#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 1.39 5.12 1.43 2.47 -1.26 -4.60 119.74 124.28 1h6r s LYS 3 Ca 0.00 -0.99 0.00 0.00 -1.56 0.00 0.00 55.97 53.42 1h6r s LYS 3 Cb 0.00 -1.53 0.00 0.00 -1.46 0.00 0.00 37.83 34.84 1h6r s LYS 3 CO 0.00 0.39 0.00 0.41 0.16 0.00 0.00 175.35 176.31 1h6r n GLY 4 N 1.74 2.94 0.33 5.54 0.00 -0.33 -2.62 105.19 112.79 1h6r n GLY 4 Ca -0.17 -0.20 0.19 0.00 0.00 0.00 0.00 46.02 45.83 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 0.00 1.61 4.11 -1.90 -0.83 114.58 117.57 1h6r h GLU 5 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 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 -0.03 0.93 0.07 0.00 0.00 179.01 179.98 1h6r h GLU 6 N 0.00 0.00 0.00 1.06 4.39 -1.88 -1.33 114.58 116.83 1h6r h GLU 6 Ca 0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1h6r h GLU 6 Cb 0.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1h6r h GLU 6 CO -0.00 0.03 0.00 1.28 -1.16 0.00 0.00 179.01 179.16 1h6r n LEU 7 N -3.62 0.00 -0.31 1.33 4.77 -0.32 -3.65 117.00 115.20 1h6r n LEU 7 Ca -0.03 0.35 0.05 0.00 -0.03 0.00 0.00 56.01 56.35 1h6r n LEU 7 Cb 0.13 -0.35 0.11 0.00 -2.33 0.00 0.00 43.42 40.98 1h6r n LEU 7 CO 0.27 -0.05 0.58 0.49 -1.33 0.00 0.00 177.39 177.35 1h6r n PHE 8 N -1.35 0.26 0.25 -1.77 3.01 -0.50 -4.70 117.46 112.67 1h6r n PHE 8 Ca 0.10 -0.66 0.12 0.00 1.01 0.00 0.00 57.45 58.03 1h6r n PHE 8 Cb 0.23 -0.10 0.65 0.00 -0.01 0.00 0.00 39.48 40.24 1h6r n PHE 8 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 1h6r h THR 9 N 0.80 0.55 -3.27 4.37 1.35 -1.63 -3.38 112.91 111.70 1h6r h THR 9 Ca 0.00 -0.73 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 1h6r h THR 9 Cb 0.80 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1h6r h THR 9 CO 0.03 0.15 0.00 0.61 -0.25 0.00 0.00 175.52 176.06 1h6r n GLY 10 N -0.40 6.66 3.70 5.82 0.00 -1.26 -4.84 105.19 114.86 1h6r n GLY 10 Ca -0.01 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.51 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 0.51 4.86 -0.14 1.61 1.01 -1.26 -4.52 120.40 122.47 1h6r s VAL 11 Ca 0.00 1.95 -0.01 0.00 0.00 0.00 0.00 61.98 63.92 1h6r s VAL 11 Cb 0.00 -4.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 1h6r s VAL 11 CO 0.00 0.10 -0.11 -0.69 0.00 0.00 0.00 175.10 174.41 1h6r s VAL 12 N 1.43 3.24 0.34 2.92 1.01 0.08 -4.93 120.40 124.49 1h6r s VAL 12 Ca 0.48 -0.59 -0.28 0.00 0.00 0.00 0.00 61.98 61.59 1h6r s VAL 12 Cb -0.19 -2.38 -0.10 0.00 0.00 0.00 0.00 36.38 33.71 1h6r s VAL 12 CO 0.22 0.51 1.28 -2.84 0.00 0.00 0.00 175.10 174.28 1h6r s PRO 13 N 0.41 4.31 -0.01 2.72 0.02 -1.26 -1.04 135.00 140.15 1h6r s PRO 13 Ca -0.09 2.16 0.07 0.00 0.02 0.00 0.00 61.00 63.15 1h6r s PRO 13 Cb -0.15 -3.02 -0.02 0.00 0.02 0.00 0.00 34.50 31.33 1h6r s PRO 13 CO 0.05 -0.20 -0.21 0.42 -0.33 0.00 0.00 177.00 176.72 1h6r s ILE 14 N -1.17 1.65 -0.06 2.83 1.01 0.19 -0.86 121.20 124.79 1h6r s ILE 14 Ca 0.50 -0.92 0.03 0.00 0.00 0.00 0.00 60.65 60.27 1h6r s ILE 14 Cb -0.38 -1.38 0.01 0.00 0.01 0.00 0.00 42.46 40.71 1h6r s ILE 14 CO 0.51 0.45 -0.15 -0.22 0.00 0.00 0.00 174.94 175.52 1h6r s LEU 15 N -0.54 1.80 -0.06 2.97 2.96 -0.29 -2.00 118.68 123.51 1h6r s LEU 15 Ca 0.08 -0.34 0.04 0.00 -0.22 0.00 0.00 54.13 53.69 1h6r s LEU 15 Cb -0.08 -0.92 -0.00 0.00 0.50 0.00 0.00 46.19 45.69 1h6r s LEU 15 CO -0.01 0.09 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.24 1h6r s VAL 16 N 0.38 1.58 -0.06 1.68 1.01 -0.05 -0.49 120.40 124.44 1h6r s VAL 16 Ca -0.10 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.10 1h6r s VAL 16 Cb -0.14 -1.37 0.02 0.00 0.00 0.00 0.00 36.38 34.89 1h6r s VAL 16 CO 0.04 0.45 -0.05 -1.61 0.00 0.00 0.00 175.10 173.92 1h6r s GLU 17 N 0.15 1.02 -0.04 2.72 0.41 -0.61 0.03 118.70 122.38 1h6r s GLU 17 Ca -0.08 -0.14 0.02 0.00 -0.41 0.00 0.00 54.97 54.37 1h6r s GLU 17 Cb -0.14 -1.05 0.01 0.00 -1.78 0.00 0.00 34.13 31.17 1h6r s GLU 17 CO 0.04 -0.12 -0.11 -1.17 -0.49 0.00 0.00 175.26 173.41 1h6r s LEU 18 N 1.15 1.70 -0.20 1.80 0.20 -0.04 -0.32 118.68 122.97 1h6r s LEU 18 Ca -0.07 -0.24 -0.03 0.00 0.69 0.00 0.00 54.13 54.48 1h6r s LEU 18 Cb -0.14 -0.68 -0.01 0.00 -0.43 0.00 0.00 46.19 44.93 1h6r s LEU 18 CO -0.01 0.05 -0.06 -1.81 -0.29 0.00 0.00 176.35 174.23 1h6r s ASP 19 N 0.41 4.31 0.16 3.68 1.01 -0.55 -0.95 116.67 124.75 1h6r s ASP 19 Ca -0.08 -0.35 0.06 0.00 0.71 0.00 0.00 52.55 52.89 1h6r s ASP 19 Cb -0.12 -1.72 -0.04 0.00 1.01 0.00 0.00 42.92 42.04 1h6r s ASP 19 CO 0.02 0.03 -0.12 -0.83 0.21 0.00 0.00 175.17 174.48 1h6r s GLY 20 N 1.17 1.18 -0.22 0.21 0.00 0.35 -0.89 107.32 109.12 1h6r s GLY 20 Ca 0.02 -1.53 -0.03 0.00 0.00 0.00 0.00 44.72 43.18 1h6r s GLY 20 CO -0.01 -1.62 0.33 -0.35 0.00 0.00 0.00 173.10 171.45 1h6r s ASP 21 N -3.15 0.52 -0.19 1.64 -1.08 -0.60 -1.51 116.67 112.30 1h6r s ASP 21 Ca 0.18 0.18 0.01 0.00 -0.52 0.00 0.00 52.55 52.40 1h6r s ASP 21 Cb 0.01 0.90 0.03 0.00 -1.46 0.00 0.00 42.92 42.40 1h6r s ASP 21 CO 0.03 -0.30 -0.16 -0.69 0.52 0.00 0.00 175.17 174.57 1h6r s VAL 22 N 2.48 1.98 -1.36 1.11 1.01 -0.53 0.04 120.40 125.13 1h6r s VAL 22 Ca 0.09 -1.05 -0.06 0.00 0.00 0.00 0.00 61.98 60.96 1h6r s VAL 22 Cb -0.15 -1.88 0.04 0.00 0.00 0.00 0.00 36.38 34.38 1h6r s VAL 22 CO -0.14 0.37 0.43 0.59 0.00 0.00 0.00 175.10 176.35 1h6r n ASN 23 N 4.61 -4.63 0.00 3.32 4.13 -0.08 -0.67 115.26 121.94 1h6r n ASN 23 Ca -0.18 -0.24 0.00 0.00 1.68 0.00 0.00 54.58 55.83 1h6r n ASN 23 Cb 0.48 -3.81 0.00 0.00 -1.54 0.00 0.00 39.78 34.91 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 -1.22 1.86 3.61 7.41 0.00 -1.26 -5.01 105.19 110.57 1h6r n GLY 24 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.42 2.99 0.11 1.61 3.76 0.16 -5.01 115.29 116.49 1h6r s HIS 25 Ca 0.00 0.82 -0.14 0.00 -0.15 0.00 0.00 55.06 55.59 1h6r s HIS 25 Cb 0.00 -3.95 -0.06 0.00 1.11 0.00 0.00 32.58 29.68 1h6r s HIS 25 CO 0.00 -0.98 0.50 0.15 -0.85 0.00 0.00 174.74 173.55 1h6r s LYS 26 N 3.86 3.94 0.12 1.40 1.02 -1.26 -1.46 119.74 127.36 1h6r s LYS 26 Ca 0.43 0.42 -0.25 0.00 0.02 0.00 0.00 55.97 56.60 1h6r s LYS 26 Cb -0.10 -3.00 0.07 0.00 -0.52 0.00 0.00 37.83 34.28 1h6r s LYS 26 CO 0.23 0.53 0.75 -0.59 -0.92 0.00 0.00 175.35 175.35 1h6r s PHE 27 N -1.38 -0.38 0.04 3.18 -0.12 -0.57 -4.28 117.98 114.47 1h6r s PHE 27 Ca 0.34 0.15 0.02 0.00 -0.05 0.00 0.00 56.93 57.40 1h6r s PHE 27 Cb -0.15 0.58 -0.02 0.00 -0.63 0.00 0.00 43.02 42.80 1h6r s PHE 27 CO 0.18 -0.80 -0.07 -1.12 -0.05 0.00 0.00 175.22 173.36 1h6r s SER 28 N -2.71 0.81 -0.00 1.98 0.01 -0.66 -0.49 113.70 112.63 1h6r s SER 28 Ca 0.05 -0.52 0.02 0.00 1.31 0.00 0.00 55.95 56.81 1h6r s SER 28 Cb -0.02 0.03 -0.01 0.00 0.21 0.00 0.00 66.02 66.24 1h6r s SER 28 CO -0.07 -0.19 -0.06 -0.69 0.41 0.00 0.00 173.24 172.64 1h6r s VAL 29 N -1.30 0.44 -0.07 3.43 1.01 -0.13 -1.24 120.40 122.55 1h6r s VAL 29 Ca -0.10 -0.27 0.05 0.00 0.00 0.00 0.00 61.98 61.66 1h6r s VAL 29 Cb -0.09 -0.38 -0.01 0.00 0.00 0.00 0.00 36.38 35.90 1h6r s VAL 29 CO 0.00 0.10 -0.23 -0.55 0.00 0.00 0.00 175.10 174.43 1h6r s SER 30 N -0.19 2.85 0.08 3.32 0.15 -0.53 -0.86 113.70 118.52 1h6r s SER 30 Ca 0.02 -0.49 0.07 0.00 0.70 0.00 0.00 55.95 56.25 1h6r s SER 30 Cb -0.02 -0.94 -0.03 0.00 -1.71 0.00 0.00 66.02 63.31 1h6r s SER 30 CO -0.00 0.20 -0.18 -0.83 1.20 0.00 0.00 173.24 173.63 1h6r s GLY 31 N 0.04 1.04 -0.02 9.45 0.00 0.10 -0.44 107.32 117.50 1h6r s GLY 31 Ca -0.08 -1.08 -0.05 0.00 0.00 0.00 0.00 44.72 43.51 1h6r s GLY 31 CO 0.05 -1.08 0.10 -0.54 0.00 0.00 0.00 173.10 171.63 1h6r s GLU 32 N -1.64 0.29 0.00 2.90 2.02 -0.63 -0.88 118.70 120.76 1h6r s GLU 32 Ca 0.03 -0.17 0.00 0.00 0.02 0.00 0.00 54.97 54.86 1h6r s GLU 32 Cb -0.10 0.12 0.00 0.00 0.10 0.00 0.00 34.13 34.26 1h6r s GLU 32 CO 0.03 -0.06 0.00 0.41 0.02 0.00 0.00 175.26 175.66 1h6r n GLY 33 N 2.21 -0.72 3.32 -1.39 0.00 -0.85 -1.22 105.19 106.54 1h6r n GLY 33 Ca -0.18 -0.40 -0.11 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.68 1.02 0.06 1.61 -1.05 -0.39 -0.63 118.70 118.63 1h6r s GLU 34 Ca 0.00 -0.58 0.06 0.00 -0.15 0.00 0.00 54.97 54.30 1h6r s GLU 34 Cb 0.00 0.45 -0.03 0.00 -0.44 0.00 0.00 34.13 34.11 1h6r s GLU 34 CO 0.00 -0.38 -0.17 0.20 0.95 0.00 0.00 175.26 175.86 1h6r s GLY 35 N -2.51 0.96 -0.40 -3.83 0.00 -0.21 -1.52 107.32 99.82 1h6r s GLY 35 Ca -0.00 -0.99 0.01 0.00 0.00 0.00 0.00 44.72 43.74 1h6r s GLY 35 CO -0.08 -0.97 0.22 -0.35 0.00 0.00 0.00 173.10 171.92 1h6r s ASP 36 N -1.42 3.38 0.60 1.64 3.68 0.83 -0.74 116.67 124.64 1h6r s ASP 36 Ca 0.03 -2.40 0.36 0.00 2.13 0.00 0.00 52.55 52.67 1h6r s ASP 36 Cb -0.09 -0.76 1.92 0.00 -1.45 0.00 0.00 42.92 42.54 1h6r s ASP 36 CO 0.02 -0.29 2.23 0.00 0.13 0.00 0.00 175.17 177.26 1h6r h ALA 37 N 6.91 1.20 -0.05 3.66 0.00 -1.74 -1.01 119.26 128.23 1h6r h ALA 37 Ca 0.01 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1h6r h ALA 37 Cb 0.95 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1h6r h ALA 37 CO 0.39 0.04 0.03 1.15 0.00 0.00 0.00 179.25 180.86 1h6r h THR 38 N 0.00 0.96 -0.14 0.00 2.02 -1.87 -1.90 112.91 111.98 1h6r h THR 38 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1h6r h THR 38 Cb 0.14 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1h6r h THR 38 CO 0.00 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.67 1h6r n TYR 39 N -4.50 0.19 -2.17 3.16 4.01 -0.48 -4.94 117.16 112.42 1h6r n TYR 39 Ca -0.02 -0.33 -0.19 0.00 -0.16 0.00 0.00 57.90 57.20 1h6r n TYR 39 Cb 0.14 -0.02 -0.02 0.00 -0.31 0.00 0.00 39.34 39.12 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 0.21 0.10 3.62 2.72 0.00 -0.65 -4.75 105.19 106.44 1h6r n GLY 40 Ca 0.06 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 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 -4.63 3.86 -0.04 1.61 2.20 -0.62 -0.65 119.74 121.47 1h6r s LYS 41 Ca 0.00 -0.37 0.05 0.00 -0.36 0.00 0.00 55.97 55.29 1h6r s LYS 41 Cb 0.00 -3.14 -0.01 0.00 -1.51 0.00 0.00 37.83 33.17 1h6r s LYS 41 CO 0.00 0.31 -0.20 -0.51 -0.36 0.00 0.00 175.35 174.59 1h6r s LEU 42 N 0.25 1.99 -0.09 5.43 1.43 0.14 -0.12 118.68 127.71 1h6r s LEU 42 Ca 0.03 -0.41 -0.01 0.00 -1.03 0.00 0.00 54.13 52.71 1h6r s LEU 42 Cb -0.13 -1.12 0.03 0.00 0.03 0.00 0.00 46.19 45.00 1h6r s LEU 42 CO 0.01 0.20 -0.03 0.28 0.23 0.00 0.00 176.35 177.04 1h6r s THR 43 N -0.11 0.62 0.02 5.49 -1.32 -0.58 -1.08 115.64 118.68 1h6r s THR 43 Ca -0.02 -0.03 -0.02 0.00 -1.21 0.00 0.00 61.69 60.41 1h6r s THR 43 Cb -0.12 -0.72 -0.02 0.00 -1.51 0.00 0.00 72.50 70.14 1h6r s THR 43 CO 0.02 0.30 0.01 -0.76 -2.21 0.00 0.00 174.62 171.98 1h6r s LEU 44 N 1.83 2.07 -0.10 9.08 1.43 -0.40 -1.26 118.68 131.33 1h6r s LEU 44 Ca 0.04 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.70 1h6r s LEU 44 Cb -0.12 0.26 0.02 0.00 0.03 0.00 0.00 46.19 46.37 1h6r s LEU 44 CO -0.06 -0.34 -0.14 -0.75 0.23 0.00 0.00 176.35 175.29 1h6r s LYS 45 N -1.62 2.05 -0.09 1.70 2.20 -0.36 -0.20 119.74 123.41 1h6r s LYS 45 Ca -0.14 -0.50 -0.01 0.00 -0.36 0.00 0.00 55.97 54.96 1h6r s LYS 45 Cb -0.08 -1.78 -0.03 0.00 -1.51 0.00 0.00 37.83 34.43 1h6r s LYS 45 CO -0.01 -0.09 -0.04 -0.06 -0.36 0.00 0.00 175.35 174.79 1h6r s PHE 46 N 1.06 3.02 -0.01 4.03 0.40 0.45 -1.61 117.98 125.32 1h6r s PHE 46 Ca -0.06 -0.01 0.03 0.00 -0.60 0.00 0.00 56.93 56.29 1h6r s PHE 46 Cb -0.15 -1.79 -0.01 0.00 0.51 0.00 0.00 43.02 41.58 1h6r s PHE 46 CO -0.02 0.28 -0.10 0.42 0.70 0.00 0.00 175.22 176.49 1h6r s ILE 47 N -0.54 0.84 -0.15 0.64 1.01 0.42 -1.37 121.20 122.05 1h6r s ILE 47 Ca 0.08 -0.44 -0.29 0.00 0.00 0.00 0.00 60.65 60.00 1h6r s ILE 47 Cb -0.12 -0.71 -0.02 0.00 0.01 0.00 0.00 42.46 41.62 1h6r s ILE 47 CO 0.02 0.24 1.24 -0.69 0.00 0.00 0.00 174.94 175.75 1h6r s VAL 48 N -0.15 4.30 -0.13 2.92 1.01 -1.12 -1.46 120.40 125.78 1h6r s VAL 48 Ca 0.02 1.59 0.03 0.00 0.00 0.00 0.00 61.98 63.62 1h6r s VAL 48 Cb -0.05 -4.02 -0.24 0.00 0.00 0.00 0.00 36.38 32.07 1h6r s VAL 48 CO -0.00 -0.11 0.33 0.35 0.00 0.00 0.00 175.10 175.67 1h6r n THR 49 N 5.22 1.65 -4.02 3.92 -2.24 -0.37 -4.89 114.28 113.55 1h6r n THR 49 Ca 0.13 -0.71 -0.12 0.00 -2.27 0.00 0.00 64.05 61.08 1h6r n THR 49 Cb 0.45 -1.36 -0.13 0.00 -2.10 0.00 0.00 70.33 67.20 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 -2.56 0.28 0.02 4.28 -4.23 -1.20 -4.96 115.64 107.27 1h6r s THR 50 Ca -0.18 -0.60 0.00 0.00 -1.18 0.00 0.00 61.69 59.73 1h6r s THR 50 Cb 0.07 -0.33 0.00 0.00 1.34 0.00 0.00 72.50 73.59 1h6r s THR 50 CO 0.77 -0.21 0.00 0.61 -0.54 0.00 0.00 174.62 175.24 1h6r n GLY 51 N 2.20 -1.87 3.48 3.99 0.00 -1.26 -1.66 105.19 110.08 1h6r n GLY 51 Ca -0.18 -1.33 -0.33 0.00 0.00 0.00 0.00 46.02 44.17 1h6r n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h6r s LYS 52 N -0.31 2.54 -0.35 1.61 -0.14 -1.26 -4.91 119.74 116.92 1h6r s LYS 52 Ca 0.00 -0.69 -0.29 0.00 -1.36 0.00 0.00 55.97 53.64 1h6r s LYS 52 Cb 0.00 -2.40 -0.01 0.00 -1.68 0.00 0.00 37.83 33.74 1h6r s LYS 52 CO 0.00 0.61 1.64 -1.17 -0.76 0.00 0.00 175.35 175.67 1h6r s LEU 53 N -0.71 3.57 0.00 3.17 2.96 -1.26 -4.77 118.68 121.65 1h6r s LEU 53 Ca 0.11 1.16 0.29 0.00 -0.22 0.00 0.00 54.13 55.47 1h6r s LEU 53 Cb -0.11 -3.53 1.30 0.00 0.50 0.00 0.00 46.19 44.35 1h6r s LEU 53 CO 0.01 -1.56 1.92 -0.81 -1.32 0.00 0.00 176.35 174.59 1h6r n PRO 54 N 8.22 0.44 -4.28 0.98 -0.04 -1.26 -4.87 135.00 134.20 1h6r n PRO 54 Ca 0.20 -0.09 -0.15 0.00 -0.04 0.00 0.00 63.50 63.42 1h6r n PRO 54 Cb 0.47 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.33 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 -2.62 1.21 0.33 0.52 -7.23 -1.26 -4.49 120.40 106.86 1h6r s VAL 55 Ca 0.26 -2.07 -0.29 0.00 -1.81 0.00 0.00 61.98 58.06 1h6r s VAL 55 Cb 0.20 -1.97 -0.10 0.00 0.56 0.00 0.00 36.38 35.06 1h6r s VAL 55 CO 0.49 -0.64 1.29 -2.84 -0.31 0.00 0.00 175.10 173.09 1h6r s PRO 56 N -3.76 4.38 0.26 4.82 0.02 -1.26 -4.92 135.00 134.54 1h6r s PRO 56 Ca 0.20 2.19 -0.02 0.00 0.02 0.00 0.00 61.00 63.38 1h6r s PRO 56 Cb 0.03 -3.08 0.53 0.00 0.02 0.00 0.00 34.50 32.00 1h6r s PRO 56 CO 0.03 -0.16 1.73 -1.49 -0.33 0.00 0.00 177.00 176.78 1h6r h TRP 57 N 3.41 0.58 -0.28 6.54 4.06 -1.97 -1.69 115.95 126.60 1h6r h TRP 57 Ca -0.49 0.04 0.08 0.00 2.06 0.00 0.00 58.89 60.58 1h6r h TRP 57 Cb 1.23 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 29.24 1h6r h TRP 57 CO 0.56 0.06 0.21 -1.35 -3.56 0.00 0.00 178.44 174.35 1h6r h PRO 58 N 0.46 0.00 0.00 0.49 0.11 -1.91 -0.59 132.00 130.57 1h6r h PRO 58 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.56 1h6r h PRO 58 Cb 0.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.84 1h6r h PRO 58 CO -0.43 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.61 1h6r n THR 59 N -4.35 0.78 0.79 -1.15 -2.24 -0.64 -2.68 114.28 104.78 1h6r n THR 59 Ca 0.04 0.19 0.09 0.00 -2.27 0.00 0.00 64.05 62.10 1h6r n THR 59 Cb 0.37 -0.91 -0.01 0.00 -2.10 0.00 0.00 70.33 67.67 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 -1.44 1.68 -0.02 3.22 4.77 -0.23 -4.64 117.00 120.34 1h6r n LEU 60 Ca 0.05 -0.75 -0.09 0.00 -0.03 0.00 0.00 56.01 55.19 1h6r n LEU 60 Cb 0.18 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.24 1h6r n LEU 60 CO 0.15 0.32 0.81 0.58 -1.33 0.00 0.00 177.39 177.91 1h6r h VAL 61 N 1.85 0.73 -0.02 4.08 2.07 -1.53 -0.49 116.25 122.95 1h6r h VAL 61 Ca 0.00 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 1h6r h VAL 61 Cb 0.59 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1h6r h VAL 61 CO 0.00 0.00 -0.22 0.71 0.02 0.00 0.00 177.57 178.08 1h6r h THR 62 N -0.07 1.17 -0.13 2.57 1.35 -1.82 -2.77 112.91 113.21 1h6r h THR 62 Ca 0.09 -0.79 -0.16 0.00 -0.55 0.00 0.00 66.41 65.00 1h6r h THR 62 Cb 0.21 1.40 0.01 0.00 -1.73 0.00 0.00 68.15 68.03 1h6r h THR 62 CO -0.21 0.23 -0.54 0.74 -0.25 0.00 0.00 175.52 175.49 1h6r h THR 63 N 0.03 1.34 0.00 6.82 2.02 -1.67 -3.45 112.91 118.00 1h6r h THR 63 Ca 0.00 -1.82 -0.02 0.00 0.77 0.00 0.00 66.41 65.34 1h6r h THR 63 Cb 0.41 2.09 -0.01 0.00 -1.74 0.00 0.00 68.15 68.90 1h6r h THR 63 CO 0.03 0.56 0.06 0.49 0.37 0.00 0.00 175.52 177.02 1h6r n PHE 64 N -4.17 0.00 0.00 3.16 0.99 -0.26 -5.03 117.46 112.15 1h6r n PHE 64 Ca -0.07 -0.38 0.00 0.00 -0.00 0.00 0.00 57.45 57.00 1h6r n PHE 64 Cb 0.62 -0.46 0.00 0.00 -1.00 0.00 0.00 39.48 38.64 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 2.11 0.00 0.04 4.37 4.77 -1.26 -5.02 117.00 122.00 1h6r n LEU 68 Ca 0.04 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.10 1h6r n LEU 68 Cb 0.20 0.00 0.34 0.00 -2.33 0.00 0.00 43.42 41.63 1h6r n LEU 68 CO 0.06 0.00 0.75 0.00 -1.33 0.00 0.00 177.39 176.86 1h6r n GLN 69 N 0.00 0.05 0.08 3.23 6.02 -1.26 -1.72 117.38 123.79 1h6r n GLN 69 Ca 0.00 0.33 0.09 0.00 -0.01 0.00 0.00 57.00 57.41 1h6r n GLN 69 Cb 0.00 -1.61 0.40 0.00 1.02 0.00 0.00 30.24 30.05 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 -1.93 0.58 -1.98 0.00 3.72 -0.70 -4.64 117.46 112.50 1h6r n PHE 71 Ca 0.02 -0.29 -0.37 0.00 -0.05 0.00 0.00 57.45 56.76 1h6r n PHE 71 Cb 0.16 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.73 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 -1.42 2.68 -0.44 4.37 0.00 -0.88 -3.98 121.76 122.09 1h6r s ALA 72 Ca 0.35 1.10 -0.25 0.00 0.00 0.00 0.00 51.96 53.15 1h6r s ALA 72 Cb 0.18 -3.48 0.02 0.00 0.00 0.00 0.00 23.12 19.85 1h6r s ALA 72 CO 0.25 -1.15 0.88 0.50 0.00 0.00 0.00 175.76 176.23 1h6r s ARG 73 N -3.10 3.56 -0.20 0.00 3.52 0.19 -4.71 118.95 118.20 1h6r s ARG 73 Ca 0.74 0.16 -0.15 0.00 -0.13 0.00 0.00 55.73 56.35 1h6r s ARG 73 Cb -0.33 -3.90 -0.04 0.00 -1.56 0.00 0.00 34.95 29.11 1h6r s ARG 73 CO 0.38 -1.13 0.35 0.71 -0.81 0.00 0.00 175.30 174.80 1h6r s TYR 74 N 3.55 3.37 1.03 5.12 1.51 -1.26 -0.99 117.35 129.68 1h6r s TYR 74 Ca 0.35 0.55 -0.12 0.00 -1.01 0.00 0.00 57.07 56.84 1h6r s TYR 74 Cb -0.11 -2.47 0.21 0.00 -0.11 0.00 0.00 41.96 39.48 1h6r s TYR 74 CO 0.24 0.03 1.07 -2.14 -1.11 0.00 0.00 175.55 173.63 1h6r s PRO 75 N 1.19 0.13 0.64 -1.71 0.02 -1.26 -4.81 135.00 129.20 1h6r s PRO 75 Ca 0.17 0.85 0.37 0.00 0.02 0.00 0.00 61.00 62.41 1h6r s PRO 75 Cb -0.14 -1.68 2.07 0.00 0.02 0.00 0.00 34.50 34.77 1h6r s PRO 75 CO 0.07 -3.02 2.23 -0.44 -0.33 0.00 0.00 177.00 175.50 1h6r h ASP 76 N -2.12 0.00 -0.70 2.53 3.45 -1.99 -0.74 116.42 116.86 1h6r h ASP 76 Ca -0.55 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.91 1h6r h ASP 76 Cb 1.31 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.08 1h6r h ASP 76 CO 0.52 0.00 0.00 0.00 -1.57 0.00 0.00 179.24 178.19 1h6r n HIS 77 N -3.27 1.24 -0.90 4.55 1.44 -1.26 -4.40 115.22 112.61 1h6r n HIS 77 Ca -0.02 -0.55 0.02 0.00 -2.01 0.00 0.00 57.72 55.16 1h6r n HIS 77 Cb 0.18 -0.12 0.03 0.00 0.12 0.00 0.00 29.99 30.20 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 1.43 1.15 0.27 -1.40 2.81 -0.28 -4.83 117.12 116.26 1h6r n MET 78 Ca 0.25 -1.29 0.10 0.00 -1.81 0.00 0.00 57.70 54.95 1h6r n MET 78 Cb 0.75 -0.84 0.70 0.00 -0.71 0.00 0.00 33.22 33.12 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 0.00 0.00 0.00 0.03 1.79 -1.76 -0.52 116.57 116.11 1h6r h LYS 79 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1h6r h LYS 79 Cb 0.92 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.57 1h6r h LYS 79 CO 0.00 0.00 0.00 -2.13 -1.08 0.00 0.00 179.45 176.24 1h6r n ARG 80 N -4.40 0.43 -0.27 3.15 0.63 -1.26 -3.02 116.66 111.92 1h6r n ARG 80 Ca -0.03 0.05 0.07 0.00 -0.92 0.00 0.00 57.85 57.02 1h6r n ARG 80 Cb 0.09 -1.50 0.19 0.00 0.45 0.00 0.00 32.46 31.69 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 -1.22 0.64 -3.12 -0.14 8.25 -0.20 -4.62 115.22 114.82 1h6r n HIS 81 Ca 0.13 -0.63 -0.45 0.00 -0.26 0.00 0.00 57.72 56.51 1h6r n HIS 81 Cb 0.16 -0.13 -0.02 0.00 1.12 0.00 0.00 29.99 31.13 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 -1.30 6.86 0.16 0.41 -1.08 -1.17 -4.50 116.67 116.05 1h6r s ASP 82 Ca 0.30 -2.66 -0.13 0.00 -0.52 0.00 0.00 52.55 49.54 1h6r s ASP 82 Cb 0.20 -2.31 0.05 0.00 -1.46 0.00 0.00 42.92 39.40 1h6r s ASP 82 CO 0.14 -0.73 1.73 0.15 0.52 0.00 0.00 175.17 176.97 1h6r h PHE 83 N 7.87 0.80 -0.17 -5.34 3.57 -1.89 -3.01 116.94 118.78 1h6r h PHE 83 Ca 0.17 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.66 1h6r h PHE 83 Cb 0.98 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.44 1h6r h PHE 83 CO 1.05 0.64 -0.06 0.74 -2.23 0.00 0.00 178.31 178.45 1h6r h PHE 84 N 0.73 -0.15 -0.06 0.41 -1.00 -1.89 -1.93 116.94 113.05 1h6r h PHE 84 Ca 0.18 0.02 -0.15 0.00 2.81 0.00 0.00 57.97 60.83 1h6r h PHE 84 Cb 0.16 0.09 -0.01 0.00 3.61 0.00 0.00 35.95 39.80 1h6r h PHE 84 CO 0.00 -0.10 -0.61 0.87 -1.61 0.00 0.00 178.31 176.86 1h6r h LYS 85 N -0.04 0.22 0.00 1.51 1.57 -1.82 -3.12 116.57 114.89 1h6r h LYS 85 Ca 0.09 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1h6r h LYS 85 Cb 0.17 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 1h6r h LYS 85 CO -0.19 0.76 -0.05 0.66 -0.57 0.00 0.00 179.45 180.06 1h6r h SER 86 N 0.16 0.00 1.04 0.86 4.64 -1.22 -1.04 113.55 118.00 1h6r h SER 86 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1h6r h SER 86 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1h6r h SER 86 CO 0.09 0.05 0.00 0.00 -0.87 0.00 0.00 176.83 176.10 1h6r n ALA 87 N -2.23 2.20 -2.12 5.18 0.00 -0.95 -4.57 120.51 118.02 1h6r n ALA 87 Ca -0.02 -0.07 -0.31 0.00 0.00 0.00 0.00 53.44 53.04 1h6r n ALA 87 Cb 0.16 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.13 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 -3.04 3.88 0.29 0.00 1.00 -0.39 -0.35 119.30 120.68 1h6r s MET 88 Ca 0.12 0.61 0.25 0.00 0.00 0.00 0.00 55.69 56.67 1h6r s MET 88 Cb 0.16 -2.37 0.71 0.00 0.00 0.00 0.00 34.83 33.33 1h6r s MET 88 CO 0.51 -0.00 1.73 -1.00 0.00 0.00 0.00 175.02 176.26 1h6r h PRO 89 N 1.56 0.00 -0.62 2.03 0.13 -1.87 -0.86 132.00 132.36 1h6r h PRO 89 Ca -0.47 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 64.74 1h6r h PRO 89 Cb 1.18 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.27 1h6r h PRO 89 CO 0.64 0.00 0.42 0.93 -0.23 0.00 0.00 178.00 179.76 1h6r h GLU 90 N 0.00 0.49 0.00 0.86 5.08 -1.89 -2.44 114.58 116.68 1h6r h GLU 90 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1h6r h GLU 90 Cb 0.78 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1h6r h GLU 90 CO 0.00 0.33 0.00 0.41 -1.00 0.00 0.00 179.01 178.75 1h6r n GLY 91 N -1.50 -1.85 3.28 -3.84 0.00 0.52 -4.69 105.19 97.11 1h6r n GLY 91 Ca 0.10 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.26 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 0.00 0.39 -0.18 1.61 -0.85 -0.48 -1.08 117.35 116.76 1h6r s TYR 92 Ca 0.00 -0.78 -0.07 0.00 -0.52 0.00 0.00 57.07 55.70 1h6r s TYR 92 Cb 0.00 -0.11 -0.04 0.00 0.38 0.00 0.00 41.96 42.19 1h6r s TYR 92 CO 0.00 -0.64 0.07 0.08 -1.52 0.00 0.00 175.55 173.53 1h6r s VAL 93 N -3.95 4.83 -0.18 -3.49 1.01 0.09 -0.74 120.40 117.97 1h6r s VAL 93 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.11 1h6r s VAL 93 Cb 0.04 -3.17 0.01 0.00 0.00 0.00 0.00 36.38 33.26 1h6r s VAL 93 CO -0.03 0.47 -0.17 -1.58 0.00 0.00 0.00 175.10 173.79 1h6r s GLN 94 N 0.27 3.09 -0.03 2.72 0.74 0.57 -1.41 119.66 125.60 1h6r s GLN 94 Ca 0.04 -0.79 0.07 0.00 0.05 0.00 0.00 55.36 54.73 1h6r s GLN 94 Cb -0.12 -2.65 -0.02 0.00 1.10 0.00 0.00 33.01 31.32 1h6r s GLN 94 CO 0.00 -0.17 -0.24 -1.21 -0.55 0.00 0.00 175.29 173.12 1h6r s GLU 95 N 1.25 2.27 0.04 1.67 2.02 -0.09 -0.67 118.70 125.19 1h6r s GLU 95 Ca 0.03 -0.88 -0.02 0.00 0.02 0.00 0.00 54.97 54.12 1h6r s GLU 95 Cb -0.14 -2.12 -0.03 0.00 0.10 0.00 0.00 34.13 31.94 1h6r s GLU 95 CO -0.09 0.54 -0.00 1.03 0.02 0.00 0.00 175.26 176.75 1h6r s ARG 96 N -0.54 0.51 -0.09 1.61 0.52 -0.33 -1.02 118.95 119.59 1h6r s ARG 96 Ca 0.08 -0.92 0.03 0.00 -0.52 0.00 0.00 55.73 54.40 1h6r s ARG 96 Cb -0.11 0.18 0.00 0.00 0.52 0.00 0.00 34.95 35.55 1h6r s ARG 96 CO 0.00 -0.10 -0.20 0.99 0.02 0.00 0.00 175.30 176.01 1h6r s THR 97 N -2.82 1.78 -0.26 0.02 2.01 -0.58 -0.50 115.64 115.29 1h6r s THR 97 Ca -0.03 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.13 1h6r s THR 97 Cb 0.00 -1.56 0.05 0.00 0.01 0.00 0.00 72.50 71.00 1h6r s THR 97 CO -0.06 0.50 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.65 1h6r s ILE 98 N 0.48 2.41 -0.31 1.82 1.01 0.38 -1.03 121.20 125.96 1h6r s ILE 98 Ca -0.17 -1.43 -0.16 0.00 0.00 0.00 0.00 60.65 58.90 1h6r s ILE 98 Cb -0.17 -2.34 -0.02 0.00 0.01 0.00 0.00 42.46 39.94 1h6r s ILE 98 CO 0.07 0.05 0.40 -0.36 0.00 0.00 0.00 174.94 175.10 1h6r s PHE 99 N 1.18 3.22 -0.26 3.97 0.40 0.13 -0.94 117.98 125.68 1h6r s PHE 99 Ca -0.05 0.21 -0.22 0.00 -0.60 0.00 0.00 56.93 56.27 1h6r s PHE 99 Cb -0.19 -2.69 -0.01 0.00 0.51 0.00 0.00 43.02 40.64 1h6r s PHE 99 CO -0.05 -0.37 0.69 -0.06 0.70 0.00 0.00 175.22 176.13 1h6r s PHE 100 N 2.13 3.27 0.00 0.36 0.40 -0.22 -0.55 117.98 123.36 1h6r s PHE 100 Ca 0.15 0.85 -0.37 0.00 -0.60 0.00 0.00 56.93 56.96 1h6r s PHE 100 Cb -0.16 -2.94 -0.16 0.00 0.51 0.00 0.00 43.02 40.27 1h6r s PHE 100 CO 0.11 -0.39 1.48 1.17 0.70 0.00 0.00 175.22 178.30 1h6r n LYS 101 N 5.85 1.29 -2.09 0.44 3.00 -0.52 -0.76 118.16 125.37 1h6r n LYS 101 Ca 0.01 0.47 -0.20 0.00 -0.00 0.00 0.00 58.31 58.59 1h6r n LYS 101 Cb 0.49 -2.14 -0.04 0.00 0.00 0.00 0.00 35.03 33.34 1h6r n LYS 101 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1h6r n ASP 102 N 3.45 -5.57 -0.30 3.14 10.43 -1.26 -4.83 116.55 121.61 1h6r n ASP 102 Ca 0.20 0.17 0.00 0.00 2.57 0.00 0.00 54.79 57.73 1h6r n ASP 102 Cb 0.19 -4.67 0.00 0.00 1.84 0.00 0.00 41.12 38.48 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 -1.57 0.00 -2.32 -2.24 4.64 0.06 -4.92 116.55 110.20 1h6r n ASP 103 Ca -0.22 -0.30 -0.03 0.00 -1.38 0.00 0.00 54.79 52.85 1h6r n ASP 103 Cb 0.67 0.00 0.02 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 -1.52 3.08 0.27 0.00 -1.16 -4.55 105.19 101.31 1h6r n GLY 104 Ca 0.00 -1.62 -0.12 0.00 0.00 0.00 0.00 46.02 44.28 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 -1.62 0.88 -0.02 1.61 2.20 -0.89 -1.06 114.94 116.04 1h6r s ASN 105 Ca 0.08 -0.64 -0.01 0.00 -0.94 0.00 0.00 52.86 51.36 1h6r s ASN 105 Cb -0.00 0.05 -0.04 0.00 -2.00 0.00 0.00 41.25 39.26 1h6r s ASN 105 CO 0.06 -0.26 0.06 -0.31 -2.94 0.00 0.00 177.10 173.71 1h6r s TYR 106 N -1.82 3.24 -0.10 1.54 2.02 -0.11 -1.63 117.35 120.50 1h6r s TYR 106 Ca -0.06 0.19 0.03 0.00 -0.37 0.00 0.00 57.07 56.87 1h6r s TYR 106 Cb -0.07 -1.74 0.01 0.00 -0.40 0.00 0.00 41.96 39.76 1h6r s TYR 106 CO -0.01 0.53 -0.20 0.15 -1.57 0.00 0.00 175.55 174.46 1h6r s LYS 107 N -1.56 2.61 0.06 -0.62 1.02 0.45 -0.47 119.74 121.23 1h6r s LYS 107 Ca 0.21 -0.72 0.05 0.00 0.02 0.00 0.00 55.97 55.52 1h6r s LYS 107 Cb -0.12 -2.04 -0.03 0.00 -0.52 0.00 0.00 37.83 35.13 1h6r s LYS 107 CO 0.11 0.10 -0.14 0.95 -0.92 0.00 0.00 175.35 175.46 1h6r s THR 108 N 0.53 1.06 -0.04 2.17 -4.23 0.35 -1.22 115.64 114.26 1h6r s THR 108 Ca -0.16 -1.17 -0.00 0.00 -1.18 0.00 0.00 61.69 59.18 1h6r s THR 108 Cb -0.17 -1.00 0.03 0.00 1.34 0.00 0.00 72.50 72.69 1h6r s THR 108 CO 0.06 -0.16 0.01 -0.60 -0.54 0.00 0.00 174.62 173.39 1h6r s ARG 109 N -1.51 0.30 0.04 3.99 3.52 -0.72 -1.19 118.95 123.38 1h6r s ARG 109 Ca -0.01 0.12 0.03 0.00 -0.13 0.00 0.00 55.73 55.73 1h6r s ARG 109 Cb -0.09 -0.56 -0.02 0.00 -1.56 0.00 0.00 34.95 32.72 1h6r s ARG 109 CO 0.02 -0.18 -0.09 0.00 -0.81 0.00 0.00 175.30 174.23 1h6r s ALA 110 N 1.30 0.71 -0.15 6.12 0.00 0.16 -1.09 121.76 128.81 1h6r s ALA 110 Ca -0.06 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.13 1h6r s ALA 110 Cb -0.13 -0.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 1h6r s ALA 110 CO -0.02 0.04 -0.15 -1.21 0.00 0.00 0.00 175.76 174.42 1h6r s GLU 111 N -1.47 3.26 -0.21 0.00 2.02 -0.31 -0.32 118.70 121.67 1h6r s GLU 111 Ca -0.07 -0.73 -0.01 0.00 0.02 0.00 0.00 54.97 54.18 1h6r s GLU 111 Cb -0.09 -2.62 0.02 0.00 0.10 0.00 0.00 34.13 31.53 1h6r s GLU 111 CO 0.01 0.07 -0.13 0.08 0.02 0.00 0.00 175.26 175.30 1h6r s VAL 112 N 0.70 2.53 0.21 2.63 1.01 0.08 -1.38 120.40 126.17 1h6r s VAL 112 Ca -0.07 -0.90 -0.23 0.00 0.00 0.00 0.00 61.98 60.78 1h6r s VAL 112 Cb -0.16 -2.16 0.04 0.00 0.00 0.00 0.00 36.38 34.11 1h6r s VAL 112 CO 0.02 0.41 0.80 -1.59 0.00 0.00 0.00 175.10 174.74 1h6r s LYS 113 N 1.33 1.47 0.12 2.72 -2.85 -0.74 -1.38 119.74 120.40 1h6r s LYS 113 Ca 0.03 -0.78 -0.24 0.00 -1.00 0.00 0.00 55.97 53.98 1h6r s LYS 113 Cb -0.14 0.52 -0.07 0.00 -2.06 0.00 0.00 37.83 36.08 1h6r s LYS 113 CO -0.09 -0.67 0.72 -0.06 0.10 0.00 0.00 175.35 175.36 1h6r s PHE 114 N -3.63 3.84 -0.31 1.78 0.40 -0.92 -0.74 117.98 118.41 1h6r s PHE 114 Ca 0.10 1.51 0.02 0.00 -0.60 0.00 0.00 56.93 57.96 1h6r s PHE 114 Cb -0.04 -2.71 0.09 0.00 0.51 0.00 0.00 43.02 40.87 1h6r s PHE 114 CO 0.02 0.48 0.03 -1.21 0.70 0.00 0.00 175.22 175.24 1h6r s GLU 115 N -0.89 1.34 6.71 0.44 2.02 -0.33 -4.92 118.70 123.08 1h6r s GLU 115 Ca 0.35 -1.44 0.00 0.00 0.02 0.00 0.00 54.97 53.89 1h6r s GLU 115 Cb -0.22 -2.73 0.00 0.00 0.10 0.00 0.00 34.13 31.29 1h6r s GLU 115 CO 0.24 -0.86 0.00 0.41 0.02 0.00 0.00 175.26 175.07 1h6r n GLY 116 N 4.51 2.78 1.03 -1.39 0.00 -1.26 -2.06 105.19 108.80 1h6r n GLY 116 Ca -0.02 -0.33 0.09 0.00 0.00 0.00 0.00 46.02 45.76 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 3.63 2.98 -4.75 1.61 8.00 -1.26 -4.89 116.55 121.87 1h6r n ASP 117 Ca 0.00 -1.99 -0.36 0.00 0.71 0.00 0.00 54.79 53.16 1h6r n ASP 117 Cb 0.00 -0.36 -0.08 0.00 -0.02 0.00 0.00 41.12 40.66 1h6r n ASP 117 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1h6r s THR 118 N -1.28 4.91 -0.21 -3.53 2.01 -0.87 -4.37 115.64 112.29 1h6r s THR 118 Ca 0.37 -0.01 -0.21 0.00 0.31 0.00 0.00 61.69 62.16 1h6r s THR 118 Cb 0.20 -3.14 -0.02 0.00 0.01 0.00 0.00 72.50 69.55 1h6r s THR 118 CO 0.26 0.57 0.63 -0.22 -0.69 0.00 0.00 174.62 175.17 1h6r s LEU 119 N -0.59 4.12 -0.10 4.42 1.98 -0.04 -1.19 118.68 127.28 1h6r s LEU 119 Ca 0.11 0.80 0.02 0.00 -2.89 0.00 0.00 54.13 52.17 1h6r s LEU 119 Cb -0.12 -2.88 -0.01 0.00 0.66 0.00 0.00 46.19 43.85 1h6r s LEU 119 CO 0.02 -0.29 -0.18 -0.69 -1.89 0.00 0.00 176.35 173.32 1h6r s VAL 120 N 2.05 2.64 -0.37 1.68 1.01 0.08 -1.14 120.40 126.35 1h6r s VAL 120 Ca 0.28 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 1h6r s VAL 120 Cb -0.16 -2.06 0.09 0.00 0.00 0.00 0.00 36.38 34.26 1h6r s VAL 120 CO 0.10 0.55 0.13 0.21 0.00 0.00 0.00 175.10 176.09 1h6r s ASN 121 N 0.15 5.10 -0.29 3.32 2.47 0.35 -1.79 114.94 124.25 1h6r s ASN 121 Ca -0.10 -1.85 -0.10 0.00 0.42 0.00 0.00 52.86 51.24 1h6r s ASN 121 Cb -0.16 -1.77 -0.03 0.00 -1.45 0.00 0.00 41.25 37.84 1h6r s ASN 121 CO 0.06 -0.45 0.16 -0.13 -3.72 0.00 0.00 177.10 173.02 1h6r s ARG 122 N 1.14 3.70 0.05 0.43 0.52 -0.48 -1.57 118.95 122.73 1h6r s ARG 122 Ca 0.05 -0.48 0.08 0.00 -0.52 0.00 0.00 55.73 54.86 1h6r s ARG 122 Cb -0.21 -3.59 -0.03 0.00 0.52 0.00 0.00 34.95 31.64 1h6r s ARG 122 CO -0.04 -0.27 -0.23 0.42 0.02 0.00 0.00 175.30 175.20 1h6r s ILE 123 N 1.69 1.88 -0.06 1.52 1.01 0.56 -1.17 121.20 126.64 1h6r s ILE 123 Ca 0.06 -1.32 0.06 0.00 0.00 0.00 0.00 60.65 59.44 1h6r s ILE 123 Cb -0.16 -1.63 -0.01 0.00 0.01 0.00 0.00 42.46 40.67 1h6r s ILE 123 CO 0.08 0.24 -0.24 -1.83 0.00 0.00 0.00 174.94 173.20 1h6r s GLU 124 N -1.30 2.45 -0.04 2.79 -1.05 -0.25 -1.48 118.70 119.82 1h6r s GLU 124 Ca 0.09 -0.85 0.02 0.00 -0.15 0.00 0.00 54.97 54.08 1h6r s GLU 124 Cb -0.09 -2.07 0.01 0.00 -0.44 0.00 0.00 34.13 31.54 1h6r s GLU 124 CO 0.02 0.34 -0.10 -1.17 0.95 0.00 0.00 175.26 175.31 1h6r s LEU 125 N -0.10 1.69 -0.10 1.83 0.20 -0.07 -1.75 118.68 120.38 1h6r s LEU 125 Ca -0.05 -0.22 0.01 0.00 0.69 0.00 0.00 54.13 54.56 1h6r s LEU 125 Cb -0.14 -0.64 0.02 0.00 -0.43 0.00 0.00 46.19 45.01 1h6r s LEU 125 CO 0.04 0.05 -0.11 -0.75 -0.29 0.00 0.00 176.35 175.29 1h6r s LYS 126 N 0.40 1.77 -0.08 1.98 2.20 -0.35 -1.55 119.74 124.11 1h6r s LYS 126 Ca -0.07 -0.38 0.03 0.00 -0.36 0.00 0.00 55.97 55.19 1h6r s LYS 126 Cb -0.12 -1.63 -0.02 0.00 -1.51 0.00 0.00 37.83 34.56 1h6r s LYS 126 CO 0.01 -0.14 -0.17 0.20 -0.36 0.00 0.00 175.35 174.89 1h6r s GLY 127 N 1.25 1.46 0.12 5.54 0.00 0.11 -0.41 107.32 115.37 1h6r s GLY 127 Ca -0.03 -0.97 0.01 0.00 0.00 0.00 0.00 44.72 43.72 1h6r s GLY 127 CO -0.04 -0.55 -0.02 -0.26 0.00 0.00 0.00 173.10 172.24 1h6r s ILE 128 N -0.21 0.49 -1.85 0.90 -4.36 -0.64 -0.90 121.20 114.63 1h6r s ILE 128 Ca -0.01 -1.92 0.00 0.00 -0.26 0.00 0.00 60.65 58.46 1h6r s ILE 128 Cb -0.13 -1.84 0.00 0.00 1.25 0.00 0.00 42.46 41.74 1h6r s ILE 128 CO 0.03 -0.72 0.00 0.47 0.24 0.00 0.00 174.94 174.97 1h6r n ASP 129 N -0.08 -5.45 -4.78 4.36 9.92 -1.26 -2.09 116.55 117.16 1h6r n ASP 129 Ca -0.10 0.22 -0.37 0.00 -0.53 0.00 0.00 54.79 54.01 1h6r n ASP 129 Cb 0.62 -4.57 -0.06 0.00 -0.64 0.00 0.00 41.12 36.47 1h6r n ASP 129 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1h6r s PHE 130 N -2.85 3.54 -0.05 1.24 0.40 -1.26 -3.00 117.98 116.00 1h6r s PHE 130 Ca 0.00 1.73 -0.19 0.00 -0.60 0.00 0.00 56.93 57.87 1h6r s PHE 130 Cb 0.00 -2.99 -0.05 0.00 0.51 0.00 0.00 43.02 40.49 1h6r s PHE 130 CO 0.00 -0.07 0.53 0.15 0.70 0.00 0.00 175.22 176.53 1h6r s LYS 131 N -2.23 4.29 0.51 0.44 1.02 -1.26 -4.89 119.74 117.61 1h6r s LYS 131 Ca 0.53 0.59 0.23 0.00 0.02 0.00 0.00 55.97 57.33 1h6r s LYS 131 Cb -0.19 -3.37 1.35 0.00 -0.52 0.00 0.00 37.83 35.09 1h6r s LYS 131 CO 0.25 0.30 2.08 0.93 -0.92 0.00 0.00 175.35 177.99 1h6r h GLU 132 N 6.05 0.00 -0.69 1.68 3.07 -1.96 -0.41 114.58 122.32 1h6r h GLU 132 Ca -0.44 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.36 1h6r h GLU 132 Cb 1.19 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.07 1h6r h GLU 132 CO 0.71 0.12 0.07 -0.40 -1.40 0.00 0.00 179.01 178.11 1h6r n ASP 133 N -3.97 4.92 -4.98 1.42 5.75 -1.26 -4.09 116.55 114.35 1h6r n ASP 133 Ca -0.02 -2.88 -0.20 0.00 -0.01 0.00 0.00 54.79 51.67 1h6r n ASP 133 Cb 0.20 -0.68 0.03 0.00 -1.03 0.00 0.00 41.12 39.65 1h6r n ASP 133 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1h6r s GLY 134 N -0.71 1.85 0.55 6.12 0.00 -0.16 -4.93 107.32 110.03 1h6r s GLY 134 Ca 0.47 -1.40 0.33 0.00 0.00 0.00 0.00 44.72 44.12 1h6r s GLY 134 CO 0.13 -1.13 2.02 3.43 0.00 0.00 0.00 173.10 177.55 1h6r h ASN 135 N 0.17 0.00 0.00 1.64 2.35 -1.92 -0.53 115.58 117.29 1h6r h ASN 135 Ca -0.42 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.33 1h6r h ASN 135 Cb 1.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.66 1h6r h ASN 135 CO 0.51 0.04 -0.19 0.40 -1.65 0.00 0.00 177.43 176.54 1h6r h ILE 136 N 0.00 0.00 0.00 2.81 5.03 -1.95 -1.05 117.51 122.35 1h6r h ILE 136 Ca -0.00 -0.82 -0.05 0.00 -0.12 0.00 0.00 64.86 63.87 1h6r h ILE 136 Cb 0.47 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 34.25 1h6r h ILE 136 CO 0.01 0.00 -0.25 -0.07 -0.68 0.00 0.00 178.15 177.15 1h6r h LEU 137 N -0.82 0.00 -0.31 1.44 3.38 -1.75 -1.98 115.31 115.27 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 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1h6r h LEU 137 CO 0.00 0.25 -0.02 0.61 0.09 0.00 0.00 178.44 179.37 1h6r n GLY 138 N -0.54 -0.72 3.80 0.83 0.00 -0.21 -4.95 105.19 103.41 1h6r n GLY 138 Ca -0.02 -0.28 -0.27 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.67 -1.80 -0.50 1.61 8.25 -0.74 -4.90 115.22 116.47 1h6r n HIS 139 Ca 0.21 0.66 0.09 0.00 -0.26 0.00 0.00 57.72 58.42 1h6r n HIS 139 Cb 0.21 -3.77 0.29 0.00 1.12 0.00 0.00 29.99 27.84 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 -4.29 3.21 -3.65 -0.41 5.02 -0.41 -4.98 118.16 112.64 1h6r n LYS 140 Ca -0.23 -2.62 -0.38 0.00 -2.02 0.00 0.00 58.31 53.07 1h6r n LYS 140 Cb 0.65 -1.65 -0.06 0.00 -0.02 0.00 0.00 35.03 33.95 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 -1.56 4.44 0.61 -0.35 1.43 -1.25 -4.50 118.68 117.50 1h6r s LEU 141 Ca 0.42 0.77 -0.16 0.00 -1.03 0.00 0.00 54.13 54.13 1h6r s LEU 141 Cb 0.26 -2.38 -0.02 0.00 0.03 0.00 0.00 46.19 44.07 1h6r s LEU 141 CO 0.22 0.36 1.09 -1.61 0.23 0.00 0.00 176.35 176.64 1h6r s GLU 142 N -1.05 3.10 -1.25 1.70 2.02 -0.17 -4.93 118.70 118.12 1h6r s GLU 142 Ca 0.20 1.35 -0.13 0.00 0.02 0.00 0.00 54.97 56.41 1h6r s GLU 142 Cb -0.15 -1.99 0.16 0.00 0.10 0.00 0.00 34.13 32.24 1h6r s GLU 142 CO 0.10 -1.00 1.62 0.98 0.02 0.00 0.00 175.26 176.97 1h6r n TYR 143 N -2.07 4.33 -3.49 1.61 9.36 -1.26 -4.79 117.16 120.86 1h6r n TYR 143 Ca 0.10 -3.14 -0.05 0.00 3.32 0.00 0.00 57.90 58.12 1h6r n TYR 143 Cb 0.52 -2.18 0.02 0.00 -0.63 0.00 0.00 39.34 37.07 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 5.43 -1.40 -3.64 2.98 0.23 -1.26 -4.86 115.26 112.74 1h6r n ASN 144 Ca 0.39 -1.96 -0.08 0.00 -0.53 0.00 0.00 54.58 52.40 1h6r n ASN 144 Cb 0.41 2.34 -0.07 0.00 -2.08 0.00 0.00 39.78 40.38 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 -4.77 -1.02 0.36 -2.53 5.04 -1.26 -4.86 117.35 108.30 1h6r s TYR 145 Ca 0.10 2.08 -0.18 0.00 -2.44 0.00 0.00 57.07 56.64 1h6r s TYR 145 Cb -0.03 0.58 -0.10 0.00 0.35 0.00 0.00 41.96 42.77 1h6r s TYR 145 CO 0.07 -0.50 0.82 -0.80 -1.34 0.00 0.00 175.55 173.79 1h6r s ASN 146 N 1.46 6.86 0.17 4.32 0.01 -1.26 -4.66 114.94 121.84 1h6r s ASN 146 Ca -0.09 1.44 -0.07 0.00 -0.71 0.00 0.00 52.86 53.43 1h6r s ASN 146 Cb -0.05 -2.44 -0.06 0.00 0.41 0.00 0.00 41.25 39.11 1h6r s ASN 146 CO -0.17 -0.25 0.45 -0.44 -1.51 0.00 0.00 177.10 175.18 1h6r s SER 147 N -2.20 6.56 -0.09 -1.22 0.01 -1.26 -4.73 113.70 110.77 1h6r s SER 147 Ca 0.56 0.75 -0.32 0.00 1.31 0.00 0.00 55.95 58.25 1h6r s SER 147 Cb -0.10 -2.16 0.14 0.00 0.21 0.00 0.00 66.02 64.11 1h6r s SER 147 CO 0.16 0.02 1.42 -1.38 0.41 0.00 0.00 173.24 173.87 1h6r s HIS 148 N -1.69 -0.00 0.09 2.43 -3.43 -1.03 -5.02 115.29 106.63 1h6r s HIS 148 Ca 0.43 -0.01 0.08 0.00 -0.80 0.00 0.00 55.06 54.76 1h6r s HIS 148 Cb -0.12 0.51 -0.04 0.00 -1.43 0.00 0.00 32.58 31.50 1h6r s HIS 148 CO 0.23 -0.03 -0.17 0.00 -2.00 0.00 0.00 174.74 172.76 1h6r s VAL 150 N -1.07 2.67 -0.36 0.00 -7.23 0.12 -4.95 120.40 109.59 1h6r s VAL 150 Ca 0.17 -1.97 -0.12 0.00 -1.81 0.00 0.00 61.98 58.24 1h6r s VAL 150 Cb -0.11 -2.32 -0.00 0.00 0.56 0.00 0.00 36.38 34.52 1h6r s VAL 150 CO 0.09 -0.17 0.23 -0.47 -0.31 0.00 0.00 175.10 174.47 1h6r s TYR 151 N -1.84 3.22 -0.17 2.82 5.04 -1.26 -1.40 117.35 123.77 1h6r s TYR 151 Ca 0.24 -0.47 -0.18 0.00 -2.44 0.00 0.00 57.07 54.21 1h6r s TYR 151 Cb -0.08 -2.47 -0.04 0.00 0.35 0.00 0.00 41.96 39.72 1h6r s TYR 151 CO 0.13 -0.47 0.50 0.42 -1.34 0.00 0.00 175.55 174.78 1h6r s ILE 152 N 1.67 5.14 0.01 3.14 -1.09 0.88 -4.43 121.20 126.52 1h6r s ILE 152 Ca 0.05 0.95 0.06 0.00 -2.23 0.00 0.00 60.65 59.48 1h6r s ILE 152 Cb -0.18 -3.83 -0.02 0.00 -1.58 0.00 0.00 42.46 36.85 1h6r s ILE 152 CO 0.09 0.24 -0.18 -0.69 -1.23 0.00 0.00 174.94 173.17 1h6r s VAL 153 N 1.20 1.44 0.49 2.92 1.01 -0.91 -1.66 120.40 124.88 1h6r s VAL 153 Ca 0.25 -0.89 -0.20 0.00 0.00 0.00 0.00 61.98 61.13 1h6r s VAL 153 Cb -0.15 -1.22 -0.08 0.00 0.00 0.00 0.00 36.38 34.92 1h6r s VAL 153 CO 0.10 0.31 1.05 0.00 0.00 0.00 0.00 175.10 176.55 1h6r s ALA 154 N -0.56 2.86 -0.48 5.51 0.00 -1.26 -0.86 121.76 126.98 1h6r s ALA 154 Ca 0.06 0.63 0.03 0.00 0.00 0.00 0.00 51.96 52.68 1h6r s ALA 154 Cb -0.07 -3.26 0.13 0.00 0.00 0.00 0.00 23.12 19.91 1h6r s ALA 154 CO 0.00 -0.34 0.24 0.34 0.00 0.00 0.00 175.76 176.00 1h6r s ASP 155 N -1.96 4.08 0.24 0.00 -1.08 0.78 -4.73 116.67 114.00 1h6r s ASP 155 Ca 0.68 -2.81 -0.06 0.00 -0.52 0.00 0.00 52.55 49.83 1h6r s ASP 155 Cb -0.17 -1.40 0.23 0.00 -1.46 0.00 0.00 42.92 40.13 1h6r s ASP 155 CO 0.20 -0.25 1.87 0.11 0.52 0.00 0.00 175.17 177.62 1h6r h LYS 156 N 6.65 1.25 -0.76 4.34 1.57 -1.95 0.02 116.57 127.69 1h6r h LYS 156 Ca -0.05 -0.14 0.10 0.00 -1.87 0.00 0.00 60.65 58.69 1h6r h LYS 156 Cb 0.91 -0.25 -0.05 0.00 0.08 0.00 0.00 32.23 32.92 1h6r h LYS 156 CO 0.60 0.90 0.50 1.96 -0.57 0.00 0.00 179.45 182.84 1h6r h GLN 157 N 1.26 0.63 -0.17 3.15 4.20 -1.95 -0.81 115.11 121.42 1h6r h GLN 157 Ca 0.32 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.99 1h6r h GLN 157 Cb 0.01 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.65 1h6r h GLN 157 CO -0.05 0.42 0.00 1.63 -0.67 0.00 0.00 178.83 180.16 1h6r n LYS 158 N -4.50 2.12 -3.73 1.46 4.76 -0.99 -4.96 118.16 112.32 1h6r n LYS 158 Ca 0.13 -1.94 -0.25 0.00 -2.87 0.00 0.00 58.31 53.38 1h6r n LYS 158 Cb 0.35 -1.43 0.05 0.00 -1.84 0.00 0.00 35.03 32.16 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 1.24 -3.86 0.00 4.39 5.15 -0.16 -4.57 115.26 117.45 1h6r n ASN 159 Ca 0.15 -0.72 0.00 0.00 -0.60 0.00 0.00 54.58 53.41 1h6r n ASN 159 Cb 0.54 -4.33 0.00 0.00 -0.53 0.00 0.00 39.78 35.46 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 -1.67 4.53 3.21 8.20 0.00 -0.31 -4.30 105.19 114.85 1h6r n GLY 160 Ca -0.10 -0.68 -0.12 0.00 0.00 0.00 0.00 46.02 45.12 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 0.41 0.59 0.03 -0.61 -5.25 -0.97 -0.15 121.20 115.24 1h6r s ILE 161 Ca 0.00 -1.96 0.00 0.00 -0.99 0.00 0.00 60.65 57.70 1h6r s ILE 161 Cb 0.00 -2.02 -0.03 0.00 2.95 0.00 0.00 42.46 43.36 1h6r s ILE 161 CO 0.00 -0.55 -0.04 -1.59 -1.79 0.00 0.00 174.94 170.97 1h6r s LYS 162 N -3.92 0.42 -0.11 0.37 -2.85 -0.04 -0.99 119.74 112.62 1h6r s LYS 162 Ca 0.22 -0.78 -0.13 0.00 -1.00 0.00 0.00 55.97 54.28 1h6r s LYS 162 Cb 0.06 0.08 0.03 0.00 -2.06 0.00 0.00 37.83 35.95 1h6r s LYS 162 CO 0.02 -0.05 0.34 0.08 0.10 0.00 0.00 175.35 175.84 1h6r s VAL 163 N -2.07 0.01 -0.07 1.79 1.01 -0.61 -2.14 120.40 118.31 1h6r s VAL 163 Ca -0.09 -0.07 0.01 0.00 0.00 0.00 0.00 61.98 61.82 1h6r s VAL 163 Cb -0.05 -0.51 0.02 0.00 0.00 0.00 0.00 36.38 35.84 1h6r s VAL 163 CO -0.03 -0.04 -0.07 0.21 0.00 0.00 0.00 175.10 175.17 1h6r s ASN 164 N -0.05 1.63 0.14 3.32 3.04 -1.26 -0.02 114.94 121.74 1h6r s ASN 164 Ca -0.02 -0.22 -0.14 0.00 0.04 0.00 0.00 52.86 52.52 1h6r s ASN 164 Cb -0.03 -0.66 0.02 0.00 -1.54 0.00 0.00 41.25 39.04 1h6r s ASN 164 CO 0.01 -0.07 0.37 0.72 -3.04 0.00 0.00 177.10 175.09 1h6r s PHE 165 N 1.24 -0.04 -0.06 0.43 -0.12 -0.77 -4.66 117.98 114.00 1h6r s PHE 165 Ca -0.05 -0.31 0.05 0.00 -0.05 0.00 0.00 56.93 56.57 1h6r s PHE 165 Cb -0.14 0.19 -0.01 0.00 -0.63 0.00 0.00 43.02 42.43 1h6r s PHE 165 CO -0.02 -0.72 -0.22 0.15 -0.05 0.00 0.00 175.22 174.36 1h6r s LYS 166 N -3.85 2.60 -0.13 1.99 1.02 -1.26 -0.19 119.74 119.92 1h6r s LYS 166 Ca 0.07 -0.85 -0.05 0.00 0.02 0.00 0.00 55.97 55.16 1h6r s LYS 166 Cb 0.02 -2.24 -0.04 0.00 -0.52 0.00 0.00 37.83 35.05 1h6r s LYS 166 CO -0.08 0.42 0.06 0.42 -0.92 0.00 0.00 175.35 175.24 1h6r s ILE 167 N -0.24 4.77 -0.26 2.17 -1.09 -0.15 -4.94 121.20 121.47 1h6r s ILE 167 Ca -0.01 -0.06 -0.05 0.00 -2.23 0.00 0.00 60.65 58.31 1h6r s ILE 167 Cb -0.13 -3.08 0.01 0.00 -1.58 0.00 0.00 42.46 37.68 1h6r s ILE 167 CO 0.03 0.56 0.01 -0.13 -1.23 0.00 0.00 174.94 174.18 1h6r s ARG 168 N -0.52 3.13 -0.22 2.79 0.52 -1.26 -0.42 118.95 122.97 1h6r s ARG 168 Ca 0.10 -0.81 -0.16 0.00 -0.52 0.00 0.00 55.73 54.34 1h6r s ARG 168 Cb -0.12 -3.18 -0.04 0.00 0.52 0.00 0.00 34.95 32.14 1h6r s ARG 168 CO 0.02 -0.36 0.43 -1.01 0.02 0.00 0.00 175.30 174.40 1h6r s HIS 169 N 1.45 3.34 0.42 -0.53 3.76 0.30 -4.57 115.29 119.46 1h6r s HIS 169 Ca 0.03 0.61 -0.24 0.00 -0.15 0.00 0.00 55.06 55.31 1h6r s HIS 169 Cb -0.16 -2.58 -0.08 0.00 1.11 0.00 0.00 32.58 30.87 1h6r s HIS 169 CO -0.01 -0.09 1.15 -0.80 -0.85 0.00 0.00 174.74 174.14 1h6r s ASN 170 N 1.22 6.44 -0.03 1.40 -0.87 -1.26 -0.21 114.94 121.62 1h6r s ASN 170 Ca 0.19 2.29 0.06 0.00 -1.57 0.00 0.00 52.86 53.84 1h6r s ASN 170 Cb -0.15 -2.61 -0.01 0.00 -0.02 0.00 0.00 41.25 38.46 1h6r s ASN 170 CO 0.09 -0.73 -0.22 -0.63 -2.57 0.00 0.00 177.10 173.04 1h6r s ILE 171 N -1.49 1.77 0.28 0.60 1.01 -0.08 -1.00 121.20 122.28 1h6r s ILE 171 Ca 0.59 -0.93 -0.03 0.00 0.00 0.00 0.00 60.65 60.28 1h6r s ILE 171 Cb -0.29 -1.49 0.34 0.00 0.01 0.00 0.00 42.46 41.04 1h6r s ILE 171 CO 0.36 0.50 1.61 -0.33 0.00 0.00 0.00 174.94 177.08 1h6r h GLU 172 N 5.85 0.08 0.00 2.79 5.08 -1.84 0.26 114.58 126.79 1h6r h GLU 172 Ca -0.36 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1h6r h GLU 172 Cb 1.15 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1h6r h GLU 172 CO 0.47 0.05 0.00 -0.40 -1.00 0.00 0.00 179.01 178.13 1h6r n ASP 173 N -5.40 0.00 0.00 1.42 3.85 -1.26 -4.75 116.55 110.41 1h6r n ASP 173 Ca 0.18 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.26 1h6r n ASP 173 Cb 0.61 -0.10 0.00 0.00 -1.35 0.00 0.00 41.12 40.28 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 -0.83 0.50 3.93 6.12 0.00 0.90 -5.07 105.19 110.75 1h6r n GLY 174 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1h6r n GLY 174 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h6r s SER 175 N -1.87 3.19 0.02 1.61 1.04 -1.21 -4.81 113.70 111.67 1h6r s SER 175 Ca 0.00 0.28 -0.02 0.00 0.48 0.00 0.00 55.95 56.69 1h6r s SER 175 Cb 0.00 -0.34 -0.02 0.00 0.10 0.00 0.00 66.02 65.76 1h6r s SER 175 CO 0.00 -2.69 0.01 0.68 0.98 0.00 0.00 173.24 172.22 1h6r s VAL 176 N -3.87 0.12 -0.27 5.02 -7.23 -1.26 -0.91 120.40 112.00 1h6r s VAL 176 Ca 0.73 -0.97 -0.08 0.00 -1.81 0.00 0.00 61.98 59.85 1h6r s VAL 176 Cb -0.04 -0.47 -0.02 0.00 0.56 0.00 0.00 36.38 36.40 1h6r s VAL 176 CO 0.53 -0.54 0.11 -1.58 -0.31 0.00 0.00 175.10 173.31 1h6r s GLN 177 N -1.79 3.58 0.12 4.82 2.00 0.71 -4.91 119.66 124.19 1h6r s GLN 177 Ca -0.13 -0.54 -0.26 0.00 -2.00 0.00 0.00 55.36 52.43 1h6r s GLN 177 Cb -0.07 -3.44 -0.07 0.00 0.80 0.00 0.00 33.01 30.23 1h6r s GLN 177 CO -0.02 -0.26 0.80 -0.51 -0.50 0.00 0.00 175.29 174.80 1h6r s LEU 178 N 1.63 4.54 -0.26 3.68 1.43 -1.26 -0.54 118.68 127.90 1h6r s LEU 178 Ca 0.06 1.61 0.00 0.00 -1.03 0.00 0.00 54.13 54.77 1h6r s LEU 178 Cb -0.16 -3.32 0.08 0.00 0.03 0.00 0.00 46.19 42.82 1h6r s LEU 178 CO 0.05 0.11 0.02 0.00 0.23 0.00 0.00 176.35 176.76 1h6r s ALA 179 N -0.67 1.80 -0.37 4.21 0.00 0.44 -1.43 121.76 125.75 1h6r s ALA 179 Ca 0.38 -1.49 -0.23 0.00 0.00 0.00 0.00 51.96 50.63 1h6r s ALA 179 Cb -0.22 -1.51 0.01 0.00 0.00 0.00 0.00 23.12 21.39 1h6r s ALA 179 CO 0.26 -1.39 0.76 0.34 0.00 0.00 0.00 175.76 175.73 1h6r s ASP 180 N 1.47 6.52 -0.16 0.00 2.15 0.28 -0.97 116.67 125.96 1h6r s ASP 180 Ca 0.01 0.29 -0.11 0.00 0.43 0.00 0.00 52.55 53.17 1h6r s ASP 180 Cb -0.18 -2.38 -0.05 0.00 -0.30 0.00 0.00 42.92 40.01 1h6r s ASP 180 CO -0.12 -0.72 0.20 -1.00 -0.17 0.00 0.00 175.17 173.36 1h6r s HIS 181 N 3.05 3.48 -0.16 -5.34 3.76 0.74 -0.69 115.29 120.12 1h6r s HIS 181 Ca 0.30 0.48 0.01 0.00 -0.15 0.00 0.00 55.06 55.70 1h6r s HIS 181 Cb -0.13 -2.19 0.02 0.00 1.11 0.00 0.00 32.58 31.39 1h6r s HIS 181 CO 0.17 0.37 -0.19 0.71 -0.85 0.00 0.00 174.74 174.95 1h6r s TYR 182 N 0.08 2.58 0.01 1.40 1.51 -0.20 -1.84 117.35 120.89 1h6r s TYR 182 Ca 0.13 -1.46 0.05 0.00 -1.01 0.00 0.00 57.07 54.77 1h6r s TYR 182 Cb -0.12 -1.80 -0.02 0.00 -0.11 0.00 0.00 41.96 39.91 1h6r s TYR 182 CO 0.02 -0.73 -0.14 -1.14 -1.11 0.00 0.00 175.55 172.45 1h6r s GLN 183 N 1.23 1.04 -0.02 -0.62 0.74 0.97 -1.53 119.66 121.48 1h6r s GLN 183 Ca 0.02 -0.61 0.01 0.00 0.05 0.00 0.00 55.36 54.83 1h6r s GLN 183 Cb -0.13 -1.03 0.01 0.00 1.10 0.00 0.00 33.01 32.96 1h6r s GLN 183 CO -0.10 0.27 -0.04 -1.14 -0.55 0.00 0.00 175.29 173.74 1h6r s GLN 184 N -0.68 0.52 -0.07 1.67 0.74 -0.19 -1.57 119.66 120.07 1h6r s GLN 184 Ca 0.04 -0.10 0.04 0.00 0.05 0.00 0.00 55.36 55.39 1h6r s GLN 184 Cb -0.06 -0.55 -0.00 0.00 1.10 0.00 0.00 33.01 33.49 1h6r s GLN 184 CO 0.00 -0.01 -0.20 -0.80 -0.55 0.00 0.00 175.29 173.73 1h6r s ASN 185 N 0.47 2.59 -0.03 6.67 -0.87 -0.16 -0.91 114.94 122.71 1h6r s ASN 185 Ca -0.05 -0.44 0.02 0.00 -1.57 0.00 0.00 52.86 50.81 1h6r s ASN 185 Cb -0.09 -0.94 0.01 0.00 -0.02 0.00 0.00 41.25 40.21 1h6r s ASN 185 CO -0.00 0.16 -0.09 -0.89 -2.57 0.00 0.00 177.10 173.71 1h6r s THR 186 N 0.18 0.78 0.59 1.60 2.01 -0.50 -2.28 115.64 118.01 1h6r s THR 186 Ca -0.10 -0.34 -0.19 0.00 0.31 0.00 0.00 61.69 61.37 1h6r s THR 186 Cb -0.15 -0.71 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 1h6r s THR 186 CO 0.05 0.25 1.18 -2.16 -0.69 0.00 0.00 174.62 173.25 1h6r s PRO 187 N 0.32 3.03 -0.06 4.92 0.04 -1.26 -0.73 135.00 141.26 1h6r s PRO 187 Ca -0.05 1.75 -0.14 0.00 0.04 0.00 0.00 61.00 62.59 1h6r s PRO 187 Cb -0.10 -1.95 -0.30 0.00 0.04 0.00 0.00 34.50 32.19 1h6r s PRO 187 CO 0.01 -1.14 0.69 0.82 0.04 0.00 0.00 177.00 177.42 1h6r h ILE 188 N 0.88 1.05 -2.91 0.56 2.04 -1.39 -3.45 117.51 114.30 1h6r h ILE 188 Ca -0.50 -2.50 -0.02 0.00 1.00 0.00 0.00 64.86 62.85 1h6r h ILE 188 Cb 1.29 2.82 0.00 0.00 -0.74 0.00 0.00 36.82 40.19 1h6r h ILE 188 CO 0.55 0.79 0.01 0.61 0.00 0.00 0.00 178.15 180.11 1h6r n GLY 189 N 1.79 0.14 0.68 5.37 0.00 -1.26 -5.02 105.19 106.90 1h6r n GLY 189 Ca -0.23 -1.86 0.07 0.00 0.00 0.00 0.00 46.02 43.99 1h6r n GLY 189 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h6r n ASP 190 N -3.01 2.77 -4.22 1.61 8.00 -1.26 -5.02 116.55 115.42 1h6r n ASP 190 Ca 0.01 -1.85 -0.29 0.00 0.71 0.00 0.00 54.79 53.36 1h6r n ASP 190 Cb 0.02 -0.18 0.20 0.00 -0.02 0.00 0.00 41.12 41.13 1h6r n ASP 190 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1h6r s GLY 191 N -1.03 1.62 0.39 0.44 0.00 -1.26 -5.00 107.32 102.48 1h6r s GLY 191 Ca 0.23 -0.83 -0.25 0.00 0.00 0.00 0.00 44.72 43.87 1h6r s GLY 191 CO 0.18 -0.08 1.14 2.56 0.00 0.00 0.00 173.10 176.90 1h6r s PRO 192 N -5.42 4.12 0.15 2.90 0.04 -1.26 -5.05 135.00 130.47 1h6r s PRO 192 Ca 0.69 1.77 0.05 0.00 0.04 0.00 0.00 61.00 63.55 1h6r s PRO 192 Cb -0.11 -2.69 -0.04 0.00 0.04 0.00 0.00 34.50 31.70 1h6r s PRO 192 CO 0.55 -0.24 -0.11 0.14 0.04 0.00 0.00 177.00 177.37 1h6r s VAL 193 N -1.44 1.25 -0.47 -0.36 -7.23 -1.26 -4.71 120.40 106.18 1h6r s VAL 193 Ca 0.56 -2.01 -0.19 0.00 -1.81 0.00 0.00 61.98 58.53 1h6r s VAL 193 Cb -0.29 -1.80 0.04 0.00 0.56 0.00 0.00 36.38 34.89 1h6r s VAL 193 CO 0.37 -0.67 0.60 -0.76 -0.31 0.00 0.00 175.10 174.32 1h6r s LEU 194 N -3.05 4.80 -0.14 1.32 1.43 -1.26 -5.03 118.68 116.74 1h6r s LEU 194 Ca 0.16 -0.69 -0.23 0.00 -1.03 0.00 0.00 54.13 52.33 1h6r s LEU 194 Cb 0.01 -2.52 -0.02 0.00 0.03 0.00 0.00 46.19 43.68 1h6r s LEU 194 CO 0.02 -0.80 0.73 -0.76 0.23 0.00 0.00 176.35 175.76 1h6r s LEU 195 N 2.61 4.21 0.48 1.79 1.43 -1.26 -3.41 118.68 124.53 1h6r s LEU 195 Ca 0.17 1.08 -0.08 0.00 -1.03 0.00 0.00 54.13 54.27 1h6r s LEU 195 Cb -0.17 -3.09 -0.05 0.00 0.03 0.00 0.00 46.19 42.92 1h6r s LEU 195 CO 0.14 -0.27 0.82 -2.16 0.23 0.00 0.00 176.35 175.11 1h6r s PRO 196 N 1.63 3.63 0.68 1.29 0.04 -1.26 -4.88 135.00 136.11 1h6r s PRO 196 Ca 0.35 0.37 -0.11 0.00 0.04 0.00 0.00 61.00 61.65 1h6r s PRO 196 Cb -0.17 -2.33 -0.01 0.00 0.04 0.00 0.00 34.50 32.03 1h6r s PRO 196 CO 0.14 -0.21 1.05 -0.51 0.04 0.00 0.00 177.00 177.51 1h6r s ASP 197 N -3.82 5.63 0.33 6.66 1.01 -1.26 -4.10 116.67 121.11 1h6r s ASP 197 Ca 0.50 1.51 -0.29 0.00 0.71 0.00 0.00 52.55 54.98 1h6r s ASP 197 Cb -0.10 -2.44 -0.12 0.00 1.01 0.00 0.00 42.92 41.27 1h6r s ASP 197 CO 0.42 -1.27 1.38 0.59 0.21 0.00 0.00 175.17 176.51 1h6r n ASN 198 N -3.01 3.13 -1.73 0.27 3.02 -1.26 -4.83 115.26 110.84 1h6r n ASN 198 Ca 0.07 1.20 -0.04 0.00 -0.03 0.00 0.00 54.58 55.78 1h6r n ASN 198 Cb 0.54 -1.52 0.01 0.00 -0.61 0.00 0.00 39.78 38.20 1h6r n ASN 198 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1h6r n HIS 199 N 0.75 -1.55 -4.52 3.10 1.44 -0.67 -4.74 115.22 109.03 1h6r n HIS 199 Ca 0.05 -0.77 -0.30 0.00 -2.01 0.00 0.00 57.72 54.69 1h6r n HIS 199 Cb 0.36 0.38 -0.12 0.00 0.12 0.00 0.00 29.99 30.73 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 -6.16 2.50 -0.15 -1.40 1.51 -0.01 -0.08 117.35 113.56 1h6r s TYR 200 Ca 0.07 -0.29 0.01 0.00 -1.01 0.00 0.00 57.07 55.85 1h6r s TYR 200 Cb -0.02 -1.39 0.00 0.00 -0.11 0.00 0.00 41.96 40.44 1h6r s TYR 200 CO 0.05 0.30 -0.18 -0.51 -1.11 0.00 0.00 175.55 174.10 1h6r s LEU 201 N -1.75 2.33 -0.13 -1.29 1.43 -0.50 -1.02 118.68 117.75 1h6r s LEU 201 Ca 0.16 -0.53 -0.02 0.00 -1.03 0.00 0.00 54.13 52.70 1h6r s LEU 201 Cb -0.10 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.57 1h6r s LEU 201 CO 0.07 0.07 -0.06 0.00 0.23 0.00 0.00 176.35 176.66 1h6r s TYR 203 N 0.13 2.62 -0.05 0.00 1.51 -0.05 -0.84 117.35 120.67 1h6r s TYR 203 Ca -0.02 -0.21 -0.01 0.00 -1.01 0.00 0.00 57.07 55.81 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 0.03 0.22 0.01 -0.65 -1.11 0.00 0.00 175.55 174.04 1h6r s GLN 204 N -1.11 0.43 0.05 -0.62 -0.21 -0.53 -2.47 119.66 115.20 1h6r s GLN 204 Ca 0.13 0.12 0.05 0.00 0.02 0.00 0.00 55.36 55.68 1h6r s GLN 204 Cb -0.11 -0.75 -0.02 0.00 1.00 0.00 0.00 33.01 33.13 1h6r s GLN 204 CO 0.03 -0.24 -0.14 -1.12 -2.12 0.00 0.00 175.29 171.71 1h6r s SER 205 N 1.64 1.61 -0.05 5.90 0.01 -1.26 -0.60 113.70 120.95 1h6r s SER 205 Ca -0.01 -0.53 0.00 0.00 1.31 0.00 0.00 55.95 56.73 1h6r s SER 205 Cb -0.13 -0.07 0.02 0.00 0.21 0.00 0.00 66.02 66.05 1h6r s SER 205 CO -0.03 -0.03 -0.03 0.00 0.41 0.00 0.00 173.24 173.56 1h6r s ALA 206 N -1.05 0.63 -0.11 1.44 0.00 0.61 -4.61 121.76 118.66 1h6r s ALA 206 Ca -0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 51.96 51.87 1h6r s ALA 206 Cb -0.09 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.52 1h6r s ALA 206 CO 0.02 -0.12 0.06 -0.51 0.00 0.00 0.00 175.76 175.21 1h6r s LEU 207 N 1.15 3.90 0.00 0.00 1.43 -1.26 -1.22 118.68 122.67 1h6r s LEU 207 Ca -0.08 0.25 -0.01 0.00 -1.03 0.00 0.00 54.13 53.27 1h6r s LEU 207 Cb -0.14 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.16 1h6r s LEU 207 CO -0.01 0.37 0.23 -1.54 0.23 0.00 0.00 176.35 175.62 1h6r n SER 208 N 2.25 -0.64 -4.21 2.29 3.41 0.22 -4.93 113.62 112.02 1h6r n SER 208 Ca -0.19 -1.91 -0.20 0.00 -0.26 0.00 0.00 58.87 56.31 1h6r n SER 208 Cb 0.54 1.20 -0.12 0.00 -0.26 0.00 0.00 64.21 65.57 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 -2.39 0.93 -0.32 4.33 -0.14 -1.26 -1.36 119.74 119.54 1h6r s LYS 209 Ca 0.14 -1.03 -0.23 0.00 -1.36 0.00 0.00 55.97 53.49 1h6r s LYS 209 Cb -0.00 -1.03 0.00 0.00 -1.68 0.00 0.00 37.83 35.11 1h6r s LYS 209 CO 0.10 0.23 0.75 0.34 -0.76 0.00 0.00 175.35 176.02 1h6r s ASP 210 N -1.80 6.60 0.61 2.83 -1.08 -1.26 -4.94 116.67 117.63 1h6r s ASP 210 Ca 0.01 0.55 0.32 0.00 -0.52 0.00 0.00 52.55 52.90 1h6r s ASP 210 Cb -0.10 -2.39 1.82 0.00 -1.46 0.00 0.00 42.92 40.79 1h6r s ASP 210 CO 0.03 -0.61 2.17 1.55 0.52 0.00 0.00 175.17 178.83 1h6r h PRO 211 N 8.21 0.00 -0.62 4.34 0.13 -2.04 -1.58 132.00 140.44 1h6r h PRO 211 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1h6r h PRO 211 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1h6r h PRO 211 CO 0.87 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.73 1h6r n ASN 212 N -3.61 3.75 -4.56 1.44 3.02 -1.26 -4.92 115.26 109.11 1h6r n ASN 212 Ca -0.01 -2.00 -0.37 0.00 -0.03 0.00 0.00 54.58 52.18 1h6r n ASN 212 Cb 0.23 -0.41 -0.11 0.00 -0.61 0.00 0.00 39.78 38.88 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 -1.18 3.87 0.03 3.52 2.56 -0.60 -4.97 118.70 121.94 1h6r s GLU 213 Ca 0.46 -0.37 0.20 0.00 0.00 0.00 0.00 54.97 55.25 1h6r s GLU 213 Cb 0.25 -3.43 -0.17 0.00 2.00 0.00 0.00 34.13 32.77 1h6r s GLU 213 CO 0.33 -0.05 0.68 1.63 -0.56 0.00 0.00 175.26 177.28 1h6r n LYS 214 N 4.58 0.64 -1.60 4.30 5.02 -1.26 -4.87 118.16 124.96 1h6r n LYS 214 Ca -0.15 0.06 -0.31 0.00 -2.02 0.00 0.00 58.31 55.88 1h6r n LYS 214 Cb 0.52 -1.70 0.05 0.00 -0.02 0.00 0.00 35.03 33.88 1h6r n LYS 214 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1h6r s ARG 215 N -3.12 2.87 0.13 1.97 0.52 -1.26 -4.95 118.95 115.11 1h6r s ARG 215 Ca -0.05 1.05 -0.31 0.00 -0.52 0.00 0.00 55.73 55.90 1h6r s ARG 215 Cb 0.10 -1.98 -0.09 0.00 0.52 0.00 0.00 34.95 33.50 1h6r s ARG 215 CO 0.83 -1.16 1.57 0.34 0.02 0.00 0.00 175.30 176.91 1h6r s ASP 216 N -3.51 6.62 0.32 0.23 3.68 -1.26 -4.95 116.67 117.80 1h6r s ASP 216 Ca 0.60 2.53 -0.17 0.00 2.13 0.00 0.00 52.55 57.64 1h6r s ASP 216 Cb -0.15 -2.58 0.03 0.00 -1.45 0.00 0.00 42.92 38.76 1h6r s ASP 216 CO 0.52 -0.82 0.70 -1.38 0.13 0.00 0.00 175.17 174.32 1h6r s HIS 217 N 1.64 0.05 -0.06 -5.34 -3.43 -1.26 -2.78 115.29 104.11 1h6r s HIS 217 Ca 0.70 -0.56 -0.02 0.00 -0.80 0.00 0.00 55.06 54.38 1h6r s HIS 217 Cb -0.41 0.65 0.04 0.00 -1.43 0.00 0.00 32.58 31.43 1h6r s HIS 217 CO 0.31 -1.32 0.12 1.41 -2.00 0.00 0.00 174.74 173.26 1h6r s MET 218 N -3.32 0.07 -0.18 -0.38 0.00 -0.47 -4.97 119.30 110.04 1h6r s MET 218 Ca 0.15 0.33 -0.08 0.00 0.00 0.00 0.00 55.69 56.10 1h6r s MET 218 Cb -0.05 -0.19 -0.04 0.00 0.00 0.00 0.00 34.83 34.55 1h6r s MET 218 CO 0.10 -0.16 0.06 0.08 0.00 0.00 0.00 175.02 175.10 1h6r s VAL 219 N 1.14 4.80 -0.07 10.11 1.01 -0.46 -0.41 120.40 136.52 1h6r s VAL 219 Ca -0.09 -0.03 0.04 0.00 0.00 0.00 0.00 61.98 61.90 1h6r s VAL 219 Cb -0.12 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.10 1h6r s VAL 219 CO -0.05 0.46 -0.19 -0.22 0.00 0.00 0.00 175.10 175.10 1h6r s LEU 220 N 0.39 1.91 -0.14 3.92 2.96 0.72 -0.61 118.68 127.83 1h6r s LEU 220 Ca 0.03 -0.42 0.02 0.00 -0.22 0.00 0.00 54.13 53.54 1h6r s LEU 220 Cb -0.12 -1.11 0.01 0.00 0.50 0.00 0.00 46.19 45.46 1h6r s LEU 220 CO 0.00 0.13 -0.21 -0.22 -1.32 0.00 0.00 176.35 174.74 1h6r s LEU 221 N 0.28 2.19 -0.01 -0.68 2.96 -0.36 -1.28 118.68 121.79 1h6r s LEU 221 Ca -0.12 -0.58 0.01 0.00 -0.22 0.00 0.00 54.13 53.23 1h6r s LEU 221 Cb -0.15 -1.47 0.00 0.00 0.50 0.00 0.00 46.19 45.07 1h6r s LEU 221 CO 0.05 0.08 -0.04 -0.70 -1.32 0.00 0.00 176.35 174.42 1h6r s GLU 222 N 0.81 0.39 -0.11 1.98 2.12 -0.24 -0.29 118.70 123.36 1h6r s GLU 222 Ca -0.07 -0.13 0.03 0.00 0.36 0.00 0.00 54.97 55.16 1h6r s GLU 222 Cb -0.16 -0.40 -0.00 0.00 0.26 0.00 0.00 34.13 33.83 1h6r s GLU 222 CO -0.01 0.06 -0.21 -0.06 -0.54 0.00 0.00 175.26 174.49 1h6r s PHE 223 N 0.09 2.63 -0.10 5.30 0.08 0.23 -0.68 117.98 125.54 1h6r s PHE 223 Ca -0.01 -0.98 0.01 0.00 0.12 0.00 0.00 56.93 56.07 1h6r s PHE 223 Cb -0.04 -1.75 0.02 0.00 -0.57 0.00 0.00 43.02 40.68 1h6r s PHE 223 CO -0.00 -0.39 -0.10 0.08 -0.10 0.00 0.00 175.22 174.71 1h6r s VAL 224 N 0.39 1.11 -0.05 -0.44 1.01 0.18 -1.46 120.40 121.14 1h6r s VAL 224 Ca -0.16 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 61.45 1h6r s VAL 224 Cb -0.17 -1.08 0.02 0.00 0.00 0.00 0.00 36.38 35.15 1h6r s VAL 224 CO 0.07 0.37 -0.09 -0.89 0.00 0.00 0.00 175.10 174.56 1h6r s THR 225 N 1.31 0.86 0.35 3.92 2.01 -0.02 -0.63 115.64 123.43 1h6r s THR 225 Ca -0.02 -0.32 -0.10 0.00 0.31 0.00 0.00 61.69 61.55 1h6r s THR 225 Cb -0.14 -0.81 -0.07 0.00 0.01 0.00 0.00 72.50 71.49 1h6r s THR 225 CO -0.04 0.29 0.69 0.00 -0.69 0.00 0.00 174.62 174.87 1h6r s ALA 226 N 0.71 3.43 0.12 7.40 0.00 -0.16 -0.33 121.76 132.93 1h6r s ALA 226 Ca -0.13 -0.24 -0.25 0.00 0.00 0.00 0.00 51.96 51.34 1h6r s ALA 226 Cb -0.15 -2.60 0.07 0.00 0.00 0.00 0.00 23.12 20.45 1h6r s ALA 226 CO 0.02 0.16 0.76 0.00 0.00 0.00 0.00 175.76 176.70 1h6r s ALA 227 N -2.18 -1.63 0.00 0.00 0.00 -0.19 -4.43 121.76 113.33 1h6r s ALA 227 Ca 0.50 0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.97 1h6r s ALA 227 Cb -0.10 0.69 0.00 0.00 0.00 0.00 0.00 23.12 23.71 1h6r s ALA 227 CO 0.27 -0.81 0.00 0.41 0.00 0.00 0.00 175.76 175.63 1h6r n GLY 228 N -0.36 0.86 3.78 0.00 0.00 -1.26 -0.83 105.19 107.38 1h6r n GLY 228 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.74 3.78 0.50 -0.61 -1.09 -1.26 -4.96 121.20 116.81 1h6r s ILE 229 Ca 0.00 1.45 -0.23 0.00 -2.23 0.00 0.00 60.65 59.64 1h6r s ILE 229 Cb 0.00 -3.79 -0.06 0.00 -1.58 0.00 0.00 42.46 37.02 1h6r s ILE 229 CO 0.00 0.09 1.31 0.28 -1.23 0.00 0.00 174.94 175.40 1h6r s THR 230 N -1.57 2.40 -0.12 2.92 -1.32 -1.26 -4.91 115.64 111.78 1h6r s THR 230 Ca 0.54 0.31 0.15 0.00 -1.21 0.00 0.00 61.69 61.48 1h6r s THR 230 Cb -0.23 -3.16 -0.01 0.00 -1.51 0.00 0.00 72.50 67.59 1h6r s THR 230 CO 0.29 0.01 1.29 0.45 -2.21 0.00 0.00 174.62 174.45 1h6r h HIS 231 N 1.86 0.00 0.00 9.09 3.86 -1.94 -3.49 115.15 124.53 1h6r h HIS 231 Ca -0.50 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.71 1h6r h HIS 231 Cb 1.28 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.75 1h6r h HIS 231 CO 0.49 0.57 0.00 0.41 0.86 0.00 0.00 177.93 180.26