#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xxe n GLU 4 N 0.00 0.55 -4.36 3.23 1.02 0.28 -4.71 120.64 116.65 1xxe n GLU 4 Ca 0.00 0.24 -0.20 0.00 -0.02 0.00 0.00 57.16 57.18 1xxe n GLU 4 Cb 0.00 -2.13 -0.13 0.00 -0.02 0.00 0.00 31.44 29.16 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 -3.07 0.96 0.32 3.49 2.20 -1.25 -1.32 119.74 121.07 1xxe s LYS 5 Ca 0.73 -0.78 0.01 0.00 -0.36 0.00 0.00 55.97 55.57 1xxe s LYS 5 Cb -0.36 -0.98 -0.01 0.00 -1.51 0.00 0.00 37.83 34.97 1xxe s LYS 5 CO 0.51 0.24 0.37 -0.08 -0.36 0.00 0.00 175.35 176.03 1xxe s THR 6 N -0.87 0.00 0.31 3.43 -1.32 -0.58 -1.91 115.64 114.70 1xxe s THR 6 Ca 0.02 -1.78 -0.20 0.00 -1.21 0.00 0.00 61.69 58.52 1xxe s THR 6 Cb -0.08 -2.56 -0.09 0.00 -1.51 0.00 0.00 72.50 68.26 1xxe s THR 6 CO 0.01 0.00 0.81 0.68 -2.21 0.00 0.00 174.62 173.91 1xxe s VAL 7 N -3.33 4.50 -0.03 5.08 -7.23 -1.26 0.37 120.40 118.50 1xxe s VAL 7 Ca 0.35 1.32 -0.15 0.00 -1.81 0.00 0.00 61.98 61.69 1xxe s VAL 7 Cb 0.01 -3.77 -0.32 0.00 0.56 0.00 0.00 36.38 32.87 1xxe s VAL 7 CO 0.22 -0.02 0.79 0.50 -0.31 0.00 0.00 175.10 176.28 1xxe h LYS 8 N 2.76 0.41 -5.36 4.82 3.64 0.16 -3.41 116.57 119.59 1xxe h LYS 8 Ca -0.48 -0.70 -0.40 0.00 -1.27 0.00 0.00 60.65 57.80 1xxe h LYS 8 Cb 1.18 0.26 -0.18 0.00 -0.41 0.00 0.00 32.23 33.09 1xxe h LYS 8 CO 0.64 1.34 -0.75 -1.21 -2.27 0.00 0.00 179.45 177.20 1xxe s GLU 9 N -2.55 1.02 0.24 1.90 2.02 -1.25 -4.96 118.70 115.11 1xxe s GLU 9 Ca -0.14 -1.25 -0.31 0.00 0.02 0.00 0.00 54.97 53.29 1xxe s GLU 9 Cb 0.04 -0.86 -0.11 0.00 0.10 0.00 0.00 34.13 33.31 1xxe s GLU 9 CO 0.87 0.16 1.56 0.21 0.02 0.00 0.00 175.26 178.07 1xxe s LYS 10 N -2.77 4.19 0.31 1.61 2.20 -1.26 -4.84 119.74 119.17 1xxe s LYS 10 Ca 0.09 2.44 0.11 0.00 -0.36 0.00 0.00 55.97 58.26 1xxe s LYS 10 Cb -0.04 -3.09 -0.06 0.00 -1.51 0.00 0.00 37.83 33.14 1xxe s LYS 10 CO 0.03 -0.58 -0.15 -0.51 -0.36 0.00 0.00 175.35 173.78 1xxe s LEU 11 N 0.15 2.67 0.00 5.43 1.02 -0.60 -4.95 118.68 122.40 1xxe s LEU 11 Ca 0.65 -1.08 -0.27 0.00 0.02 0.00 0.00 54.13 53.45 1xxe s LEU 11 Cb -0.45 -1.08 0.06 0.00 0.02 0.00 0.00 46.19 44.74 1xxe s LEU 11 CO 0.40 -0.06 0.61 -0.94 0.02 0.00 0.00 176.35 176.38 1xxe s SER 12 N -3.56 -0.56 0.28 2.29 1.04 -1.26 -0.48 113.70 111.45 1xxe s SER 12 Ca 0.31 0.45 0.02 0.00 0.48 0.00 0.00 55.95 57.21 1xxe s SER 12 Cb -0.02 0.52 -0.05 0.00 0.10 0.00 0.00 66.02 66.57 1xxe s SER 12 CO 0.16 -0.67 0.12 -0.36 0.98 0.00 0.00 173.24 173.46 1xxe s PHE 13 N -1.83 1.56 -0.13 5.02 0.40 -0.39 -4.95 117.98 117.66 1xxe s PHE 13 Ca -0.08 -1.25 -0.11 0.00 -0.60 0.00 0.00 56.93 54.89 1xxe s PHE 13 Cb -0.01 -0.89 0.04 0.00 0.51 0.00 0.00 43.02 42.67 1xxe s PHE 13 CO 0.04 -0.40 0.35 -1.83 0.70 0.00 0.00 175.22 174.08 1xxe s GLU 14 N -3.96 0.38 0.00 0.44 -1.05 -1.26 -1.67 118.70 111.59 1xxe s GLU 14 Ca 0.37 0.53 0.00 0.00 -0.15 0.00 0.00 54.97 55.72 1xxe s GLU 14 Cb 0.07 0.14 0.00 0.00 -0.44 0.00 0.00 34.13 33.89 1xxe s GLU 14 CO 0.15 -0.07 0.00 0.41 0.95 0.00 0.00 175.26 176.69 1xxe n GLY 15 N 3.21 1.75 3.83 -3.83 0.00 -0.69 -4.89 105.19 104.56 1xxe n GLY 15 Ca -0.16 -0.78 -0.36 0.00 0.00 0.00 0.00 46.02 44.73 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 4.73 0.36 1.61 0.11 -1.26 -1.61 120.40 122.35 1xxe s VAL 16 Ca 0.00 1.03 -0.28 0.00 -2.93 0.00 0.00 61.98 59.81 1xxe s VAL 16 Cb 0.00 -3.79 -0.10 0.00 -1.53 0.00 0.00 36.38 30.96 1xxe s VAL 16 CO 0.00 0.25 1.30 -0.83 -3.33 0.00 0.00 175.10 172.49 1xxe s GLY 17 N -1.66 2.97 0.17 6.54 0.00 -0.82 -2.39 107.32 112.13 1xxe s GLY 17 Ca 0.39 1.25 -0.13 0.00 0.00 0.00 0.00 44.72 46.23 1xxe s GLY 17 CO 0.20 1.87 1.76 1.19 0.00 0.00 0.00 173.10 178.12 1xxe h ILE 18 N 2.81 1.20 0.15 0.90 2.10 -1.81 -0.14 117.51 122.72 1xxe h ILE 18 Ca -0.49 -0.55 -0.35 0.00 1.08 0.00 0.00 64.86 64.54 1xxe h ILE 18 Cb 1.23 0.52 -0.01 0.00 -1.09 0.00 0.00 36.82 37.48 1xxe h ILE 18 CO 0.64 0.22 -1.86 0.45 -1.08 0.00 0.00 178.15 176.52 1xxe h HIS 19 N 0.76 0.56 -0.42 2.19 -0.00 -1.87 3.42 115.15 119.79 1xxe h HIS 19 Ca 0.20 -0.41 -0.14 0.00 -0.00 0.00 0.00 60.37 60.01 1xxe h HIS 19 Cb 0.10 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.48 1xxe h HIS 19 CO -0.01 1.70 -0.29 1.79 -0.00 0.00 0.00 177.93 181.12 1xxe h THR 20 N 0.08 1.27 -0.25 2.45 1.35 -1.92 -2.15 112.91 113.74 1xxe h THR 20 Ca -0.38 -1.46 -0.11 0.00 -0.55 0.00 0.00 66.41 63.91 1xxe h THR 20 Cb 2.06 1.29 -0.04 0.00 -1.73 0.00 0.00 68.15 69.73 1xxe h THR 20 CO 0.13 0.49 -0.10 0.61 -0.25 0.00 0.00 175.52 176.41 1xxe n GLY 21 N 0.03 0.78 3.56 5.82 0.00 -0.06 -4.60 105.19 110.71 1xxe n GLY 21 Ca -0.01 -0.55 -0.28 0.00 0.00 0.00 0.00 46.02 45.18 1xxe n GLY 21 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1xxe s GLU 22 N -2.12 2.03 0.29 1.61 4.04 -1.26 -4.85 118.70 118.44 1xxe s GLU 22 Ca 0.00 -1.19 -0.29 0.00 0.04 0.00 0.00 54.97 53.52 1xxe s GLU 22 Cb 0.00 -2.19 -0.10 0.00 0.02 0.00 0.00 34.13 31.87 1xxe s GLU 22 CO 0.00 0.46 1.17 -0.47 -1.84 0.00 0.00 175.26 174.58 1xxe s TYR 23 N -1.49 3.40 0.07 4.83 5.04 -1.26 -1.94 117.35 125.99 1xxe s TYR 23 Ca 0.23 1.59 -0.09 0.00 -2.44 0.00 0.00 57.07 56.36 1xxe s TYR 23 Cb -0.10 -3.42 0.00 0.00 0.35 0.00 0.00 41.96 38.79 1xxe s TYR 23 CO 0.14 -1.02 0.20 0.45 -1.34 0.00 0.00 175.55 173.98 1xxe s SER 24 N -0.69 0.08 0.17 4.32 0.15 -0.63 -4.86 113.70 112.25 1xxe s SER 24 Ca 0.46 -0.52 0.07 0.00 0.70 0.00 0.00 55.95 56.67 1xxe s SER 24 Cb -0.35 0.32 -0.04 0.00 -1.71 0.00 0.00 66.02 64.24 1xxe s SER 24 CO 0.45 -0.66 -0.15 -0.75 1.20 0.00 0.00 173.24 173.33 1xxe s LYS 25 N -3.29 1.24 0.04 5.44 2.20 -0.91 -1.71 119.74 122.74 1xxe s LYS 25 Ca 0.01 -1.46 0.06 0.00 -0.36 0.00 0.00 55.97 54.21 1xxe s LYS 25 Cb 0.02 -1.10 -0.02 0.00 -1.51 0.00 0.00 37.83 35.22 1xxe s LYS 25 CO -0.08 0.20 -0.18 -0.51 -0.36 0.00 0.00 175.35 174.42 1xxe s LEU 26 N -2.97 2.16 -0.02 5.43 1.43 -0.67 -1.65 118.68 122.39 1xxe s LEU 26 Ca 0.18 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1xxe s LEU 26 Cb -0.03 -0.85 0.02 0.00 0.03 0.00 0.00 46.19 45.37 1xxe s LEU 26 CO 0.06 0.12 0.00 -0.63 0.23 0.00 0.00 176.35 176.13 1xxe s ILE 27 N -0.79 0.10 -0.11 -0.59 1.01 -0.52 -1.26 121.20 119.04 1xxe s ILE 27 Ca 0.05 0.09 0.03 0.00 0.00 0.00 0.00 60.65 60.82 1xxe s ILE 27 Cb -0.08 -0.18 0.01 0.00 0.01 0.00 0.00 42.46 42.21 1xxe s ILE 27 CO 0.01 0.10 -0.22 -0.63 0.00 0.00 0.00 174.94 174.21 1xxe s ILE 28 N 0.79 1.96 0.09 2.92 1.01 0.37 0.57 121.20 128.90 1xxe s ILE 28 Ca -0.07 -0.94 0.08 0.00 0.00 0.00 0.00 60.65 59.71 1xxe s ILE 28 Cb -0.10 -1.71 -0.03 0.00 0.01 0.00 0.00 42.46 40.62 1xxe s ILE 28 CO -0.02 0.53 -0.20 -1.00 0.00 0.00 0.00 174.94 174.26 1xxe s HIS 29 N 0.56 1.72 0.85 3.97 3.76 -0.97 -1.55 115.29 123.62 1xxe s HIS 29 Ca -0.14 -0.41 -0.12 0.00 -0.15 0.00 0.00 55.06 54.24 1xxe s HIS 29 Cb -0.17 -0.96 0.11 0.00 1.11 0.00 0.00 32.58 32.67 1xxe s HIS 29 CO 0.04 0.17 1.18 -1.25 -0.85 0.00 0.00 174.74 174.03 1xxe s PRO 30 N -1.75 1.40 0.14 8.40 0.04 -1.26 -2.00 135.00 139.97 1xxe s PRO 30 Ca 0.06 1.67 0.01 0.00 0.04 0.00 0.00 61.00 62.78 1xxe s PRO 30 Cb -0.10 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 1xxe s PRO 30 CO 0.04 -2.37 -0.02 -1.21 0.04 0.00 0.00 177.00 173.48 1xxe s GLU 31 N -4.35 0.99 0.61 4.56 0.41 -1.25 -4.66 118.70 114.99 1xxe s GLU 31 Ca 0.70 -1.45 -0.18 0.00 -0.41 0.00 0.00 54.97 53.63 1xxe s GLU 31 Cb -0.26 -0.18 -0.03 0.00 -1.78 0.00 0.00 34.13 31.88 1xxe s GLU 31 CO 0.53 -0.11 1.21 0.21 -0.49 0.00 0.00 175.26 176.62 1xxe s LYS 32 N -3.90 2.89 0.53 1.61 2.20 -1.26 -4.87 119.74 116.93 1xxe s LYS 32 Ca 0.19 1.83 -0.19 0.00 -0.36 0.00 0.00 55.97 57.45 1xxe s LYS 32 Cb 0.06 -1.92 -0.10 0.00 -1.51 0.00 0.00 37.83 34.36 1xxe s LYS 32 CO 0.00 -1.28 0.49 -1.91 -0.36 0.00 0.00 175.35 172.29 1xxe n GLU 33 N -1.70 0.50 -2.04 4.03 0.00 -1.26 -1.82 120.64 118.35 1xxe n GLU 33 Ca 0.14 0.19 -0.21 0.00 0.00 0.00 0.00 57.16 57.28 1xxe n GLU 33 Cb 0.50 -1.61 -0.05 0.00 0.00 0.00 0.00 31.44 30.28 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 1.83 0.63 0.12 8.31 0.00 -1.26 -4.86 105.19 109.96 1xxe n GLY 34 Ca 0.11 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 1xxe n GLY 34 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xxe h THR 35 N 0.00 1.40 0.00 2.61 2.02 -1.58 -3.50 112.91 113.86 1xxe h THR 35 Ca -0.46 -2.91 0.00 0.00 0.77 0.00 0.00 66.41 63.81 1xxe h THR 35 Cb 1.36 2.98 0.00 0.00 -1.74 0.00 0.00 68.15 70.76 1xxe h THR 35 CO 0.60 0.86 0.00 0.61 0.37 0.00 0.00 175.52 177.96 1xxe n GLY 36 N 1.62 -2.34 3.62 2.16 0.00 -0.07 -4.87 105.19 105.31 1xxe n GLY 36 Ca -0.12 -1.90 -0.37 0.00 0.00 0.00 0.00 46.02 43.63 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 -0.27 5.27 0.01 -0.61 -1.09 -1.24 -2.25 121.20 121.02 1xxe s ILE 37 Ca 0.00 0.15 0.00 0.00 -2.23 0.00 0.00 60.65 58.57 1xxe s ILE 37 Cb 0.00 -3.48 -0.01 0.00 -1.58 0.00 0.00 42.46 37.39 1xxe s ILE 37 CO 0.00 0.30 -0.02 0.00 -1.23 0.00 0.00 174.94 173.99 1xxe s ARG 38 N 1.40 0.17 0.13 2.79 1.70 -1.04 -1.49 118.95 122.61 1xxe s ARG 38 Ca 0.07 -0.26 0.03 0.00 -0.47 0.00 0.00 55.73 55.10 1xxe s ARG 38 Cb -0.15 -0.02 -0.04 0.00 -0.57 0.00 0.00 34.95 34.18 1xxe s ARG 38 CO 0.07 -0.00 0.23 -0.06 -1.08 0.00 0.00 175.30 174.46 1xxe s PHE 39 N -0.56 3.40 0.08 5.89 0.08 -0.49 -1.71 117.98 124.68 1xxe s PHE 39 Ca -0.06 0.11 0.08 0.00 0.12 0.00 0.00 56.93 57.19 1xxe s PHE 39 Cb -0.04 -1.65 -0.03 0.00 -0.57 0.00 0.00 43.02 40.73 1xxe s PHE 39 CO -0.00 0.53 -0.22 0.12 -0.10 0.00 0.00 175.22 175.55 1xxe s PHE 40 N -1.67 1.86 -0.29 0.36 2.19 -0.69 0.35 117.98 120.08 1xxe s PHE 40 Ca 0.34 -0.40 -0.19 0.00 0.33 0.00 0.00 56.93 57.01 1xxe s PHE 40 Cb -0.11 -1.05 0.17 0.00 -1.31 0.00 0.00 43.02 40.71 1xxe s PHE 40 CO 0.27 0.17 1.16 0.21 1.83 0.00 0.00 175.22 178.86 1xxe s LYS 41 N -1.63 0.24 -1.18 10.12 2.20 -0.00 -1.66 119.74 127.83 1xxe s LYS 41 Ca 0.08 0.36 0.00 0.00 -0.36 0.00 0.00 55.97 56.05 1xxe s LYS 41 Cb -0.10 0.07 0.00 0.00 -1.51 0.00 0.00 37.83 36.30 1xxe s LYS 41 CO 0.03 -0.04 0.00 0.27 -0.36 0.00 0.00 175.35 175.25 1xxe n ASN 42 N 2.88 -4.18 0.00 1.43 6.94 -1.26 0.60 115.26 121.66 1xxe n ASN 42 Ca -0.16 0.17 0.00 0.00 -0.02 0.00 0.00 54.58 54.58 1xxe n ASN 42 Cb 0.57 -3.55 0.00 0.00 -2.36 0.00 0.00 39.78 34.43 1xxe n ASN 42 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1xxe n GLY 43 N -0.81 2.87 3.84 4.83 0.00 -1.26 -4.99 105.19 109.66 1xxe n GLY 43 Ca -0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.98 5.12 0.04 1.61 1.01 0.20 -5.08 120.40 120.32 1xxe s VAL 44 Ca 0.00 0.73 -0.06 0.00 0.00 0.00 0.00 61.98 62.66 1xxe s VAL 44 Cb 0.00 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 1xxe s VAL 44 CO 0.00 0.57 0.28 -0.31 0.00 0.00 0.00 175.10 175.65 1xxe s TYR 45 N -0.96 3.55 -0.32 5.22 1.51 -1.26 -0.82 117.35 124.27 1xxe s TYR 45 Ca 0.22 0.54 -0.02 0.00 -1.01 0.00 0.00 57.07 56.80 1xxe s TYR 45 Cb -0.16 -1.97 0.11 0.00 -0.11 0.00 0.00 41.96 39.83 1xxe s TYR 45 CO 0.11 0.58 0.15 0.42 -1.11 0.00 0.00 175.55 175.70 1xxe s ILE 46 N -1.39 0.22 0.33 2.71 1.01 0.15 -4.91 121.20 119.32 1xxe s ILE 46 Ca 0.31 -1.19 -0.27 0.00 0.00 0.00 0.00 60.65 59.50 1xxe s ILE 46 Cb -0.13 -1.18 -0.13 0.00 0.01 0.00 0.00 42.46 41.03 1xxe s ILE 46 CO 0.19 -0.79 0.98 -2.65 0.00 0.00 0.00 174.94 172.67 1xxe n PRO 47 N 4.80 1.32 -3.04 2.79 -0.02 -1.26 -1.39 135.00 138.20 1xxe n PRO 47 Ca -0.00 0.47 -0.44 0.00 -2.02 0.00 0.00 63.50 61.50 1xxe n PRO 47 Cb 0.40 -1.88 -0.01 0.00 -0.02 0.00 0.00 33.50 32.00 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 -1.14 3.92 0.05 3.55 0.00 -0.55 -4.81 121.76 122.77 1xxe s ALA 48 Ca 0.60 -3.24 -0.02 0.00 0.00 0.00 0.00 51.96 49.29 1xxe s ALA 48 Cb -0.66 -3.96 -0.03 0.00 0.00 0.00 0.00 23.12 18.47 1xxe s ALA 48 CO 0.59 -2.70 0.01 1.03 0.00 0.00 0.00 175.76 174.69 1xxe s ARG 49 N 1.37 0.58 0.16 0.00 0.52 -1.26 -4.57 118.95 115.76 1xxe s ARG 49 Ca 0.35 -1.03 -0.17 0.00 -0.52 0.00 0.00 55.73 54.37 1xxe s ARG 49 Cb -0.05 0.21 0.09 0.00 0.52 0.00 0.00 34.95 35.72 1xxe s ARG 49 CO -0.05 -0.12 1.68 1.12 0.02 0.00 0.00 175.30 177.94 1xxe h HIS 50 N 3.43 -0.16 0.00 -0.53 2.07 -1.93 0.24 115.15 118.26 1xxe h HIS 50 Ca -0.33 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.22 1xxe h HIS 50 Cb 1.16 0.13 0.00 0.00 2.57 0.00 0.00 27.41 31.28 1xxe h HIS 50 CO 0.54 -0.15 0.47 0.93 -3.07 0.00 0.00 177.93 176.65 1xxe h GLU 51 N 0.02 0.00 -0.41 5.12 5.08 -1.97 1.70 114.58 124.13 1xxe h GLU 51 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1xxe h GLU 51 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1xxe h GLU 51 CO -0.38 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 178.82 1xxe n PHE 52 N -2.24 0.53 -1.94 4.33 3.01 0.85 -4.93 117.46 117.06 1xxe n PHE 52 Ca -0.01 -0.26 -0.42 0.00 1.01 0.00 0.00 57.45 57.77 1xxe n PHE 52 Cb 0.49 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.93 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 -1.47 2.71 -0.03 -4.37 1.01 0.58 -2.04 120.40 116.78 1xxe s VAL 53 Ca 0.38 0.47 0.03 0.00 0.00 0.00 0.00 61.98 62.87 1xxe s VAL 53 Cb 0.22 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 1xxe s VAL 53 CO 0.30 0.03 0.02 1.33 0.00 0.00 0.00 175.10 176.78 1xxe n VAL 54 N 4.08 0.22 -3.66 2.92 0.24 -1.03 -4.86 118.33 116.24 1xxe n VAL 54 Ca 0.14 -0.14 -0.08 0.00 -2.04 0.00 0.00 64.34 62.22 1xxe n VAL 54 Cb 0.39 -0.84 -0.09 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 -2.09 -0.81 -0.11 6.34 5.65 -1.20 -5.05 115.29 118.02 1xxe s HIS 55 Ca -0.02 1.56 0.00 0.00 0.25 0.00 0.00 55.06 56.86 1xxe s HIS 55 Cb 0.01 0.35 -0.02 0.00 -1.18 0.00 0.00 32.58 31.74 1xxe s HIS 55 CO 0.14 -0.47 -0.12 0.95 -0.65 0.00 0.00 174.74 174.59 1xxe s THR 56 N 2.33 3.18 0.00 0.89 -4.23 -1.26 -1.82 115.64 114.73 1xxe s THR 56 Ca -0.04 -0.63 0.00 0.00 -1.18 0.00 0.00 61.69 59.84 1xxe s THR 56 Cb -0.11 -2.32 0.00 0.00 1.34 0.00 0.00 72.50 71.41 1xxe s THR 56 CO -0.14 0.54 0.00 -3.20 -0.54 0.00 0.00 174.62 171.29 1xxe n ASN 57 N 3.14 0.00 0.12 3.99 2.85 -1.26 -4.84 115.26 119.25 1xxe n ASN 57 Ca -0.18 0.00 0.03 0.00 -0.11 0.00 0.00 54.58 54.32 1xxe n ASN 57 Cb 0.53 0.00 0.16 0.00 1.24 0.00 0.00 39.78 41.71 1xxe n ASN 57 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1xxe n HIS 58 N 0.00 0.20 -4.25 1.20 8.25 -1.26 -4.38 115.22 114.98 1xxe n HIS 58 Ca 0.00 0.10 -0.14 0.00 -0.26 0.00 0.00 57.72 57.43 1xxe n HIS 58 Cb 0.00 -0.34 -0.10 0.00 1.12 0.00 0.00 29.99 30.67 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 -2.87 1.12 -0.24 0.41 0.15 -1.26 -5.00 113.70 106.01 1xxe s SER 59 Ca -0.01 -1.22 -0.08 0.00 0.70 0.00 0.00 55.95 55.34 1xxe s SER 59 Cb 0.02 0.15 -0.04 0.00 -1.71 0.00 0.00 66.02 64.44 1xxe s SER 59 CO 0.05 -0.62 0.10 -0.89 1.20 0.00 0.00 173.24 173.09 1xxe s THR 60 N -3.71 4.69 -0.04 6.45 2.01 -1.26 -4.60 115.64 119.17 1xxe s THR 60 Ca 0.27 -0.05 0.07 0.00 0.31 0.00 0.00 61.69 62.29 1xxe s THR 60 Cb 0.07 -3.19 -0.01 0.00 0.01 0.00 0.00 72.50 69.37 1xxe s THR 60 CO 0.06 0.34 -0.25 -1.81 -0.69 0.00 0.00 174.62 172.27 1xxe s ASP 61 N 1.37 3.03 0.25 3.53 1.01 -0.76 -0.33 116.67 124.78 1xxe s ASP 61 Ca 0.06 -0.49 0.11 0.00 0.71 0.00 0.00 52.55 52.93 1xxe s ASP 61 Cb -0.15 -0.66 -0.05 0.00 1.01 0.00 0.00 42.92 43.07 1xxe s ASP 61 CO 0.05 0.27 -0.15 -0.76 0.21 0.00 0.00 175.17 174.79 1xxe s LEU 62 N -0.31 2.75 -0.27 1.23 1.43 -0.60 -2.46 118.68 120.44 1xxe s LEU 62 Ca 0.01 -0.85 -0.26 0.00 -1.03 0.00 0.00 54.13 51.99 1xxe s LEU 62 Cb -0.12 -1.32 0.17 0.00 0.03 0.00 0.00 46.19 44.94 1xxe s LEU 62 CO 0.02 0.05 1.27 -0.83 0.23 0.00 0.00 176.35 177.09 1xxe s GLY 63 N -3.30 0.10 0.01 -3.19 0.00 -0.87 0.17 107.32 100.25 1xxe s GLY 63 Ca 0.28 3.00 -0.08 0.00 0.00 0.00 0.00 44.72 47.93 1xxe s GLY 63 CO 0.15 1.65 0.15 -0.12 0.00 0.00 0.00 173.10 174.93 1xxe s PHE 64 N -0.26 0.06 -1.60 1.90 5.36 0.44 -4.71 117.98 119.18 1xxe s PHE 64 Ca 0.05 -0.20 0.00 0.00 -0.96 0.00 0.00 56.93 55.82 1xxe s PHE 64 Cb -0.04 -0.05 0.00 0.00 -0.34 0.00 0.00 43.02 42.59 1xxe s PHE 64 CO -0.10 -0.33 0.00 1.63 -1.46 0.00 0.00 175.22 174.96 1xxe n LYS 65 N 1.20 -1.77 -0.55 10.12 4.76 -1.26 -0.33 118.16 130.33 1xxe n LYS 65 Ca -0.21 0.90 0.00 0.00 -2.87 0.00 0.00 58.31 56.13 1xxe n LYS 65 Cb 0.57 -5.47 0.00 0.00 -1.84 0.00 0.00 35.03 28.29 1xxe n LYS 65 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xxe n GLY 66 N -0.79 0.83 3.83 0.72 0.00 -1.26 -5.04 105.19 103.48 1xxe n GLY 66 Ca -0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.43 3.87 0.03 1.61 -1.52 0.55 -5.08 119.66 118.69 1xxe s GLN 67 Ca 0.00 0.28 0.03 0.00 -1.95 0.00 0.00 55.36 53.72 1xxe s GLN 67 Cb 0.00 -3.24 -0.02 0.00 -0.22 0.00 0.00 33.01 29.53 1xxe s GLN 67 CO 0.00 0.65 -0.09 1.03 -0.25 0.00 0.00 175.29 176.63 1xxe s ARG 68 N -0.87 0.62 0.03 2.91 0.52 -1.26 -0.42 118.95 120.46 1xxe s ARG 68 Ca 0.21 -0.64 0.02 0.00 -0.52 0.00 0.00 55.73 54.81 1xxe s ARG 68 Cb -0.15 -0.50 -0.02 0.00 0.52 0.00 0.00 34.95 34.80 1xxe s ARG 68 CO 0.11 0.12 -0.08 0.42 0.02 0.00 0.00 175.30 175.88 1xxe s ILE 69 N -0.96 0.60 0.15 1.52 1.01 0.13 -4.83 121.20 118.82 1xxe s ILE 69 Ca -0.04 -0.78 0.09 0.00 0.00 0.00 0.00 60.65 59.92 1xxe s ILE 69 Cb -0.08 -0.60 -0.04 0.00 0.01 0.00 0.00 42.46 41.76 1xxe s ILE 69 CO 0.01 -0.14 -0.12 -0.54 0.00 0.00 0.00 174.94 174.15 1xxe s LYS 70 N -1.01 2.01 -0.71 2.79 1.02 -0.71 -1.56 119.74 121.56 1xxe s LYS 70 Ca -0.04 -1.21 -0.04 0.00 0.02 0.00 0.00 55.97 54.70 1xxe s LYS 70 Cb -0.07 -2.17 0.01 0.00 -0.52 0.00 0.00 37.83 35.08 1xxe s LYS 70 CO 0.00 0.46 0.66 2.41 -0.92 0.00 0.00 175.35 177.96 1xxe n THR 71 N 0.31 -8.22 0.33 2.17 -1.04 0.55 -2.11 114.28 106.27 1xxe n THR 71 Ca -0.12 -0.03 0.04 0.00 -2.04 0.00 0.00 64.05 61.89 1xxe n THR 71 Cb 0.54 -5.78 0.02 0.00 -1.82 0.00 0.00 70.33 63.30 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 -1.74 0.00 -0.09 12.58 0.24 -1.09 -4.23 118.33 124.01 1xxe n VAL 72 Ca -0.07 -0.48 -0.14 0.00 -2.04 0.00 0.00 64.34 61.61 1xxe n VAL 72 Cb 0.56 1.14 -0.02 0.00 -1.47 0.00 0.00 33.84 34.04 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 1.31 0.88 0.43 7.34 4.11 -1.86 -2.47 114.58 124.31 1xxe h GLU 73 Ca 0.00 -0.51 -0.01 0.00 0.07 0.00 0.00 59.36 58.91 1xxe h GLU 73 Cb 0.30 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1xxe h GLU 73 CO 0.00 1.15 -0.49 0.45 0.07 0.00 0.00 179.01 180.20 1xxe h HIS 74 N 0.70 -1.36 -0.43 2.06 3.86 -1.91 0.41 115.15 118.48 1xxe h HIS 74 Ca 0.04 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.28 1xxe h HIS 74 Cb 1.07 0.54 -0.03 0.00 1.06 0.00 0.00 27.41 30.04 1xxe h HIS 74 CO 0.07 -0.63 0.24 0.97 0.86 0.00 0.00 177.93 179.43 1xxe h ILE 75 N -0.93 1.02 -0.94 2.45 6.09 -1.87 -1.36 117.51 121.98 1xxe h ILE 75 Ca -0.05 -0.17 0.11 0.00 -1.37 0.00 0.00 64.86 63.38 1xxe h ILE 75 Cb 0.82 0.49 -0.07 0.00 0.47 0.00 0.00 36.82 38.53 1xxe h ILE 75 CO -0.09 0.09 0.60 -0.07 -3.07 0.00 0.00 178.15 175.61 1xxe h LEU 76 N 0.48 0.85 -0.22 2.19 3.38 -1.06 -1.39 115.31 119.54 1xxe h LEU 76 Ca 0.18 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.19 1xxe h LEU 76 Cb 0.04 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1xxe h LEU 76 CO -0.10 0.48 0.11 -1.28 0.09 0.00 0.00 178.44 177.74 1xxe h SER 77 N 0.93 0.16 0.23 -0.43 0.87 0.96 0.22 113.55 116.48 1xxe h SER 77 Ca 0.44 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 61.02 1xxe h SER 77 Cb 0.44 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 1xxe h SER 77 CO -0.21 0.12 -0.23 0.58 -0.53 0.00 0.00 176.83 176.57 1xxe h VAL 78 N 0.23 0.50 -0.61 2.23 2.07 -0.93 -0.44 116.25 119.31 1xxe h VAL 78 Ca 0.09 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.72 1xxe h VAL 78 Cb 0.02 0.50 -0.08 0.00 -1.52 0.00 0.00 31.29 30.21 1xxe h VAL 78 CO -0.06 0.00 0.16 -0.07 0.02 0.00 0.00 177.57 177.62 1xxe h LEU 79 N -0.49 0.08 0.07 2.57 3.38 -1.04 0.20 115.31 120.07 1xxe h LEU 79 Ca -0.00 0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1xxe h LEU 79 Cb 0.46 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 1xxe h LEU 79 CO -0.06 0.05 -0.22 -0.74 0.09 0.00 0.00 178.44 177.56 1xxe h HIS 80 N 0.31 -0.59 -0.71 1.13 2.76 0.12 0.93 115.15 119.09 1xxe h HIS 80 Ca 0.32 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.46 1xxe h HIS 80 Cb 0.45 0.25 -0.03 0.00 1.55 0.00 0.00 27.41 29.63 1xxe h HIS 80 CO -0.22 -0.32 0.29 -0.07 -1.30 0.00 0.00 177.93 176.31 1xxe h LEU 81 N -0.39 0.96 0.00 0.26 3.38 -0.26 -1.84 115.31 117.41 1xxe h LEU 81 Ca 0.04 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1xxe h LEU 81 Cb 0.44 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1xxe h LEU 81 CO -0.15 0.85 0.00 0.18 0.09 0.00 0.00 178.44 179.41 1xxe n LEU 82 N -4.30 0.00 -3.02 1.67 4.77 0.62 -4.91 117.00 111.83 1xxe n LEU 82 Ca 0.06 0.22 -0.14 0.00 -0.03 0.00 0.00 56.01 56.13 1xxe n LEU 82 Cb 0.17 -0.22 0.07 0.00 -2.33 0.00 0.00 43.42 41.11 1xxe n LEU 82 CO 0.40 -0.02 0.08 -0.62 -1.33 0.00 0.00 177.39 175.90 1xxe n GLU 83 N -1.22 -4.97 -3.58 3.23 1.02 0.24 -4.98 120.64 110.38 1xxe n GLU 83 Ca 0.15 0.71 -0.37 0.00 -0.02 0.00 0.00 57.16 57.63 1xxe n GLU 83 Cb 0.20 -5.29 -0.09 0.00 -0.02 0.00 0.00 31.44 26.24 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 -3.30 5.31 -0.06 -3.67 -1.09 -0.71 -3.83 121.20 113.85 1xxe s ILE 84 Ca 0.06 0.32 0.09 0.00 -2.23 0.00 0.00 60.65 58.90 1xxe s ILE 84 Cb -0.01 -3.57 -0.14 0.00 -1.58 0.00 0.00 42.46 37.17 1xxe s ILE 84 CO 0.61 0.31 0.22 0.35 -1.23 0.00 0.00 174.94 175.20 1xxe n THR 85 N 4.40 0.00 -3.85 2.92 -2.24 -0.80 -4.81 114.28 109.90 1xxe n THR 85 Ca -0.13 -0.22 -0.29 0.00 -2.27 0.00 0.00 64.05 61.14 1xxe n THR 85 Cb 0.52 0.36 -0.16 0.00 -2.10 0.00 0.00 70.33 68.95 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 -2.94 3.17 -0.22 3.42 0.02 -1.21 -0.89 114.94 116.30 1xxe s ASN 86 Ca -0.03 -0.87 -0.27 0.00 -1.02 0.00 0.00 52.86 50.67 1xxe s ASN 86 Cb 0.06 -0.88 0.10 0.00 0.02 0.00 0.00 41.25 40.55 1xxe s ASN 86 CO 0.38 -0.24 0.88 0.68 0.02 0.00 0.00 177.10 178.82 1xxe s VAL 87 N 1.64 0.00 -0.41 1.60 -7.23 -0.95 -3.95 120.40 111.10 1xxe s VAL 87 Ca -0.02 0.00 -0.04 0.00 -1.81 0.00 0.00 61.98 60.11 1xxe s VAL 87 Cb -0.17 -1.00 0.10 0.00 0.56 0.00 0.00 36.38 35.87 1xxe s VAL 87 CO -0.07 0.00 0.21 -0.89 -0.31 0.00 0.00 175.10 174.04 1xxe s THR 88 N -0.22 3.42 -0.43 5.32 2.01 -0.85 -2.49 115.64 122.41 1xxe s THR 88 Ca -0.01 -1.94 -0.20 0.00 0.31 0.00 0.00 61.69 59.85 1xxe s THR 88 Cb -0.03 -3.29 0.02 0.00 0.01 0.00 0.00 72.50 69.21 1xxe s THR 88 CO -0.00 -0.64 0.62 -0.63 -0.69 0.00 0.00 174.62 173.28 1xxe s ILE 89 N 1.19 4.86 -0.19 1.82 1.01 -0.69 -2.30 121.20 126.89 1xxe s ILE 89 Ca 0.07 0.14 -0.23 0.00 0.00 0.00 0.00 60.65 60.63 1xxe s ILE 89 Cb -0.23 -4.17 -0.02 0.00 0.01 0.00 0.00 42.46 38.05 1xxe s ILE 89 CO -0.03 -0.54 0.74 -1.61 0.00 0.00 0.00 174.94 173.49 1xxe s GLU 90 N 2.75 4.24 -0.40 2.79 2.02 0.19 -1.70 118.70 128.60 1xxe s GLU 90 Ca 0.22 0.82 -0.08 0.00 0.02 0.00 0.00 54.97 55.94 1xxe s GLU 90 Cb -0.14 -3.59 0.07 0.00 0.10 0.00 0.00 34.13 30.57 1xxe s GLU 90 CO 0.18 -0.31 0.22 0.08 0.02 0.00 0.00 175.26 175.45 1xxe s VAL 91 N 2.12 4.11 -0.43 2.63 1.01 -0.66 -1.44 120.40 127.74 1xxe s VAL 91 Ca 0.33 -1.32 -0.23 0.00 0.00 0.00 0.00 61.98 60.76 1xxe s VAL 91 Cb -0.16 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 32.77 1xxe s VAL 91 CO 0.11 -0.42 0.78 -0.63 0.00 0.00 0.00 175.10 174.95 1xxe s ILE 92 N 1.42 4.67 -3.03 2.22 1.01 -0.66 -4.74 121.20 122.09 1xxe s ILE 92 Ca 0.02 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.20 1xxe s ILE 92 Cb -0.22 -4.30 0.00 0.00 0.01 0.00 0.00 42.46 37.96 1xxe s ILE 92 CO 0.02 -0.65 0.00 0.61 0.00 0.00 0.00 174.94 174.92 1xxe n GLY 93 N 4.89 0.79 0.00 6.18 0.00 -1.26 -2.15 105.19 113.64 1xxe n GLY 93 Ca 0.02 -2.05 0.02 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 0.29 1.86 -3.93 1.61 3.02 -1.26 -5.00 115.26 111.86 1xxe n ASN 94 Ca 0.00 -0.34 -0.10 0.00 -0.03 0.00 0.00 54.58 54.11 1xxe n ASN 94 Cb 0.00 1.10 -0.12 0.00 -0.61 0.00 0.00 39.78 40.16 1xxe n ASN 94 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1xxe s GLU 95 N -1.86 0.24 -0.00 3.52 -6.30 -1.26 -1.74 118.70 111.29 1xxe s GLU 95 Ca 0.00 -0.36 -0.30 0.00 -2.50 0.00 0.00 54.97 51.81 1xxe s GLU 95 Cb 0.03 0.09 -0.06 0.00 0.00 0.00 0.00 34.13 34.20 1xxe s GLU 95 CO 0.21 -0.04 1.49 0.42 0.02 0.00 0.00 175.26 177.36 1xxe s ILE 96 N -0.95 3.56 0.07 -3.70 -1.09 -0.89 -4.62 121.20 113.57 1xxe s ILE 96 Ca -0.10 0.91 -0.37 0.00 -2.23 0.00 0.00 60.65 58.86 1xxe s ILE 96 Cb -0.06 -3.59 -0.18 0.00 -1.58 0.00 0.00 42.46 37.05 1xxe s ILE 96 CO -0.00 -0.02 1.17 -2.65 -1.23 0.00 0.00 174.94 172.21 1xxe n PRO 97 N 5.76 0.64 0.08 2.79 -0.02 -1.26 -4.57 135.00 138.42 1xxe n PRO 97 Ca 0.14 0.23 -0.06 0.00 -2.02 0.00 0.00 63.50 61.79 1xxe n PRO 97 Cb 0.43 -1.77 -0.07 0.00 -0.02 0.00 0.00 33.50 32.07 1xxe n PRO 97 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1xxe h ILE 98 N 3.01 1.66 0.00 4.25 6.09 -1.74 -3.47 117.51 127.30 1xxe h ILE 98 Ca -0.48 -3.16 0.00 0.00 -1.37 0.00 0.00 64.86 59.85 1xxe h ILE 98 Cb 1.38 2.72 0.00 0.00 0.47 0.00 0.00 36.82 41.39 1xxe h ILE 98 CO 0.71 0.90 0.00 0.18 -3.07 0.00 0.00 178.15 176.87 1xxe n LEU 99 N -3.45 0.00 0.03 2.19 4.77 -1.26 -1.00 117.00 118.28 1xxe n LEU 99 Ca -0.01 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.03 1xxe n LEU 99 Cb 0.88 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.88 1xxe n LEU 99 CO 0.46 0.00 -0.44 -0.67 -1.33 0.00 0.00 177.39 175.41 1xxe n ASP 100 N 10.16 0.50 0.00 -1.43 -0.08 -1.26 -4.56 116.55 119.89 1xxe n ASP 100 Ca 0.00 0.21 0.00 0.00 -1.51 0.00 0.00 54.79 53.49 1xxe n ASP 100 Cb 0.00 0.88 0.00 0.00 2.34 0.00 0.00 41.12 44.34 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 1.34 1.19 0.36 0.27 0.00 -0.17 -4.25 105.19 103.93 1xxe n GLY 101 Ca -0.08 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.91 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 1.97 -0.20 1.61 3.41 -1.26 -1.38 113.62 117.76 1xxe n SER 102 Ca 0.00 -1.21 0.04 0.00 -0.26 0.00 0.00 58.87 57.44 1xxe n SER 102 Cb 0.00 0.03 -0.00 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 4.39 -0.17 0.37 5.00 0.00 -0.84 -4.62 105.19 109.32 1xxe n GLY 103 Ca -0.02 -0.26 0.24 0.00 0.00 0.00 0.00 46.02 45.98 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 0.99 0.85 0.19 1.61 2.91 -1.74 0.13 115.95 120.89 1xxe h TRP 104 Ca 0.00 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.04 1xxe h TRP 104 Cb 0.30 -0.23 0.00 0.00 -0.51 0.00 0.00 29.16 28.72 1xxe h TRP 104 CO 0.00 -0.07 -0.09 0.93 -1.03 0.00 0.00 178.44 178.18 1xxe h GLU 105 N 0.38 -0.25 -0.52 2.65 5.08 -1.89 0.85 114.58 120.89 1xxe h GLU 105 Ca 0.69 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 59.04 1xxe h GLU 105 Cb 1.63 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.91 1xxe h GLU 105 CO -0.49 -0.11 0.19 0.74 -1.00 0.00 0.00 179.01 178.34 1xxe h PHE 106 N -0.33 0.81 -0.52 4.33 0.04 -1.35 -1.35 116.94 118.56 1xxe h PHE 106 Ca -0.03 -0.07 -0.05 0.00 2.80 0.00 0.00 57.97 60.63 1xxe h PHE 106 Cb 0.26 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.14 1xxe h PHE 106 CO -0.04 0.68 0.13 -0.92 -0.60 0.00 0.00 178.31 177.55 1xxe h TYR 107 N 0.70 0.82 -0.00 -0.55 5.03 -0.61 -0.97 116.97 121.39 1xxe h TYR 107 Ca 0.17 -0.07 -0.00 0.00 2.58 0.00 0.00 58.73 61.41 1xxe h TYR 107 Cb 0.23 -0.24 0.00 0.00 1.55 0.00 0.00 36.73 38.27 1xxe h TYR 107 CO 0.01 0.69 -0.00 0.93 -1.32 0.00 0.00 178.16 178.47 1xxe h GLU 108 N 0.77 0.00 -0.09 1.82 4.39 0.12 -1.83 114.58 119.76 1xxe h GLU 108 Ca 0.17 -0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.74 1xxe h GLU 108 Cb 0.28 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1xxe h GLU 108 CO -0.00 0.64 -0.42 0.00 -1.16 0.00 0.00 179.01 178.07 1xxe h ALA 109 N 0.36 0.17 -0.42 3.43 0.00 -1.26 -3.21 119.26 118.33 1xxe h ALA 109 Ca -0.00 -0.48 -0.15 0.00 0.00 0.00 0.00 54.91 54.28 1xxe h ALA 109 Cb 0.64 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1xxe h ALA 109 CO 0.00 0.30 -0.32 0.82 0.00 0.00 0.00 179.25 180.04 1xxe h ILE 110 N -0.00 1.27 -0.70 0.00 2.04 -1.31 -2.85 117.51 115.96 1xxe h ILE 110 Ca -0.03 -1.50 0.16 0.00 1.00 0.00 0.00 64.86 64.50 1xxe h ILE 110 Cb 1.07 1.28 -0.04 0.00 -0.74 0.00 0.00 36.82 38.39 1xxe h ILE 110 CO 0.09 0.51 0.48 -0.09 0.00 0.00 0.00 178.15 179.13 1xxe h ARG 111 N 0.81 0.24 0.00 2.37 9.65 -1.40 0.43 114.38 126.48 1xxe h ARG 111 Ca 0.08 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.95 1xxe h ARG 111 Cb 0.92 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.44 1xxe h ARG 111 CO 0.09 0.16 -0.14 1.17 2.80 0.00 0.00 179.97 184.05 1xxe n LYS 112 N -4.43 0.19 -0.95 0.20 4.81 -1.08 -3.76 118.16 113.13 1xxe n LYS 112 Ca 0.13 0.13 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 1xxe n LYS 112 Cb 0.59 -1.70 0.16 0.00 0.02 0.00 0.00 35.03 34.11 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 -2.01 2.29 -4.82 3.14 4.13 0.14 -5.06 115.26 113.07 1xxe n ASN 113 Ca 0.05 -3.75 -0.34 0.00 1.68 0.00 0.00 54.58 52.23 1xxe n ASN 113 Cb 0.41 -0.48 -0.06 0.00 -1.54 0.00 0.00 39.78 38.10 1xxe n ASN 113 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1xxe s ILE 114 N -3.33 4.48 0.08 2.41 1.01 -0.68 0.80 121.20 125.97 1xxe s ILE 114 Ca 0.40 1.33 0.06 0.00 0.00 0.00 0.00 60.65 62.44 1xxe s ILE 114 Cb 0.38 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.12 1xxe s ILE 114 CO -0.05 -0.13 -0.17 -0.22 0.00 0.00 0.00 174.94 174.37 1xxe s LEU 115 N -2.77 2.27 0.03 2.97 2.96 0.16 -4.49 118.68 119.81 1xxe s LEU 115 Ca 0.55 -0.63 -0.05 0.00 -0.22 0.00 0.00 54.13 53.78 1xxe s LEU 115 Cb -0.12 -0.66 -0.05 0.00 0.50 0.00 0.00 46.19 45.87 1xxe s LEU 115 CO 0.17 -0.02 0.27 0.20 -1.32 0.00 0.00 176.35 175.66 1xxe s ASN 116 N -1.74 6.47 0.00 3.68 0.01 -1.26 -1.52 114.94 120.57 1xxe s ASN 116 Ca 0.01 0.51 0.00 0.00 -0.71 0.00 0.00 52.86 52.68 1xxe s ASN 116 Cb -0.10 -2.07 0.00 0.00 0.41 0.00 0.00 41.25 39.49 1xxe s ASN 116 CO 0.03 0.21 0.00 0.00 -1.51 0.00 0.00 177.10 175.83 1xxe n GLN 117 N 0.85 1.79 -3.48 -0.60 6.02 -0.44 -4.87 117.38 116.65 1xxe n GLN 117 Ca -0.09 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.63 1xxe n GLN 117 Cb 0.52 0.00 -0.09 0.00 1.02 0.00 0.00 30.24 31.70 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 -1.73 2.78 -3.58 1.08 5.15 -1.26 -4.64 115.26 113.07 1xxe n ASN 118 Ca 0.00 -3.21 -0.11 0.00 -0.60 0.00 0.00 54.58 50.66 1xxe n ASN 118 Cb 0.00 -0.68 -0.05 0.00 -0.53 0.00 0.00 39.78 38.52 1xxe n ASN 118 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1xxe s ARG 119 N -1.91 0.60 -0.10 1.20 3.52 -1.26 -4.95 118.95 116.04 1xxe s ARG 119 Ca 0.36 0.17 -0.26 0.00 -0.13 0.00 0.00 55.73 55.86 1xxe s ARG 119 Cb 0.11 0.28 -0.02 0.00 -1.56 0.00 0.00 34.95 33.75 1xxe s ARG 119 CO -0.07 -0.18 0.86 -2.00 -0.81 0.00 0.00 175.30 173.10 1xxe s GLU 120 N -1.04 4.41 0.25 5.12 2.12 -1.26 0.10 118.70 128.40 1xxe s GLU 120 Ca -0.02 1.13 -0.30 0.00 0.36 0.00 0.00 54.97 56.14 1xxe s GLU 120 Cb -0.01 -3.51 -0.10 0.00 0.26 0.00 0.00 34.13 30.77 1xxe s GLU 120 CO 0.01 -0.17 1.37 0.42 -0.54 0.00 0.00 175.26 176.35 1xxe s ILE 121 N 1.55 2.85 -1.13 -3.70 1.01 -1.26 -4.69 121.20 115.83 1xxe s ILE 121 Ca 0.43 0.74 -0.19 0.00 0.00 0.00 0.00 60.65 61.62 1xxe s ILE 121 Cb -0.18 -3.47 -0.05 0.00 0.01 0.00 0.00 42.46 38.77 1xxe s ILE 121 CO 0.18 0.13 1.98 -0.67 0.00 0.00 0.00 174.94 176.55 1xxe n ASP 122 N 2.12 3.40 -4.62 3.58 2.03 -1.26 -4.87 116.55 116.93 1xxe n ASP 122 Ca 0.05 -2.77 -0.43 0.00 0.52 0.00 0.00 54.79 52.17 1xxe n ASP 122 Cb 0.41 -1.49 -0.00 0.00 -0.72 0.00 0.00 41.12 39.32 1xxe n ASP 122 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1xxe n TYR 123 N 8.64 1.48 -3.93 -0.67 4.01 -1.26 -4.73 117.16 120.68 1xxe n TYR 123 Ca 0.49 0.62 -0.35 0.00 -0.16 0.00 0.00 57.90 58.50 1xxe n TYR 123 Cb 0.42 -2.28 -0.11 0.00 -0.31 0.00 0.00 39.34 37.06 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 -1.14 3.16 0.02 -0.72 2.19 -0.29 -4.99 117.98 116.20 1xxe s PHE 124 Ca 0.59 -0.15 0.05 0.00 0.33 0.00 0.00 56.93 57.75 1xxe s PHE 124 Cb -0.62 -2.14 -0.02 0.00 -1.31 0.00 0.00 43.02 38.93 1xxe s PHE 124 CO 0.59 -0.08 -0.15 0.08 1.83 0.00 0.00 175.22 177.49 1xxe s VAL 125 N 0.92 1.20 0.11 3.12 1.01 -1.26 0.00 120.40 125.51 1xxe s VAL 125 Ca 0.04 -0.84 -0.29 0.00 0.00 0.00 0.00 61.98 60.88 1xxe s VAL 125 Cb -0.14 -1.04 -0.06 0.00 0.00 0.00 0.00 36.38 35.14 1xxe s VAL 125 CO 0.03 0.18 0.91 -0.69 0.00 0.00 0.00 175.10 175.53 1xxe s VAL 126 N -0.60 4.51 -0.15 2.92 1.01 -0.49 -4.92 120.40 122.67 1xxe s VAL 126 Ca 0.04 1.97 0.04 0.00 0.00 0.00 0.00 61.98 64.03 1xxe s VAL 126 Cb -0.07 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 1xxe s VAL 126 CO 0.00 0.35 0.15 -0.62 0.00 0.00 0.00 175.10 174.98 1xxe n GLU 127 N 2.64 4.98 -3.89 2.72 1.02 -1.26 -4.24 120.64 122.60 1xxe n GLU 127 Ca 0.01 -0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 1xxe n GLU 127 Cb 0.49 -0.73 -0.12 0.00 -0.02 0.00 0.00 31.44 31.05 1xxe n GLU 127 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 1xxe s GLU 128 N -1.48 0.17 0.75 3.49 -1.05 -1.26 -4.82 118.70 114.50 1xxe s GLU 128 Ca 0.01 -0.15 -0.11 0.00 -0.15 0.00 0.00 54.97 54.57 1xxe s GLU 128 Cb 0.03 0.07 0.04 0.00 -0.44 0.00 0.00 34.13 33.83 1xxe s GLU 128 CO 0.15 -0.03 1.08 -1.25 0.95 0.00 0.00 175.26 176.16 1xxe s PRO 129 N -0.51 2.48 -0.21 -4.83 0.04 -1.26 -4.62 135.00 126.09 1xxe s PRO 129 Ca -0.06 0.91 -0.19 0.00 0.04 0.00 0.00 61.00 61.70 1xxe s PRO 129 Cb -0.04 -1.94 0.05 0.00 0.04 0.00 0.00 34.50 32.62 1xxe s PRO 129 CO -0.00 -1.41 0.55 -1.50 0.04 0.00 0.00 177.00 174.68 1xxe s ILE 130 N -3.04 -0.00 -0.10 0.56 2.07 -0.90 -4.95 121.20 114.85 1xxe s ILE 130 Ca 0.60 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.85 1xxe s ILE 130 Cb -0.15 -0.77 0.02 0.00 0.13 0.00 0.00 42.46 41.69 1xxe s ILE 130 CO 0.55 0.00 -0.11 -0.63 -1.91 0.00 0.00 174.94 172.84 1xxe s ILE 131 N 0.29 1.22 -0.18 2.00 1.09 -1.26 -0.81 121.20 123.55 1xxe s ILE 131 Ca -0.00 -0.46 0.01 0.00 -1.10 0.00 0.00 60.65 59.10 1xxe s ILE 131 Cb -0.04 -1.15 0.03 0.00 -1.06 0.00 0.00 42.46 40.23 1xxe s ILE 131 CO 0.01 0.39 -0.17 0.68 -0.10 0.00 0.00 174.94 175.74 1xxe s VAL 132 N 1.20 1.92 -0.09 2.92 -7.23 -0.40 -4.98 120.40 113.74 1xxe s VAL 132 Ca -0.04 -0.93 0.02 0.00 -1.81 0.00 0.00 61.98 59.23 1xxe s VAL 132 Cb -0.14 -1.79 -0.02 0.00 0.56 0.00 0.00 36.38 34.99 1xxe s VAL 132 CO -0.03 0.45 -0.16 -0.70 -0.31 0.00 0.00 175.10 174.34 1xxe s GLU 133 N 1.33 2.98 -0.21 4.82 -6.30 -1.26 -1.59 118.70 118.46 1xxe s GLU 133 Ca 0.03 -0.74 -0.30 0.00 -2.50 0.00 0.00 54.97 51.46 1xxe s GLU 133 Cb -0.14 -2.46 0.16 0.00 0.00 0.00 0.00 34.13 31.69 1xxe s GLU 133 CO -0.12 0.35 1.16 0.34 0.02 0.00 0.00 175.26 177.02 1xxe s ASP 134 N -0.03 -0.21 -1.87 -1.70 -1.08 -0.77 -4.95 116.67 106.05 1xxe s ASP 134 Ca -0.04 0.22 0.00 0.00 -0.52 0.00 0.00 52.55 52.21 1xxe s ASP 134 Cb -0.14 0.18 0.00 0.00 -1.46 0.00 0.00 42.92 41.50 1xxe s ASP 134 CO 0.04 -0.21 0.00 -0.62 0.52 0.00 0.00 175.17 174.90 1xxe n GLU 135 N 0.59 -1.51 -0.99 4.34 1.02 -1.26 0.22 120.64 123.05 1xxe n GLU 135 Ca -0.05 1.04 0.00 0.00 -0.02 0.00 0.00 57.16 58.13 1xxe n GLU 135 Cb 0.58 -5.46 0.00 0.00 -0.02 0.00 0.00 31.44 26.55 1xxe n GLU 135 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xxe n GLY 136 N -0.48 0.63 3.92 0.62 0.00 -1.26 -5.01 105.19 103.60 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 -0.06 2.54 -0.06 1.61 0.52 0.13 -4.96 118.95 118.67 1xxe s ARG 137 Ca 0.00 -1.54 -0.30 0.00 -0.52 0.00 0.00 55.73 53.36 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 -0.31 0.67 -1.17 0.02 0.00 0.00 175.30 174.51 1xxe s LEU 138 N -4.23 -0.61 -0.11 2.53 0.20 -1.01 -1.85 118.68 113.60 1xxe s LEU 138 Ca 0.49 0.73 -0.09 0.00 0.69 0.00 0.00 54.13 55.95 1xxe s LEU 138 Cb -0.04 2.49 0.03 0.00 -0.43 0.00 0.00 46.19 48.24 1xxe s LEU 138 CO 0.29 -0.59 0.28 -0.63 -0.29 0.00 0.00 176.35 175.41 1xxe s ILE 139 N -1.13 -0.00 0.01 6.68 1.01 -0.62 -1.11 121.20 126.04 1xxe s ILE 139 Ca -0.11 0.01 0.04 0.00 0.00 0.00 0.00 60.65 60.60 1xxe s ILE 139 Cb -0.00 -0.39 -0.01 0.00 0.01 0.00 0.00 42.46 42.06 1xxe s ILE 139 CO 0.09 0.01 -0.12 -0.75 0.00 0.00 0.00 174.94 174.17 1xxe s LYS 140 N 0.25 0.89 0.06 2.79 2.20 -0.33 -1.27 119.74 124.32 1xxe s LYS 140 Ca -0.01 -0.55 0.08 0.00 -0.36 0.00 0.00 55.97 55.13 1xxe s LYS 140 Cb -0.03 -0.86 -0.03 0.00 -1.51 0.00 0.00 37.83 35.41 1xxe s LYS 140 CO -0.01 0.22 -0.22 0.00 -0.36 0.00 0.00 175.35 174.98 1xxe s ALA 141 N -0.54 1.92 -0.04 3.13 0.00 0.01 -0.15 121.76 126.09 1xxe s ALA 141 Ca 0.02 -1.16 -0.03 0.00 0.00 0.00 0.00 51.96 50.80 1xxe s ALA 141 Cb -0.06 -0.36 0.02 0.00 0.00 0.00 0.00 23.12 22.72 1xxe s ALA 141 CO 0.00 0.43 0.10 -2.00 0.00 0.00 0.00 175.76 174.29 1xxe s GLU 142 N -1.35 0.08 0.54 0.00 2.12 0.62 -2.11 118.70 118.60 1xxe s GLU 142 Ca 0.09 0.22 -0.20 0.00 0.36 0.00 0.00 54.97 55.44 1xxe s GLU 142 Cb -0.09 -0.07 -0.07 0.00 0.26 0.00 0.00 34.13 34.15 1xxe s GLU 142 CO 0.02 -0.09 0.91 -0.35 -0.54 0.00 0.00 175.26 175.22 1xxe n PRO 143 N 3.61 0.98 -3.54 4.30 -0.04 -1.26 -0.00 135.00 139.04 1xxe n PRO 143 Ca -0.19 0.37 -0.11 0.00 -0.04 0.00 0.00 63.50 63.53 1xxe n PRO 143 Cb 0.55 -2.06 -0.04 0.00 -0.04 0.00 0.00 33.50 31.91 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 -1.08 -0.40 0.00 3.54 0.15 -1.26 -4.39 113.70 110.26 1xxe s SER 144 Ca 0.71 0.27 0.28 0.00 0.70 0.00 0.00 55.95 57.91 1xxe s SER 144 Cb -0.46 0.37 1.39 0.00 -1.71 0.00 0.00 66.02 65.60 1xxe s SER 144 CO 0.51 -0.50 1.93 0.47 1.20 0.00 0.00 173.24 176.85 1xxe n ASP 145 N 0.34 0.76 -4.06 5.45 8.00 -1.26 -3.80 116.55 121.98 1xxe n ASP 145 Ca -0.11 -1.30 -0.12 0.00 0.71 0.00 0.00 54.79 53.97 1xxe n ASP 145 Cb 0.59 -0.01 -0.11 0.00 -0.02 0.00 0.00 41.12 41.57 1xxe n ASP 145 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1xxe s THR 146 N -1.98 0.46 -0.29 -3.53 -4.23 -1.26 -4.92 115.64 99.88 1xxe s THR 146 Ca 0.41 -1.19 -0.23 0.00 -1.18 0.00 0.00 61.69 59.50 1xxe s THR 146 Cb 0.20 -0.72 -0.00 0.00 1.34 0.00 0.00 72.50 73.32 1xxe s THR 146 CO 0.33 -0.50 0.75 -0.22 -0.54 0.00 0.00 174.62 174.44 1xxe s LEU 147 N -1.81 4.09 0.01 4.79 2.96 -1.26 -2.61 118.68 124.85 1xxe s LEU 147 Ca -0.08 0.68 0.02 0.00 -0.22 0.00 0.00 54.13 54.53 1xxe s LEU 147 Cb -0.07 -3.02 -0.01 0.00 0.50 0.00 0.00 46.19 43.59 1xxe s LEU 147 CO -0.01 -0.55 -0.06 -0.70 -1.32 0.00 0.00 176.35 173.71 1xxe s GLU 148 N 2.83 0.44 -0.09 1.98 2.12 -0.73 -2.78 118.70 122.47 1xxe s GLU 148 Ca 0.31 -0.35 -0.02 0.00 0.36 0.00 0.00 54.97 55.27 1xxe s GLU 148 Cb -0.15 -0.36 0.03 0.00 0.26 0.00 0.00 34.13 33.92 1xxe s GLU 148 CO 0.11 0.09 0.01 0.08 -0.54 0.00 0.00 175.26 175.02 1xxe s VAL 149 N -0.49 0.34 -0.20 3.70 1.01 -0.49 -0.79 120.40 123.48 1xxe s VAL 149 Ca -0.02 0.05 -0.07 0.00 0.00 0.00 0.00 61.98 61.94 1xxe s VAL 149 Cb -0.04 -0.57 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 1xxe s VAL 149 CO -0.00 0.17 0.05 -0.89 0.00 0.00 0.00 175.10 174.43 1xxe s THR 150 N 1.98 4.52 -0.09 3.92 2.01 0.39 -0.96 115.64 127.40 1xxe s THR 150 Ca 0.04 -0.12 0.04 0.00 0.31 0.00 0.00 61.69 61.96 1xxe s THR 150 Cb -0.13 -3.05 0.00 0.00 0.01 0.00 0.00 72.50 69.33 1xxe s THR 150 CO -0.06 0.43 -0.22 -0.47 -0.69 0.00 0.00 174.62 173.61 1xxe s TYR 151 N 0.73 2.39 -0.37 4.92 5.04 -0.93 0.93 117.35 130.05 1xxe s TYR 151 Ca 0.03 -0.97 -0.04 0.00 -2.44 0.00 0.00 57.07 53.65 1xxe s TYR 151 Cb -0.14 -1.61 0.08 0.00 0.35 0.00 0.00 41.96 40.64 1xxe s TYR 151 CO 0.02 -0.40 0.14 -2.00 -1.34 0.00 0.00 175.55 171.97 1xxe s GLU 152 N 0.38 2.29 -0.16 4.97 -6.30 0.10 -1.79 118.70 118.20 1xxe s GLU 152 Ca -0.18 -1.52 -0.15 0.00 -2.50 0.00 0.00 54.97 50.62 1xxe s GLU 152 Cb -0.18 -3.47 -0.04 0.00 0.00 0.00 0.00 34.13 30.44 1xxe s GLU 152 CO 0.08 -0.87 0.34 0.20 0.02 0.00 0.00 175.26 175.03 1xxe s GLY 153 N 1.64 2.23 -0.51 -1.50 0.00 0.41 -1.22 107.32 108.38 1xxe s GLY 153 Ca 0.02 -0.41 -0.06 0.00 0.00 0.00 0.00 44.72 44.27 1xxe s GLY 153 CO -0.02 0.54 0.35 1.85 0.00 0.00 0.00 173.10 175.83 1xxe s GLU 154 N 0.60 2.41 0.05 2.90 2.56 -1.26 -0.87 118.70 125.08 1xxe s GLU 154 Ca 0.19 -1.99 -0.01 0.00 0.00 0.00 0.00 54.97 53.15 1xxe s GLU 154 Cb -0.14 -3.81 -0.04 0.00 2.00 0.00 0.00 34.13 32.15 1xxe s GLU 154 CO 0.06 -1.16 0.22 -0.06 -0.56 0.00 0.00 175.26 173.75 1xxe s PHE 155 N 0.91 3.53 -0.99 5.30 0.08 0.67 -4.95 117.98 122.52 1xxe s PHE 155 Ca 0.10 0.31 0.24 0.00 0.12 0.00 0.00 56.93 57.69 1xxe s PHE 155 Cb -0.23 -1.80 0.29 0.00 -0.57 0.00 0.00 43.02 40.71 1xxe s PHE 155 CO -0.03 0.59 1.26 1.63 -0.10 0.00 0.00 175.22 178.58 1xxe n LYS 156 N 0.46 0.01 0.00 0.44 5.02 -1.26 -3.22 118.16 119.61 1xxe n LYS 156 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 1xxe n LYS 156 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 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 -1.52 -0.77 0.30 4.39 2.04 -1.26 -4.70 115.26 113.75 1xxe n ASN 157 Ca 0.05 -0.41 0.16 0.00 -0.44 0.00 0.00 54.58 53.94 1xxe n ASN 157 Cb 0.34 0.00 0.96 0.00 -2.53 0.00 0.00 39.78 38.55 1xxe n ASN 157 CO 0.00 0.00 0.00 2.19 -0.44 0.00 0.00 177.26 179.01 1xxe h PHE 158 N -1.28 0.00 -0.65 -2.53 -0.00 -1.57 -1.47 116.94 109.44 1xxe h PHE 158 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.97 57.90 1xxe h PHE 158 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 35.95 35.92 1xxe h PHE 158 CO 0.00 0.00 0.13 -0.07 -0.00 0.00 0.00 178.31 178.37 1xxe h LEU 159 N 0.00 1.02 0.00 2.10 3.38 -1.88 -3.47 115.31 116.46 1xxe h LEU 159 Ca -0.00 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1xxe h LEU 159 Cb 0.01 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.49 1xxe h LEU 159 CO 0.00 1.00 0.00 0.61 0.09 0.00 0.00 178.44 180.14 1xxe n GLY 160 N -0.60 1.68 3.27 0.83 0.00 -0.56 -4.72 105.19 105.09 1xxe n GLY 160 Ca 0.04 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 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 1.86 0.06 1.61 3.00 -1.26 0.24 118.95 124.46 1xxe s ARG 161 Ca 0.00 -0.87 -0.06 0.00 0.00 0.00 0.00 55.73 54.80 1xxe s ARG 161 Cb 0.00 -1.83 -0.01 0.00 0.00 0.00 0.00 34.95 33.11 1xxe s ARG 161 CO 0.00 0.50 0.11 -0.65 0.00 0.00 0.00 175.30 175.26 1xxe s GLN 162 N -0.65 0.70 -0.02 3.54 -1.52 -0.05 -4.95 119.66 116.71 1xxe s GLN 162 Ca 0.09 -0.93 -0.04 0.00 -1.95 0.00 0.00 55.36 52.53 1xxe s GLN 162 Cb -0.09 0.28 0.00 0.00 -0.22 0.00 0.00 33.01 32.98 1xxe s GLN 162 CO -0.00 -0.19 0.09 -1.59 -0.25 0.00 0.00 175.29 173.34 1xxe s LYS 163 N -3.40 0.25 -0.05 2.91 -2.85 -1.26 -0.45 119.74 114.90 1xxe s LYS 163 Ca 0.02 -0.14 -0.01 0.00 -1.00 0.00 0.00 55.97 54.84 1xxe s LYS 163 Cb 0.03 0.11 0.03 0.00 -2.06 0.00 0.00 37.83 35.94 1xxe s LYS 163 CO -0.08 -0.05 0.01 0.12 0.10 0.00 0.00 175.35 175.45 1xxe s PHE 164 N -0.61 0.44 -0.22 1.78 5.36 -0.74 -4.99 117.98 119.01 1xxe s PHE 164 Ca -0.07 -0.03 -0.08 0.00 -0.96 0.00 0.00 56.93 55.79 1xxe s PHE 164 Cb -0.04 -0.60 -0.04 0.00 -0.34 0.00 0.00 43.02 42.00 1xxe s PHE 164 CO 0.00 -0.23 0.07 0.99 -1.46 0.00 0.00 175.22 174.60 1xxe s THR 165 N 1.62 4.59 -0.20 0.12 2.01 -1.26 -2.20 115.64 120.32 1xxe s THR 165 Ca -0.01 -0.09 -0.10 0.00 0.31 0.00 0.00 61.69 61.80 1xxe s THR 165 Cb -0.13 -3.11 -0.05 0.00 0.01 0.00 0.00 72.50 69.22 1xxe s THR 165 CO -0.03 0.39 0.14 0.12 -0.69 0.00 0.00 174.62 174.55 1xxe s PHE 166 N 1.06 3.42 0.07 4.92 5.36 -0.14 -4.94 117.98 127.72 1xxe s PHE 166 Ca 0.04 0.36 0.07 0.00 -0.96 0.00 0.00 56.93 56.43 1xxe s PHE 166 Cb -0.14 -2.17 -0.03 0.00 -0.34 0.00 0.00 43.02 40.34 1xxe s PHE 166 CO 0.03 0.29 -0.18 0.08 -1.46 0.00 0.00 175.22 173.98 1xxe s VAL 167 N 0.35 1.44 -0.29 3.12 1.01 -1.26 -1.40 120.40 123.38 1xxe s VAL 167 Ca 0.09 -1.29 -0.37 0.00 0.00 0.00 0.00 61.98 60.41 1xxe s VAL 167 Cb -0.11 -1.31 -0.13 0.00 0.00 0.00 0.00 36.38 34.83 1xxe s VAL 167 CO -0.01 -0.01 1.96 -0.62 0.00 0.00 0.00 175.10 176.41 1xxe n GLU 168 N 1.49 1.25 0.00 2.72 1.02 -1.12 -1.18 120.64 124.82 1xxe n GLU 168 Ca -0.19 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.37 1xxe n GLU 168 Cb 0.54 -2.31 0.00 0.00 -0.02 0.00 0.00 31.44 29.65 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 5.31 1.15 1.11 0.62 0.00 -1.26 -4.96 105.19 107.16 1xxe n GLY 169 Ca 0.33 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.39 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 1.18 0.06 1.61 5.03 -0.33 -4.83 115.26 117.99 1xxe n ASN 170 Ca 0.00 -2.59 -0.01 0.00 0.87 0.00 0.00 54.58 52.84 1xxe n ASN 170 Cb 0.00 -0.36 0.26 0.00 -1.02 0.00 0.00 39.78 38.66 1xxe n ASN 170 CO 0.00 0.00 0.00 -0.33 -1.83 0.00 0.00 177.26 175.10 1xxe h GLU 171 N 0.89 0.35 0.00 3.52 5.08 -1.93 -2.60 114.58 119.88 1xxe h GLU 171 Ca -0.14 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1xxe h GLU 171 Cb 1.57 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.79 1xxe h GLU 171 CO 0.06 0.58 0.04 0.39 -1.00 0.00 0.00 179.01 179.07 1xxe n GLU 172 N -4.14 0.00 0.00 2.33 4.71 -1.26 -0.73 120.64 121.54 1xxe n GLU 172 Ca -0.01 0.46 0.11 0.00 -0.01 0.00 0.00 57.16 57.72 1xxe n GLU 172 Cb 0.38 -1.54 0.06 0.00 -1.01 0.00 0.00 31.44 29.33 1xxe n GLU 172 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1xxe n GLU 173 N -1.46 1.15 -0.08 3.49 1.02 -0.98 -4.24 120.64 119.54 1xxe n GLU 173 Ca 0.00 -0.92 0.04 0.00 -0.02 0.00 0.00 57.16 56.26 1xxe n GLU 173 Cb 0.04 -1.48 0.08 0.00 -0.02 0.00 0.00 31.44 30.05 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 -0.13 1.30 -0.04 -3.67 -5.35 0.09 -4.62 119.36 106.95 1xxe n ILE 174 Ca 0.10 -1.36 -0.01 0.00 -0.27 0.00 0.00 62.75 61.21 1xxe n ILE 174 Cb 0.45 0.27 -0.09 0.00 -1.74 0.00 0.00 39.64 38.53 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 -0.53 0.47 1.36 7.28 0.24 -1.21 -4.48 118.33 121.45 1xxe n VAL 175 Ca 0.07 -0.39 0.13 0.00 -2.04 0.00 0.00 64.34 62.11 1xxe n VAL 175 Cb 0.42 -0.35 0.44 0.00 -1.47 0.00 0.00 33.84 32.88 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 -2.22 1.79 -4.63 1.34 4.32 -1.26 -1.87 117.00 114.47 1xxe n LEU 176 Ca -0.12 -0.63 -0.43 0.00 -0.02 0.00 0.00 56.01 54.82 1xxe n LEU 176 Cb 0.65 -0.02 -0.02 0.00 -1.62 0.00 0.00 43.42 42.40 1xxe n LEU 176 CO 0.24 0.31 0.94 0.00 -1.22 0.00 0.00 177.39 177.67 1xxe s ALA 177 N -1.95 3.44 0.39 -1.18 0.00 -1.26 -4.88 121.76 116.32 1xxe s ALA 177 Ca 0.36 -0.16 -0.15 0.00 0.00 0.00 0.00 51.96 52.01 1xxe s ALA 177 Cb 0.20 -3.69 -0.09 0.00 0.00 0.00 0.00 23.12 19.55 1xxe s ALA 177 CO 0.32 -1.60 0.82 1.03 0.00 0.00 0.00 175.76 176.33 1xxe s ARG 178 N 3.73 3.99 0.25 0.00 0.52 -1.26 -4.47 118.95 121.70 1xxe s ARG 178 Ca 0.45 0.75 -0.31 0.00 -0.52 0.00 0.00 55.73 56.09 1xxe s ARG 178 Cb -0.11 -2.33 -0.12 0.00 0.52 0.00 0.00 34.95 32.90 1xxe s ARG 178 CO 0.18 0.02 1.64 -2.37 0.02 0.00 0.00 175.30 174.79 1xxe n THR 179 N -0.79 0.53 -3.89 0.02 5.66 -0.48 -4.80 114.28 110.52 1xxe n THR 179 Ca 0.04 -0.13 -0.23 0.00 -3.05 0.00 0.00 64.05 60.68 1xxe n THR 179 Cb 0.54 -1.92 -0.05 0.00 -1.55 0.00 0.00 70.33 67.34 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 0.54 2.63 0.17 1.09 -0.71 -1.26 -2.33 117.98 118.10 1xxe s PHE 180 Ca 0.70 -0.56 -0.16 0.00 -1.04 0.00 0.00 56.93 55.87 1xxe s PHE 180 Cb -0.52 -2.05 0.03 0.00 -1.21 0.00 0.00 43.02 39.27 1xxe s PHE 180 CO 0.41 0.05 0.46 0.00 -1.34 0.00 0.00 175.22 174.79 1xxe s PHE 182 N -3.86 3.28 0.52 0.00 0.08 -1.26 -0.03 117.98 116.72 1xxe s PHE 182 Ca 0.08 0.21 0.27 0.00 0.12 0.00 0.00 56.93 57.61 1xxe s PHE 182 Cb 0.00 -1.75 1.61 0.00 -0.57 0.00 0.00 43.02 42.32 1xxe s PHE 182 CO -0.06 0.55 2.18 0.38 -0.10 0.00 0.00 175.22 178.16 1xxe h ASP 183 N 4.25 0.00 0.90 1.36 3.04 -1.81 -0.41 116.42 123.77 1xxe h ASP 183 Ca -0.50 0.00 -0.23 0.00 -3.24 0.00 0.00 57.03 53.07 1xxe h ASP 183 Cb 1.19 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 39.44 1xxe h ASP 183 CO 0.61 0.05 -1.13 4.11 -2.04 0.00 0.00 179.24 180.84 1xxe h TRP 184 N 0.00 0.01 0.00 4.15 0.09 -1.94 -3.27 115.95 114.98 1xxe h TRP 184 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 58.89 58.97 1xxe h TRP 184 Cb 0.12 -0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.36 1xxe h TRP 184 CO 0.00 1.01 -0.63 1.05 0.09 0.00 0.00 178.44 179.96 1xxe h GLU 185 N 0.00 0.00 0.20 0.12 4.11 -1.79 -3.36 114.58 113.86 1xxe h GLU 185 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.37 1xxe h GLU 185 Cb 1.82 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.05 1xxe h GLU 185 CO 0.12 0.00 -0.19 0.82 0.07 0.00 0.00 179.01 179.84 1xxe h ILE 186 N 0.00 0.59 -0.24 -1.06 2.04 -1.15 -1.20 117.51 116.49 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 0.85 0.59 -0.07 0.00 -0.74 0.00 0.00 36.82 37.45 1xxe h ILE 186 CO 0.00 0.00 -0.24 -0.33 0.00 0.00 0.00 178.15 177.58 1xxe h GLU 187 N -0.41 -0.24 -0.71 2.37 5.08 -1.72 0.39 114.58 119.34 1xxe h GLU 187 Ca -0.00 0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.49 1xxe h GLU 187 Cb 0.38 0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.60 1xxe h GLU 187 CO -0.04 -0.16 0.30 1.25 -1.00 0.00 0.00 179.01 179.36 1xxe h HIS 188 N -0.25 0.53 -0.24 4.33 2.76 -1.69 0.77 115.15 121.35 1xxe h HIS 188 Ca 0.13 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.28 1xxe h HIS 188 Cb 0.46 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.28 1xxe h HIS 188 CO -0.39 0.12 -0.11 0.82 -1.30 0.00 0.00 177.93 177.07 1xxe h ILE 189 N 0.48 1.21 0.00 6.26 2.04 0.20 -2.02 117.51 125.69 1xxe h ILE 189 Ca 0.37 -0.89 -0.15 0.00 1.00 0.00 0.00 64.86 65.19 1xxe h ILE 189 Cb 0.50 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 1xxe h ILE 189 CO -0.34 0.29 -0.71 0.11 0.00 0.00 0.00 178.15 177.50 1xxe h LYS 190 N 0.37 0.00 0.00 2.37 1.57 0.34 -1.34 116.57 119.88 1xxe h LYS 190 Ca 0.07 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.71 1xxe h LYS 190 Cb 0.42 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 1xxe h LYS 190 CO 0.02 0.71 -0.68 0.87 -0.57 0.00 0.00 179.45 179.80 1xxe h LYS 191 N 0.00 0.00 -0.09 3.15 1.57 0.86 -2.99 116.57 119.08 1xxe h LYS 191 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1xxe h LYS 191 Cb 1.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.77 1xxe h LYS 191 CO 0.09 0.68 0.00 1.33 -0.57 0.00 0.00 179.45 180.99 1xxe n VAL 192 N -3.46 0.12 -1.23 0.50 0.24 -0.81 -4.84 118.33 108.85 1xxe n VAL 192 Ca 0.00 -0.13 -0.03 0.00 -2.04 0.00 0.00 64.34 62.15 1xxe n VAL 192 Cb 0.74 0.04 -0.01 0.00 -1.47 0.00 0.00 33.84 33.14 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 0.68 0.54 3.46 7.63 0.00 -1.13 -5.04 105.19 111.34 1xxe n GLY 193 Ca 0.05 -0.92 -0.25 0.00 0.00 0.00 0.00 46.02 44.89 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 -0.67 2.55 0.00 0.99 1.43 -0.51 -4.71 118.68 117.76 1xxe s LEU 194 Ca 0.00 -0.96 0.00 0.00 -1.03 0.00 0.00 54.13 52.14 1xxe s LEU 194 Cb 0.00 -1.14 0.00 0.00 0.03 0.00 0.00 46.19 45.08 1xxe s LEU 194 CO 0.00 0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.26 1xxe n GLY 195 N -0.31 0.40 0.25 -3.19 0.00 -1.24 -3.34 105.19 97.76 1xxe n GLY 195 Ca -0.08 -1.03 0.13 0.00 0.00 0.00 0.00 46.02 45.04 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 -0.02 1.61 1.57 -1.21 -2.49 116.57 116.03 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 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1xxe h LYS 196 CO 0.00 0.14 -0.31 0.41 -0.57 0.00 0.00 179.45 179.12 1xxe n GLY 197 N -0.10 0.33 3.71 3.86 0.00 1.08 -4.62 105.19 109.46 1xxe n GLY 197 Ca -0.00 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.25 1.58 0.10 -0.02 0.00 0.17 -4.58 107.32 102.32 1xxe s GLY 198 Ca 0.21 1.32 0.00 0.00 0.00 0.00 0.00 44.72 46.25 1xxe s GLY 198 CO 0.46 2.69 -0.01 -1.35 0.00 0.00 0.00 173.10 174.89 1xxe s SER 199 N 1.47 0.69 0.43 1.64 1.04 -1.26 -4.99 113.70 112.71 1xxe s SER 199 Ca 0.71 -1.09 0.11 0.00 0.48 0.00 0.00 55.95 56.16 1xxe s SER 199 Cb -0.42 0.19 0.93 0.00 0.10 0.00 0.00 66.02 66.81 1xxe s SER 199 CO 0.31 -0.60 1.99 -0.07 0.98 0.00 0.00 173.24 175.85 1xxe h LEU 200 N 2.96 0.16 -0.31 2.42 3.38 -1.95 1.08 115.31 123.04 1xxe h LEU 200 Ca -0.35 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1xxe h LEU 200 Cb 1.17 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1xxe h LEU 200 CO 0.63 0.27 0.00 1.17 0.09 0.00 0.00 178.44 180.60 1xxe n LYS 201 N -4.35 0.23 0.00 1.13 4.81 -1.26 -3.45 118.16 115.26 1xxe n LYS 201 Ca -0.01 0.30 0.00 0.00 -0.87 0.00 0.00 58.31 57.73 1xxe n LYS 201 Cb 0.21 -1.83 0.00 0.00 0.02 0.00 0.00 35.03 33.43 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 -2.23 0.96 -3.67 3.14 4.13 -0.50 -4.74 115.26 112.34 1xxe n ASN 202 Ca 0.04 -1.48 -0.10 0.00 1.68 0.00 0.00 54.58 54.72 1xxe n ASN 202 Cb 0.34 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.47 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 -0.48 -0.38 -0.34 3.41 2.01 0.36 -4.12 115.64 116.11 1xxe s THR 203 Ca 0.00 0.17 -0.25 0.00 0.31 0.00 0.00 61.69 61.92 1xxe s THR 203 Cb 0.00 -0.58 0.01 0.00 0.01 0.00 0.00 72.50 71.94 1xxe s THR 203 CO 0.00 0.07 0.87 -0.22 -0.69 0.00 0.00 174.62 174.65 1xxe s LEU 204 N 2.13 4.05 -0.22 4.42 2.96 -0.99 -4.22 118.68 126.81 1xxe s LEU 204 Ca -0.04 0.61 -0.09 0.00 -0.22 0.00 0.00 54.13 54.39 1xxe s LEU 204 Cb -0.11 -3.18 -0.05 0.00 0.50 0.00 0.00 46.19 43.35 1xxe s LEU 204 CO -0.11 -0.75 0.12 -0.69 -1.32 0.00 0.00 176.35 173.59 1xxe s VAL 205 N 3.24 5.12 -0.07 1.68 1.01 -1.26 0.41 120.40 130.53 1xxe s VAL 205 Ca 0.36 0.09 -0.04 0.00 0.00 0.00 0.00 61.98 62.39 1xxe s VAL 205 Cb -0.13 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 1xxe s VAL 205 CO 0.16 0.39 0.10 -0.76 0.00 0.00 0.00 175.10 174.99 1xxe s LEU 206 N 0.80 4.11 0.07 3.92 1.43 0.96 -2.60 118.68 127.37 1xxe s LEU 206 Ca 0.06 0.32 -0.01 0.00 -1.03 0.00 0.00 54.13 53.46 1xxe s LEU 206 Cb -0.13 -2.13 -0.04 0.00 0.03 0.00 0.00 46.19 43.92 1xxe s LEU 206 CO 0.02 0.36 0.24 -0.83 0.23 0.00 0.00 176.35 176.37 1xxe s GLY 207 N -1.26 2.20 0.57 -3.19 0.00 0.53 -2.22 107.32 103.95 1xxe s GLY 207 Ca 0.18 -0.77 0.43 0.00 0.00 0.00 0.00 44.72 44.55 1xxe s GLY 207 CO 0.08 -0.73 1.59 0.07 0.00 0.00 0.00 173.10 174.10 1xxe h LYS 208 N 3.10 0.00 0.00 2.90 2.10 -1.99 -2.45 116.57 120.24 1xxe h LYS 208 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 1xxe h LYS 208 Cb 1.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 1xxe h LYS 208 CO 0.75 0.00 -0.12 -3.47 -2.00 0.00 0.00 179.45 174.60 1xxe n ASP 209 N -3.85 0.00 -3.84 7.07 -0.08 -1.26 -1.61 116.55 112.97 1xxe n ASP 209 Ca 0.36 -1.25 -0.10 0.00 -1.51 0.00 0.00 54.79 52.29 1xxe n ASP 209 Cb 1.73 -0.05 -0.08 0.00 2.34 0.00 0.00 41.12 45.06 1xxe n ASP 209 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1xxe s LYS 210 N 0.00 0.72 -0.21 -0.67 1.02 -0.92 -5.00 119.74 114.68 1xxe s LYS 210 Ca 0.00 -0.68 -0.09 0.00 0.02 0.00 0.00 55.97 55.21 1xxe s LYS 210 Cb 0.00 0.30 -0.05 0.00 -0.52 0.00 0.00 37.83 37.56 1xxe s LYS 210 CO 0.00 -0.21 0.12 0.08 -0.92 0.00 0.00 175.35 174.41 1xxe s VAL 211 N -2.79 5.15 -0.05 3.17 1.01 -1.26 0.20 120.40 125.82 1xxe s VAL 211 Ca -0.03 0.10 -0.21 0.00 0.00 0.00 0.00 61.98 61.84 1xxe s VAL 211 Cb -0.00 -3.36 -0.15 0.00 0.00 0.00 0.00 36.38 32.86 1xxe s VAL 211 CO -0.05 0.41 0.86 1.88 0.00 0.00 0.00 175.10 178.20 1xxe h TYR 212 N 7.07 -0.21 -2.39 5.22 -1.99 -1.85 -3.44 116.97 119.38 1xxe h TYR 212 Ca -0.39 -0.01 -0.58 0.00 2.00 0.00 0.00 58.73 59.76 1xxe h TYR 212 Cb 1.16 0.07 0.06 0.00 2.00 0.00 0.00 36.73 40.03 1xxe h TYR 212 CO 0.61 0.21 0.74 0.09 -0.00 0.00 0.00 178.16 179.82 1xxe n ASN 213 N -4.93 2.99 0.12 3.88 4.13 -1.26 -4.84 115.26 115.35 1xxe n ASN 213 Ca -0.08 1.10 0.12 0.00 1.68 0.00 0.00 54.58 57.40 1xxe n ASN 213 Cb 0.26 -1.43 0.47 0.00 -1.54 0.00 0.00 39.78 37.55 1xxe n ASN 213 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1xxe n PRO 214 N 3.01 0.20 0.00 3.52 -0.04 -1.26 -2.58 135.00 137.85 1xxe n PRO 214 Ca 0.15 0.38 0.14 0.00 -0.04 0.00 0.00 63.50 64.13 1xxe n PRO 214 Cb 0.29 -1.85 0.64 0.00 -0.04 0.00 0.00 33.50 32.54 1xxe n PRO 214 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1xxe n GLU 215 N -2.23 0.46 0.00 0.54 4.07 -1.26 -5.03 120.64 117.20 1xxe n GLU 215 Ca 0.03 -0.10 0.00 0.00 -0.06 0.00 0.00 57.16 57.02 1xxe n GLU 215 Cb 0.27 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.15 1xxe n GLU 215 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1xxe n GLY 216 N 1.32 -1.35 3.81 8.31 0.00 -1.07 -4.79 105.19 111.43 1xxe n GLY 216 Ca 0.13 -1.21 -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 4.24 0.20 0.99 1.43 -1.26 -4.96 118.68 119.31 1xxe s LEU 217 Ca 0.00 1.59 0.22 0.00 -1.03 0.00 0.00 54.13 54.91 1xxe s LEU 217 Cb 0.00 -3.96 -0.00 0.00 0.03 0.00 0.00 46.19 42.26 1xxe s LEU 217 CO 0.00 -0.10 1.05 0.03 0.23 0.00 0.00 176.35 177.56 1xxe h ARG 218 N 2.92 0.00 -3.58 1.70 3.08 -1.99 -3.46 114.38 113.04 1xxe h ARG 218 Ca -0.48 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.36 1xxe h ARG 218 Cb 1.19 0.00 -0.28 0.00 0.08 0.00 0.00 29.97 30.96 1xxe h ARG 218 CO 0.64 0.04 -0.65 0.71 -1.07 0.00 0.00 179.97 179.64 1xxe s TYR 219 N -3.30 -0.06 -0.46 3.04 2.02 -1.26 -4.96 117.35 112.37 1xxe s TYR 219 Ca -0.00 0.16 0.04 0.00 -0.37 0.00 0.00 57.07 56.89 1xxe s TYR 219 Cb 0.09 0.01 0.20 0.00 -0.40 0.00 0.00 41.96 41.87 1xxe s TYR 219 CO 0.79 -0.03 0.95 -0.85 -1.57 0.00 0.00 175.55 174.84 1xxe n GLU 220 N 3.11 0.03 -2.55 -0.62 0.28 -1.26 -0.44 120.64 119.18 1xxe n GLU 220 Ca -0.13 0.38 0.00 0.00 -0.16 0.00 0.00 57.16 57.26 1xxe n GLU 220 Cb 0.59 -1.79 0.05 0.00 1.43 0.00 0.00 31.44 31.72 1xxe n GLU 220 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1xxe n ASN 221 N -1.52 1.19 -0.19 -1.84 3.02 -1.26 -4.92 115.26 109.75 1xxe n ASN 221 Ca -0.00 -2.03 0.05 0.00 -0.03 0.00 0.00 54.58 52.57 1xxe n ASN 221 Cb 0.22 -0.35 0.33 0.00 -0.61 0.00 0.00 39.78 39.37 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 2.15 0.79 -0.12 3.52 4.22 -1.12 0.14 114.58 124.15 1xxe h GLU 222 Ca -0.19 -0.05 -0.12 0.00 0.08 0.00 0.00 59.36 59.09 1xxe h GLU 222 Cb 1.39 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1xxe h GLU 222 CO 0.13 0.52 -0.39 -1.35 -2.18 0.00 0.00 179.01 175.75 1xxe h PRO 223 N 0.81 0.48 0.00 0.92 0.11 -1.89 -2.28 132.00 130.16 1xxe h PRO 223 Ca 0.30 -0.35 -0.08 0.00 0.11 0.00 0.00 66.00 65.98 1xxe h PRO 223 Cb 0.16 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 1xxe h PRO 223 CO -0.09 0.97 -0.36 -0.39 -0.21 0.00 0.00 178.00 177.92 1xxe h VAL 224 N 0.08 0.70 -0.43 3.15 -1.51 -1.91 -2.60 116.25 113.73 1xxe h VAL 224 Ca -0.01 -1.68 -0.10 0.00 -1.23 0.00 0.00 66.70 63.68 1xxe h VAL 224 Cb 1.01 2.11 -0.01 0.00 -2.13 0.00 0.00 31.29 32.27 1xxe h VAL 224 CO 0.08 0.35 -0.13 0.03 -1.23 0.00 0.00 177.57 176.68 1xxe h ARG 225 N 0.00 0.84 -0.59 5.19 3.08 -0.70 -1.70 114.38 120.50 1xxe h ARG 225 Ca -0.00 -0.33 -0.03 0.00 0.07 0.00 0.00 59.98 59.68 1xxe h ARG 225 Cb 1.08 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 31.06 1xxe h ARG 225 CO 0.05 0.96 0.24 1.25 -1.07 0.00 0.00 179.97 181.40 1xxe h HIS 226 N 0.66 0.89 -0.37 3.04 2.76 -1.25 -1.02 115.15 119.86 1xxe h HIS 226 Ca 0.11 -0.06 0.04 0.00 -2.20 0.00 0.00 60.37 58.26 1xxe h HIS 226 Cb 0.67 -0.27 -0.04 0.00 1.55 0.00 0.00 27.41 29.32 1xxe h HIS 226 CO 0.05 0.71 0.12 -0.22 -1.30 0.00 0.00 177.93 177.29 1xxe h LYS 227 N 0.81 0.26 -0.56 5.26 1.63 -1.17 -0.42 116.57 122.38 1xxe h LYS 227 Ca 0.20 -0.02 0.01 0.00 -0.85 0.00 0.00 60.65 59.99 1xxe h LYS 227 Cb 0.19 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 31.73 1xxe h LYS 227 CO -0.02 0.17 0.36 0.28 -3.45 0.00 0.00 179.45 176.80 1xxe h VAL 228 N 0.27 1.12 -0.87 2.00 2.07 -0.95 0.87 116.25 120.76 1xxe h VAL 228 Ca 0.17 -0.25 0.12 0.00 0.82 0.00 0.00 66.70 67.55 1xxe h VAL 228 Cb 0.15 0.32 -0.07 0.00 -1.52 0.00 0.00 31.29 30.18 1xxe h VAL 228 CO -0.18 0.13 0.56 0.15 0.02 0.00 0.00 177.57 178.26 1xxe h PHE 229 N 0.73 0.86 0.02 1.57 3.57 -0.13 -1.11 116.94 122.46 1xxe h PHE 229 Ca 0.21 0.02 -0.26 0.00 3.53 0.00 0.00 57.97 61.47 1xxe h PHE 229 Cb -0.05 -0.28 0.02 0.00 2.79 0.00 0.00 35.95 38.43 1xxe h PHE 229 CO -0.04 0.36 -1.06 -0.44 -2.23 0.00 0.00 178.31 174.90 1xxe h ASP 230 N 0.77 0.81 -0.84 0.41 5.19 0.07 -2.40 116.42 120.42 1xxe h ASP 230 Ca 0.42 -0.67 0.08 0.00 -0.62 0.00 0.00 57.03 56.24 1xxe h ASP 230 Cb 0.56 -0.25 -0.06 0.00 0.18 0.00 0.00 39.33 39.76 1xxe h ASP 230 CO -0.18 1.47 0.55 0.25 -3.12 0.00 0.00 179.24 178.21 1xxe h LEU 231 N 0.33 0.79 -0.02 1.55 5.85 0.35 -0.03 115.31 124.13 1xxe h LEU 231 Ca -0.13 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.57 1xxe h LEU 231 Cb 1.72 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.59 1xxe h LEU 231 CO 0.20 0.49 -0.10 0.40 -0.34 0.00 0.00 178.44 179.09 1xxe h ILE 232 N 0.88 1.49 -1.05 4.05 2.04 -1.35 -1.84 117.51 121.72 1xxe h ILE 232 Ca 0.37 -1.59 0.28 0.00 1.00 0.00 0.00 64.86 64.92 1xxe h ILE 232 Cb 0.30 2.48 -0.08 0.00 -0.74 0.00 0.00 36.82 38.78 1xxe h ILE 232 CO -0.14 0.43 0.70 1.23 0.00 0.00 0.00 178.15 180.37 1xxe h GLY 233 N -0.48 0.86 1.78 5.37 0.00 -0.81 0.55 103.07 110.33 1xxe h GLY 233 Ca -0.01 -0.15 -0.16 0.00 0.00 0.00 0.00 47.33 47.02 1xxe h GLY 233 CO 0.02 -0.09 -0.86 -0.55 0.00 0.00 0.00 176.54 175.05 1xxe h ASP 234 N 0.28 0.00 1.58 0.19 5.19 -0.89 -3.26 116.42 119.51 1xxe h ASP 234 Ca 0.57 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.93 1xxe h ASP 234 Cb 1.66 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 41.17 1xxe h ASP 234 CO -0.21 0.69 -0.24 -0.07 -3.12 0.00 0.00 179.24 176.29 1xxe h LEU 235 N 0.00 0.00 0.00 1.55 3.38 0.87 -2.90 115.31 118.21 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 1.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.32 1xxe h LEU 235 CO 0.08 0.24 0.00 0.00 0.09 0.00 0.00 178.44 178.85 1xxe n TYR 236 N -3.19 0.00 -0.13 1.13 9.36 -0.09 -2.73 117.16 121.51 1xxe n TYR 236 Ca 0.02 0.00 0.25 0.00 3.32 0.00 0.00 57.90 61.49 1xxe n TYR 236 Cb 0.58 -0.27 0.69 0.00 -0.63 0.00 0.00 39.34 39.72 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 0.05 -1.93 2.98 3.38 -1.67 1.18 115.31 119.29 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 0.14 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1xxe h LEU 237 CO 0.00 0.02 0.17 -0.07 0.09 0.00 0.00 178.44 178.64 1xxe h LEU 238 N 0.05 0.00 0.00 1.67 3.38 -1.79 -3.24 115.31 115.38 1xxe h LEU 238 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 1xxe h LEU 238 Cb 1.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.19 1xxe h LEU 238 CO -0.02 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.12 1xxe n GLY 239 N -1.21 0.53 3.46 0.83 0.00 0.40 -5.00 105.19 104.20 1xxe n GLY 239 Ca -0.02 -0.42 -0.16 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.38 -0.56 0.13 1.61 1.04 -1.25 -4.86 113.70 107.42 1xxe s SER 240 Ca 0.00 0.48 -0.35 0.00 0.48 0.00 0.00 55.95 56.56 1xxe s SER 240 Cb 0.00 0.51 -0.16 0.00 0.10 0.00 0.00 66.02 66.48 1xxe s SER 240 CO 0.00 -0.65 1.35 -0.81 0.98 0.00 0.00 173.24 174.11 1xxe n PRO 241 N 0.72 1.39 -3.70 4.02 -0.04 -1.26 -4.66 135.00 131.46 1xxe n PRO 241 Ca -0.19 0.50 -0.37 0.00 -0.04 0.00 0.00 63.50 63.40 1xxe n PRO 241 Cb 0.58 -2.13 -0.07 0.00 -0.04 0.00 0.00 33.50 31.84 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 0.37 5.36 -0.12 0.52 1.01 -1.26 -1.13 120.40 125.15 1xxe s VAL 242 Ca 0.80 0.38 0.02 0.00 0.00 0.00 0.00 61.98 63.18 1xxe s VAL 242 Cb -0.86 -3.52 0.01 0.00 0.00 0.00 0.00 36.38 32.01 1xxe s VAL 242 CO 0.47 0.51 -0.20 -0.75 0.00 0.00 0.00 175.10 175.13 1xxe s LYS 243 N -0.34 2.70 0.00 2.72 2.47 0.10 -4.65 119.74 122.73 1xxe s LYS 243 Ca 0.15 -0.74 0.00 0.00 -1.56 0.00 0.00 55.97 53.82 1xxe s LYS 243 Cb -0.13 -2.19 0.00 0.00 -1.46 0.00 0.00 37.83 34.05 1xxe s LYS 243 CO 0.04 -0.00 0.00 0.41 0.16 0.00 0.00 175.35 175.96 1xxe n GLY 244 N 4.03 2.16 3.51 5.54 0.00 -1.07 -1.40 105.19 117.95 1xxe n GLY 244 Ca -0.20 -1.22 -0.41 0.00 0.00 0.00 0.00 46.02 44.20 1xxe n GLY 244 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xxe s LYS 245 N -1.99 3.32 0.08 1.61 2.20 1.00 -1.77 119.74 124.17 1xxe s LYS 245 Ca 0.00 -0.76 0.06 0.00 -0.36 0.00 0.00 55.97 54.91 1xxe s LYS 245 Cb 0.00 -3.87 -0.04 0.00 -1.51 0.00 0.00 37.83 32.41 1xxe s LYS 245 CO 0.00 -0.56 -0.08 -0.06 -0.36 0.00 0.00 175.35 174.29 1xxe s PHE 246 N 1.73 2.79 0.03 4.03 0.40 0.03 -0.28 117.98 126.72 1xxe s PHE 246 Ca 0.06 -0.12 0.06 0.00 -0.60 0.00 0.00 56.93 56.33 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 0.10 0.41 -0.16 -0.47 0.70 0.00 0.00 175.22 175.80 1xxe s TYR 247 N -1.17 1.42 -0.09 0.36 6.14 0.79 -0.46 117.35 124.34 1xxe s TYR 247 Ca 0.21 -0.34 -0.04 0.00 0.64 0.00 0.00 57.07 57.54 1xxe s TYR 247 Cb -0.11 -0.86 0.05 0.00 0.42 0.00 0.00 41.96 41.46 1xxe s TYR 247 CO 0.13 0.04 0.20 0.45 0.64 0.00 0.00 175.55 177.01 1xxe s SER 248 N -1.02 0.22 -0.27 4.32 0.15 0.26 -1.19 113.70 116.17 1xxe s SER 248 Ca 0.04 0.42 -0.05 0.00 0.70 0.00 0.00 55.95 57.06 1xxe s SER 248 Cb -0.08 0.37 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 1xxe s SER 248 CO 0.01 -0.20 0.03 0.12 1.20 0.00 0.00 173.24 174.40 1xxe s PHE 249 N 1.80 3.09 -1.28 3.44 5.36 -0.27 0.01 117.98 130.14 1xxe s PHE 249 Ca -0.03 -0.99 -0.18 0.00 -0.96 0.00 0.00 56.93 54.77 1xxe s PHE 249 Cb -0.12 -2.19 0.01 0.00 -0.34 0.00 0.00 43.02 40.38 1xxe s PHE 249 CO -0.07 -0.57 0.57 0.54 -1.46 0.00 0.00 175.22 174.23 1xxe n ARG 250 N 4.83 -1.36 -3.11 10.12 5.12 -0.35 -2.41 116.66 129.50 1xxe n ARG 250 Ca -0.16 0.28 -0.31 0.00 -1.93 0.00 0.00 57.85 55.73 1xxe n ARG 250 Cb 0.49 -3.65 -0.04 0.00 -1.16 0.00 0.00 32.46 28.10 1xxe n ARG 250 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1xxe s GLY 251 N -3.82 2.09 0.41 -0.13 0.00 -1.26 -4.32 107.32 100.29 1xxe s GLY 251 Ca 0.31 -0.22 0.00 0.00 0.00 0.00 0.00 44.72 44.81 1xxe s GLY 251 CO 0.92 -0.05 0.00 0.61 0.00 0.00 0.00 173.10 174.58 1xxe n GLY 252 N -0.79 3.68 0.09 0.20 0.00 -1.26 -5.00 105.19 102.12 1xxe n GLY 252 Ca 0.02 -2.34 -0.13 0.00 0.00 0.00 0.00 46.02 43.57 1xxe n GLY 252 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1xxe h HIS 253 N 1.21 -0.08 -0.56 1.61 3.86 -1.95 -1.18 115.15 118.05 1xxe h HIS 253 Ca -0.34 -0.00 0.05 0.00 -1.16 0.00 0.00 60.37 58.92 1xxe h HIS 253 Cb 1.04 0.03 -0.03 0.00 1.06 0.00 0.00 27.41 29.50 1xxe h HIS 253 CO 0.00 0.42 0.37 0.66 0.86 0.00 0.00 177.93 180.24 1xxe h SER 254 N -0.65 0.49 -0.19 2.45 4.64 -1.88 -0.22 113.55 118.19 1xxe h SER 254 Ca -0.01 -0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.10 1xxe h SER 254 Cb 0.54 -0.11 0.01 0.00 -0.31 0.00 0.00 62.40 62.53 1xxe h SER 254 CO 0.02 0.33 -0.70 0.25 -0.87 0.00 0.00 176.83 175.86 1xxe h LEU 255 N 0.56 0.93 0.10 5.97 5.85 -1.95 -2.67 115.31 124.11 1xxe h LEU 255 Ca 0.24 -0.60 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 1xxe h LEU 255 Cb 0.23 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.99 1xxe h LEU 255 CO -0.07 1.38 -0.05 0.78 -0.34 0.00 0.00 178.44 180.14 1xxe h ASN 256 N 0.54 -0.12 -0.74 1.25 2.35 -0.10 -2.24 115.58 116.52 1xxe h ASN 256 Ca -0.03 -0.04 0.14 0.00 -0.55 0.00 0.00 56.30 55.82 1xxe h ASN 256 Cb 1.32 0.03 -0.10 0.00 0.05 0.00 0.00 38.32 39.63 1xxe h ASN 256 CO 0.15 -0.04 0.28 0.58 -1.65 0.00 0.00 177.43 176.75 1xxe h VAL 257 N -0.19 0.65 -0.32 2.81 2.07 -1.09 0.07 116.25 120.24 1xxe h VAL 257 Ca -0.01 -0.14 0.06 0.00 0.82 0.00 0.00 66.70 67.42 1xxe h VAL 257 Cb 0.15 0.19 -0.05 0.00 -1.52 0.00 0.00 31.29 30.06 1xxe h VAL 257 CO 0.02 0.08 -0.00 0.50 0.02 0.00 0.00 177.57 178.19 1xxe h LYS 258 N 0.42 0.09 -1.00 1.57 3.64 -1.06 0.77 116.57 121.00 1xxe h LYS 258 Ca 0.41 -0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.94 1xxe h LYS 258 Cb 0.62 -0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 32.33 1xxe h LYS 258 CO -0.41 0.06 0.61 1.25 -2.27 0.00 0.00 179.45 178.69 1xxe h LEU 259 N 0.09 0.85 -0.06 5.20 5.85 -0.45 0.81 115.31 127.59 1xxe h LEU 259 Ca 0.16 0.07 -0.21 0.00 0.84 0.00 0.00 57.88 58.74 1xxe h LEU 259 Cb 0.21 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 41.17 1xxe h LEU 259 CO -0.26 0.38 -0.78 0.58 -0.34 0.00 0.00 178.44 178.02 1xxe h VAL 260 N 0.87 1.32 -0.20 1.05 2.07 -0.18 -2.39 116.25 118.79 1xxe h VAL 260 Ca 0.53 -2.05 0.01 0.00 0.82 0.00 0.00 66.70 66.01 1xxe h VAL 260 Cb 0.69 2.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.72 1xxe h VAL 260 CO -0.32 0.63 0.12 0.11 0.02 0.00 0.00 177.57 178.12 1xxe h LYS 261 N 0.29 0.24 -0.15 1.57 1.57 0.18 0.35 116.57 120.62 1xxe h LYS 261 Ca -0.08 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 1xxe h LYS 261 Cb 1.43 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.68 1xxe h LYS 261 CO 0.16 0.16 -0.01 0.93 -0.57 0.00 0.00 179.45 180.12 1xxe h GLU 262 N 0.25 0.28 -0.66 3.15 4.39 -0.97 -1.00 114.58 120.01 1xxe h GLU 262 Ca 0.08 -0.09 0.03 0.00 0.34 0.00 0.00 59.36 59.72 1xxe h GLU 262 Cb -0.01 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.58 1xxe h GLU 262 CO -0.04 0.51 0.41 -0.07 -1.16 0.00 0.00 179.01 178.66 1xxe h LEU 263 N 0.01 0.66 -1.22 1.33 3.38 -1.22 0.64 115.31 118.89 1xxe h LEU 263 Ca 0.04 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 1xxe h LEU 263 Cb 0.39 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1xxe h LEU 263 CO 0.01 0.46 -0.23 0.00 0.09 0.00 0.00 178.44 178.77 1xxe h ALA 264 N 1.29 1.35 0.00 1.53 0.00 -0.15 -1.81 119.26 121.48 1xxe h ALA 264 Ca 0.27 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1xxe h ALA 264 Cb 0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1xxe h ALA 264 CO -0.11 0.44 -0.84 0.87 0.00 0.00 0.00 179.25 179.61 1xxe h LYS 265 N 0.23 0.00 -0.20 0.00 1.57 -0.20 -3.30 116.57 114.67 1xxe h LYS 265 Ca 0.04 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.74 1xxe h LYS 265 Cb 0.54 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1xxe h LYS 265 CO 0.04 0.34 -0.19 0.87 -0.57 0.00 0.00 179.45 179.94 1xxe h LYS 266 N 0.00 0.48 -0.49 3.15 1.57 0.76 -2.75 116.57 119.29 1xxe h LYS 266 Ca -0.06 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 1xxe h LYS 266 Cb 1.39 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.71 1xxe h LYS 266 CO 0.05 0.82 0.00 0.94 -0.57 0.00 0.00 179.45 180.69 1xxe n GLN 267 N -4.46 0.95 -0.06 3.15 7.27 -0.73 -4.31 117.38 119.20 1xxe n GLN 267 Ca -0.05 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.02 1xxe n GLN 267 Cb 0.40 -1.24 0.00 0.00 2.41 0.00 0.00 30.24 31.80 1xxe n GLN 267 CO 0.00 0.00 0.00 1.17 0.07 0.00 0.00 177.06 178.30 1xxe n LYS 268 N -0.23 0.30 0.00 3.69 4.81 -1.04 -3.97 118.16 121.72 1xxe n LYS 268 Ca 0.00 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.48 1xxe n LYS 268 Cb 0.12 -1.35 0.20 0.00 0.02 0.00 0.00 35.03 34.02 1xxe n LYS 268 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1xxe n LEU 269 N 1.21 0.00 0.00 3.14 4.77 -1.26 -5.13 117.00 119.73 1xxe n LEU 269 Ca 0.00 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 1xxe n LEU 269 Cb 0.15 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1xxe n LEU 269 CO 0.00 -0.22 0.00 1.07 -1.33 0.00 0.00 177.39 176.91