#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xws n LEU 34 N 0.00 1.90 0.20 2.45 0.00 -1.26 -4.33 117.00 115.97 1xws n LEU 34 Ca 0.00 0.14 0.11 0.00 0.00 0.00 0.00 56.01 56.26 1xws n LEU 34 Cb 0.00 -0.62 0.14 0.00 0.00 0.00 0.00 43.42 42.94 1xws n LEU 34 CO 0.00 0.54 0.71 -0.33 0.00 0.00 0.00 177.39 178.31 1xws h GLU 35 N -0.51 0.00 0.00 1.96 3.07 -2.05 0.83 114.58 117.88 1xws h GLU 35 Ca -0.49 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.27 1xws h GLU 35 Cb 1.52 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.41 1xws h GLU 35 CO -0.24 0.06 -0.85 0.66 -1.40 0.00 0.00 179.01 177.24 1xws h SER 36 N 0.00 0.00 0.69 1.42 4.64 -2.04 -3.37 113.55 114.89 1xws h SER 36 Ca -0.00 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.13 1xws h SER 36 Cb 1.05 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.11 1xws h SER 36 CO 0.01 0.40 -1.44 -0.61 -0.87 0.00 0.00 176.83 174.31 1xws h GLN 37 N 0.00 0.00 -5.10 4.77 4.15 -1.62 -3.46 115.11 113.86 1xws h GLN 37 Ca -0.06 0.00 -0.47 0.00 0.77 0.00 0.00 58.65 58.89 1xws h GLN 37 Cb 1.35 0.00 -0.29 0.00 0.21 0.00 0.00 27.48 28.75 1xws h GLN 37 CO 0.04 0.35 -0.81 0.71 -1.93 0.00 0.00 178.83 177.19 1xws s TYR 38 N -2.85 1.18 -0.31 3.99 1.51 0.24 -1.71 117.35 119.40 1xws s TYR 38 Ca -0.03 -0.25 -0.13 0.00 -1.01 0.00 0.00 57.07 55.66 1xws s TYR 38 Cb 0.08 -0.78 -0.03 0.00 -0.11 0.00 0.00 41.96 41.13 1xws s TYR 38 CO 0.81 -0.05 0.25 -1.14 -1.11 0.00 0.00 175.55 174.32 1xws s GLN 39 N -0.20 3.71 -0.13 -0.62 0.74 -0.61 -4.50 119.66 118.06 1xws s GLN 39 Ca 0.03 -0.44 -0.19 0.00 0.05 0.00 0.00 55.36 54.81 1xws s GLN 39 Cb -0.06 -3.74 -0.04 0.00 1.10 0.00 0.00 33.01 30.27 1xws s GLN 39 CO -0.00 -0.35 0.51 0.54 -0.55 0.00 0.00 175.29 175.44 1xws s VAL 40 N 1.81 5.16 0.00 1.34 0.11 -1.26 -1.38 120.40 126.18 1xws s VAL 40 Ca 0.08 1.00 0.00 0.00 -2.93 0.00 0.00 61.98 60.13 1xws s VAL 40 Cb -0.17 -3.84 0.00 0.00 -1.53 0.00 0.00 36.38 30.84 1xws s VAL 40 CO 0.11 0.29 0.00 0.61 -3.33 0.00 0.00 175.10 172.78 1xws n GLY 41 N 3.36 2.75 3.74 6.54 0.00 0.20 -4.96 105.19 116.81 1xws n GLY 41 Ca -0.06 -1.99 -0.32 0.00 0.00 0.00 0.00 46.02 43.64 1xws n GLY 41 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xws s PRO 42 N 2.98 2.14 0.25 1.61 0.04 -1.26 -4.43 135.00 136.32 1xws s PRO 42 Ca 0.00 1.46 -0.31 0.00 0.04 0.00 0.00 61.00 62.19 1xws s PRO 42 Cb 0.00 -1.86 -0.12 0.00 0.04 0.00 0.00 34.50 32.56 1xws s PRO 42 CO 0.00 -1.78 1.65 -1.17 0.04 0.00 0.00 177.00 175.75 1xws s LEU 43 N -5.55 4.36 -0.16 -3.56 2.96 -1.26 -1.30 118.68 114.17 1xws s LEU 43 Ca 0.67 2.90 -0.13 0.00 -0.22 0.00 0.00 54.13 57.35 1xws s LEU 43 Cb -0.22 -3.62 -0.23 0.00 0.50 0.00 0.00 46.19 42.62 1xws s LEU 43 CO 0.49 -0.94 0.29 0.18 -1.32 0.00 0.00 176.35 175.05 1xws n LEU 44 N 3.12 2.29 -3.60 -0.68 4.77 0.13 -4.84 117.00 118.21 1xws n LEU 44 Ca 0.12 0.30 0.02 0.00 -0.03 0.00 0.00 56.01 56.43 1xws n LEU 44 Cb 0.36 -1.05 -0.00 0.00 -2.33 0.00 0.00 43.42 40.40 1xws n LEU 44 CO 0.64 0.60 1.12 -0.83 -1.33 0.00 0.00 177.39 177.59 1xws s GLY 45 N -5.27 -0.44 0.10 -0.72 0.00 -0.99 -5.02 107.32 94.97 1xws s GLY 45 Ca -0.25 0.80 -0.07 0.00 0.00 0.00 0.00 44.72 45.20 1xws s GLY 45 CO 0.69 0.15 0.17 -1.35 0.00 0.00 0.00 173.10 172.76 1xws s SER 46 N -2.97 0.16 0.00 1.64 1.04 -1.26 -0.51 113.70 111.79 1xws s SER 46 Ca 0.14 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 55.81 1xws s SER 46 Cb 0.06 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.52 1xws s SER 46 CO -0.05 -0.74 0.00 0.61 0.98 0.00 0.00 173.24 174.04 1xws n GLY 47 N -0.07 -0.75 0.16 7.32 0.00 -0.23 -4.94 105.19 106.67 1xws n GLY 47 Ca -0.13 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 45.96 1xws n GLY 47 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1xws h GLY 48 N 0.00 0.00 -1.11 -0.02 0.00 -2.03 -1.69 103.07 98.22 1xws h GLY 48 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1xws h GLY 48 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 176.54 178.51 1xws n PHE 49 N -2.45 0.38 -0.74 5.60 -1.74 -1.26 -5.06 117.46 112.19 1xws n PHE 49 Ca 0.02 -0.19 0.00 0.00 -0.56 0.00 0.00 57.45 56.73 1xws n PHE 49 Cb 0.29 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.29 1xws n PHE 49 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1xws n GLY 50 N 1.08 -0.07 3.08 4.97 0.00 -0.64 -4.84 105.19 108.78 1xws n GLY 50 Ca 0.13 -1.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.16 1xws n GLY 50 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xws s SER 51 N -4.00 2.74 -0.16 1.61 0.01 -0.08 -1.07 113.70 112.75 1xws s SER 51 Ca 0.00 -0.51 -0.01 0.00 1.31 0.00 0.00 55.95 56.74 1xws s SER 51 Cb 0.00 -1.24 -0.01 0.00 0.21 0.00 0.00 66.02 64.98 1xws s SER 51 CO 0.00 0.01 -0.12 -0.69 0.41 0.00 0.00 173.24 172.85 1xws s VAL 52 N 1.14 2.96 0.05 3.43 1.01 0.33 -0.37 120.40 128.95 1xws s VAL 52 Ca -0.02 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.34 1xws s VAL 52 Cb -0.14 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1xws s VAL 52 CO -0.06 0.50 -0.04 -0.31 0.00 0.00 0.00 175.10 175.20 1xws s TYR 53 N 0.81 2.93 0.40 5.22 2.02 0.61 0.21 117.35 129.56 1xws s TYR 53 Ca -0.04 -0.03 -0.25 0.00 -0.37 0.00 0.00 57.07 56.37 1xws s TYR 53 Cb -0.15 -1.56 -0.08 0.00 -0.40 0.00 0.00 41.96 39.76 1xws s TYR 53 CO 0.01 0.44 1.15 0.45 -1.57 0.00 0.00 175.55 176.02 1xws s SER 54 N -1.92 6.56 0.30 2.29 0.15 -0.42 0.23 113.70 120.88 1xws s SER 54 Ca 0.22 2.30 -0.11 0.00 0.70 0.00 0.00 55.95 59.06 1xws s SER 54 Cb -0.11 -2.61 0.01 0.00 -1.71 0.00 0.00 66.02 61.60 1xws s SER 54 CO 0.13 -0.65 0.55 -0.83 1.20 0.00 0.00 173.24 173.64 1xws s GLY 55 N -1.19 0.75 0.01 9.45 0.00 -0.13 0.59 107.32 116.79 1xws s GLY 55 Ca 0.57 -1.01 0.04 0.00 0.00 0.00 0.00 44.72 44.32 1xws s GLY 55 CO 0.37 -0.65 -0.11 -0.26 0.00 0.00 0.00 173.10 172.45 1xws s ILE 56 N -3.43 0.86 -0.01 0.90 -5.25 -0.48 -1.38 121.20 112.41 1xws s ILE 56 Ca 0.23 -0.66 -0.30 0.00 -0.99 0.00 0.00 60.65 58.93 1xws s ILE 56 Cb -0.02 -0.75 -0.04 0.00 2.95 0.00 0.00 42.46 44.60 1xws s ILE 56 CO 0.13 0.10 1.18 -0.60 -1.79 0.00 0.00 174.94 173.95 1xws s ARG 57 N -0.64 4.39 0.32 0.37 3.52 0.82 -1.57 118.95 126.17 1xws s ARG 57 Ca 0.02 1.68 0.07 0.00 -0.13 0.00 0.00 55.73 57.37 1xws s ARG 57 Cb -0.06 -3.48 0.53 0.00 -1.56 0.00 0.00 34.95 30.38 1xws s ARG 57 CO 0.00 -0.36 1.75 0.28 -0.81 0.00 0.00 175.30 176.17 1xws h VAL 58 N 4.84 1.28 -0.48 7.11 2.07 -1.66 0.12 116.25 129.53 1xws h VAL 58 Ca -0.37 -1.34 -0.02 0.00 0.82 0.00 0.00 66.70 65.79 1xws h VAL 58 Cb 1.18 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.50 1xws h VAL 58 CO 0.85 0.40 0.21 0.77 0.02 0.00 0.00 177.57 179.82 1xws h SER 59 N 0.21 0.62 0.00 0.57 4.64 -1.92 -3.35 113.55 114.31 1xws h SER 59 Ca 0.03 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1xws h SER 59 Cb 0.71 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1xws h SER 59 CO 0.05 0.55 -0.15 -0.90 -0.87 0.00 0.00 176.83 175.52 1xws n ASP 60 N -4.37 0.00 -1.73 4.97 5.75 -1.19 -5.02 116.55 114.96 1xws n ASP 60 Ca 0.04 -1.29 -0.18 0.00 -0.01 0.00 0.00 54.79 53.35 1xws n ASP 60 Cb 0.14 -0.06 -0.06 0.00 -1.03 0.00 0.00 41.12 40.11 1xws n ASP 60 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1xws n ASN 61 N 0.00 -4.84 -4.69 -1.12 3.02 0.41 -4.95 115.26 103.09 1xws n ASN 61 Ca 0.00 0.35 -0.42 0.00 -0.03 0.00 0.00 54.58 54.48 1xws n ASN 61 Cb 0.56 -4.27 -0.03 0.00 -0.61 0.00 0.00 39.78 35.43 1xws n ASN 61 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1xws s LEU 62 N -4.73 4.39 0.15 3.41 2.96 -1.20 -4.66 118.68 119.01 1xws s LEU 62 Ca 0.00 2.73 -0.31 0.00 -0.22 0.00 0.00 54.13 56.33 1xws s LEU 62 Cb 0.00 -3.57 -0.11 0.00 0.50 0.00 0.00 46.19 43.02 1xws s LEU 62 CO 0.00 -0.99 1.75 -2.16 -1.32 0.00 0.00 176.35 173.63 1xws s PRO 63 N 2.65 4.15 0.26 0.98 0.04 -1.26 -0.12 135.00 141.69 1xws s PRO 63 Ca 0.80 2.55 0.04 0.00 0.04 0.00 0.00 61.00 64.43 1xws s PRO 63 Cb -0.45 -3.40 -0.05 0.00 0.04 0.00 0.00 34.50 30.63 1xws s PRO 63 CO 0.36 -0.78 0.00 0.14 0.04 0.00 0.00 177.00 176.76 1xws s VAL 64 N 2.11 1.14 -0.09 -0.36 -7.23 -0.48 -3.04 120.40 112.45 1xws s VAL 64 Ca 0.77 -2.04 0.03 0.00 -1.81 0.00 0.00 61.98 58.93 1xws s VAL 64 Cb -0.46 -2.45 -0.01 0.00 0.56 0.00 0.00 36.38 34.01 1xws s VAL 64 CO 0.34 -0.25 -0.18 0.00 -0.31 0.00 0.00 175.10 174.70 1xws s ALA 65 N -3.35 2.46 -0.30 1.32 0.00 0.66 -0.96 121.76 121.60 1xws s ALA 65 Ca 0.30 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 51.30 1xws s ALA 65 Cb 0.06 -0.98 0.06 0.00 0.00 0.00 0.00 23.12 22.26 1xws s ALA 65 CO 0.11 0.36 -0.01 0.42 0.00 0.00 0.00 175.76 176.63 1xws s ILE 66 N 0.00 2.81 -0.18 0.00 1.01 0.13 -0.41 121.20 124.56 1xws s ILE 66 Ca -0.06 -1.50 -0.05 0.00 0.00 0.00 0.00 60.65 59.04 1xws s ILE 66 Cb -0.15 -2.65 -0.03 0.00 0.01 0.00 0.00 42.46 39.65 1xws s ILE 66 CO 0.05 -0.13 -0.01 -0.75 0.00 0.00 0.00 174.94 174.10 1xws s LYS 67 N 1.20 3.71 -0.06 2.79 2.20 0.05 -0.28 119.74 129.35 1xws s LYS 67 Ca -0.05 -0.49 0.03 0.00 -0.36 0.00 0.00 55.97 55.10 1xws s LYS 67 Cb -0.20 -3.03 -0.02 0.00 -1.51 0.00 0.00 37.83 33.07 1xws s LYS 67 CO -0.02 0.16 -0.13 -1.01 -0.36 0.00 0.00 175.35 173.99 1xws s HIS 68 N 0.60 2.74 -0.01 4.03 3.76 0.51 -0.39 115.29 126.52 1xws s HIS 68 Ca -0.01 -0.22 0.00 0.00 -0.15 0.00 0.00 55.06 54.68 1xws s HIS 68 Cb -0.14 -1.67 0.02 0.00 1.11 0.00 0.00 32.58 31.90 1xws s HIS 68 CO 0.02 0.14 0.02 0.54 -0.85 0.00 0.00 174.74 174.61 1xws s VAL 69 N -0.56 -0.02 0.38 -0.90 0.11 -0.62 -0.90 120.40 117.88 1xws s VAL 69 Ca 0.08 0.14 -0.26 0.00 -2.93 0.00 0.00 61.98 59.01 1xws s VAL 69 Cb -0.11 -0.07 -0.09 0.00 -1.53 0.00 0.00 36.38 34.58 1xws s VAL 69 CO 0.01 0.06 1.17 -1.61 -3.33 0.00 0.00 175.10 171.41 1xws s GLU 70 N 0.71 4.16 0.28 1.54 2.02 -1.26 -1.69 118.70 124.45 1xws s GLU 70 Ca -0.06 1.86 -0.03 0.00 0.02 0.00 0.00 54.97 56.75 1xws s GLU 70 Cb -0.09 -2.77 0.38 0.00 0.10 0.00 0.00 34.13 31.75 1xws s GLU 70 CO -0.02 -0.23 1.92 0.87 0.02 0.00 0.00 175.26 177.82 1xws h LYS 71 N 2.85 1.11 0.00 1.61 1.57 -0.81 -1.93 116.57 120.96 1xws h LYS 71 Ca -0.48 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.20 1xws h LYS 71 Cb 1.23 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 33.31 1xws h LYS 71 CO 0.63 0.78 0.00 -0.44 -0.57 0.00 0.00 179.45 179.85 1xws h ASP 72 N 1.12 0.00 -0.01 0.86 3.45 -1.92 -1.65 116.42 118.27 1xws h ASP 72 Ca 0.29 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.75 1xws h ASP 72 Cb -0.04 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.73 1xws h ASP 72 CO -0.05 0.00 -0.24 0.54 -1.57 0.00 0.00 179.24 177.92 1xws n ARG 73 N -2.43 1.70 -2.98 3.56 1.74 -0.73 -4.87 116.66 112.65 1xws n ARG 73 Ca -0.00 -1.38 -0.41 0.00 -0.77 0.00 0.00 57.85 55.28 1xws n ARG 73 Cb 0.12 -1.47 -0.05 0.00 -1.02 0.00 0.00 32.46 30.04 1xws n ARG 73 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1xws s ILE 74 N -2.25 4.88 -0.16 0.55 1.01 -0.62 -4.95 121.20 119.66 1xws s ILE 74 Ca 0.24 1.33 -0.10 0.00 0.00 0.00 0.00 60.65 62.13 1xws s ILE 74 Cb 0.19 -4.06 -0.23 0.00 0.01 0.00 0.00 42.46 38.37 1xws s ILE 74 CO 0.44 -0.07 0.23 -1.54 0.00 0.00 0.00 174.94 174.00 1xws n SER 75 N 5.94 2.04 -4.53 3.58 3.41 -1.26 -4.88 113.62 117.92 1xws n SER 75 Ca 0.03 0.23 -0.39 0.00 -0.26 0.00 0.00 58.87 58.48 1xws n SER 75 Cb 0.48 -0.84 -0.11 0.00 -0.26 0.00 0.00 64.21 63.48 1xws n SER 75 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1xws s ASP 76 N -6.97 5.90 0.13 4.04 3.68 -1.26 -5.07 116.67 117.13 1xws s ASP 76 Ca -0.26 -0.27 0.10 0.00 2.13 0.00 0.00 52.55 54.25 1xws s ASP 76 Cb 0.07 -2.10 -0.04 0.00 -1.45 0.00 0.00 42.92 39.40 1xws s ASP 76 CO 0.70 -0.15 -0.23 0.26 0.13 0.00 0.00 175.17 175.88 1xws s TRP 77 N 1.71 2.39 0.00 -5.34 0.52 -1.26 -1.43 118.94 115.53 1xws s TRP 77 Ca 0.06 -0.34 0.00 0.00 0.02 0.00 0.00 56.10 55.85 1xws s TRP 77 Cb -0.17 -1.27 0.00 0.00 -1.15 0.00 0.00 33.47 30.88 1xws s TRP 77 CO 0.10 0.38 0.00 0.41 0.02 0.00 0.00 176.95 177.85 1xws n GLY 78 N 0.78 4.42 3.11 0.98 0.00 0.60 -4.56 105.19 110.52 1xws n GLY 78 Ca -0.16 -1.45 -0.10 0.00 0.00 0.00 0.00 46.02 44.31 1xws n GLY 78 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1xws s GLU 79 N -0.34 0.57 0.50 1.61 -1.05 -1.26 -1.51 118.70 117.23 1xws s GLU 79 Ca 0.00 -0.71 -0.10 0.00 -0.15 0.00 0.00 54.97 54.00 1xws s GLU 79 Cb 0.00 0.23 -0.05 0.00 -0.44 0.00 0.00 34.13 33.86 1xws s GLU 79 CO 0.00 -0.14 0.88 -0.51 0.95 0.00 0.00 175.26 176.44 1xws s LEU 80 N -2.04 3.59 0.31 1.83 1.43 -0.93 -4.87 118.68 118.00 1xws s LEU 80 Ca -0.06 1.23 0.02 0.00 -1.03 0.00 0.00 54.13 54.29 1xws s LEU 80 Cb -0.02 -4.19 0.76 0.00 0.03 0.00 0.00 46.19 42.77 1xws s LEU 80 CO -0.04 -0.60 1.57 -0.65 0.23 0.00 0.00 176.35 176.86 1xws h PRO 81 N 0.54 0.00 0.00 1.29 0.11 -2.00 1.68 132.00 133.63 1xws h PRO 81 Ca -0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1xws h PRO 81 Cb 1.19 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1xws h PRO 81 CO 0.62 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.68 1xws n ASN 82 N -5.50 0.00 0.00 -2.05 6.94 -1.26 -4.88 115.26 108.51 1xws n ASN 82 Ca 0.23 -0.27 0.00 0.00 -0.02 0.00 0.00 54.58 54.52 1xws n ASN 82 Cb 0.77 -0.13 0.00 0.00 -2.36 0.00 0.00 39.78 38.06 1xws n ASN 82 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1xws n GLY 83 N 0.10 0.75 3.75 4.83 0.00 0.57 -5.07 105.19 110.12 1xws n GLY 83 Ca 0.11 -0.57 -0.40 0.00 0.00 0.00 0.00 46.02 45.16 1xws n GLY 83 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xws s THR 84 N -2.00 3.90 -0.57 2.61 2.01 -1.25 -4.75 115.64 115.58 1xws s THR 84 Ca 0.00 1.87 -0.27 0.00 0.31 0.00 0.00 61.69 63.60 1xws s THR 84 Cb 0.00 -4.19 -0.00 0.00 0.01 0.00 0.00 72.50 68.32 1xws s THR 84 CO 0.00 0.43 1.60 -0.60 -0.69 0.00 0.00 174.62 175.36 1xws s ARG 85 N -1.13 3.06 0.20 4.92 6.06 -1.26 -2.20 118.95 128.60 1xws s ARG 85 Ca 0.43 0.54 0.06 0.00 -2.50 0.00 0.00 55.73 54.27 1xws s ARG 85 Cb -0.28 -4.23 -0.05 0.00 0.06 0.00 0.00 34.95 30.45 1xws s ARG 85 CO 0.35 -2.23 -0.11 0.14 -2.50 0.00 0.00 175.30 170.95 1xws s VAL 86 N 7.16 1.50 0.31 7.11 -7.23 -0.57 -4.99 120.40 123.69 1xws s VAL 86 Ca 0.59 -2.14 -0.28 0.00 -1.81 0.00 0.00 61.98 58.34 1xws s VAL 86 Cb -0.12 -2.05 -0.13 0.00 0.56 0.00 0.00 36.38 34.63 1xws s VAL 86 CO 0.23 -0.59 1.08 -2.65 -0.31 0.00 0.00 175.10 172.87 1xws n PRO 87 N -0.35 1.56 -0.31 4.82 -0.02 -1.26 -0.29 135.00 139.14 1xws n PRO 87 Ca -0.08 0.55 0.22 0.00 -2.02 0.00 0.00 63.50 62.16 1xws n PRO 87 Cb 0.61 -1.98 0.50 0.00 -0.02 0.00 0.00 33.50 32.61 1xws n PRO 87 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1xws h MET 88 N 2.12 0.40 -0.95 -0.52 1.85 -1.49 -1.82 114.93 114.52 1xws h MET 88 Ca -0.41 -0.02 0.13 0.00 -0.61 0.00 0.00 59.70 58.78 1xws h MET 88 Cb 1.32 -0.09 -0.08 0.00 0.43 0.00 0.00 31.60 33.19 1xws h MET 88 CO 0.61 0.26 0.61 1.49 -0.40 0.00 0.00 176.91 179.48 1xws h GLU 89 N 0.41 0.86 -0.11 0.39 4.81 -1.80 -0.75 114.58 118.38 1xws h GLU 89 Ca 0.57 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.74 1xws h GLU 89 Cb 1.43 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 30.61 1xws h GLU 89 CO -0.27 0.57 0.03 0.28 -0.73 0.00 0.00 179.01 178.88 1xws h VAL 90 N 0.88 1.20 -0.45 0.32 2.07 -1.69 -0.70 116.25 117.89 1xws h VAL 90 Ca 0.47 -0.62 0.07 0.00 0.82 0.00 0.00 66.70 67.44 1xws h VAL 90 Cb 0.56 1.40 -0.06 0.00 -1.52 0.00 0.00 31.29 31.67 1xws h VAL 90 CO -0.24 0.18 0.12 0.58 0.02 0.00 0.00 177.57 178.23 1xws h VAL 91 N -0.02 0.80 -0.18 2.57 2.07 -1.20 -0.28 116.25 120.00 1xws h VAL 91 Ca 0.04 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 67.41 1xws h VAL 91 Cb 0.26 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1xws h VAL 91 CO 0.00 0.05 -0.10 -0.07 0.02 0.00 0.00 177.57 177.47 1xws h LEU 92 N 0.26 0.40 -0.75 2.57 3.38 -1.12 -2.56 115.31 117.50 1xws h LEU 92 Ca 0.22 -0.42 0.05 0.00 0.09 0.00 0.00 57.88 57.81 1xws h LEU 92 Cb 0.25 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 1xws h LEU 92 CO -0.26 0.74 0.45 -0.07 0.09 0.00 0.00 178.44 179.39 1xws h LEU 93 N 0.06 0.70 -1.08 1.67 3.38 -0.93 -2.35 115.31 116.76 1xws h LEU 93 Ca 0.04 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1xws h LEU 93 Cb 0.59 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1xws h LEU 93 CO 0.03 0.46 0.41 0.11 0.09 0.00 0.00 178.44 179.54 1xws h LYS 94 N 0.84 1.05 -0.08 1.13 1.57 -0.94 -1.61 116.57 118.52 1xws h LYS 94 Ca 0.32 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.92 1xws h LYS 94 Cb 0.14 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1xws h LYS 94 CO -0.16 0.77 -0.24 0.87 -0.57 0.00 0.00 179.45 180.12 1xws h LYS 95 N 1.05 0.14 -0.02 3.15 1.57 -1.01 -3.16 116.57 118.29 1xws h LYS 95 Ca 0.27 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1xws h LYS 95 Cb 0.03 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1xws h LYS 95 CO -0.04 0.38 -0.19 1.33 -0.57 0.00 0.00 179.45 180.35 1xws n VAL 96 N -4.20 0.00 0.96 0.50 0.24 -0.94 -4.57 118.33 110.31 1xws n VAL 96 Ca -0.01 -0.40 0.12 0.00 -2.04 0.00 0.00 64.34 62.00 1xws n VAL 96 Cb 0.33 1.34 0.31 0.00 -1.47 0.00 0.00 33.84 34.35 1xws n VAL 96 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1xws n SER 97 N 0.59 2.36 -4.74 -1.34 7.64 -0.65 -4.89 113.62 112.58 1xws n SER 97 Ca 0.10 -1.81 -0.39 0.00 1.01 0.00 0.00 58.87 57.79 1xws n SER 97 Cb 0.47 -0.12 -0.06 0.00 -1.01 0.00 0.00 64.21 63.49 1xws n SER 97 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1xws s SER 98 N -1.65 6.86 0.17 6.43 0.01 -1.26 -4.84 113.70 119.42 1xws s SER 98 Ca 0.34 1.03 0.00 0.00 1.31 0.00 0.00 55.95 58.63 1xws s SER 98 Cb 0.20 -2.34 0.00 0.00 0.21 0.00 0.00 66.02 64.09 1xws s SER 98 CO 0.29 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.59 1xws n GLY 99 N 2.84 -2.09 3.79 3.44 0.00 -1.26 -4.87 105.19 107.05 1xws n GLY 99 Ca -0.06 -1.36 -0.35 0.00 0.00 0.00 0.00 46.02 44.25 1xws n GLY 99 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xws s PHE 100 N -1.54 3.02 0.09 1.61 0.08 -1.26 -5.05 117.98 114.93 1xws s PHE 100 Ca 0.00 1.59 -0.26 0.00 0.12 0.00 0.00 56.93 58.37 1xws s PHE 100 Cb 0.00 -3.15 0.09 0.00 -0.57 0.00 0.00 43.02 39.39 1xws s PHE 100 CO 0.00 -0.95 1.11 -1.54 -0.10 0.00 0.00 175.22 173.74 1xws s SER 101 N -1.76 -0.07 -0.05 1.36 1.04 -1.26 -4.99 113.70 107.96 1xws s SER 101 Ca 0.65 -0.38 0.01 0.00 0.48 0.00 0.00 55.95 56.71 1xws s SER 101 Cb -0.20 0.36 0.10 0.00 0.10 0.00 0.00 66.02 66.38 1xws s SER 101 CO 0.25 -0.68 0.97 0.61 0.98 0.00 0.00 173.24 175.37 1xws n GLY 102 N -0.59 2.13 3.58 7.32 0.00 -1.26 -4.81 105.19 111.56 1xws n GLY 102 Ca -0.05 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 1xws n GLY 102 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xws s VAL 103 N -0.75 3.87 0.08 1.61 1.01 -1.26 -0.57 120.40 124.39 1xws s VAL 103 Ca 0.08 -0.40 -0.31 0.00 0.00 0.00 0.00 61.98 61.35 1xws s VAL 103 Cb 0.07 -2.62 -0.09 0.00 0.00 0.00 0.00 36.38 33.73 1xws s VAL 103 CO 0.02 0.57 1.75 -0.63 0.00 0.00 0.00 175.10 176.81 1xws s ILE 104 N -0.49 2.85 0.13 2.22 -1.09 -0.66 -4.81 121.20 119.36 1xws s ILE 104 Ca 0.08 0.28 -0.11 0.00 -2.23 0.00 0.00 60.65 58.67 1xws s ILE 104 Cb -0.12 -3.18 -0.06 0.00 -1.58 0.00 0.00 42.46 37.51 1xws s ILE 104 CO 0.02 -0.00 0.48 -0.13 -1.23 0.00 0.00 174.94 174.08 1xws s ARG 105 N 2.86 3.84 -0.35 2.79 0.52 -1.26 -4.88 118.95 122.48 1xws s ARG 105 Ca 0.78 0.29 -0.28 0.00 -0.52 0.00 0.00 55.73 56.00 1xws s ARG 105 Cb -0.42 -2.90 0.02 0.00 0.52 0.00 0.00 34.95 32.16 1xws s ARG 105 CO 0.34 0.48 1.05 -1.17 0.02 0.00 0.00 175.30 176.02 1xws s LEU 106 N -2.13 3.91 -0.02 2.53 2.96 -1.26 -1.88 118.68 122.79 1xws s LEU 106 Ca 0.38 0.86 0.08 0.00 -0.22 0.00 0.00 54.13 55.23 1xws s LEU 106 Cb -0.14 -3.47 -0.23 0.00 0.50 0.00 0.00 46.19 42.85 1xws s LEU 106 CO 0.19 -0.92 0.75 -0.07 -1.32 0.00 0.00 176.35 174.98 1xws h LEU 107 N 10.23 0.08 -7.61 -0.68 3.38 -1.05 -3.49 115.31 116.17 1xws h LEU 107 Ca -0.21 -0.14 0.14 0.00 0.09 0.00 0.00 57.88 57.76 1xws h LEU 107 Cb 1.06 -0.02 -0.09 0.00 0.09 0.00 0.00 40.66 41.70 1xws h LEU 107 CO 1.03 1.12 0.43 -0.62 0.09 0.00 0.00 178.44 180.50 1xws s ASP 108 N -6.36 -0.23 0.07 -0.43 2.15 -1.18 -5.00 116.67 105.69 1xws s ASP 108 Ca -0.06 -0.37 -0.14 0.00 0.43 0.00 0.00 52.55 52.41 1xws s ASP 108 Cb 0.08 0.52 0.02 0.00 -0.30 0.00 0.00 42.92 43.24 1xws s ASP 108 CO 0.82 -0.94 0.33 -1.66 -0.17 0.00 0.00 175.17 173.55 1xws s TRP 109 N -3.39 -0.12 0.02 -5.34 1.48 -1.26 -0.04 118.94 110.29 1xws s TRP 109 Ca 0.11 -0.10 0.01 0.00 -1.06 0.00 0.00 56.10 55.06 1xws s TRP 109 Cb -0.02 0.14 -0.01 0.00 -1.16 0.00 0.00 33.47 32.41 1xws s TRP 109 CO 0.01 -0.58 -0.05 -0.06 -4.06 0.00 0.00 176.95 172.21 1xws s PHE 110 N -3.12 0.40 -0.15 1.66 0.40 0.64 -5.00 117.98 112.82 1xws s PHE 110 Ca -0.01 -0.34 -0.05 0.00 -0.60 0.00 0.00 56.93 55.93 1xws s PHE 110 Cb 0.01 -0.25 -0.03 0.00 0.51 0.00 0.00 43.02 43.25 1xws s PHE 110 CO -0.07 -0.08 0.01 -2.00 0.70 0.00 0.00 175.22 173.78 1xws s GLU 111 N -0.97 3.61 0.42 0.44 2.12 -1.26 -1.07 118.70 121.99 1xws s GLU 111 Ca -0.07 -0.41 0.07 0.00 0.36 0.00 0.00 54.97 54.91 1xws s GLU 111 Cb -0.07 -3.00 -0.04 0.00 0.26 0.00 0.00 34.13 31.28 1xws s GLU 111 CO -0.00 0.39 0.25 1.03 -0.54 0.00 0.00 175.26 176.38 1xws s ARG 112 N 0.01 2.31 0.40 4.30 0.52 0.91 -5.00 118.95 122.41 1xws s ARG 112 Ca 0.03 -1.77 0.09 0.00 -0.52 0.00 0.00 55.73 53.56 1xws s ARG 112 Cb -0.13 -2.10 0.87 0.00 0.52 0.00 0.00 34.95 34.12 1xws s ARG 112 CO 0.02 -0.16 1.99 -1.35 0.02 0.00 0.00 175.30 175.82 1xws h PRO 113 N 1.28 0.57 0.00 3.54 0.11 -2.03 -3.22 132.00 132.25 1xws h PRO 113 Ca -0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1xws h PRO 113 Cb 1.26 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1xws h PRO 113 CO 0.66 0.37 0.00 -0.25 -0.21 0.00 0.00 178.00 178.57 1xws n ASP 114 N -4.47 1.41 -3.90 -2.05 10.43 -1.26 -4.99 116.55 111.72 1xws n ASP 114 Ca 0.08 -1.46 -0.09 0.00 2.57 0.00 0.00 54.79 55.89 1xws n ASP 114 Cb 0.23 0.00 -0.05 0.00 1.84 0.00 0.00 41.12 43.14 1xws n ASP 114 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 1xws s SER 115 N -0.46 -0.12 0.06 -2.24 1.04 -1.22 -0.07 113.70 110.70 1xws s SER 115 Ca 0.00 -0.75 0.05 0.00 0.48 0.00 0.00 55.95 55.73 1xws s SER 115 Cb 0.00 0.55 -0.04 0.00 0.10 0.00 0.00 66.02 66.63 1xws s SER 115 CO 0.00 -1.06 -0.08 -0.36 0.98 0.00 0.00 173.24 172.72 1xws s PHE 116 N -3.95 2.82 -0.12 5.02 0.08 -0.68 -0.06 117.98 121.08 1xws s PHE 116 Ca 0.16 -0.10 0.02 0.00 0.12 0.00 0.00 56.93 57.13 1xws s PHE 116 Cb 0.00 -1.52 0.01 0.00 -0.57 0.00 0.00 43.02 40.95 1xws s PHE 116 CO 0.03 0.40 -0.16 0.08 -0.10 0.00 0.00 175.22 175.46 1xws s VAL 117 N -1.12 1.61 -0.11 -0.44 1.01 -0.23 -1.58 120.40 119.53 1xws s VAL 117 Ca 0.20 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1xws s VAL 117 Cb -0.11 -1.46 -0.02 0.00 0.00 0.00 0.00 36.38 34.79 1xws s VAL 117 CO 0.11 0.46 -0.14 -0.76 0.00 0.00 0.00 175.10 174.78 1xws s LEU 118 N 1.01 2.70 -0.29 3.92 1.02 0.48 -0.26 118.68 127.26 1xws s LEU 118 Ca -0.05 -0.30 -0.09 0.00 0.02 0.00 0.00 54.13 53.71 1xws s LEU 118 Cb -0.15 -1.59 -0.02 0.00 0.02 0.00 0.00 46.19 44.46 1xws s LEU 118 CO -0.03 0.22 0.13 -0.63 0.02 0.00 0.00 176.35 176.06 1xws s ILE 119 N 0.04 4.56 0.19 -0.59 -1.09 0.95 -0.77 121.20 124.49 1xws s ILE 119 Ca -0.05 -0.30 0.11 0.00 -2.23 0.00 0.00 60.65 58.19 1xws s ILE 119 Cb -0.14 -3.26 -0.04 0.00 -1.58 0.00 0.00 42.46 37.44 1xws s ILE 119 CO 0.04 0.17 -0.24 -0.76 -1.23 0.00 0.00 174.94 172.92 1xws s LEU 120 N 1.62 2.42 0.74 2.97 1.43 0.45 -0.37 118.68 127.94 1xws s LEU 120 Ca 0.05 -0.86 -0.15 0.00 -1.03 0.00 0.00 54.13 52.14 1xws s LEU 120 Cb -0.16 -1.17 0.03 0.00 0.03 0.00 0.00 46.19 44.91 1xws s LEU 120 CO 0.06 0.12 1.11 -0.62 0.23 0.00 0.00 176.35 177.25 1xws n GLU 121 N 0.32 0.52 -3.63 1.70 1.02 -0.79 -0.25 120.64 119.54 1xws n GLU 121 Ca -0.13 0.24 -0.27 0.00 -0.02 0.00 0.00 57.16 56.98 1xws n GLU 121 Cb 0.56 -2.35 -0.16 0.00 -0.02 0.00 0.00 31.44 29.46 1xws n GLU 121 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1xws s ARG 122 N -3.60 0.25 0.60 3.49 3.52 -1.17 -4.27 118.95 117.76 1xws s ARG 122 Ca 0.75 -0.31 -0.19 0.00 -0.13 0.00 0.00 55.73 55.86 1xws s ARG 122 Cb -0.33 -1.74 -0.03 0.00 -1.56 0.00 0.00 34.95 31.28 1xws s ARG 122 CO 0.48 -0.76 1.20 -2.14 -0.81 0.00 0.00 175.30 173.27 1xws s PRO 123 N 2.04 2.97 -0.13 5.12 0.02 -1.26 -4.65 135.00 139.11 1xws s PRO 123 Ca 0.03 1.78 -0.06 0.00 0.02 0.00 0.00 61.00 62.78 1xws s PRO 123 Cb -0.16 -1.93 0.06 0.00 0.02 0.00 0.00 34.50 32.48 1xws s PRO 123 CO -0.16 -1.19 0.30 -2.00 -0.33 0.00 0.00 177.00 173.61 1xws s GLU 124 N -3.38 0.23 0.64 5.54 2.56 -1.26 -4.06 118.70 118.97 1xws s GLU 124 Ca 0.76 0.70 -0.15 0.00 0.00 0.00 0.00 54.97 56.29 1xws s GLU 124 Cb -0.29 -0.03 -0.01 0.00 2.00 0.00 0.00 34.13 35.80 1xws s GLU 124 CO 0.33 -0.21 1.08 -1.25 -0.56 0.00 0.00 175.26 174.65 1xws s PRO 125 N 1.82 3.01 0.03 4.30 0.04 -1.26 -4.91 135.00 138.03 1xws s PRO 125 Ca -0.05 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.27 1xws s PRO 125 Cb -0.11 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.42 1xws s PRO 125 CO -0.10 -1.07 -0.04 0.54 0.04 0.00 0.00 177.00 176.37 1xws s VAL 126 N -2.46 0.20 -0.13 -0.36 0.11 -1.26 -2.35 120.40 114.16 1xws s VAL 126 Ca 0.65 -1.05 -0.10 0.00 -2.93 0.00 0.00 61.98 58.54 1xws s VAL 126 Cb -0.18 -0.48 0.04 0.00 -1.53 0.00 0.00 36.38 34.23 1xws s VAL 126 CO 0.41 -0.54 0.33 -1.58 -3.33 0.00 0.00 175.10 170.38 1xws s GLN 127 N -1.79 0.36 0.72 1.54 0.74 -0.91 -4.96 119.66 115.35 1xws s GLN 127 Ca -0.12 0.51 -0.11 0.00 0.05 0.00 0.00 55.36 55.69 1xws s GLN 127 Cb -0.08 0.11 0.03 0.00 1.10 0.00 0.00 33.01 34.17 1xws s GLN 127 CO -0.02 -0.08 1.08 0.16 -0.55 0.00 0.00 175.29 175.88 1xws s ASP 128 N 0.50 4.99 0.35 6.67 3.84 -1.26 -0.41 116.67 131.35 1xws s ASP 128 Ca -0.03 1.76 0.11 0.00 -0.00 0.00 0.00 52.55 54.39 1xws s ASP 128 Cb -0.04 -2.51 0.65 0.00 -1.38 0.00 0.00 42.92 39.63 1xws s ASP 128 CO -0.03 -1.70 1.79 0.25 -0.00 0.00 0.00 175.17 175.48 1xws h LEU 129 N -0.76 0.06 -0.45 2.11 5.85 -0.57 -0.88 115.31 120.68 1xws h LEU 129 Ca -0.44 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.28 1xws h LEU 129 Cb 1.22 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.21 1xws h LEU 129 CO 0.54 0.44 0.26 0.15 -0.34 0.00 0.00 178.44 179.49 1xws h PHE 130 N 0.05 0.49 -0.12 1.25 3.57 -1.76 -0.99 116.94 119.43 1xws h PHE 130 Ca 0.00 0.02 -0.17 0.00 3.53 0.00 0.00 57.97 61.35 1xws h PHE 130 Cb 0.70 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 1xws h PHE 130 CO 0.00 0.28 -0.64 -0.44 -2.23 0.00 0.00 178.31 175.28 1xws h ASP 131 N 0.52 0.53 0.15 0.41 3.32 -1.80 0.73 116.42 120.28 1xws h ASP 131 Ca 0.18 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 1xws h ASP 131 Cb 0.02 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.42 1xws h ASP 131 CO -0.09 1.03 -0.07 0.15 -1.72 0.00 0.00 179.24 178.54 1xws h PHE 132 N 0.34 -0.19 -0.45 4.55 3.57 -0.92 -1.42 116.94 122.42 1xws h PHE 132 Ca -0.01 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 1xws h PHE 132 Cb 1.19 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.97 1xws h PHE 132 CO 0.04 0.04 0.22 0.82 -2.23 0.00 0.00 178.31 177.20 1xws h ILE 133 N -0.39 1.18 -0.97 1.41 2.04 -1.11 0.69 117.51 120.37 1xws h ILE 133 Ca -0.02 -0.50 0.13 0.00 1.00 0.00 0.00 64.86 65.47 1xws h ILE 133 Cb 0.31 0.69 -0.09 0.00 -0.74 0.00 0.00 36.82 36.99 1xws h ILE 133 CO 0.03 0.19 0.59 0.74 0.00 0.00 0.00 178.15 179.71 1xws h THR 134 N 0.58 0.87 0.15 -0.27 2.02 -0.78 0.64 112.91 116.12 1xws h THR 134 Ca 0.15 -0.31 -0.30 0.00 0.77 0.00 0.00 66.41 66.73 1xws h THR 134 Cb 0.11 -0.11 0.03 0.00 -1.74 0.00 0.00 68.15 66.43 1xws h THR 134 CO -0.02 0.16 -1.28 -0.33 0.37 0.00 0.00 175.52 174.42 1xws h GLU 135 N 0.90 0.53 0.00 6.66 5.08 -0.89 -3.38 114.58 123.48 1xws h GLU 135 Ca 0.49 -0.76 -0.03 0.00 -1.00 0.00 0.00 59.36 58.06 1xws h GLU 135 Cb 0.55 0.26 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 1xws h GLU 135 CO -0.29 1.35 -1.90 0.54 -1.00 0.00 0.00 179.01 177.70 1xws n ARG 136 N -3.72 0.66 0.00 2.33 1.74 0.20 -5.10 116.66 112.76 1xws n ARG 136 Ca -0.13 -0.14 0.00 0.00 -0.77 0.00 0.00 57.85 56.81 1xws n ARG 136 Cb 1.01 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 30.89 1xws n ARG 136 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xws n GLY 137 N 1.29 -2.00 3.59 -0.13 0.00 0.22 -4.91 105.19 103.25 1xws n GLY 137 Ca -0.06 -1.54 -0.44 0.00 0.00 0.00 0.00 46.02 43.99 1xws n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xws n ALA 138 N 0.10 -0.17 -2.14 4.61 0.00 -1.26 -4.71 120.51 116.93 1xws n ALA 138 Ca 0.00 0.37 -0.35 0.00 0.00 0.00 0.00 53.44 53.46 1xws n ALA 138 Cb 0.00 -2.03 -0.06 0.00 0.00 0.00 0.00 19.45 17.36 1xws n ALA 138 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xws s LEU 139 N 0.35 4.26 0.43 0.00 1.43 0.31 -4.95 118.68 120.51 1xws s LEU 139 Ca 0.59 1.34 -0.25 0.00 -1.03 0.00 0.00 54.13 54.78 1xws s LEU 139 Cb -0.68 -3.71 -0.09 0.00 0.03 0.00 0.00 46.19 41.73 1xws s LEU 139 CO 0.60 -0.04 1.29 0.00 0.23 0.00 0.00 176.35 178.43 1xws n GLN 140 N 0.39 1.95 -0.35 1.70 6.02 -1.26 -4.62 117.38 121.21 1xws n GLN 140 Ca -0.01 0.69 0.08 0.00 -0.01 0.00 0.00 57.00 57.76 1xws n GLN 140 Cb 0.52 -2.42 0.26 0.00 1.02 0.00 0.00 30.24 29.62 1xws n GLN 140 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1xws h GLU 141 N 2.06 0.93 -0.85 -1.09 5.08 -1.97 0.55 114.58 119.28 1xws h GLU 141 Ca -0.48 -0.06 0.12 0.00 -1.00 0.00 0.00 59.36 57.94 1xws h GLU 141 Cb 1.29 -0.21 -0.08 0.00 0.50 0.00 0.00 28.75 30.25 1xws h GLU 141 CO 0.60 0.61 0.47 1.49 -1.00 0.00 0.00 179.01 181.18 1xws h GLU 142 N 0.95 0.71 0.04 2.33 4.81 -1.99 0.21 114.58 121.64 1xws h GLU 142 Ca 0.49 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 59.50 1xws h GLU 142 Cb 0.53 -0.16 0.02 0.00 0.63 0.00 0.00 28.75 29.76 1xws h GLU 142 CO -0.26 0.47 -0.73 1.25 -0.73 0.00 0.00 179.01 179.01 1xws h LEU 143 N 0.74 0.58 -1.08 1.64 5.85 -1.46 -2.65 115.31 118.92 1xws h LEU 143 Ca 0.44 -0.80 0.02 0.00 0.84 0.00 0.00 57.88 58.38 1xws h LEU 143 Cb 0.51 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 1xws h LEU 143 CO -0.30 1.31 0.62 0.00 -0.34 0.00 0.00 178.44 179.73 1xws h ALA 144 N 0.28 1.37 -0.18 1.25 0.00 -0.77 -1.27 119.26 119.93 1xws h ALA 144 Ca -0.10 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1xws h ALA 144 Cb 1.46 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1xws h ALA 144 CO 0.14 0.56 0.11 -0.09 0.00 0.00 0.00 179.25 179.97 1xws h ARG 145 N 1.22 0.22 0.04 0.00 2.43 -0.55 0.22 114.38 117.96 1xws h ARG 145 Ca 0.36 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.52 1xws h ARG 145 Cb -0.06 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.44 1xws h ARG 145 CO -0.10 0.14 -0.02 1.03 -1.51 0.00 0.00 179.97 179.52 1xws h SER 146 N 0.23 -0.05 -0.17 -3.80 0.87 -1.24 0.44 113.55 109.82 1xws h SER 146 Ca 0.07 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1xws h SER 146 Cb -0.01 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 1xws h SER 146 CO -0.03 -0.04 0.09 -0.26 -0.53 0.00 0.00 176.83 176.07 1xws h PHE 147 N -0.06 0.24 -0.62 2.24 0.05 -1.15 -2.03 116.94 115.62 1xws h PHE 147 Ca -0.00 -0.01 -0.08 0.00 3.82 0.00 0.00 57.97 61.70 1xws h PHE 147 Cb 0.05 -0.08 -0.02 0.00 2.00 0.00 0.00 35.95 37.90 1xws h PHE 147 CO -0.08 0.25 0.08 0.35 -0.18 0.00 0.00 178.31 178.73 1xws h PHE 148 N 0.17 1.10 -0.40 -0.55 3.57 -0.42 -1.76 116.94 118.66 1xws h PHE 148 Ca 0.06 -0.16 0.06 0.00 3.53 0.00 0.00 57.97 61.46 1xws h PHE 148 Cb 0.09 -0.30 -0.06 0.00 2.79 0.00 0.00 35.95 38.47 1xws h PHE 148 CO -0.03 0.95 0.07 2.35 -2.23 0.00 0.00 178.31 179.41 1xws h TRP 149 N 0.94 0.10 -0.71 0.41 2.91 -0.82 -0.98 115.95 117.81 1xws h TRP 149 Ca 0.18 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.21 1xws h TRP 149 Cb 0.45 0.01 -0.03 0.00 -0.51 0.00 0.00 29.16 29.09 1xws h TRP 149 CO 0.03 -0.00 0.35 1.96 -1.03 0.00 0.00 178.44 179.75 1xws h GLN 150 N 0.19 0.99 -0.21 2.65 4.20 -1.01 -1.16 115.11 120.76 1xws h GLN 150 Ca 0.19 -0.13 -0.04 0.00 0.06 0.00 0.00 58.65 58.74 1xws h GLN 150 Cb 0.24 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1xws h GLN 150 CO -0.27 0.76 -0.01 0.28 -0.67 0.00 0.00 178.83 178.92 1xws h VAL 151 N 0.99 1.26 -0.47 -0.54 2.07 -0.67 -1.74 116.25 117.15 1xws h VAL 151 Ca 0.25 -0.92 0.08 0.00 0.82 0.00 0.00 66.70 66.92 1xws h VAL 151 Cb 0.08 1.45 -0.07 0.00 -1.52 0.00 0.00 31.29 31.23 1xws h VAL 151 CO -0.03 0.28 0.09 -0.07 0.02 0.00 0.00 177.57 177.86 1xws h LEU 152 N 0.14 -0.00 -0.79 2.57 3.38 -0.75 0.29 115.31 120.14 1xws h LEU 152 Ca 0.06 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1xws h LEU 152 Cb 0.43 0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 1xws h LEU 152 CO 0.01 0.03 0.51 -0.33 0.09 0.00 0.00 178.44 178.75 1xws h GLU 153 N 0.23 1.06 -0.42 1.13 4.39 -1.11 -0.06 114.58 119.78 1xws h GLU 153 Ca 0.23 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.85 1xws h GLU 153 Cb 0.31 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 1xws h GLU 153 CO -0.31 0.72 0.23 0.00 -1.16 0.00 0.00 179.01 178.49 1xws h ALA 154 N 1.28 0.54 -0.58 3.43 0.00 -0.87 -1.13 119.26 121.94 1xws h ALA 154 Ca 0.29 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.03 1xws h ALA 154 Cb -0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1xws h ALA 154 CO -0.06 0.07 0.01 0.28 0.00 0.00 0.00 179.25 179.55 1xws h VAL 155 N 0.55 1.26 -0.70 0.00 2.07 -0.68 -1.63 116.25 117.13 1xws h VAL 155 Ca 0.15 -1.12 0.01 0.00 0.82 0.00 0.00 66.70 66.56 1xws h VAL 155 Cb 0.05 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 1xws h VAL 155 CO -0.02 0.40 0.46 0.03 0.02 0.00 0.00 177.57 178.46 1xws h ARG 156 N 0.91 0.90 -0.12 1.57 3.08 -0.86 -0.49 114.38 119.37 1xws h ARG 156 Ca 0.17 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 60.21 1xws h ARG 156 Cb 0.53 -0.20 -0.05 0.00 0.08 0.00 0.00 29.97 30.33 1xws h ARG 156 CO 0.03 0.60 -0.21 1.25 -1.07 0.00 0.00 179.97 180.56 1xws h HIS 157 N 0.93 -0.55 -0.10 3.04 2.76 -0.90 0.12 115.15 120.44 1xws h HIS 157 Ca 0.26 0.03 0.04 0.00 -2.20 0.00 0.00 60.37 58.50 1xws h HIS 157 Cb -0.09 0.26 -0.06 0.00 1.55 0.00 0.00 27.41 29.08 1xws h HIS 157 CO -0.03 -0.29 -0.27 0.00 -1.30 0.00 0.00 177.93 176.04 1xws h HIS 159 N -0.36 1.12 -0.03 0.00 -0.00 -0.86 0.58 115.15 115.60 1xws h HIS 159 Ca 0.09 0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 60.44 1xws h HIS 159 Cb 0.50 -0.37 -0.01 0.00 -0.00 0.00 0.00 27.41 27.53 1xws h HIS 159 CO -0.36 0.62 -0.24 -0.91 -0.00 0.00 0.00 177.93 177.05 1xws h ASN 160 N 1.13 0.05 -0.02 2.45 2.35 -0.23 -1.48 115.58 119.83 1xws h ASN 160 Ca 0.38 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 1xws h ASN 160 Cb 0.08 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1xws h ASN 160 CO -0.13 0.29 0.00 0.00 -1.65 0.00 0.00 177.43 175.94 1xws n GLY 162 N 0.98 0.47 3.21 0.00 0.00 -0.56 -4.86 105.19 104.44 1xws n GLY 162 Ca 0.20 -0.94 -0.31 0.00 0.00 0.00 0.00 46.02 44.97 1xws n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xws s VAL 163 N -2.00 1.92 -0.23 1.61 1.01 0.06 -0.62 120.40 122.15 1xws s VAL 163 Ca 0.00 -0.96 -0.05 0.00 0.00 0.00 0.00 61.98 60.96 1xws s VAL 163 Cb 0.00 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.71 1xws s VAL 163 CO 0.00 0.53 0.01 -0.22 0.00 0.00 0.00 175.10 175.42 1xws s LEU 164 N 0.17 3.19 0.02 3.92 2.96 0.12 -2.84 118.68 126.21 1xws s LEU 164 Ca -0.12 -0.27 -0.22 0.00 -0.22 0.00 0.00 54.13 53.29 1xws s LEU 164 Cb -0.16 -1.83 -0.17 0.00 0.50 0.00 0.00 46.19 44.54 1xws s LEU 164 CO 0.06 -0.00 1.32 -0.74 -1.32 0.00 0.00 176.35 175.67 1xws h HIS 165 N 8.00 0.26 0.00 5.38 -0.00 -1.93 0.48 115.15 127.34 1xws h HIS 165 Ca -0.39 -0.08 0.00 0.00 -0.00 0.00 0.00 60.37 59.90 1xws h HIS 165 Cb 1.17 -0.06 0.00 0.00 -0.00 0.00 0.00 27.41 28.53 1xws h HIS 165 CO 0.62 0.64 0.00 0.54 -0.00 0.00 0.00 177.93 179.73 1xws n ARG 166 N -4.68 -0.15 -2.71 5.26 1.74 -1.26 -3.04 116.66 111.83 1xws n ARG 166 Ca -0.07 0.04 -0.06 0.00 -0.77 0.00 0.00 57.85 56.99 1xws n ARG 166 Cb 0.31 -3.63 0.05 0.00 -1.02 0.00 0.00 32.46 28.18 1xws n ARG 166 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1xws n ASP 167 N -0.08 0.92 -4.69 0.55 4.64 -1.26 -4.37 116.55 112.27 1xws n ASP 167 Ca 0.00 -2.49 -0.42 0.00 -1.38 0.00 0.00 54.79 50.50 1xws n ASP 167 Cb 0.04 -0.27 -0.03 0.00 -1.04 0.00 0.00 41.12 39.82 1xws n ASP 167 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1xws s ILE 168 N -2.73 3.76 0.13 5.18 1.01 -1.26 -4.79 121.20 122.49 1xws s ILE 168 Ca 0.25 1.13 -0.26 0.00 0.00 0.00 0.00 60.65 61.78 1xws s ILE 168 Cb 0.42 -3.73 0.07 0.00 0.01 0.00 0.00 42.46 39.23 1xws s ILE 168 CO -0.00 -0.00 0.98 -1.59 0.00 0.00 0.00 174.94 174.33 1xws s LYS 169 N 2.41 1.10 0.29 2.79 -2.85 -1.26 -4.86 119.74 117.36 1xws s LYS 169 Ca 0.63 -0.60 -0.00 0.00 -1.00 0.00 0.00 55.97 55.00 1xws s LYS 169 Cb -0.31 0.38 0.49 0.00 -2.06 0.00 0.00 37.83 36.34 1xws s LYS 169 CO 0.26 -0.50 1.89 0.38 0.10 0.00 0.00 175.35 177.48 1xws h ASP 170 N 2.00 0.96 0.65 0.03 3.04 -1.94 -1.44 116.42 119.72 1xws h ASP 170 Ca -0.24 0.01 -0.01 0.00 -3.24 0.00 0.00 57.03 53.55 1xws h ASP 170 Cb 1.23 -0.19 -0.00 0.00 -1.04 0.00 0.00 39.33 39.33 1xws h ASP 170 CO 0.26 0.60 -0.03 -0.33 -2.04 0.00 0.00 179.24 177.69 1xws h GLU 171 N 1.08 0.00 -0.61 4.15 5.08 -1.96 -2.79 114.58 119.53 1xws h GLU 171 Ca 0.42 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.63 1xws h GLU 171 Cb 0.24 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.40 1xws h GLU 171 CO -0.17 0.03 0.16 0.09 -1.00 0.00 0.00 179.01 178.12 1xws n ASN 172 N -3.18 4.57 -3.95 1.42 3.02 -0.54 -4.85 115.26 111.75 1xws n ASN 172 Ca -0.01 -3.21 -0.28 0.00 -0.03 0.00 0.00 54.58 51.05 1xws n ASN 172 Cb 0.24 -0.70 -0.17 0.00 -0.61 0.00 0.00 39.78 38.55 1xws n ASN 172 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1xws s ILE 173 N -2.97 1.19 -0.13 2.41 1.01 -1.08 -1.44 121.20 120.19 1xws s ILE 173 Ca 0.52 -0.40 -0.10 0.00 0.00 0.00 0.00 60.65 60.67 1xws s ILE 173 Cb 0.42 -1.17 -0.05 0.00 0.01 0.00 0.00 42.46 41.67 1xws s ILE 173 CO 0.12 0.39 0.20 -0.76 0.00 0.00 0.00 174.94 174.89 1xws s LEU 174 N 1.56 4.33 -0.25 2.97 1.43 0.07 -0.34 118.68 128.46 1xws s LEU 174 Ca 0.03 0.48 -0.10 0.00 -1.03 0.00 0.00 54.13 53.51 1xws s LEU 174 Cb -0.13 -2.19 -0.05 0.00 0.03 0.00 0.00 46.19 43.86 1xws s LEU 174 CO -0.08 0.29 0.15 -0.63 0.23 0.00 0.00 176.35 176.31 1xws s ILE 175 N -0.45 5.12 -0.76 -0.59 1.01 0.45 -0.77 121.20 125.21 1xws s ILE 175 Ca 0.15 0.10 -0.27 0.00 0.00 0.00 0.00 60.65 60.63 1xws s ILE 175 Cb -0.12 -3.40 0.03 0.00 0.01 0.00 0.00 42.46 38.97 1xws s ILE 175 CO 0.04 0.32 1.28 -0.62 0.00 0.00 0.00 174.94 175.96 1xws s ASP 176 N 1.37 6.18 0.59 3.58 3.68 0.53 -2.15 116.67 130.44 1xws s ASP 176 Ca 0.07 -0.52 0.35 0.00 2.13 0.00 0.00 52.55 54.57 1xws s ASP 176 Cb -0.15 -2.56 1.83 0.00 -1.45 0.00 0.00 42.92 40.60 1xws s ASP 176 CO 0.07 -1.81 2.19 -0.07 0.13 0.00 0.00 175.17 175.67 1xws h LEU 177 N 12.98 0.00 0.01 -1.34 3.38 -1.77 0.98 115.31 129.55 1xws h LEU 177 Ca -0.25 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.44 1xws h LEU 177 Cb 1.05 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 1xws h LEU 177 CO 1.29 0.04 -1.55 0.78 0.09 0.00 0.00 178.44 179.09 1xws h ASN 178 N 0.00 0.04 0.06 -0.43 2.35 -1.90 -3.38 115.58 112.31 1xws h ASN 178 Ca -0.00 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1xws h ASN 178 Cb 0.21 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1xws h ASN 178 CO 0.01 1.05 -1.67 0.54 -1.65 0.00 0.00 177.43 175.71 1xws n ARG 179 N -3.15 0.48 -1.46 0.81 1.74 -0.94 -4.91 116.66 109.23 1xws n ARG 179 Ca -0.14 -0.13 -0.09 0.00 -0.77 0.00 0.00 57.85 56.72 1xws n ARG 179 Cb 1.03 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.90 1xws n ARG 179 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xws n GLY 180 N 1.32 0.85 3.73 -0.13 0.00 0.30 -3.36 105.19 107.90 1xws n GLY 180 Ca -0.02 -0.59 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 1xws n GLY 180 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xws s GLU 181 N -3.14 3.72 -0.03 1.61 2.02 -1.18 -4.64 118.70 117.05 1xws s GLU 181 Ca 0.00 -0.26 -0.03 0.00 0.02 0.00 0.00 54.97 54.70 1xws s GLU 181 Cb 0.00 -3.19 -0.04 0.00 0.10 0.00 0.00 34.13 31.00 1xws s GLU 181 CO 0.00 0.49 0.15 -0.51 0.02 0.00 0.00 175.26 175.41 1xws s LEU 182 N -0.23 4.25 -0.02 1.80 1.02 -1.26 -0.35 118.68 123.89 1xws s LEU 182 Ca 0.09 0.32 0.00 0.00 0.02 0.00 0.00 54.13 54.56 1xws s LEU 182 Cb -0.12 -2.43 0.03 0.00 0.02 0.00 0.00 46.19 43.69 1xws s LEU 182 CO 0.01 0.29 0.02 -0.54 0.02 0.00 0.00 176.35 176.15 1xws s LYS 183 N -1.72 0.10 0.15 1.70 -0.14 0.05 -4.61 119.74 115.27 1xws s LYS 183 Ca 0.24 0.13 -0.30 0.00 -1.36 0.00 0.00 55.97 54.68 1xws s LYS 183 Cb -0.12 -0.33 -0.07 0.00 -1.68 0.00 0.00 37.83 35.63 1xws s LYS 183 CO 0.15 -0.14 1.00 -1.17 -0.76 0.00 0.00 175.35 174.42 1xws s LEU 184 N 0.98 4.52 0.27 3.17 2.96 0.26 -0.75 118.68 130.09 1xws s LEU 184 Ca -0.09 1.90 0.04 0.00 -0.22 0.00 0.00 54.13 55.76 1xws s LEU 184 Cb -0.12 -3.60 -0.06 0.00 0.50 0.00 0.00 46.19 42.91 1xws s LEU 184 CO -0.02 -0.08 0.01 0.27 -1.32 0.00 0.00 176.35 175.21 1xws s ILE 185 N -0.23 1.16 -0.29 6.68 -4.36 -0.52 -1.65 121.20 121.98 1xws s ILE 185 Ca 0.47 -2.04 -0.10 0.00 -0.26 0.00 0.00 60.65 58.72 1xws s ILE 185 Cb -0.25 -2.51 0.01 0.00 1.25 0.00 0.00 42.46 40.96 1xws s ILE 185 CO 0.32 -0.21 0.37 -0.67 0.24 0.00 0.00 174.94 174.98 1xws n ASP 186 N -0.53 -6.13 -0.79 4.36 -0.08 -1.26 -4.81 116.55 107.31 1xws n ASP 186 Ca -0.04 0.44 0.05 0.00 -1.51 0.00 0.00 54.79 53.73 1xws n ASP 186 Cb 0.65 -4.04 0.16 0.00 2.34 0.00 0.00 41.12 40.22 1xws n ASP 186 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1xws n PHE 187 N -0.26 0.62 0.26 -0.67 3.72 -1.26 -4.40 117.46 115.46 1xws n PHE 187 Ca 0.07 -0.26 0.12 0.00 -0.05 0.00 0.00 57.45 57.34 1xws n PHE 187 Cb 0.28 -0.10 0.59 0.00 -0.94 0.00 0.00 39.48 39.31 1xws n PHE 187 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1xws h GLY 188 N 5.03 0.00 -1.25 1.37 0.00 -1.91 -1.64 103.07 104.67 1xws h GLY 188 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1xws h GLY 188 CO 0.08 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.06 1xws n SER 189 N -2.32 2.52 -4.44 0.19 7.64 -1.26 -4.89 113.62 111.05 1xws n SER 189 Ca -0.00 -1.74 -0.29 0.00 1.01 0.00 0.00 58.87 57.85 1xws n SER 189 Cb 0.11 -0.11 0.16 0.00 -1.01 0.00 0.00 64.21 63.36 1xws n SER 189 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1xws s GLY 190 N -1.06 1.64 0.15 0.23 0.00 -0.62 -4.68 107.32 102.98 1xws s GLY 190 Ca 0.20 -0.83 -0.08 0.00 0.00 0.00 0.00 44.72 44.01 1xws s GLY 190 CO 0.17 -0.16 0.25 0.00 0.00 0.00 0.00 173.10 173.36 1xws s ALA 191 N -3.48 0.03 0.32 3.20 0.00 0.16 -4.99 121.76 117.00 1xws s ALA 191 Ca 0.68 -0.88 -0.29 0.00 0.00 0.00 0.00 51.96 51.46 1xws s ALA 191 Cb -0.10 0.79 -0.11 0.00 0.00 0.00 0.00 23.12 23.70 1xws s ALA 191 CO 0.53 -0.61 1.51 -0.51 0.00 0.00 0.00 175.76 176.69 1xws s LEU 192 N -2.95 4.35 0.14 0.00 1.43 -1.26 -0.71 118.68 119.67 1xws s LEU 192 Ca 0.15 2.94 -0.30 0.00 -1.03 0.00 0.00 54.13 55.88 1xws s LEU 192 Cb 0.04 -3.65 -0.07 0.00 0.03 0.00 0.00 46.19 42.54 1xws s LEU 192 CO -0.02 -0.85 1.25 -0.22 0.23 0.00 0.00 176.35 176.75 1xws s LEU 193 N -1.18 4.41 0.19 1.79 2.96 0.20 -4.68 118.68 122.38 1xws s LEU 193 Ca 0.58 2.22 -0.01 0.00 -0.22 0.00 0.00 54.13 56.70 1xws s LEU 193 Cb -0.46 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.59 1xws s LEU 193 CO 0.53 -0.48 0.11 -1.59 -1.32 0.00 0.00 176.35 173.61 1xws s LYS 194 N 0.40 1.17 0.00 1.98 -2.85 -1.26 -4.91 119.74 114.28 1xws s LYS 194 Ca 0.57 -1.61 0.21 0.00 -1.00 0.00 0.00 55.97 54.14 1xws s LYS 194 Cb -0.33 0.20 -0.04 0.00 -2.06 0.00 0.00 37.83 35.60 1xws s LYS 194 CO 0.34 -0.35 1.00 -0.25 0.10 0.00 0.00 175.35 176.18 1xws n ASP 195 N -0.26 1.79 -4.91 0.03 10.43 -1.26 -4.56 116.55 117.81 1xws n ASP 195 Ca 0.00 -1.40 -0.21 0.00 2.57 0.00 0.00 54.79 55.76 1xws n ASP 195 Cb 0.66 0.54 0.05 0.00 1.84 0.00 0.00 41.12 44.21 1xws n ASP 195 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 1xws s THR 196 N -2.38 2.51 0.44 -3.53 -4.23 -1.26 -4.98 115.64 102.22 1xws s THR 196 Ca 0.16 -0.76 -0.22 0.00 -1.18 0.00 0.00 61.69 59.68 1xws s THR 196 Cb 0.16 -2.75 -0.08 0.00 1.34 0.00 0.00 72.50 71.17 1xws s THR 196 CO 0.56 0.00 1.08 0.54 -0.54 0.00 0.00 174.62 176.26 1xws s VAL 197 N -2.77 3.57 -0.12 2.29 0.11 -1.26 -4.71 120.40 117.50 1xws s VAL 197 Ca 0.60 1.12 -0.06 0.00 -2.93 0.00 0.00 61.98 60.71 1xws s VAL 197 Cb -0.08 -3.54 -0.04 0.00 -1.53 0.00 0.00 36.38 31.19 1xws s VAL 197 CO 0.39 -0.07 0.11 -0.31 -3.33 0.00 0.00 175.10 171.89 1xws s TYR 198 N -1.73 3.49 0.00 1.54 1.51 0.12 -4.97 117.35 117.32 1xws s TYR 198 Ca 0.63 0.43 0.00 0.00 -1.01 0.00 0.00 57.07 57.12 1xws s TYR 198 Cb -0.22 -1.94 0.00 0.00 -0.11 0.00 0.00 41.96 39.69 1xws s TYR 198 CO 0.27 0.63 0.55 0.25 -1.11 0.00 0.00 175.55 176.14 1xws n THR 199 N 2.20 0.20 -4.67 -0.71 -2.24 -1.26 -1.72 114.28 106.09 1xws n THR 199 Ca -0.19 -0.53 -0.27 0.00 -2.27 0.00 0.00 64.05 60.78 1xws n THR 199 Cb 0.54 1.00 -0.14 0.00 -2.10 0.00 0.00 70.33 69.64 1xws n THR 199 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1xws s ASP 200 N -0.20 2.75 -0.26 3.42 -4.77 -1.26 -4.86 116.67 111.49 1xws s ASP 200 Ca 0.00 -0.58 -0.12 0.00 -3.30 0.00 0.00 52.55 48.55 1xws s ASP 200 Cb 0.00 -0.22 0.09 0.00 -1.09 0.00 0.00 42.92 41.70 1xws s ASP 200 CO 0.00 0.18 0.60 0.12 0.70 0.00 0.00 175.17 176.77 1xws s PHE 201 N -0.86 -1.04 -0.02 2.11 5.36 -1.26 -5.03 117.98 117.24 1xws s PHE 201 Ca 0.09 1.98 0.16 0.00 -0.96 0.00 0.00 56.93 58.20 1xws s PHE 201 Cb -0.09 0.59 0.29 0.00 -0.34 0.00 0.00 43.02 43.46 1xws s PHE 201 CO 0.02 -0.53 1.12 -3.47 -1.46 0.00 0.00 175.22 170.90 1xws n ASP 202 N 4.76 0.80 -2.85 6.13 4.64 -1.26 -5.06 116.55 123.71 1xws n ASP 202 Ca -0.17 -2.21 0.00 0.00 -1.38 0.00 0.00 54.79 51.03 1xws n ASP 202 Cb 0.54 -0.29 0.00 0.00 -1.04 0.00 0.00 41.12 40.33 1xws n ASP 202 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1xws n GLY 203 N 0.12 -1.17 3.69 0.27 0.00 -1.26 -4.91 105.19 101.92 1xws n GLY 203 Ca 0.06 -1.59 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 1xws n GLY 203 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xws s THR 204 N -0.27 4.76 0.23 2.61 2.01 -1.26 -4.99 115.64 118.73 1xws s THR 204 Ca 0.00 2.03 -0.06 0.00 0.31 0.00 0.00 61.69 63.97 1xws s THR 204 Cb 0.00 -4.30 0.19 0.00 0.01 0.00 0.00 72.50 68.39 1xws s THR 204 CO 0.00 -0.00 1.79 -0.09 -0.69 0.00 0.00 174.62 175.63 1xws h ARG 205 N 7.13 0.67 0.00 4.92 2.43 -1.96 -2.40 114.38 125.16 1xws h ARG 205 Ca -0.31 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 1xws h ARG 205 Cb 1.14 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.54 1xws h ARG 205 CO 0.86 0.44 0.00 1.33 -1.51 0.00 0.00 179.97 181.09 1xws n VAL 206 N -4.81 0.57 0.57 0.20 0.24 -1.26 -1.15 118.33 112.69 1xws n VAL 206 Ca 0.12 0.08 0.11 0.00 -2.04 0.00 0.00 64.34 62.61 1xws n VAL 206 Cb 0.26 -0.79 0.15 0.00 -1.47 0.00 0.00 33.84 32.00 1xws n VAL 206 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1xws n TYR 207 N -1.73 0.26 -3.35 6.34 4.02 -0.92 -4.87 117.16 116.91 1xws n TYR 207 Ca 0.05 -0.14 -0.36 0.00 -0.01 0.00 0.00 57.90 57.44 1xws n TYR 207 Cb 0.28 -0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.54 1xws n TYR 207 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1xws s SER 208 N -1.63 6.87 0.62 7.72 1.04 -0.30 -4.07 113.70 123.96 1xws s SER 208 Ca 0.32 1.11 -0.10 0.00 0.48 0.00 0.00 55.95 57.76 1xws s SER 208 Cb 0.20 -2.30 -0.02 0.00 0.10 0.00 0.00 66.02 64.01 1xws s SER 208 CO 0.29 0.15 1.00 -2.16 0.98 0.00 0.00 173.24 173.50 1xws s PRO 209 N -1.74 3.29 0.52 4.02 0.04 -1.26 -4.89 135.00 134.97 1xws s PRO 209 Ca 0.35 0.49 0.18 0.00 0.04 0.00 0.00 61.00 62.05 1xws s PRO 209 Cb -0.16 -2.13 1.31 0.00 0.04 0.00 0.00 34.50 33.56 1xws s PRO 209 CO 0.19 -0.67 2.14 -1.00 0.04 0.00 0.00 177.00 177.70 1xws h PRO 210 N -0.32 0.00 0.00 0.56 0.13 -1.88 -1.40 132.00 129.09 1xws h PRO 210 Ca -0.45 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.58 1xws h PRO 210 Cb 1.22 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 1xws h PRO 210 CO 0.62 0.02 -0.50 1.05 -0.23 0.00 0.00 178.00 178.96 1xws h GLU 211 N 0.00 0.00 -0.04 0.86 9.09 -1.86 0.19 114.58 122.82 1xws h GLU 211 Ca -0.00 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 59.37 1xws h GLU 211 Cb 0.04 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.15 1xws h GLU 211 CO 0.00 0.50 -0.12 2.35 0.05 0.00 0.00 179.01 181.79 1xws h TRP 212 N 0.00 0.20 -0.22 2.06 2.91 -1.31 -0.87 115.95 118.72 1xws h TRP 212 Ca -0.01 -0.08 0.05 0.00 1.13 0.00 0.00 58.89 59.99 1xws h TRP 212 Cb 0.99 -0.03 -0.06 0.00 -0.51 0.00 0.00 29.16 29.55 1xws h TRP 212 CO 0.00 0.74 -0.13 0.82 -1.03 0.00 0.00 178.44 178.84 1xws h ILE 213 N -0.40 0.60 -0.07 2.65 1.08 -1.23 0.23 117.51 120.37 1xws h ILE 213 Ca -0.00 0.00 -0.22 0.00 -0.39 0.00 0.00 64.86 64.24 1xws h ILE 213 Cb 0.75 0.60 0.01 0.00 -3.07 0.00 0.00 36.82 35.11 1xws h ILE 213 CO 0.03 0.00 -0.83 0.03 -0.69 0.00 0.00 178.15 176.68 1xws h ARG 214 N -0.12 0.69 0.00 2.37 3.08 -0.68 -3.40 114.38 116.32 1xws h ARG 214 Ca 0.12 -0.65 0.00 0.00 0.07 0.00 0.00 59.98 59.53 1xws h ARG 214 Cb 0.31 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.52 1xws h ARG 214 CO -0.29 1.25 0.00 0.66 -1.07 0.00 0.00 179.97 180.51 1xws n TYR 215 N -3.97 0.00 -3.72 3.04 4.02 -0.35 -5.01 117.16 111.16 1xws n TYR 215 Ca -0.09 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.52 1xws n TYR 215 Cb 0.78 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 40.14 1xws n TYR 215 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 1xws n HIS 216 N -0.70 -2.43 -3.74 -0.72 8.25 0.79 -4.98 115.22 111.69 1xws n HIS 216 Ca 0.00 0.89 -0.13 0.00 -0.26 0.00 0.00 57.72 58.22 1xws n HIS 216 Cb 0.01 -4.27 -0.13 0.00 1.12 0.00 0.00 29.99 26.72 1xws n HIS 216 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1xws s ARG 217 N -6.43 0.20 0.14 -0.41 0.52 -1.21 -4.44 118.95 107.31 1xws s ARG 217 Ca 0.60 0.47 -0.12 0.00 -0.52 0.00 0.00 55.73 56.17 1xws s ARG 217 Cb -0.29 -0.09 0.01 0.00 0.52 0.00 0.00 34.95 35.10 1xws s ARG 217 CO 0.75 -0.14 0.31 1.52 0.02 0.00 0.00 175.30 177.76 1xws s TYR 218 N 1.06 0.11 0.10 -0.53 1.13 -0.70 -3.52 117.35 115.01 1xws s TYR 218 Ca -0.08 -0.48 0.06 0.00 -1.41 0.00 0.00 57.07 55.16 1xws s TYR 218 Cb -0.09 0.08 -0.04 0.00 -1.10 0.00 0.00 41.96 40.81 1xws s TYR 218 CO -0.07 -0.69 -0.04 -1.01 -2.51 0.00 0.00 175.55 171.24 1xws s HIS 219 N -3.88 2.88 0.03 -3.49 3.76 -1.26 0.13 115.29 113.46 1xws s HIS 219 Ca 0.09 -0.09 -0.25 0.00 -0.15 0.00 0.00 55.06 54.66 1xws s HIS 219 Cb 0.03 -1.48 -0.18 0.00 1.11 0.00 0.00 32.58 32.06 1xws s HIS 219 CO -0.07 0.46 1.48 0.78 -0.85 0.00 0.00 174.74 176.55 1xws h GLY 220 N 3.44 -0.08 0.78 -2.22 0.00 -1.84 -1.90 103.07 101.24 1xws h GLY 220 Ca -0.48 0.03 -0.06 0.00 0.00 0.00 0.00 47.33 46.82 1xws h GLY 220 CO 0.57 -0.03 -0.11 3.21 0.00 0.00 0.00 176.54 180.17 1xws h ARG 221 N -0.32 0.39 -0.30 4.80 3.08 -1.97 -1.13 114.38 118.93 1xws h ARG 221 Ca -0.01 -0.18 -0.07 0.00 0.07 0.00 0.00 59.98 59.79 1xws h ARG 221 Cb 0.28 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 1xws h ARG 221 CO 0.01 0.71 -0.11 0.66 -1.07 0.00 0.00 179.97 180.17 1xws h SER 222 N 0.06 0.49 -0.71 7.04 4.64 -1.91 -1.24 113.55 121.92 1xws h SER 222 Ca 0.04 -0.12 -0.06 0.00 -0.47 0.00 0.00 61.79 61.17 1xws h SER 222 Cb 0.61 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.54 1xws h SER 222 CO 0.03 0.64 0.20 0.00 -0.87 0.00 0.00 176.83 176.83 1xws h ALA 223 N 1.41 0.99 -0.88 5.18 0.00 -1.26 -1.92 119.26 122.77 1xws h ALA 223 Ca 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1xws h ALA 223 Cb 0.48 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1xws h ALA 223 CO 0.03 0.66 0.53 0.00 0.00 0.00 0.00 179.25 180.47 1xws h ALA 224 N 1.13 1.13 -0.49 0.00 0.00 -0.72 -1.93 119.26 118.37 1xws h ALA 224 Ca 0.23 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 1xws h ALA 224 Cb 0.34 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1xws h ALA 224 CO -0.00 0.59 -0.19 0.28 0.00 0.00 0.00 179.25 179.92 1xws h VAL 225 N 1.22 1.27 -0.05 0.00 2.07 -1.08 -1.08 116.25 118.59 1xws h VAL 225 Ca 0.32 -1.36 0.03 0.00 0.82 0.00 0.00 66.70 66.52 1xws h VAL 225 Cb -0.05 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 1xws h VAL 225 CO -0.06 0.47 -0.19 -0.25 0.02 0.00 0.00 177.57 177.56 1xws h TRP 226 N 0.86 -0.49 0.00 1.57 2.91 -1.15 -0.13 115.95 119.52 1xws h TRP 226 Ca 0.12 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.15 1xws h TRP 226 Cb 0.77 0.23 -0.00 0.00 -0.51 0.00 0.00 29.16 29.64 1xws h TRP 226 CO 0.05 -0.27 -0.03 0.66 -1.03 0.00 0.00 178.44 177.82 1xws h SER 227 N -0.28 0.00 0.52 2.65 4.64 -0.89 -1.22 113.55 118.98 1xws h SER 227 Ca 0.07 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.20 1xws h SER 227 Cb 0.38 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 1xws h SER 227 CO -0.21 0.03 -0.87 -0.07 -0.87 0.00 0.00 176.83 174.84 1xws h LEU 228 N 0.00 0.31 -0.42 5.97 3.38 -0.57 -0.78 115.31 123.19 1xws h LEU 228 Ca -0.00 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1xws h LEU 228 Cb 0.05 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1xws h LEU 228 CO 0.00 1.03 0.24 1.23 0.09 0.00 0.00 178.44 181.04 1xws h GLY 229 N 1.71 0.63 0.73 0.83 0.00 0.11 0.11 103.07 107.19 1xws h GLY 229 Ca -0.05 -0.27 0.04 0.00 0.00 0.00 0.00 47.33 47.05 1xws h GLY 229 CO 0.14 0.26 0.16 -2.22 0.00 0.00 0.00 176.54 174.88 1xws h ILE 230 N 0.56 0.93 -0.14 2.60 1.08 -1.23 -1.37 117.51 119.93 1xws h ILE 230 Ca 0.15 -0.11 -0.00 0.00 -0.39 0.00 0.00 64.86 64.50 1xws h ILE 230 Cb 0.03 0.57 -0.01 0.00 -3.07 0.00 0.00 36.82 34.35 1xws h ILE 230 CO -0.03 0.06 0.07 0.25 -0.69 0.00 0.00 178.15 177.82 1xws h LEU 231 N 0.33 0.18 -0.24 1.44 5.85 -0.87 0.27 115.31 122.26 1xws h LEU 231 Ca 0.17 -0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.81 1xws h LEU 231 Cb 0.12 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1xws h LEU 231 CO -0.15 0.23 0.08 0.25 -0.34 0.00 0.00 178.44 178.51 1xws h LEU 232 N 0.12 0.09 -0.52 2.25 5.85 -0.66 -0.71 115.31 121.72 1xws h LEU 232 Ca 0.05 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.88 1xws h LEU 232 Cb 0.10 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.07 1xws h LEU 232 CO -0.01 0.08 0.13 0.22 -0.34 0.00 0.00 178.44 178.52 1xws h TYR 233 N 0.19 0.21 -0.82 1.25 5.03 -1.12 -2.04 116.97 119.66 1xws h TYR 233 Ca 0.11 0.03 0.05 0.00 2.58 0.00 0.00 58.73 61.50 1xws h TYR 233 Cb 0.08 -0.01 -0.06 0.00 1.55 0.00 0.00 36.73 38.28 1xws h TYR 233 CO -0.13 0.02 0.51 0.22 -1.32 0.00 0.00 178.16 177.46 1xws h ASP 234 N 0.27 0.81 -0.25 -2.11 3.58 -0.46 0.12 116.42 118.38 1xws h ASP 234 Ca 0.26 0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.72 1xws h ASP 234 Cb 0.34 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 1xws h ASP 234 CO -0.32 0.53 0.14 0.24 -2.88 0.00 0.00 179.24 176.95 1xws h MET 235 N 0.95 0.35 0.00 0.28 2.86 -0.48 0.19 114.93 119.08 1xws h MET 235 Ca 0.35 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.95 1xws h MET 235 Cb 0.12 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.71 1xws h MET 235 CO -0.15 0.31 -0.70 -0.39 1.06 0.00 0.00 176.91 177.04 1xws h VAL 236 N 0.29 0.00 0.00 -2.22 -1.51 -0.89 0.89 116.25 112.81 1xws h VAL 236 Ca 0.09 -0.65 0.00 0.00 -1.23 0.00 0.00 66.70 64.90 1xws h VAL 236 Cb 0.06 1.23 0.00 0.00 -2.13 0.00 0.00 31.29 30.46 1xws h VAL 236 CO -0.01 0.00 -1.58 0.00 -1.23 0.00 0.00 177.57 174.74 1xws n GLY 238 N 1.65 0.63 3.62 0.00 0.00 0.65 -4.56 105.19 107.18 1xws n GLY 238 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.93 1xws n GLY 238 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xws s ASP 239 N -2.13 -0.29 0.48 1.61 -1.08 -1.20 -4.83 116.67 109.22 1xws s ASP 239 Ca 0.00 -0.21 -0.17 0.00 -0.52 0.00 0.00 52.55 51.65 1xws s ASP 239 Cb 0.00 0.46 -0.09 0.00 -1.46 0.00 0.00 42.92 41.84 1xws s ASP 239 CO 0.00 -0.81 0.95 0.27 0.52 0.00 0.00 175.17 176.10 1xws s ILE 240 N -3.28 4.52 -0.15 4.11 -4.36 -1.26 -3.72 121.20 117.06 1xws s ILE 240 Ca 0.08 1.23 0.19 0.00 -0.26 0.00 0.00 60.65 61.90 1xws s ILE 240 Cb -0.01 -3.68 0.17 0.00 1.25 0.00 0.00 42.46 40.18 1xws s ILE 240 CO -0.04 -0.56 1.58 1.55 0.24 0.00 0.00 174.94 177.72 1xws h PRO 241 N 1.26 0.00 -4.60 0.37 0.13 -1.93 -3.46 132.00 123.78 1xws h PRO 241 Ca -0.47 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.15 1xws h PRO 241 Cb 1.18 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 31.98 1xws h PRO 241 CO 0.62 0.32 -0.81 -0.06 -0.23 0.00 0.00 178.00 177.83 1xws s PHE 242 N -3.19 1.38 -0.25 1.56 2.99 -1.26 -4.88 117.98 114.34 1xws s PHE 242 Ca 0.04 -0.47 -0.05 0.00 0.00 0.00 0.00 56.93 56.44 1xws s PHE 242 Cb 0.08 -1.00 -0.16 0.00 0.00 0.00 0.00 43.02 41.93 1xws s PHE 242 CO 0.70 -0.24 -0.18 -0.85 -0.00 0.00 0.00 175.22 174.65 1xws n GLU 243 N 3.69 0.64 -4.10 0.44 0.00 -1.26 -4.92 120.64 115.12 1xws n GLU 243 Ca -0.22 0.22 -0.24 0.00 0.00 0.00 0.00 57.16 56.92 1xws n GLU 243 Cb 0.52 -1.54 -0.05 0.00 0.00 0.00 0.00 31.44 30.37 1xws n GLU 243 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 1xws s HIS 244 N -2.51 3.12 0.27 -1.84 3.76 -1.26 -4.94 115.29 111.89 1xws s HIS 244 Ca -0.35 -0.07 0.00 0.00 -0.15 0.00 0.00 55.06 54.50 1xws s HIS 244 Cb 0.10 -1.45 0.63 0.00 1.11 0.00 0.00 32.58 32.98 1xws s HIS 244 CO 0.58 0.52 1.68 -0.44 -0.85 0.00 0.00 174.74 176.24 1xws h ASP 245 N 1.96 0.16 -0.07 1.40 3.45 -1.98 -1.62 116.42 119.72 1xws h ASP 245 Ca -0.48 0.16 -0.08 0.00 0.43 0.00 0.00 57.03 57.05 1xws h ASP 245 Cb 1.22 0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 40.15 1xws h ASP 245 CO 0.62 -0.04 -0.20 -0.33 -1.57 0.00 0.00 179.24 177.72 1xws h GLU 246 N 0.33 0.46 -0.15 3.56 3.07 -1.98 -1.29 114.58 118.58 1xws h GLU 246 Ca 0.51 -0.16 -0.13 0.00 -0.50 0.00 0.00 59.36 59.08 1xws h GLU 246 Cb 0.94 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.82 1xws h GLU 246 CO -0.54 0.65 -0.43 0.93 -1.40 0.00 0.00 179.01 178.21 1xws h GLU 247 N 0.42 0.56 -0.49 2.33 5.08 -1.74 -1.56 114.58 119.18 1xws h GLU 247 Ca 0.07 -0.40 0.10 0.00 -1.00 0.00 0.00 59.36 58.13 1xws h GLU 247 Cb 0.59 0.06 -0.10 0.00 0.50 0.00 0.00 28.75 29.80 1xws h GLU 247 CO 0.04 1.02 -0.21 0.82 -1.00 0.00 0.00 179.01 179.68 1xws h ILE 248 N 0.20 0.36 0.00 3.13 2.04 -0.99 -0.34 117.51 121.91 1xws h ILE 248 Ca -0.01 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 1xws h ILE 248 Cb 1.05 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1xws h ILE 248 CO 0.09 0.00 -0.20 0.16 0.00 0.00 0.00 178.15 178.20 1xws h ILE 249 N -0.10 0.37 -0.01 -0.67 3.07 -1.29 -3.00 117.51 115.88 1xws h ILE 249 Ca 0.23 -1.39 -0.18 0.00 1.55 0.00 0.00 64.86 65.08 1xws h ILE 249 Cb 0.46 2.07 -0.02 0.00 -0.27 0.00 0.00 36.82 39.07 1xws h ILE 249 CO -0.56 0.20 -0.80 0.08 -1.05 0.00 0.00 178.15 176.02 1xws h ARG 250 N 0.00 0.12 -0.80 0.16 0.11 -0.91 -3.47 114.38 109.59 1xws h ARG 250 Ca -0.00 -0.12 -0.34 0.00 0.10 0.00 0.00 59.98 59.61 1xws h ARG 250 Cb 1.06 0.03 -0.14 0.00 1.11 0.00 0.00 29.97 32.03 1xws h ARG 250 CO 0.03 0.85 -0.31 0.41 0.10 0.00 0.00 179.97 181.05 1xws n GLY 251 N 0.72 1.60 3.68 0.08 0.00 -0.17 -4.95 105.19 106.14 1xws n GLY 251 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1xws n GLY 251 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xws s GLN 252 N -3.42 4.27 -0.32 1.61 -0.21 -1.26 -4.96 119.66 115.37 1xws s GLN 252 Ca 0.00 1.86 -0.10 0.00 0.02 0.00 0.00 55.36 57.14 1xws s GLN 252 Cb 0.00 -3.67 -0.01 0.00 1.00 0.00 0.00 33.01 30.34 1xws s GLN 252 CO 0.00 -0.61 0.16 0.08 -2.12 0.00 0.00 175.29 172.80 1xws s VAL 253 N 2.82 4.66 -0.12 1.09 1.01 -1.26 -5.02 120.40 123.57 1xws s VAL 253 Ca 0.61 -0.43 -0.03 0.00 0.00 0.00 0.00 61.98 62.13 1xws s VAL 253 Cb -0.28 -3.39 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 1xws s VAL 253 CO 0.23 0.05 -0.00 -0.36 0.00 0.00 0.00 175.10 175.01 1xws s PHE 254 N 1.62 3.12 -0.09 5.22 0.08 -1.26 -5.10 117.98 121.57 1xws s PHE 254 Ca 0.05 0.02 -0.17 0.00 0.12 0.00 0.00 56.93 56.94 1xws s PHE 254 Cb -0.17 -1.88 -0.05 0.00 -0.57 0.00 0.00 43.02 40.35 1xws s PHE 254 CO 0.07 0.26 0.44 -0.06 -0.10 0.00 0.00 175.22 175.83 1xws s PHE 255 N -0.30 3.57 -0.95 0.36 0.08 -1.26 -4.98 117.98 114.50 1xws s PHE 255 Ca 0.06 0.90 0.23 0.00 0.12 0.00 0.00 56.93 58.24 1xws s PHE 255 Cb -0.12 -2.46 0.04 0.00 -0.57 0.00 0.00 43.02 39.90 1xws s PHE 255 CO 0.02 0.31 1.07 2.89 -0.10 0.00 0.00 175.22 179.41 1xws n ARG 256 N 3.13 0.03 -4.34 0.44 1.85 -1.26 -4.97 116.66 111.54 1xws n ARG 256 Ca -0.09 -0.00 -0.18 0.00 -1.00 0.00 0.00 57.85 56.57 1xws n ARG 256 Cb 0.52 -1.51 -0.10 0.00 -1.05 0.00 0.00 32.46 30.32 1xws n ARG 256 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1xws s GLN 257 N -3.02 1.32 -0.00 2.89 -1.52 -1.26 -5.10 119.66 112.96 1xws s GLN 257 Ca 0.08 -1.59 -0.30 0.00 -1.95 0.00 0.00 55.36 51.60 1xws s GLN 257 Cb 0.16 -1.05 -0.07 0.00 -0.22 0.00 0.00 33.01 31.83 1xws s GLN 257 CO 0.81 0.15 1.81 0.50 -0.25 0.00 0.00 175.29 178.31 1xws s ARG 258 N -3.67 4.16 -0.01 2.91 6.06 -1.26 -4.98 118.95 122.15 1xws s ARG 258 Ca 0.23 2.41 0.02 0.00 -2.50 0.00 0.00 55.73 55.88 1xws s ARG 258 Cb 0.00 -4.05 0.00 0.00 0.06 0.00 0.00 34.95 30.97 1xws s ARG 258 CO 0.07 -0.89 -0.06 0.08 -2.50 0.00 0.00 175.30 172.00 1xws s VAL 259 N 4.16 0.48 0.79 7.11 1.01 -1.26 -5.03 120.40 127.66 1xws s VAL 259 Ca 0.81 -0.22 -0.13 0.00 0.00 0.00 0.00 61.98 62.44 1xws s VAL 259 Cb -0.38 -0.44 0.07 0.00 0.00 0.00 0.00 36.38 35.63 1xws s VAL 259 CO 0.36 0.16 1.19 -0.94 0.00 0.00 0.00 175.10 175.87 1xws s SER 260 N 0.13 3.81 0.45 3.32 1.04 -1.26 -4.76 113.70 116.43 1xws s SER 260 Ca -0.01 2.31 0.16 0.00 0.48 0.00 0.00 55.95 58.89 1xws s SER 260 Cb -0.06 -2.58 1.05 0.00 0.10 0.00 0.00 66.02 64.53 1xws s SER 260 CO -0.00 -2.52 1.99 0.77 0.98 0.00 0.00 173.24 174.46 1xws h SER 261 N -0.77 0.00 -0.15 7.02 4.64 -2.01 -1.59 113.55 120.70 1xws h SER 261 Ca -0.46 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.80 1xws h SER 261 Cb 1.29 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1xws h SER 261 CO 0.47 0.19 -0.14 -0.33 -0.87 0.00 0.00 176.83 176.15 1xws h GLU 262 N 0.00 0.36 -0.22 4.77 4.39 -1.99 -1.54 114.58 120.34 1xws h GLU 262 Ca -0.00 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 1xws h GLU 262 Cb 0.36 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 1xws h GLU 262 CO 0.02 0.74 0.12 0.00 -1.16 0.00 0.00 179.01 178.73 1xws h GLN 264 N 0.24 0.22 -0.41 0.00 4.20 -1.30 -0.48 115.11 117.58 1xws h GLN 264 Ca 0.08 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 1xws h GLN 264 Cb 0.09 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 1xws h GLN 264 CO -0.01 0.15 0.18 1.25 -0.67 0.00 0.00 178.83 179.73 1xws h HIS 265 N 0.23 0.61 -0.63 2.96 2.76 -0.92 -0.14 115.15 120.02 1xws h HIS 265 Ca 0.42 -0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.51 1xws h HIS 265 Cb 0.74 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 29.48 1xws h HIS 265 CO -0.29 0.52 0.21 1.25 -1.30 0.00 0.00 177.93 178.32 1xws h LEU 266 N 0.52 0.90 -0.06 0.26 5.85 -0.75 -1.67 115.31 120.36 1xws h LEU 266 Ca 0.14 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 1xws h LEU 266 Cb 0.15 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 40.95 1xws h LEU 266 CO -0.01 0.86 0.02 0.40 -0.34 0.00 0.00 178.44 179.36 1xws h ILE 267 N 0.89 1.16 -0.36 4.05 2.04 -0.76 -0.96 117.51 123.57 1xws h ILE 267 Ca 0.20 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 1xws h ILE 267 Cb 0.27 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 1xws h ILE 267 CO -0.01 0.14 0.21 0.03 0.00 0.00 0.00 178.15 178.52 1xws h ARG 268 N -0.08 0.49 -0.04 2.37 3.08 -0.93 -0.88 114.38 118.39 1xws h ARG 268 Ca 0.02 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1xws h ARG 268 Cb 0.20 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 1xws h ARG 268 CO -0.00 0.35 -0.01 2.35 -1.07 0.00 0.00 179.97 181.59 1xws h TRP 269 N 0.50 0.09 -0.44 3.04 7.01 -0.92 -2.70 115.95 122.53 1xws h TRP 269 Ca 0.13 -0.02 0.06 0.00 2.11 0.00 0.00 58.89 61.17 1xws h TRP 269 Cb -0.01 -0.02 -0.02 0.00 -2.10 0.00 0.00 29.16 27.00 1xws h TRP 269 CO 0.00 0.43 0.30 0.00 -2.79 0.00 0.00 178.44 176.38 1xws n LEU 271 N -4.48 5.28 -4.72 0.00 4.77 -0.36 -3.76 117.00 113.74 1xws n LEU 271 Ca 0.06 -2.73 -0.43 0.00 -0.03 0.00 0.00 56.01 52.88 1xws n LEU 271 Cb 0.24 -0.70 -0.02 0.00 -2.33 0.00 0.00 43.42 40.62 1xws n LEU 271 CO 0.35 0.69 1.17 0.00 -1.33 0.00 0.00 177.39 178.27 1xws n ALA 272 N 0.07 2.07 -0.16 -1.18 0.00 -0.86 -4.91 120.51 115.53 1xws n ALA 272 Ca 0.31 0.39 -0.07 0.00 0.00 0.00 0.00 53.44 54.07 1xws n ALA 272 Cb 1.17 -2.40 0.01 0.00 0.00 0.00 0.00 19.45 18.23 1xws n ALA 272 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1xws h LEU 273 N 4.74 0.56 -9.03 0.00 3.38 -1.92 -3.40 115.31 109.64 1xws h LEU 273 Ca -0.46 -0.04 -0.57 0.00 0.09 0.00 0.00 57.88 56.90 1xws h LEU 273 Cb 1.24 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.79 1xws h LEU 273 CO 0.79 0.44 0.87 -0.13 0.09 0.00 0.00 178.44 180.50 1xws s ARG 274 N -6.05 4.13 0.32 1.13 0.52 -1.26 -4.77 118.95 112.96 1xws s ARG 274 Ca -0.13 1.33 0.08 0.00 -0.52 0.00 0.00 55.73 56.49 1xws s ARG 274 Cb 0.12 -3.75 0.80 0.00 0.52 0.00 0.00 34.95 32.64 1xws s ARG 274 CO 0.74 -0.83 1.77 -1.35 0.02 0.00 0.00 175.30 175.65 1xws h PRO 275 N 8.21 0.68 0.00 3.54 0.11 -1.96 -0.03 132.00 142.54 1xws h PRO 275 Ca -0.23 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1xws h PRO 275 Cb 1.08 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1xws h PRO 275 CO 1.00 0.45 0.00 -1.13 -0.21 0.00 0.00 178.00 178.11 1xws n SER 276 N -4.76 0.05 -0.12 -2.05 3.41 -1.26 -2.18 113.62 106.71 1xws n SER 276 Ca 0.24 0.51 0.13 0.00 -0.26 0.00 0.00 58.87 59.49 1xws n SER 276 Cb 0.62 -0.52 0.44 0.00 -0.26 0.00 0.00 64.21 64.49 1xws n SER 276 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1xws n ASP 277 N -1.55 0.62 -4.82 4.04 8.00 -0.03 -4.92 116.55 117.88 1xws n ASP 277 Ca 0.04 -0.49 -0.33 0.00 0.71 0.00 0.00 54.79 54.72 1xws n ASP 277 Cb 0.22 0.04 -0.04 0.00 -0.02 0.00 0.00 41.12 41.32 1xws n ASP 277 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1xws s ARG 278 N -2.67 3.97 0.58 -1.24 0.52 -0.93 -4.86 118.95 114.32 1xws s ARG 278 Ca 0.21 1.12 -0.18 0.00 -0.52 0.00 0.00 55.73 56.37 1xws s ARG 278 Cb 0.19 -2.13 -0.04 0.00 0.52 0.00 0.00 34.95 33.48 1xws s ARG 278 CO 0.55 -0.26 1.10 -1.25 0.02 0.00 0.00 175.30 175.47 1xws s PRO 279 N -3.56 3.23 0.88 3.54 0.04 -1.26 -5.04 135.00 132.82 1xws s PRO 279 Ca 0.62 1.47 -0.12 0.00 0.04 0.00 0.00 61.00 63.01 1xws s PRO 279 Cb -0.11 -2.00 0.12 0.00 0.04 0.00 0.00 34.50 32.54 1xws s PRO 279 CO 0.23 -0.92 1.10 0.95 0.04 0.00 0.00 177.00 178.40 1xws s THR 280 N -2.05 2.65 0.27 1.26 -4.23 -1.26 -4.86 115.64 107.41 1xws s THR 280 Ca 0.69 0.21 -0.01 0.00 -1.18 0.00 0.00 61.69 61.40 1xws s THR 280 Cb -0.21 -2.81 0.25 0.00 1.34 0.00 0.00 72.50 71.07 1xws s THR 280 CO 0.32 -0.27 1.80 -0.26 -0.54 0.00 0.00 174.62 175.67 1xws h PHE 281 N -1.43 0.95 -0.17 3.99 0.05 -1.97 -1.20 116.94 117.15 1xws h PHE 281 Ca -0.49 0.03 0.03 0.00 3.82 0.00 0.00 57.97 61.36 1xws h PHE 281 Cb 1.29 -0.29 -0.03 0.00 2.00 0.00 0.00 35.95 38.92 1xws h PHE 281 CO 0.41 0.33 -0.04 1.49 -0.18 0.00 0.00 178.31 180.31 1xws h GLU 282 N 0.81 -0.00 -0.57 1.51 4.81 -1.99 -1.37 114.58 117.79 1xws h GLU 282 Ca 0.46 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.66 1xws h GLU 282 Cb 0.52 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.87 1xws h GLU 282 CO -0.29 -0.00 0.24 0.93 -0.73 0.00 0.00 179.01 179.16 1xws h GLU 283 N -0.00 0.82 -0.15 1.92 5.08 -1.74 0.71 114.58 121.22 1xws h GLU 283 Ca 0.08 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1xws h GLU 283 Cb 0.13 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1xws h GLU 283 CO -0.18 0.66 0.07 0.82 -1.00 0.00 0.00 179.01 179.38 1xws h ILE 284 N 0.81 1.13 0.00 3.13 2.04 -0.93 -1.86 117.51 121.82 1xws h ILE 284 Ca 0.20 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 1xws h ILE 284 Cb 0.14 1.11 -0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1xws h ILE 284 CO -0.02 0.12 -0.05 1.56 0.00 0.00 0.00 178.15 179.76 1xws h GLN 285 N 0.11 0.00 -0.01 2.37 4.20 -0.84 -2.14 115.11 118.80 1xws h GLN 285 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1xws h GLN 285 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1xws h GLN 285 CO -0.01 0.05 -0.12 0.09 -0.67 0.00 0.00 178.83 178.17 1xws n ASN 286 N -3.13 0.88 -4.77 1.46 3.02 0.21 -4.77 115.26 108.16 1xws n ASN 286 Ca 0.03 -0.95 -0.40 0.00 -0.03 0.00 0.00 54.58 53.23 1xws n ASN 286 Cb 0.47 0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 1xws n ASN 286 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1xws s HIS 287 N -2.33 2.66 0.43 3.10 2.46 -0.71 -4.92 115.29 115.98 1xws s HIS 287 Ca 0.31 1.29 0.18 0.00 0.47 0.00 0.00 55.06 57.31 1xws s HIS 287 Cb 0.20 -3.87 1.10 0.00 -0.13 0.00 0.00 32.58 29.89 1xws s HIS 287 CO 0.45 -2.62 1.86 -1.35 -2.47 0.00 0.00 174.74 170.61 1xws h PRO 288 N 2.77 0.37 0.00 2.88 0.11 -1.91 -0.32 132.00 135.90 1xws h PRO 288 Ca -0.50 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 1xws h PRO 288 Cb 1.25 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1xws h PRO 288 CO 0.63 0.25 -0.07 2.35 -0.21 0.00 0.00 178.00 180.95 1xws h TRP 289 N 0.38 0.00 -0.05 0.65 7.01 -1.91 -3.00 115.95 119.04 1xws h TRP 289 Ca 0.46 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.46 1xws h TRP 289 Cb 1.17 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.23 1xws h TRP 289 CO -0.00 0.07 0.00 -1.33 -2.79 0.00 0.00 178.44 174.39 1xws n MET 290 N -3.33 1.56 -2.23 2.65 2.81 -0.13 -4.92 117.12 113.53 1xws n MET 290 Ca -0.01 -0.82 -0.32 0.00 -1.81 0.00 0.00 57.70 54.74 1xws n MET 290 Cb 0.25 -1.46 -0.02 0.00 -0.71 0.00 0.00 33.22 31.29 1xws n MET 290 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 1xws s GLN 291 N -1.95 3.72 -1.17 0.03 -1.52 -1.14 -4.18 119.66 113.45 1xws s GLN 291 Ca 0.38 1.00 -0.07 0.00 -1.95 0.00 0.00 55.36 54.72 1xws s GLN 291 Cb 0.20 -2.10 0.01 0.00 -0.22 0.00 0.00 33.01 30.90 1xws s GLN 291 CO 0.32 -0.47 0.90 -0.25 -0.25 0.00 0.00 175.29 175.54 1xws n ASP 292 N -1.86 -5.64 -4.77 5.90 10.43 -1.26 -4.97 116.55 114.38 1xws n ASP 292 Ca 0.07 -0.41 -0.39 0.00 2.57 0.00 0.00 54.79 56.63 1xws n ASP 292 Cb 0.54 -4.29 -0.02 0.00 1.84 0.00 0.00 41.12 39.19 1xws n ASP 292 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1xws s VAL 293 N -3.23 2.98 0.30 2.53 0.11 -1.26 -5.02 120.40 116.82 1xws s VAL 293 Ca 0.45 0.88 -0.21 0.00 -2.93 0.00 0.00 61.98 60.17 1xws s VAL 293 Cb -0.20 -3.52 -0.09 0.00 -1.53 0.00 0.00 36.38 31.04 1xws s VAL 293 CO 0.55 0.13 0.82 -0.76 -3.33 0.00 0.00 175.10 172.51 1xws s LEU 294 N -2.26 4.24 0.78 2.54 1.43 -1.26 -5.07 118.68 119.09 1xws s LEU 294 Ca 0.54 1.56 -0.11 0.00 -1.03 0.00 0.00 54.13 55.09 1xws s LEU 294 Cb -0.34 -3.93 0.06 0.00 0.03 0.00 0.00 46.19 42.01 1xws s LEU 294 CO 0.44 -0.09 1.09 -0.76 0.23 0.00 0.00 176.35 177.25 1xws s LEU 295 N -2.34 2.72 0.20 1.79 1.43 -1.26 -4.79 118.68 116.43 1xws s LEU 295 Ca 0.50 1.45 -0.10 0.00 -1.03 0.00 0.00 54.13 54.95 1xws s LEU 295 Cb -0.15 -4.11 0.24 0.00 0.03 0.00 0.00 46.19 42.20 1xws s LEU 295 CO 0.20 -1.94 1.78 -0.65 0.23 0.00 0.00 176.35 175.97 1xws h PRO 296 N -1.07 0.55 -0.16 1.29 0.11 -1.85 -1.21 132.00 129.66 1xws h PRO 296 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1xws h PRO 296 Cb 1.25 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1xws h PRO 296 CO 0.57 0.36 0.10 0.37 -0.21 0.00 0.00 178.00 179.19 1xws h GLN 297 N 0.56 0.21 -0.08 1.05 5.75 -1.86 -1.22 115.11 119.53 1xws h GLN 297 Ca 0.29 -0.02 -0.06 0.00 -0.15 0.00 0.00 58.65 58.71 1xws h GLN 297 Cb 0.25 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.74 1xws h GLN 297 CO -0.22 0.16 -0.24 1.05 -2.65 0.00 0.00 178.83 176.93 1xws h GLU 298 N 0.20 0.14 -0.43 1.69 4.11 -1.85 -1.76 114.58 116.68 1xws h GLU 298 Ca 0.06 -0.04 0.04 0.00 0.07 0.00 0.00 59.36 59.49 1xws h GLU 298 Cb 0.00 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 1xws h GLU 298 CO -0.01 0.38 0.18 1.15 0.07 0.00 0.00 179.01 180.78 1xws h THR 299 N 0.13 0.92 -0.66 -1.06 2.02 -0.64 -1.12 112.91 112.50 1xws h THR 299 Ca 0.02 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 67.06 1xws h THR 299 Cb 0.50 0.51 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 1xws h THR 299 CO 0.04 0.07 0.35 0.00 0.37 0.00 0.00 175.52 176.34 1xws h ALA 300 N 1.25 0.85 -0.18 6.16 0.00 -0.64 0.43 119.26 127.14 1xws h ALA 300 Ca 0.19 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1xws h ALA 300 Cb 0.14 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1xws h ALA 300 CO -0.17 0.38 0.02 0.93 0.00 0.00 0.00 179.25 180.41 1xws h GLU 301 N 0.91 0.30 -0.12 0.00 5.08 -0.98 0.34 114.58 120.10 1xws h GLU 301 Ca 0.23 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.43 1xws h GLU 301 Cb 0.06 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1xws h GLU 301 CO -0.04 0.47 -0.25 0.82 -1.00 0.00 0.00 179.01 179.02 1xws h ILE 302 N 0.08 1.38 0.00 3.13 2.04 -1.18 -3.39 117.51 119.57 1xws h ILE 302 Ca 0.05 -1.54 0.00 0.00 1.00 0.00 0.00 64.86 64.38 1xws h ILE 302 Cb 0.33 2.09 0.00 0.00 -0.74 0.00 0.00 36.82 38.49 1xws h ILE 302 CO 0.00 0.45 -1.09 1.41 0.00 0.00 0.00 178.15 178.93 1xws n HIS 303 N -4.46 0.00 -0.01 1.37 8.25 0.14 -4.84 115.22 115.67 1xws n HIS 303 Ca -0.07 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.38 1xws n HIS 303 Cb 0.44 -0.13 -0.01 0.00 1.12 0.00 0.00 29.99 31.41 1xws n HIS 303 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1xws n LEU 304 N -1.61 0.99 0.00 2.41 4.77 0.46 -5.01 117.00 119.01 1xws n LEU 304 Ca -0.01 -0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.09 1xws n LEU 304 Cb 0.19 0.00 0.69 0.00 -2.33 0.00 0.00 43.42 41.97 1xws n LEU 304 CO 0.17 0.20 0.88 1.41 -1.33 0.00 0.00 177.39 178.72