#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 0.72 -4.72 3.23 4.71 0.11 -4.70 120.64 119.99 1xxe n GLU 4 Ca 0.00 0.26 -0.33 0.00 -0.01 0.00 0.00 57.16 57.08 1xxe n GLU 4 Cb 0.00 -1.86 -0.13 0.00 -1.01 0.00 0.00 31.44 28.44 1xxe n GLU 4 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 1xxe s LYS 5 N 0.94 3.21 0.33 3.49 2.47 -1.26 -0.77 119.74 128.14 1xxe s LYS 5 Ca 0.90 -0.64 0.03 0.00 -1.56 0.00 0.00 55.97 54.70 1xxe s LYS 5 Cb -1.10 -2.63 -0.04 0.00 -1.46 0.00 0.00 37.83 32.60 1xxe s LYS 5 CO 0.55 0.34 0.14 -0.08 0.16 0.00 0.00 175.35 176.46 1xxe s THR 6 N 0.04 0.50 0.02 3.43 -1.32 -0.64 -2.30 115.64 115.36 1xxe s THR 6 Ca -0.03 -2.00 -0.27 0.00 -1.21 0.00 0.00 61.69 58.18 1xxe s THR 6 Cb -0.14 -2.52 -0.04 0.00 -1.51 0.00 0.00 72.50 68.29 1xxe s THR 6 CO 0.04 0.00 0.83 0.68 -2.21 0.00 0.00 174.62 173.96 1xxe s VAL 7 N -3.49 4.81 0.08 5.08 -7.23 -1.26 0.87 120.40 119.25 1xxe s VAL 7 Ca 0.33 1.76 -0.22 0.00 -1.81 0.00 0.00 61.98 62.04 1xxe s VAL 7 Cb 0.05 -4.18 -0.14 0.00 0.56 0.00 0.00 36.38 32.67 1xxe s VAL 7 CO 0.16 0.28 1.64 0.50 -0.31 0.00 0.00 175.10 177.38 1xxe h LYS 8 N 6.20 0.10 -5.79 4.82 3.64 0.27 -3.42 116.57 122.40 1xxe h LYS 8 Ca -0.42 -0.01 -0.49 0.00 -1.27 0.00 0.00 60.65 58.45 1xxe h LYS 8 Cb 1.21 -0.02 -0.18 0.00 -0.41 0.00 0.00 32.23 32.83 1xxe h LYS 8 CO 0.73 0.18 -0.77 -2.00 -2.27 0.00 0.00 179.45 175.32 1xxe s GLU 9 N -5.73 1.23 0.33 1.90 2.12 -1.26 -5.00 118.70 112.29 1xxe s GLU 9 Ca -0.14 -1.39 -0.29 0.00 0.36 0.00 0.00 54.97 53.51 1xxe s GLU 9 Cb 0.06 -1.22 -0.11 0.00 0.26 0.00 0.00 34.13 33.12 1xxe s GLU 9 CO 0.68 0.24 1.53 1.17 -0.54 0.00 0.00 175.26 178.34 1xxe n LYS 10 N 0.27 2.67 -4.50 4.30 0.00 -1.26 -4.91 118.16 114.73 1xxe n LYS 10 Ca -0.13 0.94 -0.25 0.00 0.00 0.00 0.00 58.31 58.87 1xxe n LYS 10 Cb 0.57 -2.69 -0.10 0.00 0.00 0.00 0.00 35.03 32.81 1xxe n LYS 10 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1xxe s LEU 11 N -1.23 2.66 -0.08 3.14 1.43 -0.93 -4.99 118.68 118.68 1xxe s LEU 11 Ca 0.59 -1.10 -0.16 0.00 -1.03 0.00 0.00 54.13 52.42 1xxe s LEU 11 Cb -0.49 -1.06 0.04 0.00 0.03 0.00 0.00 46.19 44.71 1xxe s LEU 11 CO 0.56 -0.07 0.40 -0.94 0.23 0.00 0.00 176.35 176.53 1xxe s SER 12 N -3.55 -0.35 0.20 2.29 1.04 -1.26 -1.37 113.70 110.69 1xxe s SER 12 Ca 0.31 0.48 0.06 0.00 0.48 0.00 0.00 55.95 57.28 1xxe s SER 12 Cb -0.02 0.57 -0.05 0.00 0.10 0.00 0.00 66.02 66.62 1xxe s SER 12 CO 0.16 -0.33 -0.10 -0.36 0.98 0.00 0.00 173.24 173.58 1xxe s PHE 13 N -0.65 1.56 -0.17 5.02 0.08 -0.01 -4.96 117.98 118.86 1xxe s PHE 13 Ca -0.07 -0.71 -0.10 0.00 0.12 0.00 0.00 56.93 56.16 1xxe s PHE 13 Cb -0.04 -0.79 0.05 0.00 -0.57 0.00 0.00 43.02 41.67 1xxe s PHE 13 CO 0.03 0.19 0.41 -1.83 -0.10 0.00 0.00 175.22 173.92 1xxe s GLU 14 N -3.72 0.41 0.00 0.44 1.03 -1.26 -1.25 118.70 114.35 1xxe s GLU 14 Ca 0.22 0.73 0.00 0.00 0.03 0.00 0.00 54.97 55.95 1xxe s GLU 14 Cb 0.02 0.04 0.00 0.00 -0.80 0.00 0.00 34.13 33.39 1xxe s GLU 14 CO 0.05 -0.13 0.00 0.41 -1.33 0.00 0.00 175.26 174.26 1xxe n GLY 15 N 3.92 1.59 3.81 -3.83 0.00 -0.78 -4.96 105.19 104.95 1xxe n GLY 15 Ca -0.21 -0.65 -0.31 0.00 0.00 0.00 0.00 46.02 44.85 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 3.90 0.04 1.61 0.11 -1.26 -2.26 120.40 120.53 1xxe s VAL 16 Ca 0.00 0.62 -0.19 0.00 -2.93 0.00 0.00 61.98 59.48 1xxe s VAL 16 Cb 0.00 -3.33 -0.06 0.00 -1.53 0.00 0.00 36.38 31.46 1xxe s VAL 16 CO 0.00 -0.81 0.54 -0.83 -3.33 0.00 0.00 175.10 170.67 1xxe s GLY 17 N -3.75 2.62 0.15 6.54 0.00 -0.83 -1.31 107.32 110.74 1xxe s GLY 17 Ca 0.59 -0.02 -0.17 0.00 0.00 0.00 0.00 44.72 45.12 1xxe s GLY 17 CO 0.55 0.47 1.80 1.19 0.00 0.00 0.00 173.10 177.11 1xxe h ILE 18 N 3.72 1.11 0.13 0.90 2.10 -1.83 0.53 117.51 124.17 1xxe h ILE 18 Ca -0.49 -0.22 -0.33 0.00 1.08 0.00 0.00 64.86 64.90 1xxe h ILE 18 Cb 1.21 0.57 -0.01 0.00 -1.09 0.00 0.00 36.82 37.51 1xxe h ILE 18 CO 0.65 0.11 -1.72 0.45 -1.08 0.00 0.00 178.15 176.55 1xxe h HIS 19 N 0.51 0.49 0.02 2.19 -0.00 -1.89 2.53 115.15 119.00 1xxe h HIS 19 Ca 0.14 -0.36 -0.27 0.00 -0.00 0.00 0.00 60.37 59.88 1xxe h HIS 19 Cb -0.04 -0.02 0.02 0.00 -0.00 0.00 0.00 27.41 27.38 1xxe h HIS 19 CO -0.04 1.52 -1.07 1.79 -0.00 0.00 0.00 177.93 180.13 1xxe h THR 20 N 0.07 1.28 0.00 2.45 1.35 -1.93 -1.88 112.91 114.26 1xxe h THR 20 Ca -0.32 -2.27 0.00 0.00 -0.55 0.00 0.00 66.41 63.27 1xxe h THR 20 Cb 2.05 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 70.90 1xxe h THR 20 CO 0.14 0.70 0.00 0.61 -0.25 0.00 0.00 175.52 176.72 1xxe n GLY 21 N 1.13 0.51 3.90 5.82 0.00 0.19 -4.55 105.19 112.19 1xxe n GLY 21 Ca -0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.48 3.65 0.14 1.61 2.12 -1.26 -4.69 118.70 119.79 1xxe s GLU 22 Ca 0.00 -0.01 -0.30 0.00 0.36 0.00 0.00 54.97 55.02 1xxe s GLU 22 Cb 0.00 -2.72 -0.07 0.00 0.26 0.00 0.00 34.13 31.59 1xxe s GLU 22 CO 0.00 0.33 1.18 -0.47 -0.54 0.00 0.00 175.26 175.76 1xxe s TYR 23 N -1.89 3.46 0.07 5.30 6.14 -1.26 -1.96 117.35 127.21 1xxe s TYR 23 Ca 0.43 1.41 0.01 0.00 0.64 0.00 0.00 57.07 59.56 1xxe s TYR 23 Cb -0.11 -3.41 -0.04 0.00 0.42 0.00 0.00 41.96 38.83 1xxe s TYR 23 CO 0.26 -1.15 -0.05 0.45 0.64 0.00 0.00 175.55 175.70 1xxe s SER 24 N 0.40 0.83 0.10 4.32 0.15 -0.96 -4.87 113.70 113.67 1xxe s SER 24 Ca 0.54 -0.90 0.04 0.00 0.70 0.00 0.00 55.95 56.33 1xxe s SER 24 Cb -0.31 0.12 -0.04 0.00 -1.71 0.00 0.00 66.02 64.08 1xxe s SER 24 CO 0.34 -0.46 -0.10 -0.75 1.20 0.00 0.00 173.24 173.47 1xxe s LYS 25 N -3.36 0.87 0.02 5.44 2.20 -0.83 -1.86 119.74 122.22 1xxe s LYS 25 Ca 0.05 -1.19 0.04 0.00 -0.36 0.00 0.00 55.97 54.51 1xxe s LYS 25 Cb 0.03 -0.55 -0.02 0.00 -1.51 0.00 0.00 37.83 35.78 1xxe s LYS 25 CO -0.05 0.08 -0.11 -0.51 -0.36 0.00 0.00 175.35 174.40 1xxe s LEU 26 N -2.51 2.13 -0.07 5.43 1.43 -0.38 -0.52 118.68 124.19 1xxe s LEU 26 Ca 0.06 -0.36 -0.00 0.00 -1.03 0.00 0.00 54.13 52.80 1xxe s LEU 26 Cb -0.02 -0.48 0.03 0.00 0.03 0.00 0.00 46.19 45.74 1xxe s LEU 26 CO 0.00 0.03 -0.02 -0.63 0.23 0.00 0.00 176.35 175.96 1xxe s ILE 27 N -0.69 0.49 -0.16 -0.59 1.01 -0.56 -0.83 121.20 119.88 1xxe s ILE 27 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 60.65 60.63 1xxe s ILE 27 Cb -0.06 -0.59 -0.02 0.00 0.01 0.00 0.00 42.46 41.80 1xxe s ILE 27 CO 0.01 0.26 -0.08 -0.63 0.00 0.00 0.00 174.94 174.50 1xxe s ILE 28 N 1.58 3.44 0.17 2.92 1.01 -0.47 0.11 121.20 129.94 1xxe s ILE 28 Ca -0.01 -0.51 0.11 0.00 0.00 0.00 0.00 60.65 60.24 1xxe s ILE 28 Cb -0.13 -2.50 -0.04 0.00 0.01 0.00 0.00 42.46 39.80 1xxe s ILE 28 CO -0.04 0.49 -0.24 -1.00 0.00 0.00 0.00 174.94 174.15 1xxe s HIS 29 N 0.62 2.33 0.84 3.97 3.76 -0.93 -2.18 115.29 123.70 1xxe s HIS 29 Ca -0.05 -0.36 -0.12 0.00 -0.15 0.00 0.00 55.06 54.39 1xxe s HIS 29 Cb -0.15 -1.19 0.10 0.00 1.11 0.00 0.00 32.58 32.45 1xxe s HIS 29 CO 0.03 0.44 1.17 -1.25 -0.85 0.00 0.00 174.74 174.28 1xxe s PRO 30 N -2.46 1.51 0.13 8.40 0.04 -1.26 -1.91 135.00 139.45 1xxe s PRO 30 Ca 0.19 1.61 0.01 0.00 0.04 0.00 0.00 61.00 62.85 1xxe s PRO 30 Cb -0.09 -1.78 -0.01 0.00 0.04 0.00 0.00 34.50 32.67 1xxe s PRO 30 CO 0.09 -2.28 0.05 0.39 0.04 0.00 0.00 177.00 175.29 1xxe n GLU 31 N -3.63 0.73 -3.32 4.56 -0.58 -1.25 -4.68 120.64 112.46 1xxe n GLU 31 Ca 0.12 -1.13 -0.29 0.00 -0.42 0.00 0.00 57.16 55.44 1xxe n GLU 31 Cb 0.51 0.66 -0.04 0.00 -0.57 0.00 0.00 31.44 32.01 1xxe n GLU 31 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1xxe s LYS 32 N -2.51 3.67 0.45 3.49 2.20 -1.26 -4.94 119.74 120.85 1xxe s LYS 32 Ca 0.08 0.08 -0.22 0.00 -0.36 0.00 0.00 55.97 55.55 1xxe s LYS 32 Cb 0.00 -2.63 -0.11 0.00 -1.51 0.00 0.00 37.83 33.58 1xxe s LYS 32 CO 0.05 0.22 0.62 0.39 -0.36 0.00 0.00 175.35 176.27 1xxe n GLU 33 N -0.80 0.69 -2.00 4.03 4.71 -1.26 -1.38 120.64 124.62 1xxe n GLU 33 Ca -0.01 0.25 -0.20 0.00 -0.01 0.00 0.00 57.16 57.19 1xxe n GLU 33 Cb 0.54 -1.64 -0.05 0.00 -1.01 0.00 0.00 31.44 29.28 1xxe n GLU 33 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1xxe n GLY 34 N 1.68 0.71 0.12 0.62 0.00 -1.26 -4.85 105.19 102.21 1xxe n GLY 34 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 1xxe n GLY 34 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xxe h THR 35 N 0.00 1.30 0.00 2.61 2.02 -1.40 -3.50 112.91 113.94 1xxe h THR 35 Ca -0.45 -2.85 0.00 0.00 0.77 0.00 0.00 66.41 63.88 1xxe h THR 35 Cb 1.34 2.91 0.00 0.00 -1.74 0.00 0.00 68.15 70.66 1xxe h THR 35 CO 0.59 0.85 0.00 0.61 0.37 0.00 0.00 175.52 177.94 1xxe n GLY 36 N 1.65 -1.88 3.63 2.16 0.00 0.15 -4.86 105.19 106.04 1xxe n GLY 36 Ca -0.14 -1.82 -0.37 0.00 0.00 0.00 0.00 46.02 43.69 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 -0.02 5.23 0.01 -0.61 -1.09 -1.25 -2.33 121.20 121.13 1xxe s ILE 37 Ca 0.00 0.14 0.02 0.00 -2.23 0.00 0.00 60.65 58.57 1xxe s ILE 37 Cb 0.00 -3.44 -0.01 0.00 -1.58 0.00 0.00 42.46 37.43 1xxe s ILE 37 CO 0.00 0.34 -0.06 0.00 -1.23 0.00 0.00 174.94 173.99 1xxe s ARG 38 N 1.16 0.43 0.13 2.79 1.70 -1.01 -1.52 118.95 122.63 1xxe s ARG 38 Ca 0.07 -0.36 0.04 0.00 -0.47 0.00 0.00 55.73 55.01 1xxe s ARG 38 Cb -0.14 -0.35 -0.04 0.00 -0.57 0.00 0.00 34.95 33.86 1xxe s ARG 38 CO 0.05 0.09 0.15 -0.06 -1.08 0.00 0.00 175.30 174.45 1xxe s PHE 39 N -0.52 3.24 -0.00 5.89 0.08 -0.41 -1.62 117.98 124.64 1xxe s PHE 39 Ca -0.02 0.05 0.04 0.00 0.12 0.00 0.00 56.93 57.12 1xxe s PHE 39 Cb -0.04 -1.58 -0.01 0.00 -0.57 0.00 0.00 43.02 40.81 1xxe s PHE 39 CO -0.00 0.52 -0.14 0.12 -0.10 0.00 0.00 175.22 175.63 1xxe s PHE 40 N -1.63 1.23 -0.29 0.36 2.19 -0.75 0.69 117.98 119.78 1xxe s PHE 40 Ca 0.31 -0.25 -0.22 0.00 0.33 0.00 0.00 56.93 57.11 1xxe s PHE 40 Cb -0.11 -0.79 0.14 0.00 -1.31 0.00 0.00 43.02 40.95 1xxe s PHE 40 CO 0.24 -0.01 1.05 0.21 1.83 0.00 0.00 175.22 178.54 1xxe s LYS 41 N -0.44 0.41 -1.78 10.12 2.20 -0.56 -1.63 119.74 128.06 1xxe s LYS 41 Ca 0.05 0.56 0.00 0.00 -0.36 0.00 0.00 55.97 56.22 1xxe s LYS 41 Cb -0.06 0.16 0.00 0.00 -1.51 0.00 0.00 37.83 36.43 1xxe s LYS 41 CO -0.00 -0.06 0.00 -1.71 -0.36 0.00 0.00 175.35 173.22 1xxe n ASN 42 N 2.68 -5.79 -0.80 1.43 4.05 -1.26 -1.19 115.26 114.39 1xxe n ASN 42 Ca -0.14 0.02 -0.09 0.00 0.45 0.00 0.00 54.58 54.82 1xxe n ASN 42 Cb 0.57 -4.83 -0.03 0.00 1.23 0.00 0.00 39.78 36.72 1xxe n ASN 42 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1xxe n GLY 43 N -0.97 0.81 3.07 8.20 0.00 -1.26 -5.01 105.19 110.03 1xxe n GLY 43 Ca -0.24 -0.58 -0.24 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.37 1.19 0.27 1.61 1.01 -0.33 -5.13 120.40 116.64 1xxe s VAL 44 Ca 0.00 -0.56 -0.16 0.00 0.00 0.00 0.00 61.98 61.25 1xxe s VAL 44 Cb 0.00 -1.04 -0.08 0.00 0.00 0.00 0.00 36.38 35.25 1xxe s VAL 44 CO 0.00 0.35 0.71 -0.31 0.00 0.00 0.00 175.10 175.86 1xxe s TYR 45 N 0.24 3.49 -0.33 5.22 2.02 -1.26 -1.50 117.35 125.23 1xxe s TYR 45 Ca -0.06 1.26 -0.00 0.00 -0.37 0.00 0.00 57.07 57.89 1xxe s TYR 45 Cb -0.12 -2.54 0.13 0.00 -0.40 0.00 0.00 41.96 39.03 1xxe s TYR 45 CO 0.02 0.21 0.24 0.42 -1.57 0.00 0.00 175.55 174.88 1xxe s ILE 46 N -1.77 -0.12 0.35 2.71 1.01 0.22 -4.92 121.20 118.67 1xxe s ILE 46 Ca 0.49 -1.07 -0.25 0.00 0.00 0.00 0.00 60.65 59.82 1xxe s ILE 46 Cb -0.13 -0.96 -0.13 0.00 0.01 0.00 0.00 42.46 41.25 1xxe s ILE 46 CO 0.19 -0.73 0.78 -2.65 0.00 0.00 0.00 174.94 172.52 1xxe n PRO 47 N 4.65 0.89 -3.20 2.79 -0.02 -1.26 -1.29 135.00 137.56 1xxe n PRO 47 Ca 0.04 0.32 -0.46 0.00 -2.02 0.00 0.00 63.50 61.38 1xxe n PRO 47 Cb 0.42 -1.64 -0.02 0.00 -0.02 0.00 0.00 33.50 32.24 1xxe n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xxe s ALA 48 N -1.24 4.02 0.06 3.55 0.00 -0.57 -4.78 121.76 122.80 1xxe s ALA 48 Ca 0.62 -3.29 -0.04 0.00 0.00 0.00 0.00 51.96 49.25 1xxe s ALA 48 Cb -0.67 -3.71 -0.02 0.00 0.00 0.00 0.00 23.12 18.72 1xxe s ALA 48 CO 0.58 -2.48 0.05 1.03 0.00 0.00 0.00 175.76 174.94 1xxe s ARG 49 N 0.64 0.67 0.16 0.00 0.52 -1.26 -4.65 118.95 115.03 1xxe s ARG 49 Ca 0.26 -1.08 -0.17 0.00 -0.52 0.00 0.00 55.73 54.22 1xxe s ARG 49 Cb -0.08 0.25 0.07 0.00 0.52 0.00 0.00 34.95 35.71 1xxe s ARG 49 CO -0.08 -0.16 1.68 1.12 0.02 0.00 0.00 175.30 177.88 1xxe h HIS 50 N 3.12 -0.14 0.00 -0.53 2.07 -1.94 0.16 115.15 117.90 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 0.50 -0.13 0.47 0.93 -3.07 0.00 0.00 177.93 176.64 1xxe h GLU 51 N 0.03 0.00 -0.39 5.12 5.08 -1.97 1.95 114.58 124.40 1xxe h GLU 51 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1xxe h GLU 51 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1xxe h GLU 51 CO -0.34 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 178.86 1xxe n PHE 52 N -2.15 0.50 -1.89 4.33 3.01 0.58 -4.92 117.46 116.93 1xxe n PHE 52 Ca -0.01 -0.25 -0.42 0.00 1.01 0.00 0.00 57.45 57.78 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 -1.50 3.15 -0.07 -4.37 1.01 0.66 -2.77 120.40 116.52 1xxe s VAL 53 Ca 0.38 0.43 0.07 0.00 0.00 0.00 0.00 61.98 62.86 1xxe s VAL 53 Cb 0.22 -3.28 -0.09 0.00 0.00 0.00 0.00 36.38 33.23 1xxe s VAL 53 CO 0.30 -0.02 0.03 1.33 0.00 0.00 0.00 175.10 176.75 1xxe n VAL 54 N 5.09 0.49 -3.63 2.92 0.24 -0.98 -4.93 118.33 117.53 1xxe n VAL 54 Ca 0.17 -0.31 -0.14 0.00 -2.04 0.00 0.00 64.34 62.02 1xxe n VAL 54 Cb 0.41 -0.75 -0.13 0.00 -1.47 0.00 0.00 33.84 31.90 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 -2.20 -0.39 -0.17 6.34 5.65 -1.21 -5.06 115.29 118.25 1xxe s HIS 55 Ca -0.04 0.81 -0.03 0.00 0.25 0.00 0.00 55.06 56.06 1xxe s HIS 55 Cb 0.02 -0.11 -0.02 0.00 -1.18 0.00 0.00 32.58 31.29 1xxe s HIS 55 CO 0.31 -0.39 -0.06 0.95 -0.65 0.00 0.00 174.74 174.90 1xxe s THR 56 N 2.40 3.57 0.00 0.89 -4.23 -1.26 -2.04 115.64 114.96 1xxe s THR 56 Ca 0.03 -0.46 0.00 0.00 -1.18 0.00 0.00 61.69 60.08 1xxe s THR 56 Cb -0.13 -2.57 0.00 0.00 1.34 0.00 0.00 72.50 71.14 1xxe s THR 56 CO -0.09 0.48 0.00 -3.20 -0.54 0.00 0.00 174.62 171.27 1xxe n ASN 57 N 3.91 0.00 0.10 3.99 5.15 -1.26 -4.87 115.26 122.28 1xxe n ASN 57 Ca -0.18 0.00 0.02 0.00 -0.60 0.00 0.00 54.58 53.83 1xxe n ASN 57 Cb 0.52 0.00 0.12 0.00 -0.53 0.00 0.00 39.78 39.89 1xxe n ASN 57 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 1xxe n HIS 58 N 0.00 0.15 -4.17 1.20 8.25 -1.26 -4.39 115.22 115.01 1xxe n HIS 58 Ca 0.00 0.08 -0.11 0.00 -0.26 0.00 0.00 57.72 57.43 1xxe n HIS 58 Cb 0.00 -0.30 -0.10 0.00 1.12 0.00 0.00 29.99 30.71 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 -2.75 0.43 -0.19 0.41 0.15 -1.26 -5.06 113.70 105.43 1xxe s SER 59 Ca -0.01 -1.23 -0.05 0.00 0.70 0.00 0.00 55.95 55.37 1xxe s SER 59 Cb 0.01 0.28 -0.02 0.00 -1.71 0.00 0.00 66.02 64.58 1xxe s SER 59 CO 0.04 -0.72 -0.01 -0.89 1.20 0.00 0.00 173.24 172.86 1xxe s THR 60 N -4.00 3.91 0.06 6.45 2.01 -1.26 -4.54 115.64 118.26 1xxe s THR 60 Ca 0.26 -0.33 0.07 0.00 0.31 0.00 0.00 61.69 62.00 1xxe s THR 60 Cb 0.07 -2.76 -0.03 0.00 0.01 0.00 0.00 72.50 69.80 1xxe s THR 60 CO 0.03 0.44 -0.19 -1.81 -0.69 0.00 0.00 174.62 172.40 1xxe s ASP 61 N 0.91 2.32 0.17 3.53 1.01 -0.87 -1.07 116.67 122.67 1xxe s ASP 61 Ca 0.01 -0.55 0.08 0.00 0.71 0.00 0.00 52.55 52.80 1xxe s ASP 61 Cb -0.14 -0.17 -0.04 0.00 1.01 0.00 0.00 42.92 43.58 1xxe s ASP 61 CO 0.02 0.11 -0.17 -0.76 0.21 0.00 0.00 175.17 174.58 1xxe s LEU 62 N -1.35 2.46 -0.25 1.23 1.43 -0.81 -2.32 118.68 119.07 1xxe s LEU 62 Ca 0.06 -0.89 -0.28 0.00 -1.03 0.00 0.00 54.13 51.98 1xxe s LEU 62 Cb -0.09 -0.76 0.17 0.00 0.03 0.00 0.00 46.19 45.54 1xxe s LEU 62 CO 0.02 -0.08 1.25 -0.83 0.23 0.00 0.00 176.35 176.95 1xxe s GLY 63 N -2.80 0.02 0.00 -3.19 0.00 -1.11 -0.01 107.32 100.22 1xxe s GLY 63 Ca 0.17 2.73 -0.07 0.00 0.00 0.00 0.00 44.72 47.55 1xxe s GLY 63 CO 0.06 1.28 0.13 -0.12 0.00 0.00 0.00 173.10 174.46 1xxe s PHE 64 N -0.77 0.04 -1.57 1.90 5.36 0.88 -4.81 117.98 119.02 1xxe s PHE 64 Ca 0.05 -0.13 -0.03 0.00 -0.96 0.00 0.00 56.93 55.87 1xxe s PHE 64 Cb -0.02 -0.05 0.01 0.00 -0.34 0.00 0.00 43.02 42.62 1xxe s PHE 64 CO -0.07 -0.27 0.29 1.63 -1.46 0.00 0.00 175.22 175.34 1xxe n LYS 65 N 1.52 -3.20 -0.96 10.12 5.02 -1.26 -0.89 118.16 128.52 1xxe n LYS 65 Ca -0.22 0.88 0.00 0.00 -2.02 0.00 0.00 58.31 56.94 1xxe n LYS 65 Cb 0.56 -5.62 0.00 0.00 -0.02 0.00 0.00 35.03 29.94 1xxe n LYS 65 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xxe n GLY 66 N -1.21 0.67 3.69 0.72 0.00 -1.26 -5.02 105.19 102.78 1xxe n GLY 66 Ca -0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.04 3.00 0.07 1.61 -1.52 -0.06 -5.11 119.66 117.60 1xxe s GLN 67 Ca 0.00 -0.40 -0.05 0.00 -1.95 0.00 0.00 55.36 52.96 1xxe s GLN 67 Cb 0.00 -2.81 -0.02 0.00 -0.22 0.00 0.00 33.01 29.96 1xxe s GLN 67 CO 0.00 0.70 0.07 -0.98 -0.25 0.00 0.00 175.29 174.84 1xxe s ARG 68 N -0.92 0.71 -0.01 2.91 1.70 -1.26 -0.08 118.95 122.00 1xxe s ARG 68 Ca 0.14 -1.08 0.02 0.00 -0.47 0.00 0.00 55.73 54.34 1xxe s ARG 68 Cb -0.11 0.27 -0.00 0.00 -0.57 0.00 0.00 34.95 34.53 1xxe s ARG 68 CO 0.03 -0.18 -0.07 0.42 -1.08 0.00 0.00 175.30 174.41 1xxe s ILE 69 N -3.83 0.59 0.06 4.99 1.01 0.98 -4.81 121.20 120.19 1xxe s ILE 69 Ca 0.05 -0.31 0.04 0.00 0.00 0.00 0.00 60.65 60.43 1xxe s ILE 69 Cb 0.06 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 42.00 1xxe s ILE 69 CO -0.10 0.17 -0.00 -0.54 0.00 0.00 0.00 174.94 174.47 1xxe s LYS 70 N -0.13 2.63 -0.73 2.79 1.02 -0.75 -1.92 119.74 122.65 1xxe s LYS 70 Ca 0.02 -0.76 -0.02 0.00 0.02 0.00 0.00 55.97 55.23 1xxe s LYS 70 Cb -0.03 -2.58 0.00 0.00 -0.52 0.00 0.00 37.83 34.70 1xxe s LYS 70 CO -0.00 0.57 0.68 2.41 -0.92 0.00 0.00 175.35 178.08 1xxe n THR 71 N 0.86 -9.06 0.32 2.17 -1.04 -0.23 -1.92 114.28 105.38 1xxe n THR 71 Ca -0.12 -0.12 0.04 0.00 -2.04 0.00 0.00 64.05 61.81 1xxe n THR 71 Cb 0.52 -6.27 0.00 0.00 -1.82 0.00 0.00 70.33 62.76 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 -1.78 0.00 0.07 12.58 0.24 -1.17 -4.37 118.33 123.90 1xxe n VAL 72 Ca -0.04 -0.44 -0.02 0.00 -2.04 0.00 0.00 64.34 61.80 1xxe n VAL 72 Cb 0.53 1.09 0.23 0.00 -1.47 0.00 0.00 33.84 34.22 1xxe n VAL 72 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1xxe h GLU 73 N 0.88 0.32 0.79 7.34 4.11 -1.88 -2.18 114.58 123.95 1xxe h GLU 73 Ca 0.00 -0.14 -0.04 0.00 0.07 0.00 0.00 59.36 59.26 1xxe h GLU 73 Cb 0.25 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.50 1xxe h GLU 73 CO 0.00 0.63 -0.38 0.45 0.07 0.00 0.00 179.01 179.78 1xxe h HIS 74 N 0.27 -0.98 -0.58 2.06 3.86 -1.92 0.60 115.15 118.46 1xxe h HIS 74 Ca 0.03 -0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.28 1xxe h HIS 74 Cb 0.75 0.32 -0.06 0.00 1.06 0.00 0.00 27.41 29.49 1xxe h HIS 74 CO 0.02 -0.61 0.27 0.97 0.86 0.00 0.00 177.93 179.44 1xxe h ILE 75 N -1.26 0.89 -0.94 2.45 6.09 -1.86 -0.50 117.51 122.38 1xxe h ILE 75 Ca -0.11 -0.17 0.11 0.00 -1.37 0.00 0.00 64.86 63.32 1xxe h ILE 75 Cb 0.81 0.34 -0.08 0.00 0.47 0.00 0.00 36.82 38.36 1xxe h ILE 75 CO 0.18 0.09 0.57 -0.07 -3.07 0.00 0.00 178.15 175.85 1xxe h LEU 76 N 0.51 0.83 -0.32 2.19 3.38 -1.31 -1.54 115.31 119.04 1xxe h LEU 76 Ca 0.27 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.30 1xxe h LEU 76 Cb 0.23 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1xxe h LEU 76 CO -0.21 0.45 0.20 -1.28 0.09 0.00 0.00 178.44 177.68 1xxe h SER 77 N 0.91 0.34 0.01 -0.43 0.87 0.79 -0.96 113.55 115.08 1xxe h SER 77 Ca 0.46 -0.00 0.01 0.00 -1.23 0.00 0.00 61.79 61.03 1xxe h SER 77 Cb 0.45 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 1xxe h SER 77 CO -0.26 0.25 -0.06 0.58 -0.53 0.00 0.00 176.83 176.80 1xxe h VAL 78 N 0.41 0.85 -0.77 2.23 2.07 -0.89 -1.91 116.25 118.25 1xxe h VAL 78 Ca 0.12 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.79 1xxe h VAL 78 Cb -0.03 0.85 -0.10 0.00 -1.52 0.00 0.00 31.29 30.50 1xxe h VAL 78 CO -0.04 0.00 0.32 -0.07 0.02 0.00 0.00 177.57 177.79 1xxe h LEU 79 N -0.11 0.30 -0.16 2.57 3.38 -0.99 -0.57 115.31 119.73 1xxe h LEU 79 Ca 0.02 0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.13 1xxe h LEU 79 Cb 0.13 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1xxe h LEU 79 CO -0.06 0.11 -0.03 -0.74 0.09 0.00 0.00 178.44 177.81 1xxe h HIS 80 N 0.46 -0.07 -0.62 1.13 2.76 -0.42 0.76 115.15 119.15 1xxe h HIS 80 Ca 0.43 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.56 1xxe h HIS 80 Cb 0.65 0.06 -0.03 0.00 1.55 0.00 0.00 27.41 29.64 1xxe h HIS 80 CO -0.16 -0.06 0.17 -0.07 -1.30 0.00 0.00 177.93 176.51 1xxe h LEU 81 N 0.01 0.88 -0.07 0.26 3.38 -0.67 -2.28 115.31 116.83 1xxe h LEU 81 Ca 0.08 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1xxe h LEU 81 Cb 0.11 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1xxe h LEU 81 CO -0.16 0.84 -0.04 0.18 0.09 0.00 0.00 178.44 179.35 1xxe n LEU 82 N -4.27 0.15 -3.02 1.67 4.77 -0.33 -4.94 117.00 111.03 1xxe n LEU 82 Ca 0.05 0.20 -0.13 0.00 -0.03 0.00 0.00 56.01 56.10 1xxe n LEU 82 Cb 0.22 -0.26 0.06 0.00 -2.33 0.00 0.00 43.42 41.12 1xxe n LEU 82 CO 0.41 0.03 0.03 -0.62 -1.33 0.00 0.00 177.39 175.91 1xxe n GLU 83 N -1.20 -2.28 -3.58 3.23 1.02 0.21 -4.98 120.64 113.06 1xxe n GLU 83 Ca 0.14 0.75 -0.37 0.00 -0.02 0.00 0.00 57.16 57.66 1xxe n GLU 83 Cb 0.26 -5.26 -0.09 0.00 -0.02 0.00 0.00 31.44 26.33 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 -3.33 5.31 -0.04 -3.67 -1.09 -0.93 -4.02 121.20 113.43 1xxe s ILE 84 Ca 0.36 0.34 0.09 0.00 -2.23 0.00 0.00 60.65 59.22 1xxe s ILE 84 Cb -0.05 -3.57 -0.14 0.00 -1.58 0.00 0.00 42.46 37.12 1xxe s ILE 84 CO 0.64 0.32 0.16 0.35 -1.23 0.00 0.00 174.94 175.17 1xxe n THR 85 N 4.29 0.19 -3.82 2.92 -2.24 -0.97 -4.88 114.28 109.77 1xxe n THR 85 Ca -0.13 -0.28 -0.28 0.00 -2.27 0.00 0.00 64.05 61.09 1xxe n THR 85 Cb 0.52 -0.04 -0.16 0.00 -2.10 0.00 0.00 70.33 68.54 1xxe n THR 85 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1xxe s ASN 86 N -3.44 3.00 -0.27 3.42 0.02 -1.22 0.34 114.94 116.78 1xxe s ASN 86 Ca -0.04 -0.80 -0.23 0.00 -1.02 0.00 0.00 52.86 50.77 1xxe s ASN 86 Cb 0.05 -0.80 0.09 0.00 0.02 0.00 0.00 41.25 40.61 1xxe s ASN 86 CO 0.40 -0.25 0.79 0.68 0.02 0.00 0.00 177.10 178.74 1xxe s VAL 87 N 1.70 0.00 -0.44 1.60 -7.23 -0.98 -3.96 120.40 111.08 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 0.12 0.00 0.56 0.00 0.00 36.38 35.89 1xxe s VAL 87 CO -0.07 0.00 0.26 -0.89 -0.31 0.00 0.00 175.10 174.09 1xxe s THR 88 N 0.58 3.59 -0.40 5.32 2.01 -0.80 -2.42 115.64 123.52 1xxe s THR 88 Ca -0.01 -2.03 -0.22 0.00 0.31 0.00 0.00 61.69 59.73 1xxe s THR 88 Cb -0.05 -3.43 0.01 0.00 0.01 0.00 0.00 72.50 69.05 1xxe s THR 88 CO -0.04 -0.73 0.74 -0.63 -0.69 0.00 0.00 174.62 173.27 1xxe s ILE 89 N 1.13 4.74 -0.26 1.82 1.01 -0.64 -2.19 121.20 126.82 1xxe s ILE 89 Ca 0.08 0.62 -0.20 0.00 0.00 0.00 0.00 60.65 61.15 1xxe s ILE 89 Cb -0.24 -4.22 -0.02 0.00 0.01 0.00 0.00 42.46 38.00 1xxe s ILE 89 CO -0.03 -0.51 0.60 -1.61 0.00 0.00 0.00 174.94 173.39 1xxe s GLU 90 N 3.06 4.09 -0.43 2.79 2.02 0.12 -1.80 118.70 128.55 1xxe s GLU 90 Ca 0.29 0.48 -0.13 0.00 0.02 0.00 0.00 54.97 55.63 1xxe s GLU 90 Cb -0.13 -3.66 0.06 0.00 0.10 0.00 0.00 34.13 30.50 1xxe s GLU 90 CO 0.18 -0.41 0.30 0.08 0.02 0.00 0.00 175.26 175.44 1xxe s VAL 91 N 2.47 4.81 -0.46 2.63 1.01 -0.65 -1.50 120.40 128.71 1xxe s VAL 91 Ca 0.25 -1.05 -0.24 0.00 0.00 0.00 0.00 61.98 60.94 1xxe s VAL 91 Cb -0.15 -3.82 0.03 0.00 0.00 0.00 0.00 36.38 32.43 1xxe s VAL 91 CO 0.09 -0.44 0.86 -0.63 0.00 0.00 0.00 175.10 174.98 1xxe s ILE 92 N 1.57 4.55 -2.44 2.22 1.09 0.32 -4.71 121.20 123.80 1xxe s ILE 92 Ca 0.03 0.57 0.00 0.00 -1.10 0.00 0.00 60.65 60.15 1xxe s ILE 92 Cb -0.22 -4.39 0.00 0.00 -1.06 0.00 0.00 42.46 36.79 1xxe s ILE 92 CO 0.06 -0.80 0.00 0.61 -0.10 0.00 0.00 174.94 174.71 1xxe n GLY 93 N 4.97 0.72 0.00 6.18 0.00 -1.26 -1.96 105.19 113.84 1xxe n GLY 93 Ca 0.04 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 44.01 1xxe n GLY 93 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1xxe n ASN 94 N 0.00 1.91 -3.98 1.61 5.15 -1.26 -4.99 115.26 113.69 1xxe n ASN 94 Ca 0.00 -0.26 -0.17 0.00 -0.60 0.00 0.00 54.58 53.56 1xxe n ASN 94 Cb 0.00 0.89 -0.14 0.00 -0.53 0.00 0.00 39.78 40.00 1xxe n ASN 94 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 1xxe s GLU 95 N -1.28 0.54 0.06 1.20 2.12 -1.26 -1.81 118.70 118.28 1xxe s GLU 95 Ca 0.00 -0.25 -0.31 0.00 0.36 0.00 0.00 54.97 54.77 1xxe s GLU 95 Cb 0.00 -0.52 -0.07 0.00 0.26 0.00 0.00 34.13 33.80 1xxe s GLU 95 CO 0.00 0.14 1.47 0.42 -0.54 0.00 0.00 175.26 176.75 1xxe s ILE 96 N -0.18 3.35 0.01 -3.70 -1.09 -0.81 -4.65 121.20 114.14 1xxe s ILE 96 Ca 0.02 0.86 -0.38 0.00 -2.23 0.00 0.00 60.65 58.92 1xxe s ILE 96 Cb -0.03 -3.55 -0.17 0.00 -1.58 0.00 0.00 42.46 37.13 1xxe s ILE 96 CO -0.00 0.02 1.35 -2.65 -1.23 0.00 0.00 174.94 172.43 1xxe n PRO 97 N 4.89 0.89 0.21 2.79 -0.02 -1.26 -4.57 135.00 137.94 1xxe n PRO 97 Ca 0.13 0.32 0.10 0.00 -2.02 0.00 0.00 63.50 62.04 1xxe n PRO 97 Cb 0.42 -1.94 0.30 0.00 -0.02 0.00 0.00 33.50 32.26 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 3.54 0.33 0.00 4.25 6.09 -1.47 -3.48 117.51 126.78 1xxe h ILE 98 Ca -0.48 -1.23 0.00 0.00 -1.37 0.00 0.00 64.86 61.78 1xxe h ILE 98 Cb 1.35 1.96 0.00 0.00 0.47 0.00 0.00 36.82 40.60 1xxe h ILE 98 CO 0.78 0.17 0.00 0.18 -3.07 0.00 0.00 178.15 176.21 1xxe n LEU 99 N -3.20 0.00 0.01 2.19 4.77 -1.26 -0.37 117.00 119.14 1xxe n LEU 99 Ca 0.02 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.11 1xxe n LEU 99 Cb 0.51 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.68 1xxe n LEU 99 CO 0.34 0.00 0.18 -0.67 -1.33 0.00 0.00 177.39 175.91 1xxe n ASP 100 N 7.64 0.69 0.00 -1.43 -0.08 -1.26 -4.65 116.55 117.46 1xxe n ASP 100 Ca 0.00 -0.49 0.00 0.00 -1.51 0.00 0.00 54.79 52.79 1xxe n ASP 100 Cb 0.00 0.63 0.00 0.00 2.34 0.00 0.00 41.12 44.09 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 1.47 0.95 0.00 0.27 0.00 0.51 -4.28 105.19 104.11 1xxe n GLY 101 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 1.55 -0.32 1.61 3.41 -1.26 -1.41 113.62 117.20 1xxe n SER 102 Ca 0.00 -0.95 0.04 0.00 -0.26 0.00 0.00 58.87 57.70 1xxe n SER 102 Cb 0.00 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 63.99 1xxe n SER 102 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xxe n GLY 103 N 5.00 -0.48 0.30 5.00 0.00 -0.74 -4.67 105.19 109.61 1xxe n GLY 103 Ca 0.00 -0.22 0.12 0.00 0.00 0.00 0.00 46.02 45.92 1xxe n GLY 103 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1xxe h TRP 104 N 1.51 0.41 0.14 1.61 2.91 -1.83 0.25 115.95 120.94 1xxe h TRP 104 Ca 0.00 0.05 -0.01 0.00 1.13 0.00 0.00 58.89 60.06 1xxe h TRP 104 Cb 0.34 -0.04 0.00 0.00 -0.51 0.00 0.00 29.16 28.95 1xxe h TRP 104 CO 0.01 -0.16 -0.07 0.93 -1.03 0.00 0.00 178.44 178.12 1xxe h GLU 105 N 0.26 -0.18 -0.41 2.65 5.08 -1.90 0.38 114.58 120.45 1xxe h GLU 105 Ca 0.54 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.90 1xxe h GLU 105 Cb 1.05 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.32 1xxe h GLU 105 CO -0.61 -0.11 0.24 0.74 -1.00 0.00 0.00 179.01 178.27 1xxe h PHE 106 N -0.19 0.55 -0.97 4.33 0.04 -1.40 0.14 116.94 119.44 1xxe h PHE 106 Ca -0.02 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1xxe h PHE 106 Cb 0.15 -0.18 -0.05 0.00 2.20 0.00 0.00 35.95 38.08 1xxe h PHE 106 CO -0.07 0.40 0.61 -0.92 -0.60 0.00 0.00 178.31 177.73 1xxe h TYR 107 N 0.53 1.25 -0.07 -0.55 5.03 -0.30 0.14 116.97 123.00 1xxe h TYR 107 Ca 0.15 0.01 -0.17 0.00 2.58 0.00 0.00 58.73 61.29 1xxe h TYR 107 Cb 0.02 -0.42 0.01 0.00 1.55 0.00 0.00 36.73 37.90 1xxe h TYR 107 CO -0.03 0.82 -0.61 0.93 -1.32 0.00 0.00 178.16 177.94 1xxe h GLU 108 N 1.33 0.55 -0.03 1.82 3.07 0.23 -1.87 114.58 119.68 1xxe h GLU 108 Ca 0.35 -0.49 -0.08 0.00 -0.50 0.00 0.00 59.36 58.64 1xxe h GLU 108 Cb -0.09 0.12 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1xxe h GLU 108 CO -0.07 1.12 -0.28 0.00 -1.40 0.00 0.00 179.01 178.38 1xxe h ALA 109 N 0.44 0.07 -0.30 3.43 0.00 -0.57 -3.22 119.26 119.10 1xxe h ALA 109 Ca -0.06 -0.45 -0.18 0.00 0.00 0.00 0.00 54.91 54.22 1xxe h ALA 109 Cb 1.27 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1xxe h ALA 109 CO 0.12 0.12 -0.51 0.82 0.00 0.00 0.00 179.25 179.80 1xxe h ILE 110 N -0.36 1.28 -0.48 0.00 2.04 -0.86 -2.97 117.51 116.16 1xxe h ILE 110 Ca -0.03 -1.70 0.11 0.00 1.00 0.00 0.00 64.86 64.24 1xxe h ILE 110 Cb 0.98 1.59 -0.02 0.00 -0.74 0.00 0.00 36.82 38.63 1xxe h ILE 110 CO 0.06 0.56 0.33 -0.09 0.00 0.00 0.00 178.15 179.00 1xxe h ARG 111 N 0.67 0.15 -0.00 2.37 1.12 -1.44 0.40 114.38 117.65 1xxe h ARG 111 Ca 0.02 -0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.88 1xxe h ARG 111 Cb 1.12 -0.03 0.00 0.00 -0.01 0.00 0.00 29.97 31.04 1xxe h ARG 111 CO 0.12 0.10 -0.10 1.17 -3.11 0.00 0.00 179.97 178.14 1xxe n LYS 112 N -4.44 0.60 -1.09 0.20 4.81 -1.13 -3.83 118.16 113.28 1xxe n LYS 112 Ca 0.08 -0.18 0.02 0.00 -0.87 0.00 0.00 58.31 57.36 1xxe n LYS 112 Cb 0.44 -1.50 0.13 0.00 0.02 0.00 0.00 35.03 34.12 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 -1.04 1.80 -4.84 3.14 4.13 0.14 -5.01 115.26 113.57 1xxe n ASN 113 Ca 0.14 -3.26 -0.35 0.00 1.68 0.00 0.00 54.58 52.78 1xxe n ASN 113 Cb 0.28 -0.44 -0.06 0.00 -1.54 0.00 0.00 39.78 38.01 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 -2.47 4.80 0.13 2.41 1.01 -0.92 0.88 121.20 127.04 1xxe s ILE 114 Ca 0.38 0.89 0.04 0.00 0.00 0.00 0.00 60.65 61.96 1xxe s ILE 114 Cb 0.38 -3.74 -0.04 0.00 0.01 0.00 0.00 42.46 39.06 1xxe s ILE 114 CO -0.09 0.19 -0.10 -0.22 0.00 0.00 0.00 174.94 174.72 1xxe s LEU 115 N -2.08 2.50 0.01 2.97 2.96 0.25 -4.45 118.68 120.83 1xxe s LEU 115 Ca 0.40 -0.96 0.01 0.00 -0.22 0.00 0.00 54.13 53.37 1xxe s LEU 115 Cb -0.15 -0.34 -0.04 0.00 0.50 0.00 0.00 46.19 46.17 1xxe s LEU 115 CO 0.20 -0.31 0.02 0.20 -1.32 0.00 0.00 176.35 175.14 1xxe s ASN 116 N -2.96 5.27 0.00 3.68 0.01 -1.26 -1.63 114.94 118.05 1xxe s ASN 116 Ca 0.13 0.02 0.00 0.00 -0.71 0.00 0.00 52.86 52.30 1xxe s ASN 116 Cb 0.01 -1.41 0.00 0.00 0.41 0.00 0.00 41.25 40.27 1xxe s ASN 116 CO 0.00 0.27 0.00 0.00 -1.51 0.00 0.00 177.10 175.86 1xxe n GLN 117 N 1.24 2.85 -3.36 -0.60 6.02 0.05 -4.90 117.38 118.69 1xxe n GLN 117 Ca -0.14 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.57 1xxe n GLN 117 Cb 0.53 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 -0.67 4.07 -3.62 1.08 5.15 -1.26 -4.66 115.26 115.34 1xxe n ASN 118 Ca 0.00 -3.46 -0.13 0.00 -0.60 0.00 0.00 54.58 50.39 1xxe n ASN 118 Cb 0.00 -0.72 -0.07 0.00 -0.53 0.00 0.00 39.78 38.46 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 -2.58 0.79 -0.09 1.20 6.06 -1.26 -4.97 118.95 118.09 1xxe s ARG 119 Ca 0.40 0.87 -0.28 0.00 -2.50 0.00 0.00 55.73 54.22 1xxe s ARG 119 Cb 0.15 0.38 -0.02 0.00 0.06 0.00 0.00 34.95 35.52 1xxe s ARG 119 CO -0.01 -0.11 0.94 -2.00 -2.50 0.00 0.00 175.30 171.62 1xxe s GLU 120 N 0.24 4.42 0.35 5.12 2.12 -1.26 0.07 118.70 129.77 1xxe s GLU 120 Ca -0.00 1.27 -0.27 0.00 0.36 0.00 0.00 54.97 56.33 1xxe s GLU 120 Cb -0.05 -3.52 -0.09 0.00 0.26 0.00 0.00 34.13 30.73 1xxe s GLU 120 CO 0.00 -0.23 1.11 0.42 -0.54 0.00 0.00 175.26 176.02 1xxe s ILE 121 N 1.73 3.46 -0.69 -3.70 1.01 -1.26 -4.79 121.20 116.95 1xxe s ILE 121 Ca 0.46 1.29 -0.19 0.00 0.00 0.00 0.00 60.65 62.20 1xxe s ILE 121 Cb -0.18 -3.75 0.11 0.00 0.01 0.00 0.00 42.46 38.65 1xxe s ILE 121 CO 0.19 0.17 0.84 -0.62 0.00 0.00 0.00 174.94 175.52 1xxe s ASP 122 N -1.16 6.31 0.47 3.58 -1.08 -1.26 -5.01 116.67 118.53 1xxe s ASP 122 Ca 0.52 -1.57 -0.23 0.00 -0.52 0.00 0.00 52.55 50.75 1xxe s ASP 122 Cb -0.29 -2.34 -0.07 0.00 -1.46 0.00 0.00 42.92 38.77 1xxe s ASP 122 CO 0.36 -1.12 1.19 -0.31 0.52 0.00 0.00 175.17 175.80 1xxe s TYR 123 N 2.74 2.80 -0.25 -5.34 1.51 -1.26 -4.67 117.35 112.88 1xxe s TYR 123 Ca 0.18 1.52 -0.11 0.00 -1.01 0.00 0.00 57.07 57.65 1xxe s TYR 123 Cb -0.18 -3.42 -0.05 0.00 -0.11 0.00 0.00 41.96 38.20 1xxe s TYR 123 CO 0.03 -1.66 0.18 0.12 -1.11 0.00 0.00 175.55 173.10 1xxe s PHE 124 N -1.53 3.29 -0.00 2.71 2.19 0.32 -4.99 117.98 119.97 1xxe s PHE 124 Ca 0.65 0.21 0.06 0.00 0.33 0.00 0.00 56.93 58.18 1xxe s PHE 124 Cb -0.30 -2.31 -0.02 0.00 -1.31 0.00 0.00 43.02 39.08 1xxe s PHE 124 CO 0.36 -0.01 -0.19 0.08 1.83 0.00 0.00 175.22 177.29 1xxe s VAL 125 N 1.28 1.50 0.11 3.12 1.01 -1.26 0.68 120.40 126.85 1xxe s VAL 125 Ca 0.08 -0.87 -0.26 0.00 0.00 0.00 0.00 61.98 60.93 1xxe s VAL 125 Cb -0.14 -1.26 -0.07 0.00 0.00 0.00 0.00 36.38 34.91 1xxe s VAL 125 CO 0.07 0.38 0.79 -0.69 0.00 0.00 0.00 175.10 175.64 1xxe s VAL 126 N -0.51 4.52 -0.17 2.92 1.01 -0.78 -4.94 120.40 122.47 1xxe s VAL 126 Ca 0.07 1.71 0.04 0.00 0.00 0.00 0.00 61.98 63.81 1xxe s VAL 126 Cb -0.07 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 1xxe s VAL 126 CO -0.00 0.44 0.16 -0.62 0.00 0.00 0.00 175.10 175.08 1xxe n GLU 127 N 2.20 4.77 -3.92 2.72 4.71 -1.26 -4.24 120.64 125.62 1xxe n GLU 127 Ca -0.04 -0.01 -0.11 0.00 -0.01 0.00 0.00 57.16 57.00 1xxe n GLU 127 Cb 0.49 -0.76 -0.13 0.00 -1.01 0.00 0.00 31.44 30.04 1xxe n GLU 127 CO 0.00 0.00 0.00 -1.83 0.09 0.00 0.00 177.13 175.39 1xxe s GLU 128 N -1.53 0.15 1.03 3.49 -1.05 -1.26 -4.81 118.70 114.72 1xxe s GLU 128 Ca 0.01 -0.30 -0.15 0.00 -0.15 0.00 0.00 54.97 54.39 1xxe s GLU 128 Cb 0.03 0.06 0.20 0.00 -0.44 0.00 0.00 34.13 33.98 1xxe s GLU 128 CO 0.17 -0.03 1.13 -1.25 0.95 0.00 0.00 175.26 176.24 1xxe s PRO 129 N -0.72 0.16 -0.23 -4.83 0.04 -1.26 -4.57 135.00 123.59 1xxe s PRO 129 Ca -0.08 0.20 -0.26 0.00 0.04 0.00 0.00 61.00 60.90 1xxe s PRO 129 Cb -0.05 -1.73 0.10 0.00 0.04 0.00 0.00 34.50 32.86 1xxe s PRO 129 CO -0.00 -2.84 0.91 -1.50 0.04 0.00 0.00 177.00 173.60 1xxe s ILE 130 N -3.14 0.00 -0.09 0.56 2.07 -0.79 -4.95 121.20 114.86 1xxe s ILE 130 Ca 0.67 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.93 1xxe s ILE 130 Cb -0.14 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.47 1xxe s ILE 130 CO 0.56 0.00 -0.12 -0.63 -1.91 0.00 0.00 174.94 172.83 1xxe s ILE 131 N -0.10 1.21 -0.15 2.00 1.01 -1.26 -1.13 121.20 122.78 1xxe s ILE 131 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 60.65 60.17 1xxe s ILE 131 Cb -0.04 -1.12 0.03 0.00 0.01 0.00 0.00 42.46 41.33 1xxe s ILE 131 CO -0.01 0.38 -0.12 0.68 0.00 0.00 0.00 174.94 175.86 1xxe s VAL 132 N 0.95 1.49 -0.05 2.92 -7.23 -0.55 -5.00 120.40 112.94 1xxe s VAL 132 Ca -0.09 -0.64 0.05 0.00 -1.81 0.00 0.00 61.98 59.49 1xxe s VAL 132 Cb -0.15 -1.45 -0.02 0.00 0.56 0.00 0.00 36.38 35.32 1xxe s VAL 132 CO 0.00 0.39 -0.21 -0.70 -0.31 0.00 0.00 175.10 174.28 1xxe s GLU 133 N 1.51 2.44 -0.26 4.82 2.12 -1.26 -1.50 118.70 126.57 1xxe s GLU 133 Ca 0.04 -0.82 -0.26 0.00 0.36 0.00 0.00 54.97 54.29 1xxe s GLU 133 Cb -0.13 -2.23 0.15 0.00 0.26 0.00 0.00 34.13 32.17 1xxe s GLU 133 CO -0.10 0.52 1.17 0.34 -0.54 0.00 0.00 175.26 176.65 1xxe s ASP 134 N -0.49 -0.29 -1.51 -1.70 2.15 -0.68 -4.96 116.67 109.20 1xxe s ASP 134 Ca 0.06 0.50 0.00 0.00 0.43 0.00 0.00 52.55 53.54 1xxe s ASP 134 Cb -0.11 0.48 0.00 0.00 -0.30 0.00 0.00 42.92 42.99 1xxe s ASP 134 CO 0.01 -0.14 0.00 -0.62 -0.17 0.00 0.00 175.17 174.25 1xxe n GLU 135 N 1.62 -1.84 -0.99 4.34 1.02 -1.26 0.28 120.64 123.81 1xxe n GLU 135 Ca -0.10 0.85 0.00 0.00 -0.02 0.00 0.00 57.16 57.89 1xxe n GLU 135 Cb 0.57 -5.43 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 -0.81 0.49 3.91 0.62 0.00 -1.26 -5.01 105.19 103.13 1xxe n GLY 136 Ca -0.20 0.00 -0.20 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 -0.26 2.70 -0.07 1.61 0.52 0.14 -4.92 118.95 118.68 1xxe s ARG 137 Ca 0.00 -1.36 -0.31 0.00 -0.52 0.00 0.00 55.73 53.55 1xxe s ARG 137 Cb 0.00 -2.52 0.07 0.00 0.52 0.00 0.00 34.95 33.02 1xxe s ARG 137 CO 0.00 -0.10 0.71 -1.17 0.02 0.00 0.00 175.30 174.76 1xxe s LEU 138 N -4.14 -0.64 -0.13 2.53 0.20 -0.85 -1.68 118.68 113.97 1xxe s LEU 138 Ca 0.47 0.73 -0.10 0.00 0.69 0.00 0.00 54.13 55.92 1xxe s LEU 138 Cb -0.06 2.49 0.04 0.00 -0.43 0.00 0.00 46.19 48.23 1xxe s LEU 138 CO 0.29 -0.57 0.34 -0.63 -0.29 0.00 0.00 176.35 175.48 1xxe s ILE 139 N -1.11 -0.01 0.02 6.68 1.01 -0.56 -0.96 121.20 126.26 1xxe s ILE 139 Ca -0.10 0.05 0.06 0.00 0.00 0.00 0.00 60.65 60.66 1xxe s ILE 139 Cb -0.00 -0.49 -0.02 0.00 0.01 0.00 0.00 42.46 41.96 1xxe s ILE 139 CO 0.09 0.02 -0.18 -0.75 0.00 0.00 0.00 174.94 174.12 1xxe s LYS 140 N 0.63 1.34 0.05 2.79 2.20 -0.39 -1.48 119.74 124.89 1xxe s LYS 140 Ca -0.04 -0.77 0.08 0.00 -0.36 0.00 0.00 55.97 54.88 1xxe s LYS 140 Cb -0.05 -1.36 -0.03 0.00 -1.51 0.00 0.00 37.83 34.88 1xxe s LYS 140 CO -0.04 0.36 -0.22 0.00 -0.36 0.00 0.00 175.35 175.09 1xxe s ALA 141 N -0.63 1.88 -0.04 3.13 0.00 -0.28 -0.73 121.76 125.08 1xxe s ALA 141 Ca 0.06 -1.14 -0.03 0.00 0.00 0.00 0.00 51.96 50.86 1xxe s ALA 141 Cb -0.08 -0.36 0.02 0.00 0.00 0.00 0.00 23.12 22.71 1xxe s ALA 141 CO 0.01 0.42 0.11 -2.00 0.00 0.00 0.00 175.76 174.29 1xxe s GLU 142 N -1.31 0.10 0.50 0.00 2.56 0.92 -1.89 118.70 119.58 1xxe s GLU 142 Ca 0.08 0.21 -0.21 0.00 0.00 0.00 0.00 54.97 55.05 1xxe s GLU 142 Cb -0.09 -0.03 -0.09 0.00 2.00 0.00 0.00 34.13 35.92 1xxe s GLU 142 CO 0.02 -0.07 0.84 -0.35 -0.56 0.00 0.00 175.26 175.15 1xxe n PRO 143 N 3.43 0.96 -3.55 4.30 -0.04 -1.26 0.16 135.00 138.99 1xxe n PRO 143 Ca -0.17 0.36 -0.11 0.00 -0.04 0.00 0.00 63.50 63.53 1xxe n PRO 143 Cb 0.57 -1.95 -0.04 0.00 -0.04 0.00 0.00 33.50 32.03 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 -1.00 -0.42 0.00 3.54 0.15 -1.26 -4.39 113.70 110.32 1xxe s SER 144 Ca 0.68 0.35 0.26 0.00 0.70 0.00 0.00 55.95 57.93 1xxe s SER 144 Cb -0.50 0.37 1.22 0.00 -1.71 0.00 0.00 66.02 65.41 1xxe s SER 144 CO 0.54 -0.47 1.82 0.47 1.20 0.00 0.00 173.24 176.80 1xxe n ASP 145 N 0.49 0.86 -3.98 5.45 9.92 -1.26 -3.54 116.55 124.49 1xxe n ASP 145 Ca -0.11 -1.40 -0.13 0.00 -0.53 0.00 0.00 54.79 52.62 1xxe n ASP 145 Cb 0.59 -0.02 -0.13 0.00 -0.64 0.00 0.00 41.12 40.92 1xxe n ASP 145 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1xxe s THR 146 N -1.95 0.33 -0.30 -3.53 -4.23 -1.26 -4.89 115.64 99.81 1xxe s THR 146 Ca 0.37 -0.60 -0.29 0.00 -1.18 0.00 0.00 61.69 60.00 1xxe s THR 146 Cb 0.19 -0.36 0.01 0.00 1.34 0.00 0.00 72.50 73.68 1xxe s THR 146 CO 0.31 -0.19 1.12 -0.22 -0.54 0.00 0.00 174.62 175.10 1xxe s LEU 147 N -0.84 3.96 -0.01 4.79 2.96 -1.26 -2.87 118.68 125.40 1xxe s LEU 147 Ca -0.06 1.15 0.01 0.00 -0.22 0.00 0.00 54.13 55.01 1xxe s LEU 147 Cb -0.06 -3.54 0.01 0.00 0.50 0.00 0.00 46.19 43.10 1xxe s LEU 147 CO -0.00 -0.88 -0.02 -0.70 -1.32 0.00 0.00 176.35 173.43 1xxe s GLU 148 N 3.67 0.28 -0.04 1.98 2.12 -0.50 -2.88 118.70 123.33 1xxe s GLU 148 Ca 0.47 -0.04 -0.00 0.00 0.36 0.00 0.00 54.97 55.76 1xxe s GLU 148 Cb -0.14 -0.34 0.03 0.00 0.26 0.00 0.00 34.13 33.93 1xxe s GLU 148 CO 0.15 -0.01 -0.00 0.08 -0.54 0.00 0.00 175.26 174.94 1xxe s VAL 149 N 0.36 0.26 -0.14 3.70 1.01 -0.72 -0.60 120.40 124.27 1xxe s VAL 149 Ca -0.03 0.08 -0.00 0.00 0.00 0.00 0.00 61.98 62.02 1xxe s VAL 149 Cb -0.06 -0.37 -0.01 0.00 0.00 0.00 0.00 36.38 35.94 1xxe s VAL 149 CO -0.01 0.19 -0.12 -0.89 0.00 0.00 0.00 175.10 174.26 1xxe s THR 150 N 1.28 3.04 -0.13 3.92 2.01 0.26 -0.43 115.64 125.59 1xxe s THR 150 Ca -0.06 -0.66 0.01 0.00 0.31 0.00 0.00 61.69 61.29 1xxe s THR 150 Cb -0.13 -2.29 -0.01 0.00 0.01 0.00 0.00 72.50 70.08 1xxe s THR 150 CO -0.02 0.51 -0.15 -0.47 -0.69 0.00 0.00 174.62 173.80 1xxe s TYR 151 N 0.51 2.77 -0.34 4.92 5.04 -0.97 0.58 117.35 129.86 1xxe s TYR 151 Ca -0.08 -0.76 -0.01 0.00 -2.44 0.00 0.00 57.07 53.78 1xxe s TYR 151 Cb -0.16 -1.83 0.08 0.00 0.35 0.00 0.00 41.96 40.40 1xxe s TYR 151 CO 0.04 -0.28 0.06 -2.00 -1.34 0.00 0.00 175.55 172.03 1xxe s GLU 152 N 0.41 2.16 -0.10 4.97 2.12 0.15 -1.70 118.70 126.70 1xxe s GLU 152 Ca -0.12 -1.52 -0.16 0.00 0.36 0.00 0.00 54.97 53.54 1xxe s GLU 152 Cb -0.16 -3.29 -0.05 0.00 0.26 0.00 0.00 34.13 30.89 1xxe s GLU 152 CO 0.06 -0.80 0.39 0.20 -0.54 0.00 0.00 175.26 174.57 1xxe s GLY 153 N 1.37 2.35 -0.72 -1.50 0.00 0.39 -1.35 107.32 107.86 1xxe s GLY 153 Ca 0.01 -0.30 0.01 0.00 0.00 0.00 0.00 44.72 44.44 1xxe s GLY 153 CO -0.03 0.47 0.53 1.85 0.00 0.00 0.00 173.10 175.92 1xxe s GLU 154 N 0.09 2.67 0.16 2.90 2.12 -1.26 -1.26 118.70 124.12 1xxe s GLU 154 Ca 0.22 -3.03 -0.08 0.00 0.36 0.00 0.00 54.97 52.44 1xxe s GLU 154 Cb -0.15 -3.64 -0.06 0.00 0.26 0.00 0.00 34.13 30.54 1xxe s GLU 154 CO 0.09 -1.23 0.46 -0.06 -0.54 0.00 0.00 175.26 173.98 1xxe s PHE 155 N -0.93 3.48 -0.78 5.30 0.08 0.92 -4.95 117.98 121.10 1xxe s PHE 155 Ca 0.23 0.75 0.26 0.00 0.12 0.00 0.00 56.93 58.28 1xxe s PHE 155 Cb -0.12 -2.15 0.63 0.00 -0.57 0.00 0.00 43.02 40.80 1xxe s PHE 155 CO -0.10 0.39 1.55 1.63 -0.10 0.00 0.00 175.22 178.59 1xxe n LYS 156 N 0.20 0.19 -0.39 0.44 4.01 -1.26 -2.85 118.16 118.49 1xxe n LYS 156 Ca -0.02 0.09 -0.16 0.00 -0.51 0.00 0.00 58.31 57.71 1xxe n LYS 156 Cb 0.52 -1.66 0.14 0.00 -0.51 0.00 0.00 35.03 33.53 1xxe n LYS 156 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1xxe n ASN 157 N -1.95 -2.18 0.28 4.39 6.94 -1.26 -4.62 115.26 116.85 1xxe n ASN 157 Ca 0.05 -0.71 0.14 0.00 -0.02 0.00 0.00 54.58 54.04 1xxe n ASN 157 Cb 0.40 -0.53 0.77 0.00 -2.36 0.00 0.00 39.78 38.06 1xxe n ASN 157 CO 0.00 0.00 0.00 2.19 -1.03 0.00 0.00 177.26 178.42 1xxe h PHE 158 N -2.43 0.00 -0.13 -2.53 -0.00 -1.56 0.12 116.94 110.40 1xxe h PHE 158 Ca -0.22 0.00 -0.08 0.00 -0.00 0.00 0.00 57.97 57.67 1xxe h PHE 158 Cb 0.68 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.62 1xxe h PHE 158 CO 0.00 0.00 -0.28 -0.07 -0.00 0.00 0.00 178.31 177.96 1xxe h LEU 159 N 0.00 0.24 0.00 2.10 3.38 -1.86 -3.47 115.31 115.71 1xxe h LEU 159 Ca 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1xxe h LEU 159 Cb 0.46 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1xxe h LEU 159 CO 0.00 0.52 0.00 0.61 0.09 0.00 0.00 178.44 179.66 1xxe n GLY 160 N -0.51 3.52 3.44 0.83 0.00 0.41 -4.54 105.19 108.34 1xxe n GLY 160 Ca -0.01 0.10 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 1xxe n GLY 160 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xxe s ARG 161 N 0.00 2.53 0.03 1.61 0.52 -1.26 -0.05 118.95 122.32 1xxe s ARG 161 Ca 0.00 -0.73 -0.14 0.00 -0.52 0.00 0.00 55.73 54.33 1xxe s ARG 161 Cb 0.00 -2.35 0.02 0.00 0.52 0.00 0.00 34.95 33.14 1xxe s ARG 161 CO 0.00 0.57 0.32 -1.14 0.02 0.00 0.00 175.30 175.07 1xxe s GLN 162 N -0.60 0.78 0.02 3.54 2.00 -0.39 -5.00 119.66 120.00 1xxe s GLN 162 Ca 0.09 -0.40 -0.04 0.00 -2.00 0.00 0.00 55.36 53.01 1xxe s GLN 162 Cb -0.11 0.34 -0.01 0.00 0.80 0.00 0.00 33.01 34.03 1xxe s GLN 162 CO 0.01 -0.24 0.06 -1.59 -0.50 0.00 0.00 175.29 173.02 1xxe s LYS 163 N -2.20 0.43 -0.06 1.67 0.00 -1.26 -0.46 119.74 117.85 1xxe s LYS 163 Ca -0.07 -0.56 -0.00 0.00 0.00 0.00 0.00 55.97 55.34 1xxe s LYS 163 Cb -0.02 0.17 0.03 0.00 0.00 0.00 0.00 37.83 38.00 1xxe s LYS 163 CO -0.01 -0.09 -0.02 0.12 0.00 0.00 0.00 175.35 175.35 1xxe s PHE 164 N -1.64 0.73 -0.25 1.78 5.36 -0.69 -4.98 117.98 118.28 1xxe s PHE 164 Ca -0.13 -0.21 -0.14 0.00 -0.96 0.00 0.00 56.93 55.49 1xxe s PHE 164 Cb -0.07 -0.75 -0.04 0.00 -0.34 0.00 0.00 43.02 41.81 1xxe s PHE 164 CO -0.01 -0.28 0.31 0.99 -1.46 0.00 0.00 175.22 174.77 1xxe s THR 165 N 1.50 5.24 -0.14 0.12 2.01 -1.26 -2.30 115.64 120.81 1xxe s THR 165 Ca -0.02 0.46 -0.10 0.00 0.31 0.00 0.00 61.69 62.34 1xxe s THR 165 Cb -0.13 -3.64 -0.05 0.00 0.01 0.00 0.00 72.50 68.69 1xxe s THR 165 CO -0.03 0.23 0.18 0.12 -0.69 0.00 0.00 174.62 174.43 1xxe s PHE 166 N 1.69 3.53 0.05 4.92 5.36 0.42 -4.97 117.98 128.98 1xxe s PHE 166 Ca 0.13 0.51 0.03 0.00 -0.96 0.00 0.00 56.93 56.64 1xxe s PHE 166 Cb -0.15 -2.11 -0.03 0.00 -0.34 0.00 0.00 43.02 40.39 1xxe s PHE 166 CO 0.09 0.50 -0.09 0.08 -1.46 0.00 0.00 175.22 174.33 1xxe s VAL 167 N -0.33 0.71 -0.20 3.12 1.01 -1.26 -1.76 120.40 121.69 1xxe s VAL 167 Ca 0.14 -1.20 -0.35 0.00 0.00 0.00 0.00 61.98 60.56 1xxe s VAL 167 Cb -0.12 -0.80 -0.12 0.00 0.00 0.00 0.00 36.38 35.33 1xxe s VAL 167 CO 0.03 -0.37 1.95 -0.62 0.00 0.00 0.00 175.10 176.08 1xxe n GLU 168 N 1.31 1.70 0.00 2.72 1.02 -1.14 -1.45 120.64 124.80 1xxe n GLU 168 Ca -0.22 0.59 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 1xxe n GLU 168 Cb 0.55 -2.53 0.00 0.00 -0.02 0.00 0.00 31.44 29.43 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 4.96 1.17 0.96 0.62 0.00 -1.26 -4.97 105.19 106.67 1xxe n GLY 169 Ca 0.28 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.35 1xxe n GLY 169 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xxe n ASN 170 N 0.00 1.20 0.15 1.61 3.02 -0.53 -4.82 115.26 115.88 1xxe n ASN 170 Ca 0.00 -2.67 0.03 0.00 -0.03 0.00 0.00 54.58 51.90 1xxe n ASN 170 Cb 0.00 -0.37 0.40 0.00 -0.61 0.00 0.00 39.78 39.20 1xxe n ASN 170 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1xxe h GLU 171 N 0.77 0.16 0.00 3.52 3.07 -1.94 -2.47 114.58 117.71 1xxe h GLU 171 Ca -0.11 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.71 1xxe h GLU 171 Cb 1.48 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.37 1xxe h GLU 171 CO 0.05 0.35 0.00 0.93 -1.40 0.00 0.00 179.01 178.94 1xxe h GLU 172 N 0.15 0.00 -0.01 2.33 5.08 -1.98 -0.92 114.58 119.24 1xxe h GLU 172 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1xxe h GLU 172 Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1xxe h GLU 172 CO 0.03 0.00 -0.25 0.39 -1.00 0.00 0.00 179.01 178.18 1xxe n GLU 173 N -2.42 1.01 -0.07 2.33 -0.58 -0.93 -4.04 120.64 115.94 1xxe n GLU 173 Ca -0.01 -0.64 0.06 0.00 -0.42 0.00 0.00 57.16 56.15 1xxe n GLU 173 Cb 0.07 -1.49 0.09 0.00 -0.57 0.00 0.00 31.44 29.54 1xxe n GLU 173 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 1xxe n ILE 174 N -0.44 1.48 -0.07 -3.67 -5.35 -0.35 -4.68 119.36 106.28 1xxe n ILE 174 Ca 0.13 -1.72 -0.08 0.00 -0.27 0.00 0.00 62.75 60.81 1xxe n ILE 174 Cb 0.37 0.05 -0.08 0.00 -1.74 0.00 0.00 39.64 38.23 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 -1.05 0.83 1.62 7.28 0.24 -1.20 -4.47 118.33 121.58 1xxe n VAL 175 Ca 0.10 -0.42 0.12 0.00 -2.04 0.00 0.00 64.34 62.10 1xxe n VAL 175 Cb 0.53 -0.84 0.56 0.00 -1.47 0.00 0.00 33.84 32.62 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 -2.65 0.92 -4.61 1.34 4.77 -1.26 -1.80 117.00 113.72 1xxe n LEU 176 Ca -0.22 -0.35 -0.43 0.00 -0.03 0.00 0.00 56.01 54.97 1xxe n LEU 176 Cb 0.84 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.87 1xxe n LEU 176 CO 0.21 0.18 0.94 0.00 -1.33 0.00 0.00 177.39 177.39 1xxe s ALA 177 N -1.93 3.32 0.38 -1.18 0.00 -1.26 -4.87 121.76 116.21 1xxe s ALA 177 Ca 0.35 -0.35 -0.12 0.00 0.00 0.00 0.00 51.96 51.84 1xxe s ALA 177 Cb 0.18 -3.75 -0.07 0.00 0.00 0.00 0.00 23.12 19.48 1xxe s ALA 177 CO 0.29 -1.87 0.76 -0.98 0.00 0.00 0.00 175.76 173.96 1xxe s ARG 178 N 3.98 3.87 0.91 0.00 1.70 -1.26 -4.48 118.95 123.66 1xxe s ARG 178 Ca 0.45 0.56 -0.13 0.00 -0.47 0.00 0.00 55.73 56.14 1xxe s ARG 178 Cb -0.10 -2.40 0.05 0.00 -0.57 0.00 0.00 34.95 31.93 1xxe s ARG 178 CO 0.24 0.03 0.59 -2.37 -1.08 0.00 0.00 175.30 172.71 1xxe n THR 179 N -0.95 0.34 -4.18 4.99 5.66 -0.50 -4.79 114.28 114.85 1xxe n THR 179 Ca 0.03 -0.18 -0.11 0.00 -3.05 0.00 0.00 64.05 60.73 1xxe n THR 179 Cb 0.54 -0.73 -0.10 0.00 -1.55 0.00 0.00 70.33 68.48 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 -2.36 1.04 0.14 1.09 -0.71 -1.26 -2.31 117.98 113.61 1xxe s PHE 180 Ca 0.60 -1.32 -0.19 0.00 -1.04 0.00 0.00 56.93 54.98 1xxe s PHE 180 Cb -0.23 -0.53 0.05 0.00 -1.21 0.00 0.00 43.02 41.10 1xxe s PHE 180 CO 0.64 -0.59 0.50 0.00 -1.34 0.00 0.00 175.22 174.43 1xxe s PHE 182 N -3.78 3.33 0.61 0.00 0.40 -1.26 0.13 117.98 117.41 1xxe s PHE 182 Ca 0.02 0.22 0.33 0.00 -0.60 0.00 0.00 56.93 56.89 1xxe s PHE 182 Cb 0.00 -1.74 1.95 0.00 0.51 0.00 0.00 43.02 43.74 1xxe s PHE 182 CO -0.13 0.57 2.28 0.38 0.70 0.00 0.00 175.22 179.02 1xxe h ASP 183 N 3.85 0.00 1.10 1.36 2.03 -1.83 -0.61 116.42 122.32 1xxe h ASP 183 Ca -0.48 0.00 -0.19 0.00 -0.73 0.00 0.00 57.03 55.63 1xxe h ASP 183 Cb 1.18 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.65 1xxe h ASP 183 CO 0.65 0.00 -0.91 4.11 -1.03 0.00 0.00 179.24 182.06 1xxe h TRP 184 N 0.00 0.00 0.00 4.15 0.09 -1.94 -3.27 115.95 114.99 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 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.24 1xxe h TRP 184 CO 0.00 0.88 -0.94 -0.85 0.09 0.00 0.00 178.44 177.62 1xxe n GLU 185 N -3.31 0.24 0.21 0.12 0.28 -0.72 -4.30 120.64 113.16 1xxe n GLU 185 Ca -0.00 0.00 -0.15 0.00 -0.16 0.00 0.00 57.16 56.85 1xxe n GLU 185 Cb 0.89 -1.58 -0.08 0.00 1.43 0.00 0.00 31.44 32.10 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 0.60 -0.97 3.84 2.04 -1.19 -1.74 117.51 120.10 1xxe h ILE 186 Ca 0.00 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.05 1xxe h ILE 186 Cb 0.69 0.60 -0.09 0.00 -0.74 0.00 0.00 36.82 37.29 1xxe h ILE 186 CO 0.00 0.00 0.61 -0.33 0.00 0.00 0.00 178.15 178.43 1xxe h GLU 187 N -0.50 0.63 0.90 2.37 5.08 -1.75 0.94 114.58 122.25 1xxe h GLU 187 Ca -0.04 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1xxe h GLU 187 Cb 0.40 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.52 1xxe h GLU 187 CO 0.05 0.42 -0.43 1.25 -1.00 0.00 0.00 179.01 179.30 1xxe h HIS 188 N 0.65 -1.12 -0.75 4.33 2.76 -1.60 0.19 115.15 119.62 1xxe h HIS 188 Ca 0.53 -0.03 0.17 0.00 -2.20 0.00 0.00 60.37 58.84 1xxe h HIS 188 Cb 0.97 0.37 -0.05 0.00 1.55 0.00 0.00 27.41 30.25 1xxe h HIS 188 CO -0.00 -0.69 0.51 0.82 -1.30 0.00 0.00 177.93 177.26 1xxe h ILE 189 N -1.26 0.75 0.00 6.26 2.04 -0.45 0.40 117.51 125.25 1xxe h ILE 189 Ca -0.12 -0.10 -0.08 0.00 1.00 0.00 0.00 64.86 65.55 1xxe h ILE 189 Cb 0.93 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 1xxe h ILE 189 CO 0.20 0.05 -0.40 0.11 0.00 0.00 0.00 178.15 178.11 1xxe h LYS 190 N 0.30 0.00 0.04 2.37 1.79 -0.30 -1.82 116.57 118.94 1xxe h LYS 190 Ca 0.37 0.00 -0.25 0.00 -2.18 0.00 0.00 60.65 58.58 1xxe h LYS 190 Cb 1.00 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.62 1xxe h LYS 190 CO -0.10 0.40 -1.29 0.87 -1.08 0.00 0.00 179.45 178.26 1xxe h LYS 191 N 0.00 0.08 -0.23 3.15 1.79 0.29 -3.25 116.57 118.40 1xxe h LYS 191 Ca -0.00 -0.13 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 1xxe h LYS 191 Cb 1.06 0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.76 1xxe h LYS 191 CO 0.05 0.94 0.00 1.33 -1.08 0.00 0.00 179.45 180.69 1xxe n VAL 192 N -3.32 0.00 -1.69 0.50 0.24 -0.54 -4.80 118.33 108.71 1xxe n VAL 192 Ca -0.08 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.21 1xxe n VAL 192 Cb 0.99 -0.15 -0.00 0.00 -1.47 0.00 0.00 33.84 33.21 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 0.31 0.37 3.41 7.63 0.00 -1.22 -5.05 105.19 110.63 1xxe n GLY 193 Ca 0.00 -0.90 -0.20 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.35 2.40 -0.09 0.99 1.43 -0.69 -4.80 118.68 117.57 1xxe s LEU 194 Ca 0.00 -1.21 0.00 0.00 -1.03 0.00 0.00 54.13 51.89 1xxe s LEU 194 Cb 0.00 -0.54 0.00 0.00 0.03 0.00 0.00 46.19 45.68 1xxe s LEU 194 CO 0.00 -0.40 0.00 0.61 0.23 0.00 0.00 176.35 176.79 1xxe n GLY 195 N -0.55 0.41 0.26 -3.19 0.00 -1.24 -3.56 105.19 97.33 1xxe n GLY 195 Ca -0.05 -0.99 0.14 0.00 0.00 0.00 0.00 46.02 45.12 1xxe n GLY 195 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xxe h LYS 196 N 0.00 0.00 -0.01 1.61 1.57 -1.22 -2.26 116.57 116.26 1xxe h LYS 196 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1xxe h LYS 196 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1xxe h LYS 196 CO 0.03 0.10 -0.52 0.41 -0.57 0.00 0.00 179.45 178.90 1xxe n GLY 197 N -0.18 -0.13 3.70 3.86 0.00 0.81 -4.67 105.19 108.59 1xxe n GLY 197 Ca -0.00 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.39 1.48 0.13 -0.02 0.00 0.97 -4.67 107.32 102.82 1xxe s GLY 198 Ca 0.15 1.34 0.02 0.00 0.00 0.00 0.00 44.72 46.23 1xxe s GLY 198 CO 0.57 2.87 0.09 -1.14 0.00 0.00 0.00 173.10 175.49 1xxe n SER 199 N 5.04 0.19 0.03 1.64 3.41 -1.26 -5.04 113.62 117.63 1xxe n SER 199 Ca 0.16 -1.80 0.12 0.00 -0.26 0.00 0.00 58.87 57.09 1xxe n SER 199 Cb 0.39 0.53 0.17 0.00 -0.26 0.00 0.00 64.21 65.04 1xxe n SER 199 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xxe n LEU 200 N 0.00 0.60 -0.30 1.04 4.77 -1.26 -2.06 117.00 119.79 1xxe n LEU 200 Ca 0.01 0.08 0.13 0.00 -0.03 0.00 0.00 56.01 56.21 1xxe n LEU 200 Cb 0.22 -0.19 0.45 0.00 -2.33 0.00 0.00 43.42 41.57 1xxe n LEU 200 CO 0.12 0.04 0.74 1.17 -1.33 0.00 0.00 177.39 178.13 1xxe n LYS 201 N -1.83 1.06 -0.20 3.23 4.81 -1.26 -4.08 118.16 119.89 1xxe n LYS 201 Ca 0.04 -0.60 0.00 0.00 -0.87 0.00 0.00 58.31 56.88 1xxe n LYS 201 Cb 0.40 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 33.96 1xxe n LYS 201 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1xxe n ASN 202 N -0.45 0.00 -3.59 3.14 3.02 -1.24 -4.73 115.26 111.41 1xxe n ASN 202 Ca 0.15 -1.30 -0.11 0.00 -0.03 0.00 0.00 54.58 53.28 1xxe n ASN 202 Cb 0.34 -0.06 -0.11 0.00 -0.61 0.00 0.00 39.78 39.34 1xxe n ASN 202 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1xxe s THR 203 N 0.00 -0.52 -0.32 3.41 2.01 -0.88 -4.07 115.64 115.27 1xxe s THR 203 Ca 0.00 0.15 -0.29 0.00 0.31 0.00 0.00 61.69 61.86 1xxe s THR 203 Cb 0.00 -0.60 0.01 0.00 0.01 0.00 0.00 72.50 71.92 1xxe s THR 203 CO 0.00 0.03 1.13 -0.22 -0.69 0.00 0.00 174.62 174.88 1xxe s LEU 204 N 2.50 3.90 -0.23 4.42 2.96 -0.98 -4.47 118.68 126.78 1xxe s LEU 204 Ca 0.03 1.05 -0.09 0.00 -0.22 0.00 0.00 54.13 54.90 1xxe s LEU 204 Cb -0.13 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 1xxe s LEU 204 CO -0.11 -0.95 0.11 -0.69 -1.32 0.00 0.00 176.35 173.39 1xxe s VAL 205 N 3.86 4.91 0.06 1.68 1.01 -1.26 0.24 120.40 130.90 1xxe s VAL 205 Ca 0.48 0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.50 1xxe s VAL 205 Cb -0.13 -3.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 1xxe s VAL 205 CO 0.18 0.36 0.13 -0.76 0.00 0.00 0.00 175.10 175.01 1xxe s LEU 206 N 1.16 4.04 0.14 3.92 1.43 0.12 -2.43 118.68 127.06 1xxe s LEU 206 Ca 0.06 0.13 0.05 0.00 -1.03 0.00 0.00 54.13 53.33 1xxe s LEU 206 Cb -0.14 -2.63 -0.04 0.00 0.03 0.00 0.00 46.19 43.41 1xxe s LEU 206 CO 0.04 0.19 0.11 -0.83 0.23 0.00 0.00 176.35 176.10 1xxe s GLY 207 N -2.32 1.80 0.60 -3.19 0.00 0.54 -2.30 107.32 102.45 1xxe s GLY 207 Ca 0.30 -1.16 0.28 0.00 0.00 0.00 0.00 44.72 44.13 1xxe s GLY 207 CO 0.23 -1.17 1.69 0.50 0.00 0.00 0.00 173.10 174.36 1xxe h LYS 208 N 2.68 0.00 0.00 2.90 1.57 -1.98 -2.86 116.57 118.87 1xxe h LYS 208 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1xxe h LYS 208 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 1xxe h LYS 208 CO 0.64 0.00 -0.08 -3.47 -0.57 0.00 0.00 179.45 175.97 1xxe n ASP 209 N -3.46 0.00 -3.77 0.86 -0.08 -1.26 -1.63 116.55 107.22 1xxe n ASP 209 Ca 0.12 -1.15 -0.10 0.00 -1.51 0.00 0.00 54.79 52.15 1xxe n ASP 209 Cb 0.92 -0.03 -0.06 0.00 2.34 0.00 0.00 41.12 44.28 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 0.92 -0.16 -0.67 -2.85 -1.08 -4.99 119.74 110.92 1xxe s LYS 210 Ca 0.00 -0.84 -0.05 0.00 -1.00 0.00 0.00 55.97 54.08 1xxe s LYS 210 Cb 0.00 0.39 -0.03 0.00 -2.06 0.00 0.00 37.83 36.13 1xxe s LYS 210 CO 0.00 -0.32 -0.01 0.08 0.10 0.00 0.00 175.35 175.20 1xxe s VAL 211 N -3.76 4.16 -0.06 1.79 1.01 -1.26 0.20 120.40 122.49 1xxe s VAL 211 Ca 0.04 -0.26 -0.23 0.00 0.00 0.00 0.00 61.98 61.53 1xxe s VAL 211 Cb 0.03 -2.84 -0.18 0.00 0.00 0.00 0.00 36.38 33.40 1xxe s VAL 211 CO -0.11 0.49 0.93 1.88 0.00 0.00 0.00 175.10 178.29 1xxe h TYR 212 N 6.63 -0.13 -3.05 5.22 -1.99 -1.82 -3.44 116.97 118.37 1xxe h TYR 212 Ca -0.34 -0.00 -0.58 0.00 2.00 0.00 0.00 58.73 59.81 1xxe h TYR 212 Cb 1.18 0.04 0.11 0.00 2.00 0.00 0.00 36.73 40.07 1xxe h TYR 212 CO 0.54 0.37 0.41 0.09 -0.00 0.00 0.00 178.16 179.57 1xxe n ASN 213 N -4.87 2.36 0.10 3.88 5.03 -1.26 -4.89 115.26 115.62 1xxe n ASN 213 Ca -0.08 1.20 -0.04 0.00 0.87 0.00 0.00 54.58 56.53 1xxe n ASN 213 Cb 0.28 -1.43 0.14 0.00 -1.02 0.00 0.00 39.78 37.75 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 2.47 0.15 0.00 3.52 0.13 -1.99 -3.02 132.00 133.26 1xxe h PRO 214 Ca -0.44 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 1xxe h PRO 214 Cb 1.30 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1xxe h PRO 214 CO 0.63 0.71 0.00 -1.91 -0.23 0.00 0.00 178.00 177.20 1xxe n GLU 215 N -3.85 0.01 0.00 0.86 2.13 -1.26 -5.01 120.64 113.52 1xxe n GLU 215 Ca -0.02 0.04 0.00 0.00 0.66 0.00 0.00 57.16 57.84 1xxe n GLU 215 Cb 0.62 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.83 1xxe n GLU 215 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1xxe n GLY 216 N 1.26 -0.96 3.76 8.31 0.00 -1.15 -4.76 105.19 111.66 1xxe n GLY 216 Ca 0.07 -1.16 -0.39 0.00 0.00 0.00 0.00 46.02 44.53 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 4.43 0.15 0.99 1.43 -1.26 -4.92 118.68 119.50 1xxe s LEU 217 Ca 0.00 2.26 0.26 0.00 -1.03 0.00 0.00 54.13 55.62 1xxe s LEU 217 Cb 0.00 -3.78 0.79 0.00 0.03 0.00 0.00 46.19 43.23 1xxe s LEU 217 CO 0.00 -0.29 1.71 0.54 0.23 0.00 0.00 176.35 178.54 1xxe n ARG 218 N 0.80 0.22 -3.78 1.70 1.74 -1.26 -4.81 116.66 111.26 1xxe n ARG 218 Ca 0.01 0.15 -0.13 0.00 -0.77 0.00 0.00 57.85 57.11 1xxe n ARG 218 Cb 0.46 -1.73 -0.11 0.00 -1.02 0.00 0.00 32.46 30.06 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 -3.09 -0.26 -0.29 -1.55 2.02 -1.26 -4.94 117.35 107.98 1xxe s TYR 219 Ca 0.10 0.61 0.04 0.00 -0.37 0.00 0.00 57.07 57.45 1xxe s TYR 219 Cb 0.14 0.09 0.20 0.00 -0.40 0.00 0.00 41.96 41.99 1xxe s TYR 219 CO 0.61 -0.19 0.90 0.39 -1.57 0.00 0.00 175.55 175.68 1xxe n GLU 220 N 2.57 0.03 -2.77 -0.62 -0.58 -1.26 0.02 120.64 118.02 1xxe n GLU 220 Ca -0.15 0.35 -0.03 0.00 -0.42 0.00 0.00 57.16 56.91 1xxe n GLU 220 Cb 0.58 -1.89 0.05 0.00 -0.57 0.00 0.00 31.44 29.61 1xxe n GLU 220 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1xxe n ASN 221 N -1.50 1.23 -0.14 1.62 4.13 -1.26 -4.93 115.26 114.41 1xxe n ASN 221 Ca -0.00 -2.26 -0.02 0.00 1.68 0.00 0.00 54.58 53.97 1xxe n ASN 221 Cb 0.31 -0.38 0.21 0.00 -1.54 0.00 0.00 39.78 38.39 1xxe n ASN 221 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 1xxe h GLU 222 N 2.61 0.84 0.05 3.52 4.81 -0.77 -0.33 114.58 125.30 1xxe h GLU 222 Ca -0.15 -0.14 -0.25 0.00 -0.13 0.00 0.00 59.36 58.69 1xxe h GLU 222 Cb 1.24 -0.14 0.02 0.00 0.63 0.00 0.00 28.75 30.51 1xxe h GLU 222 CO 0.25 0.71 -1.01 -1.00 -0.73 0.00 0.00 179.01 177.22 1xxe h PRO 223 N 0.82 0.60 0.00 0.92 0.13 -1.89 -2.38 132.00 130.20 1xxe h PRO 223 Ca 0.19 -0.71 -0.06 0.00 -0.87 0.00 0.00 66.00 64.54 1xxe h PRO 223 Cb 0.20 0.22 -0.01 0.00 0.13 0.00 0.00 31.00 31.54 1xxe h PRO 223 CO -0.01 1.30 -0.30 -0.39 -0.23 0.00 0.00 178.00 178.37 1xxe h VAL 224 N 0.22 0.60 -0.12 1.56 -1.51 -1.95 -2.67 116.25 112.39 1xxe h VAL 224 Ca -0.14 -1.52 -0.06 0.00 -1.23 0.00 0.00 66.70 63.75 1xxe h VAL 224 Cb 1.69 2.05 -0.00 0.00 -2.13 0.00 0.00 31.29 32.90 1xxe h VAL 224 CO 0.20 0.29 -0.15 0.03 -1.23 0.00 0.00 177.57 176.71 1xxe h ARG 225 N 0.00 0.30 -0.79 5.19 3.08 -1.05 -2.12 114.38 118.99 1xxe h ARG 225 Ca -0.00 -0.17 0.04 0.00 0.07 0.00 0.00 59.98 59.92 1xxe h ARG 225 Cb 1.02 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 31.03 1xxe h ARG 225 CO 0.04 0.73 0.49 1.25 -1.07 0.00 0.00 179.97 181.42 1xxe h HIS 226 N -0.11 0.92 -0.68 3.04 2.76 -1.34 -0.42 115.15 119.33 1xxe h HIS 226 Ca 0.01 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.22 1xxe h HIS 226 Cb 0.69 -0.30 -0.04 0.00 1.55 0.00 0.00 27.41 29.32 1xxe h HIS 226 CO 0.09 0.50 0.44 -0.22 -1.30 0.00 0.00 177.93 177.45 1xxe h LYS 227 N 0.94 0.87 -0.30 5.26 1.63 -1.36 -2.04 116.57 121.57 1xxe h LYS 227 Ca 0.33 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 60.08 1xxe h LYS 227 Cb 0.07 -0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 31.49 1xxe h LYS 227 CO -0.14 0.58 0.20 0.28 -3.45 0.00 0.00 179.45 176.92 1xxe h VAL 228 N 0.90 1.08 -0.75 2.00 2.07 -0.56 0.81 116.25 121.80 1xxe h VAL 228 Ca 0.25 -0.15 0.16 0.00 0.82 0.00 0.00 66.70 67.78 1xxe h VAL 228 Cb -0.08 0.65 -0.11 0.00 -1.52 0.00 0.00 31.29 30.24 1xxe h VAL 228 CO -0.07 0.08 0.22 0.15 0.02 0.00 0.00 177.57 177.97 1xxe h PHE 229 N 0.40 0.36 -0.05 1.57 3.57 -0.46 0.15 116.94 122.49 1xxe h PHE 229 Ca 0.11 0.04 -0.18 0.00 3.53 0.00 0.00 57.97 61.47 1xxe h PHE 229 Cb -0.04 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1xxe h PHE 229 CO -0.05 -0.04 -0.74 -0.44 -2.23 0.00 0.00 178.31 174.80 1xxe h ASP 230 N 0.32 0.33 -0.95 0.41 3.32 -0.80 -2.46 116.42 116.60 1xxe h ASP 230 Ca 0.42 -0.22 0.08 0.00 0.02 0.00 0.00 57.03 57.33 1xxe h ASP 230 Cb 0.71 -0.10 -0.07 0.00 0.22 0.00 0.00 39.33 40.09 1xxe h ASP 230 CO -0.48 0.95 0.61 0.25 -1.72 0.00 0.00 179.24 178.86 1xxe h LEU 231 N 0.18 0.94 -0.06 1.55 5.85 0.17 0.96 115.31 124.90 1xxe h LEU 231 Ca -0.03 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 1xxe h LEU 231 Cb 1.30 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1xxe h LEU 231 CO 0.12 0.58 -0.11 0.40 -0.34 0.00 0.00 178.44 179.08 1xxe h ILE 232 N 1.05 1.41 -1.14 4.05 2.04 -1.21 -2.03 117.51 121.69 1xxe h ILE 232 Ca 0.43 -1.41 0.32 0.00 1.00 0.00 0.00 64.86 65.20 1xxe h ILE 232 Cb 0.27 2.20 -0.07 0.00 -0.74 0.00 0.00 36.82 38.48 1xxe h ILE 232 CO -0.18 0.39 0.78 1.23 0.00 0.00 0.00 178.15 180.37 1xxe h GLY 233 N -0.31 0.56 1.77 5.37 0.00 -0.73 0.98 103.07 110.71 1xxe h GLY 233 Ca 0.00 -0.09 -0.16 0.00 0.00 0.00 0.00 47.33 47.09 1xxe h GLY 233 CO 0.02 -0.08 -0.86 -0.55 0.00 0.00 0.00 176.54 175.07 1xxe h ASP 234 N 0.16 0.00 1.38 0.19 5.19 -0.56 -3.28 116.42 119.50 1xxe h ASP 234 Ca 0.59 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.92 1xxe h ASP 234 Cb 1.99 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 41.49 1xxe h ASP 234 CO -0.15 0.68 -0.64 -0.07 -3.12 0.00 0.00 179.24 175.94 1xxe h LEU 235 N 0.00 0.00 0.00 1.55 3.38 0.15 -3.16 115.31 117.23 1xxe h LEU 235 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1xxe h LEU 235 Cb 1.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.31 1xxe h LEU 235 CO 0.08 0.36 0.00 0.00 0.09 0.00 0.00 178.44 178.97 1xxe n TYR 236 N -3.07 0.00 0.03 1.13 9.36 0.91 -2.97 117.16 122.55 1xxe n TYR 236 Ca -0.00 0.00 0.22 0.00 3.32 0.00 0.00 57.90 61.44 1xxe n TYR 236 Cb 0.69 -0.45 0.71 0.00 -0.63 0.00 0.00 39.34 39.66 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 -1.79 2.98 3.38 -1.65 0.75 115.31 118.98 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 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1xxe h LEU 237 CO 0.00 0.00 0.21 -0.07 0.09 0.00 0.00 178.44 178.67 1xxe h LEU 238 N 0.00 0.00 0.00 1.67 3.38 -1.81 -3.33 115.31 115.22 1xxe h LEU 238 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1xxe h LEU 238 Cb 1.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.11 1xxe h LEU 238 CO -0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1xxe n GLY 239 N -1.22 0.55 3.53 0.83 0.00 0.26 -5.02 105.19 104.11 1xxe n GLY 239 Ca -0.02 -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 -2.32 -0.65 0.13 1.61 1.04 -1.25 -4.85 113.70 107.40 1xxe s SER 240 Ca 0.00 0.94 -0.33 0.00 0.48 0.00 0.00 55.95 57.04 1xxe s SER 240 Cb 0.00 0.87 -0.18 0.00 0.10 0.00 0.00 66.02 66.81 1xxe s SER 240 CO 0.00 -0.45 0.86 -2.65 0.98 0.00 0.00 173.24 171.98 1xxe n PRO 241 N 1.67 0.27 -4.05 4.02 -0.02 -1.26 -4.56 135.00 131.06 1xxe n PRO 241 Ca -0.17 0.10 -0.35 0.00 -2.02 0.00 0.00 63.50 61.06 1xxe n PRO 241 Cb 0.56 -1.38 -0.09 0.00 -0.02 0.00 0.00 33.50 32.57 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 -0.49 4.80 -0.13 -1.45 1.01 -1.26 -0.52 120.40 122.36 1xxe s VAL 242 Ca 0.75 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.72 1xxe s VAL 242 Cb -1.03 -3.13 0.01 0.00 0.00 0.00 0.00 36.38 32.23 1xxe s VAL 242 CO 0.56 0.50 -0.21 -0.54 0.00 0.00 0.00 175.10 175.41 1xxe s LYS 243 N -0.01 2.86 0.00 2.72 -0.14 0.21 -4.56 119.74 120.83 1xxe s LYS 243 Ca 0.06 -0.80 0.00 0.00 -1.36 0.00 0.00 55.97 53.87 1xxe s LYS 243 Cb -0.12 -2.31 0.00 0.00 -1.68 0.00 0.00 37.83 33.72 1xxe s LYS 243 CO 0.01 -0.01 0.00 0.41 -0.76 0.00 0.00 175.35 175.00 1xxe n GLY 244 N 4.05 -0.57 3.71 -3.33 0.00 -1.14 -1.86 105.19 106.05 1xxe n GLY 244 Ca -0.20 -1.39 -0.35 0.00 0.00 0.00 0.00 46.02 44.08 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 -1.89 3.16 0.00 1.61 2.20 0.12 -1.41 119.74 123.54 1xxe s LYS 245 Ca 0.00 -0.35 -0.01 0.00 -0.36 0.00 0.00 55.97 55.25 1xxe s LYS 245 Cb 0.00 -2.91 -0.01 0.00 -1.51 0.00 0.00 37.83 33.41 1xxe s LYS 245 CO 0.00 0.67 0.01 -0.06 -0.36 0.00 0.00 175.35 175.61 1xxe s PHE 246 N -0.79 0.09 0.03 4.03 0.40 0.23 -0.06 117.98 121.92 1xxe s PHE 246 Ca 0.12 -0.18 0.05 0.00 -0.60 0.00 0.00 56.93 56.32 1xxe s PHE 246 Cb -0.12 -0.07 -0.02 0.00 0.51 0.00 0.00 43.02 43.32 1xxe s PHE 246 CO 0.02 -0.10 -0.15 -0.47 0.70 0.00 0.00 175.22 175.23 1xxe s TYR 247 N -0.66 1.30 -0.03 0.36 6.14 0.09 -0.58 117.35 123.96 1xxe s TYR 247 Ca -0.07 -0.33 -0.01 0.00 0.64 0.00 0.00 57.07 57.30 1xxe s TYR 247 Cb -0.05 -0.79 0.03 0.00 0.42 0.00 0.00 41.96 41.58 1xxe s TYR 247 CO -0.00 0.03 0.06 0.45 0.64 0.00 0.00 175.55 176.73 1xxe s SER 248 N -0.94 0.25 -0.27 4.32 0.15 0.20 -1.26 113.70 116.15 1xxe s SER 248 Ca 0.03 0.10 -0.03 0.00 0.70 0.00 0.00 55.95 56.75 1xxe s SER 248 Cb -0.07 -0.02 0.02 0.00 -1.71 0.00 0.00 66.02 64.24 1xxe s SER 248 CO 0.01 -0.16 -0.01 0.12 1.20 0.00 0.00 173.24 174.40 1xxe s PHE 249 N 1.34 3.11 -1.22 3.44 5.36 -0.13 0.31 117.98 130.18 1xxe s PHE 249 Ca -0.06 -1.38 -0.11 0.00 -0.96 0.00 0.00 56.93 54.42 1xxe s PHE 249 Cb -0.13 -2.13 -0.01 0.00 -0.34 0.00 0.00 43.02 40.42 1xxe s PHE 249 CO -0.04 -0.68 0.70 0.54 -1.46 0.00 0.00 175.22 174.28 1xxe n ARG 250 N 4.73 -2.54 0.00 10.12 1.74 -0.45 -2.02 116.66 128.24 1xxe n ARG 250 Ca -0.16 0.51 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 1xxe n ARG 250 Cb 0.47 -4.56 0.00 0.00 -1.02 0.00 0.00 32.46 27.35 1xxe n ARG 250 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xxe n GLY 251 N -1.69 -3.23 3.63 -0.13 0.00 -1.26 -4.15 105.19 98.36 1xxe n GLY 251 Ca -0.18 -1.29 -0.04 0.00 0.00 0.00 0.00 46.02 44.50 1xxe n GLY 251 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xxe s GLY 252 N -1.90 -0.35 -0.03 -0.02 0.00 -1.26 -4.96 107.32 98.80 1xxe s GLY 252 Ca 0.00 0.70 -0.24 0.00 0.00 0.00 0.00 44.72 45.18 1xxe s GLY 252 CO 0.00 0.20 1.10 0.45 0.00 0.00 0.00 173.10 174.84 1xxe h HIS 253 N 2.00 -0.13 0.42 1.90 3.86 -1.96 -0.97 115.15 120.26 1xxe h HIS 253 Ca -0.23 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 58.96 1xxe h HIS 253 Cb 1.22 0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.74 1xxe h HIS 253 CO 0.32 0.34 -0.21 1.03 0.86 0.00 0.00 177.93 180.26 1xxe h SER 254 N -0.69 -0.52 -0.96 2.45 0.87 -1.89 -1.47 113.55 111.35 1xxe h SER 254 Ca -0.01 0.02 0.18 0.00 -1.23 0.00 0.00 61.79 60.74 1xxe h SER 254 Cb 0.53 0.14 -0.10 0.00 -0.44 0.00 0.00 62.40 62.53 1xxe h SER 254 CO 0.02 -0.36 0.55 0.25 -0.53 0.00 0.00 176.83 176.77 1xxe h LEU 255 N -0.58 0.70 0.42 2.23 5.85 -1.96 -0.58 115.31 121.39 1xxe h LEU 255 Ca -0.05 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 1xxe h LEU 255 Cb 0.46 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1xxe h LEU 255 CO 0.08 0.26 -0.27 0.78 -0.34 0.00 0.00 178.44 178.95 1xxe h ASN 256 N 0.72 -0.67 -0.89 1.25 2.35 -0.51 -1.91 115.58 115.92 1xxe h ASN 256 Ca 0.54 0.04 0.21 0.00 -0.55 0.00 0.00 56.30 56.54 1xxe h ASN 256 Cb 0.82 0.20 -0.12 0.00 0.05 0.00 0.00 38.32 39.28 1xxe h ASN 256 CO -0.38 -0.42 0.42 0.58 -1.65 0.00 0.00 177.43 175.98 1xxe h VAL 257 N -0.66 0.53 -0.22 2.81 2.07 -0.12 0.62 116.25 121.28 1xxe h VAL 257 Ca -0.05 -0.16 0.04 0.00 0.82 0.00 0.00 66.70 67.36 1xxe h VAL 257 Cb 0.55 0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 1xxe h VAL 257 CO 0.04 0.08 -0.06 0.50 0.02 0.00 0.00 177.57 178.16 1xxe h LYS 258 N 0.46 -0.00 -0.81 1.57 3.64 -0.50 0.64 116.57 121.56 1xxe h LYS 258 Ca 0.55 0.00 0.14 0.00 -1.27 0.00 0.00 60.65 60.07 1xxe h LYS 258 Cb 0.99 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.71 1xxe h LYS 258 CO -0.49 -0.00 0.39 1.25 -2.27 0.00 0.00 179.45 178.33 1xxe h LEU 259 N -0.00 0.45 -0.15 5.20 5.85 -0.38 0.70 115.31 126.99 1xxe h LEU 259 Ca 0.11 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.86 1xxe h LEU 259 Cb 0.16 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 1xxe h LEU 259 CO -0.23 0.19 -0.15 0.58 -0.34 0.00 0.00 178.44 178.49 1xxe h VAL 260 N 0.57 1.35 -0.18 1.05 2.07 -0.63 -1.77 116.25 118.70 1xxe h VAL 260 Ca 0.44 -1.31 0.05 0.00 0.82 0.00 0.00 66.70 66.70 1xxe h VAL 260 Cb 0.62 1.88 -0.05 0.00 -1.52 0.00 0.00 31.29 32.22 1xxe h VAL 260 CO -0.37 0.39 -0.14 0.11 0.02 0.00 0.00 177.57 177.58 1xxe h LYS 261 N -0.01 -0.14 -0.33 1.57 1.57 0.15 0.40 116.57 119.78 1xxe h LYS 261 Ca 0.02 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 1xxe h LYS 261 Cb 0.68 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 1xxe h LYS 261 CO 0.04 -0.09 0.08 0.93 -0.57 0.00 0.00 179.45 179.83 1xxe h GLU 262 N -0.15 0.53 -0.36 3.15 4.39 -0.94 -0.35 114.58 120.85 1xxe h GLU 262 Ca 0.11 -0.13 0.02 0.00 0.34 0.00 0.00 59.36 59.70 1xxe h GLU 262 Cb 0.31 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.87 1xxe h GLU 262 CO -0.27 0.59 0.19 -0.07 -1.16 0.00 0.00 179.01 178.29 1xxe h LEU 263 N 0.37 0.30 -1.08 1.33 3.38 -0.78 1.09 115.31 119.93 1xxe h LEU 263 Ca 0.10 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 1xxe h LEU 263 Cb 0.30 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1xxe h LEU 263 CO 0.00 0.22 -0.46 0.00 0.09 0.00 0.00 178.44 178.29 1xxe h ALA 264 N 1.17 1.24 0.00 1.53 0.00 -0.06 -1.22 119.26 121.91 1xxe h ALA 264 Ca 0.15 -0.42 -0.10 0.00 0.00 0.00 0.00 54.91 54.54 1xxe h ALA 264 Cb 0.03 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1xxe h ALA 264 CO -0.09 0.57 -1.13 0.87 0.00 0.00 0.00 179.25 179.48 1xxe h LYS 265 N 0.01 0.00 -0.01 0.00 1.57 -0.50 -3.14 116.57 114.50 1xxe h LYS 265 Ca -0.00 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.67 1xxe h LYS 265 Cb 0.81 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.13 1xxe h LYS 265 CO 0.06 0.19 -0.41 0.87 -0.57 0.00 0.00 179.45 179.59 1xxe h LYS 266 N 0.00 0.29 -0.12 3.15 1.57 0.14 -3.16 116.57 118.44 1xxe h LYS 266 Ca -0.08 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 1xxe h LYS 266 Cb 1.33 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.73 1xxe h LYS 266 CO 0.03 1.00 0.00 0.94 -0.57 0.00 0.00 179.45 180.85 1xxe n GLN 267 N -4.37 1.34 0.00 3.15 7.27 -0.48 -3.69 117.38 120.59 1xxe n GLN 267 Ca -0.10 -0.52 0.11 0.00 0.07 0.00 0.00 57.00 56.56 1xxe n GLN 267 Cb 0.58 -1.21 0.64 0.00 2.41 0.00 0.00 30.24 32.66 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 -0.16 0.82 0.00 3.69 0.00 -1.19 -4.01 118.16 117.32 1xxe n LYS 268 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.40 1xxe n LYS 268 Cb 0.15 -1.41 0.00 0.00 0.00 0.00 0.00 35.03 33.77 1xxe n LYS 268 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1xxe n LEU 269 N -0.91 1.51 0.00 3.14 4.77 -1.24 -5.10 117.00 119.17 1xxe n LEU 269 Ca 0.16 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 1xxe n LEU 269 Cb 0.07 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 1xxe n LEU 269 CO 0.12 -0.24 0.00 0.35 -1.33 0.00 0.00 177.39 176.29