#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 1.22 -4.80 3.23 1.02 0.60 -4.64 120.64 117.27 1xxe n GLU 4 Ca 0.00 0.43 -0.33 0.00 -0.02 0.00 0.00 57.16 57.24 1xxe n GLU 4 Cb 0.00 -1.80 -0.14 0.00 -0.02 0.00 0.00 31.44 29.48 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 -1.60 3.27 0.26 3.49 2.47 -1.26 0.46 119.74 126.82 1xxe s LYS 5 Ca 0.60 -0.69 0.02 0.00 -1.56 0.00 0.00 55.97 54.34 1xxe s LYS 5 Cb -0.68 -2.59 -0.05 0.00 -1.46 0.00 0.00 37.83 33.04 1xxe s LYS 5 CO 0.59 0.27 0.07 -0.08 0.16 0.00 0.00 175.35 176.36 1xxe s THR 6 N 0.20 0.76 0.21 3.43 -1.32 -0.12 -2.37 115.64 116.43 1xxe s THR 6 Ca -0.08 -2.00 -0.28 0.00 -1.21 0.00 0.00 61.69 58.11 1xxe s THR 6 Cb -0.15 -2.58 -0.09 0.00 -1.51 0.00 0.00 72.50 68.17 1xxe s THR 6 CO 0.05 -0.09 0.89 0.68 -2.21 0.00 0.00 174.62 173.94 1xxe s VAL 7 N -3.61 4.19 0.02 5.08 -7.23 -1.26 0.16 120.40 117.75 1xxe s VAL 7 Ca 0.35 1.96 -0.21 0.00 -1.81 0.00 0.00 61.98 62.26 1xxe s VAL 7 Cb 0.08 -4.27 -0.16 0.00 0.56 0.00 0.00 36.38 32.59 1xxe s VAL 7 CO 0.12 0.50 1.31 0.50 -0.31 0.00 0.00 175.10 177.23 1xxe h LYS 8 N 4.26 0.28 -4.99 4.82 3.64 -0.26 -3.41 116.57 120.90 1xxe h LYS 8 Ca -0.46 -0.16 -0.33 0.00 -1.27 0.00 0.00 60.65 58.43 1xxe h LYS 8 Cb 1.20 0.01 -0.14 0.00 -0.41 0.00 0.00 32.23 32.89 1xxe h LYS 8 CO 0.67 0.71 -0.68 -1.21 -2.27 0.00 0.00 179.45 176.67 1xxe s GLU 9 N -4.23 1.17 0.26 1.90 2.02 -1.26 -4.94 118.70 113.61 1xxe s GLU 9 Ca -0.14 -1.55 -0.30 0.00 0.02 0.00 0.00 54.97 53.00 1xxe s GLU 9 Cb 0.04 -0.52 -0.10 0.00 0.10 0.00 0.00 34.13 33.66 1xxe s GLU 9 CO 0.74 -0.04 1.37 0.21 0.02 0.00 0.00 175.26 177.56 1xxe s LYS 10 N -3.83 4.32 0.34 1.61 2.36 -1.26 -4.79 119.74 118.48 1xxe s LYS 10 Ca 0.23 2.22 0.09 0.00 -2.55 0.00 0.00 55.97 55.96 1xxe s LYS 10 Cb 0.05 -3.12 -0.06 0.00 -1.05 0.00 0.00 37.83 33.65 1xxe s LYS 10 CO 0.04 -0.32 -0.02 -0.51 1.55 0.00 0.00 175.35 176.10 1xxe s LEU 11 N -0.72 2.91 -0.06 5.43 1.43 -0.67 -4.94 118.68 122.05 1xxe s LEU 11 Ca 0.56 -1.06 -0.16 0.00 -1.03 0.00 0.00 54.13 52.44 1xxe s LEU 11 Cb -0.40 -1.24 0.03 0.00 0.03 0.00 0.00 46.19 44.61 1xxe s LEU 11 CO 0.45 -0.23 0.37 -0.94 0.23 0.00 0.00 176.35 176.23 1xxe s SER 12 N -3.69 -0.31 0.14 2.29 1.04 -1.26 -0.64 113.70 111.28 1xxe s SER 12 Ca 0.34 0.39 0.03 0.00 0.48 0.00 0.00 55.95 57.19 1xxe s SER 12 Cb 0.01 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.59 1xxe s SER 12 CO 0.19 -0.35 -0.06 -0.36 0.98 0.00 0.00 173.24 173.63 1xxe s PHE 13 N -0.78 1.13 -0.14 5.02 0.08 -0.28 -4.98 117.98 118.04 1xxe s PHE 13 Ca -0.09 -0.87 -0.11 0.00 0.12 0.00 0.00 56.93 55.99 1xxe s PHE 13 Cb -0.04 -0.62 0.04 0.00 -0.57 0.00 0.00 43.02 41.83 1xxe s PHE 13 CO 0.03 -0.06 0.35 -1.83 -0.10 0.00 0.00 175.22 173.61 1xxe s GLU 14 N -3.82 0.38 0.00 0.44 4.04 -1.26 -1.70 118.70 116.78 1xxe s GLU 14 Ca 0.17 0.55 0.00 0.00 0.04 0.00 0.00 54.97 55.73 1xxe s GLU 14 Cb 0.04 0.12 0.00 0.00 0.02 0.00 0.00 34.13 34.31 1xxe s GLU 14 CO -0.00 -0.08 0.00 0.41 -1.84 0.00 0.00 175.26 173.74 1xxe n GLY 15 N 3.33 1.57 3.81 -3.83 0.00 -0.77 -4.97 105.19 104.33 1xxe n GLY 15 Ca -0.17 -0.70 -0.36 0.00 0.00 0.00 0.00 46.02 44.80 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 4.57 0.40 1.61 0.11 -1.26 -1.95 120.40 121.87 1xxe s VAL 16 Ca 0.00 1.30 -0.26 0.00 -2.93 0.00 0.00 61.98 60.09 1xxe s VAL 16 Cb 0.00 -3.87 -0.08 0.00 -1.53 0.00 0.00 36.38 30.89 1xxe s VAL 16 CO 0.00 0.24 1.20 -0.83 -3.33 0.00 0.00 175.10 172.38 1xxe s GLY 17 N -1.61 2.89 0.14 6.54 0.00 -0.67 -2.99 107.32 111.61 1xxe s GLY 17 Ca 0.42 1.04 -0.15 0.00 0.00 0.00 0.00 44.72 46.03 1xxe s GLY 17 CO 0.21 1.57 1.68 1.19 0.00 0.00 0.00 173.10 177.75 1xxe h ILE 18 N 2.38 1.21 0.12 0.90 2.10 -1.83 0.24 117.51 122.63 1xxe h ILE 18 Ca -0.49 -0.66 -0.33 0.00 1.08 0.00 0.00 64.86 64.46 1xxe h ILE 18 Cb 1.24 0.83 -0.01 0.00 -1.09 0.00 0.00 36.82 37.79 1xxe h ILE 18 CO 0.63 0.24 -1.74 0.45 -1.08 0.00 0.00 178.15 176.65 1xxe h HIS 19 N 0.56 0.46 0.00 2.19 3.86 -1.89 3.04 115.15 123.36 1xxe h HIS 19 Ca 0.14 -0.33 -0.14 0.00 -1.16 0.00 0.00 60.37 58.87 1xxe h HIS 19 Cb 0.22 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.65 1xxe h HIS 19 CO 0.01 1.51 -0.74 1.79 0.86 0.00 0.00 177.93 181.35 1xxe h THR 20 N 0.07 1.08 -0.72 2.45 1.35 -1.91 -2.02 112.91 113.20 1xxe h THR 20 Ca -0.32 -2.55 -0.31 0.00 -0.55 0.00 0.00 66.41 62.67 1xxe h THR 20 Cb 2.04 2.51 -0.12 0.00 -1.73 0.00 0.00 68.15 70.85 1xxe h THR 20 CO 0.13 0.61 -0.28 0.61 -0.25 0.00 0.00 175.52 176.34 1xxe n GLY 21 N 1.28 1.52 3.80 5.82 0.00 0.07 -4.67 105.19 113.02 1xxe n GLY 21 Ca 0.00 -0.20 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 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 -3.25 3.03 0.18 1.61 -6.30 -1.26 -4.80 118.70 107.92 1xxe s GLU 22 Ca 0.00 -0.59 -0.30 0.00 -2.50 0.00 0.00 54.97 51.58 1xxe s GLU 22 Cb 0.00 -2.82 -0.08 0.00 0.00 0.00 0.00 34.13 31.23 1xxe s GLU 22 CO 0.00 0.60 1.24 -0.47 0.02 0.00 0.00 175.26 176.65 1xxe s TYR 23 N -1.36 3.36 0.05 5.30 6.14 -1.26 -1.67 117.35 127.91 1xxe s TYR 23 Ca 0.29 1.33 -0.03 0.00 0.64 0.00 0.00 57.07 59.30 1xxe s TYR 23 Cb -0.12 -3.50 -0.03 0.00 0.42 0.00 0.00 41.96 38.73 1xxe s TYR 23 CO 0.21 -1.47 0.02 0.45 0.64 0.00 0.00 175.55 175.40 1xxe s SER 24 N 0.28 0.36 0.01 4.32 0.15 -0.82 -4.89 113.70 113.11 1xxe s SER 24 Ca 0.55 -0.82 0.01 0.00 0.70 0.00 0.00 55.95 56.39 1xxe s SER 24 Cb -0.34 0.22 -0.01 0.00 -1.71 0.00 0.00 66.02 64.18 1xxe s SER 24 CO 0.37 -0.58 -0.04 -0.75 1.20 0.00 0.00 173.24 173.44 1xxe s LYS 25 N -3.45 0.33 0.04 5.44 2.20 -0.86 -1.85 119.74 121.60 1xxe s LYS 25 Ca 0.02 -0.39 0.07 0.00 -0.36 0.00 0.00 55.97 55.31 1xxe s LYS 25 Cb 0.04 -0.17 -0.02 0.00 -1.51 0.00 0.00 37.83 36.16 1xxe s LYS 25 CO -0.08 0.04 -0.20 -0.51 -0.36 0.00 0.00 175.35 174.23 1xxe s LEU 26 N -0.78 2.17 -0.06 5.43 1.43 -0.69 -0.07 118.68 126.11 1xxe s LEU 26 Ca -0.06 -0.51 0.03 0.00 -1.03 0.00 0.00 54.13 52.56 1xxe s LEU 26 Cb -0.05 -0.93 0.00 0.00 0.03 0.00 0.00 46.19 45.24 1xxe s LEU 26 CO -0.00 0.15 -0.16 -0.63 0.23 0.00 0.00 176.35 175.94 1xxe s ILE 27 N -0.80 1.38 -0.10 -0.59 1.01 -0.21 -1.12 121.20 120.77 1xxe s ILE 27 Ca 0.07 -0.65 0.01 0.00 0.00 0.00 0.00 60.65 60.07 1xxe s ILE 27 Cb -0.09 -1.22 -0.02 0.00 0.01 0.00 0.00 42.46 41.14 1xxe s ILE 27 CO 0.02 0.41 -0.12 -0.63 0.00 0.00 0.00 174.94 174.62 1xxe s ILE 28 N 0.37 3.23 0.08 2.92 1.01 0.19 0.69 121.20 129.69 1xxe s ILE 28 Ca -0.11 -0.62 0.06 0.00 0.00 0.00 0.00 60.65 59.98 1xxe s ILE 28 Cb -0.14 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 39.96 1xxe s ILE 28 CO 0.04 0.55 -0.17 -1.00 0.00 0.00 0.00 174.94 174.36 1xxe s HIS 29 N -0.12 1.42 0.91 3.97 3.76 -0.83 -1.67 115.29 122.73 1xxe s HIS 29 Ca -0.01 -0.44 -0.10 0.00 -0.15 0.00 0.00 55.06 54.36 1xxe s HIS 29 Cb -0.14 -0.79 0.14 0.00 1.11 0.00 0.00 32.58 32.90 1xxe s HIS 29 CO 0.03 0.11 1.13 -1.25 -0.85 0.00 0.00 174.74 173.91 1xxe s PRO 30 N -1.76 1.09 0.18 8.40 0.04 -1.26 -1.60 135.00 140.08 1xxe s PRO 30 Ca 0.01 1.46 0.03 0.00 0.04 0.00 0.00 61.00 62.54 1xxe s PRO 30 Cb -0.10 -1.74 -0.01 0.00 0.04 0.00 0.00 34.50 32.69 1xxe s PRO 30 CO 0.03 -2.55 0.10 0.39 0.04 0.00 0.00 177.00 175.01 1xxe n GLU 31 N -4.17 0.48 -3.20 4.56 -0.58 -1.26 -4.63 120.64 111.85 1xxe n GLU 31 Ca 0.11 -1.64 -0.28 0.00 -0.42 0.00 0.00 57.16 54.92 1xxe n GLU 31 Cb 0.52 1.11 -0.03 0.00 -0.57 0.00 0.00 31.44 32.48 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 -2.71 3.63 0.42 3.49 2.20 -1.26 -4.93 119.74 120.59 1xxe s LYS 32 Ca 0.15 0.07 -0.23 0.00 -0.36 0.00 0.00 55.97 55.59 1xxe s LYS 32 Cb 0.01 -2.58 -0.12 0.00 -1.51 0.00 0.00 37.83 33.63 1xxe s LYS 32 CO 0.10 0.13 0.66 0.39 -0.36 0.00 0.00 175.35 176.27 1xxe n GLU 33 N -1.20 0.74 -2.19 4.03 4.71 -1.26 -1.23 120.64 124.23 1xxe n GLU 33 Ca -0.01 0.27 -0.20 0.00 -0.01 0.00 0.00 57.16 57.21 1xxe n GLU 33 Cb 0.54 -1.63 -0.03 0.00 -1.01 0.00 0.00 31.44 29.31 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 1.64 0.12 0.13 0.62 0.00 -1.26 -4.86 105.19 101.60 1xxe n GLY 34 Ca 0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 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 1.30 0.00 2.61 2.02 -1.35 -3.50 112.91 113.98 1xxe h THR 35 Ca -0.46 -2.79 0.00 0.00 0.77 0.00 0.00 66.41 63.93 1xxe h THR 35 Cb 1.34 2.97 0.00 0.00 -1.74 0.00 0.00 68.15 70.72 1xxe h THR 35 CO 0.57 0.84 0.00 0.61 0.37 0.00 0.00 175.52 177.91 1xxe n GLY 36 N 1.68 -2.61 3.62 2.16 0.00 0.11 -4.87 105.19 105.29 1xxe n GLY 36 Ca -0.15 -1.88 -0.37 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 -0.42 5.24 -0.00 -0.61 -1.09 -1.24 -2.24 121.20 120.83 1xxe s ILE 37 Ca 0.00 0.14 0.01 0.00 -2.23 0.00 0.00 60.65 58.57 1xxe s ILE 37 Cb 0.00 -3.45 -0.00 0.00 -1.58 0.00 0.00 42.46 37.43 1xxe s ILE 37 CO 0.00 0.32 -0.03 0.00 -1.23 0.00 0.00 174.94 174.01 1xxe s ARG 38 N 1.26 0.23 0.11 2.79 1.70 -1.01 -1.96 118.95 122.08 1xxe s ARG 38 Ca 0.07 -0.09 -0.05 0.00 -0.47 0.00 0.00 55.73 55.19 1xxe s ARG 38 Cb -0.14 -0.24 -0.05 0.00 -0.57 0.00 0.00 34.95 33.94 1xxe s ARG 38 CO 0.06 0.05 0.36 -0.06 -1.08 0.00 0.00 175.30 174.63 1xxe s PHE 39 N 0.00 3.50 -0.02 5.89 0.08 -0.84 -1.49 117.98 125.11 1xxe s PHE 39 Ca 0.00 0.57 0.03 0.00 0.12 0.00 0.00 56.93 57.66 1xxe s PHE 39 Cb -0.02 -2.01 -0.00 0.00 -0.57 0.00 0.00 43.02 40.42 1xxe s PHE 39 CO -0.00 0.47 -0.11 0.12 -0.10 0.00 0.00 175.22 175.60 1xxe s PHE 40 N -1.58 1.12 -0.28 0.36 2.19 -0.72 0.25 117.98 119.32 1xxe s PHE 40 Ca 0.38 -0.26 -0.25 0.00 0.33 0.00 0.00 56.93 57.13 1xxe s PHE 40 Cb -0.13 -0.76 0.11 0.00 -1.31 0.00 0.00 43.02 40.93 1xxe s PHE 40 CO 0.23 -0.08 0.93 0.21 1.83 0.00 0.00 175.22 178.34 1xxe s LYS 41 N -0.01 0.61 -1.28 10.12 2.36 -0.07 -0.70 119.74 130.77 1xxe s LYS 41 Ca -0.00 0.74 0.00 0.00 -2.55 0.00 0.00 55.97 54.15 1xxe s LYS 41 Cb -0.08 0.29 0.00 0.00 -1.05 0.00 0.00 37.83 37.00 1xxe s LYS 41 CO 0.00 -0.07 0.00 -1.71 1.55 0.00 0.00 175.35 175.12 1xxe n ASN 42 N 2.42 -4.48 -0.44 1.43 4.05 -1.26 0.33 115.26 117.32 1xxe n ASN 42 Ca -0.13 0.14 -0.06 0.00 0.45 0.00 0.00 54.58 54.98 1xxe n ASN 42 Cb 0.56 -3.78 -0.02 0.00 1.23 0.00 0.00 39.78 37.76 1xxe n ASN 42 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1xxe n GLY 43 N -0.85 0.82 3.24 8.20 0.00 -1.26 -5.01 105.19 110.33 1xxe n GLY 43 Ca -0.18 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.17 2.00 -0.13 1.61 1.01 0.15 -5.12 120.40 117.76 1xxe s VAL 44 Ca 0.00 -1.02 -0.11 0.00 0.00 0.00 0.00 61.98 60.85 1xxe s VAL 44 Cb 0.00 -1.71 -0.05 0.00 0.00 0.00 0.00 36.38 34.63 1xxe s VAL 44 CO 0.00 0.55 0.22 -0.31 0.00 0.00 0.00 175.10 175.57 1xxe s TYR 45 N -0.01 3.53 -0.39 5.22 1.51 -1.26 -0.89 117.35 125.06 1xxe s TYR 45 Ca -0.08 0.57 0.02 0.00 -1.01 0.00 0.00 57.07 56.57 1xxe s TYR 45 Cb -0.15 -2.17 0.12 0.00 -0.11 0.00 0.00 41.96 39.65 1xxe s TYR 45 CO 0.05 0.46 0.16 0.42 -1.11 0.00 0.00 175.55 175.53 1xxe s ILE 46 N -0.24 1.51 0.34 2.71 1.01 0.14 -4.95 121.20 121.72 1xxe s ILE 46 Ca 0.15 -2.23 -0.26 0.00 0.00 0.00 0.00 60.65 58.32 1xxe s ILE 46 Cb -0.13 -2.09 -0.13 0.00 0.01 0.00 0.00 42.46 40.12 1xxe s ILE 46 CO 0.04 -0.76 0.80 -2.65 0.00 0.00 0.00 174.94 172.36 1xxe n PRO 47 N 4.04 0.93 -2.89 2.79 -0.02 -1.26 -1.98 135.00 136.61 1xxe n PRO 47 Ca 0.04 0.33 -0.44 0.00 -2.02 0.00 0.00 63.50 61.41 1xxe n PRO 47 Cb 0.38 -1.65 -0.00 0.00 -0.02 0.00 0.00 33.50 32.20 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 -1.21 3.88 0.06 3.55 0.00 -0.83 -4.82 121.76 122.40 1xxe s ALA 48 Ca 0.61 -3.28 0.03 0.00 0.00 0.00 0.00 51.96 49.32 1xxe s ALA 48 Cb -0.68 -4.21 -0.03 0.00 0.00 0.00 0.00 23.12 18.20 1xxe s ALA 48 CO 0.58 -2.86 -0.09 0.50 0.00 0.00 0.00 175.76 173.89 1xxe s ARG 49 N 2.03 0.67 0.18 0.00 3.52 -1.26 -4.45 118.95 119.65 1xxe s ARG 49 Ca 0.45 -0.94 -0.13 0.00 -0.13 0.00 0.00 55.73 54.97 1xxe s ARG 49 Cb -0.02 -0.41 0.16 0.00 -1.56 0.00 0.00 34.95 33.12 1xxe s ARG 49 CO 0.01 0.07 1.74 1.12 -0.81 0.00 0.00 175.30 177.43 1xxe h HIS 50 N 4.09 0.23 -0.08 5.12 2.07 -1.93 0.07 115.15 124.72 1xxe h HIS 50 Ca -0.37 0.03 0.02 0.00 -2.85 0.00 0.00 60.37 57.20 1xxe h HIS 50 Cb 1.19 -0.03 -0.00 0.00 2.57 0.00 0.00 27.41 31.14 1xxe h HIS 50 CO 0.63 0.06 0.82 0.93 -3.07 0.00 0.00 177.93 177.30 1xxe h GLU 51 N 0.29 0.00 -0.19 5.12 5.08 -1.96 3.16 114.58 126.08 1xxe h GLU 51 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 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 -0.26 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 178.94 1xxe n PHE 52 N -2.69 0.25 -1.66 4.33 3.72 0.01 -4.89 117.46 116.53 1xxe n PHE 52 Ca 0.01 -0.12 -0.42 0.00 -0.05 0.00 0.00 57.45 56.87 1xxe n PHE 52 Cb 0.85 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.36 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 -1.75 2.98 -0.07 -4.37 1.01 1.05 -2.77 120.40 116.48 1xxe s VAL 53 Ca 0.32 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.38 1xxe s VAL 53 Cb 0.18 -3.00 -0.11 0.00 0.00 0.00 0.00 36.38 33.45 1xxe s VAL 53 CO 0.26 -0.00 0.06 1.33 0.00 0.00 0.00 175.10 176.75 1xxe n VAL 54 N 5.53 0.47 -3.66 2.92 0.24 -1.00 -4.94 118.33 117.88 1xxe n VAL 54 Ca 0.20 -0.32 -0.08 0.00 -2.04 0.00 0.00 64.34 62.10 1xxe n VAL 54 Cb 0.41 -0.60 -0.09 0.00 -1.47 0.00 0.00 33.84 32.09 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 -2.27 -0.84 -0.10 6.34 5.65 -1.20 -5.06 115.29 117.81 1xxe s HIS 55 Ca -0.04 1.61 0.02 0.00 0.25 0.00 0.00 55.06 56.90 1xxe s HIS 55 Cb 0.03 0.38 -0.01 0.00 -1.18 0.00 0.00 32.58 31.79 1xxe s HIS 55 CO 0.34 -0.48 -0.16 0.95 -0.65 0.00 0.00 174.74 174.74 1xxe s THR 56 N 2.34 2.79 0.00 0.89 -4.23 -1.26 -1.82 115.64 114.34 1xxe s THR 56 Ca -0.04 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.69 1xxe s THR 56 Cb -0.11 -2.12 0.00 0.00 1.34 0.00 0.00 72.50 71.61 1xxe s THR 56 CO -0.14 0.55 0.00 -3.20 -0.54 0.00 0.00 174.62 171.29 1xxe n ASN 57 N 3.20 0.00 0.18 3.99 2.85 -1.26 -4.85 115.26 119.38 1xxe n ASN 57 Ca -0.18 0.00 0.04 0.00 -0.11 0.00 0.00 54.58 54.33 1xxe n ASN 57 Cb 0.53 0.00 0.19 0.00 1.24 0.00 0.00 39.78 41.74 1xxe n ASN 57 CO 0.00 0.00 0.00 0.45 -2.11 0.00 0.00 177.26 175.60 1xxe h HIS 58 N 0.00 0.00 -4.03 1.20 3.86 -2.03 -3.39 115.15 110.76 1xxe h HIS 58 Ca 0.00 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 58.95 1xxe h HIS 58 Cb 0.00 0.00 -0.15 0.00 1.06 0.00 0.00 27.41 28.32 1xxe h HIS 58 CO 0.00 0.00 -0.65 -1.12 0.86 0.00 0.00 177.93 177.02 1xxe s SER 59 N -3.01 0.85 -0.19 2.45 0.01 -1.26 -5.00 113.70 107.55 1xxe s SER 59 Ca -0.01 -1.24 -0.05 0.00 1.31 0.00 0.00 55.95 55.96 1xxe s SER 59 Cb 0.02 0.20 -0.02 0.00 0.21 0.00 0.00 66.02 66.43 1xxe s SER 59 CO 0.06 -0.67 -0.01 -0.89 0.41 0.00 0.00 173.24 172.15 1xxe s THR 60 N -3.83 3.94 -0.01 1.44 2.01 -1.26 -4.54 115.64 113.38 1xxe s THR 60 Ca 0.28 -0.32 0.07 0.00 0.31 0.00 0.00 61.69 62.02 1xxe s THR 60 Cb 0.07 -2.77 -0.02 0.00 0.01 0.00 0.00 72.50 69.79 1xxe s THR 60 CO 0.06 0.44 -0.22 -1.81 -0.69 0.00 0.00 174.62 172.40 1xxe s ASP 61 N 0.86 2.53 0.26 3.53 1.01 -0.76 -0.79 116.67 123.32 1xxe s ASP 61 Ca 0.00 -0.40 0.11 0.00 0.71 0.00 0.00 52.55 52.97 1xxe s ASP 61 Cb -0.14 -0.28 -0.05 0.00 1.01 0.00 0.00 42.92 43.46 1xxe s ASP 61 CO 0.02 0.26 -0.18 -0.76 0.21 0.00 0.00 175.17 174.72 1xxe s LEU 62 N -0.57 2.58 -0.28 1.23 1.43 -0.07 -2.39 118.68 120.61 1xxe s LEU 62 Ca 0.08 -1.04 -0.26 0.00 -1.03 0.00 0.00 54.13 51.89 1xxe s LEU 62 Cb -0.08 -0.96 0.16 0.00 0.03 0.00 0.00 46.19 45.34 1xxe s LEU 62 CO -0.01 -0.04 1.25 -0.83 0.23 0.00 0.00 176.35 176.96 1xxe s GLY 63 N -3.45 0.11 -0.00 -3.19 0.00 -1.12 0.75 107.32 100.42 1xxe s GLY 63 Ca 0.28 3.07 -0.06 0.00 0.00 0.00 0.00 44.72 48.01 1xxe s GLY 63 CO 0.12 1.80 0.12 -0.12 0.00 0.00 0.00 173.10 175.03 1xxe s PHE 64 N -0.01 0.05 -1.48 1.90 5.36 0.50 -4.83 117.98 119.46 1xxe s PHE 64 Ca 0.05 -0.13 -0.11 0.00 -0.96 0.00 0.00 56.93 55.78 1xxe s PHE 64 Cb -0.05 -0.05 0.06 0.00 -0.34 0.00 0.00 43.02 42.64 1xxe s PHE 64 CO -0.11 -0.26 0.92 1.63 -1.46 0.00 0.00 175.22 175.94 1xxe n LYS 65 N 1.61 -5.68 -0.95 10.12 4.76 -1.26 -0.05 118.16 126.71 1xxe n LYS 65 Ca -0.22 0.67 0.00 0.00 -2.87 0.00 0.00 58.31 55.89 1xxe n LYS 65 Cb 0.56 -5.57 0.00 0.00 -1.84 0.00 0.00 35.03 28.18 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 -1.67 0.71 3.88 0.72 0.00 -1.26 -5.00 105.19 102.56 1xxe n GLY 66 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.20 3.65 0.01 1.61 -1.52 0.92 -5.10 119.66 119.04 1xxe s GLN 67 Ca 0.00 0.02 0.00 0.00 -1.95 0.00 0.00 55.36 53.43 1xxe s GLN 67 Cb 0.00 -3.04 -0.01 0.00 -0.22 0.00 0.00 33.01 29.74 1xxe s GLN 67 CO 0.00 0.61 -0.01 1.03 -0.25 0.00 0.00 175.29 176.67 1xxe s ARG 68 N -1.84 0.14 -0.01 2.91 0.52 -1.26 -0.37 118.95 119.03 1xxe s ARG 68 Ca 0.30 -0.24 0.02 0.00 -0.52 0.00 0.00 55.73 55.29 1xxe s ARG 68 Cb -0.13 0.02 -0.00 0.00 0.52 0.00 0.00 34.95 35.35 1xxe s ARG 68 CO 0.17 -0.01 -0.08 0.42 0.02 0.00 0.00 175.30 175.82 1xxe s ILE 69 N -0.57 0.64 0.13 1.52 1.01 0.23 -4.73 121.20 119.44 1xxe s ILE 69 Ca -0.06 -0.34 0.08 0.00 0.00 0.00 0.00 60.65 60.34 1xxe s ILE 69 Cb -0.04 -0.55 -0.04 0.00 0.01 0.00 0.00 42.46 41.84 1xxe s ILE 69 CO -0.00 0.19 -0.12 -0.54 0.00 0.00 0.00 174.94 174.46 1xxe s LYS 70 N -0.12 2.00 -0.76 2.79 1.02 -0.82 -0.89 119.74 122.97 1xxe s LYS 70 Ca 0.02 -1.15 -0.00 0.00 0.02 0.00 0.00 55.97 54.86 1xxe s LYS 70 Cb -0.04 -2.20 0.00 0.00 -0.52 0.00 0.00 37.83 35.07 1xxe s LYS 70 CO -0.00 0.48 0.67 2.41 -0.92 0.00 0.00 175.35 177.99 1xxe n THR 71 N 0.52 -8.38 0.29 2.17 -1.04 0.03 -2.05 114.28 105.82 1xxe n THR 71 Ca -0.13 -0.16 0.03 0.00 -2.04 0.00 0.00 64.05 61.75 1xxe n THR 71 Cb 0.53 -5.88 -0.02 0.00 -1.82 0.00 0.00 70.33 63.14 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 -1.96 0.00 0.30 12.58 0.24 -1.25 -4.19 118.33 124.04 1xxe n VAL 72 Ca -0.08 -0.38 0.17 0.00 -2.04 0.00 0.00 64.34 62.00 1xxe n VAL 72 Cb 0.55 1.03 0.69 0.00 -1.47 0.00 0.00 33.84 34.64 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 0.26 0.00 0.29 7.34 -0.00 -1.85 -2.51 114.58 118.11 1xxe h GLU 73 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 59.35 1xxe h GLU 73 Cb 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.92 1xxe h GLU 73 CO 0.00 0.00 -0.14 0.45 -0.00 0.00 0.00 179.01 179.32 1xxe h HIS 74 N 0.00 -0.37 -0.78 2.06 3.86 -1.91 -1.37 115.15 116.64 1xxe h HIS 74 Ca 0.00 -0.01 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 1xxe h HIS 74 Cb 0.45 0.12 -0.05 0.00 1.06 0.00 0.00 27.41 29.00 1xxe h HIS 74 CO 0.00 -0.15 0.50 0.97 0.86 0.00 0.00 177.93 180.10 1xxe h ILE 75 N -1.07 1.11 -0.79 2.45 6.09 -1.87 -0.86 117.51 122.57 1xxe h ILE 75 Ca -0.04 -0.33 0.04 0.00 -1.37 0.00 0.00 64.86 63.16 1xxe h ILE 75 Cb 0.38 0.06 -0.05 0.00 0.47 0.00 0.00 36.82 37.69 1xxe h ILE 75 CO 0.07 0.18 0.52 -0.07 -3.07 0.00 0.00 178.15 175.77 1xxe h LEU 76 N 0.96 0.83 -0.17 2.19 3.38 -1.51 -1.88 115.31 119.11 1xxe h LEU 76 Ca 0.32 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1xxe h LEU 76 Cb 0.03 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1xxe h LEU 76 CO -0.12 0.57 0.11 -1.28 0.09 0.00 0.00 178.44 177.82 1xxe h SER 77 N 0.97 0.19 0.28 -0.43 0.87 0.02 0.22 113.55 115.67 1xxe h SER 77 Ca 0.32 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.87 1xxe h SER 77 Cb 0.06 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 1xxe h SER 77 CO -0.09 0.14 -0.22 0.58 -0.53 0.00 0.00 176.83 176.70 1xxe h VAL 78 N 0.23 0.52 -0.68 2.23 2.07 -1.06 -1.07 116.25 118.49 1xxe h VAL 78 Ca 0.06 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.71 1xxe h VAL 78 Cb -0.02 0.52 -0.09 0.00 -1.52 0.00 0.00 31.29 30.18 1xxe h VAL 78 CO -0.02 0.00 0.22 -0.07 0.02 0.00 0.00 177.57 177.72 1xxe h LEU 79 N -0.51 0.16 -0.11 2.57 3.38 -1.08 0.10 115.31 119.82 1xxe h LEU 79 Ca -0.02 0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.10 1xxe h LEU 79 Cb 0.45 0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 1xxe h LEU 79 CO -0.02 0.06 -0.15 -0.74 0.09 0.00 0.00 178.44 177.69 1xxe h HIS 80 N 0.36 -0.38 -0.58 1.13 2.76 0.16 0.27 115.15 118.88 1xxe h HIS 80 Ca 0.37 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.49 1xxe h HIS 80 Cb 0.55 0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.67 1xxe h HIS 80 CO -0.20 -0.22 0.07 -0.07 -1.30 0.00 0.00 177.93 176.22 1xxe h LEU 81 N -0.19 0.90 0.00 0.26 3.38 -0.10 -2.25 115.31 117.31 1xxe h LEU 81 Ca 0.09 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1xxe h LEU 81 Cb 0.32 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1xxe h LEU 81 CO -0.22 0.92 0.00 0.18 0.09 0.00 0.00 178.44 179.40 1xxe n LEU 82 N -4.22 0.00 -3.17 1.67 4.77 0.26 -4.93 117.00 111.37 1xxe n LEU 82 Ca 0.04 0.06 -0.10 0.00 -0.03 0.00 0.00 56.01 55.97 1xxe n LEU 82 Cb 0.28 -0.06 0.05 0.00 -2.33 0.00 0.00 43.42 41.36 1xxe n LEU 82 CO 0.42 -0.00 0.14 -0.62 -1.33 0.00 0.00 177.39 176.00 1xxe n GLU 83 N -1.06 -1.91 -4.04 3.23 1.02 0.03 -4.99 120.64 112.92 1xxe n GLU 83 Ca 0.22 1.08 -0.35 0.00 -0.02 0.00 0.00 57.16 58.09 1xxe n GLU 83 Cb 0.13 -5.79 -0.11 0.00 -0.02 0.00 0.00 31.44 25.66 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 -3.25 4.47 -0.01 -3.67 -1.09 -0.90 -4.04 121.20 112.70 1xxe s ILE 84 Ca 0.30 -0.14 0.05 0.00 -2.23 0.00 0.00 60.65 58.63 1xxe s ILE 84 Cb -0.04 -3.02 -0.08 0.00 -1.58 0.00 0.00 42.46 37.74 1xxe s ILE 84 CO 0.74 0.44 0.11 0.35 -1.23 0.00 0.00 174.94 175.34 1xxe n THR 85 N 3.86 0.04 -3.88 2.92 -2.24 -1.00 -4.85 114.28 109.13 1xxe n THR 85 Ca -0.17 -0.13 -0.29 0.00 -2.27 0.00 0.00 64.05 61.19 1xxe n THR 85 Cb 0.52 0.23 -0.16 0.00 -2.10 0.00 0.00 70.33 68.82 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 -2.74 3.33 -0.28 3.42 0.01 -1.23 0.09 114.94 117.54 1xxe s ASN 86 Ca -0.02 -0.94 -0.24 0.00 -0.71 0.00 0.00 52.86 50.95 1xxe s ASN 86 Cb 0.03 -0.96 0.10 0.00 0.41 0.00 0.00 41.25 40.83 1xxe s ASN 86 CO 0.22 -0.24 0.88 0.68 -1.51 0.00 0.00 177.10 177.13 1xxe s VAL 87 N 1.57 0.00 -0.45 1.60 -7.23 -0.95 -3.99 120.40 110.96 1xxe s VAL 87 Ca -0.03 0.00 -0.06 0.00 -1.81 0.00 0.00 61.98 60.09 1xxe s VAL 87 Cb -0.17 -1.00 0.12 0.00 0.56 0.00 0.00 36.38 35.88 1xxe s VAL 87 CO -0.07 0.00 0.28 -0.89 -0.31 0.00 0.00 175.10 174.11 1xxe s THR 88 N 0.41 3.70 -0.55 5.32 2.01 -0.63 -2.39 115.64 123.50 1xxe s THR 88 Ca 0.01 -1.99 -0.22 0.00 0.31 0.00 0.00 61.69 59.80 1xxe s THR 88 Cb -0.05 -3.49 0.05 0.00 0.01 0.00 0.00 72.50 69.03 1xxe s THR 88 CO -0.04 -0.74 0.84 -0.63 -0.69 0.00 0.00 174.62 173.36 1xxe s ILE 89 N 1.17 4.55 -0.04 1.82 1.01 -0.55 -1.97 121.20 127.19 1xxe s ILE 89 Ca 0.08 -0.06 -0.29 0.00 0.00 0.00 0.00 60.65 60.37 1xxe s ILE 89 Cb -0.24 -4.47 -0.02 0.00 0.01 0.00 0.00 42.46 37.73 1xxe s ILE 89 CO -0.03 -1.05 0.96 -1.61 0.00 0.00 0.00 174.94 173.21 1xxe s GLU 90 N 3.51 4.50 -0.34 2.79 2.02 0.22 -1.76 118.70 129.63 1xxe s GLU 90 Ca 0.24 1.36 -0.05 0.00 0.02 0.00 0.00 54.97 56.53 1xxe s GLU 90 Cb -0.15 -3.49 0.05 0.00 0.10 0.00 0.00 34.13 30.64 1xxe s GLU 90 CO 0.16 -0.13 0.10 0.08 0.02 0.00 0.00 175.26 175.49 1xxe s VAL 91 N 1.32 3.61 -0.46 2.63 1.01 0.13 -1.05 120.40 127.59 1xxe s VAL 91 Ca 0.49 -1.29 -0.23 0.00 0.00 0.00 0.00 61.98 60.96 1xxe s VAL 91 Cb -0.20 -3.10 0.03 0.00 0.00 0.00 0.00 36.38 33.11 1xxe s VAL 91 CO 0.24 -0.24 0.77 -0.63 0.00 0.00 0.00 175.10 175.24 1xxe s ILE 92 N 1.35 4.67 -1.95 2.22 1.09 0.90 -4.67 121.20 124.81 1xxe s ILE 92 Ca -0.01 0.34 0.00 0.00 -1.10 0.00 0.00 60.65 59.88 1xxe s ILE 92 Cb -0.20 -4.32 0.00 0.00 -1.06 0.00 0.00 42.46 36.88 1xxe s ILE 92 CO 0.01 -0.73 0.00 0.61 -0.10 0.00 0.00 174.94 174.74 1xxe n GLY 93 N 5.01 0.59 0.00 6.18 0.00 -1.26 -2.02 105.19 113.69 1xxe n GLY 93 Ca 0.01 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1xxe n GLY 93 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xxe n ASN 94 N 0.00 0.15 -3.88 1.61 5.03 -1.26 -5.02 115.26 111.90 1xxe n ASN 94 Ca 0.00 -0.53 -0.11 0.00 0.87 0.00 0.00 54.58 54.81 1xxe n ASN 94 Cb 0.00 0.69 -0.10 0.00 -1.02 0.00 0.00 39.78 39.36 1xxe n ASN 94 CO 0.00 0.00 0.00 -1.83 -1.83 0.00 0.00 177.26 173.60 1xxe s GLU 95 N -0.69 0.50 -0.13 3.52 4.04 -1.26 -1.94 118.70 122.75 1xxe s GLU 95 Ca 0.00 -0.46 -0.29 0.00 0.04 0.00 0.00 54.97 54.26 1xxe s GLU 95 Cb 0.00 0.21 -0.02 0.00 0.02 0.00 0.00 34.13 34.34 1xxe s GLU 95 CO 0.00 -0.12 1.21 0.42 -1.84 0.00 0.00 175.26 174.93 1xxe s ILE 96 N -1.59 4.32 0.12 1.83 -1.09 -0.87 -4.75 121.20 119.18 1xxe s ILE 96 Ca -0.13 1.62 -0.34 0.00 -2.23 0.00 0.00 60.65 59.56 1xxe s ILE 96 Cb -0.07 -4.04 -0.17 0.00 -1.58 0.00 0.00 42.46 36.60 1xxe s ILE 96 CO 0.01 -0.08 1.08 -2.65 -1.23 0.00 0.00 174.94 172.07 1xxe n PRO 97 N 5.97 0.73 0.24 2.79 -0.02 -1.26 -4.67 135.00 138.78 1xxe n PRO 97 Ca 0.12 0.26 0.14 0.00 -2.02 0.00 0.00 63.50 62.00 1xxe n PRO 97 Cb 0.46 -1.71 0.35 0.00 -0.02 0.00 0.00 33.50 32.57 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 2.62 0.02 0.00 4.25 6.09 -1.83 -3.48 117.51 125.17 1xxe h ILE 98 Ca -0.44 -0.85 0.00 0.00 -1.37 0.00 0.00 64.86 62.20 1xxe h ILE 98 Cb 1.38 1.84 0.00 0.00 0.47 0.00 0.00 36.82 40.50 1xxe h ILE 98 CO 0.68 0.01 0.00 0.18 -3.07 0.00 0.00 178.15 175.95 1xxe n LEU 99 N -3.10 0.00 -0.16 2.19 4.77 -1.26 -0.81 117.00 118.63 1xxe n LEU 99 Ca 0.03 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.12 1xxe n LEU 99 Cb 0.46 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.69 1xxe n LEU 99 CO 0.32 0.00 0.35 -0.67 -1.33 0.00 0.00 177.39 176.06 1xxe n ASP 100 N 6.63 1.05 0.00 -1.43 -0.08 -1.26 -4.64 116.55 116.81 1xxe n ASP 100 Ca 0.00 -0.84 0.00 0.00 -1.51 0.00 0.00 54.79 52.44 1xxe n ASP 100 Cb 0.00 0.45 0.00 0.00 2.34 0.00 0.00 41.12 43.91 1xxe n ASP 100 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1xxe n GLY 101 N 1.44 1.95 0.67 0.27 0.00 0.01 -4.23 105.19 105.29 1xxe n GLY 101 Ca 0.08 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.05 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 1.44 -0.23 1.61 3.41 -1.26 -2.03 113.62 116.56 1xxe n SER 102 Ca 0.00 -1.34 0.03 0.00 -0.26 0.00 0.00 58.87 57.30 1xxe n SER 102 Cb 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 63.97 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 3.84 -0.54 0.33 5.00 0.00 -0.86 -4.65 105.19 108.32 1xxe n GLY 103 Ca -0.01 -0.20 0.19 0.00 0.00 0.00 0.00 46.02 46.00 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 1.13 0.84 0.21 1.61 2.91 -1.82 0.32 115.95 121.15 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 0.27 -0.22 0.00 0.00 -0.51 0.00 0.00 29.16 28.70 1xxe h TRP 104 CO 0.00 -0.09 -0.10 0.93 -1.03 0.00 0.00 178.44 178.15 1xxe h GLU 105 N 0.40 -0.28 -0.45 2.65 5.08 -1.90 0.81 114.58 120.89 1xxe h GLU 105 Ca 0.66 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 59.02 1xxe h GLU 105 Cb 1.38 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.68 1xxe h GLU 105 CO -0.56 -0.11 0.19 0.74 -1.00 0.00 0.00 179.01 178.26 1xxe h PHE 106 N -0.38 0.68 -0.59 4.33 0.04 -1.38 -0.40 116.94 119.24 1xxe h PHE 106 Ca -0.03 -0.05 -0.04 0.00 2.80 0.00 0.00 57.97 60.65 1xxe h PHE 106 Cb 0.29 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.21 1xxe h PHE 106 CO -0.04 0.58 0.21 -0.92 -0.60 0.00 0.00 178.31 177.54 1xxe h TYR 107 N 0.59 0.88 -0.05 -0.55 5.03 -0.28 0.17 116.97 122.77 1xxe h TYR 107 Ca 0.15 -0.06 -0.04 0.00 2.58 0.00 0.00 58.73 61.36 1xxe h TYR 107 Cb 0.18 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 38.19 1xxe h TYR 107 CO -0.00 0.70 -0.13 0.93 -1.32 0.00 0.00 178.16 178.34 1xxe h GLU 108 N 0.86 0.17 0.03 1.82 4.39 0.11 -2.05 114.58 119.91 1xxe h GLU 108 Ca 0.20 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.78 1xxe h GLU 108 Cb 0.21 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1xxe h GLU 108 CO -0.01 0.73 -0.01 0.00 -1.16 0.00 0.00 179.01 178.55 1xxe h ALA 109 N 0.44 -0.04 -0.74 3.43 0.00 -1.01 -3.19 119.26 118.15 1xxe h ALA 109 Ca -0.00 -0.34 0.05 0.00 0.00 0.00 0.00 54.91 54.63 1xxe h ALA 109 Cb 0.73 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 1xxe h ALA 109 CO 0.03 -0.15 0.44 0.82 0.00 0.00 0.00 179.25 180.38 1xxe h ILE 110 N -0.78 1.02 -0.66 0.00 2.04 -0.79 -0.20 117.51 118.14 1xxe h ILE 110 Ca -0.00 -0.28 0.16 0.00 1.00 0.00 0.00 64.86 65.73 1xxe h ILE 110 Cb 0.68 0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 1xxe h ILE 110 CO 0.01 0.15 0.46 -0.09 0.00 0.00 0.00 178.15 178.67 1xxe h ARG 111 N 0.82 0.20 -0.00 2.37 2.43 -1.44 0.66 114.38 119.41 1xxe h ARG 111 Ca 0.32 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.48 1xxe h ARG 111 Cb 0.15 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1xxe h ARG 111 CO -0.16 0.14 -0.01 1.17 -1.51 0.00 0.00 179.97 179.59 1xxe n LYS 112 N -4.42 1.10 -1.58 0.20 4.81 -0.10 -3.77 118.16 114.39 1xxe n LYS 112 Ca 0.13 -0.27 0.00 0.00 -0.87 0.00 0.00 58.31 57.30 1xxe n LYS 112 Cb 0.59 -1.49 0.08 0.00 0.02 0.00 0.00 35.03 34.22 1xxe n LYS 112 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1xxe n ASN 113 N -0.72 1.83 -4.86 3.14 2.85 0.23 -5.01 115.26 112.71 1xxe n ASN 113 Ca 0.21 -2.76 -0.35 0.00 -0.11 0.00 0.00 54.58 51.57 1xxe n ASN 113 Cb 0.20 -0.40 -0.06 0.00 1.24 0.00 0.00 39.78 40.76 1xxe n ASN 113 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1xxe s ILE 114 N -2.24 5.09 0.16 -1.44 1.01 -1.00 0.41 121.20 123.20 1xxe s ILE 114 Ca 0.36 0.50 0.04 0.00 0.00 0.00 0.00 60.65 61.55 1xxe s ILE 114 Cb 0.37 -3.65 -0.05 0.00 0.01 0.00 0.00 42.46 39.15 1xxe s ILE 114 CO -0.09 0.32 -0.07 -0.22 0.00 0.00 0.00 174.94 174.88 1xxe s LEU 115 N -1.81 2.42 0.03 2.97 2.96 0.43 -4.47 118.68 121.21 1xxe s LEU 115 Ca 0.32 -1.07 0.03 0.00 -0.22 0.00 0.00 54.13 53.18 1xxe s LEU 115 Cb -0.14 -0.29 -0.04 0.00 0.50 0.00 0.00 46.19 46.22 1xxe s LEU 115 CO 0.17 -0.40 -0.01 0.21 -1.32 0.00 0.00 176.35 175.00 1xxe s ASN 116 N -3.19 5.01 0.00 3.68 3.04 -1.26 -0.95 114.94 121.27 1xxe s ASN 116 Ca 0.20 -0.08 0.00 0.00 0.04 0.00 0.00 52.86 53.01 1xxe s ASN 116 Cb 0.04 -1.25 0.00 0.00 -1.54 0.00 0.00 41.25 38.50 1xxe s ASN 116 CO 0.02 0.25 0.00 0.00 -3.04 0.00 0.00 177.10 174.33 1xxe n GLN 117 N 1.16 2.77 0.00 0.43 6.02 0.17 -4.85 117.38 123.09 1xxe n GLN 117 Ca -0.13 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 56.87 1xxe n GLN 117 Cb 0.52 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.80 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 -0.60 1.30 -4.87 1.08 2.85 -1.26 -4.57 115.26 109.18 1xxe n ASN 118 Ca 0.00 -1.15 -0.33 0.00 -0.11 0.00 0.00 54.58 52.99 1xxe n ASN 118 Cb 0.00 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 40.97 1xxe n ASN 118 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 1xxe s ARG 119 N -0.30 3.76 -0.02 1.20 3.52 -1.26 -4.87 118.95 120.98 1xxe s ARG 119 Ca 0.04 0.17 -0.26 0.00 -0.13 0.00 0.00 55.73 55.55 1xxe s ARG 119 Cb 0.03 -2.87 -0.04 0.00 -1.56 0.00 0.00 34.95 30.51 1xxe s ARG 119 CO 0.04 0.47 0.80 -2.00 -0.81 0.00 0.00 175.30 173.81 1xxe s GLU 120 N -2.32 4.49 0.33 5.12 2.12 -1.26 0.22 118.70 127.40 1xxe s GLU 120 Ca 0.39 1.09 -0.28 0.00 0.36 0.00 0.00 54.97 56.53 1xxe s GLU 120 Cb -0.13 -3.43 -0.09 0.00 0.26 0.00 0.00 34.13 30.73 1xxe s GLU 120 CO 0.21 0.08 1.16 0.42 -0.54 0.00 0.00 175.26 176.59 1xxe s ILE 121 N 0.67 3.23 -0.50 -3.70 1.01 -1.26 -4.76 121.20 115.90 1xxe s ILE 121 Ca 0.42 1.18 -0.17 0.00 0.00 0.00 0.00 60.65 62.08 1xxe s ILE 121 Cb -0.19 -3.72 0.07 0.00 0.01 0.00 0.00 42.46 38.63 1xxe s ILE 121 CO 0.22 0.23 0.53 -0.62 0.00 0.00 0.00 174.94 175.30 1xxe s ASP 122 N -0.88 6.19 0.38 3.58 -1.08 -1.26 -5.03 116.67 118.57 1xxe s ASP 122 Ca 0.49 -1.21 -0.24 0.00 -0.52 0.00 0.00 52.55 51.08 1xxe s ASP 122 Cb -0.33 -2.24 -0.10 0.00 -1.46 0.00 0.00 42.92 38.79 1xxe s ASP 122 CO 0.43 -0.81 0.98 -0.31 0.52 0.00 0.00 175.17 175.97 1xxe s TYR 123 N 2.14 3.44 -0.23 -5.34 1.51 -1.26 -4.66 117.35 112.95 1xxe s TYR 123 Ca 0.09 1.69 -0.18 0.00 -1.01 0.00 0.00 57.07 57.66 1xxe s TYR 123 Cb -0.23 -2.96 -0.03 0.00 -0.11 0.00 0.00 41.96 38.64 1xxe s TYR 123 CO 0.08 -0.14 0.53 0.12 -1.11 0.00 0.00 175.55 175.03 1xxe s PHE 124 N -1.81 3.32 -0.04 2.71 2.19 -0.05 -4.97 117.98 119.33 1xxe s PHE 124 Ca 0.56 0.71 0.06 0.00 0.33 0.00 0.00 56.93 58.60 1xxe s PHE 124 Cb -0.16 -2.71 -0.01 0.00 -1.31 0.00 0.00 43.02 38.83 1xxe s PHE 124 CO 0.21 -0.20 -0.24 0.08 1.83 0.00 0.00 175.22 176.90 1xxe s VAL 125 N 2.02 1.97 0.15 3.12 1.01 -1.26 0.69 120.40 128.09 1xxe s VAL 125 Ca 0.23 -1.03 -0.29 0.00 0.00 0.00 0.00 61.98 60.89 1xxe s VAL 125 Cb -0.15 -1.66 -0.07 0.00 0.00 0.00 0.00 36.38 34.50 1xxe s VAL 125 CO 0.09 0.55 0.91 -0.69 0.00 0.00 0.00 175.10 175.96 1xxe s VAL 126 N -0.28 4.39 -0.16 2.92 1.01 -0.79 -4.93 120.40 122.56 1xxe s VAL 126 Ca 0.01 1.98 0.04 0.00 0.00 0.00 0.00 61.98 64.01 1xxe s VAL 126 Cb -0.12 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 31.93 1xxe s VAL 126 CO 0.02 0.40 0.15 -0.62 0.00 0.00 0.00 175.10 175.05 1xxe n GLU 127 N 2.28 5.06 -3.87 2.72 -0.58 -1.26 -4.30 120.64 120.69 1xxe n GLU 127 Ca -0.00 -0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.62 1xxe n GLU 127 Cb 0.49 -0.73 -0.12 0.00 -0.57 0.00 0.00 31.44 30.50 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 -1.47 0.17 0.57 3.49 -1.05 -1.26 -4.83 118.70 114.32 1xxe s GLU 128 Ca 0.01 -0.07 -0.17 0.00 -0.15 0.00 0.00 54.97 54.58 1xxe s GLU 128 Cb 0.03 0.07 -0.05 0.00 -0.44 0.00 0.00 34.13 33.74 1xxe s GLU 128 CO 0.16 -0.03 1.07 -1.25 0.95 0.00 0.00 175.26 176.16 1xxe s PRO 129 N -0.38 3.36 -0.07 -4.83 0.04 -1.26 -4.63 135.00 127.25 1xxe s PRO 129 Ca -0.04 1.35 -0.08 0.00 0.04 0.00 0.00 61.00 62.27 1xxe s PRO 129 Cb -0.03 -2.03 0.02 0.00 0.04 0.00 0.00 34.50 32.50 1xxe s PRO 129 CO 0.00 -0.79 0.21 -1.50 0.04 0.00 0.00 177.00 174.96 1xxe s ILE 130 N -2.18 0.01 -0.10 0.56 2.07 -0.86 -4.95 121.20 115.75 1xxe s ILE 130 Ca 0.67 -0.11 0.01 0.00 -1.41 0.00 0.00 60.65 59.81 1xxe s ILE 130 Cb -0.18 -0.33 0.02 0.00 0.13 0.00 0.00 42.46 42.09 1xxe s ILE 130 CO 0.31 -0.06 -0.10 -0.63 -1.91 0.00 0.00 174.94 172.55 1xxe s ILE 131 N -0.14 1.17 -0.22 2.00 1.09 -1.26 -0.69 121.20 123.15 1xxe s ILE 131 Ca -0.02 -0.41 0.01 0.00 -1.10 0.00 0.00 60.65 59.12 1xxe s ILE 131 Cb -0.02 -1.13 0.03 0.00 -1.06 0.00 0.00 42.46 40.28 1xxe s ILE 131 CO 0.01 0.38 -0.14 0.68 -0.10 0.00 0.00 174.94 175.77 1xxe s VAL 132 N 1.33 2.35 -0.07 2.92 -7.23 -0.44 -4.98 120.40 114.29 1xxe s VAL 132 Ca -0.01 -1.09 -0.00 0.00 -1.81 0.00 0.00 61.98 59.07 1xxe s VAL 132 Cb -0.14 -2.13 -0.03 0.00 0.56 0.00 0.00 36.38 34.64 1xxe s VAL 132 CO -0.05 0.33 -0.04 -0.70 -0.31 0.00 0.00 175.10 174.33 1xxe s GLU 133 N 1.27 2.85 -0.29 4.82 2.12 -1.26 -1.63 118.70 126.57 1xxe s GLU 133 Ca 0.01 -0.49 -0.15 0.00 0.36 0.00 0.00 54.97 54.71 1xxe s GLU 133 Cb -0.15 -2.68 0.12 0.00 0.26 0.00 0.00 34.13 31.68 1xxe s GLU 133 CO -0.09 0.68 0.82 0.34 -0.54 0.00 0.00 175.26 176.47 1xxe s ASP 134 N -0.86 -0.79 -1.52 -1.70 -1.08 -0.34 -4.97 116.67 105.41 1xxe s ASP 134 Ca 0.13 1.20 -0.13 0.00 -0.52 0.00 0.00 52.55 53.23 1xxe s ASP 134 Cb -0.11 1.55 0.09 0.00 -1.46 0.00 0.00 42.92 42.99 1xxe s ASP 134 CO 0.02 -0.18 0.89 -0.62 0.52 0.00 0.00 175.17 175.80 1xxe n GLU 135 N 4.45 -5.09 -0.99 4.34 1.02 -1.26 -0.41 120.64 122.69 1xxe n GLU 135 Ca -0.16 0.59 0.00 0.00 -0.02 0.00 0.00 57.16 57.56 1xxe n GLU 135 Cb 0.56 -5.45 0.00 0.00 -0.02 0.00 0.00 31.44 26.53 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 -1.60 0.72 3.83 0.62 0.00 -1.26 -5.02 105.19 102.48 1xxe n GLY 136 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.04 2.69 -0.02 1.61 0.52 0.45 -4.91 118.95 119.25 1xxe s ARG 137 Ca 0.00 -1.30 -0.30 0.00 -0.52 0.00 0.00 55.73 53.61 1xxe s ARG 137 Cb 0.00 -2.44 0.07 0.00 0.52 0.00 0.00 34.95 33.10 1xxe s ARG 137 CO 0.00 0.15 0.66 -1.17 0.02 0.00 0.00 175.30 174.96 1xxe s LEU 138 N -3.95 -0.61 -0.11 2.53 0.20 -0.93 -1.20 118.68 114.61 1xxe s LEU 138 Ca 0.39 0.62 -0.06 0.00 0.69 0.00 0.00 54.13 55.77 1xxe s LEU 138 Cb -0.06 2.52 0.05 0.00 -0.43 0.00 0.00 46.19 48.27 1xxe s LEU 138 CO 0.26 -0.65 0.26 -0.63 -0.29 0.00 0.00 176.35 175.30 1xxe s ILE 139 N -1.50 -0.04 -0.01 6.68 1.01 -0.65 -0.99 121.20 125.70 1xxe s ILE 139 Ca -0.10 0.13 0.07 0.00 0.00 0.00 0.00 60.65 60.76 1xxe s ILE 139 Cb -0.00 -0.40 -0.02 0.00 0.01 0.00 0.00 42.46 42.05 1xxe s ILE 139 CO 0.07 0.05 -0.22 -0.75 0.00 0.00 0.00 174.94 174.09 1xxe s LYS 140 N 1.19 1.80 0.09 2.79 2.20 -0.40 -1.32 119.74 126.08 1xxe s LYS 140 Ca -0.09 -0.81 0.09 0.00 -0.36 0.00 0.00 55.97 54.80 1xxe s LYS 140 Cb -0.10 -1.75 -0.04 0.00 -1.51 0.00 0.00 37.83 34.44 1xxe s LYS 140 CO -0.08 0.48 -0.20 0.00 -0.36 0.00 0.00 175.35 175.19 1xxe s ALA 141 N -0.54 2.59 -0.09 3.13 0.00 0.13 -0.67 121.76 126.31 1xxe s ALA 141 Ca 0.09 -1.32 -0.07 0.00 0.00 0.00 0.00 51.96 50.66 1xxe s ALA 141 Cb -0.09 -0.63 0.03 0.00 0.00 0.00 0.00 23.12 22.43 1xxe s ALA 141 CO -0.01 0.58 0.23 -2.00 0.00 0.00 0.00 175.76 174.56 1xxe s GLU 142 N -1.86 0.24 0.46 0.00 2.56 0.33 -2.03 118.70 118.40 1xxe s GLU 142 Ca 0.16 0.37 -0.24 0.00 0.00 0.00 0.00 54.97 55.26 1xxe s GLU 142 Cb -0.10 0.05 -0.09 0.00 2.00 0.00 0.00 34.13 35.99 1xxe s GLU 142 CO 0.08 -0.07 1.13 -0.35 -0.56 0.00 0.00 175.26 175.49 1xxe n PRO 143 N 3.34 1.53 -3.56 4.30 -0.04 -1.26 0.20 135.00 139.51 1xxe n PRO 143 Ca -0.16 0.55 -0.15 0.00 -0.04 0.00 0.00 63.50 63.70 1xxe n PRO 143 Cb 0.57 -2.24 -0.06 0.00 -0.04 0.00 0.00 33.50 31.73 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 -0.75 -0.57 0.00 3.54 0.15 -1.26 -4.40 113.70 110.40 1xxe s SER 144 Ca 0.65 0.72 0.31 0.00 0.70 0.00 0.00 55.95 58.34 1xxe s SER 144 Cb -0.50 0.60 1.75 0.00 -1.71 0.00 0.00 66.02 66.16 1xxe s SER 144 CO 0.55 -0.46 2.15 -0.67 1.20 0.00 0.00 173.24 176.01 1xxe n ASP 145 N 1.15 0.05 -4.06 5.45 2.03 -1.26 -3.71 116.55 116.20 1xxe n ASP 145 Ca -0.15 -0.73 -0.13 0.00 0.52 0.00 0.00 54.79 54.30 1xxe n ASP 145 Cb 0.57 -0.09 -0.11 0.00 -0.72 0.00 0.00 41.12 40.76 1xxe n ASP 145 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1xxe s THR 146 N -2.20 0.50 -0.30 5.18 -4.23 -1.26 -4.93 115.64 108.41 1xxe s THR 146 Ca 0.41 -1.08 -0.27 0.00 -1.18 0.00 0.00 61.69 59.56 1xxe s THR 146 Cb 0.21 -0.60 0.01 0.00 1.34 0.00 0.00 72.50 73.46 1xxe s THR 146 CO 0.40 -0.40 0.97 -0.22 -0.54 0.00 0.00 174.62 174.83 1xxe s LEU 147 N -1.60 4.01 -0.01 4.79 2.96 -1.26 -2.93 118.68 124.64 1xxe s LEU 147 Ca -0.10 0.99 0.01 0.00 -0.22 0.00 0.00 54.13 54.81 1xxe s LEU 147 Cb -0.10 -3.39 0.00 0.00 0.50 0.00 0.00 46.19 43.21 1xxe s LEU 147 CO 0.00 -0.75 -0.04 -0.70 -1.32 0.00 0.00 176.35 173.54 1xxe s GLU 148 N 3.33 0.43 -0.05 1.98 2.12 -0.64 -2.97 118.70 122.90 1xxe s GLU 148 Ca 0.41 -0.13 -0.01 0.00 0.36 0.00 0.00 54.97 55.60 1xxe s GLU 148 Cb -0.13 -0.45 0.03 0.00 0.26 0.00 0.00 34.13 33.84 1xxe s GLU 148 CO 0.12 0.05 0.01 0.08 -0.54 0.00 0.00 175.26 174.99 1xxe s VAL 149 N 0.15 0.24 -0.12 3.70 1.01 -0.88 -0.74 120.40 123.76 1xxe s VAL 149 Ca -0.01 0.15 -0.01 0.00 0.00 0.00 0.00 61.98 62.10 1xxe s VAL 149 Cb -0.05 -0.39 -0.02 0.00 0.00 0.00 0.00 36.38 35.92 1xxe s VAL 149 CO -0.00 0.21 -0.08 -0.89 0.00 0.00 0.00 175.10 174.34 1xxe s THR 150 N 1.64 3.55 -0.12 3.92 2.01 -0.02 -0.84 115.64 125.78 1xxe s THR 150 Ca -0.01 -0.50 0.02 0.00 0.31 0.00 0.00 61.69 61.51 1xxe s THR 150 Cb -0.13 -2.51 -0.01 0.00 0.01 0.00 0.00 72.50 69.87 1xxe s THR 150 CO -0.03 0.53 -0.18 -0.47 -0.69 0.00 0.00 174.62 173.78 1xxe s TYR 151 N 0.04 2.71 -0.28 4.92 5.04 -0.96 -0.36 117.35 128.47 1xxe s TYR 151 Ca -0.02 -0.89 -0.01 0.00 -2.44 0.00 0.00 57.07 53.71 1xxe s TYR 151 Cb -0.14 -1.80 0.04 0.00 0.35 0.00 0.00 41.96 40.41 1xxe s TYR 151 CO 0.03 -0.35 -0.03 -2.00 -1.34 0.00 0.00 175.55 171.87 1xxe s GLU 152 N 0.44 2.54 0.20 4.97 2.12 0.11 -1.97 118.70 127.12 1xxe s GLU 152 Ca -0.13 -1.18 0.06 0.00 0.36 0.00 0.00 54.97 54.08 1xxe s GLU 152 Cb -0.17 -3.10 -0.04 0.00 0.26 0.00 0.00 34.13 31.09 1xxe s GLU 152 CO 0.06 -0.55 0.12 0.20 -0.54 0.00 0.00 175.26 174.55 1xxe s GLY 153 N 1.26 1.61 -0.33 -1.50 0.00 -0.43 -0.98 107.32 106.96 1xxe s GLY 153 Ca -0.04 -1.34 -0.02 0.00 0.00 0.00 0.00 44.72 43.33 1xxe s GLY 153 CO -0.02 -1.36 0.17 -0.54 0.00 0.00 0.00 173.10 171.34 1xxe s GLU 154 N -3.36 0.47 0.13 2.90 2.02 -1.26 -2.04 118.70 117.56 1xxe s GLU 154 Ca 0.31 -1.02 -0.07 0.00 0.02 0.00 0.00 54.97 54.21 1xxe s GLU 154 Cb -0.09 -1.39 -0.06 0.00 0.10 0.00 0.00 34.13 32.69 1xxe s GLU 154 CO 0.23 -1.10 0.39 -0.06 0.02 0.00 0.00 175.26 174.74 1xxe s PHE 155 N 1.50 3.51 -2.53 1.61 0.08 0.20 -4.95 117.98 117.40 1xxe s PHE 155 Ca 0.13 0.66 0.27 0.00 0.12 0.00 0.00 56.93 58.11 1xxe s PHE 155 Cb -0.20 -2.07 0.92 0.00 -0.57 0.00 0.00 43.02 41.10 1xxe s PHE 155 CO -0.17 0.45 1.67 1.63 -0.10 0.00 0.00 175.22 178.70 1xxe n LYS 156 N 0.36 1.75 -0.66 0.44 5.02 -1.26 -2.76 118.16 121.05 1xxe n LYS 156 Ca -0.04 -1.10 -0.11 0.00 -2.02 0.00 0.00 58.31 55.04 1xxe n LYS 156 Cb 0.52 -1.47 0.08 0.00 -0.02 0.00 0.00 35.03 34.14 1xxe n LYS 156 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1xxe n ASN 157 N 0.33 -0.15 0.30 4.39 0.23 -1.26 -4.80 115.26 114.29 1xxe n ASN 157 Ca 0.18 -1.12 0.14 0.00 -0.53 0.00 0.00 54.58 53.25 1xxe n ASN 157 Cb 0.38 -0.37 0.72 0.00 -2.08 0.00 0.00 39.78 38.43 1xxe n ASN 157 CO 0.00 0.00 0.00 2.19 -0.93 0.00 0.00 177.26 178.52 1xxe h PHE 158 N -1.37 0.00 0.56 -2.53 -0.00 -1.60 -2.42 116.94 109.58 1xxe h PHE 158 Ca -0.16 0.00 -0.03 0.00 -0.00 0.00 0.00 57.97 57.79 1xxe h PHE 158 Cb 0.44 0.00 0.01 0.00 -0.00 0.00 0.00 35.95 36.39 1xxe h PHE 158 CO 0.00 0.00 -0.27 -0.07 -0.00 0.00 0.00 178.31 177.97 1xxe h LEU 159 N 0.00 -0.63 0.00 2.10 3.38 -1.87 -3.48 115.31 114.80 1xxe h LEU 159 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1xxe h LEU 159 Cb 0.64 0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1xxe h LEU 159 CO 0.00 -0.35 0.00 0.61 0.09 0.00 0.00 178.44 178.79 1xxe n GLY 160 N -0.60 1.01 3.60 0.83 0.00 -0.91 -4.88 105.19 104.23 1xxe n GLY 160 Ca -0.09 -1.13 -0.34 0.00 0.00 0.00 0.00 46.02 44.45 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 2.85 -0.02 1.61 0.52 -1.26 0.62 118.95 123.27 1xxe s ARG 161 Ca 0.00 -0.52 -0.20 0.00 -0.52 0.00 0.00 55.73 54.50 1xxe s ARG 161 Cb 0.00 -2.65 0.04 0.00 0.52 0.00 0.00 34.95 32.86 1xxe s ARG 161 CO 0.00 0.65 0.42 -0.65 0.02 0.00 0.00 175.30 175.74 1xxe s GLN 162 N -0.75 0.80 0.04 3.54 -0.21 -0.86 -5.00 119.66 117.22 1xxe s GLN 162 Ca 0.11 -0.09 0.01 0.00 0.02 0.00 0.00 55.36 55.41 1xxe s GLN 162 Cb -0.11 0.36 -0.03 0.00 1.00 0.00 0.00 33.01 34.23 1xxe s GLN 162 CO 0.02 -0.24 -0.05 -1.59 -2.12 0.00 0.00 175.29 171.31 1xxe s LYS 163 N -1.40 0.48 -0.05 2.91 -2.85 -1.26 -1.31 119.74 116.25 1xxe s LYS 163 Ca -0.12 -0.83 -0.00 0.00 -1.00 0.00 0.00 55.97 54.02 1xxe s LYS 163 Cb -0.03 -0.03 0.03 0.00 -2.06 0.00 0.00 37.83 35.74 1xxe s LYS 163 CO 0.05 -0.03 -0.00 0.12 0.10 0.00 0.00 175.35 175.59 1xxe s PHE 164 N -2.06 0.51 -0.25 1.78 5.36 -0.83 -4.99 117.98 117.49 1xxe s PHE 164 Ca -0.08 -0.07 -0.12 0.00 -0.96 0.00 0.00 56.93 55.70 1xxe s PHE 164 Cb -0.05 -0.62 -0.05 0.00 -0.34 0.00 0.00 43.02 41.96 1xxe s PHE 164 CO -0.02 -0.23 0.25 -0.08 -1.46 0.00 0.00 175.22 173.68 1xxe s THR 165 N 1.51 5.28 -0.10 0.12 -1.32 -1.26 -2.27 115.64 117.60 1xxe s THR 165 Ca -0.03 0.33 -0.11 0.00 -1.21 0.00 0.00 61.69 60.68 1xxe s THR 165 Cb -0.13 -3.58 -0.05 0.00 -1.51 0.00 0.00 72.50 67.23 1xxe s THR 165 CO -0.03 0.26 0.24 0.12 -2.21 0.00 0.00 174.62 173.00 1xxe s PHE 166 N 1.54 3.59 0.06 9.09 5.36 -0.02 -4.98 117.98 132.63 1xxe s PHE 166 Ca 0.10 0.65 0.04 0.00 -0.96 0.00 0.00 56.93 56.76 1xxe s PHE 166 Cb -0.15 -2.13 -0.03 0.00 -0.34 0.00 0.00 43.02 40.38 1xxe s PHE 166 CO 0.08 0.58 -0.11 0.08 -1.46 0.00 0.00 175.22 174.39 1xxe s VAL 167 N -0.64 0.84 -0.01 3.12 1.01 -1.26 -2.07 120.40 121.38 1xxe s VAL 167 Ca 0.17 -1.22 -0.33 0.00 0.00 0.00 0.00 61.98 60.60 1xxe s VAL 167 Cb -0.13 -0.87 -0.12 0.00 0.00 0.00 0.00 36.38 35.26 1xxe s VAL 167 CO 0.06 -0.31 1.83 -0.62 0.00 0.00 0.00 175.10 176.06 1xxe n GLU 168 N 1.33 2.31 0.00 2.72 1.02 -1.16 -1.68 120.64 125.19 1xxe n GLU 168 Ca -0.22 0.84 0.00 0.00 -0.02 0.00 0.00 57.16 57.77 1xxe n GLU 168 Cb 0.54 -2.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.27 1xxe n GLU 168 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xxe n GLY 169 N 4.23 2.33 1.65 0.62 0.00 -1.26 -4.94 105.19 107.82 1xxe n GLY 169 Ca 0.21 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.06 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 4.24 0.13 1.61 4.13 -0.67 -4.73 115.26 119.96 1xxe n ASN 170 Ca 0.00 -3.79 0.01 0.00 1.68 0.00 0.00 54.58 52.48 1xxe n ASN 170 Cb 0.00 -0.51 0.34 0.00 -1.54 0.00 0.00 39.78 38.07 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 1.73 0.17 0.00 3.52 5.08 -1.92 -2.60 114.58 120.55 1xxe h GLU 171 Ca 0.31 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1xxe h GLU 171 Cb 1.39 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1xxe h GLU 171 CO 0.66 0.43 0.10 0.39 -1.00 0.00 0.00 179.01 179.59 1xxe n GLU 172 N -4.16 0.10 0.00 2.33 -0.58 -1.26 -0.45 120.64 116.62 1xxe n GLU 172 Ca -0.01 0.59 0.13 0.00 -0.42 0.00 0.00 57.16 57.44 1xxe n GLU 172 Cb 0.36 -1.94 0.41 0.00 -0.57 0.00 0.00 31.44 29.70 1xxe n GLU 172 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1xxe n GLU 173 N -2.07 1.03 -0.01 3.49 1.02 -0.98 -4.00 120.64 119.13 1xxe n GLU 173 Ca -0.01 -0.61 0.01 0.00 -0.02 0.00 0.00 57.16 56.53 1xxe n GLU 173 Cb 0.12 -1.49 0.01 0.00 -0.02 0.00 0.00 31.44 30.06 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 0.91 -0.08 -3.67 -5.35 0.40 -4.70 119.36 106.42 1xxe n ILE 174 Ca 0.14 -0.94 -0.09 0.00 -0.27 0.00 0.00 62.75 61.59 1xxe n ILE 174 Cb 0.35 0.52 -0.12 0.00 -1.74 0.00 0.00 39.64 38.66 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 -0.49 1.06 1.61 7.28 0.24 -1.19 -4.39 118.33 122.46 1xxe n VAL 175 Ca 0.01 -0.61 0.12 0.00 -2.04 0.00 0.00 64.34 61.82 1xxe n VAL 175 Cb 0.31 -0.70 0.56 0.00 -1.47 0.00 0.00 33.84 32.55 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 -2.66 0.95 -4.73 1.34 4.77 -1.26 -2.02 117.00 113.39 1xxe n LEU 176 Ca -0.27 -0.36 -0.41 0.00 -0.03 0.00 0.00 56.01 54.95 1xxe n LEU 176 Cb 0.97 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.99 1xxe n LEU 176 CO 0.30 0.18 0.56 0.00 -1.33 0.00 0.00 177.39 177.10 1xxe s ALA 177 N -1.93 3.29 0.15 -1.18 0.00 -1.26 -4.88 121.76 115.95 1xxe s ALA 177 Ca 0.36 0.40 0.05 0.00 0.00 0.00 0.00 51.96 52.76 1xxe s ALA 177 Cb 0.18 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 20.13 1xxe s ALA 177 CO 0.29 -0.03 0.13 -0.98 0.00 0.00 0.00 175.76 175.18 1xxe s ARG 178 N 0.23 2.92 0.92 0.00 1.70 -1.26 -4.21 118.95 119.26 1xxe s ARG 178 Ca 0.43 -0.83 -0.12 0.00 -0.47 0.00 0.00 55.73 54.75 1xxe s ARG 178 Cb -0.21 -2.67 0.08 0.00 -0.57 0.00 0.00 34.95 31.58 1xxe s ARG 178 CO 0.25 0.50 0.73 -2.37 -1.08 0.00 0.00 175.30 173.34 1xxe n THR 179 N -0.22 0.16 -4.15 4.99 5.66 -0.86 -4.81 114.28 115.05 1xxe n THR 179 Ca -0.08 -0.12 -0.10 0.00 -3.05 0.00 0.00 64.05 60.69 1xxe n THR 179 Cb 0.54 -0.80 -0.10 0.00 -1.55 0.00 0.00 70.33 68.42 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 -2.46 0.89 0.16 1.09 -0.71 -1.26 -2.31 117.98 113.38 1xxe s PHE 180 Ca 0.62 -1.24 -0.14 0.00 -1.04 0.00 0.00 56.93 55.13 1xxe s PHE 180 Cb -0.23 -0.47 0.02 0.00 -1.21 0.00 0.00 43.02 41.13 1xxe s PHE 180 CO 0.63 -0.55 0.41 0.00 -1.34 0.00 0.00 175.22 174.36 1xxe s PHE 182 N -3.88 3.29 0.54 0.00 0.08 -1.26 0.13 117.98 116.87 1xxe s PHE 182 Ca 0.09 0.23 0.27 0.00 0.12 0.00 0.00 56.93 57.64 1xxe s PHE 182 Cb 0.01 -1.76 1.64 0.00 -0.57 0.00 0.00 43.02 42.34 1xxe s PHE 182 CO -0.05 0.55 2.19 0.38 -0.10 0.00 0.00 175.22 178.19 1xxe h ASP 183 N 4.36 0.00 1.29 1.36 2.03 -1.83 -0.72 116.42 122.90 1xxe h ASP 183 Ca -0.50 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 55.70 1xxe h ASP 183 Cb 1.19 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.67 1xxe h ASP 183 CO 0.60 0.04 -0.47 4.11 -1.03 0.00 0.00 179.24 182.50 1xxe h TRP 184 N 0.00 0.00 0.00 4.15 0.09 -1.94 -3.25 115.95 115.00 1xxe h TRP 184 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 1xxe h TRP 184 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.33 1xxe h TRP 184 CO 0.00 0.47 -1.14 -0.85 0.09 0.00 0.00 178.44 177.00 1xxe n GLU 185 N -3.31 0.39 0.09 0.12 0.28 -0.75 -4.47 120.64 112.98 1xxe n GLU 185 Ca 0.01 -0.04 -0.12 0.00 -0.16 0.00 0.00 57.16 56.86 1xxe n GLU 185 Cb 0.67 -1.46 -0.06 0.00 1.43 0.00 0.00 31.44 32.02 1xxe n GLU 185 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 1xxe h ILE 186 N 0.00 0.66 -0.21 3.84 2.04 -1.19 -1.83 117.51 120.82 1xxe h ILE 186 Ca 0.00 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.92 1xxe h ILE 186 Cb 0.57 0.66 -0.07 0.00 -0.74 0.00 0.00 36.82 37.24 1xxe h ILE 186 CO 0.00 0.00 -0.27 -0.33 0.00 0.00 0.00 178.15 177.55 1xxe h GLU 187 N -0.28 -0.28 -0.86 2.37 5.08 -1.78 0.30 114.58 119.13 1xxe h GLU 187 Ca 0.03 0.02 0.14 0.00 -1.00 0.00 0.00 59.36 58.54 1xxe h GLU 187 Cb 0.30 0.06 -0.09 0.00 0.50 0.00 0.00 28.75 29.53 1xxe h GLU 187 CO -0.09 -0.19 0.46 1.25 -1.00 0.00 0.00 179.01 179.44 1xxe h HIS 188 N -0.29 0.81 -0.24 4.33 2.76 -1.76 0.65 115.15 121.41 1xxe h HIS 188 Ca 0.13 0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.25 1xxe h HIS 188 Cb 0.49 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 29.20 1xxe h HIS 188 CO -0.40 0.23 -0.18 0.82 -1.30 0.00 0.00 177.93 177.09 1xxe h ILE 189 N 0.68 1.24 0.00 6.26 2.04 -0.16 -1.76 117.51 125.81 1xxe h ILE 189 Ca 0.45 -1.08 -0.12 0.00 1.00 0.00 0.00 64.86 65.12 1xxe h ILE 189 Cb 0.60 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 1xxe h ILE 189 CO -0.34 0.34 -0.57 0.11 0.00 0.00 0.00 178.15 177.70 1xxe h LYS 190 N 0.38 0.00 0.06 2.37 1.79 0.31 -1.58 116.57 119.90 1xxe h LYS 190 Ca 0.07 0.00 -0.25 0.00 -2.18 0.00 0.00 60.65 58.29 1xxe h LYS 190 Cb 0.54 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.18 1xxe h LYS 190 CO 0.04 0.57 -1.17 0.87 -1.08 0.00 0.00 179.45 178.67 1xxe h LYS 191 N 0.00 0.13 0.00 3.15 1.79 0.52 -3.13 116.57 119.02 1xxe h LYS 191 Ca -0.01 -0.22 0.00 0.00 -2.18 0.00 0.00 60.65 58.24 1xxe h LYS 191 Cb 1.37 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 32.10 1xxe h LYS 191 CO 0.07 1.08 0.00 1.33 -1.08 0.00 0.00 179.45 180.85 1xxe n VAL 192 N -3.42 0.00 -1.08 0.50 0.24 -0.70 -4.78 118.33 109.09 1xxe n VAL 192 Ca -0.05 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.23 1xxe n VAL 192 Cb 0.99 -0.23 -0.01 0.00 -1.47 0.00 0.00 33.84 33.12 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 0.22 0.47 3.50 7.63 0.00 -1.18 -5.04 105.19 110.78 1xxe n GLY 193 Ca 0.03 -1.03 -0.27 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.28 2.71 0.00 0.99 1.43 -0.60 -4.69 118.68 118.24 1xxe s LEU 194 Ca 0.00 -0.74 0.00 0.00 -1.03 0.00 0.00 54.13 52.36 1xxe s LEU 194 Cb 0.00 -1.41 0.00 0.00 0.03 0.00 0.00 46.19 44.81 1xxe s LEU 194 CO 0.00 0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.29 1xxe n GLY 195 N 0.07 0.53 0.26 -3.19 0.00 -1.23 -3.32 105.19 98.32 1xxe n GLY 195 Ca -0.11 -0.86 0.13 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.01 1.61 1.57 -1.14 -2.24 116.57 116.35 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 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1xxe h LYS 196 CO 0.00 0.12 -0.53 0.41 -0.57 0.00 0.00 179.45 178.89 1xxe n GLY 197 N -0.50 -0.16 3.72 3.86 0.00 0.99 -4.63 105.19 108.47 1xxe n GLY 197 Ca -0.01 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 1xxe n GLY 197 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xxe s GLY 198 N -2.38 1.46 0.15 -0.02 0.00 0.46 -4.68 107.32 102.30 1xxe s GLY 198 Ca 0.15 1.50 0.02 0.00 0.00 0.00 0.00 44.72 46.39 1xxe s GLY 198 CO 0.57 2.74 0.08 -1.14 0.00 0.00 0.00 173.10 175.35 1xxe n SER 199 N 3.74 0.46 0.09 1.64 3.41 -1.26 -4.99 113.62 116.71 1xxe n SER 199 Ca 0.14 -1.85 0.12 0.00 -0.26 0.00 0.00 58.87 57.02 1xxe n SER 199 Cb 0.37 0.51 0.09 0.00 -0.26 0.00 0.00 64.21 64.92 1xxe n SER 199 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1xxe h LEU 200 N 0.00 0.00 -0.13 1.04 3.38 -1.94 -0.83 115.31 116.83 1xxe h LEU 200 Ca -0.11 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1xxe h LEU 200 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1xxe h LEU 200 CO 0.17 0.06 -0.39 1.17 0.09 0.00 0.00 178.44 179.53 1xxe n LYS 201 N -2.42 0.24 0.00 1.13 4.81 -1.26 -4.12 118.16 116.54 1xxe n LYS 201 Ca 0.02 -0.13 0.00 0.00 -0.87 0.00 0.00 58.31 57.33 1xxe n LYS 201 Cb 0.49 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.05 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 -1.27 1.26 -3.97 3.14 4.13 -1.24 -4.73 115.26 112.58 1xxe n ASN 202 Ca 0.08 -0.18 -0.30 0.00 1.68 0.00 0.00 54.58 55.86 1xxe n ASN 202 Cb 0.34 0.60 -0.16 0.00 -1.54 0.00 0.00 39.78 39.02 1xxe n ASN 202 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1xxe s THR 203 N -0.85 1.52 -0.44 3.41 2.01 -0.32 -3.87 115.64 117.09 1xxe s THR 203 Ca 0.00 -0.90 -0.29 0.00 0.31 0.00 0.00 61.69 60.81 1xxe s THR 203 Cb 0.00 -1.61 0.02 0.00 0.01 0.00 0.00 72.50 70.92 1xxe s THR 203 CO 0.00 0.17 1.30 -0.22 -0.69 0.00 0.00 174.62 175.18 1xxe s LEU 204 N 1.45 3.60 -0.22 4.42 2.96 -0.98 -4.41 118.68 125.51 1xxe s LEU 204 Ca -0.01 0.66 -0.13 0.00 -0.22 0.00 0.00 54.13 54.44 1xxe s LEU 204 Cb -0.16 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.95 1xxe s LEU 204 CO -0.08 -1.37 0.25 -0.69 -1.32 0.00 0.00 176.35 173.15 1xxe s VAL 205 N 5.04 5.30 -0.04 1.68 1.01 -1.26 -0.11 120.40 132.02 1xxe s VAL 205 Ca 0.56 0.40 -0.06 0.00 0.00 0.00 0.00 61.98 62.88 1xxe s VAL 205 Cb -0.11 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 1xxe s VAL 205 CO 0.32 0.32 0.20 -0.76 0.00 0.00 0.00 175.10 175.18 1xxe s LEU 206 N 1.05 4.38 -0.02 3.92 1.43 0.12 -2.57 118.68 126.99 1xxe s LEU 206 Ca 0.12 0.47 -0.01 0.00 -1.03 0.00 0.00 54.13 53.69 1xxe s LEU 206 Cb -0.14 -2.43 -0.04 0.00 0.03 0.00 0.00 46.19 43.62 1xxe s LEU 206 CO 0.05 0.32 0.07 -0.83 0.23 0.00 0.00 176.35 176.19 1xxe s GLY 207 N -1.51 2.00 0.63 -3.19 0.00 0.33 -2.39 107.32 103.18 1xxe s GLY 207 Ca 0.23 -0.86 0.18 0.00 0.00 0.00 0.00 44.72 44.27 1xxe s GLY 207 CO 0.12 -0.71 1.27 0.07 0.00 0.00 0.00 173.10 173.85 1xxe h LYS 208 N 4.28 0.00 0.00 2.90 2.10 -1.98 -2.15 116.57 121.72 1xxe h LYS 208 Ca -0.50 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.15 1xxe h LYS 208 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1xxe h LYS 208 CO 0.61 0.00 -0.04 -0.40 -2.00 0.00 0.00 179.45 177.62 1xxe n ASP 209 N -3.01 0.00 -3.79 7.07 5.75 -1.26 -1.75 116.55 119.56 1xxe n ASP 209 Ca 0.13 -1.07 -0.10 0.00 -0.01 0.00 0.00 54.79 53.74 1xxe n ASP 209 Cb 1.24 -0.01 -0.07 0.00 -1.03 0.00 0.00 41.12 41.25 1xxe n ASP 209 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1xxe s LYS 210 N 0.00 0.85 -0.21 0.11 2.20 -0.81 -4.99 119.74 116.90 1xxe s LYS 210 Ca 0.00 -0.75 -0.09 0.00 -0.36 0.00 0.00 55.97 54.77 1xxe s LYS 210 Cb 0.00 0.36 -0.05 0.00 -1.51 0.00 0.00 37.83 36.63 1xxe s LYS 210 CO 0.00 -0.28 0.11 0.08 -0.36 0.00 0.00 175.35 174.90 1xxe s VAL 211 N -3.34 5.13 -0.06 4.02 1.01 -1.26 0.12 120.40 126.03 1xxe s VAL 211 Ca 0.01 0.09 -0.20 0.00 0.00 0.00 0.00 61.98 61.88 1xxe s VAL 211 Cb 0.02 -3.35 -0.15 0.00 0.00 0.00 0.00 36.38 32.90 1xxe s VAL 211 CO -0.08 0.41 0.80 1.88 0.00 0.00 0.00 175.10 178.11 1xxe h TYR 212 N 7.03 -0.20 -1.55 5.22 -1.99 -1.85 -3.43 116.97 120.20 1xxe h TYR 212 Ca -0.39 -0.00 -0.63 0.00 2.00 0.00 0.00 58.73 59.71 1xxe h TYR 212 Cb 1.16 0.07 -0.01 0.00 2.00 0.00 0.00 36.73 39.95 1xxe h TYR 212 CO 0.61 0.23 1.41 0.09 -0.00 0.00 0.00 178.16 180.49 1xxe n ASN 213 N -4.91 2.74 0.00 3.88 5.03 -1.26 -4.77 115.26 115.97 1xxe n ASN 213 Ca -0.07 0.40 0.00 0.00 0.87 0.00 0.00 54.58 55.78 1xxe n ASN 213 Cb 0.26 -1.39 0.00 0.00 -1.02 0.00 0.00 39.78 37.63 1xxe n ASN 213 CO 0.00 0.00 0.00 -2.65 -1.83 0.00 0.00 177.26 172.78 1xxe n PRO 214 N 8.21 0.00 0.00 3.52 -0.02 -1.26 -0.33 135.00 145.12 1xxe n PRO 214 Ca 0.34 0.31 0.13 0.00 -2.02 0.00 0.00 63.50 62.26 1xxe n PRO 214 Cb 0.32 -1.62 0.39 0.00 -0.02 0.00 0.00 33.50 32.57 1xxe n PRO 214 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1xxe n GLU 215 N -1.29 0.35 0.00 -0.52 2.13 -1.26 -5.05 120.64 115.00 1xxe n GLU 215 Ca 0.00 -0.18 0.00 0.00 0.66 0.00 0.00 57.16 57.64 1xxe n GLU 215 Cb 0.12 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.33 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 1.42 -1.18 3.84 8.31 0.00 0.55 -4.79 105.19 113.34 1xxe n GLY 216 Ca 0.09 -1.17 -0.35 0.00 0.00 0.00 0.00 46.02 44.59 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 4.32 0.19 0.99 1.43 -1.26 -4.95 118.68 119.40 1xxe s LEU 217 Ca 0.00 1.16 0.23 0.00 -1.03 0.00 0.00 54.13 54.49 1xxe s LEU 217 Cb 0.00 -3.40 0.20 0.00 0.03 0.00 0.00 46.19 43.03 1xxe s LEU 217 CO 0.00 0.06 1.24 0.03 0.23 0.00 0.00 176.35 177.91 1xxe h ARG 218 N 3.42 0.00 -3.21 1.70 2.47 -1.98 -3.46 114.38 113.32 1xxe h ARG 218 Ca -0.48 0.00 -0.20 0.00 -1.26 0.00 0.00 59.98 58.03 1xxe h ARG 218 Cb 1.19 0.00 -0.29 0.00 -1.65 0.00 0.00 29.97 29.22 1xxe h ARG 218 CO 0.66 0.00 -0.53 0.71 0.56 0.00 0.00 179.97 181.37 1xxe s TYR 219 N -3.25 -0.22 0.63 3.04 2.02 -1.26 -4.97 117.35 113.33 1xxe s TYR 219 Ca 0.03 0.56 0.25 0.00 -0.37 0.00 0.00 57.07 57.55 1xxe s TYR 219 Cb 0.11 0.02 1.26 0.00 -0.40 0.00 0.00 41.96 42.95 1xxe s TYR 219 CO 0.74 -0.15 1.71 0.93 -1.57 0.00 0.00 175.55 177.21 1xxe h GLU 220 N 6.63 0.00 -0.38 -0.62 5.08 -2.04 0.47 114.58 123.72 1xxe h GLU 220 Ca -0.35 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 57.72 1xxe h GLU 220 Cb 1.17 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 30.14 1xxe h GLU 220 CO 0.40 0.00 -0.78 0.09 -1.00 0.00 0.00 179.01 177.72 1xxe n ASN 221 N -3.21 3.00 0.24 1.42 4.13 -1.26 -4.89 115.26 114.70 1xxe n ASN 221 Ca 0.06 -3.37 -0.17 0.00 1.68 0.00 0.00 54.58 52.78 1xxe n ASN 221 Cb 0.73 -0.42 -0.08 0.00 -1.54 0.00 0.00 39.78 38.47 1xxe n ASN 221 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 1xxe h GLU 222 N 1.74 -0.81 -1.01 3.52 4.81 -0.42 0.21 114.58 122.62 1xxe h GLU 222 Ca 0.12 0.06 0.13 0.00 -0.13 0.00 0.00 59.36 59.53 1xxe h GLU 222 Cb 1.37 0.18 -0.09 0.00 0.63 0.00 0.00 28.75 30.84 1xxe h GLU 222 CO 0.36 -0.54 0.63 -1.00 -0.73 0.00 0.00 179.01 177.73 1xxe h PRO 223 N -0.84 0.94 0.00 0.92 0.13 -1.88 0.17 132.00 131.44 1xxe h PRO 223 Ca -0.03 -0.06 -0.14 0.00 -0.87 0.00 0.00 66.00 64.90 1xxe h PRO 223 Cb 0.75 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.65 1xxe h PRO 223 CO -0.08 0.62 -0.68 -0.39 -0.23 0.00 0.00 178.00 177.24 1xxe h VAL 224 N 0.97 1.13 -0.40 1.56 -1.51 -1.91 -2.69 116.25 113.41 1xxe h VAL 224 Ca 0.51 -2.61 -0.07 0.00 -1.23 0.00 0.00 66.70 63.30 1xxe h VAL 224 Cb 0.54 2.56 -0.01 0.00 -2.13 0.00 0.00 31.29 32.25 1xxe h VAL 224 CO -0.28 0.65 -0.03 0.03 -1.23 0.00 0.00 177.57 176.70 1xxe h ARG 225 N 0.00 0.72 -0.67 5.19 3.08 0.87 -2.07 114.38 121.50 1xxe h ARG 225 Ca -0.01 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.77 1xxe h ARG 225 Cb 1.52 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.48 1xxe h ARG 225 CO 0.09 0.83 0.35 1.25 -1.07 0.00 0.00 179.97 181.41 1xxe h HIS 226 N 0.54 0.95 -0.94 3.04 2.76 -1.02 -1.21 115.15 119.27 1xxe h HIS 226 Ca 0.11 -0.04 0.08 0.00 -2.20 0.00 0.00 60.37 58.32 1xxe h HIS 226 Cb 0.53 -0.30 -0.07 0.00 1.55 0.00 0.00 27.41 29.12 1xxe h HIS 226 CO 0.04 0.69 0.61 0.87 -1.30 0.00 0.00 177.93 178.85 1xxe h LYS 227 N 0.93 1.01 -0.55 5.26 1.79 -1.14 0.50 116.57 124.37 1xxe h LYS 227 Ca 0.23 -0.06 -0.09 0.00 -2.18 0.00 0.00 60.65 58.55 1xxe h LYS 227 Cb 0.08 -0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 30.48 1xxe h LYS 227 CO -0.03 0.67 -0.02 0.28 -1.08 0.00 0.00 179.45 179.26 1xxe h VAL 228 N 1.04 1.27 -0.78 0.50 2.07 -0.64 0.12 116.25 119.82 1xxe h VAL 228 Ca 0.42 -1.15 0.03 0.00 0.82 0.00 0.00 66.70 66.82 1xxe h VAL 228 Cb 0.27 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1xxe h VAL 228 CO -0.17 0.41 0.51 0.15 0.02 0.00 0.00 177.57 178.49 1xxe h PHE 229 N 0.86 0.94 0.01 1.57 3.57 0.14 -1.85 116.94 122.17 1xxe h PHE 229 Ca 0.15 0.02 -0.25 0.00 3.53 0.00 0.00 57.97 61.43 1xxe h PHE 229 Cb 0.57 -0.31 0.02 0.00 2.79 0.00 0.00 35.95 39.01 1xxe h PHE 229 CO 0.04 0.56 -0.97 -0.44 -2.23 0.00 0.00 178.31 175.26 1xxe h ASP 230 N 0.98 0.84 -0.82 0.41 3.32 -0.48 -2.30 116.42 118.37 1xxe h ASP 230 Ca 0.30 -0.75 0.11 0.00 0.02 0.00 0.00 57.03 56.72 1xxe h ASP 230 Cb 0.00 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 39.24 1xxe h ASP 230 CO -0.08 1.48 0.54 0.25 -1.72 0.00 0.00 179.24 179.71 1xxe h LEU 231 N 0.29 0.65 -0.04 1.55 5.85 -0.17 0.26 115.31 123.69 1xxe h LEU 231 Ca -0.12 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.57 1xxe h LEU 231 Cb 1.64 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.56 1xxe h LEU 231 CO 0.19 0.37 -0.17 0.40 -0.34 0.00 0.00 178.44 178.89 1xxe h ILE 232 N 0.71 1.47 -0.96 4.05 2.04 -1.34 -1.96 117.51 121.53 1xxe h ILE 232 Ca 0.39 -1.63 0.24 0.00 1.00 0.00 0.00 64.86 64.86 1xxe h ILE 232 Cb 0.54 2.43 -0.07 0.00 -0.74 0.00 0.00 36.82 38.99 1xxe h ILE 232 CO -0.16 0.45 0.64 1.23 0.00 0.00 0.00 178.15 180.31 1xxe h GLY 233 N -0.38 0.71 1.76 5.37 0.00 -0.61 0.43 103.07 110.35 1xxe h GLY 233 Ca -0.01 -0.14 -0.16 0.00 0.00 0.00 0.00 47.33 47.02 1xxe h GLY 233 CO 0.04 -0.04 -0.87 -0.55 0.00 0.00 0.00 176.54 175.11 1xxe h ASP 234 N 0.29 0.00 1.90 0.19 5.19 -0.88 -3.25 116.42 119.86 1xxe h ASP 234 Ca 0.50 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.89 1xxe h ASP 234 Cb 1.44 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.95 1xxe h ASP 234 CO -0.16 0.68 -0.07 -0.07 -3.12 0.00 0.00 179.24 176.50 1xxe h LEU 235 N 0.00 0.00 0.00 1.55 3.38 0.53 -3.03 115.31 117.75 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 1.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.31 1xxe h LEU 235 CO 0.08 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.68 1xxe n TYR 236 N -3.12 0.00 -0.11 1.13 9.36 0.19 -2.99 117.16 121.62 1xxe n TYR 236 Ca 0.04 0.00 0.27 0.00 3.32 0.00 0.00 57.90 61.52 1xxe n TYR 236 Cb 0.55 -0.45 0.72 0.00 -0.63 0.00 0.00 39.34 39.53 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 -0.34 2.98 3.38 -1.66 1.20 115.31 120.87 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 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1xxe h LEU 237 CO 0.00 0.00 0.05 0.18 0.09 0.00 0.00 178.44 178.76 1xxe n LEU 238 N -4.06 0.13 -0.17 1.67 4.77 -1.16 -3.78 117.00 114.40 1xxe n LEU 238 Ca 0.16 0.52 -0.02 0.00 -0.03 0.00 0.00 56.01 56.64 1xxe n LEU 238 Cb 0.91 -0.53 -0.01 0.00 -2.33 0.00 0.00 43.42 41.46 1xxe n LEU 238 CO 0.35 -0.57 -0.02 0.61 -1.33 0.00 0.00 177.39 176.43 1xxe n GLY 239 N -1.41 0.56 3.48 -0.72 0.00 0.41 -4.99 105.19 102.52 1xxe n GLY 239 Ca -0.00 -0.55 -0.17 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.59 0.31 1.61 1.04 -1.25 -4.83 113.70 107.42 1xxe s SER 240 Ca 0.00 0.60 -0.28 0.00 0.48 0.00 0.00 55.95 56.74 1xxe s SER 240 Cb 0.00 0.51 -0.13 0.00 0.10 0.00 0.00 66.02 66.50 1xxe s SER 240 CO 0.00 -0.60 1.19 -0.81 0.98 0.00 0.00 173.24 174.00 1xxe n PRO 241 N 0.90 1.80 -4.00 4.02 -0.04 -1.26 -4.69 135.00 131.74 1xxe n PRO 241 Ca -0.19 0.63 -0.35 0.00 -0.04 0.00 0.00 63.50 63.55 1xxe n PRO 241 Cb 0.57 -2.14 -0.09 0.00 -0.04 0.00 0.00 33.50 31.81 1xxe n PRO 241 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1xxe s VAL 242 N -0.98 4.95 -0.16 0.52 1.01 -1.26 -0.87 120.40 123.61 1xxe s VAL 242 Ca 0.58 0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.58 1xxe s VAL 242 Cb -0.63 -3.20 0.01 0.00 0.00 0.00 0.00 36.38 32.56 1xxe s VAL 242 CO 0.60 0.51 -0.18 -0.54 0.00 0.00 0.00 175.10 175.49 1xxe s LYS 243 N -0.10 3.10 0.00 2.72 -0.14 0.22 -4.61 119.74 120.92 1xxe s LYS 243 Ca 0.08 -0.80 0.00 0.00 -1.36 0.00 0.00 55.97 53.88 1xxe s LYS 243 Cb -0.12 -2.55 0.00 0.00 -1.68 0.00 0.00 37.83 33.48 1xxe s LYS 243 CO 0.01 -0.05 0.00 0.41 -0.76 0.00 0.00 175.35 174.96 1xxe n GLY 244 N 4.21 2.00 3.46 -3.33 0.00 -1.15 -1.89 105.19 108.49 1xxe n GLY 244 Ca -0.20 -1.20 -0.41 0.00 0.00 0.00 0.00 46.02 44.21 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 -1.99 3.17 0.07 1.61 2.20 0.13 -1.62 119.74 123.32 1xxe s LYS 245 Ca 0.00 -0.86 0.06 0.00 -0.36 0.00 0.00 55.97 54.81 1xxe s LYS 245 Cb 0.00 -3.81 -0.04 0.00 -1.51 0.00 0.00 37.83 32.47 1xxe s LYS 245 CO 0.00 -0.59 -0.08 -0.06 -0.36 0.00 0.00 175.35 174.26 1xxe s PHE 246 N 1.66 2.80 0.03 4.03 0.40 0.08 -0.51 117.98 126.46 1xxe s PHE 246 Ca 0.05 -0.12 0.05 0.00 -0.60 0.00 0.00 56.93 56.31 1xxe s PHE 246 Cb -0.18 -1.49 -0.02 0.00 0.51 0.00 0.00 43.02 41.84 1xxe s PHE 246 CO 0.09 0.41 -0.14 -0.47 0.70 0.00 0.00 175.22 175.81 1xxe s TYR 247 N -1.15 1.20 -0.03 0.36 6.14 0.16 -0.84 117.35 123.18 1xxe s TYR 247 Ca 0.20 -0.32 0.00 0.00 0.64 0.00 0.00 57.07 57.60 1xxe s TYR 247 Cb -0.11 -0.73 0.03 0.00 0.42 0.00 0.00 41.96 41.57 1xxe s TYR 247 CO 0.12 0.02 0.01 0.45 0.64 0.00 0.00 175.55 176.79 1xxe s SER 248 N -0.91 0.60 -0.28 4.32 0.15 0.52 -1.28 113.70 116.82 1xxe s SER 248 Ca 0.02 -0.02 -0.04 0.00 0.70 0.00 0.00 55.95 56.61 1xxe s SER 248 Cb -0.07 -0.23 0.02 0.00 -1.71 0.00 0.00 66.02 64.03 1xxe s SER 248 CO 0.01 -0.12 0.02 0.12 1.20 0.00 0.00 173.24 174.47 1xxe s PHE 249 N 1.22 3.14 -1.23 3.44 2.19 -0.16 0.07 117.98 126.65 1xxe s PHE 249 Ca -0.07 -1.34 -0.13 0.00 0.33 0.00 0.00 56.93 55.72 1xxe s PHE 249 Cb -0.13 -2.17 -0.01 0.00 -1.31 0.00 0.00 43.02 39.41 1xxe s PHE 249 CO -0.02 -0.67 0.67 0.54 1.83 0.00 0.00 175.22 177.57 1xxe n ARG 250 N 4.76 -2.21 -3.10 10.12 1.74 -0.15 -2.18 116.66 125.63 1xxe n ARG 250 Ca -0.15 0.46 -0.37 0.00 -0.77 0.00 0.00 57.85 57.01 1xxe n ARG 250 Cb 0.47 -4.34 -0.06 0.00 -1.02 0.00 0.00 32.46 27.50 1xxe n ARG 250 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1xxe s GLY 251 N -3.83 2.71 0.38 -0.13 0.00 -1.26 -4.31 107.32 100.88 1xxe s GLY 251 Ca 0.29 0.19 0.08 0.00 0.00 0.00 0.00 44.72 45.28 1xxe s GLY 251 CO 0.86 0.60 -0.01 -0.32 0.00 0.00 0.00 173.10 174.23 1xxe s GLY 252 N -1.42 2.32 0.20 0.20 0.00 -1.26 -4.97 107.32 102.39 1xxe s GLY 252 Ca 0.38 -2.17 -0.11 0.00 0.00 0.00 0.00 44.72 42.83 1xxe s GLY 252 CO 0.22 -2.03 1.79 0.45 0.00 0.00 0.00 173.10 173.53 1xxe h HIS 253 N 1.84 0.55 0.58 1.90 3.86 -1.95 0.19 115.15 122.12 1xxe h HIS 253 Ca -0.43 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 58.78 1xxe h HIS 253 Cb 1.25 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 29.56 1xxe h HIS 253 CO 0.73 0.25 -0.30 1.03 0.86 0.00 0.00 177.93 180.50 1xxe h SER 254 N 0.56 -0.72 -0.77 2.45 0.87 -1.88 -0.99 113.55 113.07 1xxe h SER 254 Ca 0.27 0.03 0.08 0.00 -1.23 0.00 0.00 61.79 60.94 1xxe h SER 254 Cb 0.19 0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 62.30 1xxe h SER 254 CO -0.19 -0.49 0.50 0.25 -0.53 0.00 0.00 176.83 176.37 1xxe h LEU 255 N -0.80 0.67 0.54 2.23 5.85 -1.88 -1.72 115.31 120.21 1xxe h LEU 255 Ca -0.08 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 1xxe h LEU 255 Cb 0.63 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.53 1xxe h LEU 255 CO 0.11 0.42 -0.27 0.78 -0.34 0.00 0.00 178.44 179.14 1xxe h ASN 256 N 0.75 -0.65 -0.97 1.25 2.35 -0.07 -1.94 115.58 116.30 1xxe h ASN 256 Ca 0.34 0.03 0.19 0.00 -0.55 0.00 0.00 56.30 56.31 1xxe h ASN 256 Cb 0.36 0.17 -0.11 0.00 0.05 0.00 0.00 38.32 38.79 1xxe h ASN 256 CO -0.12 -0.45 0.57 0.58 -1.65 0.00 0.00 177.43 176.35 1xxe h VAL 257 N -0.74 0.69 -0.44 2.81 2.07 -0.52 0.10 116.25 120.21 1xxe h VAL 257 Ca -0.07 -0.24 0.07 0.00 0.82 0.00 0.00 66.70 67.27 1xxe h VAL 257 Cb 0.58 -0.09 -0.06 0.00 -1.52 0.00 0.00 31.29 30.20 1xxe h VAL 257 CO 0.11 0.13 0.10 0.50 0.02 0.00 0.00 177.57 178.43 1xxe h LYS 258 N 0.71 0.23 -0.51 1.57 3.64 -0.60 0.52 116.57 122.13 1xxe h LYS 258 Ca 0.56 -0.01 0.09 0.00 -1.27 0.00 0.00 60.65 60.02 1xxe h LYS 258 Cb 0.88 -0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.58 1xxe h LYS 258 CO -0.39 0.15 0.11 1.25 -2.27 0.00 0.00 179.45 178.30 1xxe h LEU 259 N 0.24 0.01 -0.43 5.20 5.85 -0.22 -0.34 115.31 125.63 1xxe h LEU 259 Ca 0.21 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.96 1xxe h LEU 259 Cb 0.25 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 1xxe h LEU 259 CO -0.27 0.03 0.02 0.58 -0.34 0.00 0.00 178.44 178.46 1xxe h VAL 260 N 0.25 1.26 -0.10 1.05 2.07 -0.75 -2.09 116.25 117.94 1xxe h VAL 260 Ca 0.26 -1.00 0.04 0.00 0.82 0.00 0.00 66.70 66.82 1xxe h VAL 260 Cb 0.35 1.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 1xxe h VAL 260 CO -0.33 0.34 -0.15 0.11 0.02 0.00 0.00 177.57 177.56 1xxe h LYS 261 N 0.59 -0.19 -0.48 1.57 1.57 0.12 0.50 116.57 120.24 1xxe h LYS 261 Ca 0.12 0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.88 1xxe h LYS 261 Cb 0.46 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 1xxe h LYS 261 CO 0.02 -0.13 0.16 0.93 -0.57 0.00 0.00 179.45 179.86 1xxe h GLU 262 N -0.20 0.74 -0.57 3.15 3.07 -1.07 0.47 114.58 120.18 1xxe h GLU 262 Ca 0.08 -0.15 -0.05 0.00 -0.50 0.00 0.00 59.36 58.74 1xxe h GLU 262 Cb 0.31 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.09 1xxe h GLU 262 CO -0.21 0.69 0.17 -0.07 -1.40 0.00 0.00 179.01 178.18 1xxe h LEU 263 N 0.64 0.84 -0.25 1.33 3.38 -0.91 0.39 115.31 120.72 1xxe h LEU 263 Ca 0.16 -0.21 -0.20 0.00 0.09 0.00 0.00 57.88 57.71 1xxe h LEU 263 Cb 0.25 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1xxe h LEU 263 CO -0.01 0.83 -0.90 0.00 0.09 0.00 0.00 178.44 178.46 1xxe h ALA 264 N 1.04 0.49 0.03 1.53 0.00 0.19 -3.10 119.26 119.44 1xxe h ALA 264 Ca 0.18 -0.74 -0.22 0.00 0.00 0.00 0.00 54.91 54.13 1xxe h ALA 264 Cb 0.30 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1xxe h ALA 264 CO -0.00 0.94 -1.03 0.87 0.00 0.00 0.00 179.25 180.03 1xxe h LYS 265 N 0.10 0.08 -0.56 0.00 1.57 0.12 -3.25 116.57 114.63 1xxe h LYS 265 Ca -0.05 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1xxe h LYS 265 Cb 1.54 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.87 1xxe h LYS 265 CO 0.14 1.03 0.32 0.87 -0.57 0.00 0.00 179.45 181.24 1xxe h LYS 266 N 0.03 0.77 -0.48 3.15 1.57 -0.24 -0.27 116.57 121.10 1xxe h LYS 266 Ca -0.04 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1xxe h LYS 266 Cb 1.76 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.91 1xxe h LYS 266 CO 0.15 0.58 0.00 1.04 -0.57 0.00 0.00 179.45 180.64 1xxe n GLN 267 N -4.63 0.68 0.18 3.15 3.00 -1.17 -3.90 117.38 114.70 1xxe n GLN 267 Ca 0.03 0.00 -0.08 0.00 -0.01 0.00 0.00 57.00 56.95 1xxe n GLN 267 Cb 0.07 -1.24 -0.04 0.00 0.00 0.00 0.00 30.24 29.03 1xxe n GLN 267 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 1xxe h LYS 268 N 0.23 -0.49 0.00 -1.09 1.63 -1.13 -2.72 116.57 113.00 1xxe h LYS 268 Ca 0.00 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 1xxe h LYS 268 Cb 0.24 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.98 1xxe h LYS 268 CO 0.00 -0.33 0.49 1.28 -3.45 0.00 0.00 179.45 177.44 1xxe n LEU 269 N -4.26 0.12 0.00 5.20 4.77 -1.25 -5.15 117.00 116.43 1xxe n LEU 269 Ca -0.06 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1xxe n LEU 269 Cb 0.20 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1xxe n LEU 269 CO 0.15 -0.37 0.00 1.07 -1.33 0.00 0.00 177.39 176.91