.41 0.00 0.00 173.24 174.20 1h6r s HIS 148 N -1.14 -0.02 -0.02 2.43 -3.43 -0.83 -5.01 115.29 107.26 1h6r s HIS 148 Ca 0.21 -0.10 0.06 0.00 -0.80 0.00 0.00 55.06 54.43 1h6r s HIS 148 Cb -0.12 0.56 -0.03 0.00 -1.43 0.00 0.00 32.58 31.56 1h6r s HIS 148 CO 0.12 -0.30 -0.18 0.00 -2.00 0.00 0.00 174.74 172.38 1h6r s VAL 150 N -0.77 3.62 -0.35 0.00 -7.23 0.96 -4.92 120.40 111.71 1h6r s VAL 150 Ca 0.12 -1.47 -0.13 0.00 -1.81 0.00 0.00 61.98 58.69 1h6r s VAL 150 Cb -0.10 -2.81 -0.01 0.00 0.56 0.00 0.00 36.38 34.01 1h6r s VAL 150 CO 0.02 -0.11 0.24 -0.47 -0.31 0.00 0.00 175.10 174.46 1h6r s TYR 151 N -1.73 3.23 -0.16 2.82 5.04 -1.26 -0.99 117.35 124.30 1h6r s TYR 151 Ca 0.27 -0.32 -0.12 0.00 -2.44 0.00 0.00 57.07 54.46 1h6r s TYR 151 Cb -0.09 -2.48 -0.05 0.00 0.35 0.00 0.00 41.96 39.69 1h6r s TYR 151 CO 0.18 -0.41 0.25 0.42 -1.34 0.00 0.00 175.55 174.65 1h6r s ILE 152 N 1.70 5.33 0.06 3.14 -1.09 0.12 -4.41 121.20 126.06 1h6r s ILE 152 Ca 0.06 0.45 0.04 0.00 -2.23 0.00 0.00 60.65 58.97 1h6r s ILE 152 Cb -0.18 -3.58 -0.03 0.00 -1.58 0.00 0.00 42.46 37.10 1h6r s ILE 152 CO 0.10 0.43 -0.12 0.68 -1.23 0.00 0.00 174.94 174.80 1h6r s VAL 153 N 0.25 0.90 0.51 2.92 -7.23 -0.93 -1.78 120.40 115.04 1h6r s VAL 153 Ca 0.15 -1.20 -0.17 0.00 -1.81 0.00 0.00 61.98 58.94 1h6r s VAL 153 Cb -0.13 -0.90 -0.08 0.00 0.56 0.00 0.00 36.38 35.84 1h6r s VAL 153 CO 0.03 -0.27 0.98 0.00 -0.31 0.00 0.00 175.10 175.53 1h6r s ALA 154 N -1.28 3.06 -0.40 1.32 0.00 -1.25 -0.86 121.76 122.34 1h6r s ALA 154 Ca -0.05 0.21 0.02 0.00 0.00 0.00 0.00 51.96 52.14 1h6r s ALA 154 Cb -0.10 -3.12 0.12 0.00 0.00 0.00 0.00 23.12 20.01 1h6r s ALA 154 CO 0.02 -0.22 0.16 0.34 0.00 0.00 0.00 175.76 176.05 1h6r s ASP 155 N -2.98 4.19 0.31 0.00 -1.08 0.39 -4.76 116.67 112.73 1h6r s ASP 155 Ca 0.59 -2.34 -0.00 0.00 -0.52 0.00 0.00 52.55 50.28 1h6r s ASP 155 Cb -0.10 -1.28 0.50 0.00 -1.46 0.00 0.00 42.92 40.58 1h6r s ASP 155 CO 0.30 -0.33 1.92 0.11 0.52 0.00 0.00 175.17 177.69 1h6r h LYS 156 N 7.25 0.88 -0.83 4.34 1.57 -1.96 -0.31 116.57 127.51 1h6r h LYS 156 Ca -0.06 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 1h6r h LYS 156 Cb 0.97 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 33.07 1h6r h LYS 156 CO 0.53 0.67 0.45 1.96 -0.57 0.00 0.00 179.45 182.49 1h6r h GLN 157 N 0.88 1.16 -0.02 3.15 4.20 -1.95 -2.41 115.11 120.13 1h6r h GLN 157 Ca 0.22 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1h6r h GLN 157 Cb 0.06 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.62 1h6r h GLN 157 CO -0.03 0.85 -0.04 1.63 -0.67 0.00 0.00 178.83 180.57 1h6r n LYS 158 N -4.39 1.69 -3.74 1.46 4.76 -1.06 -4.95 118.16 111.93 1h6r n LYS 158 Ca 0.08 -1.10 -0.25 0.00 -2.87 0.00 0.00 58.31 54.17 1h6r n LYS 158 Cb 0.10 -1.48 0.04 0.00 -1.84 0.00 0.00 35.03 31.85 1h6r n LYS 158 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1h6r n ASN 159 N 0.30 -3.60 0.00 4.39 5.15 -0.20 -4.75 115.26 116.55 1h6r n ASN 159 Ca 0.17 -0.74 0.00 0.00 -0.60 0.00 0.00 54.58 53.41 1h6r n ASN 159 Cb 0.40 -4.26 0.00 0.00 -0.53 0.00 0.00 39.78 35.39 1h6r n ASN 159 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1h6r n GLY 160 N -1.66 3.93 3.31 8.20 0.00 -0.77 -4.24 105.19 113.96 1h6r n GLY 160 Ca -0.11 -0.70 -0.16 0.00 0.00 0.00 0.00 46.02 45.05 1h6r n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1h6r s ILE 161 N -0.71 1.20 0.05 -0.61 -5.25 -0.71 -0.46 121.20 114.71 1h6r s ILE 161 Ca 0.00 -2.07 0.02 0.00 -0.99 0.00 0.00 60.65 57.61 1h6r s ILE 161 Cb 0.00 -2.12 -0.03 0.00 2.95 0.00 0.00 42.46 43.26 1h6r s ILE 161 CO 0.00 -0.52 -0.08 -0.54 -1.79 0.00 0.00 174.94 172.01 1h6r s LYS 162 N -3.79 0.56 -0.15 0.37 1.02 -0.04 -1.22 119.74 116.50 1h6r s LYS 162 Ca 0.23 -0.82 -0.13 0.00 0.02 0.00 0.00 55.97 55.27 1h6r s LYS 162 Cb 0.04 -0.30 0.04 0.00 -0.52 0.00 0.00 37.83 37.09 1h6r s LYS 162 CO 0.05 0.05 0.40 0.08 -0.92 0.00 0.00 175.35 175.01 1h6r s VAL 163 N -1.58 -0.00 -0.09 3.17 1.01 -0.54 -2.19 120.40 120.17 1h6r s VAL 163 Ca -0.08 0.01 0.01 0.00 0.00 0.00 0.00 61.98 61.93 1h6r s VAL 163 Cb -0.09 -0.57 0.02 0.00 0.00 0.00 0.00 36.38 35.74 1h6r s VAL 163 CO -0.00 0.01 -0.11 0.21 0.00 0.00 0.00 175.10 175.20 1h6r s ASN 164 N 0.38 2.08 0.15 3.32 3.04 -1.26 -0.27 114.94 122.38 1h6r s ASN 164 Ca -0.01 -0.33 -0.15 0.00 0.04 0.00 0.00 52.86 52.41 1h6r s ASN 164 Cb -0.04 -0.90 0.02 0.00 -1.54 0.00 0.00 41.25 38.80 1h6r s ASN 164 CO -0.01 -0.03 0.40 0.72 -3.04 0.00 0.00 177.10 175.14 1h6r s PHE 165 N 1.13 -0.06 -0.08 0.43 -0.12 -0.60 -4.66 117.98 114.01 1h6r s PHE 165 Ca -0.05 -0.28 0.04 0.00 -0.05 0.00 0.00 56.93 56.58 1h6r s PHE 165 Cb -0.14 0.22 -0.01 0.00 -0.63 0.00 0.00 43.02 42.45 1h6r s PHE 165 CO -0.02 -0.75 -0.19 0.15 -0.05 0.00 0.00 175.22 174.36 1h6r s LYS 166 N -3.85 2.79 -0.10 1.99 1.02 -1.26 -0.08 119.74 120.24 1h6r s LYS 166 Ca 0.07 -0.79 -0.03 0.00 0.02 0.00 0.00 55.97 55.23 1h6r s LYS 166 Cb 0.02 -2.35 -0.03 0.00 -0.52 0.00 0.00 37.83 34.94 1h6r s LYS 166 CO -0.08 0.39 0.03 0.42 -0.92 0.00 0.00 175.35 175.19 1h6r s ILE 167 N -0.14 4.52 -0.27 2.17 -1.09 -0.22 -4.96 121.20 121.21 1h6r s ILE 167 Ca -0.03 -0.16 -0.01 0.00 -2.23 0.00 0.00 60.65 58.22 1h6r s ILE 167 Cb -0.14 -2.92 0.04 0.00 -1.58 0.00 0.00 42.46 37.86 1h6r s ILE 167 CO 0.04 0.60 -0.05 -0.13 -1.23 0.00 0.00 174.94 174.17 1h6r s ARG 168 N -0.83 2.53 -0.24 2.79 0.52 -1.26 -0.65 118.95 121.82 1h6r s ARG 168 Ca 0.13 -1.18 -0.19 0.00 -0.52 0.00 0.00 55.73 53.97 1h6r s ARG 168 Cb -0.12 -3.04 -0.03 0.00 0.52 0.00 0.00 34.95 32.29 1h6r s ARG 168 CO 0.02 -0.53 0.55 -1.01 0.02 0.00 0.00 175.30 174.36 1h6r s HIS 169 N 1.24 3.30 0.45 -0.53 3.76 -0.34 -4.69 115.29 118.49 1h6r s HIS 169 Ca -0.04 0.73 -0.23 0.00 -0.15 0.00 0.00 55.06 55.36 1h6r s HIS 169 Cb -0.19 -2.74 -0.08 0.00 1.11 0.00 0.00 32.58 30.69 1h6r s HIS 169 CO -0.03 -0.24 1.17 -0.80 -0.85 0.00 0.00 174.74 173.99 1h6r s ASN 170 N 1.41 6.23 0.24 1.40 0.01 -1.26 -0.41 114.94 122.56 1h6r s ASN 170 Ca 0.23 2.33 0.11 0.00 -0.71 0.00 0.00 52.86 54.83 1h6r s ASN 170 Cb -0.16 -2.61 -0.05 0.00 0.41 0.00 0.00 41.25 38.85 1h6r s ASN 170 CO 0.09 -0.88 -0.20 -0.63 -1.51 0.00 0.00 177.10 173.97 1h6r s ILE 171 N -1.51 2.29 0.11 0.60 1.01 -0.40 -1.13 121.20 122.17 1h6r s ILE 171 Ca 0.62 -2.26 -0.33 0.00 0.00 0.00 0.00 60.65 58.68 1h6r s ILE 171 Cb -0.30 -2.19 -0.13 0.00 0.01 0.00 0.00 42.46 39.86 1h6r s ILE 171 CO 0.36 -0.36 1.57 -0.33 0.00 0.00 0.00 174.94 176.18 1h6r h GLU 172 N 2.60 -0.72 0.00 2.79 3.07 -1.85 -1.90 114.58 118.57 1h6r h GLU 172 Ca -0.41 0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.50 1h6r h GLU 172 Cb 1.24 0.16 0.00 0.00 -0.84 0.00 0.00 28.75 29.31 1h6r h GLU 172 CO 0.57 -0.48 0.03 -0.40 -1.40 0.00 0.00 179.01 177.33 1h6r n ASP 173 N -5.49 0.00 0.00 1.42 3.85 -1.26 -4.71 116.55 110.36 1h6r n ASP 173 Ca -0.08 0.11 0.00 0.00 -0.71 0.00 0.00 54.79 54.11 1h6r n ASP 173 Cb 0.41 -0.11 0.00 0.00 -1.35 0.00 0.00 41.12 40.07 1h6r n ASP 173 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1h6r n GLY 174 N -1.03 1.41 3.37 6.12 0.00 -0.71 -5.06 105.19 109.28 1h6r n GLY 174 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1h6r n GLY 174 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1h6r n SER 175 N 0.00 -0.41 -4.15 1.61 3.41 -1.26 -4.77 113.62 108.05 1h6r n SER 175 Ca 0.00 -1.35 -0.12 0.00 -0.26 0.00 0.00 58.87 57.14 1h6r n SER 175 Cb 0.00 -0.91 -0.11 0.00 -0.26 0.00 0.00 64.21 62.94 1h6r n SER 175 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1h6r s VAL 176 N -3.40 0.75 -0.27 -3.33 -7.23 -1.26 -1.28 120.40 104.38 1h6r s VAL 176 Ca 0.66 -1.68 -0.04 0.00 -1.81 0.00 0.00 61.98 59.12 1h6r s VAL 176 Cb -0.03 -1.37 0.02 0.00 0.56 0.00 0.00 36.38 35.56 1h6r s VAL 176 CO 0.48 -0.68 0.01 -1.58 -0.31 0.00 0.00 175.10 173.02 1h6r s GLN 177 N -3.06 2.99 0.26 4.82 2.00 0.46 -4.94 119.66 122.19 1h6r s GLN 177 Ca 0.06 -0.90 -0.29 0.00 -2.00 0.00 0.00 55.36 52.22 1h6r s GLN 177 Cb -0.00 -3.18 -0.09 0.00 0.80 0.00 0.00 33.01 30.53 1h6r s GLN 177 CO -0.02 -0.41 0.96 -0.51 -0.50 0.00 0.00 175.29 174.80 1h6r s LEU 178 N 1.42 4.58 -0.28 3.68 1.43 -1.26 -1.19 118.68 127.05 1h6r s LEU 178 Ca 0.02 1.96 -0.01 0.00 -1.03 0.00 0.00 54.13 55.07 1h6r s LEU 178 Cb -0.17 -3.69 0.09 0.00 0.03 0.00 0.00 46.19 42.46 1h6r s LEU 178 CO -0.01 0.09 0.08 0.00 0.23 0.00 0.00 176.35 176.73 1h6r s ALA 179 N -1.26 1.49 -0.39 4.21 0.00 0.18 -1.65 121.76 124.35 1h6r s ALA 179 Ca 0.43 -1.49 -0.25 0.00 0.00 0.00 0.00 51.96 50.65 1h6r s ALA 179 Cb -0.25 -1.54 0.02 0.00 0.00 0.00 0.00 23.12 21.35 1h6r s ALA 179 CO 0.31 -1.55 0.90 0.34 0.00 0.00 0.00 175.76 175.77 1h6r s ASP 180 N 1.63 6.62 -0.17 0.00 2.15 0.42 -1.06 116.67 126.27 1h6r s ASP 180 Ca 0.07 0.44 -0.13 0.00 0.43 0.00 0.00 52.55 53.36 1h6r s ASP 180 Cb -0.17 -2.45 -0.05 0.00 -0.30 0.00 0.00 42.92 39.95 1h6r s ASP 180 CO -0.21 -0.87 0.28 -1.00 -0.17 0.00 0.00 175.17 173.20 1h6r s HIS 181 N 3.46 3.45 -0.17 -5.34 3.76 0.88 -0.12 115.29 121.22 1h6r s HIS 181 Ca 0.37 0.57 0.01 0.00 -0.15 0.00 0.00 55.06 55.85 1h6r s HIS 181 Cb -0.12 -2.33 0.02 0.00 1.11 0.00 0.00 32.58 31.27 1h6r s HIS 181 CO 0.20 0.24 -0.16 0.71 -0.85 0.00 0.00 174.74 174.87 1h6r s TYR 182 N 0.48 2.48 0.00 1.40 1.51 -0.28 -1.56 117.35 121.38 1h6r s TYR 182 Ca 0.16 -1.46 0.06 0.00 -1.01 0.00 0.00 57.07 54.82 1h6r s TYR 182 Cb -0.13 -1.75 -0.02 0.00 -0.11 0.00 0.00 41.96 39.96 1h6r s TYR 182 CO 0.03 -0.74 -0.18 -1.14 -1.11 0.00 0.00 175.55 172.41 1h6r s GLN 183 N 1.39 1.38 -0.01 -0.62 0.74 0.63 -1.42 119.66 121.74 1h6r s GLN 183 Ca 0.04 -0.70 0.00 0.00 0.05 0.00 0.00 55.36 54.75 1h6r s GLN 183 Cb -0.13 -1.37 0.00 0.00 1.10 0.00 0.00 33.01 32.62 1h6r s GLN 183 CO -0.11 0.37 -0.01 1.14 -0.55 0.00 0.00 175.29 176.13 1h6r s GLN 184 N -0.63 0.10 -0.03 1.67 -2.07 0.06 -1.47 119.66 117.29 1h6r s GLN 184 Ca 0.06 -0.01 0.05 0.00 -1.82 0.00 0.00 55.36 53.65 1h6r s GLN 184 Cb -0.07 -0.15 -0.01 0.00 -1.09 0.00 0.00 33.01 31.69 1h6r s GLN 184 CO -0.00 -0.01 -0.19 -0.80 -1.32 0.00 0.00 175.29 172.97 1h6r s ASN 185 N 0.19 2.33 0.02 12.60 -0.87 -0.36 -0.71 114.94 128.14 1h6r s ASN 185 Ca -0.02 -0.37 0.01 0.00 -1.57 0.00 0.00 52.86 50.91 1h6r s ASN 185 Cb -0.03 -0.43 -0.02 0.00 -0.02 0.00 0.00 41.25 40.76 1h6r s ASN 185 CO -0.01 0.21 -0.04 0.42 -2.57 0.00 0.00 177.10 175.12 1h6r s THR 186 N -0.27 0.19 0.59 1.60 -4.23 -0.43 -1.73 115.64 111.38 1h6r s THR 186 Ca 0.03 -0.77 -0.17 0.00 -1.18 0.00 0.00 61.69 59.60 1h6r s THR 186 Cb -0.09 -0.30 -0.03 0.00 1.34 0.00 0.00 72.50 73.42 1h6r s THR 186 CO 0.01 -0.37 1.10 -2.16 -0.54 0.00 0.00 174.62 172.66 1h6r s PRO 187 N -1.19 3.17 -0.14 3.99 0.04 -1.26 -0.31 135.00 139.30 1h6r s PRO 187 Ca -0.11 1.42 -0.17 0.00 0.04 0.00 0.00 61.00 62.18 1h6r s PRO 187 Cb -0.08 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 1h6r s PRO 187 CO -0.01 -0.96 0.43 0.42 0.04 0.00 0.00 177.00 176.92 1h6r s ILE 188 N -2.14 5.21 0.00 0.56 1.01 -0.18 -4.70 121.20 120.96 1h6r s ILE 188 Ca 0.68 0.84 0.00 0.00 0.00 0.00 0.00 60.65 62.17 1h6r s ILE 188 Cb -0.20 -3.77 0.00 0.00 0.01 0.00 0.00 42.46 38.50 1h6r s ILE 188 CO 0.34 0.32 0.00 0.61 0.00 0.00 0.00 174.94 176.21 1h6r n GLY 189 N 3.40 -0.03 1.06 6.18 0.00 -1.26 -4.59 105.19 109.94 1h6r n GLY 189 Ca -0.08 -1.84 0.08 0.00 0.00 0.00 0.00 46.02 44.18 1h6r n GLY 189 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1h6r n ASP 190 N -0.73 4.15 -4.19 1.61 5.68 -1.26 -5.00 116.55 116.80 1h6r n ASP 190 Ca 0.00 -2.91 -0.30 0.00 -0.50 0.00 0.00 54.79 51.08 1h6r n ASP 190 Cb 0.00 -0.55 0.20 0.00 -1.14 0.00 0.00 41.12 39.63 1h6r n ASP 190 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1h6r s GLY 191 N -1.65 1.63 0.42 6.12 0.00 -1.26 -5.02 107.32 107.56 1h6r s GLY 191 Ca 0.43 -0.88 -0.23 0.00 0.00 0.00 0.00 44.72 44.04 1h6r s GLY 191 CO 0.11 -0.12 1.03 2.56 0.00 0.00 0.00 173.10 176.68 1h6r s PRO 192 N -5.48 4.10 0.04 2.90 0.04 -1.26 -5.06 135.00 130.28 1h6r s PRO 192 Ca 0.70 1.43 0.01 0.00 0.04 0.00 0.00 61.00 63.18 1h6r s PRO 192 Cb -0.10 -2.41 -0.03 0.00 0.04 0.00 0.00 34.50 32.00 1h6r s PRO 192 CO 0.55 -0.18 -0.05 0.14 0.04 0.00 0.00 177.00 177.49 1h6r s VAL 193 N -1.78 0.33 -0.41 -0.36 -7.23 -1.26 -4.58 120.40 105.11 1h6r s VAL 193 Ca 0.60 -1.27 -0.20 0.00 -1.81 0.00 0.00 61.98 59.30 1h6r s VAL 193 Cb -0.19 -0.80 0.02 0.00 0.56 0.00 0.00 36.38 35.97 1h6r s VAL 193 CO 0.24 -0.61 0.59 -0.76 -0.31 0.00 0.00 175.10 174.24 1h6r s LEU 194 N -1.99 4.52 -0.13 1.32 1.43 -1.26 -5.03 118.68 117.53 1h6r s LEU 194 Ca -0.06 -0.31 -0.20 0.00 -1.03 0.00 0.00 54.13 52.53 1h6r s LEU 194 Cb -0.04 -2.65 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 1h6r s LEU 194 CO -0.03 -0.68 0.55 -0.76 0.23 0.00 0.00 176.35 175.66 1h6r s LEU 195 N 2.62 4.25 0.48 1.79 1.43 -1.26 -3.32 118.68 124.66 1h6r s LEU 195 Ca 0.20 0.88 -0.06 0.00 -1.03 0.00 0.00 54.13 54.13 1h6r s LEU 195 Cb -0.15 -2.81 -0.04 0.00 0.03 0.00 0.00 46.19 43.22 1h6r s LEU 195 CO 0.17 -0.09 0.79 -2.16 0.23 0.00 0.00 176.35 175.28 1h6r s PRO 196 N 0.99 3.56 0.66 1.29 0.04 -1.26 -4.87 135.00 135.40 1h6r s PRO 196 Ca 0.29 0.22 -0.12 0.00 0.04 0.00 0.00 61.00 61.43 1h6r s PRO 196 Cb -0.16 -2.38 -0.01 0.00 0.04 0.00 0.00 34.50 31.99 1h6r s PRO 196 CO 0.12 -0.20 1.05 -0.51 0.04 0.00 0.00 177.00 177.50 1h6r s ASP 197 N -4.05 5.70 0.23 6.66 1.01 -1.26 -3.88 116.67 121.08 1h6r s ASP 197 Ca 0.48 1.59 -0.31 0.00 0.71 0.00 0.00 52.55 55.02 1h6r s ASP 197 Cb -0.10 -2.49 -0.14 0.00 1.01 0.00 0.00 42.92 41.19 1h6r s ASP 197 CO 0.44 -1.23 1.28 0.59 0.21 0.00 0.00 175.17 176.46 1h6r n ASN 198 N -2.83 2.18 -2.11 0.27 5.03 -1.26 -4.83 115.26 111.71 1h6r n ASN 198 Ca 0.07 1.15 -0.06 0.00 0.87 0.00 0.00 54.58 56.62 1h6r n ASN 198 Cb 0.54 -1.35 0.02 0.00 -1.02 0.00 0.00 39.78 37.96 1h6r n ASN 198 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1h6r n HIS 199 N 1.49 -1.82 -4.44 3.10 1.44 -0.74 -4.73 115.22 109.52 1h6r n HIS 199 Ca 0.12 -1.17 -0.30 0.00 -2.01 0.00 0.00 57.72 54.36 1h6r n HIS 199 Cb 0.30 0.57 -0.12 0.00 0.12 0.00 0.00 29.99 30.86 1h6r n HIS 199 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 1h6r s TYR 200 N -4.72 2.57 -0.14 -1.40 1.51 -0.20 0.15 117.35 115.12 1h6r s TYR 200 Ca 0.10 -0.24 0.02 0.00 -1.01 0.00 0.00 57.07 55.94 1h6r s TYR 200 Cb -0.03 -1.41 0.01 0.00 -0.11 0.00 0.00 41.96 40.42 1h6r s TYR 200 CO 0.08 0.34 -0.21 -0.51 -1.11 0.00 0.00 175.55 174.13 1h6r s LEU 201 N -1.84 2.15 -0.19 -1.29 1.43 -0.16 -1.10 118.68 117.68 1h6r s LEU 201 Ca 0.17 -0.59 -0.05 0.00 -1.03 0.00 0.00 54.13 52.63 1h6r s LEU 201 Cb -0.11 -1.46 -0.03 0.00 0.03 0.00 0.00 46.19 44.63 1h6r s LEU 201 CO 0.08 0.08 -0.01 0.00 0.23 0.00 0.00 176.35 176.73 1h6r s TYR 203 N 0.81 2.78 -0.05 0.00 1.51 0.03 -1.17 117.35 121.26 1h6r s TYR 203 Ca 0.00 -0.12 -0.01 0.00 -1.01 0.00 0.00 57.07 55.94 1h6r s TYR 203 Cb -0.14 -1.54 0.03 0.00 -0.11 0.00 0.00 41.96 40.20 1h6r s TYR 203 CO 0.02 0.35 0.02 -0.65 -1.11 0.00 0.00 175.55 174.19 1h6r s GLN 204 N -1.58 0.26 -0.01 -0.62 -0.21 -0.28 -1.97 119.66 115.24 1h6r s GLN 204 Ca 0.17 0.20 0.03 0.00 0.02 0.00 0.00 55.36 55.78 1h6r s GLN 204 Cb -0.11 -0.65 -0.00 0.00 1.00 0.00 0.00 33.01 33.25 1h6r s GLN 204 CO 0.08 -0.26 -0.10 -1.12 -2.12 0.00 0.00 175.29 171.77 1h6r s SER 205 N 1.75 1.22 -0.06 5.90 0.01 -1.26 -0.43 113.70 120.83 1h6r s SER 205 Ca 0.00 -0.19 0.03 0.00 1.31 0.00 0.00 55.95 57.10 1h6r s SER 205 Cb -0.13 -0.20 0.01 0.00 0.21 0.00 0.00 66.02 65.91 1h6r s SER 205 CO -0.03 0.11 -0.14 0.00 0.41 0.00 0.00 173.24 173.58 1h6r s ALA 206 N -0.09 1.35 -0.10 1.44 0.00 0.11 -4.53 121.76 119.93 1h6r s ALA 206 Ca 0.01 -0.50 -0.04 0.00 0.00 0.00 0.00 51.96 51.44 1h6r s ALA 206 Cb -0.06 -0.55 -0.04 0.00 0.00 0.00 0.00 23.12 22.48 1h6r s ALA 206 CO -0.00 0.16 0.03 -0.51 0.00 0.00 0.00 175.76 175.45 1h6r s LEU 207 N 0.48 3.76 0.00 0.00 1.43 -1.26 -1.49 118.68 121.60 1h6r s LEU 207 Ca -0.12 0.20 -0.03 0.00 -1.03 0.00 0.00 54.13 53.15 1h6r s LEU 207 Cb -0.15 -1.88 0.01 0.00 0.03 0.00 0.00 46.19 44.20 1h6r s LEU 207 CO 0.04 0.36 0.41 -1.54 0.23 0.00 0.00 176.35 175.84 1h6r n SER 208 N 2.30 -1.14 -4.34 2.29 3.41 -0.12 -4.92 113.62 111.10 1h6r n SER 208 Ca -0.19 -2.37 -0.25 0.00 -0.26 0.00 0.00 58.87 55.80 1h6r n SER 208 Cb 0.54 2.07 -0.12 0.00 -0.26 0.00 0.00 64.21 66.44 1h6r n SER 208 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1h6r s LYS 209 N -2.50 1.27 -0.20 4.33 -0.14 -1.26 -1.25 119.74 120.00 1h6r s LYS 209 Ca 0.20 -1.31 -0.25 0.00 -1.36 0.00 0.00 55.97 53.25 1h6r s LYS 209 Cb -0.01 -1.54 -0.01 0.00 -1.68 0.00 0.00 37.83 34.58 1h6r s LYS 209 CO 0.14 0.35 0.83 0.34 -0.76 0.00 0.00 175.35 176.25 1h6r s ASP 210 N -2.22 6.91 0.41 2.83 -1.08 -1.26 -4.94 116.67 117.32 1h6r s ASP 210 Ca 0.12 1.12 0.21 0.00 -0.52 0.00 0.00 52.55 53.47 1h6r s ASP 210 Cb -0.09 -2.45 1.16 0.00 -1.46 0.00 0.00 42.92 40.09 1h6r s ASP 210 CO 0.06 -0.44 1.77 -0.65 0.52 0.00 0.00 175.17 176.43 1h6r h PRO 211 N 7.46 0.33 -0.19 4.34 0.11 -2.04 -2.60 132.00 139.41 1h6r h PRO 211 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1h6r h PRO 211 Cb 1.12 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1h6r h PRO 211 CO 0.85 0.22 0.00 0.09 -0.21 0.00 0.00 178.00 178.95 1h6r n ASN 212 N -4.59 2.64 -4.65 -2.05 3.02 -1.26 -4.96 115.26 103.40 1h6r n ASN 212 Ca 0.26 -1.77 -0.43 0.00 -0.03 0.00 0.00 54.58 52.61 1h6r n ASN 212 Cb 0.94 -0.12 -0.02 0.00 -0.61 0.00 0.00 39.78 39.97 1h6r n ASN 212 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1h6r s GLU 213 N -1.17 4.15 0.28 3.52 2.56 -0.98 -4.91 118.70 122.14 1h6r s GLU 213 Ca 0.23 1.18 0.22 0.00 0.00 0.00 0.00 54.97 56.60 1h6r s GLU 213 Cb 0.14 -3.69 0.11 0.00 2.00 0.00 0.00 34.13 32.69 1h6r s GLU 213 CO 0.20 -0.78 1.25 0.87 -0.56 0.00 0.00 175.26 176.25 1h6r h LYS 214 N 7.81 0.00 -7.28 4.30 1.79 -1.93 -3.47 116.57 117.79 1h6r h LYS 214 Ca -0.20 0.00 -0.50 0.00 -2.18 0.00 0.00 60.65 57.78 1h6r h LYS 214 Cb 1.06 0.00 0.05 0.00 -1.58 0.00 0.00 32.23 31.76 1h6r h LYS 214 CO 1.01 0.05 0.39 1.03 -1.08 0.00 0.00 179.45 180.85 1h6r s ARG 215 N -3.25 3.60 0.16 3.15 0.52 -1.26 -4.98 118.95 116.88 1h6r s ARG 215 Ca 0.02 0.90 -0.31 0.00 -0.52 0.00 0.00 55.73 55.82 1h6r s ARG 215 Cb 0.08 -2.08 -0.10 0.00 0.52 0.00 0.00 34.95 33.37 1h6r s ARG 215 CO 0.75 -0.57 1.53 0.34 0.02 0.00 0.00 175.30 177.37 1h6r s ASP 216 N -3.60 6.63 0.25 0.23 3.68 -1.26 -4.95 116.67 117.66 1h6r s ASP 216 Ca 0.58 2.57 -0.22 0.00 2.13 0.00 0.00 52.55 57.61 1h6r s ASP 216 Cb -0.12 -2.59 0.03 0.00 -1.45 0.00 0.00 42.92 38.79 1h6r s ASP 216 CO 0.45 -0.79 0.78 -1.38 0.13 0.00 0.00 175.17 174.36 1h6r s HIS 217 N 1.07 -0.16 -0.05 -5.34 -3.43 -1.26 -2.42 115.29 103.70 1h6r s HIS 217 Ca 0.68 -0.27 -0.03 0.00 -0.80 0.00 0.00 55.06 54.64 1h6r s HIS 217 Cb -0.42 0.70 0.03 0.00 -1.43 0.00 0.00 32.58 31.46 1h6r s HIS 217 CO 0.32 -1.16 0.12 1.41 -2.00 0.00 0.00 174.74 173.43 1h6r s MET 218 N -3.68 0.08 -0.18 -0.38 0.00 -0.18 -4.97 119.30 109.99 1h6r s MET 218 Ca 0.12 0.31 -0.08 0.00 0.00 0.00 0.00 55.69 56.04 1h6r s MET 218 Cb -0.05 -0.15 -0.04 0.00 0.00 0.00 0.00 34.83 34.59 1h6r s MET 218 CO 0.06 -0.14 0.07 0.08 0.00 0.00 0.00 175.02 175.09 1h6r s VAL 219 N 0.97 4.90 -0.07 10.11 1.01 -0.38 -0.33 120.40 136.62 1h6r s VAL 219 Ca -0.08 0.01 0.04 0.00 0.00 0.00 0.00 61.98 61.95 1h6r s VAL 219 Cb -0.10 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.07 1h6r s VAL 219 CO -0.05 0.47 -0.19 -0.22 0.00 0.00 0.00 175.10 175.12 1h6r s LEU 220 N 0.29 1.91 -0.14 3.92 2.96 0.39 -0.95 118.68 127.06 1h6r s LEU 220 Ca 0.04 -0.41 0.02 0.00 -0.22 0.00 0.00 54.13 53.56 1h6r s LEU 220 Cb -0.12 -1.09 0.01 0.00 0.50 0.00 0.00 46.19 45.49 1h6r s LEU 220 CO -0.00 0.13 -0.20 -0.22 -1.32 0.00 0.00 176.35 174.74 1h6r s LEU 221 N 0.27 2.01 0.01 -0.68 2.96 -0.56 -1.28 118.68 121.40 1h6r s LEU 221 Ca -0.11 -0.57 0.02 0.00 -0.22 0.00 0.00 54.13 53.26 1h6r s LEU 221 Cb -0.15 -1.37 -0.01 0.00 0.50 0.00 0.00 46.19 45.17 1h6r s LEU 221 CO 0.05 0.04 -0.08 -0.70 -1.32 0.00 0.00 176.35 174.34 1h6r s GLU 222 N 0.99 0.60 -0.09 1.98 2.12 -0.21 -0.72 118.70 123.37 1h6r s GLU 222 Ca -0.04 -0.43 0.02 0.00 0.36 0.00 0.00 54.97 54.89 1h6r s GLU 222 Cb -0.15 -0.53 0.01 0.00 0.26 0.00 0.00 34.13 33.72 1h6r s GLU 222 CO -0.05 0.14 -0.15 -0.06 -0.54 0.00 0.00 175.26 174.60 1h6r s PHE 223 N -0.53 1.84 -0.06 5.30 0.08 0.43 -0.82 117.98 124.22 1h6r s PHE 223 Ca -0.00 -0.77 0.01 0.00 0.12 0.00 0.00 56.93 56.28 1h6r s PHE 223 Cb -0.05 -1.32 0.02 0.00 -0.57 0.00 0.00 43.02 41.10 1h6r s PHE 223 CO 0.00 -0.38 -0.07 0.08 -0.10 0.00 0.00 175.22 174.75 1h6r s VAL 224 N 0.75 0.77 -0.04 -0.44 1.01 0.63 -1.12 120.40 121.97 1h6r s VAL 224 Ca -0.12 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.65 1h6r s VAL 224 Cb -0.16 -0.77 0.01 0.00 0.00 0.00 0.00 36.38 35.46 1h6r s VAL 224 CO 0.02 0.29 -0.08 -0.89 0.00 0.00 0.00 175.10 174.44 1h6r s THR 225 N 1.05 0.78 0.33 3.92 2.01 -0.32 -0.93 115.64 122.47 1h6r s THR 225 Ca -0.08 -0.32 -0.10 0.00 0.31 0.00 0.00 61.69 61.49 1h6r s THR 225 Cb -0.14 -0.71 -0.07 0.00 0.01 0.00 0.00 72.50 71.58 1h6r s THR 225 CO -0.00 0.26 0.67 0.00 -0.69 0.00 0.00 174.62 174.85 1h6r s ALA 226 N 0.42 3.44 0.16 7.40 0.00 0.03 -0.41 121.76 132.79 1h6r s ALA 226 Ca -0.07 -0.23 -0.25 0.00 0.00 0.00 0.00 51.96 51.41 1h6r s ALA 226 Cb -0.11 -2.58 0.06 0.00 0.00 0.00 0.00 23.12 20.49 1h6r s ALA 226 CO 0.01 0.22 0.89 0.00 0.00 0.00 0.00 175.76 176.88 1h6r s ALA 227 N -2.11 -1.59 0.00 0.00 0.00 -0.26 -4.42 121.76 113.37 1h6r s ALA 227 Ca 0.50 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.64 1h6r s ALA 227 Cb -0.11 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.68 1h6r s ALA 227 CO 0.26 -0.98 0.00 0.41 0.00 0.00 0.00 175.76 175.45 1h6r n GLY 228 N -0.43 2.38 3.74 0.00 0.00 -1.26 -1.03 105.19 108.58 1h6r n GLY 228 Ca -0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 1h6r n GLY 228 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h6r s ILE 229 N -2.24 4.30 0.47 -0.61 -1.09 -1.26 -4.94 121.20 115.83 1h6r s ILE 229 Ca 0.00 2.04 -0.24 0.00 -2.23 0.00 0.00 60.65 60.22 1h6r s ILE 229 Cb 0.00 -4.31 -0.08 0.00 -1.58 0.00 0.00 42.46 36.50 1h6r s ILE 229 CO 0.00 0.42 1.27 1.07 -1.23 0.00 0.00 174.94 176.47 1h6r n THR 230 N 2.10 2.99 0.00 2.92 5.66 -1.26 -4.82 114.28 121.87 1h6r n THR 230 Ca -0.00 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.50 1h6r n THR 230 Cb 0.48 -1.56 0.00 0.00 -1.55 0.00 0.00 70.33 67.70 1h6r n THR 230 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1h6r n HIS 231 N -0.57 -0.71 0.00 1.09 1.44 -1.26 -5.06 115.22 110.16 1h6r n HIS 231 Ca 0.08 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.79 1h6r n HIS 231 Cb 0.42 0.14 0.00 0.00 0.12 0.00 0.00 29.99 30.67 1h6r n HIS 231 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94