#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xxe n GLU 4 N 0.00 0.49 -5.23 3.23 1.02 0.52 -4.62 120.64 116.07 1xxe n GLU 4 Ca 0.00 0.18 -0.30 0.00 -0.02 0.00 0.00 57.16 57.02 1xxe n GLU 4 Cb 0.00 -1.43 -0.16 0.00 -0.02 0.00 0.00 31.44 29.83 1xxe n GLU 4 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1xxe s LYS 5 N -1.49 2.05 0.29 3.49 2.47 -1.26 -1.18 119.74 124.11 1xxe s LYS 5 Ca 0.63 -0.88 0.04 0.00 -1.56 0.00 0.00 55.97 54.20 1xxe s LYS 5 Cb -0.62 -1.95 -0.04 0.00 -1.46 0.00 0.00 37.83 33.77 1xxe s LYS 5 CO 0.59 0.51 0.20 -0.08 0.16 0.00 0.00 175.35 176.72 1xxe s THR 6 N -0.52 0.13 0.15 3.43 -1.32 -0.84 -2.26 115.64 114.41 1xxe s THR 6 Ca 0.08 -2.00 -0.21 0.00 -1.21 0.00 0.00 61.69 58.34 1xxe s THR 6 Cb -0.10 -2.50 -0.08 0.00 -1.51 0.00 0.00 72.50 68.32 1xxe s THR 6 CO -0.00 0.00 0.68 0.68 -2.21 0.00 0.00 174.62 173.77 1xxe s VAL 7 N -3.67 4.56 -0.00 5.08 -7.23 -1.26 0.66 120.40 118.53 1xxe s VAL 7 Ca 0.38 1.40 -0.22 0.00 -1.81 0.00 0.00 61.98 61.73 1xxe s VAL 7 Cb 0.04 -3.97 -0.20 0.00 0.56 0.00 0.00 36.38 32.81 1xxe s VAL 7 CO 0.20 0.44 1.15 0.50 -0.31 0.00 0.00 175.10 177.08 1xxe h LYS 8 N 4.13 0.31 -5.76 4.82 3.64 -0.04 -3.42 116.57 120.24 1xxe h LYS 8 Ca -0.48 -0.26 -0.49 0.00 -1.27 0.00 0.00 60.65 58.15 1xxe h LYS 8 Cb 1.20 0.06 -0.19 0.00 -0.41 0.00 0.00 32.23 32.89 1xxe h LYS 8 CO 0.65 0.92 -0.78 -2.00 -2.27 0.00 0.00 179.45 175.97 1xxe s GLU 9 N -3.53 1.13 0.34 1.90 2.12 -1.26 -4.98 118.70 114.42 1xxe s GLU 9 Ca -0.14 -1.28 -0.29 0.00 0.36 0.00 0.00 54.97 53.62 1xxe s GLU 9 Cb 0.03 -1.16 -0.11 0.00 0.26 0.00 0.00 34.13 33.15 1xxe s GLU 9 CO 0.77 0.24 1.44 0.21 -0.54 0.00 0.00 175.26 177.38 1xxe s LYS 10 N -2.53 4.21 0.37 4.30 2.36 -1.26 -4.89 119.74 122.30 1xxe s LYS 10 Ca 0.11 2.43 0.08 0.00 -2.55 0.00 0.00 55.97 56.03 1xxe s LYS 10 Cb -0.06 -3.02 -0.07 0.00 -1.05 0.00 0.00 37.83 33.62 1xxe s LYS 10 CO 0.05 -0.43 -0.03 -0.51 1.55 0.00 0.00 175.35 175.98 1xxe s LEU 11 N -1.59 2.77 -0.05 5.43 1.02 -0.86 -4.97 118.68 120.43 1xxe s LEU 11 Ca 0.54 -1.29 -0.26 0.00 0.02 0.00 0.00 54.13 53.14 1xxe s LEU 11 Cb -0.44 -0.91 0.06 0.00 0.02 0.00 0.00 46.19 44.92 1xxe s LEU 11 CO 0.56 -0.35 0.57 -0.94 0.02 0.00 0.00 176.35 176.20 1xxe s SER 12 N -3.65 -0.52 0.08 2.29 1.04 -1.26 -1.30 113.70 110.39 1xxe s SER 12 Ca 0.34 0.57 0.02 0.00 0.48 0.00 0.00 55.95 57.36 1xxe s SER 12 Cb 0.07 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.67 1xxe s SER 12 CO 0.17 -0.54 -0.08 -0.36 0.98 0.00 0.00 173.24 173.41 1xxe s PHE 13 N -1.13 0.89 -0.06 5.02 0.08 -0.23 -4.96 117.98 117.59 1xxe s PHE 13 Ca -0.11 -0.73 -0.04 0.00 0.12 0.00 0.00 56.93 56.17 1xxe s PHE 13 Cb -0.02 -0.51 0.02 0.00 -0.57 0.00 0.00 43.02 41.95 1xxe s PHE 13 CO 0.08 -0.09 0.14 -1.83 -0.10 0.00 0.00 175.22 173.42 1xxe s GLU 14 N -2.93 0.12 0.00 0.44 4.04 -1.26 -0.95 118.70 118.16 1xxe s GLU 14 Ca 0.04 0.27 0.00 0.00 0.04 0.00 0.00 54.97 55.32 1xxe s GLU 14 Cb -0.01 -0.04 0.00 0.00 0.02 0.00 0.00 34.13 34.10 1xxe s GLU 14 CO -0.02 -0.09 0.00 0.41 -1.84 0.00 0.00 175.26 173.73 1xxe n GLY 15 N 3.55 1.55 3.75 -3.83 0.00 -0.78 -4.91 105.19 104.53 1xxe n GLY 15 Ca -0.19 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 44.95 1xxe n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xxe s VAL 16 N -2.00 2.97 -0.05 1.61 0.11 -1.26 -2.31 120.40 119.48 1xxe s VAL 16 Ca 0.00 0.32 -0.15 0.00 -2.93 0.00 0.00 61.98 59.22 1xxe s VAL 16 Cb 0.00 -2.88 -0.05 0.00 -1.53 0.00 0.00 36.38 31.92 1xxe s VAL 16 CO 0.00 -0.41 0.40 -0.83 -3.33 0.00 0.00 175.10 170.92 1xxe s GLY 17 N -3.55 2.42 0.11 6.54 0.00 -0.63 -0.61 107.32 111.61 1xxe s GLY 17 Ca 0.62 -0.26 -0.24 0.00 0.00 0.00 0.00 44.72 44.84 1xxe s GLY 17 CO 0.56 0.27 1.67 1.19 0.00 0.00 0.00 173.10 176.79 1xxe h ILE 18 N 4.02 0.60 0.14 0.90 2.10 -1.83 0.96 117.51 124.41 1xxe h ILE 18 Ca -0.49 0.00 -0.34 0.00 1.08 0.00 0.00 64.86 65.11 1xxe h ILE 18 Cb 1.21 0.60 -0.01 0.00 -1.09 0.00 0.00 36.82 37.53 1xxe h ILE 18 CO 0.66 0.00 -1.79 0.45 -1.08 0.00 0.00 178.15 176.39 1xxe h HIS 19 N -0.28 0.55 -0.07 2.19 3.86 -1.89 2.18 115.15 121.69 1xxe h HIS 19 Ca 0.05 -0.40 -0.19 0.00 -1.16 0.00 0.00 60.37 58.66 1xxe h HIS 19 Cb 0.34 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 28.79 1xxe h HIS 19 CO -0.21 1.62 -0.77 1.15 0.86 0.00 0.00 177.93 180.58 1xxe h THR 20 N 0.08 1.38 -0.99 2.45 2.02 -1.93 -1.66 112.91 114.26 1xxe h THR 20 Ca -0.35 -2.19 -0.35 0.00 0.77 0.00 0.00 66.41 64.29 1xxe h THR 20 Cb 2.06 2.16 -0.13 0.00 -1.74 0.00 0.00 68.15 70.50 1xxe h THR 20 CO 0.14 0.66 -0.33 0.61 0.37 0.00 0.00 175.52 176.97 1xxe n GLY 21 N 0.63 1.48 3.71 2.16 0.00 0.33 -4.60 105.19 108.91 1xxe n GLY 21 Ca -0.05 -0.20 -0.31 0.00 0.00 0.00 0.00 46.02 45.46 1xxe n GLY 21 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xxe s GLU 22 N -3.60 2.71 0.01 1.61 2.56 -1.26 -4.69 118.70 116.05 1xxe s GLU 22 Ca 0.00 -0.73 -0.30 0.00 0.00 0.00 0.00 54.97 53.94 1xxe s GLU 22 Cb 0.00 -2.63 -0.06 0.00 2.00 0.00 0.00 34.13 33.44 1xxe s GLU 22 CO 0.00 0.57 1.39 -0.47 -0.56 0.00 0.00 175.26 176.19 1xxe s TYR 23 N -1.27 2.92 0.08 5.30 6.14 -1.26 -1.60 117.35 127.66 1xxe s TYR 23 Ca 0.25 0.86 0.02 0.00 0.64 0.00 0.00 57.07 58.84 1xxe s TYR 23 Cb -0.12 -3.65 -0.04 0.00 0.42 0.00 0.00 41.96 38.58 1xxe s TYR 23 CO 0.17 -2.36 -0.08 0.45 0.64 0.00 0.00 175.55 174.37 1xxe s SER 24 N 1.77 1.16 0.05 4.32 0.15 -0.98 -4.89 113.70 115.29 1xxe s SER 24 Ca 0.63 -0.85 0.03 0.00 0.70 0.00 0.00 55.95 56.47 1xxe s SER 24 Cb -0.32 0.06 -0.03 0.00 -1.71 0.00 0.00 66.02 64.03 1xxe s SER 24 CO 0.27 -0.35 -0.09 -0.75 1.20 0.00 0.00 173.24 173.52 1xxe s LYS 25 N -3.03 0.61 0.07 5.44 2.20 -0.96 -1.86 119.74 122.22 1xxe s LYS 25 Ca 0.05 -0.84 0.07 0.00 -0.36 0.00 0.00 55.97 54.88 1xxe s LYS 25 Cb -0.00 -0.40 -0.03 0.00 -1.51 0.00 0.00 37.83 35.88 1xxe s LYS 25 CO -0.02 0.07 -0.18 -0.51 -0.36 0.00 0.00 175.35 174.36 1xxe s LEU 26 N -1.72 2.25 -0.04 5.43 1.43 -0.13 -0.93 118.68 124.97 1xxe s LEU 26 Ca -0.07 -0.60 0.02 0.00 -1.03 0.00 0.00 54.13 52.45 1xxe s LEU 26 Cb -0.09 -0.74 0.01 0.00 0.03 0.00 0.00 46.19 45.40 1xxe s LEU 26 CO 0.01 0.03 -0.08 -0.63 0.23 0.00 0.00 176.35 175.90 1xxe s ILE 27 N -1.08 0.79 -0.15 -0.59 1.01 0.00 -1.06 121.20 120.12 1xxe s ILE 27 Ca 0.03 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.38 1xxe s ILE 27 Cb -0.09 -0.74 -0.00 0.00 0.01 0.00 0.00 42.46 41.63 1xxe s ILE 27 CO 0.03 0.27 -0.15 -0.63 0.00 0.00 0.00 174.94 174.46 1xxe s ILE 28 N 0.60 2.75 0.20 2.92 1.01 -0.42 0.51 121.20 128.77 1xxe s ILE 28 Ca -0.10 -0.75 0.11 0.00 0.00 0.00 0.00 60.65 59.92 1xxe s ILE 28 Cb -0.13 -2.16 -0.04 0.00 0.01 0.00 0.00 42.46 40.13 1xxe s ILE 28 CO 0.01 0.51 -0.23 -1.00 0.00 0.00 0.00 174.94 174.24 1xxe s HIS 29 N 0.74 2.25 0.81 3.97 3.76 -0.93 -2.04 115.29 123.84 1xxe s HIS 29 Ca -0.06 -0.37 -0.11 0.00 -0.15 0.00 0.00 55.06 54.37 1xxe s HIS 29 Cb -0.15 -1.10 0.08 0.00 1.11 0.00 0.00 32.58 32.52 1xxe s HIS 29 CO 0.01 0.51 1.10 -1.25 -0.85 0.00 0.00 174.74 174.26 1xxe s PRO 30 N -2.79 1.95 0.18 8.40 0.04 -1.26 -1.71 135.00 139.81 1xxe s PRO 30 Ca 0.21 1.17 0.03 0.00 0.04 0.00 0.00 61.00 62.46 1xxe s PRO 30 Cb -0.07 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.59 1xxe s PRO 30 CO 0.10 -1.86 0.11 0.39 0.04 0.00 0.00 177.00 175.78 1xxe n GLU 31 N -3.67 0.45 -2.94 4.56 -0.58 -1.26 -4.64 120.64 112.56 1xxe n GLU 31 Ca 0.09 -1.70 -0.31 0.00 -0.42 0.00 0.00 57.16 54.82 1xxe n GLU 31 Cb 0.53 1.18 -0.04 0.00 -0.57 0.00 0.00 31.44 32.54 1xxe n GLU 31 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1xxe s LYS 32 N -2.72 3.85 0.41 3.49 2.47 -1.26 -4.96 119.74 121.01 1xxe s LYS 32 Ca 0.16 0.53 -0.23 0.00 -1.56 0.00 0.00 55.97 54.87 1xxe s LYS 32 Cb 0.01 -2.40 -0.13 0.00 -1.46 0.00 0.00 37.83 33.85 1xxe s LYS 32 CO 0.11 0.02 0.61 0.39 0.16 0.00 0.00 175.35 176.64 1xxe n GLU 33 N -1.02 0.65 -2.09 4.03 4.71 -1.26 -1.26 120.64 124.41 1xxe n GLU 33 Ca 0.03 0.24 -0.20 0.00 -0.01 0.00 0.00 57.16 57.21 1xxe n GLU 33 Cb 0.54 -1.55 -0.04 0.00 -1.01 0.00 0.00 31.44 29.38 1xxe n GLU 33 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1xxe n GLY 34 N 1.72 0.45 0.14 0.62 0.00 -1.26 -4.86 105.19 101.99 1xxe n GLY 34 Ca 0.11 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 1xxe n GLY 34 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xxe h THR 35 N 0.00 1.40 0.00 2.61 2.02 -1.41 -3.50 112.91 114.02 1xxe h THR 35 Ca -0.46 -2.75 0.00 0.00 0.77 0.00 0.00 66.41 63.97 1xxe h THR 35 Cb 1.35 2.80 0.00 0.00 -1.74 0.00 0.00 68.15 70.56 1xxe h THR 35 CO 0.59 0.82 0.00 0.61 0.37 0.00 0.00 175.52 177.90 1xxe n GLY 36 N 1.41 -2.90 3.62 2.16 0.00 -0.65 -4.87 105.19 103.96 1xxe n GLY 36 Ca -0.11 -1.91 -0.38 0.00 0.00 0.00 0.00 46.02 43.62 1xxe n GLY 36 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xxe s ILE 37 N -0.56 5.31 0.01 -0.61 -1.09 -1.23 -2.18 121.20 120.86 1xxe s ILE 37 Ca 0.00 0.22 0.02 0.00 -2.23 0.00 0.00 60.65 58.66 1xxe s ILE 37 Cb 0.00 -3.54 -0.01 0.00 -1.58 0.00 0.00 42.46 37.33 1xxe s ILE 37 CO 0.00 0.28 -0.06 0.00 -1.23 0.00 0.00 174.94 173.93 1xxe s ARG 38 N 1.52 0.43 0.09 2.79 1.70 -1.00 -1.62 118.95 122.87 1xxe s ARG 38 Ca 0.08 -0.39 0.02 0.00 -0.47 0.00 0.00 55.73 54.97 1xxe s ARG 38 Cb -0.15 -0.33 -0.04 0.00 -0.57 0.00 0.00 34.95 33.86 1xxe s ARG 38 CO 0.09 0.08 0.16 -0.06 -1.08 0.00 0.00 175.30 174.48 1xxe s PHE 39 N -0.61 3.34 0.01 5.89 0.08 -0.81 -1.38 117.98 124.50 1xxe s PHE 39 Ca -0.03 0.13 0.04 0.00 0.12 0.00 0.00 56.93 57.20 1xxe s PHE 39 Cb -0.05 -1.66 -0.02 0.00 -0.57 0.00 0.00 43.02 40.72 1xxe s PHE 39 CO -0.00 0.55 -0.13 0.12 -0.10 0.00 0.00 175.22 175.65 1xxe s PHE 40 N -1.51 1.17 -0.29 0.36 5.36 -0.81 0.06 117.98 122.31 1xxe s PHE 40 Ca 0.32 -0.28 -0.23 0.00 -0.96 0.00 0.00 56.93 55.78 1xxe s PHE 40 Cb -0.12 -0.72 0.17 0.00 -0.34 0.00 0.00 43.02 42.00 1xxe s PHE 40 CO 0.25 0.00 1.26 0.21 -1.46 0.00 0.00 175.22 175.49 1xxe s LYS 41 N -0.68 0.22 -1.52 10.12 2.36 -0.25 -1.89 119.74 128.10 1xxe s LYS 41 Ca 0.03 0.28 -0.02 0.00 -2.55 0.00 0.00 55.97 53.72 1xxe s LYS 41 Cb -0.06 0.10 0.01 0.00 -1.05 0.00 0.00 37.83 36.82 1xxe s LYS 41 CO 0.00 -0.03 0.18 0.09 1.55 0.00 0.00 175.35 177.14 1xxe n ASN 42 N 2.10 -5.33 -1.09 1.43 5.03 -1.26 -0.91 115.26 115.23 1xxe n ASN 42 Ca -0.12 -0.06 -0.11 0.00 0.87 0.00 0.00 54.58 55.16 1xxe n ASN 42 Cb 0.57 -4.41 -0.02 0.00 -1.02 0.00 0.00 39.78 34.89 1xxe n ASN 42 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1xxe n GLY 43 N -1.09 0.37 2.99 7.41 0.00 -1.26 -5.01 105.19 108.61 1xxe n GLY 43 Ca -0.18 -0.47 -0.18 0.00 0.00 0.00 0.00 46.02 45.20 1xxe n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xxe s VAL 44 N -2.49 0.60 -0.12 1.61 1.01 -0.08 -5.14 120.40 115.78 1xxe s VAL 44 Ca 0.00 -0.32 -0.06 0.00 0.00 0.00 0.00 61.98 61.60 1xxe s VAL 44 Cb 0.00 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 1xxe s VAL 44 CO 0.00 0.17 0.10 -0.31 0.00 0.00 0.00 175.10 175.06 1xxe s TYR 45 N -0.12 3.43 -0.33 5.22 1.51 -1.26 -1.09 117.35 124.71 1xxe s TYR 45 Ca 0.02 0.38 -0.00 0.00 -1.01 0.00 0.00 57.07 56.46 1xxe s TYR 45 Cb -0.04 -1.93 0.11 0.00 -0.11 0.00 0.00 41.96 39.99 1xxe s TYR 45 CO -0.00 0.57 0.12 0.42 -1.11 0.00 0.00 175.55 175.55 1xxe s ILE 46 N -0.72 0.97 0.36 2.71 1.01 0.11 -4.94 121.20 120.70 1xxe s ILE 46 Ca 0.13 -1.63 -0.25 0.00 0.00 0.00 0.00 60.65 58.90 1xxe s ILE 46 Cb -0.12 -1.73 -0.13 0.00 0.01 0.00 0.00 42.46 40.50 1xxe s ILE 46 CO 0.03 -0.72 0.83 -2.65 0.00 0.00 0.00 174.94 172.42 1xxe n PRO 47 N 4.59 0.99 -2.92 2.79 -0.02 -1.26 -1.93 135.00 137.24 1xxe n PRO 47 Ca 0.00 0.35 -0.44 0.00 -2.02 0.00 0.00 63.50 61.40 1xxe n PRO 47 Cb 0.41 -1.72 -0.01 0.00 -0.02 0.00 0.00 33.50 32.16 1xxe n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xxe s ALA 48 N -1.24 3.81 0.04 3.55 0.00 -0.64 -4.82 121.76 122.47 1xxe s ALA 48 Ca 0.62 -3.19 -0.00 0.00 0.00 0.00 0.00 51.96 49.38 1xxe s ALA 48 Cb -0.65 -4.14 -0.03 0.00 0.00 0.00 0.00 23.12 18.29 1xxe s ALA 48 CO 0.58 -2.86 -0.04 1.03 0.00 0.00 0.00 175.76 174.48 1xxe s ARG 49 N 2.00 0.52 0.16 0.00 0.52 -1.26 -4.55 118.95 116.34 1xxe s ARG 49 Ca 0.41 -1.00 -0.17 0.00 -0.52 0.00 0.00 55.73 54.46 1xxe s ARG 49 Cb -0.03 0.12 0.08 0.00 0.52 0.00 0.00 34.95 35.64 1xxe s ARG 49 CO -0.02 -0.07 1.69 1.12 0.02 0.00 0.00 175.30 178.04 1xxe h HIS 50 N 3.72 -0.11 0.00 -0.53 2.07 -1.93 0.11 115.15 118.48 1xxe h HIS 50 Ca -0.34 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.21 1xxe h HIS 50 Cb 1.17 0.10 0.00 0.00 2.57 0.00 0.00 27.41 31.25 1xxe h HIS 50 CO 0.59 -0.11 0.66 0.93 -3.07 0.00 0.00 177.93 176.92 1xxe h GLU 51 N 0.05 0.00 -0.31 5.12 5.08 -1.96 2.91 114.58 125.47 1xxe h GLU 51 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1xxe h GLU 51 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1xxe h GLU 51 CO -0.34 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 178.86 1xxe n PHE 52 N -2.10 0.39 -1.70 4.33 3.72 0.38 -4.92 117.46 117.55 1xxe n PHE 52 Ca -0.00 -0.20 -0.42 0.00 -0.05 0.00 0.00 57.45 56.78 1xxe n PHE 52 Cb 0.67 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.18 1xxe n PHE 52 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1xxe s VAL 53 N -1.61 2.96 -0.04 -4.37 1.01 0.97 -2.51 120.40 116.82 1xxe s VAL 53 Ca 0.37 0.07 0.06 0.00 0.00 0.00 0.00 61.98 62.48 1xxe s VAL 53 Cb 0.22 -3.05 -0.09 0.00 0.00 0.00 0.00 36.38 33.46 1xxe s VAL 53 CO 0.31 -0.01 0.08 1.33 0.00 0.00 0.00 175.10 176.81 1xxe n VAL 54 N 5.39 0.23 -3.61 2.92 0.24 -1.01 -4.92 118.33 117.55 1xxe n VAL 54 Ca 0.19 -0.21 -0.09 0.00 -2.04 0.00 0.00 64.34 62.19 1xxe n VAL 54 Cb 0.41 -0.29 -0.10 0.00 -1.47 0.00 0.00 33.84 32.39 1xxe n VAL 54 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1xxe s HIS 55 N -2.29 -0.74 -0.13 6.34 5.65 -1.21 -5.06 115.29 117.86 1xxe s HIS 55 Ca -0.03 1.33 -0.01 0.00 0.25 0.00 0.00 55.06 56.60 1xxe s HIS 55 Cb 0.03 0.20 -0.02 0.00 -1.18 0.00 0.00 32.58 31.61 1xxe s HIS 55 CO 0.26 -0.49 -0.10 0.95 -0.65 0.00 0.00 174.74 174.71 1xxe s THR 56 N 2.57 3.36 0.00 0.89 -4.23 -1.26 -1.89 115.64 115.08 1xxe s THR 56 Ca 0.01 -0.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.96 1xxe s THR 56 Cb -0.13 -2.42 0.00 0.00 1.34 0.00 0.00 72.50 71.29 1xxe s THR 56 CO -0.12 0.52 0.00 -3.20 -0.54 0.00 0.00 174.62 171.28 1xxe n ASN 57 N 3.38 0.00 0.09 3.99 2.85 -1.26 -4.87 115.26 119.43 1xxe n ASN 57 Ca -0.18 0.00 0.02 0.00 -0.11 0.00 0.00 54.58 54.32 1xxe n ASN 57 Cb 0.53 0.00 0.13 0.00 1.24 0.00 0.00 39.78 41.67 1xxe n ASN 57 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1xxe n HIS 58 N 0.00 0.16 -4.22 1.20 8.25 -1.26 -4.39 115.22 114.96 1xxe n HIS 58 Ca 0.00 0.08 -0.13 0.00 -0.26 0.00 0.00 57.72 57.42 1xxe n HIS 58 Cb 0.00 -0.33 -0.10 0.00 1.12 0.00 0.00 29.99 30.68 1xxe n HIS 58 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1xxe s SER 59 N -2.77 0.84 -0.20 0.41 0.15 -1.26 -5.01 113.70 105.86 1xxe s SER 59 Ca -0.01 -1.23 -0.05 0.00 0.70 0.00 0.00 55.95 55.36 1xxe s SER 59 Cb 0.01 0.20 -0.02 0.00 -1.71 0.00 0.00 66.02 64.50 1xxe s SER 59 CO 0.04 -0.67 -0.01 -0.89 1.20 0.00 0.00 173.24 172.92 1xxe s THR 60 N -3.84 3.90 0.03 6.45 2.01 -1.26 -4.56 115.64 118.37 1xxe s THR 60 Ca 0.27 -0.33 0.07 0.00 0.31 0.00 0.00 61.69 62.01 1xxe s THR 60 Cb 0.07 -2.76 -0.02 0.00 0.01 0.00 0.00 72.50 69.80 1xxe s THR 60 CO 0.05 0.44 -0.21 -1.81 -0.69 0.00 0.00 174.62 172.40 1xxe s ASP 61 N 0.94 2.56 0.24 3.53 1.01 -0.79 -1.38 116.67 122.78 1xxe s ASP 61 Ca 0.01 -0.50 0.09 0.00 0.71 0.00 0.00 52.55 52.86 1xxe s ASP 61 Cb -0.14 -0.23 -0.05 0.00 1.01 0.00 0.00 42.92 43.51 1xxe s ASP 61 CO 0.02 0.19 -0.15 -0.76 0.21 0.00 0.00 175.17 174.68 1xxe s LEU 62 N -1.03 2.57 0.00 1.23 1.43 -0.77 -2.41 118.68 119.69 1xxe s LEU 62 Ca 0.08 -1.04 0.00 0.00 -1.03 0.00 0.00 54.13 52.14 1xxe s LEU 62 Cb -0.09 -0.81 0.00 0.00 0.03 0.00 0.00 46.19 45.32 1xxe s LEU 62 CO 0.01 -0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.08 1xxe n GLY 63 N -0.48 1.04 3.13 -3.19 0.00 -1.04 0.02 105.19 104.66 1xxe n GLY 63 Ca -0.07 -0.21 -0.11 0.00 0.00 0.00 0.00 46.02 45.64 1xxe n GLY 63 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1xxe s PHE 64 N -1.79 0.07 -1.71 1.61 5.36 0.66 -4.78 117.98 117.39 1xxe s PHE 64 Ca 0.00 -0.22 0.00 0.00 -0.96 0.00 0.00 56.93 55.75 1xxe s PHE 64 Cb 0.00 -0.06 0.00 0.00 -0.34 0.00 0.00 43.02 42.62 1xxe s PHE 64 CO 0.00 -0.33 0.00 1.63 -1.46 0.00 0.00 175.22 175.06 1xxe n LYS 65 N 1.18 -1.65 -0.53 10.12 4.76 -1.26 -0.63 118.16 130.16 1xxe n LYS 65 Ca -0.21 0.96 0.00 0.00 -2.87 0.00 0.00 58.31 56.19 1xxe n LYS 65 Cb 0.57 -5.46 0.00 0.00 -1.84 0.00 0.00 35.03 28.29 1xxe n LYS 65 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xxe n GLY 66 N -0.66 0.76 3.82 0.72 0.00 -1.26 -5.04 105.19 103.52 1xxe n GLY 66 Ca -0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 1xxe n GLY 66 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xxe s GLN 67 N -0.47 3.26 0.06 1.61 -1.52 0.19 -5.10 119.66 117.68 1xxe s GLN 67 Ca 0.00 -0.32 -0.08 0.00 -1.95 0.00 0.00 55.36 53.01 1xxe s GLN 67 Cb 0.00 -3.01 -0.00 0.00 -0.22 0.00 0.00 33.01 29.78 1xxe s GLN 67 CO 0.00 0.71 0.16 -0.98 -0.25 0.00 0.00 175.29 174.93 1xxe s ARG 68 N -1.39 0.73 0.02 2.91 1.70 -1.26 -0.24 118.95 121.41 1xxe s ARG 68 Ca 0.19 -0.82 0.03 0.00 -0.47 0.00 0.00 55.73 54.66 1xxe s ARG 68 Cb -0.12 0.29 -0.02 0.00 -0.57 0.00 0.00 34.95 34.54 1xxe s ARG 68 CO 0.10 -0.21 -0.10 0.42 -1.08 0.00 0.00 175.30 174.43 1xxe s ILE 69 N -3.18 0.75 0.18 4.99 1.01 0.10 -4.81 121.20 120.24 1xxe s ILE 69 Ca -0.00 -0.74 0.07 0.00 0.00 0.00 0.00 60.65 59.98 1xxe s ILE 69 Cb 0.02 -0.70 -0.04 0.00 0.01 0.00 0.00 42.46 41.75 1xxe s ILE 69 CO -0.07 -0.03 0.01 -0.54 0.00 0.00 0.00 174.94 174.31 1xxe s LYS 70 N -0.86 2.42 -0.70 2.79 1.02 -0.70 -1.85 119.74 121.87 1xxe s LYS 70 Ca -0.01 -1.12 -0.09 0.00 0.02 0.00 0.00 55.97 54.78 1xxe s LYS 70 Cb -0.06 -2.36 0.01 0.00 -0.52 0.00 0.00 37.83 34.90 1xxe s LYS 70 CO 0.00 0.45 0.64 2.41 -0.92 0.00 0.00 175.35 177.93 1xxe n THR 71 N -0.19 -6.00 0.29 2.17 -1.04 -0.48 -2.23 114.28 106.81 1xxe n THR 71 Ca -0.09 0.04 0.04 0.00 -2.04 0.00 0.00 64.05 61.99 1xxe n THR 71 Cb 0.55 -4.52 -0.04 0.00 -1.82 0.00 0.00 70.33 64.50 1xxe n THR 71 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1xxe n VAL 72 N -1.72 0.00 0.30 12.58 0.24 -1.18 -4.32 118.33 124.22 1xxe n VAL 72 Ca -0.15 -0.30 0.18 0.00 -2.04 0.00 0.00 64.34 62.03 1xxe n VAL 72 Cb 0.62 0.89 0.90 0.00 -1.47 0.00 0.00 33.84 34.78 1xxe n VAL 72 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1xxe h GLU 73 N 0.00 0.00 0.39 7.34 9.09 -1.86 -2.07 114.58 127.46 1xxe h GLU 73 Ca 0.00 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.39 1xxe h GLU 73 Cb 0.20 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.31 1xxe h GLU 73 CO 0.00 0.00 -0.19 0.45 0.05 0.00 0.00 179.01 179.32 1xxe h HIS 74 N 0.00 -0.48 -0.59 2.06 3.86 -1.92 -1.54 115.15 116.55 1xxe h HIS 74 Ca 0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1xxe h HIS 74 Cb 0.17 0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.77 1xxe h HIS 74 CO 0.00 -0.30 0.37 0.97 0.86 0.00 0.00 177.93 179.83 1xxe h ILE 75 N -1.08 1.16 -0.90 2.45 6.09 -1.85 -1.63 117.51 121.77 1xxe h ILE 75 Ca -0.05 -0.33 0.09 0.00 -1.37 0.00 0.00 64.86 63.20 1xxe h ILE 75 Cb 0.40 0.33 -0.06 0.00 0.47 0.00 0.00 36.82 37.95 1xxe h ILE 75 CO 0.09 0.16 0.58 -0.07 -3.07 0.00 0.00 178.15 175.84 1xxe h LEU 76 N 0.79 0.82 -0.14 2.19 3.38 -1.46 -1.60 115.31 119.29 1xxe h LEU 76 Ca 0.21 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 1xxe h LEU 76 Cb -0.06 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1xxe h LEU 76 CO -0.04 0.49 0.08 -1.28 0.09 0.00 0.00 178.44 177.78 1xxe h SER 77 N 0.91 0.16 0.15 -0.43 0.87 -0.29 -0.38 113.55 114.55 1xxe h SER 77 Ca 0.41 -0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.94 1xxe h SER 77 Cb 0.37 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 1xxe h SER 77 CO -0.17 0.15 -0.17 0.58 -0.53 0.00 0.00 176.83 176.69 1xxe h VAL 78 N 0.16 0.62 -0.80 2.23 2.07 -1.00 -1.80 116.25 117.73 1xxe h VAL 78 Ca 0.05 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.73 1xxe h VAL 78 Cb 0.02 0.62 -0.10 0.00 -1.52 0.00 0.00 31.29 30.30 1xxe h VAL 78 CO -0.01 0.00 0.33 -0.07 0.02 0.00 0.00 177.57 177.84 1xxe h LEU 79 N -0.36 0.31 -0.14 2.57 3.38 -1.09 0.16 115.31 120.13 1xxe h LEU 79 Ca 0.01 0.12 0.04 0.00 0.09 0.00 0.00 57.88 58.14 1xxe h LEU 79 Cb 0.35 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1xxe h LEU 79 CO -0.06 0.09 -0.12 -0.74 0.09 0.00 0.00 178.44 177.70 1xxe h HIS 80 N 0.45 -0.30 -0.35 1.13 2.76 -0.23 0.87 115.15 119.48 1xxe h HIS 80 Ca 0.45 0.02 -0.12 0.00 -2.20 0.00 0.00 60.37 58.52 1xxe h HIS 80 Cb 0.73 0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.83 1xxe h HIS 80 CO -0.15 -0.18 -0.28 -0.07 -1.30 0.00 0.00 177.93 175.94 1xxe h LEU 81 N -0.14 0.75 0.00 0.26 3.38 -0.64 -2.50 115.31 116.43 1xxe h LEU 81 Ca 0.09 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1xxe h LEU 81 Cb 0.27 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1xxe h LEU 81 CO -0.23 0.99 0.00 0.18 0.09 0.00 0.00 178.44 179.48 1xxe n LEU 82 N -4.09 0.00 -3.08 1.67 4.77 0.42 -4.90 117.00 111.79 1xxe n LEU 82 Ca -0.01 0.28 -0.14 0.00 -0.03 0.00 0.00 56.01 56.11 1xxe n LEU 82 Cb 0.46 -0.28 0.08 0.00 -2.33 0.00 0.00 43.42 41.35 1xxe n LEU 82 CO 0.45 -0.05 0.09 -0.62 -1.33 0.00 0.00 177.39 175.92 1xxe n GLU 83 N -1.28 -5.33 -3.51 3.23 1.02 0.23 -4.98 120.64 110.03 1xxe n GLU 83 Ca 0.12 0.73 -0.38 0.00 -0.02 0.00 0.00 57.16 57.61 1xxe n GLU 83 Cb 0.19 -5.38 -0.09 0.00 -0.02 0.00 0.00 31.44 26.13 1xxe n GLU 83 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1xxe s ILE 84 N -3.31 5.26 -0.03 -3.67 -1.09 -0.79 -4.20 121.20 113.37 1xxe s ILE 84 Ca 0.04 0.40 0.10 0.00 -2.23 0.00 0.00 60.65 58.96 1xxe s ILE 84 Cb -0.01 -3.61 -0.15 0.00 -1.58 0.00 0.00 42.46 37.11 1xxe s ILE 84 CO 0.63 0.24 0.18 0.35 -1.23 0.00 0.00 174.94 175.11 1xxe n THR 85 N 4.77 0.13 -3.85 2.92 -2.24 -0.96 -4.82 114.28 110.22 1xxe n THR 85 Ca -0.11 -0.26 -0.28 0.00 -2.27 0.00 0.00 64.05 61.12 1xxe n THR 85 Cb 0.51 0.06 -0.16 0.00 -2.10 0.00 0.00 70.33 68.65 1xxe n THR 85 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1xxe s ASN 86 N -3.36 3.13 -0.25 3.42 0.02 -1.17 -1.63 114.94 115.10 1xxe s ASN 86 Ca -0.04 -0.85 -0.26 0.00 -1.02 0.00 0.00 52.86 50.69 1xxe s ASN 86 Cb 0.06 -0.88 0.10 0.00 0.02 0.00 0.00 41.25 40.55 1xxe s ASN 86 CO 0.41 -0.24 0.90 0.68 0.02 0.00 0.00 177.10 178.87 1xxe s VAL 87 N 1.64 0.00 -0.43 1.60 -7.23 -0.92 -4.08 120.40 110.98 1xxe s VAL 87 Ca -0.02 0.00 -0.06 0.00 -1.81 0.00 0.00 61.98 60.10 1xxe s VAL 87 Cb -0.17 -1.00 0.11 0.00 0.56 0.00 0.00 36.38 35.88 1xxe s VAL 87 CO -0.07 0.00 0.26 -0.89 -0.31 0.00 0.00 175.10 174.09 1xxe s THR 88 N 0.03 3.71 -0.48 5.32 2.01 -0.69 -2.38 115.64 123.16 1xxe s THR 88 Ca 0.00 -1.88 -0.24 0.00 0.31 0.00 0.00 61.69 59.89 1xxe s THR 88 Cb -0.04 -3.47 0.03 0.00 0.01 0.00 0.00 72.50 69.03 1xxe s THR 88 CO -0.02 -0.69 0.84 -0.63 -0.69 0.00 0.00 174.62 173.42 1xxe s ILE 89 N 1.25 4.57 -0.32 1.82 1.09 -0.48 -2.19 121.20 126.94 1xxe s ILE 89 Ca 0.06 0.40 -0.22 0.00 -1.10 0.00 0.00 60.65 59.80 1xxe s ILE 89 Cb -0.24 -4.39 -0.00 0.00 -1.06 0.00 0.00 42.46 36.77 1xxe s ILE 89 CO -0.02 -0.83 0.73 -1.61 -0.10 0.00 0.00 174.94 173.11 1xxe s GLU 90 N 3.48 3.88 -0.28 2.79 2.02 0.18 -1.92 118.70 128.85 1xxe s GLU 90 Ca 0.30 0.41 -0.08 0.00 0.02 0.00 0.00 54.97 55.62 1xxe s GLU 90 Cb -0.12 -3.75 -0.01 0.00 0.10 0.00 0.00 34.13 30.34 1xxe s GLU 90 CO 0.22 -0.69 0.09 0.08 0.02 0.00 0.00 175.26 174.99 1xxe s VAL 91 N 2.86 4.29 -0.39 2.63 1.01 -0.79 -0.82 120.40 129.20 1xxe s VAL 91 Ca 0.29 -0.37 -0.16 0.00 0.00 0.00 0.00 61.98 61.75 1xxe s VAL 91 Cb -0.14 -3.10 0.01 0.00 0.00 0.00 0.00 36.38 33.14 1xxe s VAL 91 CO 0.13 0.21 0.40 -0.63 0.00 0.00 0.00 175.10 175.21 1xxe s ILE 92 N 1.59 5.13 -3.48 2.22 1.09 -0.11 -4.68 121.20 122.96 1xxe s ILE 92 Ca 0.05 -0.19 0.00 0.00 -1.10 0.00 0.00 60.65 59.41 1xxe s ILE 92 Cb -0.16 -3.94 0.00 0.00 -1.06 0.00 0.00 42.46 37.30 1xxe s ILE 92 CO 0.04 -0.27 0.00 0.61 -0.10 0.00 0.00 174.94 175.22 1xxe n GLY 93 N 5.04 0.83 0.00 6.18 0.00 -1.26 -2.26 105.19 113.73 1xxe n GLY 93 Ca -0.08 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 43.93 1xxe n GLY 93 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1xxe n ASN 94 N 0.43 3.73 -4.04 1.61 2.85 -1.26 -4.98 115.26 113.60 1xxe n ASN 94 Ca 0.00 -0.12 -0.19 0.00 -0.11 0.00 0.00 54.58 54.17 1xxe n ASN 94 Cb 0.00 0.98 -0.14 0.00 1.24 0.00 0.00 39.78 41.85 1xxe n ASN 94 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 1xxe s GLU 95 N -1.72 0.77 0.05 1.20 2.56 -1.26 -1.72 118.70 118.58 1xxe s GLU 95 Ca 0.00 -0.40 -0.31 0.00 0.00 0.00 0.00 54.97 54.27 1xxe s GLU 95 Cb 0.00 -0.74 -0.07 0.00 2.00 0.00 0.00 34.13 35.32 1xxe s GLU 95 CO 0.00 0.20 1.53 0.42 -0.56 0.00 0.00 175.26 176.85 1xxe s ILE 96 N -0.33 3.30 0.09 -3.70 -1.09 -0.95 -4.71 121.20 113.80 1xxe s ILE 96 Ca 0.03 0.75 -0.36 0.00 -2.23 0.00 0.00 60.65 58.84 1xxe s ILE 96 Cb -0.04 -3.48 -0.17 0.00 -1.58 0.00 0.00 42.46 37.18 1xxe s ILE 96 CO -0.00 0.01 1.21 -2.65 -1.23 0.00 0.00 174.94 172.27 1xxe n PRO 97 N 5.31 0.82 0.10 2.79 -0.02 -1.26 -4.54 135.00 138.20 1xxe n PRO 97 Ca 0.14 0.29 -0.04 0.00 -2.02 0.00 0.00 63.50 61.88 1xxe n PRO 97 Cb 0.42 -1.85 0.03 0.00 -0.02 0.00 0.00 33.50 32.08 1xxe n PRO 97 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1xxe h ILE 98 N 3.02 1.53 0.00 4.25 6.09 -1.11 -3.48 117.51 127.82 1xxe h ILE 98 Ca -0.47 -2.75 0.00 0.00 -1.37 0.00 0.00 64.86 60.27 1xxe h ILE 98 Cb 1.37 2.50 0.00 0.00 0.47 0.00 0.00 36.82 41.15 1xxe h ILE 98 CO 0.72 0.78 0.00 0.18 -3.07 0.00 0.00 178.15 176.76 1xxe n LEU 99 N -3.54 0.00 0.03 2.19 4.77 -1.26 -0.33 117.00 118.86 1xxe n LEU 99 Ca -0.00 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.09 1xxe n LEU 99 Cb 0.78 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.85 1xxe n LEU 99 CO 0.44 0.00 -0.11 -0.67 -1.33 0.00 0.00 177.39 175.73 1xxe n ASP 100 N 8.93 0.57 0.00 -1.43 2.03 -1.26 -4.60 116.55 120.79 1xxe n ASP 100 Ca 0.00 -0.14 0.00 0.00 0.52 0.00 0.00 54.79 55.17 1xxe n ASP 100 Cb 0.00 0.93 0.00 0.00 -0.72 0.00 0.00 41.12 41.33 1xxe n ASP 100 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xxe n GLY 101 N 1.33 1.23 0.00 0.27 0.00 0.55 -4.29 105.19 104.29 1xxe n GLY 101 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1xxe n GLY 101 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xxe n SER 102 N 0.00 1.23 -0.25 1.61 3.41 -1.26 -1.86 113.62 116.50 1xxe n SER 102 Ca 0.00 -0.92 0.04 0.00 -0.26 0.00 0.00 58.87 57.73 1xxe n SER 102 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 1xxe n SER 102 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xxe n GLY 103 N 5.00 -0.32 0.32 5.00 0.00 -0.91 -4.63 105.19 109.66 1xxe n GLY 103 Ca 0.00 -0.25 0.16 0.00 0.00 0.00 0.00 46.02 45.93 1xxe n GLY 103 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1xxe h TRP 104 N 1.20 0.74 0.21 1.61 2.91 -1.83 0.25 115.95 121.04 1xxe h TRP 104 Ca 0.00 0.04 -0.01 0.00 1.13 0.00 0.00 58.89 60.05 1xxe h TRP 104 Cb 0.31 -0.18 0.00 0.00 -0.51 0.00 0.00 29.16 28.79 1xxe h TRP 104 CO 0.00 -0.05 -0.10 0.93 -1.03 0.00 0.00 178.44 178.19 1xxe h GLU 105 N 0.41 -0.27 -0.51 2.65 4.39 -1.90 0.51 114.58 119.86 1xxe h GLU 105 Ca 0.60 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 60.31 1xxe h GLU 105 Cb 1.18 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.87 1xxe h GLU 105 CO -0.54 -0.06 0.27 0.74 -1.16 0.00 0.00 179.01 178.26 1xxe h PHE 106 N -0.42 0.71 -0.78 4.33 0.04 -1.55 0.04 116.94 119.30 1xxe h PHE 106 Ca -0.03 -0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.69 1xxe h PHE 106 Cb 0.32 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 38.21 1xxe h PHE 106 CO -0.02 0.54 0.39 -0.92 -0.60 0.00 0.00 178.31 177.69 1xxe h TYR 107 N 0.68 1.11 -0.06 -0.55 3.20 -0.41 0.22 116.97 121.16 1xxe h TYR 107 Ca 0.18 -0.04 -0.12 0.00 3.14 0.00 0.00 58.73 61.89 1xxe h TYR 107 Cb 0.07 -0.35 0.01 0.00 1.54 0.00 0.00 36.73 38.00 1xxe h TYR 107 CO -0.01 0.80 -0.43 0.93 -1.64 0.00 0.00 178.16 177.80 1xxe h GLU 108 N 1.11 0.39 0.01 1.82 4.39 0.51 -2.14 114.58 120.67 1xxe h GLU 108 Ca 0.27 -0.35 -0.07 0.00 0.34 0.00 0.00 59.36 59.56 1xxe h GLU 108 Cb 0.09 0.08 0.01 0.00 -0.10 0.00 0.00 28.75 28.83 1xxe h GLU 108 CO -0.04 1.00 -0.26 0.00 -1.16 0.00 0.00 179.01 178.55 1xxe h ALA 109 N 0.40 0.02 -0.49 3.43 0.00 -0.94 -3.21 119.26 118.48 1xxe h ALA 109 Ca -0.04 -0.48 -0.13 0.00 0.00 0.00 0.00 54.91 54.26 1xxe h ALA 109 Cb 1.11 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1xxe h ALA 109 CO 0.09 0.09 -0.19 0.82 0.00 0.00 0.00 179.25 180.06 1xxe h ILE 110 N -0.53 1.27 -0.26 0.00 2.04 -1.10 -2.76 117.51 116.17 1xxe h ILE 110 Ca -0.03 -1.36 0.08 0.00 1.00 0.00 0.00 64.86 64.54 1xxe h ILE 110 Cb 1.03 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 1xxe h ILE 110 CO 0.05 0.47 0.19 -0.09 0.00 0.00 0.00 178.15 178.77 1xxe h ARG 111 N 0.86 0.00 -0.00 2.37 2.43 -1.50 0.40 114.38 118.95 1xxe h ARG 111 Ca 0.12 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1xxe h ARG 111 Cb 0.77 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1xxe h ARG 111 CO 0.06 0.00 -0.03 1.17 -1.51 0.00 0.00 179.97 179.67 1xxe n LYS 112 N -4.46 0.19 -1.48 0.20 4.81 -1.05 -3.63 118.16 112.75 1xxe n LYS 112 Ca 0.03 -0.01 -0.07 0.00 -0.87 0.00 0.00 58.31 57.39 1xxe n LYS 112 Cb 0.35 -1.50 0.10 0.00 0.02 0.00 0.00 35.03 33.99 1xxe n LYS 112 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1xxe n ASN 113 N -1.40 2.95 -4.86 3.14 4.13 0.14 -5.03 115.26 114.33 1xxe n ASN 113 Ca 0.10 -3.49 -0.34 0.00 1.68 0.00 0.00 54.58 52.53 1xxe n ASN 113 Cb 0.30 -0.43 -0.06 0.00 -1.54 0.00 0.00 39.78 38.06 1xxe n ASN 113 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1xxe s ILE 114 N -3.55 4.90 0.15 2.41 1.01 -1.04 0.62 121.20 125.70 1xxe s ILE 114 Ca 0.42 0.65 0.05 0.00 0.00 0.00 0.00 60.65 61.77 1xxe s ILE 114 Cb 0.38 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 1xxe s ILE 114 CO -0.03 0.12 -0.11 -0.22 0.00 0.00 0.00 174.94 174.70 1xxe s LEU 115 N -2.31 2.52 0.04 2.97 2.96 0.21 -4.46 118.68 120.61 1xxe s LEU 115 Ca 0.41 -1.00 0.04 0.00 -0.22 0.00 0.00 54.13 53.36 1xxe s LEU 115 Cb -0.13 -0.37 -0.04 0.00 0.50 0.00 0.00 46.19 46.15 1xxe s LEU 115 CO 0.20 -0.31 -0.04 0.20 -1.32 0.00 0.00 176.35 175.08 1xxe s ASN 116 N -3.12 4.83 0.00 3.68 -0.87 -1.26 -1.99 114.94 116.21 1xxe s ASN 116 Ca 0.16 -0.14 0.00 0.00 -1.57 0.00 0.00 52.86 51.31 1xxe s ASN 116 Cb 0.02 -1.15 0.00 0.00 -0.02 0.00 0.00 41.25 40.10 1xxe s ASN 116 CO 0.01 0.24 0.00 0.00 -2.57 0.00 0.00 177.10 174.78 1xxe n GLN 117 N 1.17 2.92 0.00 -0.60 6.02 -0.33 -4.91 117.38 121.65 1xxe n GLN 117 Ca -0.14 0.00 0.01 0.00 -0.01 0.00 0.00 57.00 56.86 1xxe n GLN 117 Cb 0.52 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.79 1xxe n GLN 117 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1xxe n ASN 118 N -0.56 0.99 -4.78 1.08 5.15 -1.26 -4.66 115.26 111.23 1xxe n ASN 118 Ca 0.00 -0.99 -0.39 0.00 -0.60 0.00 0.00 54.58 52.59 1xxe n ASN 118 Cb 0.00 0.12 -0.06 0.00 -0.53 0.00 0.00 39.78 39.31 1xxe n ASN 118 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1xxe s ARG 119 N -0.24 4.48 -0.02 1.20 3.52 -1.26 -4.87 118.95 121.75 1xxe s ARG 119 Ca 0.02 1.05 -0.30 0.00 -0.13 0.00 0.00 55.73 56.36 1xxe s ARG 119 Cb 0.01 -3.28 -0.03 0.00 -1.56 0.00 0.00 34.95 30.09 1xxe s ARG 119 CO 0.02 0.52 1.07 -2.00 -0.81 0.00 0.00 175.30 174.10 1xxe s GLU 120 N -0.89 4.46 0.29 5.12 2.56 -1.26 0.20 118.70 129.18 1xxe s GLU 120 Ca 0.35 1.52 -0.29 0.00 0.00 0.00 0.00 54.97 56.55 1xxe s GLU 120 Cb -0.22 -3.48 -0.10 0.00 2.00 0.00 0.00 34.13 32.34 1xxe s GLU 120 CO 0.24 -0.22 1.20 0.42 -0.56 0.00 0.00 175.26 176.34 1xxe s ILE 121 N 1.48 3.16 -0.64 -3.70 1.01 -1.26 -4.72 121.20 116.53 1xxe s ILE 121 Ca 0.53 1.14 -0.19 0.00 0.00 0.00 0.00 60.65 62.13 1xxe s ILE 121 Cb -0.23 -3.73 0.11 0.00 0.01 0.00 0.00 42.46 38.63 1xxe s ILE 121 CO 0.25 0.26 0.76 -0.62 0.00 0.00 0.00 174.94 175.58 1xxe s ASP 122 N -0.57 6.26 0.47 3.58 2.15 -1.26 -5.00 116.67 122.30 1xxe s ASP 122 Ca 0.48 -1.56 -0.22 0.00 0.43 0.00 0.00 52.55 51.68 1xxe s ASP 122 Cb -0.35 -2.31 -0.07 0.00 -0.30 0.00 0.00 42.92 39.89 1xxe s ASP 122 CO 0.45 -1.09 1.16 -0.31 -0.17 0.00 0.00 175.17 175.21 1xxe s TYR 123 N 2.57 2.84 -0.26 -5.34 1.51 -1.26 -4.72 117.35 112.70 1xxe s TYR 123 Ca 0.14 1.54 -0.13 0.00 -1.01 0.00 0.00 57.07 57.61 1xxe s TYR 123 Cb -0.21 -3.36 -0.04 0.00 -0.11 0.00 0.00 41.96 38.23 1xxe s TYR 123 CO 0.04 -1.51 0.29 0.12 -1.11 0.00 0.00 175.55 173.38 1xxe s PHE 124 N -1.59 3.27 -0.02 2.71 2.19 -0.03 -5.00 117.98 119.51 1xxe s PHE 124 Ca 0.65 0.33 0.06 0.00 0.33 0.00 0.00 56.93 58.31 1xxe s PHE 124 Cb -0.28 -2.47 -0.01 0.00 -1.31 0.00 0.00 43.02 38.95 1xxe s PHE 124 CO 0.33 -0.14 -0.21 0.08 1.83 0.00 0.00 175.22 177.12 1xxe s VAL 125 N 1.73 1.64 0.09 3.12 1.01 -1.26 0.48 120.40 127.21 1xxe s VAL 125 Ca 0.12 -0.88 -0.27 0.00 0.00 0.00 0.00 61.98 60.96 1xxe s VAL 125 Cb -0.15 -1.37 -0.06 0.00 0.00 0.00 0.00 36.38 34.80 1xxe s VAL 125 CO 0.09 0.46 0.83 -0.69 0.00 0.00 0.00 175.10 175.79 1xxe s VAL 126 N -0.42 4.57 -0.32 2.92 1.01 -0.85 -4.93 120.40 122.38 1xxe s VAL 126 Ca 0.06 1.78 0.07 0.00 0.00 0.00 0.00 61.98 63.90 1xxe s VAL 126 Cb -0.09 -4.18 -0.08 0.00 0.00 0.00 0.00 36.38 32.03 1xxe s VAL 126 CO -0.00 0.39 0.30 -0.62 0.00 0.00 0.00 175.10 175.16 1xxe n GLU 127 N 2.52 4.25 -3.87 2.72 -0.58 -1.26 -4.24 120.64 120.18 1xxe n GLU 127 Ca -0.02 -0.01 -0.11 0.00 -0.42 0.00 0.00 57.16 56.60 1xxe n GLU 127 Cb 0.49 -0.87 -0.11 0.00 -0.57 0.00 0.00 31.44 30.38 1xxe n GLU 127 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 1xxe s GLU 128 N -1.75 0.33 1.03 3.49 -1.05 -1.26 -4.85 118.70 114.64 1xxe s GLU 128 Ca 0.02 -0.20 -0.15 0.00 -0.15 0.00 0.00 54.97 54.50 1xxe s GLU 128 Cb 0.05 0.14 0.20 0.00 -0.44 0.00 0.00 34.13 34.09 1xxe s GLU 128 CO 0.30 -0.07 1.13 -1.25 0.95 0.00 0.00 175.26 176.32 1xxe s PRO 129 N -0.83 0.18 -0.26 -4.83 0.04 -1.26 -4.61 135.00 123.43 1xxe s PRO 129 Ca -0.09 0.20 -0.25 0.00 0.04 0.00 0.00 61.00 60.90 1xxe s PRO 129 Cb -0.05 -1.74 0.10 0.00 0.04 0.00 0.00 34.50 32.85 1xxe s PRO 129 CO 0.01 -2.83 0.88 -1.50 0.04 0.00 0.00 177.00 173.60 1xxe s ILE 130 N -3.15 0.00 -0.08 0.56 2.07 -0.92 -4.96 121.20 114.72 1xxe s ILE 130 Ca 0.67 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.93 1xxe s ILE 130 Cb -0.14 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.47 1xxe s ILE 130 CO 0.56 0.00 -0.12 -0.63 -1.91 0.00 0.00 174.94 172.84 1xxe s ILE 131 N 0.17 1.20 -0.21 2.00 1.01 -1.26 -1.37 121.20 122.74 1xxe s ILE 131 Ca 0.01 -0.48 0.01 0.00 0.00 0.00 0.00 60.65 60.20 1xxe s ILE 131 Cb -0.05 -1.12 0.04 0.00 0.01 0.00 0.00 42.46 41.35 1xxe s ILE 131 CO -0.02 0.38 -0.12 0.68 0.00 0.00 0.00 174.94 175.85 1xxe s VAL 132 N 0.94 1.87 -0.10 2.92 -7.23 -0.71 -4.99 120.40 113.10 1xxe s VAL 132 Ca -0.09 -1.16 0.01 0.00 -1.81 0.00 0.00 61.98 58.93 1xxe s VAL 132 Cb -0.15 -1.90 -0.02 0.00 0.56 0.00 0.00 36.38 34.87 1xxe s VAL 132 CO 0.00 0.19 -0.14 -0.70 -0.31 0.00 0.00 175.10 174.15 1xxe s GLU 133 N 1.30 3.01 -0.22 4.82 -6.30 -1.26 -1.72 118.70 118.32 1xxe s GLU 133 Ca -0.02 -0.69 -0.30 0.00 -2.50 0.00 0.00 54.97 51.46 1xxe s GLU 133 Cb -0.17 -2.52 0.16 0.00 0.00 0.00 0.00 34.13 31.60 1xxe s GLU 133 CO -0.08 0.39 1.19 0.34 0.02 0.00 0.00 175.26 177.12 1xxe s ASP 134 N -0.11 -0.18 -1.58 -1.70 -1.08 -0.72 -4.96 116.67 106.33 1xxe s ASP 134 Ca -0.02 0.19 0.00 0.00 -0.52 0.00 0.00 52.55 52.20 1xxe s ASP 134 Cb -0.14 0.15 0.00 0.00 -1.46 0.00 0.00 42.92 41.48 1xxe s ASP 134 CO 0.04 -0.18 0.00 -0.62 0.52 0.00 0.00 175.17 174.92 1xxe n GLU 135 N 0.55 -1.66 -0.98 4.34 1.02 -1.26 0.35 120.64 123.00 1xxe n GLU 135 Ca -0.04 0.89 0.00 0.00 -0.02 0.00 0.00 57.16 57.98 1xxe n GLU 135 Cb 0.58 -5.35 0.00 0.00 -0.02 0.00 0.00 31.44 26.65 1xxe n GLU 135 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xxe n GLY 136 N -0.60 0.50 3.87 0.62 0.00 -1.26 -5.00 105.19 103.32 1xxe n GLY 136 Ca -0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.63 1xxe n GLY 136 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xxe s ARG 137 N -0.29 2.56 -0.04 1.61 0.52 0.16 -4.96 118.95 118.50 1xxe s ARG 137 Ca 0.00 -1.50 -0.30 0.00 -0.52 0.00 0.00 55.73 53.41 1xxe s ARG 137 Cb 0.00 -2.39 0.07 0.00 0.52 0.00 0.00 34.95 33.15 1xxe s ARG 137 CO 0.00 -0.14 0.67 -1.17 0.02 0.00 0.00 175.30 174.68 1xxe s LEU 138 N -4.10 -0.62 -0.08 2.53 0.20 -1.04 -1.76 118.68 113.81 1xxe s LEU 138 Ca 0.47 0.67 -0.07 0.00 0.69 0.00 0.00 54.13 55.89 1xxe s LEU 138 Cb -0.04 2.51 0.02 0.00 -0.43 0.00 0.00 46.19 48.26 1xxe s LEU 138 CO 0.27 -0.62 0.21 -0.63 -0.29 0.00 0.00 176.35 175.29 1xxe s ILE 139 N -1.30 -0.00 -0.01 6.68 1.01 -0.70 -1.34 121.20 125.54 1xxe s ILE 139 Ca -0.11 0.01 0.04 0.00 0.00 0.00 0.00 60.65 60.59 1xxe s ILE 139 Cb -0.00 -0.30 -0.01 0.00 0.01 0.00 0.00 42.46 42.16 1xxe s ILE 139 CO 0.09 0.00 -0.13 -0.75 0.00 0.00 0.00 174.94 174.15 1xxe s LYS 140 N 0.16 1.11 -0.01 2.79 2.20 -0.23 -1.73 119.74 124.03 1xxe s LYS 140 Ca -0.00 -0.48 0.07 0.00 -0.36 0.00 0.00 55.97 55.20 1xxe s LYS 140 Cb -0.02 -1.07 -0.02 0.00 -1.51 0.00 0.00 37.83 35.21 1xxe s LYS 140 CO -0.00 0.28 -0.24 0.00 -0.36 0.00 0.00 175.35 175.03 1xxe s ALA 141 N -0.28 2.00 -0.01 3.13 0.00 -0.47 -0.48 121.76 125.66 1xxe s ALA 141 Ca 0.04 -1.05 0.01 0.00 0.00 0.00 0.00 51.96 50.97 1xxe s ALA 141 Cb -0.06 -0.50 0.00 0.00 0.00 0.00 0.00 23.12 22.57 1xxe s ALA 141 CO -0.00 0.49 -0.04 -2.00 0.00 0.00 0.00 175.76 174.21 1xxe s GLU 142 N -0.62 0.41 0.62 0.00 2.12 0.77 -2.16 118.70 119.84 1xxe s GLU 142 Ca 0.09 -0.12 -0.18 0.00 0.36 0.00 0.00 54.97 55.12 1xxe s GLU 142 Cb -0.09 -0.42 -0.04 0.00 0.26 0.00 0.00 34.13 33.84 1xxe s GLU 142 CO -0.01 0.05 1.01 -0.35 -0.54 0.00 0.00 175.26 175.41 1xxe n PRO 143 N 3.25 0.88 -3.53 4.30 -0.04 -1.26 0.12 135.00 138.72 1xxe n PRO 143 Ca -0.16 0.35 -0.08 0.00 -0.04 0.00 0.00 63.50 63.56 1xxe n PRO 143 Cb 0.56 -2.22 -0.02 0.00 -0.04 0.00 0.00 33.50 31.78 1xxe n PRO 143 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1xxe s SER 144 N -1.31 -0.32 0.00 3.54 0.15 -1.26 -4.37 113.70 110.13 1xxe s SER 144 Ca 0.78 0.06 0.29 0.00 0.70 0.00 0.00 55.95 57.77 1xxe s SER 144 Cb -0.40 0.33 1.23 0.00 -1.71 0.00 0.00 66.02 65.46 1xxe s SER 144 CO 0.45 -0.51 1.85 0.47 1.20 0.00 0.00 173.24 176.70 1xxe n ASP 145 N -0.08 0.94 -4.11 5.45 9.92 -1.26 -3.79 116.55 123.63 1xxe n ASP 145 Ca -0.07 -1.16 -0.11 0.00 -0.53 0.00 0.00 54.79 52.92 1xxe n ASP 145 Cb 0.61 0.00 -0.11 0.00 -0.64 0.00 0.00 41.12 40.98 1xxe n ASP 145 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1xxe s THR 146 N -2.14 0.56 -0.31 -3.53 -4.23 -1.26 -4.90 115.64 99.83 1xxe s THR 146 Ca 0.37 -1.50 -0.23 0.00 -1.18 0.00 0.00 61.69 59.15 1xxe s THR 146 Cb 0.21 -1.13 -0.00 0.00 1.34 0.00 0.00 72.50 72.91 1xxe s THR 146 CO 0.39 -0.65 0.75 -0.22 -0.54 0.00 0.00 174.62 174.35 1xxe s LEU 147 N -2.32 4.10 -0.00 4.79 2.96 -1.26 -2.04 118.68 124.90 1xxe s LEU 147 Ca 0.01 0.60 0.02 0.00 -0.22 0.00 0.00 54.13 54.54 1xxe s LEU 147 Cb -0.02 -3.02 -0.01 0.00 0.50 0.00 0.00 46.19 43.65 1xxe s LEU 147 CO -0.03 -0.59 -0.08 -0.70 -1.32 0.00 0.00 176.35 173.64 1xxe s GLU 148 N 2.88 0.60 -0.03 1.98 2.12 -0.37 -3.51 118.70 122.38 1xxe s GLU 148 Ca 0.31 -0.29 -0.00 0.00 0.36 0.00 0.00 54.97 55.35 1xxe s GLU 148 Cb -0.14 -0.58 0.03 0.00 0.26 0.00 0.00 34.13 33.70 1xxe s GLU 148 CO 0.12 0.16 0.03 0.08 -0.54 0.00 0.00 175.26 175.11 1xxe s VAL 149 N -0.22 0.01 -0.06 3.70 1.01 -0.93 -0.57 120.40 123.34 1xxe s VAL 149 Ca 0.02 0.23 0.04 0.00 0.00 0.00 0.00 61.98 62.27 1xxe s VAL 149 Cb -0.03 -0.17 -0.02 0.00 0.00 0.00 0.00 36.38 36.16 1xxe s VAL 149 CO -0.00 0.14 -0.16 -0.89 0.00 0.00 0.00 175.10 174.18 1xxe s THR 150 N 1.38 2.88 -0.08 3.92 2.01 0.07 -0.23 115.64 125.59 1xxe s THR 150 Ca -0.05 -0.78 0.03 0.00 0.31 0.00 0.00 61.69 61.20 1xxe s THR 150 Cb -0.13 -2.13 0.01 0.00 0.01 0.00 0.00 72.50 70.26 1xxe s THR 150 CO -0.03 0.58 -0.16 -0.47 -0.69 0.00 0.00 174.62 173.85 1xxe s TYR 151 N -0.48 1.81 -0.34 4.92 5.04 -0.95 0.46 117.35 127.82 1xxe s TYR 151 Ca 0.06 -0.71 -0.02 0.00 -2.44 0.00 0.00 57.07 53.96 1xxe s TYR 151 Cb -0.12 -1.28 0.07 0.00 0.35 0.00 0.00 41.96 40.98 1xxe s TYR 151 CO 0.02 -0.33 0.07 -2.00 -1.34 0.00 0.00 175.55 171.96 1xxe s GLU 152 N 0.60 2.24 -0.03 4.97 2.12 0.10 -1.77 118.70 126.94 1xxe s GLU 152 Ca -0.15 -1.48 -0.10 0.00 0.36 0.00 0.00 54.97 53.60 1xxe s GLU 152 Cb -0.16 -3.32 -0.05 0.00 0.26 0.00 0.00 34.13 30.86 1xxe s GLU 152 CO 0.05 -0.79 0.29 0.20 -0.54 0.00 0.00 175.26 174.47 1xxe s GLY 153 N 1.42 2.32 -0.60 -1.50 0.00 0.96 -1.04 107.32 108.88 1xxe s GLY 153 Ca 0.00 -0.44 0.03 0.00 0.00 0.00 0.00 44.72 44.32 1xxe s GLY 153 CO -0.02 -0.15 0.37 1.85 0.00 0.00 0.00 173.10 175.15 1xxe s GLU 154 N -1.24 2.23 0.08 2.90 2.12 -1.26 -0.93 118.70 122.61 1xxe s GLU 154 Ca 0.22 -2.87 -0.14 0.00 0.36 0.00 0.00 54.97 52.54 1xxe s GLU 154 Cb -0.14 -3.42 -0.06 0.00 0.26 0.00 0.00 34.13 30.77 1xxe s GLU 154 CO 0.11 -1.18 0.48 -0.06 -0.54 0.00 0.00 175.26 174.08 1xxe s PHE 155 N -0.67 3.66 -2.34 5.30 0.40 0.82 -4.94 117.98 120.21 1xxe s PHE 155 Ca 0.20 1.01 0.27 0.00 -0.60 0.00 0.00 56.93 57.81 1xxe s PHE 155 Cb -0.18 -2.32 0.78 0.00 0.51 0.00 0.00 43.02 41.81 1xxe s PHE 155 CO -0.06 0.53 1.58 1.63 0.70 0.00 0.00 175.22 179.60 1xxe n LYS 156 N 1.21 1.51 0.00 0.44 4.76 -1.26 -3.09 118.16 121.73 1xxe n LYS 156 Ca -0.09 -0.98 0.00 0.00 -2.87 0.00 0.00 58.31 54.38 1xxe n LYS 156 Cb 0.52 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 32.23 1xxe n LYS 156 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 1xxe n ASN 157 N 0.10 -0.52 0.29 4.39 6.94 -1.26 -4.76 115.26 120.45 1xxe n ASN 157 Ca 0.16 -0.49 0.15 0.00 -0.02 0.00 0.00 54.58 54.37 1xxe n ASN 157 Cb 0.40 0.00 0.87 0.00 -2.36 0.00 0.00 39.78 38.68 1xxe n ASN 157 CO 0.00 0.00 0.00 2.19 -1.03 0.00 0.00 177.26 178.42 1xxe h PHE 158 N -1.09 0.00 -0.30 -2.53 -0.00 -1.56 -2.30 116.94 109.15 1xxe h PHE 158 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 57.95 1xxe h PHE 158 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 35.94 1xxe h PHE 158 CO 0.00 0.04 0.12 -0.07 -0.00 0.00 0.00 178.31 178.40 1xxe h LEU 159 N 0.00 0.42 0.00 2.10 3.38 -1.87 -3.48 115.31 115.86 1xxe h LEU 159 Ca -0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1xxe h LEU 159 Cb 0.11 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1xxe h LEU 159 CO 0.00 0.47 0.00 0.61 0.09 0.00 0.00 178.44 179.62 1xxe n GLY 160 N -0.74 0.43 3.87 0.83 0.00 -0.87 -4.79 105.19 103.91 1xxe n GLY 160 Ca -0.02 -0.89 -0.37 0.00 0.00 0.00 0.00 46.02 44.74 1xxe n GLY 160 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xxe s ARG 161 N 0.00 3.55 -0.06 1.61 0.52 -1.26 -0.13 118.95 123.19 1xxe s ARG 161 Ca 0.00 -0.04 -0.08 0.00 -0.52 0.00 0.00 55.73 55.09 1xxe s ARG 161 Cb 0.00 -3.20 0.02 0.00 0.52 0.00 0.00 34.95 32.28 1xxe s ARG 161 CO 0.00 0.75 0.21 -0.65 0.02 0.00 0.00 175.30 175.62 1xxe s GLN 162 N -0.98 0.33 0.03 3.54 -0.21 -0.11 -4.95 119.66 117.30 1xxe s GLN 162 Ca 0.16 0.13 0.01 0.00 0.02 0.00 0.00 55.36 55.69 1xxe s GLN 162 Cb -0.13 0.15 -0.02 0.00 1.00 0.00 0.00 33.01 34.01 1xxe s GLN 162 CO 0.05 -0.06 -0.06 -1.59 -2.12 0.00 0.00 175.29 171.52 1xxe s LYS 163 N -0.28 0.43 -0.04 2.91 -2.85 -1.26 -0.03 119.74 118.62 1xxe s LYS 163 Ca -0.04 -0.62 0.00 0.00 -1.00 0.00 0.00 55.97 54.31 1xxe s LYS 163 Cb -0.03 -0.18 0.03 0.00 -2.06 0.00 0.00 37.83 35.59 1xxe s LYS 163 CO 0.01 0.03 0.00 0.12 0.10 0.00 0.00 175.35 175.61 1xxe s PHE 164 N -1.20 0.37 -0.26 1.78 5.36 -0.73 -4.99 117.98 118.31 1xxe s PHE 164 Ca -0.10 -0.02 -0.11 0.00 -0.96 0.00 0.00 56.93 55.75 1xxe s PHE 164 Cb -0.09 -0.48 -0.05 0.00 -0.34 0.00 0.00 43.02 42.06 1xxe s PHE 164 CO -0.00 -0.16 0.18 -0.08 -1.46 0.00 0.00 175.22 173.70 1xxe s THR 165 N 1.21 5.33 -0.06 0.12 -1.32 -1.26 -2.23 115.64 117.43 1xxe s THR 165 Ca -0.07 0.19 -0.14 0.00 -1.21 0.00 0.00 61.69 60.45 1xxe s THR 165 Cb -0.13 -3.52 -0.05 0.00 -1.51 0.00 0.00 72.50 67.28 1xxe s THR 165 CO -0.02 0.29 0.37 0.12 -2.21 0.00 0.00 174.62 173.17 1xxe s PHE 166 N 1.48 3.63 0.07 9.09 5.36 0.68 -4.97 117.98 133.32 1xxe s PHE 166 Ca 0.07 0.86 0.03 0.00 -0.96 0.00 0.00 56.93 56.93 1xxe s PHE 166 Cb -0.15 -2.30 -0.03 0.00 -0.34 0.00 0.00 43.02 40.20 1xxe s PHE 166 CO 0.08 0.51 -0.09 0.08 -1.46 0.00 0.00 175.22 174.34 1xxe s VAL 167 N -0.53 0.74 -0.17 3.12 1.01 -1.26 -2.20 120.40 121.11 1xxe s VAL 167 Ca 0.22 -1.41 -0.31 0.00 0.00 0.00 0.00 61.98 60.47 1xxe s VAL 167 Cb -0.15 -1.06 -0.08 0.00 0.00 0.00 0.00 36.38 35.08 1xxe s VAL 167 CO 0.10 -0.50 2.10 -0.62 0.00 0.00 0.00 175.10 176.19 1xxe n GLU 168 N 0.92 1.99 0.00 2.72 4.71 -1.23 -1.77 120.64 127.98 1xxe n GLU 168 Ca -0.19 0.63 0.00 0.00 -0.01 0.00 0.00 57.16 57.59 1xxe n GLU 168 Cb 0.56 -2.92 0.00 0.00 -1.01 0.00 0.00 31.44 28.07 1xxe n GLU 168 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1xxe n GLY 169 N 5.43 1.45 1.22 0.62 0.00 -1.26 -4.98 105.19 107.66 1xxe n GLY 169 Ca 0.29 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.35 1xxe n GLY 169 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xxe n ASN 170 N 0.00 0.98 -0.15 1.61 4.13 -0.73 -4.87 115.26 116.24 1xxe n ASN 170 Ca 0.00 -2.26 -0.01 0.00 1.68 0.00 0.00 54.58 53.99 1xxe n ASN 170 Cb 0.00 -0.32 0.23 0.00 -1.54 0.00 0.00 39.78 38.15 1xxe n ASN 170 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 1xxe h GLU 171 N 0.84 0.86 0.00 3.52 3.07 -1.94 -2.03 114.58 118.90 1xxe h GLU 171 Ca -0.17 -0.12 0.00 0.00 -0.50 0.00 0.00 59.36 58.58 1xxe h GLU 171 Cb 1.70 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 29.45 1xxe h GLU 171 CO 0.07 0.69 0.29 0.93 -1.40 0.00 0.00 179.01 179.59 1xxe h GLU 172 N 0.86 0.00 -0.01 2.33 3.07 -1.98 0.52 114.58 119.37 1xxe h GLU 172 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1xxe h GLU 172 Cb 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.03 1xxe h GLU 172 CO -0.02 0.00 -0.23 0.39 -1.40 0.00 0.00 179.01 177.74 1xxe n GLU 173 N -2.17 1.01 0.00 2.33 1.02 -0.76 -4.06 120.64 118.01 1xxe n GLU 173 Ca -0.01 -0.62 0.00 0.00 -0.02 0.00 0.00 57.16 56.51 1xxe n GLU 173 Cb 0.32 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 1xxe n GLU 173 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1xxe n ILE 174 N -0.45 0.60 -0.10 -3.67 -5.35 0.18 -4.68 119.36 105.89 1xxe n ILE 174 Ca 0.13 -0.76 -0.12 0.00 -0.27 0.00 0.00 62.75 61.74 1xxe n ILE 174 Cb 0.36 0.73 -0.12 0.00 -1.74 0.00 0.00 39.64 38.87 1xxe n ILE 174 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 1xxe n VAL 175 N -0.30 1.21 1.83 7.28 0.24 -1.16 -4.38 118.33 123.06 1xxe n VAL 175 Ca 0.00 -0.60 0.14 0.00 -2.04 0.00 0.00 64.34 61.84 1xxe n VAL 175 Cb 0.19 -0.91 0.75 0.00 -1.47 0.00 0.00 33.84 32.39 1xxe n VAL 175 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1xxe n LEU 176 N -2.88 0.46 -4.68 1.34 4.77 -1.26 -2.13 117.00 112.62 1xxe n LEU 176 Ca -0.33 -0.16 -0.43 0.00 -0.03 0.00 0.00 56.01 55.06 1xxe n LEU 176 Cb 0.99 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 42.04 1xxe n LEU 176 CO 0.29 0.08 0.81 0.00 -1.33 0.00 0.00 177.39 177.24 1xxe s ALA 177 N -1.98 3.49 0.17 -1.18 0.00 -1.26 -4.90 121.76 116.09 1xxe s ALA 177 Ca 0.41 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.67 1xxe s ALA 177 Cb 0.20 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 1xxe s ALA 177 CO 0.33 -0.73 0.33 1.03 0.00 0.00 0.00 175.76 176.72 1xxe s ARG 178 N 2.35 3.48 0.89 0.00 0.52 -1.26 -4.40 118.95 120.52 1xxe s ARG 178 Ca 0.46 -0.46 -0.14 0.00 -0.52 0.00 0.00 55.73 55.08 1xxe s ARG 178 Cb -0.17 -2.91 0.00 0.00 0.52 0.00 0.00 34.95 32.39 1xxe s ARG 178 CO 0.14 0.47 0.38 -2.37 0.02 0.00 0.00 175.30 173.93 1xxe n THR 179 N -0.54 0.53 -4.07 0.02 5.66 -0.78 -4.78 114.28 110.32 1xxe n THR 179 Ca -0.06 -0.27 -0.10 0.00 -3.05 0.00 0.00 64.05 60.57 1xxe n THR 179 Cb 0.54 -0.62 -0.08 0.00 -1.55 0.00 0.00 70.33 68.62 1xxe n THR 179 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 1xxe s PHE 180 N -2.23 0.67 0.01 1.09 -0.71 -1.26 -2.28 117.98 113.27 1xxe s PHE 180 Ca 0.58 -0.98 -0.28 0.00 -1.04 0.00 0.00 56.93 55.21 1xxe s PHE 180 Cb -0.25 -0.15 0.10 0.00 -1.21 0.00 0.00 43.02 41.50 1xxe s PHE 180 CO 0.66 -0.79 0.85 0.00 -1.34 0.00 0.00 175.22 174.60 1xxe s PHE 182 N -3.01 3.34 0.16 0.00 0.08 -1.26 -0.71 117.98 116.58 1xxe s PHE 182 Ca 0.03 0.22 -0.19 0.00 0.12 0.00 0.00 56.93 57.11 1xxe s PHE 182 Cb -0.01 -1.74 0.07 0.00 -0.57 0.00 0.00 43.02 40.77 1xxe s PHE 182 CO -0.08 0.57 1.66 0.38 -0.10 0.00 0.00 175.22 177.64 1xxe h ASP 183 N 3.86 -0.50 -0.95 1.36 3.04 -1.86 0.43 116.42 121.81 1xxe h ASP 183 Ca -0.48 0.12 0.20 0.00 -3.24 0.00 0.00 57.03 53.63 1xxe h ASP 183 Cb 1.18 0.28 -0.08 0.00 -1.04 0.00 0.00 39.33 39.67 1xxe h ASP 183 CO 0.65 -0.18 0.61 4.11 -2.04 0.00 0.00 179.24 182.39 1xxe h TRP 184 N -0.09 0.75 0.00 4.15 0.09 -1.95 0.46 115.95 119.36 1xxe h TRP 184 Ca 0.17 0.02 0.00 0.00 0.09 0.00 0.00 58.89 59.17 1xxe h TRP 184 Cb 0.35 -0.23 0.00 0.00 0.08 0.00 0.00 29.16 29.36 1xxe h TRP 184 CO -0.36 0.19 -0.82 1.05 0.09 0.00 0.00 178.44 178.59 1xxe h GLU 185 N 0.55 0.00 0.19 0.12 4.11 -1.71 -3.37 114.58 114.48 1xxe h GLU 185 Ca 0.51 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.93 1xxe h GLU 185 Cb 1.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 1xxe h GLU 185 CO -0.25 0.00 -0.12 0.82 0.07 0.00 0.00 179.01 179.53 1xxe h ILE 186 N 0.00 0.75 -0.39 -1.06 2.04 0.12 -1.77 117.51 117.20 1xxe h ILE 186 Ca 0.00 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.94 1xxe h ILE 186 Cb 0.87 0.75 -0.08 0.00 -0.74 0.00 0.00 36.82 37.62 1xxe h ILE 186 CO 0.00 0.00 -0.16 -0.33 0.00 0.00 0.00 178.15 177.66 1xxe h GLU 187 N -0.30 -0.08 -0.70 2.37 5.08 -1.71 0.14 114.58 119.38 1xxe h GLU 187 Ca -0.02 0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.47 1xxe h GLU 187 Cb 0.25 0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.43 1xxe h GLU 187 CO 0.02 -0.06 0.27 0.45 -1.00 0.00 0.00 179.01 178.70 1xxe h HIS 188 N -0.09 0.47 -0.44 4.33 3.86 -1.69 0.63 115.15 122.23 1xxe h HIS 188 Ca 0.19 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.44 1xxe h HIS 188 Cb 0.38 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 28.73 1xxe h HIS 188 CO -0.40 0.08 0.29 0.82 0.86 0.00 0.00 177.93 179.58 1xxe h ILE 189 N 0.44 1.11 0.00 2.45 2.04 0.06 -0.91 117.51 122.70 1xxe h ILE 189 Ca 0.37 -0.20 -0.13 0.00 1.00 0.00 0.00 64.86 65.90 1xxe h ILE 189 Cb 0.52 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1xxe h ILE 189 CO -0.37 0.11 -0.63 0.11 0.00 0.00 0.00 178.15 177.37 1xxe h LYS 190 N 0.59 0.00 0.00 2.37 1.57 0.23 -1.90 116.57 119.43 1xxe h LYS 190 Ca 0.16 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.86 1xxe h LYS 190 Cb -0.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1xxe h LYS 190 CO -0.03 0.63 -0.38 0.87 -0.57 0.00 0.00 179.45 179.97 1xxe h LYS 191 N 0.00 0.00 -0.29 3.15 1.79 0.11 -3.06 116.57 118.27 1xxe h LYS 191 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1xxe h LYS 191 Cb 1.37 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.02 1xxe h LYS 191 CO 0.08 0.38 0.00 1.33 -1.08 0.00 0.00 179.45 180.16 1xxe n VAL 192 N -3.24 0.34 -1.59 0.50 0.24 -0.66 -4.85 118.33 109.08 1xxe n VAL 192 Ca 0.02 -0.30 -0.04 0.00 -2.04 0.00 0.00 64.34 61.98 1xxe n VAL 192 Cb 0.65 0.07 -0.01 0.00 -1.47 0.00 0.00 33.84 33.08 1xxe n VAL 192 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xxe n GLY 193 N 0.76 0.46 3.45 7.63 0.00 -1.16 -5.03 105.19 111.30 1xxe n GLY 193 Ca 0.07 -0.79 -0.22 0.00 0.00 0.00 0.00 46.02 45.08 1xxe n GLY 193 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xxe s LEU 194 N -1.11 2.57 0.00 0.99 1.43 -0.72 -4.77 118.68 117.08 1xxe s LEU 194 Ca 0.00 -1.14 0.00 0.00 -1.03 0.00 0.00 54.13 51.96 1xxe s LEU 194 Cb 0.00 -0.81 0.00 0.00 0.03 0.00 0.00 46.19 45.41 1xxe s LEU 194 CO 0.00 -0.22 0.00 0.61 0.23 0.00 0.00 176.35 176.97 1xxe n GLY 195 N -0.61 0.38 0.25 -3.19 0.00 -1.24 -3.54 105.19 97.25 1xxe n GLY 195 Ca -0.06 -1.01 0.13 0.00 0.00 0.00 0.00 46.02 45.09 1xxe n GLY 195 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xxe h LYS 196 N 0.00 0.00 -0.03 1.61 1.57 -1.18 -2.35 116.57 116.20 1xxe h LYS 196 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1xxe h LYS 196 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1xxe h LYS 196 CO 0.00 0.12 -0.05 0.41 -0.57 0.00 0.00 179.45 179.36 1xxe n GLY 197 N -0.13 0.71 3.69 3.86 0.00 0.72 -4.63 105.19 109.42 1xxe n GLY 197 Ca -0.00 -0.63 -0.44 0.00 0.00 0.00 0.00 46.02 44.94 1xxe n GLY 197 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xxe n GLY 198 N 1.26 1.31 1.20 -0.02 0.00 -0.12 -4.66 105.19 104.15 1xxe n GLY 198 Ca 0.12 0.64 -0.07 0.00 0.00 0.00 0.00 46.02 46.71 1xxe n GLY 198 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xxe n SER 199 N 3.66 -0.27 -0.64 1.61 3.41 -1.26 -5.04 113.62 115.09 1xxe n SER 199 Ca 0.17 -1.82 0.11 0.00 -0.26 0.00 0.00 58.87 57.07 1xxe n SER 199 Cb 0.31 0.63 0.05 0.00 -0.26 0.00 0.00 64.21 64.94 1xxe n SER 199 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xxe n LEU 200 N 0.00 2.32 -0.53 1.04 4.77 -1.26 -2.67 117.00 120.66 1xxe n LEU 200 Ca 0.03 -0.82 0.11 0.00 -0.03 0.00 0.00 56.01 55.30 1xxe n LEU 200 Cb 0.23 -0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.34 1xxe n LEU 200 CO 0.12 0.41 0.36 1.17 -1.33 0.00 0.00 177.39 178.11 1xxe n LYS 201 N 0.42 1.31 0.00 3.23 4.81 -1.26 -4.44 118.16 122.23 1xxe n LYS 201 Ca 0.11 -1.07 0.00 0.00 -0.87 0.00 0.00 58.31 56.48 1xxe n LYS 201 Cb 0.51 -1.48 0.00 0.00 0.02 0.00 0.00 35.03 34.08 1xxe n LYS 201 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1xxe n ASN 202 N 0.09 0.13 -3.97 3.14 5.03 -1.26 -4.73 115.26 113.69 1xxe n ASN 202 Ca 0.10 -0.06 -0.29 0.00 0.87 0.00 0.00 54.58 55.19 1xxe n ASN 202 Cb 0.48 0.16 -0.16 0.00 -1.02 0.00 0.00 39.78 39.23 1xxe n ASN 202 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1xxe s THR 203 N -0.18 1.43 -0.39 3.41 2.01 -1.09 -3.82 115.64 117.01 1xxe s THR 203 Ca 0.00 -0.73 -0.29 0.00 0.31 0.00 0.00 61.69 60.98 1xxe s THR 203 Cb 0.00 -1.47 0.01 0.00 0.01 0.00 0.00 72.50 71.04 1xxe s THR 203 CO 0.00 0.27 1.46 -0.22 -0.69 0.00 0.00 174.62 175.44 1xxe s LEU 204 N 1.51 3.60 -0.23 4.42 2.96 -0.96 -4.52 118.68 125.46 1xxe s LEU 204 Ca 0.02 0.92 -0.10 0.00 -0.22 0.00 0.00 54.13 54.75 1xxe s LEU 204 Cb -0.15 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.96 1xxe s LEU 204 CO -0.09 -1.45 0.15 -0.69 -1.32 0.00 0.00 176.35 172.95 1xxe s VAL 205 N 5.55 5.36 0.08 1.68 1.01 -1.26 -1.60 120.40 131.22 1xxe s VAL 205 Ca 0.64 0.18 0.05 0.00 0.00 0.00 0.00 61.98 62.84 1xxe s VAL 205 Cb -0.15 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 1xxe s VAL 205 CO 0.32 0.38 -0.04 -0.76 0.00 0.00 0.00 175.10 175.00 1xxe s LEU 206 N 0.83 3.31 0.24 3.92 1.43 0.11 -2.52 118.68 126.00 1xxe s LEU 206 Ca 0.08 -0.22 0.07 0.00 -1.03 0.00 0.00 54.13 53.03 1xxe s LEU 206 Cb -0.13 -2.03 -0.04 0.00 0.03 0.00 0.00 46.19 44.02 1xxe s LEU 206 CO 0.02 0.20 0.18 -0.83 0.23 0.00 0.00 176.35 176.15 1xxe s GLY 207 N -2.11 1.47 0.62 -3.19 0.00 0.30 -2.42 107.32 101.99 1xxe s GLY 207 Ca 0.23 -1.40 0.26 0.00 0.00 0.00 0.00 44.72 43.80 1xxe s GLY 207 CO 0.15 -1.44 1.72 0.07 0.00 0.00 0.00 173.10 173.60 1xxe h LYS 208 N 1.65 0.00 0.00 2.90 2.10 -1.99 -3.02 116.57 118.22 1xxe h LYS 208 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1xxe h LYS 208 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1xxe h LYS 208 CO 0.61 0.00 -0.04 -3.47 -2.00 0.00 0.00 179.45 174.55 1xxe n ASP 209 N -3.27 0.00 -3.90 7.07 2.03 -1.26 -1.59 116.55 115.63 1xxe n ASP 209 Ca 0.07 -1.09 -0.10 0.00 0.52 0.00 0.00 54.79 54.19 1xxe n ASP 209 Cb 0.75 -0.02 -0.10 0.00 -0.72 0.00 0.00 41.12 41.03 1xxe n ASP 209 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1xxe s LYS 210 N 0.00 0.51 -0.24 -0.67 1.02 -1.14 -5.01 119.74 114.21 1xxe s LYS 210 Ca 0.00 -0.54 -0.11 0.00 0.02 0.00 0.00 55.97 55.34 1xxe s LYS 210 Cb 0.00 0.21 -0.05 0.00 -0.52 0.00 0.00 37.83 37.47 1xxe s LYS 210 CO 0.00 -0.12 0.18 0.08 -0.92 0.00 0.00 175.35 174.57 1xxe s VAL 211 N -1.82 5.35 -0.04 3.17 1.01 -1.26 0.11 120.40 126.92 1xxe s VAL 211 Ca -0.12 0.22 -0.21 0.00 0.00 0.00 0.00 61.98 61.87 1xxe s VAL 211 Cb -0.06 -3.52 -0.15 0.00 0.00 0.00 0.00 36.38 32.65 1xxe s VAL 211 CO -0.01 0.33 0.91 1.88 0.00 0.00 0.00 175.10 178.22 1xxe h TYR 212 N 7.54 -0.24 -2.61 5.22 -1.99 -1.84 -3.44 116.97 119.59 1xxe h TYR 212 Ca -0.38 -0.01 -0.57 0.00 2.00 0.00 0.00 58.73 59.77 1xxe h TYR 212 Cb 1.17 0.08 0.07 0.00 2.00 0.00 0.00 36.73 40.05 1xxe h TYR 212 CO 0.67 0.16 0.74 0.09 -0.00 0.00 0.00 178.16 179.82 1xxe n ASN 213 N -4.97 3.09 0.03 3.88 4.13 -1.26 -4.85 115.26 115.32 1xxe n ASN 213 Ca -0.08 1.12 0.10 0.00 1.68 0.00 0.00 54.58 57.40 1xxe n ASN 213 Cb 0.26 -1.46 0.41 0.00 -1.54 0.00 0.00 39.78 37.45 1xxe n ASN 213 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1xxe n PRO 214 N 2.63 0.05 0.00 3.52 -0.04 -1.26 -2.64 135.00 137.26 1xxe n PRO 214 Ca 0.13 0.23 0.14 0.00 -0.04 0.00 0.00 63.50 63.96 1xxe n PRO 214 Cb 0.31 -1.59 0.56 0.00 -0.04 0.00 0.00 33.50 32.74 1xxe n PRO 214 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1xxe n GLU 215 N -1.69 0.44 0.00 0.54 2.13 -1.26 -5.03 120.64 115.77 1xxe n GLU 215 Ca 0.04 -0.15 0.00 0.00 0.66 0.00 0.00 57.16 57.72 1xxe n GLU 215 Cb 0.23 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.44 1xxe n GLU 215 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1xxe n GLY 216 N 1.36 -0.86 3.87 8.31 0.00 -1.08 -4.81 105.19 111.97 1xxe n GLY 216 Ca 0.12 -1.16 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 1xxe n GLY 216 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xxe s LEU 217 N 0.00 4.15 0.02 0.99 1.43 -1.26 -4.95 118.68 119.06 1xxe s LEU 217 Ca 0.00 1.02 0.19 0.00 -1.03 0.00 0.00 54.13 54.32 1xxe s LEU 217 Cb 0.00 -3.77 -0.18 0.00 0.03 0.00 0.00 46.19 42.27 1xxe s LEU 217 CO 0.00 -0.10 0.66 0.54 0.23 0.00 0.00 176.35 177.68 1xxe n ARG 218 N -0.16 0.64 -3.77 1.70 1.74 -1.26 -4.90 116.66 110.65 1xxe n ARG 218 Ca 0.01 0.06 -0.13 0.00 -0.77 0.00 0.00 57.85 57.02 1xxe n ARG 218 Cb 0.53 -1.69 -0.13 0.00 -1.02 0.00 0.00 32.46 30.14 1xxe n ARG 218 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1xxe s TYR 219 N -3.10 -0.21 -0.59 -1.55 2.02 -1.26 -4.97 117.35 107.70 1xxe s TYR 219 Ca -0.05 0.53 0.00 0.00 -0.37 0.00 0.00 57.07 57.18 1xxe s TYR 219 Cb 0.10 0.00 0.00 0.00 -0.40 0.00 0.00 41.96 41.66 1xxe s TYR 219 CO 0.84 -0.15 0.76 -1.91 -1.57 0.00 0.00 175.55 173.51 1xxe n GLU 220 N 3.74 0.00 -2.04 -0.62 2.13 -1.26 0.60 120.64 123.18 1xxe n GLU 220 Ca -0.21 0.27 -0.01 0.00 0.66 0.00 0.00 57.16 57.87 1xxe n GLU 220 Cb 0.55 -1.71 0.05 0.00 0.27 0.00 0.00 31.44 30.60 1xxe n GLU 220 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1xxe n ASN 221 N -1.26 1.87 -0.10 4.31 6.94 -1.26 -4.92 115.26 120.85 1xxe n ASN 221 Ca 0.00 -2.46 -0.06 0.00 -0.02 0.00 0.00 54.58 52.04 1xxe n ASN 221 Cb 0.21 -0.41 0.01 0.00 -2.36 0.00 0.00 39.78 37.23 1xxe n ASN 221 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 1xxe h GLU 222 N 1.85 0.04 -0.24 -3.83 4.81 -0.21 0.23 114.58 117.23 1xxe h GLU 222 Ca -0.08 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.05 1xxe h GLU 222 Cb 1.48 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.84 1xxe h GLU 222 CO 0.22 0.03 -0.27 -1.00 -0.73 0.00 0.00 179.01 177.25 1xxe h PRO 223 N 0.04 0.47 0.00 0.92 0.13 -1.88 -1.45 132.00 130.23 1xxe h PRO 223 Ca 0.17 -0.19 -0.17 0.00 -0.87 0.00 0.00 66.00 64.94 1xxe h PRO 223 Cb 0.25 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.33 1xxe h PRO 223 CO -0.33 0.71 -0.82 -0.39 -0.23 0.00 0.00 178.00 176.95 1xxe h VAL 224 N 0.41 1.41 -0.22 1.56 -1.51 -1.87 -2.50 116.25 113.54 1xxe h VAL 224 Ca 0.06 -2.97 -0.03 0.00 -1.23 0.00 0.00 66.70 62.53 1xxe h VAL 224 Cb 0.70 2.69 -0.01 0.00 -2.13 0.00 0.00 31.29 32.53 1xxe h VAL 224 CO 0.05 0.80 0.04 0.03 -1.23 0.00 0.00 177.57 177.26 1xxe h ARG 225 N 0.00 0.36 -0.73 5.19 2.47 -0.25 -0.28 114.38 121.14 1xxe h ARG 225 Ca -0.01 -0.09 -0.01 0.00 -1.26 0.00 0.00 59.98 58.61 1xxe h ARG 225 Cb 1.62 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 29.86 1xxe h ARG 225 CO 0.11 0.50 0.41 1.25 0.56 0.00 0.00 179.97 182.80 1xxe h HIS 226 N 0.16 0.98 0.06 3.04 2.76 -1.27 0.36 115.15 121.25 1xxe h HIS 226 Ca 0.07 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 1xxe h HIS 226 Cb 0.31 -0.32 -0.00 0.00 1.55 0.00 0.00 27.41 28.95 1xxe h HIS 226 CO 0.02 0.68 -0.05 -0.22 -1.30 0.00 0.00 177.93 177.07 1xxe h LYS 227 N 1.00 -0.11 -0.69 5.26 1.63 -1.11 0.18 116.57 122.73 1xxe h LYS 227 Ca 0.26 0.01 0.07 0.00 -0.85 0.00 0.00 60.65 60.14 1xxe h LYS 227 Cb 0.01 0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 31.61 1xxe h LYS 227 CO -0.04 -0.07 0.37 0.28 -3.45 0.00 0.00 179.45 176.53 1xxe h VAL 228 N -0.11 0.92 -1.01 2.00 2.07 -0.66 0.69 116.25 120.15 1xxe h VAL 228 Ca -0.00 -0.23 0.06 0.00 0.82 0.00 0.00 66.70 67.35 1xxe h VAL 228 Cb 0.10 0.20 -0.06 0.00 -1.52 0.00 0.00 31.29 30.01 1xxe h VAL 228 CO -0.01 0.12 0.65 0.15 0.02 0.00 0.00 177.57 178.51 1xxe h PHE 229 N 0.66 1.21 -0.03 1.57 3.57 -0.16 -1.05 116.94 122.72 1xxe h PHE 229 Ca 0.32 0.03 -0.19 0.00 3.53 0.00 0.00 57.97 61.66 1xxe h PHE 229 Cb 0.26 -0.40 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 1xxe h PHE 229 CO -0.09 0.65 -0.81 -0.44 -2.23 0.00 0.00 178.31 175.40 1xxe h ASP 230 N 1.21 0.37 -0.63 0.41 5.19 0.16 -2.55 116.42 120.57 1xxe h ASP 230 Ca 0.42 -0.27 0.03 0.00 -0.62 0.00 0.00 57.03 56.60 1xxe h ASP 230 Cb 0.12 -0.11 -0.03 0.00 0.18 0.00 0.00 39.33 39.48 1xxe h ASP 230 CO -0.16 1.03 0.42 0.25 -3.12 0.00 0.00 179.24 177.66 1xxe h LEU 231 N 0.19 0.65 -0.05 1.55 5.85 0.15 -0.53 115.31 123.13 1xxe h LEU 231 Ca -0.04 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.62 1xxe h LEU 231 Cb 1.40 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.28 1xxe h LEU 231 CO 0.13 0.45 -0.14 0.40 -0.34 0.00 0.00 178.44 178.94 1xxe h ILE 232 N 0.76 1.44 -0.98 4.05 2.04 -1.27 -1.82 117.51 121.73 1xxe h ILE 232 Ca 0.25 -1.52 0.26 0.00 1.00 0.00 0.00 64.86 64.85 1xxe h ILE 232 Cb 0.06 2.30 -0.06 0.00 -0.74 0.00 0.00 36.82 38.38 1xxe h ILE 232 CO -0.07 0.42 0.66 1.23 0.00 0.00 0.00 178.15 180.40 1xxe h GLY 233 N -0.33 0.60 1.79 5.37 0.00 -0.89 0.69 103.07 110.29 1xxe h GLY 233 Ca -0.00 -0.11 -0.16 0.00 0.00 0.00 0.00 47.33 47.05 1xxe h GLY 233 CO 0.03 -0.04 -0.89 -0.55 0.00 0.00 0.00 176.54 175.09 1xxe h ASP 234 N 0.23 0.00 1.36 0.19 5.19 -0.93 -3.26 116.42 119.21 1xxe h ASP 234 Ca 0.50 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.82 1xxe h ASP 234 Cb 1.56 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 41.06 1xxe h ASP 234 CO -0.14 0.73 -0.66 -0.07 -3.12 0.00 0.00 179.24 175.98 1xxe h LEU 235 N 0.00 0.00 -0.13 1.55 3.38 0.89 -3.13 115.31 117.86 1xxe h LEU 235 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1xxe h LEU 235 Cb 1.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.35 1xxe h LEU 235 CO 0.09 0.38 0.00 0.00 0.09 0.00 0.00 178.44 179.00 1xxe n TYR 236 N -3.08 0.12 -0.10 1.13 9.36 0.19 -2.60 117.16 122.18 1xxe n TYR 236 Ca -0.00 0.05 0.26 0.00 3.32 0.00 0.00 57.90 61.53 1xxe n TYR 236 Cb 0.70 -0.58 0.71 0.00 -0.63 0.00 0.00 39.34 39.55 1xxe n TYR 236 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1xxe h LEU 237 N 0.00 0.00 -2.17 2.98 3.38 -1.67 0.89 115.31 118.73 1xxe h LEU 237 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xxe h LEU 237 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1xxe h LEU 237 CO 0.00 0.00 0.05 -0.07 0.09 0.00 0.00 178.44 178.51 1xxe h LEU 238 N 0.00 0.00 0.02 1.67 3.38 -1.78 -3.33 115.31 115.27 1xxe h LEU 238 Ca 0.36 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.32 1xxe h LEU 238 Cb 1.65 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.39 1xxe h LEU 238 CO -0.00 0.00 -0.01 0.61 0.09 0.00 0.00 178.44 179.13 1xxe n GLY 239 N -1.19 0.45 3.52 0.83 0.00 0.31 -5.01 105.19 104.10 1xxe n GLY 239 Ca -0.02 -0.63 -0.15 0.00 0.00 0.00 0.00 46.02 45.22 1xxe n GLY 239 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xxe s SER 240 N -2.58 -0.64 -0.02 1.61 1.04 -1.26 -4.86 113.70 106.98 1xxe s SER 240 Ca 0.00 1.00 -0.40 0.00 0.48 0.00 0.00 55.95 57.03 1xxe s SER 240 Cb 0.00 0.96 -0.19 0.00 0.10 0.00 0.00 66.02 66.88 1xxe s SER 240 CO 0.00 -0.39 1.19 -2.65 0.98 0.00 0.00 173.24 172.37 1xxe n PRO 241 N 1.91 0.29 -3.53 4.02 -0.02 -1.26 -4.57 135.00 131.85 1xxe n PRO 241 Ca -0.16 0.11 -0.37 0.00 -2.02 0.00 0.00 63.50 61.06 1xxe n PRO 241 Cb 0.56 -1.64 -0.07 0.00 -0.02 0.00 0.00 33.50 32.33 1xxe n PRO 241 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xxe s VAL 242 N 0.43 5.29 -0.16 -1.45 1.01 -1.26 -0.85 120.40 123.41 1xxe s VAL 242 Ca 0.91 0.58 0.01 0.00 0.00 0.00 0.00 61.98 63.47 1xxe s VAL 242 Cb -1.21 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 31.53 1xxe s VAL 242 CO 0.57 0.39 -0.17 -0.54 0.00 0.00 0.00 175.10 175.35 1xxe s LYS 243 N 0.41 3.13 0.00 2.72 -0.14 0.18 -4.52 119.74 121.53 1xxe s LYS 243 Ca 0.17 -0.78 0.00 0.00 -1.36 0.00 0.00 55.97 54.00 1xxe s LYS 243 Cb -0.13 -2.60 0.00 0.00 -1.68 0.00 0.00 37.83 33.42 1xxe s LYS 243 CO 0.04 -0.06 0.00 0.41 -0.76 0.00 0.00 175.35 174.99 1xxe n GLY 244 N 4.24 0.93 3.39 -3.33 0.00 -0.87 -2.00 105.19 107.55 1xxe n GLY 244 Ca -0.20 -1.24 -0.39 0.00 0.00 0.00 0.00 46.02 44.20 1xxe n GLY 244 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xxe s LYS 245 N -1.97 3.07 0.06 1.61 2.36 0.12 -1.23 119.74 123.75 1xxe s LYS 245 Ca 0.00 -0.90 0.06 0.00 -2.55 0.00 0.00 55.97 52.58 1xxe s LYS 245 Cb 0.00 -3.57 -0.04 0.00 -1.05 0.00 0.00 37.83 33.18 1xxe s LYS 245 CO 0.00 -0.53 -0.10 -0.06 1.55 0.00 0.00 175.35 176.21 1xxe s PHE 246 N 1.55 2.75 0.02 4.03 0.40 0.27 -0.16 117.98 126.84 1xxe s PHE 246 Ca 0.03 -0.14 0.05 0.00 -0.60 0.00 0.00 56.93 56.27 1xxe s PHE 246 Cb -0.18 -1.50 -0.02 0.00 0.51 0.00 0.00 43.02 41.84 1xxe s PHE 246 CO 0.05 0.38 -0.14 -0.47 0.70 0.00 0.00 175.22 175.74 1xxe s TYR 247 N -1.09 1.24 -0.05 0.36 6.14 0.37 -0.75 117.35 123.57 1xxe s TYR 247 Ca 0.19 -0.30 -0.02 0.00 0.64 0.00 0.00 57.07 57.58 1xxe s TYR 247 Cb -0.11 -0.76 0.04 0.00 0.42 0.00 0.00 41.96 41.54 1xxe s TYR 247 CO 0.10 0.01 0.10 0.45 0.64 0.00 0.00 175.55 176.86 1xxe s SER 248 N -0.79 0.14 -0.26 4.32 0.15 0.17 -1.06 113.70 116.37 1xxe s SER 248 Ca 0.03 0.20 -0.04 0.00 0.70 0.00 0.00 55.95 56.85 1xxe s SER 248 Cb -0.07 0.09 0.01 0.00 -1.71 0.00 0.00 66.02 64.34 1xxe s SER 248 CO 0.01 -0.16 -0.01 0.12 1.20 0.00 0.00 173.24 174.39 1xxe s PHE 249 N 1.35 3.07 -1.29 3.44 5.36 -0.45 0.03 117.98 129.50 1xxe s PHE 249 Ca -0.07 -1.24 -0.16 0.00 -0.96 0.00 0.00 56.93 54.51 1xxe s PHE 249 Cb -0.12 -2.13 0.01 0.00 -0.34 0.00 0.00 43.02 40.44 1xxe s PHE 249 CO -0.05 -0.64 0.56 0.54 -1.46 0.00 0.00 175.22 174.17 1xxe n ARG 250 N 4.76 -1.59 -3.20 10.12 5.12 -0.20 -2.50 116.66 129.17 1xxe n ARG 250 Ca -0.16 0.31 -0.31 0.00 -1.93 0.00 0.00 57.85 55.76 1xxe n ARG 250 Cb 0.48 -3.80 -0.04 0.00 -1.16 0.00 0.00 32.46 27.93 1xxe n ARG 250 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1xxe s GLY 251 N -3.86 2.09 0.32 -0.13 0.00 -1.26 -4.34 107.32 100.13 1xxe s GLY 251 Ca 0.28 -0.27 0.01 0.00 0.00 0.00 0.00 44.72 44.74 1xxe s GLY 251 CO 0.91 -0.12 0.12 0.61 0.00 0.00 0.00 173.10 174.63 1xxe n GLY 252 N -0.69 3.35 0.10 0.20 0.00 -1.26 -4.99 105.19 101.90 1xxe n GLY 252 Ca 0.01 -2.28 -0.12 0.00 0.00 0.00 0.00 46.02 43.63 1xxe n GLY 252 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1xxe h HIS 253 N 0.88 -0.13 0.17 1.61 3.86 -1.95 -2.10 115.15 117.50 1xxe h HIS 253 Ca -0.23 -0.00 0.01 0.00 -1.16 0.00 0.00 60.37 58.98 1xxe h HIS 253 Cb 0.77 0.04 -0.03 0.00 1.06 0.00 0.00 27.41 29.26 1xxe h HIS 253 CO 0.00 0.35 -0.25 0.66 0.86 0.00 0.00 177.93 179.55 1xxe h SER 254 N -0.69 -0.70 -0.87 2.45 4.64 -1.89 -0.19 113.55 116.30 1xxe h SER 254 Ca -0.01 0.07 0.17 0.00 -0.47 0.00 0.00 61.79 61.55 1xxe h SER 254 Cb 0.53 0.26 -0.10 0.00 -0.31 0.00 0.00 62.40 62.77 1xxe h SER 254 CO 0.02 -0.35 0.44 0.25 -0.87 0.00 0.00 176.83 176.32 1xxe h LEU 255 N -0.49 0.50 0.09 5.97 5.85 -1.97 0.24 115.31 125.51 1xxe h LEU 255 Ca 0.02 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 1xxe h LEU 255 Cb 0.49 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.55 1xxe h LEU 255 CO -0.11 0.17 -0.04 0.78 -0.34 0.00 0.00 178.44 178.90 1xxe h ASN 256 N 0.58 -0.10 -0.95 1.25 2.35 -0.58 -2.27 115.58 115.85 1xxe h ASN 256 Ca 0.50 -0.05 0.13 0.00 -0.55 0.00 0.00 56.30 56.33 1xxe h ASN 256 Cb 0.78 0.03 -0.09 0.00 0.05 0.00 0.00 38.32 39.09 1xxe h ASN 256 CO -0.41 -0.02 0.57 0.58 -1.65 0.00 0.00 177.43 176.51 1xxe h VAL 257 N -0.18 0.86 -0.38 2.81 2.07 0.70 -0.53 116.25 121.60 1xxe h VAL 257 Ca -0.01 -0.30 0.06 0.00 0.82 0.00 0.00 66.70 67.27 1xxe h VAL 257 Cb 0.15 -0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 29.77 1xxe h VAL 257 CO 0.02 0.16 0.07 0.11 0.02 0.00 0.00 177.57 177.95 1xxe h LYS 258 N 0.88 0.19 -0.67 1.57 1.57 -0.47 0.43 116.57 120.06 1xxe h LYS 258 Ca 0.49 -0.01 0.11 0.00 -1.87 0.00 0.00 60.65 59.37 1xxe h LYS 258 Cb 0.55 -0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.73 1xxe h LYS 258 CO -0.29 0.12 0.25 1.25 -0.57 0.00 0.00 179.45 180.21 1xxe h LEU 259 N 0.19 0.23 -0.28 2.94 5.85 -0.69 -0.51 115.31 123.04 1xxe h LEU 259 Ca 0.18 0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.95 1xxe h LEU 259 Cb 0.22 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1xxe h LEU 259 CO -0.24 0.12 0.02 0.58 -0.34 0.00 0.00 178.44 178.57 1xxe h VAL 260 N 0.42 1.25 -0.21 1.05 2.07 -0.64 -1.42 116.25 118.76 1xxe h VAL 260 Ca 0.35 -0.88 0.06 0.00 0.82 0.00 0.00 66.70 67.05 1xxe h VAL 260 Cb 0.48 1.27 -0.06 0.00 -1.52 0.00 0.00 31.29 31.45 1xxe h VAL 260 CO -0.35 0.28 -0.18 0.50 0.02 0.00 0.00 177.57 177.84 1xxe h LYS 261 N 0.29 -0.18 -0.26 1.57 3.64 0.11 0.58 116.57 122.32 1xxe h LYS 261 Ca 0.08 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1xxe h LYS 261 Cb 0.39 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 1xxe h LYS 261 CO 0.01 -0.12 0.07 0.93 -2.27 0.00 0.00 179.45 178.07 1xxe h GLU 262 N -0.19 0.41 -0.40 1.90 5.08 -1.10 0.15 114.58 120.43 1xxe h GLU 262 Ca 0.13 -0.09 0.02 0.00 -1.00 0.00 0.00 59.36 58.41 1xxe h GLU 262 Cb 0.38 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1xxe h GLU 262 CO -0.33 0.50 0.23 -0.07 -1.00 0.00 0.00 179.01 178.34 1xxe h LEU 263 N 0.25 0.38 -0.70 1.33 3.38 -0.66 0.59 115.31 119.87 1xxe h LEU 263 Ca 0.08 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.92 1xxe h LEU 263 Cb 0.27 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1xxe h LEU 263 CO -0.00 0.27 -0.48 0.00 0.09 0.00 0.00 178.44 178.32 1xxe h ALA 264 N 1.17 0.88 0.00 1.53 0.00 0.29 -2.73 119.26 120.41 1xxe h ALA 264 Ca 0.16 -0.47 -0.14 0.00 0.00 0.00 0.00 54.91 54.45 1xxe h ALA 264 Cb 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1xxe h ALA 264 CO -0.07 0.66 -0.68 0.87 0.00 0.00 0.00 179.25 180.03 1xxe h LYS 265 N 0.33 0.00 -0.23 0.00 1.57 -0.28 -3.07 116.57 114.88 1xxe h LYS 265 Ca 0.02 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 1xxe h LYS 265 Cb 0.97 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 1xxe h LYS 265 CO 0.08 0.68 -0.03 0.87 -0.57 0.00 0.00 179.45 180.49 1xxe h LYS 266 N 0.00 0.43 -0.32 3.15 1.57 0.35 -2.79 116.57 118.97 1xxe h LYS 266 Ca -0.01 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 1xxe h LYS 266 Cb 1.49 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.77 1xxe h LYS 266 CO 0.09 0.64 0.00 0.94 -0.57 0.00 0.00 179.45 180.55 1xxe n GLN 267 N -4.61 1.59 0.20 3.15 7.27 -1.05 -3.82 117.38 120.12 1xxe n GLN 267 Ca -0.04 -0.79 0.09 0.00 0.07 0.00 0.00 57.00 56.34 1xxe n GLN 267 Cb 0.27 -1.25 0.30 0.00 2.41 0.00 0.00 30.24 31.97 1xxe n GLN 267 CO 0.00 0.00 0.00 1.57 0.07 0.00 0.00 177.06 178.70 1xxe h LYS 268 N 1.23 0.00 -0.00 3.69 5.09 -1.39 -3.26 116.57 121.93 1xxe h LYS 268 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 60.65 60.74 1xxe h LYS 268 Cb 0.38 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.71 1xxe h LYS 268 CO 0.02 0.23 -0.01 -0.07 -2.09 0.00 0.00 179.45 177.53 1xxe h LEU 269 N 0.00 0.01 -1.34 7.07 3.38 -1.75 -3.52 115.31 119.15 1xxe h LEU 269 Ca -0.00 -0.76 0.00 0.00 0.09 0.00 0.00 57.88 57.21 1xxe h LEU 269 Cb 0.96 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1xxe h LEU 269 CO 0.03 0.77 0.00 0.35 0.09 0.00 0.00 178.44 179.68