#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 1.30 -5.16 3.23 1.02 0.26 -4.70 120.64 116.59 1xxe n GLU 4 Ca 0.00 0.48 -0.29 0.00 -0.02 0.00 0.00 57.16 57.32 1xxe n GLU 4 Cb 0.00 -2.17 -0.16 0.00 -0.02 0.00 0.00 31.44 29.09 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 -2.36 1.97 0.30 3.49 2.47 -1.25 -1.14 119.74 123.23 1xxe s LYS 5 Ca 0.68 -0.83 0.03 0.00 -1.56 0.00 0.00 55.97 54.28 1xxe s LYS 5 Cb -0.49 -1.86 -0.04 0.00 -1.46 0.00 0.00 37.83 33.98 1xxe s LYS 5 CO 0.53 0.47 0.14 -0.08 0.16 0.00 0.00 175.35 176.58 1xxe s THR 6 N -0.47 0.40 0.21 3.43 -1.32 -0.65 -2.31 115.64 114.94 1xxe s THR 6 Ca 0.07 -2.00 -0.24 0.00 -1.21 0.00 0.00 61.69 58.30 1xxe s THR 6 Cb -0.10 -2.53 -0.08 0.00 -1.51 0.00 0.00 72.50 68.28 1xxe s THR 6 CO -0.00 0.00 0.80 0.68 -2.21 0.00 0.00 174.62 173.89 1xxe s VAL 7 N -3.60 4.37 0.03 5.08 -7.23 -1.26 0.51 120.40 118.30 1xxe s VAL 7 Ca 0.35 1.64 -0.17 0.00 -1.81 0.00 0.00 61.98 61.99 1xxe s VAL 7 Cb 0.05 -4.05 -0.28 0.00 0.56 0.00 0.00 36.38 32.66 1xxe s VAL 7 CO 0.17 0.37 1.07 0.50 -0.31 0.00 0.00 175.10 176.89 1xxe h LYS 8 N 3.85 0.53 -4.92 4.82 3.64 -0.07 -3.42 116.57 121.00 1xxe h LYS 8 Ca -0.47 -0.69 -0.30 0.00 -1.27 0.00 0.00 60.65 57.92 1xxe h LYS 8 Cb 1.20 0.22 -0.16 0.00 -0.41 0.00 0.00 32.23 33.08 1xxe h LYS 8 CO 0.66 1.29 -0.72 -1.21 -2.27 0.00 0.00 179.45 177.20 1xxe s GLU 9 N -2.97 0.90 0.25 1.90 0.41 -1.26 -4.99 118.70 112.94 1xxe s GLU 9 Ca -0.11 -1.27 -0.31 0.00 -0.41 0.00 0.00 54.97 52.87 1xxe s GLU 9 Cb 0.04 -0.49 -0.12 0.00 -1.78 0.00 0.00 34.13 31.79 1xxe s GLU 9 CO 0.89 0.06 1.66 1.17 -0.49 0.00 0.00 175.26 178.55 1xxe n LYS 10 N 0.24 2.73 -4.40 1.61 4.81 -1.26 -4.87 118.16 117.01 1xxe n LYS 10 Ca -0.14 0.98 -0.27 0.00 -0.87 0.00 0.00 58.31 58.01 1xxe n LYS 10 Cb 0.59 -2.79 -0.12 0.00 0.02 0.00 0.00 35.03 32.73 1xxe n LYS 10 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1xxe s LEU 11 N 0.43 2.48 -0.05 3.14 1.43 -0.81 -4.96 118.68 120.34 1xxe s LEU 11 Ca 0.70 -0.82 -0.16 0.00 -1.03 0.00 0.00 54.13 52.83 1xxe s LEU 11 Cb -0.51 -1.23 0.03 0.00 0.03 0.00 0.00 46.19 44.51 1xxe s LEU 11 CO 0.40 0.13 0.36 -0.94 0.23 0.00 0.00 176.35 176.53 1xxe s SER 12 N -2.59 -0.28 0.14 2.29 1.04 -1.26 -0.34 113.70 112.69 1xxe s SER 12 Ca 0.20 0.31 0.02 0.00 0.48 0.00 0.00 55.95 56.96 1xxe s SER 12 Cb -0.08 0.45 -0.04 0.00 0.10 0.00 0.00 66.02 66.44 1xxe s SER 12 CO 0.10 -0.38 -0.02 -0.36 0.98 0.00 0.00 173.24 173.55 1xxe s PHE 13 N -0.93 1.04 -0.08 5.02 0.08 -0.54 -4.96 117.98 117.61 1xxe s PHE 13 Ca -0.10 -0.99 -0.07 0.00 0.12 0.00 0.00 56.93 55.89 1xxe s PHE 13 Cb -0.04 -0.60 0.02 0.00 -0.57 0.00 0.00 43.02 41.83 1xxe s PHE 13 CO 0.04 -0.21 0.21 -1.83 -0.10 0.00 0.00 175.22 173.34 1xxe s GLU 14 N -3.89 0.24 0.00 0.44 -1.05 -1.26 -1.26 118.70 111.92 1xxe s GLU 14 Ca 0.19 0.31 0.00 0.00 -0.15 0.00 0.00 54.97 55.32 1xxe s GLU 14 Cb 0.06 0.10 0.00 0.00 -0.44 0.00 0.00 34.13 33.85 1xxe s GLU 14 CO -0.00 -0.04 0.00 0.41 0.95 0.00 0.00 175.26 176.58 1xxe n GLY 15 N 3.08 1.51 3.81 -3.83 0.00 -0.62 -4.97 105.19 104.16 1xxe n GLY 15 Ca -0.14 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 44.82 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 4.56 0.38 1.61 0.11 -1.26 -1.73 120.40 122.07 1xxe s VAL 16 Ca 0.00 1.31 -0.26 0.00 -2.93 0.00 0.00 61.98 60.11 1xxe s VAL 16 Cb 0.00 -3.89 -0.09 0.00 -1.53 0.00 0.00 36.38 30.87 1xxe s VAL 16 CO 0.00 0.27 1.17 -0.83 -3.33 0.00 0.00 175.10 172.38 1xxe s GLY 17 N -1.56 2.90 0.22 6.54 0.00 -0.86 -2.40 107.32 112.16 1xxe s GLY 17 Ca 0.41 0.97 -0.06 0.00 0.00 0.00 0.00 44.72 46.04 1xxe s GLY 17 CO 0.21 1.50 1.70 1.19 0.00 0.00 0.00 173.10 177.71 1xxe h ILE 18 N 2.47 1.26 0.12 0.90 2.10 -1.82 -0.97 117.51 121.57 1xxe h ILE 18 Ca -0.48 -1.08 -0.32 0.00 1.08 0.00 0.00 64.86 64.05 1xxe h ILE 18 Cb 1.23 0.80 -0.01 0.00 -1.09 0.00 0.00 36.82 37.75 1xxe h ILE 18 CO 0.63 0.39 -1.67 0.45 -1.08 0.00 0.00 178.15 176.87 1xxe h HIS 19 N 0.90 0.46 0.19 2.19 -0.00 -1.89 2.82 115.15 119.82 1xxe h HIS 19 Ca 0.17 -0.34 -0.34 0.00 -0.00 0.00 0.00 60.37 59.86 1xxe h HIS 19 Cb 0.50 -0.02 0.01 0.00 -0.00 0.00 0.00 27.41 27.90 1xxe h HIS 19 CO 0.03 1.47 -1.66 1.15 -0.00 0.00 0.00 177.93 178.92 1xxe h THR 20 N 0.07 1.00 0.00 2.45 2.02 -1.90 -2.40 112.91 114.15 1xxe h THR 20 Ca -0.30 -2.52 0.00 0.00 0.77 0.00 0.00 66.41 64.36 1xxe h THR 20 Cb 2.04 2.81 0.00 0.00 -1.74 0.00 0.00 68.15 71.25 1xxe h THR 20 CO 0.14 0.83 0.00 0.61 0.37 0.00 0.00 175.52 177.48 1xxe n GLY 21 N 1.83 0.58 3.90 2.16 0.00 -0.37 -4.52 105.19 108.78 1xxe n GLY 21 Ca -0.24 -0.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.38 3.33 0.36 1.61 2.56 -1.26 -4.81 118.70 120.11 1xxe s GLU 22 Ca 0.00 -0.56 -0.26 0.00 0.00 0.00 0.00 54.97 54.15 1xxe s GLU 22 Cb 0.00 -2.95 -0.09 0.00 2.00 0.00 0.00 34.13 33.09 1xxe s GLU 22 CO 0.00 0.56 1.11 -0.47 -0.56 0.00 0.00 175.26 175.90 1xxe s TYR 23 N -1.60 3.29 0.06 5.30 5.04 -1.26 -2.02 117.35 126.16 1xxe s TYR 23 Ca 0.34 1.63 -0.08 0.00 -2.44 0.00 0.00 57.07 56.52 1xxe s TYR 23 Cb -0.12 -3.27 -0.00 0.00 0.35 0.00 0.00 41.96 38.91 1xxe s TYR 23 CO 0.27 -0.85 0.16 0.45 -1.34 0.00 0.00 175.55 174.24 1xxe s SER 24 N -1.20 0.12 0.02 4.32 0.15 -0.71 -4.85 113.70 111.56 1xxe s SER 24 Ca 0.53 -0.56 0.02 0.00 0.70 0.00 0.00 55.95 56.64 1xxe s SER 24 Cb -0.28 0.30 -0.02 0.00 -1.71 0.00 0.00 66.02 64.31 1xxe s SER 24 CO 0.36 -0.63 -0.06 -0.75 1.20 0.00 0.00 173.24 173.35 1xxe s LYS 25 N -3.26 0.45 0.10 5.44 2.20 -0.82 -1.59 119.74 122.26 1xxe s LYS 25 Ca 0.00 -0.54 0.10 0.00 -0.36 0.00 0.00 55.97 55.17 1xxe s LYS 25 Cb 0.02 -0.27 -0.04 0.00 -1.51 0.00 0.00 37.83 36.04 1xxe s LYS 25 CO -0.08 0.05 -0.25 -0.51 -0.36 0.00 0.00 175.35 174.21 1xxe s LEU 26 N -1.07 2.28 -0.05 5.43 1.43 -0.39 -0.43 118.68 125.88 1xxe s LEU 26 Ca -0.07 -0.69 0.00 0.00 -1.03 0.00 0.00 54.13 52.34 1xxe s LEU 26 Cb -0.07 -1.13 0.03 0.00 0.03 0.00 0.00 46.19 45.04 1xxe s LEU 26 CO 0.00 0.16 -0.02 -0.63 0.23 0.00 0.00 176.35 176.10 1xxe s ILE 27 N -1.02 0.39 -0.18 -0.59 1.01 -0.24 -1.47 121.20 119.10 1xxe s ILE 27 Ca 0.11 0.02 -0.03 0.00 0.00 0.00 0.00 60.65 60.75 1xxe s ILE 27 Cb -0.10 -0.48 -0.02 0.00 0.01 0.00 0.00 42.46 41.87 1xxe s ILE 27 CO 0.05 0.22 -0.06 -0.63 0.00 0.00 0.00 174.94 174.51 1xxe s ILE 28 N 1.34 3.44 0.13 2.92 1.01 0.54 0.42 121.20 130.99 1xxe s ILE 28 Ca -0.05 -0.50 0.11 0.00 0.00 0.00 0.00 60.65 60.21 1xxe s ILE 28 Cb -0.13 -2.52 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 1xxe s ILE 28 CO -0.02 0.47 -0.26 -1.00 0.00 0.00 0.00 174.94 174.12 1xxe s HIS 29 N 0.90 2.25 0.92 3.97 3.76 -0.91 -1.91 115.29 124.25 1xxe s HIS 29 Ca -0.01 -0.39 -0.10 0.00 -0.15 0.00 0.00 55.06 54.41 1xxe s HIS 29 Cb -0.15 -1.22 0.15 0.00 1.11 0.00 0.00 32.58 32.47 1xxe s HIS 29 CO 0.01 0.32 1.14 -0.35 -0.85 0.00 0.00 174.74 175.01 1xxe n PRO 30 N 0.94 -0.45 -4.42 8.40 -0.04 -1.26 -1.78 135.00 136.40 1xxe n PRO 30 Ca -0.18 -0.06 -0.23 0.00 -0.04 0.00 0.00 63.50 62.98 1xxe n PRO 30 Cb 0.53 -2.37 -0.08 0.00 -0.04 0.00 0.00 33.50 31.54 1xxe n PRO 30 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1xxe s GLU 31 N -4.61 1.88 0.40 0.54 0.41 -1.26 -4.63 118.70 111.44 1xxe s GLU 31 Ca 0.67 -2.13 -0.23 0.00 -0.41 0.00 0.00 54.97 52.87 1xxe s GLU 31 Cb -0.23 -0.17 -0.10 0.00 -1.78 0.00 0.00 34.13 31.84 1xxe s GLU 31 CO 0.58 -0.58 0.96 0.21 -0.49 0.00 0.00 175.26 175.94 1xxe s LYS 32 N -3.57 4.30 0.47 1.61 2.20 -1.26 -4.92 119.74 118.57 1xxe s LYS 32 Ca 0.31 1.22 -0.21 0.00 -0.36 0.00 0.00 55.97 56.92 1xxe s LYS 32 Cb 0.02 -2.37 -0.11 0.00 -1.51 0.00 0.00 37.83 33.86 1xxe s LYS 32 CO 0.21 0.03 0.57 -1.91 -0.36 0.00 0.00 175.35 173.88 1xxe n GLU 33 N -0.29 0.62 -2.00 4.03 0.00 -1.26 -1.16 120.64 120.59 1xxe n GLU 33 Ca 0.06 0.23 -0.20 0.00 0.00 0.00 0.00 57.16 57.25 1xxe n GLU 33 Cb 0.53 -1.62 -0.05 0.00 0.00 0.00 0.00 31.44 30.30 1xxe n GLU 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1xxe n GLY 34 N 1.74 0.69 0.13 8.31 0.00 -1.26 -4.85 105.19 109.94 1xxe n GLY 34 Ca 0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.92 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 1.34 0.00 2.61 2.02 -1.35 -3.51 112.91 114.03 1xxe h THR 35 Ca -0.44 -2.84 0.00 0.00 0.77 0.00 0.00 66.41 63.90 1xxe h THR 35 Cb 1.32 2.98 0.00 0.00 -1.74 0.00 0.00 68.15 70.72 1xxe h THR 35 CO 0.58 0.85 0.00 0.61 0.37 0.00 0.00 175.52 177.92 1xxe n GLY 36 N 1.65 -3.60 3.66 2.16 0.00 -0.01 -4.90 105.19 104.16 1xxe n GLY 36 Ca -0.14 -2.03 -0.37 0.00 0.00 0.00 0.00 46.02 43.48 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 -0.78 5.28 -0.01 -0.61 -1.09 -1.24 -2.32 121.20 120.44 1xxe s ILE 37 Ca 0.00 0.42 -0.00 0.00 -2.23 0.00 0.00 60.65 58.83 1xxe s ILE 37 Cb 0.00 -3.61 0.00 0.00 -1.58 0.00 0.00 42.46 37.28 1xxe s ILE 37 CO 0.00 0.29 0.01 0.00 -1.23 0.00 0.00 174.94 174.02 1xxe s ARG 38 N 1.23 0.01 0.17 2.79 1.70 -1.02 -1.91 118.95 121.92 1xxe s ARG 38 Ca 0.13 0.03 -0.00 0.00 -0.47 0.00 0.00 55.73 55.41 1xxe s ARG 38 Cb -0.14 -0.01 -0.04 0.00 -0.57 0.00 0.00 34.95 34.19 1xxe s ARG 38 CO 0.06 -0.01 0.34 -0.06 -1.08 0.00 0.00 175.30 174.56 1xxe s PHE 39 N 0.07 3.49 0.00 5.89 0.08 -0.77 -1.55 117.98 125.18 1xxe s PHE 39 Ca -0.01 0.30 0.03 0.00 0.12 0.00 0.00 56.93 57.38 1xxe s PHE 39 Cb -0.01 -1.81 -0.01 0.00 -0.57 0.00 0.00 43.02 40.62 1xxe s PHE 39 CO -0.00 0.44 -0.10 0.12 -0.10 0.00 0.00 175.22 175.57 1xxe s PHE 40 N -1.78 0.92 -0.28 0.36 2.19 -0.78 0.18 117.98 118.79 1xxe s PHE 40 Ca 0.37 -0.21 -0.25 0.00 0.33 0.00 0.00 56.93 57.17 1xxe s PHE 40 Cb -0.11 -0.58 0.14 0.00 -1.31 0.00 0.00 43.02 41.16 1xxe s PHE 40 CO 0.28 -0.01 1.14 0.21 1.83 0.00 0.00 175.22 178.67 1xxe s LYS 41 N -0.41 0.39 -1.74 10.12 2.36 -0.65 -0.91 119.74 128.90 1xxe s LYS 41 Ca 0.03 0.42 0.00 0.00 -2.55 0.00 0.00 55.97 53.87 1xxe s LYS 41 Cb -0.05 0.19 0.00 0.00 -1.05 0.00 0.00 37.83 36.92 1xxe s LYS 41 CO -0.00 -0.05 0.00 0.09 1.55 0.00 0.00 175.35 176.93 1xxe n ASN 42 N 1.92 -5.54 -1.24 1.43 3.02 -1.26 -1.06 115.26 112.52 1xxe n ASN 42 Ca -0.11 0.09 -0.10 0.00 -0.03 0.00 0.00 54.58 54.42 1xxe n ASN 42 Cb 0.56 -4.67 -0.00 0.00 -0.61 0.00 0.00 39.78 35.06 1xxe n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xxe n GLY 43 N -0.89 -0.04 2.89 7.41 0.00 -1.26 -5.02 105.19 108.29 1xxe n GLY 43 Ca -0.23 -0.44 -0.18 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.56 0.42 0.08 1.61 1.01 -0.22 -5.13 120.40 115.61 1xxe s VAL 44 Ca 0.02 -0.10 -0.17 0.00 0.00 0.00 0.00 61.98 61.73 1xxe s VAL 44 Cb -0.01 -0.44 -0.07 0.00 0.00 0.00 0.00 36.38 35.86 1xxe s VAL 44 CO 0.02 0.18 0.54 -0.31 0.00 0.00 0.00 175.10 175.54 1xxe s TYR 45 N 0.68 3.75 -0.32 5.22 2.02 -1.26 -1.63 117.35 125.81 1xxe s TYR 45 Ca -0.08 1.18 -0.02 0.00 -0.37 0.00 0.00 57.07 57.78 1xxe s TYR 45 Cb -0.12 -2.44 0.11 0.00 -0.40 0.00 0.00 41.96 39.12 1xxe s TYR 45 CO -0.00 0.55 0.15 0.42 -1.57 0.00 0.00 175.55 175.10 1xxe s ILE 46 N -1.20 0.26 0.41 2.71 1.01 0.13 -4.94 121.20 119.58 1xxe s ILE 46 Ca 0.31 -1.22 -0.23 0.00 0.00 0.00 0.00 60.65 59.50 1xxe s ILE 46 Cb -0.18 -1.21 -0.12 0.00 0.01 0.00 0.00 42.46 40.96 1xxe s ILE 46 CO 0.18 -0.79 0.67 -2.65 0.00 0.00 0.00 174.94 172.35 1xxe n PRO 47 N 4.78 0.75 -3.13 2.79 -0.02 -1.26 -1.85 135.00 137.05 1xxe n PRO 47 Ca -0.00 0.27 -0.45 0.00 -2.02 0.00 0.00 63.50 61.30 1xxe n PRO 47 Cb 0.40 -1.63 -0.01 0.00 -0.02 0.00 0.00 33.50 32.25 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 -1.40 4.06 0.04 3.55 0.00 -0.80 -4.80 121.76 122.41 1xxe s ALA 48 Ca 0.63 -3.34 -0.00 0.00 0.00 0.00 0.00 51.96 49.25 1xxe s ALA 48 Cb -0.60 -3.82 -0.03 0.00 0.00 0.00 0.00 23.12 18.66 1xxe s ALA 48 CO 0.58 -2.56 -0.03 1.03 0.00 0.00 0.00 175.76 174.77 1xxe s ARG 49 N 0.78 0.54 0.16 0.00 0.52 -1.26 -4.53 118.95 115.15 1xxe s ARG 49 Ca 0.31 -1.04 -0.17 0.00 -0.52 0.00 0.00 55.73 54.31 1xxe s ARG 49 Cb -0.07 0.14 0.07 0.00 0.52 0.00 0.00 34.95 35.61 1xxe s ARG 49 CO -0.06 -0.08 1.68 1.12 0.02 0.00 0.00 175.30 177.98 1xxe h HIS 50 N 3.60 -0.14 0.00 -0.53 2.07 -1.94 0.11 115.15 118.32 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 1.16 0.12 0.00 0.00 2.57 0.00 0.00 27.41 31.26 1xxe h HIS 50 CO 0.57 -0.13 0.50 0.93 -3.07 0.00 0.00 177.93 176.74 1xxe h GLU 51 N 0.02 0.00 -0.46 5.12 4.39 -1.97 2.01 114.58 123.70 1xxe h GLU 51 Ca 0.17 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.87 1xxe h GLU 51 Cb 0.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1xxe h GLU 51 CO -0.34 0.00 0.00 1.19 -1.16 0.00 0.00 179.01 178.70 1xxe n PHE 52 N -2.14 0.60 -1.82 4.33 3.01 0.37 -4.93 117.46 116.90 1xxe n PHE 52 Ca -0.01 -0.30 -0.42 0.00 1.01 0.00 0.00 57.45 57.73 1xxe n PHE 52 Cb 0.52 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.96 1xxe n PHE 52 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1xxe s VAL 53 N -1.40 2.58 -0.08 -4.37 1.01 0.68 -2.57 120.40 116.24 1xxe s VAL 53 Ca 0.39 0.23 0.04 0.00 0.00 0.00 0.00 61.98 62.65 1xxe s VAL 53 Cb 0.22 -3.15 -0.08 0.00 0.00 0.00 0.00 36.38 33.37 1xxe s VAL 53 CO 0.30 0.01 -0.02 1.33 0.00 0.00 0.00 175.10 176.71 1xxe n VAL 54 N 4.43 0.53 -3.67 2.92 0.24 -0.96 -4.90 118.33 116.92 1xxe n VAL 54 Ca 0.16 -0.27 -0.11 0.00 -2.04 0.00 0.00 64.34 62.08 1xxe n VAL 54 Cb 0.38 -0.82 -0.11 0.00 -1.47 0.00 0.00 33.84 31.82 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 -2.19 -0.58 -0.13 6.34 5.65 -1.19 -5.05 115.29 118.13 1xxe s HIS 55 Ca -0.08 1.21 -0.01 0.00 0.25 0.00 0.00 55.06 56.44 1xxe s HIS 55 Cb 0.03 0.15 -0.02 0.00 -1.18 0.00 0.00 32.58 31.55 1xxe s HIS 55 CO 0.27 -0.39 -0.10 0.95 -0.65 0.00 0.00 174.74 174.82 1xxe s THR 56 N 2.24 3.34 0.00 0.89 -4.23 -1.26 -1.87 115.64 114.76 1xxe s THR 56 Ca -0.02 -0.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.92 1xxe s THR 56 Cb -0.11 -2.42 0.00 0.00 1.34 0.00 0.00 72.50 71.31 1xxe s THR 56 CO -0.11 0.52 0.00 -0.46 -0.54 0.00 0.00 174.62 174.03 1xxe n ASN 57 N 3.40 0.00 0.10 3.99 2.04 -1.26 -4.88 115.26 118.65 1xxe n ASN 57 Ca -0.18 0.00 0.02 0.00 -0.44 0.00 0.00 54.58 53.98 1xxe n ASN 57 Cb 0.53 0.00 0.12 0.00 -2.53 0.00 0.00 39.78 37.90 1xxe n ASN 57 CO 0.00 0.00 0.00 1.41 -0.44 0.00 0.00 177.26 178.23 1xxe n HIS 58 N 0.00 0.15 -4.20 -2.53 8.25 -1.26 -4.39 115.22 111.25 1xxe n HIS 58 Ca 0.00 0.08 -0.12 0.00 -0.26 0.00 0.00 57.72 57.42 1xxe n HIS 58 Cb 0.00 -0.29 -0.10 0.00 1.12 0.00 0.00 29.99 30.72 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 -2.74 0.68 -0.26 0.41 0.15 -1.26 -5.05 113.70 105.62 1xxe s SER 59 Ca -0.00 -1.22 -0.09 0.00 0.70 0.00 0.00 55.95 55.34 1xxe s SER 59 Cb 0.01 0.23 -0.04 0.00 -1.71 0.00 0.00 66.02 64.51 1xxe s SER 59 CO 0.04 -0.68 0.14 -0.89 1.20 0.00 0.00 173.24 173.05 1xxe s THR 60 N -3.89 4.88 -0.06 6.45 2.01 -1.26 -4.60 115.64 119.17 1xxe s THR 60 Ca 0.26 0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.33 1xxe s THR 60 Cb 0.07 -3.31 -0.02 0.00 0.01 0.00 0.00 72.50 69.26 1xxe s THR 60 CO 0.04 0.29 -0.21 -1.81 -0.69 0.00 0.00 174.62 172.24 1xxe s ASP 61 N 1.65 3.43 0.20 3.53 1.11 -0.78 -1.74 116.67 124.08 1xxe s ASP 61 Ca 0.07 -0.40 0.08 0.00 0.18 0.00 0.00 52.55 52.47 1xxe s ASP 61 Cb -0.15 -0.87 -0.05 0.00 1.07 0.00 0.00 42.92 42.92 1xxe s ASP 61 CO 0.08 0.27 -0.15 -0.76 1.18 0.00 0.00 175.17 175.78 1xxe s LEU 62 N -0.30 2.54 0.00 1.23 1.43 -0.93 -2.27 118.68 120.38 1xxe s LEU 62 Ca 0.01 -1.00 0.00 0.00 -1.03 0.00 0.00 54.13 52.11 1xxe s LEU 62 Cb -0.13 -0.71 0.00 0.00 0.03 0.00 0.00 46.19 45.38 1xxe s LEU 62 CO 0.02 -0.14 0.00 0.61 0.23 0.00 0.00 176.35 177.07 1xxe n GLY 63 N -0.30 1.22 3.12 -3.19 0.00 -1.06 -0.28 105.19 104.70 1xxe n GLY 63 Ca -0.08 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.00 0.11 -1.90 1.61 5.36 0.11 -4.77 117.98 116.49 1xxe s PHE 64 Ca 0.00 -0.30 0.00 0.00 -0.96 0.00 0.00 56.93 55.67 1xxe s PHE 64 Cb 0.00 -0.08 0.00 0.00 -0.34 0.00 0.00 43.02 42.60 1xxe s PHE 64 CO 0.00 -0.34 0.00 1.63 -1.46 0.00 0.00 175.22 175.05 1xxe n LYS 65 N 1.07 -1.57 -0.58 10.12 4.76 -1.26 -0.81 118.16 129.89 1xxe n LYS 65 Ca -0.21 1.07 0.00 0.00 -2.87 0.00 0.00 58.31 56.30 1xxe n LYS 65 Cb 0.57 -5.54 0.00 0.00 -1.84 0.00 0.00 35.03 28.22 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 -0.61 0.75 3.60 0.72 0.00 -1.26 -5.04 105.19 103.35 1xxe n GLY 66 Ca -0.21 0.00 -0.34 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 -0.42 3.09 0.13 1.61 -1.52 0.01 -5.11 119.66 117.44 1xxe s GLN 67 Ca 0.00 -0.48 -0.04 0.00 -1.95 0.00 0.00 55.36 52.89 1xxe s GLN 67 Cb 0.00 -2.76 -0.03 0.00 -0.22 0.00 0.00 33.01 30.00 1xxe s GLN 67 CO 0.00 0.57 0.12 -0.98 -0.25 0.00 0.00 175.29 174.75 1xxe s ARG 68 N -0.53 0.95 0.04 2.91 1.70 -1.26 0.10 118.95 122.86 1xxe s ARG 68 Ca 0.09 -1.30 0.03 0.00 -0.47 0.00 0.00 55.73 54.07 1xxe s ARG 68 Cb -0.12 0.29 -0.02 0.00 -0.57 0.00 0.00 34.95 34.52 1xxe s ARG 68 CO 0.02 -0.29 -0.09 0.42 -1.08 0.00 0.00 175.30 174.28 1xxe s ILE 69 N -3.99 0.63 0.11 4.99 1.01 0.62 -4.82 121.20 119.74 1xxe s ILE 69 Ca 0.19 -1.05 0.08 0.00 0.00 0.00 0.00 60.65 59.86 1xxe s ILE 69 Cb 0.06 -0.67 -0.04 0.00 0.01 0.00 0.00 42.46 41.82 1xxe s ILE 69 CO -0.01 -0.32 -0.13 -0.54 0.00 0.00 0.00 174.94 173.94 1xxe s LYS 70 N -1.49 2.01 -0.87 2.79 1.02 -0.62 -2.19 119.74 120.39 1xxe s LYS 70 Ca -0.08 -1.08 -0.04 0.00 0.02 0.00 0.00 55.97 54.79 1xxe s LYS 70 Cb -0.09 -2.24 -0.01 0.00 -0.52 0.00 0.00 37.83 34.97 1xxe s LYS 70 CO 0.01 0.50 0.73 2.41 -0.92 0.00 0.00 175.35 178.07 1xxe n THR 71 N 0.76 -7.98 0.31 2.17 -1.04 -0.71 -2.23 114.28 105.57 1xxe n THR 71 Ca -0.14 -0.47 0.04 0.00 -2.04 0.00 0.00 64.05 61.43 1xxe n THR 71 Cb 0.52 -5.66 0.02 0.00 -1.82 0.00 0.00 70.33 63.40 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 -2.55 0.00 0.13 12.58 0.24 -1.24 -4.34 118.33 123.15 1xxe n VAL 72 Ca -0.09 -0.47 -0.02 0.00 -2.04 0.00 0.00 64.34 61.72 1xxe n VAL 72 Cb 0.57 1.13 0.20 0.00 -1.47 0.00 0.00 33.84 34.27 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 1.22 0.08 0.75 7.34 4.11 -1.88 -2.31 114.58 123.88 1xxe h GLU 73 Ca 0.00 -0.05 -0.04 0.00 0.07 0.00 0.00 59.36 59.35 1xxe h GLU 73 Cb 0.29 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.55 1xxe h GLU 73 CO 0.00 0.61 -0.36 0.45 0.07 0.00 0.00 179.01 179.78 1xxe h HIS 74 N 0.06 -0.93 -0.50 2.06 3.86 -1.92 0.13 115.15 117.91 1xxe h HIS 74 Ca -0.00 -0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.23 1xxe h HIS 74 Cb 1.00 0.31 -0.05 0.00 1.06 0.00 0.00 27.41 29.73 1xxe h HIS 74 CO 0.01 -0.57 0.24 0.97 0.86 0.00 0.00 177.93 179.44 1xxe h ILE 75 N -1.23 0.93 -0.92 2.45 6.09 -1.86 -0.93 117.51 122.04 1xxe h ILE 75 Ca -0.10 -0.16 0.10 0.00 -1.37 0.00 0.00 64.86 63.33 1xxe h ILE 75 Cb 0.78 0.43 -0.08 0.00 0.47 0.00 0.00 36.82 38.42 1xxe h ILE 75 CO 0.17 0.08 0.56 -0.07 -3.07 0.00 0.00 178.15 175.83 1xxe h LEU 76 N 0.46 0.83 -0.53 2.19 3.38 -1.35 -1.09 115.31 119.20 1xxe h LEU 76 Ca 0.22 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.28 1xxe h LEU 76 Cb 0.16 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 1xxe h LEU 76 CO -0.17 0.47 0.27 -1.28 0.09 0.00 0.00 178.44 177.82 1xxe h SER 77 N 0.93 0.38 0.24 -0.43 0.87 0.66 -0.07 113.55 116.14 1xxe h SER 77 Ca 0.44 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 61.03 1xxe h SER 77 Cb 0.38 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 1xxe h SER 77 CO -0.24 0.26 -0.18 0.58 -0.53 0.00 0.00 176.83 176.71 1xxe h VAL 78 N 0.52 0.61 -0.75 2.23 2.07 -0.81 -1.66 116.25 118.46 1xxe h VAL 78 Ca 0.24 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.91 1xxe h VAL 78 Cb 0.15 0.61 -0.10 0.00 -1.52 0.00 0.00 31.29 30.43 1xxe h VAL 78 CO -0.17 0.00 0.27 -0.07 0.02 0.00 0.00 177.57 177.62 1xxe h LEU 79 N -0.43 0.22 -0.39 2.57 3.38 -0.84 0.36 115.31 120.18 1xxe h LEU 79 Ca -0.01 0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.13 1xxe h LEU 79 Cb 0.38 0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 1xxe h LEU 79 CO -0.01 0.07 0.10 -0.74 0.09 0.00 0.00 178.44 177.94 1xxe h HIS 80 N 0.40 0.17 -0.46 1.13 2.76 -0.28 0.25 115.15 119.12 1xxe h HIS 80 Ca 0.42 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.51 1xxe h HIS 80 Cb 0.66 -0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.58 1xxe h HIS 80 CO -0.19 0.04 -0.10 -0.07 -1.30 0.00 0.00 177.93 176.31 1xxe h LEU 81 N 0.23 0.82 -0.03 0.26 3.38 -0.18 -2.59 115.31 117.20 1xxe h LEU 81 Ca 0.19 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1xxe h LEU 81 Cb 0.20 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1xxe h LEU 81 CO -0.23 0.94 -0.05 0.18 0.09 0.00 0.00 178.44 179.38 1xxe n LEU 82 N -4.16 0.09 -2.90 1.67 4.77 -0.06 -4.95 117.00 111.46 1xxe n LEU 82 Ca 0.01 0.32 -0.08 0.00 -0.03 0.00 0.00 56.01 56.23 1xxe n LEU 82 Cb 0.37 -0.36 0.04 0.00 -2.33 0.00 0.00 43.42 41.14 1xxe n LEU 82 CO 0.43 0.02 0.11 -0.62 -1.33 0.00 0.00 177.39 176.01 1xxe n GLU 83 N -1.35 -1.61 -4.10 3.23 1.02 0.82 -4.97 120.64 113.67 1xxe n GLU 83 Ca 0.11 0.93 -0.34 0.00 -0.02 0.00 0.00 57.16 57.83 1xxe n GLU 83 Cb 0.29 -5.09 -0.10 0.00 -0.02 0.00 0.00 31.44 26.52 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 -3.22 4.59 -0.02 -3.67 -1.09 -1.01 -3.91 121.20 112.88 1xxe s ILE 84 Ca 0.26 -0.11 0.03 0.00 -2.23 0.00 0.00 60.65 58.60 1xxe s ILE 84 Cb -0.03 -3.05 -0.04 0.00 -1.58 0.00 0.00 42.46 37.75 1xxe s ILE 84 CO 0.62 0.47 0.07 0.35 -1.23 0.00 0.00 174.94 175.22 1xxe n THR 85 N 3.48 0.00 -3.76 2.92 -2.24 -0.98 -4.87 114.28 108.83 1xxe n THR 85 Ca -0.17 -0.11 -0.27 0.00 -2.27 0.00 0.00 64.05 61.23 1xxe n THR 85 Cb 0.52 0.50 -0.17 0.00 -2.10 0.00 0.00 70.33 69.09 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 -2.20 2.84 -0.25 3.42 0.01 -1.23 -0.83 114.94 116.70 1xxe s ASN 86 Ca -0.01 -0.76 -0.26 0.00 -0.71 0.00 0.00 52.86 51.12 1xxe s ASN 86 Cb 0.02 -0.64 0.10 0.00 0.41 0.00 0.00 41.25 41.14 1xxe s ASN 86 CO 0.12 -0.28 0.91 0.68 -1.51 0.00 0.00 177.10 177.01 1xxe s VAL 87 N 1.82 0.00 -0.43 1.60 -7.23 -0.98 -4.04 120.40 111.14 1xxe s VAL 87 Ca -0.01 0.00 -0.05 0.00 -1.81 0.00 0.00 61.98 60.11 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 -0.08 0.00 0.25 -0.89 -0.31 0.00 0.00 175.10 174.07 1xxe s THR 88 N 0.03 3.63 -0.56 5.32 2.01 -0.73 -2.43 115.64 122.90 1xxe s THR 88 Ca 0.01 -1.91 -0.22 0.00 0.31 0.00 0.00 61.69 59.87 1xxe s THR 88 Cb -0.04 -3.42 0.05 0.00 0.01 0.00 0.00 72.50 69.10 1xxe s THR 88 CO -0.02 -0.69 0.83 -0.63 -0.69 0.00 0.00 174.62 173.42 1xxe s ILE 89 N 1.23 4.56 -0.25 1.82 1.01 -0.60 -2.15 121.20 126.82 1xxe s ILE 89 Ca 0.07 -0.15 -0.27 0.00 0.00 0.00 0.00 60.65 60.30 1xxe s ILE 89 Cb -0.24 -4.48 0.00 0.00 0.01 0.00 0.00 42.46 37.76 1xxe s ILE 89 CO -0.03 -1.07 0.95 -1.61 0.00 0.00 0.00 174.94 173.18 1xxe s GLU 90 N 3.46 4.19 -0.41 2.79 2.02 0.17 -1.87 118.70 129.05 1xxe s GLU 90 Ca 0.23 1.12 -0.12 0.00 0.02 0.00 0.00 54.97 56.22 1xxe s GLU 90 Cb -0.16 -3.66 0.04 0.00 0.10 0.00 0.00 34.13 30.45 1xxe s GLU 90 CO 0.15 -0.62 0.27 0.08 0.02 0.00 0.00 175.26 175.16 1xxe s VAL 91 N 3.10 4.80 -0.49 2.63 1.01 -0.08 -1.08 120.40 130.28 1xxe s VAL 91 Ca 0.40 -0.95 -0.23 0.00 0.00 0.00 0.00 61.98 61.20 1xxe s VAL 91 Cb -0.15 -3.76 0.03 0.00 0.00 0.00 0.00 36.38 32.51 1xxe s VAL 91 CO 0.08 -0.37 0.81 -0.63 0.00 0.00 0.00 175.10 175.00 1xxe s ILE 92 N 1.58 4.60 -2.83 2.22 1.09 0.43 -4.64 121.20 123.65 1xxe s ILE 92 Ca 0.03 0.27 0.00 0.00 -1.10 0.00 0.00 60.65 59.85 1xxe s ILE 92 Cb -0.21 -4.39 0.00 0.00 -1.06 0.00 0.00 42.46 36.81 1xxe s ILE 92 CO 0.07 -0.85 0.00 0.61 -0.10 0.00 0.00 174.94 174.66 1xxe n GLY 93 N 5.05 0.79 0.00 6.18 0.00 -1.26 -1.94 105.19 114.01 1xxe n GLY 93 Ca 0.01 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.97 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 2.31 -3.99 1.61 4.13 -1.26 -4.99 115.26 113.07 1xxe n ASN 94 Ca 0.00 -0.21 -0.16 0.00 1.68 0.00 0.00 54.58 55.90 1xxe n ASN 94 Cb 0.00 0.88 -0.14 0.00 -1.54 0.00 0.00 39.78 38.98 1xxe n ASN 94 CO 0.00 0.00 0.00 -1.83 0.28 0.00 0.00 177.26 175.71 1xxe s GLU 95 N -1.34 0.48 0.31 3.52 4.04 -1.26 -1.58 118.70 122.87 1xxe s GLU 95 Ca 0.00 -0.33 -0.29 0.00 0.04 0.00 0.00 54.97 54.39 1xxe s GLU 95 Cb 0.00 -0.42 -0.10 0.00 0.02 0.00 0.00 34.13 33.63 1xxe s GLU 95 CO 0.00 0.11 1.27 0.42 -1.84 0.00 0.00 175.26 175.21 1xxe s ILE 96 N -0.41 2.91 0.19 1.83 -1.09 -0.95 -4.51 121.20 119.17 1xxe s ILE 96 Ca -0.00 0.90 -0.33 0.00 -2.23 0.00 0.00 60.65 58.99 1xxe s ILE 96 Cb -0.04 -3.57 -0.13 0.00 -1.58 0.00 0.00 42.46 37.14 1xxe s ILE 96 CO -0.00 0.21 1.65 -0.81 -1.23 0.00 0.00 174.94 174.76 1xxe n PRO 97 N 1.03 2.48 0.08 2.79 -0.04 -1.26 -4.36 135.00 135.72 1xxe n PRO 97 Ca 0.00 0.90 -0.07 0.00 -0.04 0.00 0.00 63.50 64.29 1xxe n PRO 97 Cb 0.42 -2.70 -0.07 0.00 -0.04 0.00 0.00 33.50 31.11 1xxe n PRO 97 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 1xxe h ILE 98 N 3.69 1.65 0.00 0.52 6.09 -1.76 -3.47 117.51 124.23 1xxe h ILE 98 Ca -0.44 -3.17 0.00 0.00 -1.37 0.00 0.00 64.86 59.88 1xxe h ILE 98 Cb 1.23 2.73 0.00 0.00 0.47 0.00 0.00 36.82 41.25 1xxe h ILE 98 CO 0.92 0.91 0.00 0.18 -3.07 0.00 0.00 178.15 177.09 1xxe n LEU 99 N -3.45 0.00 0.04 2.19 4.77 -1.26 -0.24 117.00 119.05 1xxe n LEU 99 Ca -0.01 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.08 1xxe n LEU 99 Cb 0.89 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.92 1xxe n LEU 99 CO 0.47 0.00 -0.29 -0.67 -1.33 0.00 0.00 177.39 175.57 1xxe n ASP 100 N 9.06 0.47 0.00 -1.43 -0.08 -1.26 -4.45 116.55 118.85 1xxe n ASP 100 Ca 0.00 0.05 0.00 0.00 -1.51 0.00 0.00 54.79 53.33 1xxe n ASP 100 Cb 0.00 1.14 0.00 0.00 2.34 0.00 0.00 41.12 44.60 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 1.26 0.78 0.81 0.27 0.00 0.67 -4.27 105.19 104.71 1xxe n GLY 101 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.95 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 1.74 -0.15 1.61 3.41 -1.26 -1.96 113.62 117.01 1xxe n SER 102 Ca 0.00 -1.44 0.03 0.00 -0.26 0.00 0.00 58.87 57.20 1xxe n SER 102 Cb 0.00 0.03 0.01 0.00 -0.26 0.00 0.00 64.21 63.98 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 3.61 -0.45 0.34 5.00 0.00 -0.88 -4.68 105.19 108.13 1xxe n GLY 103 Ca -0.02 -0.15 0.21 0.00 0.00 0.00 0.00 46.02 46.06 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 0.72 0.98 0.15 1.61 2.91 -1.82 0.20 115.95 120.68 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 0.19 -0.27 0.00 0.00 -0.51 0.00 0.00 29.16 28.57 1xxe h TRP 104 CO 0.00 -0.05 -0.07 0.93 -1.03 0.00 0.00 178.44 178.22 1xxe h GLU 105 N 0.46 -0.19 -0.44 2.65 5.08 -1.90 0.53 114.58 120.77 1xxe h GLU 105 Ca 0.69 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 59.05 1xxe h GLU 105 Cb 1.44 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.71 1xxe h GLU 105 CO -0.54 0.02 0.23 0.74 -1.00 0.00 0.00 179.01 178.46 1xxe h PHE 106 N -0.37 0.62 -0.90 4.33 0.04 -1.49 -1.22 116.94 117.95 1xxe h PHE 106 Ca -0.02 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 1xxe h PHE 106 Cb 0.30 -0.19 -0.04 0.00 2.20 0.00 0.00 35.95 38.21 1xxe h PHE 106 CO -0.01 0.48 0.54 -0.92 -0.60 0.00 0.00 178.31 177.80 1xxe h TYR 107 N 0.57 1.19 -0.15 -0.55 3.20 -0.51 0.13 116.97 120.86 1xxe h TYR 107 Ca 0.15 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.93 1xxe h TYR 107 Cb 0.08 -0.39 -0.00 0.00 1.54 0.00 0.00 36.73 37.96 1xxe h TYR 107 CO -0.02 0.79 -0.26 0.93 -1.64 0.00 0.00 178.16 177.97 1xxe h GLU 108 N 1.25 0.43 0.03 1.82 4.39 0.49 -2.07 114.58 120.93 1xxe h GLU 108 Ca 0.32 -0.27 -0.00 0.00 0.34 0.00 0.00 59.36 59.75 1xxe h GLU 108 Cb -0.05 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1xxe h GLU 108 CO -0.06 0.87 -0.02 0.00 -1.16 0.00 0.00 179.01 178.64 1xxe h ALA 109 N 0.56 -0.05 -0.73 3.43 0.00 -1.12 -3.22 119.26 118.13 1xxe h ALA 109 Ca 0.01 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.61 1xxe h ALA 109 Cb 0.84 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 1xxe h ALA 109 CO 0.06 -0.16 0.47 0.82 0.00 0.00 0.00 179.25 180.44 1xxe h ILE 110 N -0.77 1.14 -0.55 0.00 2.04 -1.10 -1.14 117.51 117.14 1xxe h ILE 110 Ca -0.00 -0.32 0.16 0.00 1.00 0.00 0.00 64.86 65.69 1xxe h ILE 110 Cb 0.67 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1xxe h ILE 110 CO 0.01 0.17 0.41 -0.09 0.00 0.00 0.00 178.15 178.65 1xxe h ARG 111 N 0.94 0.00 0.00 2.37 9.65 -1.45 0.43 114.38 126.31 1xxe h ARG 111 Ca 0.28 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.16 1xxe h ARG 111 Cb -0.03 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.55 1xxe h ARG 111 CO -0.09 0.00 -0.34 1.17 2.80 0.00 0.00 179.97 183.51 1xxe n LYS 112 N -4.30 0.09 -0.57 0.20 4.81 -0.45 -3.96 118.16 113.98 1xxe n LYS 112 Ca 0.10 0.04 0.06 0.00 -0.87 0.00 0.00 58.31 57.64 1xxe n LYS 112 Cb 0.63 -1.57 0.21 0.00 0.02 0.00 0.00 35.03 34.32 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 -1.71 1.78 -4.83 3.14 3.02 0.15 -5.04 115.26 111.77 1xxe n ASN 113 Ca 0.05 -3.85 -0.34 0.00 -0.03 0.00 0.00 54.58 50.42 1xxe n ASN 113 Cb 0.37 -0.53 -0.06 0.00 -0.61 0.00 0.00 39.78 38.95 1xxe n ASN 113 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1xxe s ILE 114 N -3.22 4.57 0.14 2.41 1.01 -0.90 0.60 121.20 125.81 1xxe s ILE 114 Ca 0.38 1.20 0.05 0.00 0.00 0.00 0.00 60.65 62.27 1xxe s ILE 114 Cb 0.37 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 39.08 1xxe s ILE 114 CO -0.06 -0.07 -0.11 -0.22 0.00 0.00 0.00 174.94 174.47 1xxe s LEU 115 N -2.66 2.49 0.00 2.97 2.96 0.18 -4.50 118.68 120.12 1xxe s LEU 115 Ca 0.52 -0.94 -0.02 0.00 -0.22 0.00 0.00 54.13 53.47 1xxe s LEU 115 Cb -0.12 -0.42 -0.04 0.00 0.50 0.00 0.00 46.19 46.11 1xxe s LEU 115 CO 0.18 -0.26 0.16 0.20 -1.32 0.00 0.00 176.35 175.31 1xxe s ASN 116 N -2.92 6.20 0.00 3.68 0.01 -1.26 -1.64 114.94 119.02 1xxe s ASN 116 Ca 0.14 0.29 0.00 0.00 -0.71 0.00 0.00 52.86 52.58 1xxe s ASN 116 Cb -0.00 -1.91 0.00 0.00 0.41 0.00 0.00 41.25 39.75 1xxe s ASN 116 CO 0.02 0.25 0.00 0.00 -1.51 0.00 0.00 177.10 175.86 1xxe n GLN 117 N 0.91 1.66 -3.27 -0.60 6.02 -0.29 -4.84 117.38 116.96 1xxe n GLN 117 Ca -0.11 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.61 1xxe n GLN 117 Cb 0.52 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.72 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 -1.86 3.98 -3.58 1.08 2.85 -1.26 -4.68 115.26 111.79 1xxe n ASN 118 Ca 0.00 -3.52 -0.10 0.00 -0.11 0.00 0.00 54.58 50.85 1xxe n ASN 118 Cb 0.00 -0.64 -0.05 0.00 1.24 0.00 0.00 39.78 40.34 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 -2.78 0.58 0.00 1.20 3.52 -1.26 -4.99 118.95 115.21 1xxe s ARG 119 Ca 0.43 0.10 -0.22 0.00 -0.13 0.00 0.00 55.73 55.90 1xxe s ARG 119 Cb 0.19 0.27 -0.05 0.00 -1.56 0.00 0.00 34.95 33.80 1xxe s ARG 119 CO -0.05 -0.19 0.66 -2.00 -0.81 0.00 0.00 175.30 172.91 1xxe s GLU 120 N -1.29 4.39 0.22 5.12 2.56 -1.26 0.89 118.70 129.32 1xxe s GLU 120 Ca -0.00 0.84 -0.30 0.00 0.00 0.00 0.00 54.97 55.51 1xxe s GLU 120 Cb -0.01 -3.36 -0.09 0.00 2.00 0.00 0.00 34.13 32.67 1xxe s GLU 120 CO 0.00 0.30 1.28 0.42 -0.56 0.00 0.00 175.26 176.71 1xxe s ILE 121 N -0.01 3.20 -1.26 -3.70 1.01 -1.26 -4.75 121.20 114.44 1xxe s ILE 121 Ca 0.34 1.02 -0.19 0.00 0.00 0.00 0.00 60.65 61.82 1xxe s ILE 121 Cb -0.19 -3.65 0.04 0.00 0.01 0.00 0.00 42.46 38.67 1xxe s ILE 121 CO 0.19 0.17 1.75 -0.62 0.00 0.00 0.00 174.94 176.43 1xxe s ASP 122 N 0.13 6.51 0.40 3.58 2.15 -1.26 -4.95 116.67 123.23 1xxe s ASP 122 Ca 0.54 -2.23 -0.27 0.00 0.43 0.00 0.00 52.55 51.03 1xxe s ASP 122 Cb -0.36 -2.58 -0.10 0.00 -0.30 0.00 0.00 42.92 39.57 1xxe s ASP 122 CO 0.40 -1.52 1.38 -1.22 -0.17 0.00 0.00 175.17 174.04 1xxe n TYR 123 N 9.45 2.56 -3.52 -5.34 4.01 -1.26 -4.75 117.16 118.31 1xxe n TYR 123 Ca 0.47 0.48 -0.38 0.00 -0.16 0.00 0.00 57.90 58.31 1xxe n TYR 123 Cb 0.46 -2.45 -0.10 0.00 -0.31 0.00 0.00 39.34 36.94 1xxe n TYR 123 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1xxe s PHE 124 N -1.15 3.24 -0.03 -0.72 2.19 -0.42 -5.01 117.98 116.08 1xxe s PHE 124 Ca 0.58 0.24 0.06 0.00 0.33 0.00 0.00 56.93 58.14 1xxe s PHE 124 Cb -0.49 -2.44 -0.01 0.00 -1.31 0.00 0.00 43.02 38.76 1xxe s PHE 124 CO 0.60 -0.17 -0.23 0.08 1.83 0.00 0.00 175.22 177.34 1xxe s VAL 125 N 1.81 1.81 0.11 3.12 1.01 -1.26 0.48 120.40 127.48 1xxe s VAL 125 Ca 0.10 -0.96 -0.26 0.00 0.00 0.00 0.00 61.98 60.86 1xxe s VAL 125 Cb -0.16 -1.51 -0.07 0.00 0.00 0.00 0.00 36.38 34.64 1xxe s VAL 125 CO 0.10 0.51 0.82 -0.69 0.00 0.00 0.00 175.10 175.84 1xxe s VAL 126 N -0.36 4.51 -0.27 2.92 1.01 -0.82 -4.93 120.40 122.46 1xxe s VAL 126 Ca 0.04 1.78 0.06 0.00 0.00 0.00 0.00 61.98 63.85 1xxe s VAL 126 Cb -0.10 -4.18 -0.06 0.00 0.00 0.00 0.00 36.38 32.03 1xxe s VAL 126 CO 0.01 0.42 0.25 -0.62 0.00 0.00 0.00 175.10 175.15 1xxe n GLU 127 N 2.30 5.04 -3.88 2.72 -0.58 -1.26 -4.26 120.64 120.71 1xxe n GLU 127 Ca -0.03 -0.00 -0.11 0.00 -0.42 0.00 0.00 57.16 56.60 1xxe n GLU 127 Cb 0.49 -0.78 -0.11 0.00 -0.57 0.00 0.00 31.44 30.47 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 -1.56 0.29 1.13 3.49 -1.05 -1.26 -4.85 118.70 114.90 1xxe s GLU 128 Ca 0.02 -0.23 -0.18 0.00 -0.15 0.00 0.00 54.97 54.43 1xxe s GLU 128 Cb 0.04 0.12 0.26 0.00 -0.44 0.00 0.00 34.13 34.11 1xxe s GLU 128 CO 0.24 -0.06 1.15 -1.25 0.95 0.00 0.00 175.26 176.30 1xxe s PRO 129 N -0.82 -0.68 -0.21 -4.83 0.04 -1.26 -4.58 135.00 122.66 1xxe s PRO 129 Ca -0.09 -0.11 -0.28 0.00 0.04 0.00 0.00 61.00 60.57 1xxe s PRO 129 Cb -0.05 -1.66 0.11 0.00 0.04 0.00 0.00 34.50 32.93 1xxe s PRO 129 CO 0.00 -3.35 0.91 -1.50 0.04 0.00 0.00 177.00 173.11 1xxe s ILE 130 N -3.20 0.00 -0.10 0.56 2.07 -0.75 -4.93 121.20 114.84 1xxe s ILE 130 Ca 0.71 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.94 1xxe s ILE 130 Cb -0.09 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.53 1xxe s ILE 130 CO 0.55 0.00 -0.03 -0.63 -1.91 0.00 0.00 174.94 172.92 1xxe s ILE 131 N -0.38 0.68 -0.25 2.00 1.09 -1.26 -0.92 121.20 122.16 1xxe s ILE 131 Ca -0.01 -0.14 0.00 0.00 -1.10 0.00 0.00 60.65 59.40 1xxe s ILE 131 Cb -0.03 -0.82 0.04 0.00 -1.06 0.00 0.00 42.46 40.59 1xxe s ILE 131 CO -0.00 0.26 -0.09 0.68 -0.10 0.00 0.00 174.94 175.69 1xxe s VAL 132 N 1.84 2.52 -0.14 2.92 -7.23 -0.52 -4.98 120.40 114.81 1xxe s VAL 132 Ca 0.04 -1.28 0.00 0.00 -1.81 0.00 0.00 61.98 58.93 1xxe s VAL 132 Cb -0.13 -2.35 -0.01 0.00 0.56 0.00 0.00 36.38 34.46 1xxe s VAL 132 CO -0.07 0.12 -0.15 -0.70 -0.31 0.00 0.00 175.10 174.00 1xxe s GLU 133 N 1.23 3.28 -0.19 4.82 -6.30 -1.26 -1.66 118.70 118.61 1xxe s GLU 133 Ca -0.03 -0.73 -0.34 0.00 -2.50 0.00 0.00 54.97 51.37 1xxe s GLU 133 Cb -0.18 -2.62 0.14 0.00 0.00 0.00 0.00 34.13 31.47 1xxe s GLU 133 CO -0.05 0.09 1.19 0.34 0.02 0.00 0.00 175.26 176.85 1xxe s ASP 134 N 0.64 -0.15 -2.02 -1.70 2.15 -0.80 -4.95 116.67 109.83 1xxe s ASP 134 Ca -0.08 0.04 0.00 0.00 0.43 0.00 0.00 52.55 52.94 1xxe s ASP 134 Cb -0.16 0.15 0.00 0.00 -0.30 0.00 0.00 42.92 42.62 1xxe s ASP 134 CO 0.03 -0.24 0.00 -0.62 -0.17 0.00 0.00 175.17 174.17 1xxe n GLU 135 N 0.03 -1.47 -0.98 4.34 -0.58 -1.26 0.03 120.64 120.75 1xxe n GLU 135 Ca -0.01 1.15 0.00 0.00 -0.42 0.00 0.00 57.16 57.88 1xxe n GLU 135 Cb 0.58 -5.52 0.00 0.00 -0.57 0.00 0.00 31.44 25.93 1xxe n GLU 135 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xxe n GLY 136 N -0.31 0.82 3.95 0.62 0.00 -1.26 -5.00 105.19 104.01 1xxe n GLY 136 Ca -0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.07 2.50 -0.09 1.61 0.52 0.10 -4.95 118.95 118.56 1xxe s ARG 137 Ca 0.00 -1.58 -0.30 0.00 -0.52 0.00 0.00 55.73 53.33 1xxe s ARG 137 Cb 0.00 -2.49 0.07 0.00 0.52 0.00 0.00 34.95 33.05 1xxe s ARG 137 CO 0.00 -0.46 0.69 -1.17 0.02 0.00 0.00 175.30 174.38 1xxe s LEU 138 N -4.35 -0.67 -0.07 2.53 0.20 -0.97 -1.90 118.68 113.45 1xxe s LEU 138 Ca 0.51 0.86 -0.08 0.00 0.69 0.00 0.00 54.13 56.10 1xxe s LEU 138 Cb -0.05 2.52 0.02 0.00 -0.43 0.00 0.00 46.19 48.25 1xxe s LEU 138 CO 0.31 -0.54 0.22 -0.63 -0.29 0.00 0.00 176.35 175.42 1xxe s ILE 139 N -0.89 0.01 -0.01 6.68 1.01 -0.67 -1.07 121.20 126.27 1xxe s ILE 139 Ca -0.09 -0.09 0.04 0.00 0.00 0.00 0.00 60.65 60.51 1xxe s ILE 139 Cb -0.01 -0.34 -0.01 0.00 0.01 0.00 0.00 42.46 42.11 1xxe s ILE 139 CO 0.08 -0.05 -0.12 -0.75 0.00 0.00 0.00 174.94 174.10 1xxe s LYS 140 N -0.10 1.06 0.06 2.79 2.20 -0.25 -1.43 119.74 124.06 1xxe s LYS 140 Ca -0.02 -0.44 0.09 0.00 -0.36 0.00 0.00 55.97 55.24 1xxe s LYS 140 Cb -0.02 -1.01 -0.03 0.00 -1.51 0.00 0.00 37.83 35.26 1xxe s LYS 140 CO 0.01 0.25 -0.26 0.00 -0.36 0.00 0.00 175.35 174.98 1xxe s ALA 141 N -0.21 2.23 -0.03 3.13 0.00 -0.10 -0.39 121.76 126.40 1xxe s ALA 141 Ca 0.03 -1.29 -0.03 0.00 0.00 0.00 0.00 51.96 50.67 1xxe s ALA 141 Cb -0.06 -0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.63 1xxe s ALA 141 CO -0.00 0.52 0.08 -2.00 0.00 0.00 0.00 175.76 174.36 1xxe s GLU 142 N -1.41 0.08 0.56 0.00 2.12 0.73 -1.81 118.70 118.97 1xxe s GLU 142 Ca 0.12 0.14 -0.20 0.00 0.36 0.00 0.00 54.97 55.38 1xxe s GLU 142 Cb -0.10 0.01 -0.06 0.00 0.26 0.00 0.00 34.13 34.24 1xxe s GLU 142 CO 0.03 -0.03 1.09 -0.35 -0.54 0.00 0.00 175.26 175.46 1xxe n PRO 143 N 3.20 1.20 -3.53 4.30 -0.04 -1.26 0.32 135.00 139.19 1xxe n PRO 143 Ca -0.14 0.45 -0.08 0.00 -0.04 0.00 0.00 63.50 63.69 1xxe n PRO 143 Cb 0.58 -2.27 -0.02 0.00 -0.04 0.00 0.00 33.50 31.75 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 -1.07 -0.32 0.00 3.54 0.15 -1.26 -4.36 113.70 110.38 1xxe s SER 144 Ca 0.73 0.06 0.22 0.00 0.70 0.00 0.00 55.95 57.66 1xxe s SER 144 Cb -0.44 0.32 0.62 0.00 -1.71 0.00 0.00 66.02 64.82 1xxe s SER 144 CO 0.49 -0.50 1.49 -0.90 1.20 0.00 0.00 173.24 175.02 1xxe n ASP 145 N -0.07 2.30 -4.01 5.45 5.68 -1.26 -3.57 116.55 121.07 1xxe n ASP 145 Ca -0.07 -1.81 -0.13 0.00 -0.50 0.00 0.00 54.79 52.28 1xxe n ASP 145 Cb 0.60 -0.14 -0.12 0.00 -1.14 0.00 0.00 41.12 40.32 1xxe n ASP 145 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1xxe s THR 146 N -1.72 0.39 -0.29 2.12 -4.23 -1.26 -4.90 115.64 105.74 1xxe s THR 146 Ca 0.34 -0.80 -0.29 0.00 -1.18 0.00 0.00 61.69 59.76 1xxe s THR 146 Cb 0.19 -0.45 0.01 0.00 1.34 0.00 0.00 72.50 73.59 1xxe s THR 146 CO 0.28 -0.28 1.21 -0.22 -0.54 0.00 0.00 174.62 175.07 1xxe s LEU 147 N -1.16 3.93 -0.01 4.79 2.96 -1.26 -3.00 118.68 124.93 1xxe s LEU 147 Ca -0.08 1.19 0.00 0.00 -0.22 0.00 0.00 54.13 55.02 1xxe s LEU 147 Cb -0.08 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.09 1xxe s LEU 147 CO -0.00 -0.97 0.01 -0.70 -1.32 0.00 0.00 176.35 173.36 1xxe s GLU 148 N 3.91 0.06 -0.04 1.98 2.12 -0.91 -2.96 118.70 122.86 1xxe s GLU 148 Ca 0.52 0.06 0.00 0.00 0.36 0.00 0.00 54.97 55.91 1xxe s GLU 148 Cb -0.15 -0.19 0.03 0.00 0.26 0.00 0.00 34.13 34.08 1xxe s GLU 148 CO 0.19 -0.07 0.00 0.08 -0.54 0.00 0.00 175.26 174.93 1xxe s VAL 149 N 0.50 0.21 -0.12 3.70 1.01 -0.93 -0.53 120.40 124.24 1xxe s VAL 149 Ca -0.04 0.10 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 1xxe s VAL 149 Cb -0.07 -0.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.97 1xxe s VAL 149 CO -0.01 0.17 -0.10 -0.89 0.00 0.00 0.00 175.10 174.27 1xxe s THR 150 N 1.21 3.36 -0.11 3.92 2.01 0.21 -1.20 115.64 125.04 1xxe s THR 150 Ca -0.07 -0.56 0.04 0.00 0.31 0.00 0.00 61.69 61.40 1xxe s THR 150 Cb -0.13 -2.42 0.00 0.00 0.01 0.00 0.00 72.50 69.96 1xxe s THR 150 CO -0.02 0.53 -0.23 -0.47 -0.69 0.00 0.00 174.62 173.74 1xxe s TYR 151 N 0.12 2.58 -0.35 4.92 5.04 -0.96 0.32 117.35 129.01 1xxe s TYR 151 Ca -0.04 -1.07 -0.01 0.00 -2.44 0.00 0.00 57.07 53.50 1xxe s TYR 151 Cb -0.14 -1.72 0.08 0.00 0.35 0.00 0.00 41.96 40.52 1xxe s TYR 151 CO 0.04 -0.43 0.09 -2.00 -1.34 0.00 0.00 175.55 171.91 1xxe s GLU 152 N 0.39 2.13 0.25 4.97 2.56 0.93 -1.52 118.70 128.42 1xxe s GLU 152 Ca -0.18 -1.57 -0.02 0.00 0.00 0.00 0.00 54.97 53.20 1xxe s GLU 152 Cb -0.18 -3.35 -0.04 0.00 2.00 0.00 0.00 34.13 32.56 1xxe s GLU 152 CO 0.08 -0.85 0.47 0.20 -0.56 0.00 0.00 175.26 174.60 1xxe s GLY 153 N 1.45 1.75 -0.42 -1.50 0.00 -0.24 -1.35 107.32 107.00 1xxe s GLY 153 Ca 0.02 -0.75 0.02 0.00 0.00 0.00 0.00 44.72 44.01 1xxe s GLY 153 CO -0.03 -0.69 0.26 1.85 0.00 0.00 0.00 173.10 174.49 1xxe s GLU 154 N -3.54 1.04 0.21 2.90 2.12 -1.26 -2.17 118.70 118.00 1xxe s GLU 154 Ca 0.40 -1.86 -0.11 0.00 0.36 0.00 0.00 54.97 53.77 1xxe s GLU 154 Cb -0.11 -1.91 -0.07 0.00 0.26 0.00 0.00 34.13 32.30 1xxe s GLU 154 CO 0.30 -1.22 0.54 -0.06 -0.54 0.00 0.00 175.26 174.29 1xxe s PHE 155 N 0.46 3.47 -1.50 5.30 0.08 0.30 -4.95 117.98 121.15 1xxe s PHE 155 Ca 0.20 0.91 0.25 0.00 0.12 0.00 0.00 56.93 58.41 1xxe s PHE 155 Cb -0.19 -2.28 0.48 0.00 -0.57 0.00 0.00 43.02 40.47 1xxe s PHE 155 CO -0.03 0.31 1.39 1.63 -0.10 0.00 0.00 175.22 178.42 1xxe n LYS 156 N 0.11 0.56 0.00 0.44 5.02 -1.26 -2.60 118.16 120.43 1xxe n LYS 156 Ca -0.01 -0.37 0.00 0.00 -2.02 0.00 0.00 58.31 55.91 1xxe n LYS 156 Cb 0.52 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.04 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 -0.90 -0.52 0.25 4.39 0.23 -1.26 -4.70 115.26 112.75 1xxe n ASN 157 Ca 0.09 -0.60 0.14 0.00 -0.53 0.00 0.00 54.58 53.68 1xxe n ASN 157 Cb 0.36 0.00 0.74 0.00 -2.08 0.00 0.00 39.78 38.80 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 -1.16 0.00 0.08 -2.53 -5.15 -1.18 -1.63 116.94 105.37 1xxe h PHE 158 Ca 0.00 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 57.77 1xxe h PHE 158 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.17 1xxe h PHE 158 CO 0.00 0.00 -0.04 -0.07 -2.00 0.00 0.00 178.31 176.20 1xxe h LEU 159 N 0.00 -0.10 0.00 2.10 3.38 -1.86 -3.47 115.31 115.36 1xxe h LEU 159 Ca 0.00 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1xxe h LEU 159 Cb 0.35 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1xxe h LEU 159 CO 0.00 0.21 0.00 0.61 0.09 0.00 0.00 178.44 179.35 1xxe n GLY 160 N -0.32 1.72 3.19 0.83 0.00 -0.61 -4.77 105.19 105.22 1xxe n GLY 160 Ca -0.08 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.23 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 1.51 -0.06 1.61 0.52 -1.26 0.11 118.95 121.38 1xxe s ARG 161 Ca 0.00 -0.70 -0.26 0.00 -0.52 0.00 0.00 55.73 54.25 1xxe s ARG 161 Cb 0.00 -1.48 0.06 0.00 0.52 0.00 0.00 34.95 34.05 1xxe s ARG 161 CO 0.00 0.40 0.58 -1.14 0.02 0.00 0.00 175.30 175.16 1xxe s GLN 162 N -0.52 0.92 0.09 3.54 0.74 -0.92 -4.99 119.66 118.53 1xxe s GLN 162 Ca 0.07 0.21 0.05 0.00 0.05 0.00 0.00 55.36 55.74 1xxe s GLN 162 Cb -0.07 0.43 -0.03 0.00 1.10 0.00 0.00 33.01 34.43 1xxe s GLN 162 CO -0.00 -0.27 -0.13 -1.59 -0.55 0.00 0.00 175.29 172.75 1xxe s LYS 163 N -1.06 0.88 -0.06 1.67 -2.85 -1.26 -1.08 119.74 115.98 1xxe s LYS 163 Ca -0.10 -1.08 -0.00 0.00 -1.00 0.00 0.00 55.97 53.78 1xxe s LYS 163 Cb -0.02 -0.79 0.03 0.00 -2.06 0.00 0.00 37.83 34.99 1xxe s LYS 163 CO 0.08 0.16 -0.01 0.12 0.10 0.00 0.00 175.35 175.79 1xxe s PHE 164 N -1.76 0.65 -0.26 1.78 5.36 -0.57 -4.98 117.98 118.19 1xxe s PHE 164 Ca 0.03 -0.16 -0.11 0.00 -0.96 0.00 0.00 56.93 55.73 1xxe s PHE 164 Cb -0.07 -0.72 -0.05 0.00 -0.34 0.00 0.00 43.02 41.85 1xxe s PHE 164 CO 0.02 -0.27 0.20 -0.08 -1.46 0.00 0.00 175.22 173.63 1xxe s THR 165 N 1.56 5.32 -0.15 0.12 -1.32 -1.26 -2.27 115.64 117.63 1xxe s THR 165 Ca -0.01 0.22 -0.08 0.00 -1.21 0.00 0.00 61.69 60.60 1xxe s THR 165 Cb -0.13 -3.54 -0.04 0.00 -1.51 0.00 0.00 72.50 67.28 1xxe s THR 165 CO -0.03 0.28 0.14 0.12 -2.21 0.00 0.00 174.62 172.92 1xxe s PHE 166 N 1.48 3.53 0.06 9.09 5.36 -0.34 -4.99 117.98 132.16 1xxe s PHE 166 Ca 0.08 0.46 0.04 0.00 -0.96 0.00 0.00 56.93 56.55 1xxe s PHE 166 Cb -0.15 -2.04 -0.03 0.00 -0.34 0.00 0.00 43.02 40.47 1xxe s PHE 166 CO 0.08 0.56 -0.11 0.08 -1.46 0.00 0.00 175.22 174.37 1xxe s VAL 167 N -0.47 0.83 -0.06 3.12 1.01 -1.26 -2.19 120.40 121.37 1xxe s VAL 167 Ca 0.12 -1.21 -0.35 0.00 0.00 0.00 0.00 61.98 60.54 1xxe s VAL 167 Cb -0.12 -0.86 -0.13 0.00 0.00 0.00 0.00 36.38 35.27 1xxe s VAL 167 CO 0.02 -0.32 1.76 -0.62 0.00 0.00 0.00 175.10 175.94 1xxe n GLU 168 N 1.33 1.93 0.00 2.72 1.02 -1.16 -1.62 120.64 124.86 1xxe n GLU 168 Ca -0.22 0.70 0.00 0.00 -0.02 0.00 0.00 57.16 57.63 1xxe n GLU 168 Cb 0.55 -2.49 0.00 0.00 -0.02 0.00 0.00 31.44 29.47 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 4.04 1.53 1.09 0.62 0.00 -1.26 -4.94 105.19 106.27 1xxe n GLY 169 Ca 0.22 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.21 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 2.58 -0.09 1.61 4.13 -0.64 -4.78 115.26 118.07 1xxe n ASN 170 Ca 0.00 -3.73 -0.01 0.00 1.68 0.00 0.00 54.58 52.52 1xxe n ASN 170 Cb 0.00 -0.46 0.26 0.00 -1.54 0.00 0.00 39.78 38.03 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 1.36 0.73 0.00 3.52 5.08 -1.92 -2.29 114.58 121.06 1xxe h GLU 171 Ca 0.09 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1xxe h GLU 171 Cb 1.20 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1xxe h GLU 171 CO 0.22 0.63 0.18 0.93 -1.00 0.00 0.00 179.01 179.97 1xxe h GLU 172 N 0.71 0.00 -0.01 2.33 3.07 -1.97 0.19 114.58 118.90 1xxe h GLU 172 Ca 0.17 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 1xxe h GLU 172 Cb 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.11 1xxe h GLU 172 CO -0.01 0.00 -0.16 0.39 -1.40 0.00 0.00 179.01 177.83 1xxe n GLU 173 N -2.27 1.02 0.00 2.33 1.02 -0.86 -4.04 120.64 117.83 1xxe n GLU 173 Ca -0.01 -0.54 0.00 0.00 -0.02 0.00 0.00 57.16 56.58 1xxe n GLU 173 Cb 0.21 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 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 -0.52 0.07 -0.07 -3.67 -5.35 0.65 -4.71 119.36 105.76 1xxe n ILE 174 Ca 0.15 -0.43 -0.09 0.00 -0.27 0.00 0.00 62.75 62.11 1xxe n ILE 174 Cb 0.33 1.16 -0.15 0.00 -1.74 0.00 0.00 39.64 39.24 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 -0.03 1.47 1.56 7.28 0.24 -1.14 -4.15 118.33 123.55 1xxe n VAL 175 Ca 0.00 -0.83 0.13 0.00 -2.04 0.00 0.00 64.34 61.60 1xxe n VAL 175 Cb 0.07 -0.70 0.55 0.00 -1.47 0.00 0.00 33.84 32.29 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 -2.87 1.12 -4.66 1.34 4.77 -1.26 -2.08 117.00 113.36 1xxe n LEU 176 Ca -0.26 -0.42 -0.43 0.00 -0.03 0.00 0.00 56.01 54.87 1xxe n LEU 176 Cb 1.11 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 42.14 1xxe n LEU 176 CO 0.44 0.21 0.90 0.00 -1.33 0.00 0.00 177.39 177.61 1xxe s ALA 177 N -1.93 3.69 0.27 -1.18 0.00 -1.26 -4.86 121.76 116.48 1xxe s ALA 177 Ca 0.36 0.16 -0.06 0.00 0.00 0.00 0.00 51.96 52.42 1xxe s ALA 177 Cb 0.19 -3.53 -0.06 0.00 0.00 0.00 0.00 23.12 19.72 1xxe s ALA 177 CO 0.30 -1.04 0.54 -0.98 0.00 0.00 0.00 175.76 174.59 1xxe s ARG 178 N 3.17 3.67 0.78 0.00 1.70 -1.26 -4.39 118.95 122.62 1xxe s ARG 178 Ca 0.43 0.06 -0.15 0.00 -0.47 0.00 0.00 55.73 55.61 1xxe s ARG 178 Cb -0.15 -2.66 0.02 0.00 -0.57 0.00 0.00 34.95 31.60 1xxe s ARG 178 CO 0.06 0.25 0.86 -2.37 -1.08 0.00 0.00 175.30 173.02 1xxe n THR 179 N -0.71 1.97 -4.26 4.99 5.66 -0.83 -4.78 114.28 116.32 1xxe n THR 179 Ca -0.01 -0.30 -0.14 0.00 -3.05 0.00 0.00 64.05 60.54 1xxe n THR 179 Cb 0.53 -0.98 -0.10 0.00 -1.55 0.00 0.00 70.33 68.23 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 -2.01 1.29 0.13 1.09 -0.71 -1.26 -2.23 117.98 114.29 1xxe s PHE 180 Ca 0.69 -1.13 -0.16 0.00 -1.04 0.00 0.00 56.93 55.29 1xxe s PHE 180 Cb -0.31 -0.73 0.03 0.00 -1.21 0.00 0.00 43.02 40.80 1xxe s PHE 180 CO 0.54 -0.33 0.41 0.00 -1.34 0.00 0.00 175.22 174.51 1xxe s PHE 182 N -3.82 3.40 0.56 0.00 0.08 -1.26 -1.08 117.98 115.86 1xxe s PHE 182 Ca 0.04 0.31 0.27 0.00 0.12 0.00 0.00 56.93 57.67 1xxe s PHE 182 Cb 0.02 -1.81 1.69 0.00 -0.57 0.00 0.00 43.02 42.35 1xxe s PHE 182 CO -0.11 0.60 2.22 0.38 -0.10 0.00 0.00 175.22 178.22 1xxe h ASP 183 N 4.42 0.00 1.40 1.36 2.03 -1.83 -0.01 116.42 123.78 1xxe h ASP 183 Ca -0.51 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 55.69 1xxe h ASP 183 Cb 1.20 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.68 1xxe h ASP 183 CO 0.61 0.01 -0.50 4.11 -1.03 0.00 0.00 179.24 182.45 1xxe h TRP 184 N 0.00 0.00 0.00 4.15 0.09 -1.94 -3.26 115.95 115.00 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 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.27 1xxe h TRP 184 CO 0.00 0.50 -1.30 -0.85 0.09 0.00 0.00 178.44 176.88 1xxe n GLU 185 N -3.26 0.25 0.15 0.12 0.28 -0.66 -4.42 120.64 113.09 1xxe n GLU 185 Ca 0.02 -0.06 -0.14 0.00 -0.16 0.00 0.00 57.16 56.82 1xxe n GLU 185 Cb 0.71 -1.52 -0.07 0.00 1.43 0.00 0.00 31.44 31.99 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 0.65 -0.48 3.84 2.04 -1.07 -0.62 117.51 121.87 1xxe h ILE 186 Ca 0.00 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.95 1xxe h ILE 186 Cb 0.69 0.65 -0.08 0.00 -0.74 0.00 0.00 36.82 37.34 1xxe h ILE 186 CO 0.00 0.00 0.01 -0.33 0.00 0.00 0.00 178.15 177.83 1xxe h GLU 187 N -0.38 0.12 -0.13 2.37 5.08 -1.77 0.26 114.58 120.12 1xxe h GLU 187 Ca -0.01 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1xxe h GLU 187 Cb 0.34 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.51 1xxe h GLU 187 CO -0.01 0.08 -0.16 1.25 -1.00 0.00 0.00 179.01 179.16 1xxe h HIS 188 N 0.12 -0.42 -0.56 4.33 2.76 -1.68 0.65 115.15 120.35 1xxe h HIS 188 Ca 0.24 0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.49 1xxe h HIS 188 Cb 0.36 0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.49 1xxe h HIS 188 CO -0.30 -0.24 0.38 0.82 -1.30 0.00 0.00 177.93 177.29 1xxe h ILE 189 N -0.21 1.00 0.00 6.26 2.04 0.20 -0.12 117.51 126.69 1xxe h ILE 189 Ca 0.10 -0.19 -0.10 0.00 1.00 0.00 0.00 64.86 65.66 1xxe h ILE 189 Cb 0.35 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 1xxe h ILE 189 CO -0.25 0.10 -0.49 0.11 0.00 0.00 0.00 178.15 177.62 1xxe h LYS 190 N 0.55 0.00 -0.01 2.37 1.79 0.16 -1.79 116.57 119.64 1xxe h LYS 190 Ca 0.24 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.54 1xxe h LYS 190 Cb 0.25 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.89 1xxe h LYS 190 CO -0.07 0.49 -0.78 0.87 -1.08 0.00 0.00 179.45 178.88 1xxe h LYS 191 N 0.00 0.12 -0.31 3.15 1.57 0.21 -2.87 116.57 118.44 1xxe h LYS 191 Ca -0.00 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1xxe h LYS 191 Cb 1.24 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1xxe h LYS 191 CO 0.06 0.84 0.00 1.33 -0.57 0.00 0.00 179.45 181.11 1xxe n VAL 192 N -3.69 0.08 -1.61 0.50 0.24 -0.83 -4.82 118.33 108.20 1xxe n VAL 192 Ca -0.02 -0.06 -0.08 0.00 -2.04 0.00 0.00 64.34 62.14 1xxe n VAL 192 Cb 0.74 -0.12 -0.02 0.00 -1.47 0.00 0.00 33.84 32.97 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 0.41 0.60 3.44 7.63 0.00 -1.08 -5.02 105.19 111.16 1xxe n GLY 193 Ca 0.01 -0.63 -0.23 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.00 2.56 -0.62 0.99 1.43 -0.68 -4.72 118.68 115.65 1xxe s LEU 194 Ca 0.00 -1.00 0.00 0.00 -1.03 0.00 0.00 54.13 52.10 1xxe s LEU 194 Cb 0.00 -1.03 0.00 0.00 0.03 0.00 0.00 46.19 45.19 1xxe s LEU 194 CO 0.00 0.02 0.00 0.61 0.23 0.00 0.00 176.35 177.21 1xxe n GLY 195 N -0.44 0.69 0.20 -3.19 0.00 -1.24 -3.37 105.19 97.84 1xxe n GLY 195 Ca -0.07 -0.75 -0.14 0.00 0.00 0.00 0.00 46.02 45.06 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 -0.41 0.00 1.61 1.57 -0.89 -2.28 116.57 116.18 1xxe h LYS 196 Ca -0.13 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1xxe h LYS 196 Cb 0.56 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.96 1xxe h LYS 196 CO 0.18 -0.17 0.00 0.41 -0.57 0.00 0.00 179.45 179.30 1xxe n GLY 197 N -0.81 -0.63 3.74 3.86 0.00 0.90 -4.78 105.19 107.48 1xxe n GLY 197 Ca -0.10 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.26 2.13 0.31 -0.02 0.00 0.11 -4.62 107.32 102.97 1xxe s GLY 198 Ca 0.19 1.39 0.04 0.00 0.00 0.00 0.00 44.72 46.34 1xxe s GLY 198 CO 0.20 2.41 0.30 -1.35 0.00 0.00 0.00 173.10 174.67 1xxe s SER 199 N 0.54 1.29 0.10 1.64 1.04 -1.26 -5.01 113.70 112.04 1xxe s SER 199 Ca 0.62 -1.64 -0.12 0.00 0.48 0.00 0.00 55.95 55.29 1xxe s SER 199 Cb -0.44 0.56 -0.17 0.00 0.10 0.00 0.00 66.02 66.07 1xxe s SER 199 CO 0.42 -1.08 1.27 -0.07 0.98 0.00 0.00 173.24 174.75 1xxe h LEU 200 N 2.20 0.88 -0.92 2.42 3.38 -1.95 0.56 115.31 121.87 1xxe h LEU 200 Ca -0.27 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 57.07 1xxe h LEU 200 Cb 1.24 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1xxe h LEU 200 CO 0.39 1.43 0.00 1.17 0.09 0.00 0.00 178.44 181.52 1xxe n LYS 201 N -3.88 0.17 0.00 1.13 3.00 -1.26 -2.68 118.16 114.64 1xxe n LYS 201 Ca -0.09 0.50 0.00 0.00 -0.00 0.00 0.00 58.31 58.72 1xxe n LYS 201 Cb 0.81 -1.88 0.00 0.00 0.00 0.00 0.00 35.03 33.95 1xxe n LYS 201 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1xxe n ASN 202 N -2.21 0.82 -3.52 3.14 5.03 -1.15 -4.67 115.26 112.70 1xxe n ASN 202 Ca 0.01 -1.39 -0.13 0.00 0.87 0.00 0.00 54.58 53.93 1xxe n ASN 202 Cb 0.15 0.00 -0.11 0.00 -1.02 0.00 0.00 39.78 38.80 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 -0.39 -0.46 -0.27 3.41 2.01 0.19 -4.12 115.64 116.02 1xxe s THR 203 Ca 0.00 0.04 -0.29 0.00 0.31 0.00 0.00 61.69 61.75 1xxe s THR 203 Cb 0.00 -0.65 -0.00 0.00 0.01 0.00 0.00 72.50 71.86 1xxe s THR 203 CO 0.00 -0.06 1.31 -0.22 -0.69 0.00 0.00 174.62 174.95 1xxe s LEU 204 N 2.44 3.94 -0.19 4.42 2.96 -0.95 -4.26 118.68 127.05 1xxe s LEU 204 Ca 0.06 1.33 -0.06 0.00 -0.22 0.00 0.00 54.13 55.24 1xxe s LEU 204 Cb -0.14 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.98 1xxe s LEU 204 CO -0.12 -1.02 0.02 -0.69 -1.32 0.00 0.00 176.35 173.22 1xxe s VAL 205 N 4.23 4.25 0.10 1.68 1.01 -1.26 -0.15 120.40 130.26 1xxe s VAL 205 Ca 0.57 -0.22 0.06 0.00 0.00 0.00 0.00 61.98 62.39 1xxe s VAL 205 Cb -0.18 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 1xxe s VAL 205 CO 0.22 0.44 -0.05 -0.76 0.00 0.00 0.00 175.10 174.95 1xxe s LEU 206 N 0.71 3.27 0.12 3.92 1.43 -0.24 -2.46 118.68 125.43 1xxe s LEU 206 Ca 0.01 -0.27 0.04 0.00 -1.03 0.00 0.00 54.13 52.88 1xxe s LEU 206 Cb -0.14 -2.03 -0.04 0.00 0.03 0.00 0.00 46.19 44.02 1xxe s LEU 206 CO 0.02 0.18 0.09 -0.83 0.23 0.00 0.00 176.35 176.04 1xxe s GLY 207 N -2.26 1.87 0.42 -3.19 0.00 0.76 -2.34 107.32 102.59 1xxe s GLY 207 Ca 0.24 -1.12 0.28 0.00 0.00 0.00 0.00 44.72 44.12 1xxe s GLY 207 CO 0.16 -1.11 1.60 1.70 0.00 0.00 0.00 173.10 175.45 1xxe h LYS 208 N 2.92 0.05 0.00 2.90 3.64 -1.98 -2.55 116.57 121.56 1xxe h LYS 208 Ca -0.47 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1xxe h LYS 208 Cb 1.18 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1xxe h LYS 208 CO 0.64 0.03 -0.07 -3.47 -2.27 0.00 0.00 179.45 174.31 1xxe n ASP 209 N -4.84 0.00 -3.93 4.20 -0.08 -1.26 -0.75 116.55 109.88 1xxe n ASP 209 Ca 0.38 -1.14 -0.10 0.00 -1.51 0.00 0.00 54.79 52.42 1xxe n ASP 209 Cb 1.43 -0.03 -0.10 0.00 2.34 0.00 0.00 41.12 44.76 1xxe n ASP 209 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 1xxe s LYS 210 N 0.00 0.45 -0.20 -0.67 -2.85 -0.96 -4.99 119.74 110.51 1xxe s LYS 210 Ca 0.00 -0.59 -0.08 0.00 -1.00 0.00 0.00 55.97 54.30 1xxe s LYS 210 Cb 0.00 0.17 -0.04 0.00 -2.06 0.00 0.00 37.83 35.90 1xxe s LYS 210 CO 0.00 -0.10 0.09 0.08 0.10 0.00 0.00 175.35 175.53 1xxe s VAL 211 N -1.78 4.96 -0.05 1.79 1.01 -1.26 0.27 120.40 125.34 1xxe s VAL 211 Ca -0.12 0.03 -0.23 0.00 0.00 0.00 0.00 61.98 61.66 1xxe s VAL 211 Cb -0.06 -3.27 -0.17 0.00 0.00 0.00 0.00 36.38 32.87 1xxe s VAL 211 CO -0.01 0.42 0.93 1.88 0.00 0.00 0.00 175.10 178.32 1xxe h TYR 212 N 7.01 -0.14 -3.40 5.22 -1.99 -1.82 -3.45 116.97 118.41 1xxe h TYR 212 Ca -0.38 -0.00 -0.56 0.00 2.00 0.00 0.00 58.73 59.79 1xxe h TYR 212 Cb 1.17 0.05 0.11 0.00 2.00 0.00 0.00 36.73 40.05 1xxe h TYR 212 CO 0.60 0.36 0.57 0.09 -0.00 0.00 0.00 178.16 179.78 1xxe n ASN 213 N -4.88 2.98 0.06 3.88 5.03 -1.25 -4.90 115.26 116.18 1xxe n ASN 213 Ca -0.08 1.21 -0.07 0.00 0.87 0.00 0.00 54.58 56.51 1xxe n ASN 213 Cb 0.28 -1.51 0.10 0.00 -1.02 0.00 0.00 39.78 37.63 1xxe n ASN 213 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 1xxe h PRO 214 N 2.74 0.35 0.00 3.52 0.13 -1.98 -3.02 132.00 133.73 1xxe h PRO 214 Ca -0.47 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.43 1xxe h PRO 214 Cb 1.27 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1xxe h PRO 214 CO 0.64 0.83 0.00 -1.91 -0.23 0.00 0.00 178.00 177.33 1xxe n GLU 215 N -3.90 0.07 0.00 0.86 2.13 -1.26 -5.00 120.64 113.53 1xxe n GLU 215 Ca -0.03 0.09 0.00 0.00 0.66 0.00 0.00 57.16 57.88 1xxe n GLU 215 Cb 0.61 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.82 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 0.91 -0.76 3.76 8.31 0.00 -1.14 -4.73 105.19 111.54 1xxe n GLY 216 Ca 0.07 -1.12 -0.40 0.00 0.00 0.00 0.00 46.02 44.57 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 4.50 0.15 0.99 1.43 -1.26 -4.92 118.68 119.57 1xxe s LEU 217 Ca 0.00 2.34 0.25 0.00 -1.03 0.00 0.00 54.13 55.69 1xxe s LEU 217 Cb 0.00 -3.67 0.57 0.00 0.03 0.00 0.00 46.19 43.13 1xxe s LEU 217 CO 0.00 -0.25 1.54 0.54 0.23 0.00 0.00 176.35 178.41 1xxe n ARG 218 N 1.03 0.26 -3.76 1.70 1.74 -1.26 -4.80 116.66 111.57 1xxe n ARG 218 Ca -0.00 0.14 -0.13 0.00 -0.77 0.00 0.00 57.85 57.09 1xxe n ARG 218 Cb 0.44 -1.73 -0.13 0.00 -1.02 0.00 0.00 32.46 30.03 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 -3.13 -0.28 -0.10 -1.55 2.02 -1.26 -4.95 117.35 108.11 1xxe s TYR 219 Ca 0.08 0.68 0.05 0.00 -0.37 0.00 0.00 57.07 57.52 1xxe s TYR 219 Cb 0.13 0.05 0.28 0.00 -0.40 0.00 0.00 41.96 42.02 1xxe s TYR 219 CO 0.66 -0.18 0.94 0.39 -1.57 0.00 0.00 175.55 175.79 1xxe n GLU 220 N 3.74 0.04 -2.63 -0.62 1.02 -1.26 0.78 120.64 121.70 1xxe n GLU 220 Ca -0.21 0.40 -0.03 0.00 -0.02 0.00 0.00 57.16 57.30 1xxe n GLU 220 Cb 0.55 -2.01 0.05 0.00 -0.02 0.00 0.00 31.44 30.01 1xxe n GLU 220 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1xxe n ASN 221 N -1.64 1.98 -0.28 1.62 3.02 -1.26 -4.91 115.26 113.79 1xxe n ASN 221 Ca -0.00 -2.26 -0.05 0.00 -0.03 0.00 0.00 54.58 52.24 1xxe n ASN 221 Cb 0.39 -0.45 0.09 0.00 -0.61 0.00 0.00 39.78 39.20 1xxe n ASN 221 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1xxe h GLU 222 N 2.45 1.17 -0.11 3.52 4.22 -0.00 0.19 114.58 126.02 1xxe h GLU 222 Ca -0.08 -0.19 -0.23 0.00 0.08 0.00 0.00 59.36 58.94 1xxe h GLU 222 Cb 1.34 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 30.40 1xxe h GLU 222 CO 0.25 0.92 -0.83 -1.00 -2.18 0.00 0.00 179.01 176.18 1xxe h PRO 223 N 1.15 0.75 0.00 0.92 0.13 -1.88 -2.45 132.00 130.61 1xxe h PRO 223 Ca 0.27 -0.66 -0.08 0.00 -0.87 0.00 0.00 66.00 64.65 1xxe h PRO 223 Cb 0.17 0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.44 1xxe h PRO 223 CO -0.03 1.26 -0.40 -0.39 -0.23 0.00 0.00 178.00 178.21 1xxe h VAL 224 N 0.46 0.77 -0.14 1.56 -1.51 -1.94 -2.59 116.25 112.86 1xxe h VAL 224 Ca -0.07 -1.81 -0.03 0.00 -1.23 0.00 0.00 66.70 63.56 1xxe h VAL 224 Cb 1.47 2.17 -0.00 0.00 -2.13 0.00 0.00 31.29 32.80 1xxe h VAL 224 CO 0.17 0.39 -0.03 0.03 -1.23 0.00 0.00 177.57 176.90 1xxe h ARG 225 N 0.00 0.27 -0.94 5.19 3.08 -0.92 -1.51 114.38 119.55 1xxe h ARG 225 Ca -0.00 -0.10 0.01 0.00 0.07 0.00 0.00 59.98 59.96 1xxe h ARG 225 Cb 1.14 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 31.13 1xxe h ARG 225 CO 0.05 0.55 0.62 1.25 -1.07 0.00 0.00 179.97 181.38 1xxe h HIS 226 N -0.04 1.18 -0.40 3.04 2.76 -1.38 0.02 115.15 120.34 1xxe h HIS 226 Ca 0.04 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.24 1xxe h HIS 226 Cb 0.46 -0.40 -0.02 0.00 1.55 0.00 0.00 27.41 29.00 1xxe h HIS 226 CO 0.05 0.73 0.26 0.87 -1.30 0.00 0.00 177.93 178.54 1xxe h LYS 227 N 1.26 0.51 -0.68 5.26 1.79 -1.22 -1.03 116.57 122.47 1xxe h LYS 227 Ca 0.35 -0.03 -0.02 0.00 -2.18 0.00 0.00 60.65 58.77 1xxe h LYS 227 Cb -0.12 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 30.38 1xxe h LYS 227 CO -0.08 0.34 0.34 0.28 -1.08 0.00 0.00 179.45 179.24 1xxe h VAL 228 N 0.52 1.22 -0.44 0.50 2.07 -0.57 0.16 116.25 119.72 1xxe h VAL 228 Ca 0.15 -0.61 0.06 0.00 0.82 0.00 0.00 66.70 67.12 1xxe h VAL 228 Cb -0.05 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 30.05 1xxe h VAL 228 CO -0.04 0.26 0.13 0.15 0.02 0.00 0.00 177.57 178.09 1xxe h PHE 229 N 0.94 0.22 -0.11 1.57 3.57 -0.32 -1.47 116.94 121.34 1xxe h PHE 229 Ca 0.23 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.60 1xxe h PHE 229 Cb 0.10 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 1xxe h PHE 229 CO 0.00 0.06 -0.62 -0.44 -2.23 0.00 0.00 178.31 175.09 1xxe h ASP 230 N 0.28 0.45 -0.76 0.41 3.32 -0.80 -2.52 116.42 116.79 1xxe h ASP 230 Ca 0.21 -0.26 0.09 0.00 0.02 0.00 0.00 57.03 57.10 1xxe h ASP 230 Cb 0.23 -0.13 -0.05 0.00 0.22 0.00 0.00 39.33 39.60 1xxe h ASP 230 CO -0.24 0.95 0.50 0.25 -1.72 0.00 0.00 179.24 178.98 1xxe h LEU 231 N 0.29 0.62 -0.03 1.55 5.85 0.31 0.27 115.31 124.17 1xxe h LEU 231 Ca -0.01 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1xxe h LEU 231 Cb 1.15 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1xxe h LEU 231 CO 0.11 0.37 -0.08 0.40 -0.34 0.00 0.00 178.44 178.89 1xxe h ILE 232 N 0.69 1.47 -1.14 4.05 2.04 -1.16 -2.00 117.51 121.46 1xxe h ILE 232 Ca 0.35 -1.51 0.32 0.00 1.00 0.00 0.00 64.86 65.02 1xxe h ILE 232 Cb 0.45 2.41 -0.06 0.00 -0.74 0.00 0.00 36.82 38.88 1xxe h ILE 232 CO -0.13 0.41 0.80 1.23 0.00 0.00 0.00 178.15 180.46 1xxe h GLY 233 N -0.47 0.34 1.74 5.37 0.00 -0.75 0.85 103.07 110.15 1xxe h GLY 233 Ca -0.00 -0.05 -0.22 0.00 0.00 0.00 0.00 47.33 47.06 1xxe h GLY 233 CO 0.02 -0.05 -1.12 -0.55 0.00 0.00 0.00 176.54 174.84 1xxe h ASP 234 N 0.10 0.00 1.68 0.19 3.32 -0.76 -3.27 116.42 117.69 1xxe h ASP 234 Ca 0.57 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.56 1xxe h ASP 234 Cb 2.07 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.61 1xxe h ASP 234 CO -0.09 0.94 -0.32 -0.07 -1.72 0.00 0.00 179.24 177.98 1xxe h LEU 235 N 0.00 0.00 0.00 1.55 3.38 0.13 -2.98 115.31 117.38 1xxe h LEU 235 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1xxe h LEU 235 Cb 1.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.53 1xxe h LEU 235 CO 0.11 0.28 0.00 0.00 0.09 0.00 0.00 178.44 178.92 1xxe n TYR 236 N -3.16 0.00 -0.12 1.13 9.36 0.11 -2.84 117.16 121.64 1xxe n TYR 236 Ca 0.03 0.00 0.27 0.00 3.32 0.00 0.00 57.90 61.52 1xxe n TYR 236 Cb 0.65 -0.44 0.71 0.00 -0.63 0.00 0.00 39.34 39.63 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 -1.24 2.98 3.38 -1.64 0.76 115.31 119.56 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 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1xxe h LEU 237 CO 0.00 0.00 0.23 -0.07 0.09 0.00 0.00 178.44 178.69 1xxe h LEU 238 N 0.00 0.00 0.02 1.67 3.38 -1.80 -3.31 115.31 115.28 1xxe h LEU 238 Ca 0.38 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.34 1xxe h LEU 238 Cb 1.71 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.46 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 -1.27 0.47 3.52 0.83 0.00 0.27 -5.00 105.19 104.02 1xxe n GLY 239 Ca -0.01 -0.36 -0.16 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.35 -0.64 0.04 1.61 1.04 -1.25 -4.85 113.70 107.29 1xxe s SER 240 Ca 0.00 0.93 -0.38 0.00 0.48 0.00 0.00 55.95 56.97 1xxe s SER 240 Cb 0.00 0.85 -0.19 0.00 0.10 0.00 0.00 66.02 66.79 1xxe s SER 240 CO 0.00 -0.45 1.16 -2.65 0.98 0.00 0.00 173.24 172.28 1xxe n PRO 241 N 1.65 0.45 -3.63 4.02 -0.02 -1.26 -4.62 135.00 131.59 1xxe n PRO 241 Ca -0.17 0.16 -0.36 0.00 -2.02 0.00 0.00 63.50 61.11 1xxe n PRO 241 Cb 0.56 -1.71 -0.07 0.00 -0.02 0.00 0.00 33.50 32.26 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 0.16 5.34 -0.16 -1.45 1.01 -1.26 -1.30 120.40 122.74 1xxe s VAL 242 Ca 0.88 0.43 0.01 0.00 0.00 0.00 0.00 61.98 63.30 1xxe s VAL 242 Cb -1.14 -3.56 0.01 0.00 0.00 0.00 0.00 36.38 31.68 1xxe s VAL 242 CO 0.53 0.45 -0.18 -0.54 0.00 0.00 0.00 175.10 175.36 1xxe s LYS 243 N 0.12 3.12 0.00 2.72 -0.14 0.18 -4.56 119.74 121.18 1xxe s LYS 243 Ca 0.15 -0.79 0.00 0.00 -1.36 0.00 0.00 55.97 53.96 1xxe s LYS 243 Cb -0.13 -2.58 0.00 0.00 -1.68 0.00 0.00 37.83 33.44 1xxe s LYS 243 CO 0.03 -0.06 0.00 0.41 -0.76 0.00 0.00 175.35 174.97 1xxe n GLY 244 N 4.24 1.37 3.42 -3.33 0.00 -1.16 -1.94 105.19 107.79 1xxe n GLY 244 Ca -0.20 -1.21 -0.39 0.00 0.00 0.00 0.00 46.02 44.22 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 -1.98 3.22 0.08 1.61 2.20 0.15 -2.14 119.74 122.88 1xxe s LYS 245 Ca 0.00 -0.80 0.06 0.00 -0.36 0.00 0.00 55.97 54.87 1xxe s LYS 245 Cb 0.00 -3.60 -0.04 0.00 -1.51 0.00 0.00 37.83 32.68 1xxe s LYS 245 CO 0.00 -0.48 -0.10 -0.06 -0.36 0.00 0.00 175.35 174.35 1xxe s PHE 246 N 1.60 2.76 0.03 4.03 0.40 0.31 -0.19 117.98 126.91 1xxe s PHE 246 Ca 0.04 -0.14 0.04 0.00 -0.60 0.00 0.00 56.93 56.27 1xxe s PHE 246 Cb -0.18 -1.47 -0.02 0.00 0.51 0.00 0.00 43.02 41.87 1xxe s PHE 246 CO 0.06 0.41 -0.13 -0.47 0.70 0.00 0.00 175.22 175.79 1xxe s TYR 247 N -1.16 1.17 -0.05 0.36 6.14 0.48 -0.62 117.35 123.66 1xxe s TYR 247 Ca 0.20 -0.32 -0.02 0.00 0.64 0.00 0.00 57.07 57.58 1xxe s TYR 247 Cb -0.11 -0.71 0.04 0.00 0.42 0.00 0.00 41.96 41.60 1xxe s TYR 247 CO 0.12 0.02 0.11 0.45 0.64 0.00 0.00 175.55 176.89 1xxe s SER 248 N -0.91 -0.01 -0.27 4.32 0.15 0.15 -1.09 113.70 116.04 1xxe s SER 248 Ca 0.02 0.21 -0.04 0.00 0.70 0.00 0.00 55.95 56.85 1xxe s SER 248 Cb -0.07 0.10 0.02 0.00 -1.71 0.00 0.00 66.02 64.36 1xxe s SER 248 CO 0.01 -0.15 0.00 0.12 1.20 0.00 0.00 173.24 174.42 1xxe s PHE 249 N 1.19 3.11 -1.28 3.44 5.36 -0.23 -0.05 117.98 129.53 1xxe s PHE 249 Ca -0.09 -1.32 -0.08 0.00 -0.96 0.00 0.00 56.93 54.49 1xxe s PHE 249 Cb -0.12 -2.15 -0.00 0.00 -0.34 0.00 0.00 43.02 40.41 1xxe s PHE 249 CO -0.05 -0.67 0.63 0.54 -1.46 0.00 0.00 175.22 174.22 1xxe n ARG 250 N 4.75 -2.88 -2.53 10.12 1.74 -0.46 -2.29 116.66 125.11 1xxe n ARG 250 Ca -0.15 0.48 -0.41 0.00 -0.77 0.00 0.00 57.85 57.00 1xxe n ARG 250 Cb 0.47 -4.55 -0.04 0.00 -1.02 0.00 0.00 32.46 27.32 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 -4.02 2.92 0.19 -0.13 0.00 -1.26 -4.32 107.32 100.70 1xxe s GLY 251 Ca 0.19 0.80 0.08 0.00 0.00 0.00 0.00 44.72 45.79 1xxe s GLY 251 CO 0.86 1.58 -0.01 -0.32 0.00 0.00 0.00 173.10 175.21 1xxe s GLY 252 N -0.33 1.71 0.20 0.20 0.00 -1.26 -4.98 107.32 102.86 1xxe s GLY 252 Ca 0.48 -1.43 -0.12 0.00 0.00 0.00 0.00 44.72 43.65 1xxe s GLY 252 CO 0.36 -1.45 1.71 0.45 0.00 0.00 0.00 173.10 174.17 1xxe h HIS 253 N 2.59 0.18 0.41 1.90 3.86 -1.96 0.28 115.15 122.41 1xxe h HIS 253 Ca -0.47 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 58.76 1xxe h HIS 253 Cb 1.21 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.67 1xxe h HIS 253 CO 0.63 -0.01 -0.28 1.03 0.86 0.00 0.00 177.93 180.17 1xxe h SER 254 N 0.25 -0.71 -0.89 2.45 0.87 -1.90 -0.81 113.55 112.82 1xxe h SER 254 Ca 0.27 0.05 0.15 0.00 -1.23 0.00 0.00 61.79 61.03 1xxe h SER 254 Cb 0.38 0.22 -0.07 0.00 -0.44 0.00 0.00 62.40 62.49 1xxe h SER 254 CO -0.35 -0.43 0.58 0.25 -0.53 0.00 0.00 176.83 176.34 1xxe h LEU 255 N -0.67 0.64 0.42 2.23 5.85 -1.76 -1.44 115.31 120.59 1xxe h LEU 255 Ca -0.04 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1xxe h LEU 255 Cb 0.56 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.51 1xxe h LEU 255 CO 0.03 0.32 -0.20 0.78 -0.34 0.00 0.00 178.44 179.02 1xxe h ASN 256 N 0.68 -0.48 -0.86 1.25 -0.26 0.46 -2.25 115.58 114.12 1xxe h ASN 256 Ca 0.45 -0.02 0.17 0.00 -0.56 0.00 0.00 56.30 56.34 1xxe h ASN 256 Cb 0.74 0.12 -0.10 0.00 -1.06 0.00 0.00 38.32 38.02 1xxe h ASN 256 CO -0.21 -0.30 0.42 0.58 -1.06 0.00 0.00 177.43 176.87 1xxe h VAL 257 N -0.62 0.65 -0.23 2.81 2.07 -0.16 -0.14 116.25 120.63 1xxe h VAL 257 Ca -0.06 -0.19 0.04 0.00 0.82 0.00 0.00 66.70 67.32 1xxe h VAL 257 Cb 0.46 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 30.25 1xxe h VAL 257 CO 0.09 0.10 -0.03 0.50 0.02 0.00 0.00 177.57 178.25 1xxe h LYS 258 N 0.55 0.03 -0.88 1.57 3.64 -0.93 0.53 116.57 121.09 1xxe h LYS 258 Ca 0.49 -0.00 0.15 0.00 -1.27 0.00 0.00 60.65 60.02 1xxe h LYS 258 Cb 0.77 -0.01 -0.10 0.00 -0.41 0.00 0.00 32.23 32.49 1xxe h LYS 258 CO -0.41 0.02 0.47 1.25 -2.27 0.00 0.00 179.45 178.51 1xxe h LEU 259 N 0.03 0.57 -0.13 5.20 5.85 -0.47 0.52 115.31 126.90 1xxe h LEU 259 Ca 0.11 0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.86 1xxe h LEU 259 Cb 0.16 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 1xxe h LEU 259 CO -0.22 0.24 -0.18 0.58 -0.34 0.00 0.00 178.44 178.52 1xxe h VAL 260 N 0.65 1.37 -0.24 1.05 2.07 -0.57 -2.38 116.25 118.20 1xxe h VAL 260 Ca 0.48 -1.40 0.06 0.00 0.82 0.00 0.00 66.70 66.66 1xxe h VAL 260 Cb 0.68 1.99 -0.06 0.00 -1.52 0.00 0.00 31.29 32.38 1xxe h VAL 260 CO -0.36 0.41 -0.15 0.50 0.02 0.00 0.00 177.57 177.98 1xxe h LYS 261 N -0.06 -0.13 0.34 1.57 3.64 0.14 0.49 116.57 122.56 1xxe h LYS 261 Ca 0.01 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1xxe h LYS 261 Cb 0.74 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1xxe h LYS 261 CO 0.04 -0.09 -0.16 1.49 -2.27 0.00 0.00 179.45 178.46 1xxe h GLU 262 N -0.14 -0.44 -0.84 1.90 4.57 -0.99 0.13 114.58 118.77 1xxe h GLU 262 Ca 0.13 0.03 0.09 0.00 -1.18 0.00 0.00 59.36 58.43 1xxe h GLU 262 Cb 0.34 0.10 -0.07 0.00 -0.16 0.00 0.00 28.75 28.96 1xxe h GLU 262 CO -0.33 -0.25 0.49 -0.07 -1.18 0.00 0.00 179.01 177.67 1xxe h LEU 263 N -0.54 0.72 -0.80 1.64 3.38 -1.07 0.54 115.31 119.18 1xxe h LEU 263 Ca -0.05 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1xxe h LEU 263 Cb 0.40 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1xxe h LEU 263 CO 0.08 0.42 0.04 0.00 0.09 0.00 0.00 178.44 179.07 1xxe h ALA 264 N 1.45 1.00 -0.00 1.53 0.00 0.30 -2.37 119.26 121.18 1xxe h ALA 264 Ca 0.40 -0.27 -0.17 0.00 0.00 0.00 0.00 54.91 54.87 1xxe h ALA 264 Cb 0.33 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1xxe h ALA 264 CO -0.23 0.62 -0.79 0.87 0.00 0.00 0.00 179.25 179.71 1xxe h LYS 265 N 0.88 0.01 -0.36 0.00 1.57 0.71 -2.71 116.57 116.67 1xxe h LYS 265 Ca 0.17 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.92 1xxe h LYS 265 Cb 0.46 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 1xxe h LYS 265 CO 0.02 0.80 0.16 0.87 -0.57 0.00 0.00 179.45 180.73 1xxe h LYS 266 N 0.01 0.53 -0.34 3.15 1.57 0.45 -2.34 116.57 119.60 1xxe h LYS 266 Ca -0.01 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1xxe h LYS 266 Cb 1.40 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.62 1xxe h LYS 266 CO 0.10 0.50 0.00 0.94 -0.57 0.00 0.00 179.45 180.42 1xxe n GLN 267 N -4.70 1.80 0.03 3.15 -0.06 -0.93 -3.80 117.38 112.87 1xxe n GLN 267 Ca -0.01 -1.24 0.07 0.00 -2.00 0.00 0.00 57.00 53.83 1xxe n GLN 267 Cb 0.12 -1.28 -0.09 0.00 -4.06 0.00 0.00 30.24 24.94 1xxe n GLN 267 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 1xxe n LYS 268 N 0.50 0.63 0.43 3.69 3.00 -0.88 -4.37 118.16 121.17 1xxe n LYS 268 Ca 0.12 0.02 -0.19 0.00 -0.00 0.00 0.00 58.31 58.26 1xxe n LYS 268 Cb 0.29 -1.69 -0.09 0.00 0.00 0.00 0.00 35.03 33.54 1xxe n LYS 268 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 1xxe h LEU 269 N 0.00 -0.92 0.00 3.14 3.38 -1.65 -3.51 115.31 115.75 1xxe h LEU 269 Ca -0.08 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1xxe h LEU 269 Cb 1.23 0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.22 1xxe h LEU 269 CO 0.01 -0.64 0.00 0.41 0.09 0.00 0.00 178.44 178.31