#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wcg s LYS 4 N 0.00 0.64 0.39 -0.72 -2.85 -1.26 -4.70 119.74 111.23 1wcg s LYS 4 Ca 0.00 -0.92 -0.26 0.00 -1.00 0.00 0.00 55.97 53.79 1wcg s LYS 4 Cb 0.00 -0.34 -0.09 0.00 -2.06 0.00 0.00 37.83 35.34 1wcg s LYS 4 CO 0.00 0.05 1.18 -0.06 0.10 0.00 0.00 175.35 176.62 1wcg s PHE 5 N -1.90 3.09 0.85 1.78 0.08 0.38 -5.01 117.98 117.25 1wcg s PHE 5 Ca -0.04 1.55 -0.11 0.00 0.12 0.00 0.00 56.93 58.45 1wcg s PHE 5 Cb -0.06 -3.41 0.10 0.00 -0.57 0.00 0.00 43.02 39.07 1wcg s PHE 5 CO -0.00 -1.32 1.09 -1.25 -0.10 0.00 0.00 175.22 173.63 1wcg s PRO 6 N -2.20 1.63 0.47 0.24 0.04 -1.26 -4.76 135.00 129.15 1wcg s PRO 6 Ca 0.56 1.05 0.13 0.00 0.04 0.00 0.00 61.00 62.77 1wcg s PRO 6 Cb -0.32 -1.83 1.11 0.00 0.04 0.00 0.00 34.50 33.50 1wcg s PRO 6 CO 0.40 -2.05 2.10 -0.22 0.04 0.00 0.00 177.00 177.27 1wcg h LYS 7 N -1.42 0.23 -0.15 4.56 3.64 -2.00 -2.03 116.57 119.39 1wcg h LYS 7 Ca -0.47 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1wcg h LYS 7 Cb 1.26 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1wcg h LYS 7 CO 0.52 0.15 0.00 -0.25 -2.27 0.00 0.00 179.45 177.60 1wcg n ASP 8 N -4.50 1.87 -4.76 4.20 8.00 -1.26 -4.93 116.55 115.18 1wcg n ASP 8 Ca 0.01 -1.71 -0.41 0.00 0.71 0.00 0.00 54.79 53.39 1wcg n ASP 8 Cb 0.13 -0.10 -0.02 0.00 -0.02 0.00 0.00 41.12 41.11 1wcg n ASP 8 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1wcg s PHE 9 N -1.81 3.02 -0.40 1.24 5.36 -0.77 -4.99 117.98 119.63 1wcg s PHE 9 Ca 0.34 1.21 -0.17 0.00 -0.96 0.00 0.00 56.93 57.36 1wcg s PHE 9 Cb 0.19 -3.76 0.01 0.00 -0.34 0.00 0.00 43.02 39.12 1wcg s PHE 9 CO 0.28 -2.29 0.41 -1.64 -1.46 0.00 0.00 175.22 170.53 1wcg s MET 10 N -1.07 3.18 -0.13 10.12 -1.94 -0.70 -5.00 119.30 123.77 1wcg s MET 10 Ca 0.54 -0.71 -0.10 0.00 -1.71 0.00 0.00 55.69 53.72 1wcg s MET 10 Cb -0.41 -3.94 -0.05 0.00 2.01 0.00 0.00 34.83 32.45 1wcg s MET 10 CO 0.48 -0.78 0.19 -0.06 -0.01 0.00 0.00 175.02 174.85 1wcg s PHE 11 N 2.08 3.54 0.14 -0.03 0.08 -1.26 -0.76 117.98 121.78 1wcg s PHE 11 Ca 0.12 0.54 0.01 0.00 0.12 0.00 0.00 56.93 57.71 1wcg s PHE 11 Cb -0.17 -2.10 -0.00 0.00 -0.57 0.00 0.00 43.02 40.18 1wcg s PHE 11 CO 0.13 0.53 0.17 0.41 -0.10 0.00 0.00 175.22 176.36 1wcg n GLY 12 N 2.59 3.01 3.14 4.36 0.00 -0.20 -0.87 105.19 117.22 1wcg n GLY 12 Ca -0.17 -1.57 -0.08 0.00 0.00 0.00 0.00 46.02 44.20 1wcg n GLY 12 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1wcg s THR 13 N -2.58 0.18 0.06 2.61 -1.32 -1.21 -1.78 115.64 111.59 1wcg s THR 13 Ca 0.14 -1.60 0.05 0.00 -1.21 0.00 0.00 61.69 59.06 1wcg s THR 13 Cb 0.00 -1.53 -0.03 0.00 -1.51 0.00 0.00 72.50 69.43 1wcg s THR 13 CO 0.10 -0.80 -0.13 -0.55 -2.21 0.00 0.00 174.62 171.02 1wcg s SER 14 N -2.92 1.53 0.16 8.08 0.15 -0.87 -0.84 113.70 119.00 1wcg s SER 14 Ca 0.09 -0.55 0.02 0.00 0.70 0.00 0.00 55.95 56.21 1wcg s SER 14 Cb 0.07 -0.05 -0.01 0.00 -1.71 0.00 0.00 66.02 64.32 1wcg s SER 14 CO -0.09 -0.06 0.08 0.35 1.20 0.00 0.00 173.24 174.72 1wcg n THR 15 N 1.52 0.00 -3.86 6.45 -2.24 -0.38 -3.55 114.28 112.23 1wcg n THR 15 Ca -0.20 -0.98 -0.11 0.00 -2.27 0.00 0.00 64.05 60.49 1wcg n THR 15 Cb 0.54 0.39 -0.10 0.00 -2.10 0.00 0.00 70.33 69.07 1wcg n THR 15 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wcg s ALA 16 N -2.48 -0.38 0.11 6.98 0.00 -1.26 -4.14 121.76 120.59 1wcg s ALA 16 Ca 0.11 -0.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.71 1wcg s ALA 16 Cb 0.01 0.09 -0.10 0.00 0.00 0.00 0.00 23.12 23.12 1wcg s ALA 16 CO 0.08 -0.21 1.60 0.66 0.00 0.00 0.00 175.76 177.89 1wcg h SER 17 N 4.30 -1.05 0.27 0.00 4.64 -1.89 -2.19 113.55 117.64 1wcg h SER 17 Ca -0.30 0.11 -0.06 0.00 -0.47 0.00 0.00 61.79 61.06 1wcg h SER 17 Cb 1.19 0.39 -0.01 0.00 -0.31 0.00 0.00 62.40 63.66 1wcg h SER 17 CO 0.40 -0.46 -0.29 0.22 -0.87 0.00 0.00 176.83 175.83 1wcg h TYR 18 N -0.63 0.04 0.00 4.77 3.20 -1.94 -0.25 116.97 122.17 1wcg h TYR 18 Ca 0.02 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.80 1wcg h TYR 18 Cb 0.64 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 1wcg h TYR 18 CO -0.30 0.33 -0.38 1.96 -1.64 0.00 0.00 178.16 178.13 1wcg h GLN 19 N 0.03 0.00 0.00 1.82 4.20 -1.68 -3.38 115.11 116.10 1wcg h GLN 19 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1wcg h GLN 19 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1wcg h GLN 19 CO 0.04 0.38 -0.85 0.44 -0.67 0.00 0.00 178.83 178.16 1wcg n ILE 20 N -3.50 0.00 -0.03 2.54 -5.35 -0.96 -1.72 119.36 110.33 1wcg n ILE 20 Ca -0.00 0.00 -0.16 0.00 -0.27 0.00 0.00 62.75 62.32 1wcg n ILE 20 Cb 0.52 -0.14 -0.08 0.00 -1.74 0.00 0.00 39.64 38.20 1wcg n ILE 20 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1wcg h GLU 21 N 0.00 0.57 0.00 6.28 5.08 -1.23 -1.59 114.58 123.69 1wcg h GLU 21 Ca 0.00 -0.44 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1wcg h GLU 21 Cb 0.38 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1wcg h GLU 21 CO 0.00 1.07 0.00 0.41 -1.00 0.00 0.00 179.01 179.49 1wcg n GLY 22 N 0.64 1.21 4.07 -3.84 0.00 -1.08 -0.80 105.19 105.39 1wcg n GLY 22 Ca -0.07 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 44.98 1wcg n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wcg n GLY 23 N 0.00 -0.47 0.25 -0.02 0.00 -1.07 -4.79 105.19 99.08 1wcg n GLY 23 Ca 0.00 0.16 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1wcg n GLY 23 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1wcg h TRP 24 N -1.77 0.00 0.00 1.61 5.08 -1.85 -2.91 115.95 116.12 1wcg h TRP 24 Ca -0.58 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 59.34 1wcg h TRP 24 Cb 1.38 0.00 -0.10 0.00 -3.00 0.00 0.00 29.16 27.44 1wcg h TRP 24 CO 0.61 0.16 -0.56 0.27 -1.28 0.00 0.00 178.44 177.64 1wcg n ASN 25 N -3.50 1.49 -4.89 0.11 6.94 -1.26 -4.80 115.26 109.35 1wcg n ASN 25 Ca -0.01 -3.13 -0.28 0.00 -0.02 0.00 0.00 54.58 51.14 1wcg n ASN 25 Cb 0.32 -0.43 -0.04 0.00 -2.36 0.00 0.00 39.78 37.27 1wcg n ASN 25 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1wcg s GLU 26 N -2.09 3.25 -1.49 -3.83 2.02 -1.10 -4.64 118.70 110.82 1wcg s GLU 26 Ca 0.33 -0.64 -0.06 0.00 0.02 0.00 0.00 54.97 54.62 1wcg s GLU 26 Cb 0.33 -2.88 0.02 0.00 0.10 0.00 0.00 34.13 31.71 1wcg s GLU 26 CO -0.07 0.53 0.57 -0.25 0.02 0.00 0.00 175.26 176.06 1wcg n ASP 27 N -0.22 -5.54 0.00 -0.19 8.00 -1.26 -1.58 116.55 115.76 1wcg n ASP 27 Ca -0.07 -0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.13 1wcg n ASP 27 Cb 0.53 -4.49 0.00 0.00 -0.02 0.00 0.00 41.12 37.14 1wcg n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wcg n GLY 28 N -1.43 0.56 3.74 0.44 0.00 -1.26 -4.52 105.19 102.72 1wcg n GLY 28 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 1wcg n GLY 28 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1wcg s LYS 29 N -0.19 4.11 0.67 1.61 2.20 -0.61 -4.71 119.74 122.82 1wcg s LYS 29 Ca 0.00 2.61 -0.12 0.00 -0.36 0.00 0.00 55.97 58.10 1wcg s LYS 29 Cb 0.00 -3.04 -0.00 0.00 -1.51 0.00 0.00 37.83 33.28 1wcg s LYS 29 CO 0.00 -0.69 1.05 0.20 -0.36 0.00 0.00 175.35 175.55 1wcg s GLY 30 N 0.76 1.73 0.23 5.54 0.00 -0.36 -4.74 107.32 110.48 1wcg s GLY 30 Ca 0.68 0.11 -0.30 0.00 0.00 0.00 0.00 44.72 45.20 1wcg s GLY 30 CO 0.42 0.41 1.37 1.85 0.00 0.00 0.00 173.10 177.15 1wcg s GLU 31 N -4.92 4.33 0.50 2.90 2.12 -1.26 -4.76 118.70 117.61 1wcg s GLU 31 Ca 0.58 2.18 0.06 0.00 0.36 0.00 0.00 54.97 58.15 1wcg s GLU 31 Cb -0.14 -3.15 0.01 0.00 0.26 0.00 0.00 34.13 31.12 1wcg s GLU 31 CO 0.52 -0.32 0.33 0.54 -0.54 0.00 0.00 175.26 175.79 1wcg s ASN 32 N 0.29 4.61 0.48 -1.70 2.20 -1.26 -0.77 114.94 118.78 1wcg s ASN 32 Ca 0.57 -1.19 0.24 0.00 -0.94 0.00 0.00 52.86 51.55 1wcg s ASN 32 Cb -0.39 0.15 1.19 0.00 -2.00 0.00 0.00 41.25 40.20 1wcg s ASN 32 CO 0.41 -0.93 1.97 0.16 -2.94 0.00 0.00 177.10 175.77 1wcg h ILE 33 N 0.95 0.66 -0.01 0.54 3.07 -1.25 -1.45 117.51 120.02 1wcg h ILE 33 Ca -0.39 -0.81 -0.14 0.00 1.55 0.00 0.00 64.86 65.07 1wcg h ILE 33 Cb 1.29 1.52 0.01 0.00 -0.27 0.00 0.00 36.82 39.37 1wcg h ILE 33 CO 0.61 0.18 -0.54 -0.50 -1.05 0.00 0.00 178.15 176.85 1wcg h TRP 34 N 0.00 0.57 -0.43 0.16 4.06 -1.87 -1.68 115.95 116.76 1wcg h TRP 34 Ca -0.00 -0.30 0.09 0.00 2.06 0.00 0.00 58.89 60.73 1wcg h TRP 34 Cb 0.50 -0.07 -0.08 0.00 -1.00 0.00 0.00 29.16 28.51 1wcg h TRP 34 CO 0.00 1.11 -0.09 -0.44 -3.56 0.00 0.00 178.44 175.46 1wcg h ASP 35 N -0.13 -0.37 -0.17 -3.49 3.32 -1.89 -0.81 116.42 112.88 1wcg h ASP 35 Ca -0.06 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1wcg h ASP 35 Cb 1.25 0.25 -0.01 0.00 0.22 0.00 0.00 39.33 41.05 1wcg h ASP 35 CO 0.11 -0.13 0.11 -0.09 -1.72 0.00 0.00 179.24 177.52 1wcg h ARG 36 N 0.01 0.23 -0.05 3.56 9.65 -1.26 -1.42 114.38 125.11 1wcg h ARG 36 Ca 0.21 -0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 59.07 1wcg h ARG 36 Cb 0.31 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 28.84 1wcg h ARG 36 CO -0.43 0.16 0.02 1.25 2.80 0.00 0.00 179.97 183.77 1wcg h LEU 37 N 0.23 0.07 -0.95 3.80 5.85 -0.93 -1.25 115.31 122.13 1wcg h LEU 37 Ca 0.06 -0.17 -0.08 0.00 0.84 0.00 0.00 57.88 58.53 1wcg h LEU 37 Cb -0.02 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1wcg h LEU 37 CO -0.01 0.22 -0.38 -0.37 -0.34 0.00 0.00 178.44 177.56 1wcg h VAL 38 N -0.09 0.90 0.10 1.05 -1.51 -1.09 0.16 116.25 115.78 1wcg h VAL 38 Ca 0.02 -1.52 -0.28 0.00 -1.23 0.00 0.00 66.70 63.69 1wcg h VAL 38 Cb 0.17 1.92 -0.01 0.00 -2.13 0.00 0.00 31.29 31.25 1wcg h VAL 38 CO -0.00 0.37 -1.32 0.45 -1.23 0.00 0.00 177.57 175.84 1wcg h HIS 39 N 0.00 0.39 0.15 5.19 3.86 -1.18 -2.97 115.15 120.59 1wcg h HIS 39 Ca -0.00 -0.28 -0.31 0.00 -1.16 0.00 0.00 60.37 58.61 1wcg h HIS 39 Cb 0.89 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.35 1wcg h HIS 39 CO 0.00 1.26 -1.57 1.15 0.86 0.00 0.00 177.93 179.63 1wcg h THR 40 N 0.06 0.99 -2.12 2.45 2.02 -1.14 -3.41 112.91 111.75 1wcg h THR 40 Ca -0.16 -2.45 -0.56 0.00 0.77 0.00 0.00 66.41 64.01 1wcg h THR 40 Cb 1.96 2.74 -0.41 0.00 -1.74 0.00 0.00 68.15 70.71 1wcg h THR 40 CO 0.17 0.78 -0.88 -1.20 0.37 0.00 0.00 175.52 174.76 1wcg n SER 41 N -3.77 2.28 0.23 4.18 7.64 0.55 -4.92 113.62 119.81 1wcg n SER 41 Ca -0.25 -3.19 0.16 0.00 1.01 0.00 0.00 58.87 56.60 1wcg n SER 41 Cb 0.98 -0.63 0.85 0.00 -1.01 0.00 0.00 64.21 64.40 1wcg n SER 41 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1wcg h PRO 42 N 3.60 0.00 0.00 1.43 0.13 -1.64 -2.05 132.00 133.47 1wcg h PRO 42 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1wcg h PRO 42 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1wcg h PRO 42 CO 0.65 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.47 1wcg h GLU 43 N 0.00 0.00 0.00 0.86 9.09 -1.91 -2.40 114.58 120.22 1wcg h GLU 43 Ca 0.06 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.47 1wcg h GLU 43 Cb 0.32 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.42 1wcg h GLU 43 CO -0.00 0.00 0.00 1.33 0.05 0.00 0.00 179.01 180.39 1wcg n VAL 44 N -2.68 0.67 -3.38 -1.06 0.24 -0.77 -4.72 118.33 106.63 1wcg n VAL 44 Ca -0.02 -0.05 -0.38 0.00 -2.04 0.00 0.00 64.34 61.85 1wcg n VAL 44 Cb 0.06 -0.83 -0.07 0.00 -1.47 0.00 0.00 33.84 31.54 1wcg n VAL 44 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1wcg s ILE 45 N -3.18 5.22 0.26 1.34 -1.09 -0.90 -4.87 121.20 117.98 1wcg s ILE 45 Ca 0.08 0.80 -0.04 0.00 -2.23 0.00 0.00 60.65 59.27 1wcg s ILE 45 Cb 0.11 -3.75 0.30 0.00 -1.58 0.00 0.00 42.46 37.54 1wcg s ILE 45 CO 0.50 0.32 1.63 0.50 -1.23 0.00 0.00 174.94 176.66 1wcg h LYS 46 N 6.87 0.12 -0.45 2.79 3.64 -0.77 -1.36 116.57 127.41 1wcg h LYS 46 Ca -0.40 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1wcg h LYS 46 Cb 1.17 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1wcg h LYS 46 CO 0.75 0.08 0.00 -0.40 -2.27 0.00 0.00 179.45 177.61 1wcg n ASP 47 N -5.33 3.38 -1.46 4.20 5.75 -1.26 -4.98 116.55 116.86 1wcg n ASP 47 Ca 0.17 -2.12 -0.14 0.00 -0.01 0.00 0.00 54.79 52.69 1wcg n ASP 47 Cb 0.56 -0.34 -0.02 0.00 -1.03 0.00 0.00 41.12 40.29 1wcg n ASP 47 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1wcg n GLY 48 N 0.73 0.11 3.93 6.12 0.00 -0.51 -5.01 105.19 110.55 1wcg n GLY 48 Ca 0.16 -0.33 -0.22 0.00 0.00 0.00 0.00 46.02 45.63 1wcg n GLY 48 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wcg s THR 49 N -2.65 2.21 0.30 2.61 -4.23 -1.26 -5.03 115.64 107.59 1wcg s THR 49 Ca 0.00 -1.30 -0.04 0.00 -1.18 0.00 0.00 61.69 59.17 1wcg s THR 49 Cb 0.00 -2.51 -0.01 0.00 1.34 0.00 0.00 72.50 71.32 1wcg s THR 49 CO 0.00 0.00 0.41 0.54 -0.54 0.00 0.00 174.62 175.03 1wcg s ASN 50 N -4.31 0.64 -0.23 3.99 2.20 -1.26 -4.88 114.94 111.09 1wcg s ASN 50 Ca 0.47 -1.37 0.08 0.00 -0.94 0.00 0.00 52.86 51.10 1wcg s ASN 50 Cb -0.04 0.60 0.59 0.00 -2.00 0.00 0.00 41.25 40.40 1wcg s ASN 50 CO 0.28 -1.18 1.53 0.61 -2.94 0.00 0.00 177.10 175.40 1wcg n GLY 51 N -0.49 3.02 0.34 0.45 0.00 -1.26 -4.46 105.19 102.79 1wcg n GLY 51 Ca 0.01 -0.74 0.03 0.00 0.00 0.00 0.00 46.02 45.32 1wcg n GLY 51 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1wcg h ASP 52 N 2.35 0.85 0.00 1.61 3.32 -1.94 -3.35 116.42 119.26 1wcg h ASP 52 Ca 0.15 0.03 -0.10 0.00 0.02 0.00 0.00 57.03 57.12 1wcg h ASP 52 Cb 1.88 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 41.27 1wcg h ASP 52 CO 0.52 0.51 -1.36 -0.38 -1.72 0.00 0.00 179.24 176.81 1wcg n ILE 53 N -4.63 0.36 0.00 0.35 5.41 -1.26 -2.60 119.36 116.99 1wcg n ILE 53 Ca 0.15 -0.11 0.00 0.00 1.00 0.00 0.00 62.75 63.79 1wcg n ILE 53 Cb 0.24 -1.29 0.00 0.00 -0.71 0.00 0.00 39.64 37.88 1wcg n ILE 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1wcg n ALA 54 N -3.08 0.00 1.62 -1.39 0.00 -1.26 -0.15 120.51 116.25 1wcg n ALA 54 Ca -0.12 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.45 1wcg n ALA 54 Cb 0.60 0.00 0.60 0.00 0.00 0.00 0.00 19.45 20.65 1wcg n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wcg n ASP 56 N -0.18 -5.36 0.07 0.00 2.03 0.79 -4.83 116.55 109.06 1wcg n ASP 56 Ca 0.19 -0.16 0.10 0.00 0.52 0.00 0.00 54.79 55.44 1wcg n ASP 56 Cb 0.26 -4.40 0.41 0.00 -0.72 0.00 0.00 41.12 36.67 1wcg n ASP 56 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1wcg n SER 57 N -2.25 0.35 0.04 1.67 7.64 -0.74 -0.72 113.62 119.62 1wcg n SER 57 Ca -0.14 0.58 0.08 0.00 1.01 0.00 0.00 58.87 60.41 1wcg n SER 57 Cb 0.62 -0.66 0.51 0.00 -1.01 0.00 0.00 64.21 63.68 1wcg n SER 57 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1wcg h TYR 58 N 0.00 0.34 0.00 1.43 3.20 -1.20 -2.35 116.97 118.38 1wcg h TYR 58 Ca 0.00 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.78 1wcg h TYR 58 Cb 0.34 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.48 1wcg h TYR 58 CO 0.00 0.19 -1.86 0.72 -1.64 0.00 0.00 178.16 175.58 1wcg n HIS 59 N -4.48 0.00 -0.57 -3.82 8.25 -0.37 -4.66 115.22 109.56 1wcg n HIS 59 Ca 0.04 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.58 1wcg n HIS 59 Cb 0.19 -0.51 0.27 0.00 1.12 0.00 0.00 29.99 31.06 1wcg n HIS 59 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1wcg n LYS 60 N -2.24 3.25 0.03 -0.41 5.02 0.11 -4.69 118.16 119.22 1wcg n LYS 60 Ca -0.10 -2.62 0.13 0.00 -2.02 0.00 0.00 58.31 53.69 1wcg n LYS 60 Cb 0.62 -1.68 0.58 0.00 -0.02 0.00 0.00 35.03 34.53 1wcg n LYS 60 CO 0.00 0.00 0.00 0.10 -0.52 0.00 0.00 177.40 176.98 1wcg h TYR 61 N 2.89 0.23 -0.50 2.13 -0.00 -1.67 -0.69 116.97 119.36 1wcg h TYR 61 Ca 0.00 0.01 -0.04 0.00 0.00 0.00 0.00 58.73 58.70 1wcg h TYR 61 Cb 1.22 -0.07 -0.02 0.00 0.00 0.00 0.00 36.73 37.85 1wcg h TYR 61 CO 0.53 0.11 0.14 0.87 -0.00 0.00 0.00 178.16 179.82 1wcg h LYS 62 N 0.22 0.74 -0.54 0.10 1.57 -1.89 -1.14 116.57 115.63 1wcg h LYS 62 Ca 0.20 -0.13 -0.12 0.00 -1.87 0.00 0.00 60.65 58.73 1wcg h LYS 62 Cb 0.49 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 1wcg h LYS 62 CO -0.04 0.65 -0.12 1.49 -0.57 0.00 0.00 179.45 180.87 1wcg h GLU 63 N 0.72 1.03 -0.41 3.15 4.81 -1.50 -1.54 114.58 120.84 1wcg h GLU 63 Ca 0.17 -0.39 0.04 0.00 -0.13 0.00 0.00 59.36 59.05 1wcg h GLU 63 Cb 0.23 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.51 1wcg h GLU 63 CO -0.01 1.08 0.18 -0.44 -0.73 0.00 0.00 179.01 179.09 1wcg h ASP 64 N 0.91 0.23 -0.72 1.04 3.32 -1.11 -1.63 116.42 118.45 1wcg h ASP 64 Ca 0.14 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.19 1wcg h ASP 64 Cb 0.69 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.21 1wcg h ASP 64 CO 0.05 0.17 0.32 0.58 -1.72 0.00 0.00 179.24 178.64 1wcg h VAL 65 N 0.36 1.24 -0.90 -1.35 2.07 -1.06 -1.35 116.25 115.26 1wcg h VAL 65 Ca 0.18 -0.72 0.01 0.00 0.82 0.00 0.00 66.70 66.99 1wcg h VAL 65 Cb 0.13 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 30.23 1wcg h VAL 65 CO -0.16 0.30 0.60 0.00 0.02 0.00 0.00 177.57 178.32 1wcg h ALA 66 N 1.15 1.37 -0.27 1.67 0.00 -0.82 -0.03 119.26 122.34 1wcg h ALA 66 Ca 0.24 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 1wcg h ALA 66 Cb 0.17 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1wcg h ALA 66 CO -0.03 0.58 -0.20 0.82 0.00 0.00 0.00 179.25 180.42 1wcg h ILE 67 N 1.20 1.31 -0.79 0.00 2.04 -0.90 -1.06 117.51 119.31 1wcg h ILE 67 Ca 0.33 -1.34 0.06 0.00 1.00 0.00 0.00 64.86 64.91 1wcg h ILE 67 Cb -0.11 1.59 -0.06 0.00 -0.74 0.00 0.00 36.82 37.50 1wcg h ILE 67 CO -0.08 0.42 0.48 0.40 0.00 0.00 0.00 178.15 179.38 1wcg h ILE 68 N 0.34 1.03 -0.68 -0.67 2.04 -0.84 -1.23 117.51 117.50 1wcg h ILE 68 Ca 0.05 -0.31 -0.05 0.00 1.00 0.00 0.00 64.86 65.55 1wcg h ILE 68 Cb 0.75 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 1wcg h ILE 68 CO 0.05 0.16 0.22 0.50 0.00 0.00 0.00 178.15 179.08 1wcg h LYS 69 N 0.89 1.05 -0.78 2.37 1.63 -0.87 -2.10 116.57 118.76 1wcg h LYS 69 Ca 0.34 -0.22 -0.02 0.00 -0.85 0.00 0.00 60.65 59.90 1wcg h LYS 69 Cb 0.15 -0.15 -0.04 0.00 -0.60 0.00 0.00 32.23 31.59 1wcg h LYS 69 CO -0.16 0.91 0.43 0.22 -3.45 0.00 0.00 179.45 177.39 1wcg h ASP 70 N 0.99 0.97 0.79 4.20 3.58 -0.57 -0.67 116.42 125.72 1wcg h ASP 70 Ca 0.22 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.59 1wcg h ASP 70 Cb 0.29 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.09 1wcg h ASP 70 CO -0.01 0.78 0.00 -0.07 -2.88 0.00 0.00 179.24 177.06 1wcg h LEU 71 N 1.09 0.00 -0.48 2.28 3.38 -0.92 -3.47 115.31 117.19 1wcg h LEU 71 Ca 0.28 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.90 1wcg h LEU 71 Cb 0.03 0.00 0.11 0.00 0.09 0.00 0.00 40.66 40.88 1wcg h LEU 71 CO -0.04 0.00 -0.58 -3.20 0.09 0.00 0.00 178.44 174.71 1wcg n ASN 72 N -2.68 -5.78 -4.79 -0.43 5.15 -0.26 -4.82 115.26 101.65 1wcg n ASN 72 Ca 0.01 -0.42 -0.34 0.00 -0.60 0.00 0.00 54.58 53.23 1wcg n ASN 72 Cb 0.25 -4.45 -0.03 0.00 -0.53 0.00 0.00 39.78 35.02 1wcg n ASN 72 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1wcg s LEU 73 N -6.37 3.83 0.15 1.20 1.43 -1.13 -4.97 118.68 112.82 1wcg s LEU 73 Ca 0.46 2.00 0.05 0.00 -1.03 0.00 0.00 54.13 55.61 1wcg s LEU 73 Cb -0.20 -4.55 -0.07 0.00 0.03 0.00 0.00 46.19 41.39 1wcg s LEU 73 CO 0.56 -0.88 1.35 0.11 0.23 0.00 0.00 176.35 177.72 1wcg h LYS 74 N 1.50 0.07 -3.80 1.70 1.57 -1.37 -3.46 116.57 112.79 1wcg h LYS 74 Ca -0.50 -0.10 -0.09 0.00 -1.87 0.00 0.00 60.65 58.10 1wcg h LYS 74 Cb 1.23 0.03 -0.14 0.00 0.08 0.00 0.00 32.23 33.44 1wcg h LYS 74 CO 0.59 0.95 -0.35 -0.59 -0.57 0.00 0.00 179.45 179.47 1wcg s PHE 75 N -2.97 0.16 -0.12 -1.35 -0.12 -1.18 -1.25 117.98 111.15 1wcg s PHE 75 Ca -0.01 -0.58 0.01 0.00 -0.05 0.00 0.00 56.93 56.30 1wcg s PHE 75 Cb 0.10 -0.04 0.02 0.00 -0.63 0.00 0.00 43.02 42.47 1wcg s PHE 75 CO 0.82 -0.57 -0.12 -0.47 -0.05 0.00 0.00 175.22 174.83 1wcg s TYR 76 N -3.87 1.82 -0.27 3.49 5.04 -0.45 -3.33 117.35 119.77 1wcg s TYR 76 Ca 0.06 -0.93 -0.17 0.00 -2.44 0.00 0.00 57.07 53.60 1wcg s TYR 76 Cb 0.05 -1.38 -0.03 0.00 0.35 0.00 0.00 41.96 40.94 1wcg s TYR 76 CO -0.10 -0.54 0.47 0.50 -1.34 0.00 0.00 175.55 174.54 1wcg s ARG 77 N 1.39 4.01 0.12 4.97 3.52 -0.02 -1.00 118.95 131.94 1wcg s ARG 77 Ca 0.01 0.19 0.01 0.00 -0.13 0.00 0.00 55.73 55.81 1wcg s ARG 77 Cb -0.13 -3.67 -0.04 0.00 -1.56 0.00 0.00 34.95 29.55 1wcg s ARG 77 CO -0.07 -0.35 -0.01 -0.59 -0.81 0.00 0.00 175.30 173.46 1wcg s PHE 78 N 2.24 0.90 0.23 5.12 -0.12 -0.84 -1.25 117.98 124.27 1wcg s PHE 78 Ca 0.19 -1.04 0.09 0.00 -0.05 0.00 0.00 56.93 56.12 1wcg s PHE 78 Cb -0.16 -0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 41.66 1wcg s PHE 78 CO 0.10 -0.29 0.00 -1.54 -0.05 0.00 0.00 175.22 173.44 1wcg s SER 79 N -3.06 4.63 -0.16 1.98 1.04 -1.26 -0.89 113.70 115.99 1wcg s SER 79 Ca 0.17 -0.55 -0.07 0.00 0.48 0.00 0.00 55.95 55.98 1wcg s SER 79 Cb 0.06 -0.91 -0.04 0.00 0.10 0.00 0.00 66.02 65.23 1wcg s SER 79 CO -0.02 0.03 0.06 -0.63 0.98 0.00 0.00 173.24 173.66 1wcg s ILE 80 N -2.11 4.82 -0.47 -1.02 1.01 -0.67 -4.19 121.20 118.57 1wcg s ILE 80 Ca 0.30 -0.03 -0.29 0.00 0.00 0.00 0.00 60.65 60.63 1wcg s ILE 80 Cb -0.07 -3.15 0.03 0.00 0.01 0.00 0.00 42.46 39.28 1wcg s ILE 80 CO 0.19 0.50 1.17 -0.55 0.00 0.00 0.00 174.94 176.25 1wcg s SER 81 N 0.04 6.60 0.23 3.58 0.15 -1.26 -4.66 113.70 118.38 1wcg s SER 81 Ca 0.06 0.51 -0.06 0.00 0.70 0.00 0.00 55.95 57.16 1wcg s SER 81 Cb -0.12 -2.55 0.40 0.00 -1.71 0.00 0.00 66.02 62.04 1wcg s SER 81 CO 0.01 -1.28 1.73 -0.25 1.20 0.00 0.00 173.24 174.65 1wcg h TRP 82 N 9.40 0.44 0.00 3.44 2.91 -1.84 -1.08 115.95 129.21 1wcg h TRP 82 Ca -0.24 0.04 0.00 0.00 1.13 0.00 0.00 58.89 59.82 1wcg h TRP 82 Cb 1.07 -0.09 0.00 0.00 -0.51 0.00 0.00 29.16 29.63 1wcg h TRP 82 CO 0.98 0.05 0.00 0.00 -1.03 0.00 0.00 178.44 178.44 1wcg n ALA 83 N -2.53 1.76 0.08 2.65 0.00 -1.26 -1.27 120.51 119.95 1wcg n ALA 83 Ca 0.12 0.07 -0.07 0.00 0.00 0.00 0.00 53.44 53.57 1wcg n ALA 83 Cb 0.38 -1.40 0.06 0.00 0.00 0.00 0.00 19.45 18.49 1wcg n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wcg h ARG 84 N 0.00 0.22 0.11 0.00 3.08 -1.49 -0.94 114.38 115.35 1wcg h ARG 84 Ca 0.00 -0.18 -0.15 0.00 0.07 0.00 0.00 59.98 59.71 1wcg h ARG 84 Cb 0.43 0.04 0.01 0.00 0.08 0.00 0.00 29.97 30.53 1wcg h ARG 84 CO 0.00 0.85 -0.68 0.82 -1.07 0.00 0.00 179.97 179.89 1wcg h ILE 85 N 0.15 1.53 -2.69 2.04 1.08 -1.25 -3.34 117.51 115.02 1wcg h ILE 85 Ca -0.02 -2.48 -0.50 0.00 -0.39 0.00 0.00 64.86 61.47 1wcg h ILE 85 Cb 1.28 3.20 -0.39 0.00 -3.07 0.00 0.00 36.82 37.84 1wcg h ILE 85 CO 0.11 0.69 -0.76 0.00 -0.69 0.00 0.00 178.15 177.50 1wcg s ALA 86 N -2.38 0.45 0.48 1.87 0.00 -0.40 -0.72 121.76 121.07 1wcg s ALA 86 Ca -0.16 -0.97 0.23 0.00 0.00 0.00 0.00 51.96 51.06 1wcg s ALA 86 Cb 0.00 -1.45 1.26 0.00 0.00 0.00 0.00 23.12 22.94 1wcg s ALA 86 CO 0.79 -1.66 1.92 -1.35 0.00 0.00 0.00 175.76 175.47 1wcg h PRO 87 N 8.39 0.18 0.00 0.00 0.11 -1.70 0.63 132.00 139.61 1wcg h PRO 87 Ca -0.19 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.91 1wcg h PRO 87 Cb 1.02 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1wcg h PRO 87 CO 0.42 0.12 -0.45 -1.13 -0.21 0.00 0.00 178.00 176.75 1wcg n SER 88 N -4.41 0.46 0.00 -2.05 3.41 -1.26 -4.27 113.62 105.50 1wcg n SER 88 Ca 0.15 -0.16 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1wcg n SER 88 Cb 0.69 0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 1wcg n SER 88 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wcg n GLY 89 N 1.49 2.18 3.74 5.00 0.00 0.21 -3.91 105.19 113.91 1wcg n GLY 89 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 1wcg n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wcg s VAL 90 N -2.58 5.34 -1.95 1.61 1.01 -1.26 -4.87 120.40 117.71 1wcg s VAL 90 Ca 0.00 0.42 0.08 0.00 0.00 0.00 0.00 61.98 62.47 1wcg s VAL 90 Cb 0.00 -3.57 0.23 0.00 0.00 0.00 0.00 36.38 33.04 1wcg s VAL 90 CO 0.00 0.42 1.18 0.23 0.00 0.00 0.00 175.10 176.93 1wcg n MET 91 N 3.45 1.63 0.18 2.72 0.00 -1.26 -3.51 117.12 120.33 1wcg n MET 91 Ca -0.14 -0.94 0.13 0.00 0.00 0.00 0.00 57.70 56.76 1wcg n MET 91 Cb 0.52 -1.22 0.38 0.00 0.00 0.00 0.00 33.22 32.90 1wcg n MET 91 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 175.97 173.02 1wcg h ASN 92 N 1.51 0.00 -3.61 7.83 -1.07 -2.00 -3.40 115.58 114.85 1wcg h ASN 92 Ca 0.00 0.00 -0.63 0.00 0.07 0.00 0.00 56.30 55.74 1wcg h ASN 92 Cb 0.37 0.00 -0.40 0.00 -2.07 0.00 0.00 38.32 36.22 1wcg h ASN 92 CO 0.01 0.00 -0.72 -0.44 0.07 0.00 0.00 177.43 176.35 1wcg s SER 93 N -5.30 4.44 0.09 6.14 0.01 -1.23 -5.11 113.70 112.73 1wcg s SER 93 Ca 0.07 -2.15 -0.03 0.00 1.31 0.00 0.00 55.95 55.15 1wcg s SER 93 Cb 0.09 -1.38 -0.05 0.00 0.21 0.00 0.00 66.02 64.89 1wcg s SER 93 CO 0.59 -0.36 0.30 -0.76 0.41 0.00 0.00 173.24 173.41 1wcg s LEU 94 N 0.92 4.32 -0.42 2.44 1.43 -1.26 -4.14 118.68 121.97 1wcg s LEU 94 Ca 0.12 0.47 -0.08 0.00 -1.03 0.00 0.00 54.13 53.61 1wcg s LEU 94 Cb -0.20 -3.08 0.08 0.00 0.03 0.00 0.00 46.19 43.03 1wcg s LEU 94 CO -0.11 0.13 0.25 -0.70 0.23 0.00 0.00 176.35 176.14 1wcg s GLU 95 N -2.44 2.51 0.50 1.70 2.56 0.10 -4.98 118.70 118.65 1wcg s GLU 95 Ca 0.36 -1.52 0.22 0.00 0.00 0.00 0.00 54.97 54.03 1wcg s GLU 95 Cb -0.13 -3.74 1.28 0.00 2.00 0.00 0.00 34.13 33.55 1wcg s GLU 95 CO 0.24 -0.97 1.99 -1.35 -0.56 0.00 0.00 175.26 174.61 1wcg h PRO 96 N 8.34 0.12 -0.19 4.30 0.11 -1.89 -1.57 132.00 141.23 1wcg h PRO 96 Ca -0.21 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.80 1wcg h PRO 96 Cb 1.08 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1wcg h PRO 96 CO 0.75 0.08 -0.28 0.87 -0.21 0.00 0.00 178.00 179.20 1wcg h LYS 97 N 0.13 0.36 -0.22 1.05 1.57 -1.90 0.24 116.57 117.79 1wcg h LYS 97 Ca 0.26 -0.14 -0.11 0.00 -1.87 0.00 0.00 60.65 58.80 1wcg h LYS 97 Cb 0.86 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.15 1wcg h LYS 97 CO -0.03 0.61 -0.28 0.78 -0.57 0.00 0.00 179.45 179.96 1wcg h GLY 98 N 1.04 0.63 1.00 3.86 0.00 -1.41 -2.26 103.07 105.92 1wcg h GLY 98 Ca 0.05 -0.68 0.01 0.00 0.00 0.00 0.00 47.33 46.71 1wcg h GLY 98 CO 0.05 0.61 0.56 -2.22 0.00 0.00 0.00 176.54 175.54 1wcg h ILE 99 N 0.26 1.21 -0.83 2.60 2.04 -1.32 -2.80 117.51 118.67 1wcg h ILE 99 Ca 0.03 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.47 1wcg h ILE 99 Cb 0.86 -0.03 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 1wcg h ILE 99 CO 0.07 0.21 0.42 0.00 0.00 0.00 0.00 178.15 178.84 1wcg h ALA 100 N 1.31 1.17 0.02 1.87 0.00 -0.83 -0.64 119.26 122.17 1wcg h ALA 100 Ca 0.31 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.09 1wcg h ALA 100 Cb -0.13 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.31 1wcg h ALA 100 CO -0.07 0.64 -0.11 -0.92 0.00 0.00 0.00 179.25 178.80 1wcg h TYR 101 N 1.18 -0.27 -0.20 0.00 3.20 -1.15 0.81 116.97 120.55 1wcg h TYR 101 Ca 0.29 0.01 -0.13 0.00 3.14 0.00 0.00 58.73 62.04 1wcg h TYR 101 Cb 0.09 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 1wcg h TYR 101 CO 0.01 -0.16 -0.42 1.88 -1.64 0.00 0.00 178.16 177.83 1wcg h TYR 102 N -0.19 0.55 -0.75 -3.82 0.05 -1.35 -0.98 116.97 110.48 1wcg h TYR 102 Ca 0.03 -0.16 0.01 0.00 0.05 0.00 0.00 58.73 58.66 1wcg h TYR 102 Cb 0.23 -0.12 -0.04 0.00 1.01 0.00 0.00 36.73 37.82 1wcg h TYR 102 CO -0.16 0.81 0.49 -0.91 -1.05 0.00 0.00 178.16 177.34 1wcg h ASN 103 N 0.38 0.84 -0.61 3.88 2.35 -0.91 -0.08 115.58 121.44 1wcg h ASN 103 Ca 0.03 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 1wcg h ASN 103 Cb 0.90 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 39.04 1wcg h ASN 103 CO 0.08 0.61 0.32 0.78 -1.65 0.00 0.00 177.43 177.56 1wcg h ASN 104 N 1.00 0.77 -0.11 5.81 2.35 -0.25 0.27 115.58 125.42 1wcg h ASN 104 Ca 0.28 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.91 1wcg h ASN 104 Cb -0.10 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.07 1wcg h ASN 104 CO -0.07 0.66 0.02 0.25 -1.65 0.00 0.00 177.43 176.64 1wcg h LEU 105 N 0.82 0.17 -0.42 1.61 5.85 -0.93 -0.68 115.31 121.73 1wcg h LEU 105 Ca 0.21 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.71 1wcg h LEU 105 Cb 0.07 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 1wcg h LEU 105 CO -0.03 0.39 0.19 0.40 -0.34 0.00 0.00 178.44 179.04 1wcg h ILE 106 N -0.05 0.93 -0.30 4.05 2.04 -0.89 -0.98 117.51 122.32 1wcg h ILE 106 Ca 0.03 -0.13 -0.10 0.00 1.00 0.00 0.00 64.86 65.66 1wcg h ILE 106 Cb 0.29 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1wcg h ILE 106 CO 0.00 0.07 -0.23 0.78 0.00 0.00 0.00 178.15 178.77 1wcg h ASN 107 N 0.39 0.57 -0.53 1.72 2.35 -0.86 -1.22 115.58 117.99 1wcg h ASN 107 Ca 0.19 -0.19 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1wcg h ASN 107 Cb 0.13 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 1wcg h ASN 107 CO -0.15 0.80 0.10 -0.08 -1.65 0.00 0.00 177.43 176.44 1wcg h GLU 108 N 0.50 0.87 -0.01 0.81 4.57 -0.75 -0.85 114.58 119.73 1wcg h GLU 108 Ca 0.07 -0.23 -0.00 0.00 -1.18 0.00 0.00 59.36 58.03 1wcg h GLU 108 Cb 0.67 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 29.16 1wcg h GLU 108 CO 0.05 0.85 0.01 -0.07 -1.18 0.00 0.00 179.01 178.66 1wcg h LEU 109 N 0.76 0.01 -0.84 1.64 3.38 -0.85 -2.85 115.31 116.57 1wcg h LEU 109 Ca 0.16 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 58.02 1wcg h LEU 109 Cb 0.39 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1wcg h LEU 109 CO 0.01 0.05 0.04 0.40 0.09 0.00 0.00 178.44 179.02 1wcg h ILE 110 N -0.03 1.25 -0.32 1.22 2.04 -1.09 -0.76 117.51 119.82 1wcg h ILE 110 Ca 0.00 -1.02 0.08 0.00 1.00 0.00 0.00 64.86 64.93 1wcg h ILE 110 Cb 0.04 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1wcg h ILE 110 CO -0.00 0.37 0.23 0.50 0.00 0.00 0.00 178.15 179.24 1wcg h LYS 111 N 0.85 0.06 -0.67 2.37 3.64 -1.12 -1.05 116.57 120.65 1wcg h LYS 111 Ca 0.17 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1wcg h LYS 111 Cb 0.45 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1wcg h LYS 111 CO 0.02 0.04 0.00 0.09 -2.27 0.00 0.00 179.45 177.33 1wcg n ASN 112 N -4.46 4.17 -2.09 4.20 3.02 -0.53 -4.96 115.26 114.61 1wcg n ASN 112 Ca 0.04 -2.23 -0.17 0.00 -0.03 0.00 0.00 54.58 52.20 1wcg n ASN 112 Cb 0.35 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 39.01 1wcg n ASN 112 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1wcg n ASP 113 N 1.29 -5.03 -4.56 6.41 8.00 -0.40 -4.98 116.55 117.28 1wcg n ASP 113 Ca 0.24 -0.09 -0.34 0.00 0.71 0.00 0.00 54.79 55.31 1wcg n ASP 113 Cb 0.73 -4.05 -0.11 0.00 -0.02 0.00 0.00 41.12 37.67 1wcg n ASP 113 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1wcg s ILE 114 N -2.91 4.03 -0.08 0.53 1.01 -0.40 -4.95 121.20 118.43 1wcg s ILE 114 Ca 0.08 -0.32 -0.30 0.00 0.00 0.00 0.00 60.65 60.11 1wcg s ILE 114 Cb -0.04 -2.74 -0.02 0.00 0.01 0.00 0.00 42.46 39.67 1wcg s ILE 114 CO 0.10 0.53 1.09 -0.63 0.00 0.00 0.00 174.94 176.03 1wcg s ILE 115 N -0.07 4.55 -0.04 2.92 1.01 -0.38 -3.73 121.20 125.45 1wcg s ILE 115 Ca 0.02 1.84 -0.30 0.00 0.00 0.00 0.00 60.65 62.21 1wcg s ILE 115 Cb -0.13 -4.18 -0.03 0.00 0.01 0.00 0.00 42.46 38.13 1wcg s ILE 115 CO 0.02 0.00 1.09 -2.16 0.00 0.00 0.00 174.94 173.90 1wcg s PRO 116 N 2.09 4.44 -0.28 2.79 0.04 -1.26 -1.34 135.00 141.47 1wcg s PRO 116 Ca 0.52 1.54 -0.01 0.00 0.04 0.00 0.00 61.00 63.09 1wcg s PRO 116 Cb -0.21 -3.49 0.05 0.00 0.04 0.00 0.00 34.50 30.88 1wcg s PRO 116 CO 0.20 -0.28 -0.04 -1.17 0.04 0.00 0.00 177.00 175.75 1wcg s LEU 117 N 1.67 3.66 -0.23 -3.56 2.96 -0.17 -4.26 118.68 118.75 1wcg s LEU 117 Ca 0.53 -1.23 -0.08 0.00 -0.22 0.00 0.00 54.13 53.13 1wcg s LEU 117 Cb -0.23 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 1wcg s LEU 117 CO 0.23 -0.22 0.10 -0.69 -1.32 0.00 0.00 176.35 174.45 1wcg s VAL 118 N 1.23 4.76 -0.27 1.68 1.01 -0.68 -1.98 120.40 126.14 1wcg s VAL 118 Ca -0.05 -0.03 -0.20 0.00 0.00 0.00 0.00 61.98 61.70 1wcg s VAL 118 Cb -0.19 -3.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 1wcg s VAL 118 CO -0.03 0.37 0.62 -0.89 0.00 0.00 0.00 175.10 175.17 1wcg s THR 119 N 1.15 4.97 0.09 3.92 2.01 -0.06 -0.52 115.64 127.20 1wcg s THR 119 Ca 0.05 1.01 -0.15 0.00 0.31 0.00 0.00 61.69 62.90 1wcg s THR 119 Cb -0.14 -3.95 -0.10 0.00 0.01 0.00 0.00 72.50 68.31 1wcg s THR 119 CO 0.04 -0.03 1.39 0.24 -0.69 0.00 0.00 174.62 175.56 1wcg h MET 120 N 8.02 0.67 -3.74 4.92 2.86 -0.72 -1.78 114.93 125.16 1wcg h MET 120 Ca -0.27 -0.38 -0.56 0.00 -2.06 0.00 0.00 59.70 56.42 1wcg h MET 120 Cb 1.12 0.03 -0.40 0.00 0.06 0.00 0.00 31.60 32.41 1wcg h MET 120 CO 0.78 1.00 -0.76 -0.47 1.06 0.00 0.00 176.91 178.51 1wcg s TYR 121 N -4.24 1.62 -0.44 -0.22 5.04 -0.30 -4.39 117.35 114.42 1wcg s TYR 121 Ca -0.12 -1.41 0.06 0.00 -2.44 0.00 0.00 57.07 53.16 1wcg s TYR 121 Cb 0.08 -1.43 0.42 0.00 0.35 0.00 0.00 41.96 41.38 1wcg s TYR 121 CO 0.83 -0.75 1.09 1.58 -1.34 0.00 0.00 175.55 176.96 1wcg n HIS 122 N 4.88 3.26 -0.30 4.97 -0.00 -1.26 -1.43 115.22 125.33 1wcg n HIS 122 Ca -0.07 -3.15 0.00 0.00 0.46 0.00 0.00 57.72 54.96 1wcg n HIS 122 Cb 0.44 -0.13 0.00 0.00 -0.12 0.00 0.00 29.99 30.19 1wcg n HIS 122 CO 0.00 0.00 0.00 0.91 0.46 0.00 0.00 176.34 177.71 1wcg n TRP 123 N -0.43 0.00 -2.79 1.57 8.01 -1.26 -4.82 117.44 117.72 1wcg n TRP 123 Ca 0.36 0.00 -0.42 0.00 -1.31 0.00 0.00 57.50 56.13 1wcg n TRP 123 Cb 0.66 0.00 0.02 0.00 -2.01 0.00 0.00 31.31 29.97 1wcg n TRP 123 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.69 176.28 1wcg n ASP 124 N 0.00 6.96 -4.75 -0.99 5.75 -1.26 -4.81 116.55 117.45 1wcg n ASP 124 Ca 0.00 -3.56 -0.41 0.00 -0.01 0.00 0.00 54.79 50.80 1wcg n ASP 124 Cb 0.00 -1.22 -0.02 0.00 -1.03 0.00 0.00 41.12 38.85 1wcg n ASP 124 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1wcg s LEU 125 N -3.62 4.36 0.26 -2.12 2.96 -1.26 -4.48 118.68 114.78 1wcg s LEU 125 Ca 0.36 2.82 -0.30 0.00 -0.22 0.00 0.00 54.13 56.79 1wcg s LEU 125 Cb 0.13 -3.63 -0.13 0.00 0.50 0.00 0.00 46.19 43.06 1wcg s LEU 125 CO -0.02 -0.81 1.38 -2.65 -1.32 0.00 0.00 176.35 172.93 1wcg n PRO 126 N 2.16 2.06 0.11 0.98 -0.02 -1.26 -0.79 135.00 138.24 1wcg n PRO 126 Ca 0.07 0.73 0.03 0.00 -2.02 0.00 0.00 63.50 62.32 1wcg n PRO 126 Cb 0.39 -2.37 0.43 0.00 -0.02 0.00 0.00 33.50 31.93 1wcg n PRO 126 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1wcg h GLN 127 N 3.82 0.29 -0.73 -0.52 5.75 -1.19 -1.85 115.11 120.68 1wcg h GLN 127 Ca -0.45 -0.05 0.05 0.00 -0.15 0.00 0.00 58.65 58.06 1wcg h GLN 127 Cb 1.28 -0.05 -0.05 0.00 1.07 0.00 0.00 27.48 29.72 1wcg h GLN 127 CO 0.73 0.33 0.43 -0.92 -2.65 0.00 0.00 178.83 176.74 1wcg h TYR 128 N 0.28 0.80 -0.16 3.99 3.20 -1.79 -0.31 116.97 122.98 1wcg h TYR 128 Ca 0.07 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.86 1wcg h TYR 128 Cb 0.22 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 1wcg h TYR 128 CO 0.00 0.40 -0.37 -0.07 -1.64 0.00 0.00 178.16 176.49 1wcg h LEU 129 N 0.80 0.34 -1.25 2.82 3.38 -1.47 -2.47 115.31 117.46 1wcg h LEU 129 Ca 0.32 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.09 1wcg h LEU 129 Cb 0.15 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1wcg h LEU 129 CO -0.17 0.69 -0.14 -0.61 0.09 0.00 0.00 178.44 178.30 1wcg h GLN 130 N 0.28 0.34 0.00 1.13 5.75 -0.79 -1.76 115.11 120.06 1wcg h GLN 130 Ca 0.03 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.44 1wcg h GLN 130 Cb 0.78 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.29 1wcg h GLN 130 CO 0.06 0.48 0.00 -0.44 -2.65 0.00 0.00 178.83 176.29 1wcg h ASP 131 N 0.32 0.00 0.57 -0.69 3.32 -0.61 0.17 116.42 119.50 1wcg h ASP 131 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1wcg h ASP 131 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1wcg h ASP 131 CO 0.03 0.00 -0.04 0.18 -1.72 0.00 0.00 179.24 177.69 1wcg n LEU 132 N -2.74 0.11 0.00 1.55 4.77 -0.79 -4.90 117.00 115.00 1wcg n LEU 132 Ca -0.00 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1wcg n LEU 132 Cb 0.19 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 1wcg n LEU 132 CO 0.21 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 1wcg n GLY 133 N 1.31 0.70 7.00 -0.72 0.00 0.60 -4.78 105.19 109.31 1wcg n GLY 133 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1wcg n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wcg n GLY 134 N -1.07 2.97 0.14 -0.02 0.00 -0.73 -3.11 105.19 103.37 1wcg n GLY 134 Ca 0.00 -0.33 0.12 0.00 0.00 0.00 0.00 46.02 45.81 1wcg n GLY 134 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1wcg h TRP 135 N 0.00 0.00 -0.00 1.61 4.06 -1.94 -1.30 115.95 118.39 1wcg h TRP 135 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1wcg h TRP 135 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.16 1wcg h TRP 135 CO 0.00 0.00 -0.08 1.33 -3.56 0.00 0.00 178.44 176.13 1wcg n VAL 136 N -2.30 0.00 -3.42 1.49 0.24 -1.18 -3.96 118.33 109.19 1wcg n VAL 136 Ca 0.02 -0.05 -0.40 0.00 -2.04 0.00 0.00 64.34 61.87 1wcg n VAL 136 Cb 0.24 -0.19 -0.09 0.00 -1.47 0.00 0.00 33.84 32.33 1wcg n VAL 136 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1wcg s ASN 137 N -2.46 6.18 0.62 -1.34 3.84 -0.49 -4.83 114.94 116.46 1wcg s ASN 137 Ca 0.30 -0.07 0.32 0.00 0.21 0.00 0.00 52.86 53.62 1wcg s ASN 137 Cb 0.20 -2.19 1.81 0.00 -0.55 0.00 0.00 41.25 40.52 1wcg s ASN 137 CO 0.46 -0.26 2.11 1.55 -2.79 0.00 0.00 177.10 178.18 1wcg h PRO 138 N 8.38 0.00 0.00 0.43 0.13 -1.85 -1.09 132.00 138.00 1wcg h PRO 138 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1wcg h PRO 138 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1wcg h PRO 138 CO 0.66 0.00 0.00 -0.84 -0.23 0.00 0.00 178.00 177.59 1wcg h ILE 139 N 0.00 0.00 0.00 -3.56 3.07 -1.94 -2.95 117.51 112.13 1wcg h ILE 139 Ca 0.05 -0.19 -0.01 0.00 1.55 0.00 0.00 64.86 66.26 1wcg h ILE 139 Cb 0.44 1.03 -0.00 0.00 -0.27 0.00 0.00 36.82 38.02 1wcg h ILE 139 CO -0.00 0.00 -0.05 -0.03 -1.05 0.00 0.00 178.15 177.02 1wcg h MET 140 N 0.00 0.00 -0.10 0.16 4.05 -1.45 -2.01 114.93 115.59 1wcg h MET 140 Ca 0.00 0.00 -0.08 0.00 -0.28 0.00 0.00 59.70 59.34 1wcg h MET 140 Cb 0.22 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.01 1wcg h MET 140 CO 0.00 0.05 -0.29 0.66 0.23 0.00 0.00 176.91 177.56 1wcg h SER 141 N 0.00 0.17 -0.11 1.39 4.64 -1.75 -0.58 113.55 117.31 1wcg h SER 141 Ca -0.00 -0.05 -0.17 0.00 -0.47 0.00 0.00 61.79 61.09 1wcg h SER 141 Cb 0.10 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1wcg h SER 141 CO 0.01 0.46 -0.55 0.44 -0.87 0.00 0.00 176.83 176.32 1wcg h ASP 142 N 0.16 0.77 -0.80 4.97 3.32 -1.59 -1.17 116.42 122.09 1wcg h ASP 142 Ca 0.02 -0.41 -0.03 0.00 0.02 0.00 0.00 57.03 56.63 1wcg h ASP 142 Cb 0.59 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.89 1wcg h ASP 142 CO 0.04 1.16 0.37 1.88 -1.72 0.00 0.00 179.24 180.98 1wcg h TYR 143 N 0.53 1.16 -0.52 4.55 0.05 -1.38 -2.35 116.97 119.01 1wcg h TYR 143 Ca 0.01 -0.06 -0.04 0.00 0.05 0.00 0.00 58.73 58.69 1wcg h TYR 143 Cb 1.12 -0.36 -0.02 0.00 1.01 0.00 0.00 36.73 38.48 1wcg h TYR 143 CO 0.06 0.85 0.16 0.35 -1.05 0.00 0.00 178.16 178.53 1wcg h PHE 144 N 1.13 0.83 -0.72 4.88 3.57 -0.99 -1.89 116.94 123.75 1wcg h PHE 144 Ca 0.27 -0.08 0.09 0.00 3.53 0.00 0.00 57.97 61.78 1wcg h PHE 144 Cb 0.13 -0.24 -0.07 0.00 2.79 0.00 0.00 35.95 38.56 1wcg h PHE 144 CO 0.01 0.72 0.37 -0.22 -2.23 0.00 0.00 178.31 176.96 1wcg h LYS 145 N 0.71 0.63 -0.16 1.11 3.64 -0.97 0.01 116.57 121.54 1wcg h LYS 145 Ca 0.17 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.38 1wcg h LYS 145 Cb 0.27 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1wcg h LYS 145 CO -0.01 0.41 -0.45 0.93 -2.27 0.00 0.00 179.45 178.07 1wcg h GLU 146 N 0.64 0.38 -0.06 1.90 4.39 -1.20 -0.89 114.58 119.74 1wcg h GLU 146 Ca 0.35 -0.20 -0.00 0.00 0.34 0.00 0.00 59.36 59.84 1wcg h GLU 146 Cb 0.33 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1wcg h GLU 146 CO -0.25 0.76 0.03 -0.92 -1.16 0.00 0.00 179.01 177.47 1wcg h TYR 147 N 0.31 0.09 -0.88 4.33 3.20 -0.69 -2.56 116.97 120.78 1wcg h TYR 147 Ca 0.02 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 61.95 1wcg h TYR 147 Cb 0.91 -0.03 -0.06 0.00 1.54 0.00 0.00 36.73 39.09 1wcg h TYR 147 CO 0.03 0.18 0.54 0.00 -1.64 0.00 0.00 178.16 177.27 1wcg h ALA 148 N 0.90 1.21 -0.57 1.82 0.00 -0.79 -1.48 119.26 120.35 1wcg h ALA 148 Ca 0.02 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.01 1wcg h ALA 148 Cb 0.12 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 1wcg h ALA 148 CO -0.00 0.28 0.20 -0.09 0.00 0.00 0.00 179.25 179.64 1wcg h ARG 149 N 0.98 0.36 -0.43 0.00 2.43 -0.94 -0.05 114.38 116.73 1wcg h ARG 149 Ca 0.39 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.48 1wcg h ARG 149 Cb 0.19 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 1wcg h ARG 149 CO -0.18 0.24 0.08 0.28 -1.51 0.00 0.00 179.97 178.88 1wcg h VAL 150 N 0.37 1.24 -0.38 0.20 2.07 -0.95 -1.09 116.25 117.71 1wcg h VAL 150 Ca 0.29 -0.86 0.01 0.00 0.82 0.00 0.00 66.70 66.95 1wcg h VAL 150 Cb 0.35 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1wcg h VAL 150 CO -0.30 0.30 0.24 -0.07 0.02 0.00 0.00 177.57 177.76 1wcg h LEU 151 N 0.57 0.41 -0.79 2.57 3.38 -0.62 -0.81 115.31 120.02 1wcg h LEU 151 Ca 0.13 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1wcg h LEU 151 Cb 0.36 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 1wcg h LEU 151 CO 0.01 0.30 0.44 -0.26 0.09 0.00 0.00 178.44 179.01 1wcg h PHE 152 N 0.49 1.08 -0.26 1.13 0.04 -0.92 -0.45 116.94 118.06 1wcg h PHE 152 Ca 0.14 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.87 1wcg h PHE 152 Cb -0.04 -0.35 -0.01 0.00 2.20 0.00 0.00 35.95 37.76 1wcg h PHE 152 CO -0.06 0.75 0.08 1.15 -0.60 0.00 0.00 178.31 179.63 1wcg h THR 153 N 1.09 1.19 0.00 -1.55 2.02 -0.74 -1.21 112.91 113.72 1wcg h THR 153 Ca 0.28 -0.62 -0.26 0.00 0.77 0.00 0.00 66.41 66.58 1wcg h THR 153 Cb 0.02 1.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.51 1wcg h THR 153 CO -0.05 0.20 -1.42 1.88 0.37 0.00 0.00 175.52 176.51 1wcg h TYR 154 N 0.25 0.02 0.00 3.16 -1.99 -1.10 -3.41 116.97 113.89 1wcg h TYR 154 Ca 0.08 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.80 1wcg h TYR 154 Cb 0.24 -0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.96 1wcg h TYR 154 CO 0.00 1.02 -0.61 1.19 -0.00 0.00 0.00 178.16 179.76 1wcg n PHE 155 N -3.18 0.00 0.51 4.88 3.72 -0.19 -4.76 117.46 118.44 1wcg n PHE 155 Ca -0.10 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.40 1wcg n PHE 155 Cb 1.01 -0.01 0.42 0.00 -0.94 0.00 0.00 39.48 39.96 1wcg n PHE 155 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wcg n GLY 156 N 1.86 -1.22 0.24 1.37 0.00 -0.46 -0.64 105.19 106.34 1wcg n GLY 156 Ca -0.00 0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.12 1wcg n GLY 156 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1wcg h ASP 157 N 0.00 0.00 0.00 1.61 2.03 -1.86 -3.34 116.42 114.86 1wcg h ASP 157 Ca 0.00 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.19 1wcg h ASP 157 Cb 0.36 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.84 1wcg h ASP 157 CO 0.00 0.18 -1.42 0.54 -1.03 0.00 0.00 179.24 177.51 1wcg n ARG 158 N -3.86 1.81 -3.05 4.15 1.74 -0.67 -4.98 116.66 111.79 1wcg n ARG 158 Ca -0.02 0.02 -0.41 0.00 -0.77 0.00 0.00 57.85 56.67 1wcg n ARG 158 Cb 0.27 -1.15 -0.06 0.00 -1.02 0.00 0.00 32.46 30.50 1wcg n ARG 158 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1wcg s VAL 159 N -2.15 4.96 -0.21 1.55 1.01 0.19 -4.88 120.40 120.86 1wcg s VAL 159 Ca -0.06 1.26 0.02 0.00 0.00 0.00 0.00 61.98 63.20 1wcg s VAL 159 Cb 0.02 -3.99 0.02 0.00 0.00 0.00 0.00 36.38 32.43 1wcg s VAL 159 CO 0.21 0.03 0.61 0.29 0.00 0.00 0.00 175.10 176.24 1wcg n LYS 160 N 5.59 -0.31 -3.83 2.72 4.76 -1.26 -4.49 118.16 121.34 1wcg n LYS 160 Ca 0.01 -0.72 -0.24 0.00 -2.87 0.00 0.00 58.31 54.48 1wcg n LYS 160 Cb 0.49 -1.04 -0.17 0.00 -1.84 0.00 0.00 35.03 32.47 1wcg n LYS 160 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1wcg s TRP 161 N -0.25 0.95 0.02 2.13 0.52 -1.26 -0.57 118.94 120.48 1wcg s TRP 161 Ca 0.02 -0.37 0.05 0.00 0.02 0.00 0.00 56.10 55.83 1wcg s TRP 161 Cb 0.02 -0.95 -0.02 0.00 -1.15 0.00 0.00 33.47 31.37 1wcg s TRP 161 CO 0.02 -0.39 -0.15 -1.58 0.02 0.00 0.00 176.95 174.88 1wcg s TRP 162 N 1.84 1.32 -0.15 -1.98 0.52 -0.18 -1.69 118.94 118.63 1wcg s TRP 162 Ca 0.04 -0.31 0.01 0.00 0.02 0.00 0.00 56.10 55.86 1wcg s TRP 162 Cb -0.12 -0.81 -0.00 0.00 -1.15 0.00 0.00 33.47 31.38 1wcg s TRP 162 CO -0.06 0.02 -0.17 0.42 0.02 0.00 0.00 176.95 177.18 1wcg s ILE 163 N -0.62 2.57 -0.02 2.03 -1.09 0.32 -1.15 121.20 123.23 1wcg s ILE 163 Ca 0.04 -0.81 -0.15 0.00 -2.23 0.00 0.00 60.65 57.51 1wcg s ILE 163 Cb -0.07 -2.07 -0.08 0.00 -1.58 0.00 0.00 42.46 38.66 1wcg s ILE 163 CO 0.01 0.52 0.67 0.71 -1.23 0.00 0.00 174.94 175.62 1wcg h THR 164 N 5.68 0.00 -3.59 2.92 1.35 -1.50 0.15 112.91 117.91 1wcg h THR 164 Ca -0.31 -0.46 -0.68 0.00 -0.55 0.00 0.00 66.41 64.40 1wcg h THR 164 Cb 1.19 0.00 -0.32 0.00 -1.73 0.00 0.00 68.15 67.29 1wcg h THR 164 CO 0.56 0.00 -0.88 -0.36 -0.25 0.00 0.00 175.52 174.59 1wcg s PHE 165 N -3.31 2.52 -0.21 4.73 0.08 -1.26 -1.15 117.98 119.37 1wcg s PHE 165 Ca -0.08 -0.93 -0.21 0.00 0.12 0.00 0.00 56.93 55.83 1wcg s PHE 165 Cb 0.01 -1.67 -0.02 0.00 -0.57 0.00 0.00 43.02 40.77 1wcg s PHE 165 CO 0.23 -0.34 0.66 1.21 -0.10 0.00 0.00 175.22 176.87 1wcg s ASN 166 N 0.15 6.69 -0.96 1.36 2.47 -0.52 -1.42 114.94 122.72 1wcg s ASN 166 Ca -0.13 0.85 -0.11 0.00 0.42 0.00 0.00 52.86 53.88 1wcg s ASN 166 Cb -0.16 -2.36 -0.00 0.00 -1.45 0.00 0.00 41.25 37.27 1wcg s ASN 166 CO 0.07 -0.32 0.72 -0.62 -3.72 0.00 0.00 177.10 173.23 1wcg n GLU 167 N 5.26 -1.28 0.03 0.43 1.02 -0.12 -4.75 120.64 121.22 1wcg n GLU 167 Ca -0.00 0.76 0.20 0.00 -0.02 0.00 0.00 57.16 58.09 1wcg n GLU 167 Cb 0.49 -3.90 0.70 0.00 -0.02 0.00 0.00 31.44 28.71 1wcg n GLU 167 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1wcg h PRO 168 N -0.94 0.00 -0.75 3.49 0.13 -1.83 -0.15 132.00 131.95 1wcg h PRO 168 Ca -0.51 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.60 1wcg h PRO 168 Cb 1.29 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.39 1wcg h PRO 168 CO 0.41 0.00 0.41 0.97 -0.23 0.00 0.00 178.00 179.56 1wcg h ILE 169 N 0.00 1.22 -0.30 -3.56 2.10 -1.92 -1.53 117.51 113.53 1wcg h ILE 169 Ca 0.23 -0.56 -0.17 0.00 1.08 0.00 0.00 64.86 65.45 1wcg h ILE 169 Cb 0.95 0.21 -0.00 0.00 -1.09 0.00 0.00 36.82 36.88 1wcg h ILE 169 CO -0.00 0.25 -0.47 0.00 -1.08 0.00 0.00 178.15 176.85 1wcg h ALA 170 N 1.40 0.60 -0.53 0.18 0.00 -1.36 -1.77 119.26 117.78 1wcg h ALA 170 Ca 0.27 -0.48 0.04 0.00 0.00 0.00 0.00 54.91 54.74 1wcg h ALA 170 Cb 0.03 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1wcg h ALA 170 CO -0.04 0.68 0.28 0.28 0.00 0.00 0.00 179.25 180.44 1wcg h VAL 171 N 0.64 0.97 -0.68 0.00 2.07 -1.15 -2.33 116.25 115.76 1wcg h VAL 171 Ca 0.03 -0.19 0.04 0.00 0.82 0.00 0.00 66.70 67.40 1wcg h VAL 171 Cb 1.05 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 1wcg h VAL 171 CO 0.10 0.10 0.42 0.00 0.02 0.00 0.00 177.57 178.21 1wcg h LYS 173 N 0.80 0.00 0.00 0.00 1.57 -0.81 -0.25 116.57 117.88 1wcg h LYS 173 Ca 0.28 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.02 1wcg h LYS 173 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1wcg h LYS 173 CO -0.13 0.07 -0.19 0.78 -0.57 0.00 0.00 179.45 179.42 1wcg h GLY 174 N 0.69 0.00 0.76 3.86 0.00 -0.98 -2.14 103.07 105.26 1wcg h GLY 174 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.02 1wcg h GLY 174 CO 0.01 0.00 -1.86 -1.72 0.00 0.00 0.00 176.54 172.97 1wcg n TYR 175 N -3.62 0.80 -0.12 5.60 4.01 -0.22 -1.48 117.16 122.14 1wcg n TYR 175 Ca -0.01 0.28 -0.15 0.00 -0.16 0.00 0.00 57.90 57.86 1wcg n TYR 175 Cb 0.32 -1.15 -0.13 0.00 -0.31 0.00 0.00 39.34 38.07 1wcg n TYR 175 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1wcg n SER 176 N -3.01 1.29 -0.72 7.72 3.41 -0.52 -1.01 113.62 120.78 1wcg n SER 176 Ca -0.21 -0.09 0.03 0.00 -0.26 0.00 0.00 58.87 58.35 1wcg n SER 176 Cb 1.07 0.10 0.05 0.00 -0.26 0.00 0.00 64.21 65.18 1wcg n SER 176 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1wcg n ILE 177 N -3.07 0.55 -3.88 -1.33 -5.35 -0.82 -1.10 119.36 104.37 1wcg n ILE 177 Ca -0.41 -1.00 -0.28 0.00 -0.27 0.00 0.00 62.75 60.79 1wcg n ILE 177 Cb 1.05 0.44 0.03 0.00 -1.74 0.00 0.00 39.64 39.41 1wcg n ILE 177 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1wcg n LYS 178 N -0.22 -5.32 -0.01 6.28 5.02 -0.12 -4.88 118.16 118.91 1wcg n LYS 178 Ca 0.06 0.59 0.10 0.00 -2.02 0.00 0.00 58.31 57.05 1wcg n LYS 178 Cb 0.81 -5.39 -0.15 0.00 -0.02 0.00 0.00 35.03 30.28 1wcg n LYS 178 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wcg n ALA 179 N -4.59 3.14 -3.43 7.82 0.00 -1.14 -4.94 120.51 117.36 1wcg n ALA 179 Ca -0.04 -0.51 -0.08 0.00 0.00 0.00 0.00 53.44 52.80 1wcg n ALA 179 Cb 0.56 -0.72 -0.04 0.00 0.00 0.00 0.00 19.45 19.25 1wcg n ALA 179 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1wcg s TYR 180 N -3.36 0.10 0.49 0.00 2.02 -1.26 -4.75 117.35 110.60 1wcg s TYR 180 Ca -0.05 -0.50 -0.23 0.00 -0.37 0.00 0.00 57.07 55.93 1wcg s TYR 180 Cb 0.14 0.40 -0.08 0.00 -0.40 0.00 0.00 41.96 42.02 1wcg s TYR 180 CO 0.87 -1.07 1.17 0.00 -1.57 0.00 0.00 175.55 174.95 1wcg n ALA 181 N -0.40 0.89 1.39 3.71 0.00 -1.26 -0.23 120.51 124.60 1wcg n ALA 181 Ca -0.04 0.17 0.01 0.00 0.00 0.00 0.00 53.44 53.59 1wcg n ALA 181 Cb 0.61 -2.21 0.05 0.00 0.00 0.00 0.00 19.45 17.89 1wcg n ALA 181 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1wcg n PRO 182 N -0.39 1.32 -3.06 0.00 -0.04 -1.23 -4.50 135.00 127.11 1wcg n PRO 182 Ca 0.09 -0.38 -0.13 0.00 -0.04 0.00 0.00 63.50 63.05 1wcg n PRO 182 Cb 0.42 -1.24 0.06 0.00 -0.04 0.00 0.00 33.50 32.70 1wcg n PRO 182 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1wcg n ASN 183 N -0.12 -3.12 -4.83 3.54 5.15 0.68 -5.02 115.26 111.54 1wcg n ASN 183 Ca 0.03 -0.39 -0.22 0.00 -0.60 0.00 0.00 54.58 53.41 1wcg n ASN 183 Cb 0.18 -3.56 -0.04 0.00 -0.53 0.00 0.00 39.78 35.83 1wcg n ASN 183 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1wcg s LEU 184 N -5.02 3.67 -0.46 1.20 1.43 -0.55 -4.77 118.68 114.19 1wcg s LEU 184 Ca 0.15 -0.40 0.07 0.00 -1.03 0.00 0.00 54.13 52.92 1wcg s LEU 184 Cb -0.07 -2.24 0.40 0.00 0.03 0.00 0.00 46.19 44.31 1wcg s LEU 184 CO 0.49 -0.20 1.01 -3.20 0.23 0.00 0.00 176.35 174.68 1wcg n ASN 185 N -1.26 3.88 0.00 2.29 5.15 -1.20 -0.94 115.26 123.17 1wcg n ASN 185 Ca -0.05 -3.51 0.14 0.00 -0.60 0.00 0.00 54.58 50.57 1wcg n ASN 185 Cb 0.59 -0.51 0.73 0.00 -0.53 0.00 0.00 39.78 40.06 1wcg n ASN 185 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1wcg n LEU 186 N -0.29 0.00 0.00 1.20 4.77 -0.18 -4.90 117.00 117.59 1wcg n LEU 186 Ca 0.31 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.59 1wcg n LEU 186 Cb 0.60 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 1wcg n LEU 186 CO 0.31 -0.01 0.00 0.29 -1.33 0.00 0.00 177.39 176.66 1wcg n LYS 187 N -1.30 0.00 0.15 3.23 5.02 -0.26 -2.92 118.16 122.08 1wcg n LYS 187 Ca 0.13 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.47 1wcg n LYS 187 Cb 0.24 0.00 0.46 0.00 -0.02 0.00 0.00 35.03 35.72 1wcg n LYS 187 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1wcg h THR 188 N 0.00 1.12 -0.21 -0.18 1.35 -1.95 -0.95 112.91 112.10 1wcg h THR 188 Ca 0.00 -0.51 0.05 0.00 -0.55 0.00 0.00 66.41 65.39 1wcg h THR 188 Cb 0.00 1.09 -0.04 0.00 -1.73 0.00 0.00 68.15 67.46 1wcg h THR 188 CO 0.00 0.16 -0.07 0.74 -0.25 0.00 0.00 175.52 176.10 1wcg h THR 189 N 0.19 0.74 -0.34 6.82 2.02 -1.90 -1.79 112.91 118.65 1wcg h THR 189 Ca 0.04 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.10 1wcg h THR 189 Cb 0.23 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 1wcg h THR 189 CO 0.01 0.00 -0.27 1.23 0.37 0.00 0.00 175.52 176.86 1wcg h GLY 190 N -0.04 0.76 0.11 2.16 0.00 -1.24 -2.76 103.07 102.07 1wcg h GLY 190 Ca 0.11 -0.68 0.06 0.00 0.00 0.00 0.00 47.33 46.83 1wcg h GLY 190 CO -0.24 0.61 -0.25 0.84 0.00 0.00 0.00 176.54 177.51 1wcg h HIS 191 N 0.61 -0.67 -0.04 5.60 6.17 -0.69 -1.22 115.15 124.90 1wcg h HIS 191 Ca 0.08 0.04 -0.18 0.00 0.71 0.00 0.00 60.37 61.02 1wcg h HIS 191 Cb 0.77 0.33 -0.01 0.00 2.52 0.00 0.00 27.41 31.03 1wcg h HIS 191 CO 0.04 -0.33 -0.76 1.88 0.71 0.00 0.00 177.93 179.47 1wcg h TYR 192 N -0.25 0.40 -0.57 5.26 0.05 -1.34 -2.32 116.97 118.21 1wcg h TYR 192 Ca 0.14 -0.19 0.00 0.00 0.05 0.00 0.00 58.73 58.74 1wcg h TYR 192 Cb 0.47 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 38.12 1wcg h TYR 192 CO -0.41 0.95 0.37 -0.07 -1.05 0.00 0.00 178.16 177.94 1wcg h LEU 193 N 0.19 0.67 -0.77 3.88 3.38 -1.18 -1.07 115.31 120.40 1wcg h LEU 193 Ca -0.03 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 1wcg h LEU 193 Cb 1.34 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 1wcg h LEU 193 CO 0.12 0.50 -0.14 0.00 0.09 0.00 0.00 178.44 179.01 1wcg h ALA 194 N 1.20 0.95 -0.56 1.53 0.00 -1.16 -2.35 119.26 118.86 1wcg h ALA 194 Ca 0.21 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 1wcg h ALA 194 Cb -0.06 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1wcg h ALA 194 CO -0.04 0.61 0.06 0.78 0.00 0.00 0.00 179.25 180.66 1wcg h GLY 195 N 0.97 1.03 0.94 0.00 0.00 -1.16 -2.30 103.07 102.54 1wcg h GLY 195 Ca 0.11 -0.71 -0.03 0.00 0.00 0.00 0.00 47.33 46.70 1wcg h GLY 195 CO 0.04 0.66 0.14 0.84 0.00 0.00 0.00 176.54 178.22 1wcg h HIS 196 N 0.85 0.61 -0.45 5.60 6.17 -1.06 -1.46 115.15 125.41 1wcg h HIS 196 Ca 0.17 -0.05 -0.09 0.00 0.71 0.00 0.00 60.37 61.10 1wcg h HIS 196 Cb 0.46 -0.18 -0.01 0.00 2.52 0.00 0.00 27.41 30.20 1wcg h HIS 196 CO 0.03 0.56 -0.08 1.15 0.71 0.00 0.00 177.93 180.30 1wcg h THR 197 N 0.48 1.27 -0.80 6.26 2.02 -1.39 -1.23 112.91 119.53 1wcg h THR 197 Ca 0.13 -1.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.11 1wcg h THR 197 Cb 0.22 1.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.72 1wcg h THR 197 CO -0.01 0.41 0.48 1.56 0.37 0.00 0.00 175.52 178.33 1wcg h GLN 198 N 0.68 1.09 -0.25 6.66 4.20 -1.30 -0.34 115.11 125.85 1wcg h GLN 198 Ca 0.12 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 1wcg h GLN 198 Cb 0.62 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1wcg h GLN 198 CO 0.04 0.77 0.11 -0.07 -0.67 0.00 0.00 178.83 179.01 1wcg h LEU 199 N 1.10 0.34 -0.97 1.46 3.38 -0.94 0.21 115.31 119.89 1wcg h LEU 199 Ca 0.29 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1wcg h LEU 199 Cb -0.03 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1wcg h LEU 199 CO -0.05 0.40 0.41 0.40 0.09 0.00 0.00 178.44 179.68 1wcg h ILE 200 N 0.26 1.24 -0.35 1.22 2.04 -1.06 -0.96 117.51 119.90 1wcg h ILE 200 Ca 0.08 -0.66 0.01 0.00 1.00 0.00 0.00 64.86 65.30 1wcg h ILE 200 Cb 0.16 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 1wcg h ILE 200 CO -0.01 0.29 0.22 0.00 0.00 0.00 0.00 178.15 178.64 1wcg h ALA 201 N 1.31 0.45 -0.13 1.87 0.00 -0.75 -0.09 119.26 121.92 1wcg h ALA 201 Ca 0.28 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.21 1wcg h ALA 201 Cb 0.08 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1wcg h ALA 201 CO -0.04 -0.13 -0.08 1.25 0.00 0.00 0.00 179.25 180.25 1wcg h HIS 202 N 0.44 -0.19 -0.56 0.00 -0.00 -0.47 -0.70 115.15 113.67 1wcg h HIS 202 Ca 0.14 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.53 1wcg h HIS 202 Cb -0.01 0.10 -0.03 0.00 -0.00 0.00 0.00 27.41 27.47 1wcg h HIS 202 CO -0.07 -0.12 0.36 0.78 -0.00 0.00 0.00 177.93 178.88 1wcg h GLY 203 N -0.08 0.79 1.01 5.26 0.00 -0.90 -0.52 103.07 108.63 1wcg h GLY 203 Ca 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 1wcg h GLY 203 CO -0.18 0.30 0.40 0.50 0.00 0.00 0.00 176.54 177.56 1wcg h LYS 204 N 0.76 0.99 -0.50 4.80 1.57 -0.80 -1.13 116.57 122.27 1wcg h LYS 204 Ca 0.20 -0.11 -0.08 0.00 -1.87 0.00 0.00 60.65 58.79 1wcg h LYS 204 Cb -0.07 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.02 1wcg h LYS 204 CO -0.04 0.74 -0.01 0.00 -0.57 0.00 0.00 179.45 179.56 1wcg h ALA 205 N 1.20 0.68 -0.35 3.86 0.00 -0.77 -1.18 119.26 122.70 1wcg h ALA 205 Ca 0.25 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1wcg h ALA 205 Cb 0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1wcg h ALA 205 CO -0.04 0.50 0.13 -0.92 0.00 0.00 0.00 179.25 178.92 1wcg h TYR 206 N 0.76 0.55 -0.22 0.00 3.20 -0.86 -1.18 116.97 119.21 1wcg h TYR 206 Ca 0.14 -0.05 -0.14 0.00 3.14 0.00 0.00 58.73 61.83 1wcg h TYR 206 Cb 0.54 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 1wcg h TYR 206 CO 0.04 0.52 -0.44 0.00 -1.64 0.00 0.00 178.16 176.64 1wcg h ARG 207 N 0.42 0.53 -0.30 1.82 2.47 -1.16 -0.42 114.38 117.75 1wcg h ARG 207 Ca 0.12 -0.28 0.02 0.00 -1.26 0.00 0.00 59.98 58.57 1wcg h ARG 207 Cb 0.21 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 28.52 1wcg h ARG 207 CO -0.01 0.87 0.15 1.25 0.56 0.00 0.00 179.97 182.79 1wcg h LEU 208 N 0.43 0.21 -0.04 3.04 5.85 -1.10 -1.40 115.31 122.30 1wcg h LEU 208 Ca 0.03 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.79 1wcg h LEU 208 Cb 0.94 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.92 1wcg h LEU 208 CO 0.08 0.16 -0.08 0.22 -0.34 0.00 0.00 178.44 178.48 1wcg h TYR 209 N 0.31 -0.20 -0.75 1.25 3.20 -0.83 -0.24 116.97 119.70 1wcg h TYR 209 Ca 0.13 0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.11 1wcg h TYR 209 Cb 0.05 0.10 -0.08 0.00 1.54 0.00 0.00 36.73 38.34 1wcg h TYR 209 CO -0.10 -0.13 0.38 1.49 -1.64 0.00 0.00 178.16 178.16 1wcg h GLU 210 N -0.12 0.60 0.16 1.82 4.81 -0.85 0.25 114.58 121.26 1wcg h GLU 210 Ca 0.05 -0.04 -0.22 0.00 -0.13 0.00 0.00 59.36 59.02 1wcg h GLU 210 Cb 0.19 -0.14 0.03 0.00 0.63 0.00 0.00 28.75 29.46 1wcg h GLU 210 CO -0.12 0.40 -0.96 0.93 -0.73 0.00 0.00 179.01 178.53 1wcg h GLU 211 N 0.62 0.37 0.00 1.92 4.39 -1.05 -3.40 114.58 117.43 1wcg h GLU 211 Ca 0.38 -0.61 -0.02 0.00 0.34 0.00 0.00 59.36 59.45 1wcg h GLU 211 Cb 0.43 0.22 -0.00 0.00 -0.10 0.00 0.00 28.75 29.30 1wcg h GLU 211 CO -0.29 1.29 -1.62 -1.33 -1.16 0.00 0.00 179.01 175.90 1wcg n MET 212 N -4.03 0.51 0.00 2.33 2.81 -0.12 -4.83 117.12 113.79 1wcg n MET 212 Ca -0.14 -0.11 0.00 0.00 -1.81 0.00 0.00 57.70 55.63 1wcg n MET 212 Cb 0.88 -1.31 0.00 0.00 -0.71 0.00 0.00 33.22 32.08 1wcg n MET 212 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1wcg n PHE 213 N -1.99 0.00 -0.33 2.03 3.72 -0.27 -4.83 117.46 115.79 1wcg n PHE 213 Ca -0.04 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.41 1wcg n PHE 213 Cb 0.38 0.01 0.20 0.00 -0.94 0.00 0.00 39.48 39.13 1wcg n PHE 213 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1wcg h LYS 214 N 0.00 0.88 -0.75 -1.08 3.64 -0.78 0.95 116.57 119.43 1wcg h LYS 214 Ca 0.00 -0.05 0.17 0.00 -1.27 0.00 0.00 60.65 59.49 1wcg h LYS 214 Cb 0.73 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 32.31 1wcg h LYS 214 CO 0.00 0.58 0.51 -1.35 -2.27 0.00 0.00 179.45 176.92 1wcg h PRO 215 N 0.91 0.31 0.00 1.90 0.11 -1.82 0.61 132.00 134.02 1wcg h PRO 215 Ca 0.44 -0.02 -0.37 0.00 0.11 0.00 0.00 66.00 66.16 1wcg h PRO 215 Cb 0.40 -0.07 -0.07 0.00 0.11 0.00 0.00 31.00 31.37 1wcg h PRO 215 CO -0.25 0.20 -2.37 0.25 -0.21 0.00 0.00 178.00 175.62 1wcg n THR 216 N -4.45 1.41 -0.06 -1.15 -2.24 -0.85 -4.70 114.28 102.24 1wcg n THR 216 Ca 0.15 -0.82 -0.09 0.00 -2.27 0.00 0.00 64.05 61.02 1wcg n THR 216 Cb 0.60 -0.62 -0.15 0.00 -2.10 0.00 0.00 70.33 68.06 1wcg n THR 216 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wcg n GLN 217 N -2.84 0.66 -3.65 -0.78 6.02 0.27 -5.01 117.38 112.06 1wcg n GLN 217 Ca -0.34 0.13 -0.22 0.00 -0.01 0.00 0.00 57.00 56.56 1wcg n GLN 217 Cb 1.13 -1.65 0.05 0.00 1.02 0.00 0.00 30.24 30.79 1wcg n GLN 217 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1wcg n ASN 218 N -2.87 -2.46 -3.08 1.08 4.05 0.18 -4.95 115.26 107.21 1wcg n ASN 218 Ca -0.25 -0.73 -0.09 0.00 0.45 0.00 0.00 54.58 53.96 1wcg n ASN 218 Cb 1.09 -4.40 0.01 0.00 1.23 0.00 0.00 39.78 37.71 1wcg n ASN 218 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1wcg n GLY 219 N -1.52 2.57 3.16 8.20 0.00 -1.26 -5.00 105.19 111.33 1wcg n GLY 219 Ca -0.21 -2.20 -0.21 0.00 0.00 0.00 0.00 46.02 43.40 1wcg n GLY 219 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wcg s LYS 220 N -2.90 1.01 -0.01 1.61 1.02 0.26 -5.01 119.74 115.72 1wcg s LYS 220 Ca 0.16 -0.79 0.04 0.00 0.02 0.00 0.00 55.97 55.40 1wcg s LYS 220 Cb -0.01 -1.03 -0.01 0.00 -0.52 0.00 0.00 37.83 36.25 1wcg s LYS 220 CO 0.10 0.26 -0.14 0.42 -0.92 0.00 0.00 175.35 175.06 1wcg s ILE 221 N -0.84 1.14 0.00 2.17 1.01 -1.26 -1.01 121.20 122.41 1wcg s ILE 221 Ca 0.02 -0.61 0.00 0.00 0.00 0.00 0.00 60.65 60.06 1wcg s ILE 221 Cb -0.08 -0.95 0.00 0.00 0.01 0.00 0.00 42.46 41.44 1wcg s ILE 221 CO 0.01 0.32 0.00 -0.24 0.00 0.00 0.00 174.94 175.04 1wcg n SER 222 N 2.75 0.00 -3.76 3.58 2.88 -0.30 -0.88 113.62 117.89 1wcg n SER 222 Ca -0.14 -0.83 -0.15 0.00 -1.33 0.00 0.00 58.87 56.42 1wcg n SER 222 Cb 0.55 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.85 1wcg n SER 222 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 1wcg s ILE 223 N -2.03 -0.06 -0.71 2.46 2.07 -1.26 -1.35 121.20 120.32 1wcg s ILE 223 Ca 0.00 0.22 -0.24 0.00 -1.41 0.00 0.00 60.65 59.21 1wcg s ILE 223 Cb 0.00 -0.13 0.05 0.00 0.13 0.00 0.00 42.46 42.52 1wcg s ILE 223 CO 0.00 0.09 1.12 -0.44 -1.91 0.00 0.00 174.94 173.80 1wcg s SER 224 N 1.15 6.19 -0.16 4.50 0.01 -0.51 -4.02 113.70 120.85 1wcg s SER 224 Ca -0.09 -0.80 -0.17 0.00 1.31 0.00 0.00 55.95 56.20 1wcg s SER 224 Cb -0.13 -2.48 -0.04 0.00 0.21 0.00 0.00 66.02 63.58 1wcg s SER 224 CO -0.04 -1.61 0.44 -0.63 0.41 0.00 0.00 173.24 171.82 1wcg s ILE 225 N 4.77 5.19 0.00 1.44 1.01 -0.50 -0.94 121.20 132.17 1wcg s ILE 225 Ca 0.29 0.85 0.00 0.00 0.00 0.00 0.00 60.65 61.78 1wcg s ILE 225 Cb -0.12 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.57 1wcg s ILE 225 CO 0.11 0.29 0.00 -1.54 0.00 0.00 0.00 174.94 173.80 1wcg n SER 226 N 4.04 1.80 0.00 3.58 3.41 -1.26 -2.27 113.62 122.92 1wcg n SER 226 Ca -0.07 -0.69 0.00 0.00 -0.26 0.00 0.00 58.87 57.85 1wcg n SER 226 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 1wcg n SER 226 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wcg n GLY 227 N 5.00 4.14 3.73 5.00 0.00 -1.26 -4.52 105.19 117.28 1wcg n GLY 227 Ca 0.00 -1.61 -0.41 0.00 0.00 0.00 0.00 46.02 44.00 1wcg n GLY 227 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wcg s VAL 228 N -2.21 3.82 0.12 1.61 1.01 -1.26 -4.69 120.40 118.80 1wcg s VAL 228 Ca 0.00 1.48 -0.21 0.00 0.00 0.00 0.00 61.98 63.25 1wcg s VAL 228 Cb 0.00 -3.95 -0.07 0.00 0.00 0.00 0.00 36.38 32.36 1wcg s VAL 228 CO 0.00 0.22 0.65 0.12 0.00 0.00 0.00 175.10 176.09 1wcg s PHE 229 N 0.14 3.83 -0.08 5.22 5.36 -0.91 -4.92 117.98 126.62 1wcg s PHE 229 Ca 0.53 1.41 0.03 0.00 -0.96 0.00 0.00 56.93 57.94 1wcg s PHE 229 Cb -0.30 -2.60 -0.02 0.00 -0.34 0.00 0.00 43.02 39.76 1wcg s PHE 229 CO 0.34 0.55 -0.17 -0.06 -1.46 0.00 0.00 175.22 174.41 1wcg s PHE 230 N -1.15 2.65 0.12 10.12 0.08 -1.26 -0.64 117.98 127.90 1wcg s PHE 230 Ca 0.32 -0.51 0.08 0.00 0.12 0.00 0.00 56.93 56.94 1wcg s PHE 230 Cb -0.21 -1.69 -0.04 0.00 -0.57 0.00 0.00 43.02 40.52 1wcg s PHE 230 CO 0.22 -0.08 -0.18 -1.64 -0.10 0.00 0.00 175.22 173.44 1wcg s MET 231 N -0.18 1.11 0.23 0.44 -1.94 -0.64 -4.86 119.30 113.46 1wcg s MET 231 Ca -0.01 -1.21 -0.30 0.00 -1.71 0.00 0.00 55.69 52.46 1wcg s MET 231 Cb -0.13 -1.23 -0.10 0.00 2.01 0.00 0.00 34.83 35.37 1wcg s MET 231 CO 0.03 0.27 1.46 -1.25 -0.01 0.00 0.00 175.02 175.52 1wcg s PRO 232 N -2.21 4.26 0.16 2.03 0.04 -1.26 -0.82 135.00 137.20 1wcg s PRO 232 Ca 0.08 2.31 -0.16 0.00 0.04 0.00 0.00 61.00 63.27 1wcg s PRO 232 Cb -0.08 -3.12 0.04 0.00 0.04 0.00 0.00 34.50 31.38 1wcg s PRO 232 CO 0.04 -0.45 1.79 -0.22 0.04 0.00 0.00 177.00 178.20 1wcg h LYS 233 N 5.33 0.42 -4.60 4.56 3.64 -1.44 -3.33 116.57 121.16 1wcg h LYS 233 Ca -0.45 -0.03 -0.70 0.00 -1.27 0.00 0.00 60.65 58.20 1wcg h LYS 233 Cb 1.22 -0.10 -0.28 0.00 -0.41 0.00 0.00 32.23 32.66 1wcg h LYS 233 CO 0.80 0.28 -0.55 1.21 -2.27 0.00 0.00 179.45 178.92 1wcg s ASN 234 N -5.47 5.50 0.47 4.20 3.84 -1.26 -4.98 114.94 117.23 1wcg s ASN 234 Ca -0.13 -1.21 0.32 0.00 0.21 0.00 0.00 52.86 52.05 1wcg s ASN 234 Cb 0.11 -1.93 1.55 0.00 -0.55 0.00 0.00 41.25 40.43 1wcg s ASN 234 CO 0.72 -0.40 1.96 0.00 -2.79 0.00 0.00 177.10 176.60 1wcg h ALA 235 N 8.31 1.00 -0.12 1.71 0.00 -1.99 -1.38 119.26 126.80 1wcg h ALA 235 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1wcg h ALA 235 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1wcg h ALA 235 CO 0.66 0.00 0.00 0.39 0.00 0.00 0.00 179.25 180.30 1wcg n GLU 236 N -2.71 2.12 -3.27 0.00 -0.58 -1.26 -4.89 120.64 110.05 1wcg n GLU 236 Ca -0.01 -1.64 -0.40 0.00 -0.42 0.00 0.00 57.16 54.69 1wcg n GLU 236 Cb 0.16 -1.47 -0.08 0.00 -0.57 0.00 0.00 31.44 29.48 1wcg n GLU 236 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1wcg s SER 237 N -1.83 6.35 0.29 1.62 0.15 -0.52 -4.95 113.70 114.80 1wcg s SER 237 Ca 0.33 0.24 -0.01 0.00 0.70 0.00 0.00 55.95 57.22 1wcg s SER 237 Cb 0.20 -2.26 0.47 0.00 -1.71 0.00 0.00 66.02 62.72 1wcg s SER 237 CO 0.31 -0.35 1.91 0.44 1.20 0.00 0.00 173.24 176.75 1wcg h ASP 238 N 8.24 0.97 -0.22 5.45 3.32 -1.90 -0.81 116.42 131.46 1wcg h ASP 238 Ca -0.29 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.76 1wcg h ASP 238 Cb 1.14 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.47 1wcg h ASP 238 CO 0.72 0.63 0.13 0.44 -1.72 0.00 0.00 179.24 179.45 1wcg h ASP 239 N 1.10 0.27 -0.32 6.45 3.32 -1.94 -1.17 116.42 124.12 1wcg h ASP 239 Ca 0.39 -0.06 -0.08 0.00 0.02 0.00 0.00 57.03 57.31 1wcg h ASP 239 Cb 0.14 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 1wcg h ASP 239 CO -0.14 0.25 -0.06 0.44 -1.72 0.00 0.00 179.24 178.00 1wcg h ASP 240 N 0.27 0.69 -0.55 6.45 5.19 -1.75 -0.26 116.42 126.45 1wcg h ASP 240 Ca 0.08 -0.18 -0.02 0.00 -0.62 0.00 0.00 57.03 56.29 1wcg h ASP 240 Cb 0.03 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 39.33 1wcg h ASP 240 CO -0.01 0.80 0.29 0.40 -3.12 0.00 0.00 179.24 177.60 1wcg h ILE 241 N 0.66 1.19 -0.50 0.35 2.04 -0.95 0.06 117.51 120.36 1wcg h ILE 241 Ca 0.12 -0.52 -0.06 0.00 1.00 0.00 0.00 64.86 65.41 1wcg h ILE 241 Cb 0.50 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 1wcg h ILE 241 CO 0.03 0.21 0.10 -0.08 0.00 0.00 0.00 178.15 178.41 1wcg h GLU 242 N 0.74 0.82 -0.58 2.37 4.57 -0.92 -1.82 114.58 119.76 1wcg h GLU 242 Ca 0.19 -0.21 0.03 0.00 -1.18 0.00 0.00 59.36 58.19 1wcg h GLU 242 Cb 0.08 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 28.53 1wcg h GLU 242 CO -0.03 0.80 0.35 1.15 -1.18 0.00 0.00 179.01 180.11 1wcg h THR 243 N 0.70 1.07 -0.63 0.32 2.02 -0.76 -1.18 112.91 114.45 1wcg h THR 243 Ca 0.15 -0.24 -0.03 0.00 0.77 0.00 0.00 66.41 67.06 1wcg h THR 243 Cb 0.37 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 1wcg h THR 243 CO 0.01 0.13 0.27 0.00 0.37 0.00 0.00 175.52 176.30 1wcg h ALA 244 N 1.25 0.82 -0.51 6.16 0.00 -0.78 0.42 119.26 126.61 1wcg h ALA 244 Ca 0.23 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1wcg h ALA 244 Cb 0.02 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1wcg h ALA 244 CO -0.10 0.42 0.26 1.49 0.00 0.00 0.00 179.25 181.32 1wcg h GLU 245 N 0.88 0.73 -0.30 0.00 4.57 -1.01 0.33 114.58 119.78 1wcg h GLU 245 Ca 0.21 -0.10 -0.01 0.00 -1.18 0.00 0.00 59.36 58.29 1wcg h GLU 245 Cb 0.17 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 1wcg h GLU 245 CO -0.02 0.59 0.15 -0.09 -1.18 0.00 0.00 179.01 178.46 1wcg h ARG 246 N 0.68 0.43 -0.82 1.92 2.43 -0.96 -0.61 114.38 117.46 1wcg h ARG 246 Ca 0.18 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1wcg h ARG 246 Cb 0.09 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.52 1wcg h ARG 246 CO -0.03 0.39 0.53 0.00 -1.51 0.00 0.00 179.97 179.35 1wcg h ALA 247 N 1.02 1.05 -0.49 2.80 0.00 -0.70 -0.61 119.26 122.32 1wcg h ALA 247 Ca 0.10 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1wcg h ALA 247 Cb 0.10 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1wcg h ALA 247 CO -0.01 0.48 0.05 -0.91 0.00 0.00 0.00 179.25 178.85 1wcg h ASN 248 N 1.12 0.80 -0.65 0.00 -0.26 -0.72 -0.82 115.58 115.04 1wcg h ASN 248 Ca 0.30 -0.28 -0.04 0.00 -0.56 0.00 0.00 56.30 55.72 1wcg h ASN 248 Cb -0.10 -0.21 -0.03 0.00 -1.06 0.00 0.00 38.32 36.92 1wcg h ASN 248 CO -0.06 0.88 0.26 1.56 -1.06 0.00 0.00 177.43 179.01 1wcg h GLN 249 N 0.70 0.98 -0.27 0.81 1.08 -0.81 -1.48 115.11 116.11 1wcg h GLN 249 Ca 0.14 -0.18 -0.06 0.00 -1.45 0.00 0.00 58.65 57.11 1wcg h GLN 249 Cb 0.44 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 27.69 1wcg h GLN 249 CO 0.01 0.82 -0.09 0.74 -0.95 0.00 0.00 178.83 179.37 1wcg h PHE 250 N 0.92 0.46 0.02 2.96 -1.00 -0.94 0.14 116.94 119.51 1wcg h PHE 250 Ca 0.22 -0.06 -0.00 0.00 2.81 0.00 0.00 57.97 60.94 1wcg h PHE 250 Cb 0.21 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 39.64 1wcg h PHE 250 CO 0.01 0.52 -0.01 1.49 -1.61 0.00 0.00 178.31 178.72 1wcg h GLU 251 N 0.41 -0.03 0.00 1.51 4.57 -0.82 -3.39 114.58 116.82 1wcg h GLU 251 Ca 0.08 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 1wcg h GLU 251 Cb 0.41 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1wcg h GLU 251 CO 0.02 0.65 -0.84 2.89 -1.18 0.00 0.00 179.01 180.56 1wcg n ARG 252 N -4.71 2.36 0.17 1.92 1.85 -0.59 -4.64 116.66 113.04 1wcg n ARG 252 Ca -0.08 0.00 0.06 0.00 -1.00 0.00 0.00 57.85 56.83 1wcg n ARG 252 Cb 0.34 -0.92 0.54 0.00 -1.05 0.00 0.00 32.46 31.37 1wcg n ARG 252 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 1wcg h GLY 253 N 0.00 0.17 -0.88 2.89 0.00 -0.97 -1.30 103.07 102.98 1wcg h GLY 253 Ca 0.00 -0.07 0.26 0.00 0.00 0.00 0.00 47.33 47.51 1wcg h GLY 253 CO 0.00 0.07 0.03 -0.25 0.00 0.00 0.00 176.54 176.39 1wcg h TRP 254 N 0.16 -0.05 0.01 5.60 7.01 -0.99 0.94 115.95 128.64 1wcg h TRP 254 Ca 0.04 0.07 -0.37 0.00 2.11 0.00 0.00 58.89 60.74 1wcg h TRP 254 Cb 0.07 0.18 -0.06 0.00 -2.10 0.00 0.00 29.16 27.25 1wcg h TRP 254 CO 0.00 -0.40 -2.29 1.19 -2.79 0.00 0.00 178.44 174.14 1wcg n PHE 255 N -5.47 0.26 0.04 2.65 3.72 -0.96 -4.48 117.46 113.22 1wcg n PHE 255 Ca 0.22 0.07 -0.13 0.00 -0.05 0.00 0.00 57.45 57.56 1wcg n PHE 255 Cb 0.72 -1.04 -0.03 0.00 -0.94 0.00 0.00 39.48 38.19 1wcg n PHE 255 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1wcg h GLY 256 N 2.93 0.58 0.89 1.37 0.00 -0.99 -3.24 103.07 104.60 1wcg h GLY 256 Ca -0.51 -0.89 -0.01 0.00 0.00 0.00 0.00 47.33 45.92 1wcg h GLY 256 CO 0.00 0.79 0.08 0.84 0.00 0.00 0.00 176.54 178.25 1wcg h HIS 257 N 0.34 0.32 -0.64 5.60 -0.00 -1.05 -0.48 115.15 119.23 1wcg h HIS 257 Ca -0.06 -0.02 0.03 0.00 -0.00 0.00 0.00 60.37 60.31 1wcg h HIS 257 Cb 1.44 -0.09 -0.03 0.00 -0.00 0.00 0.00 27.41 28.72 1wcg h HIS 257 CO 0.06 0.36 0.43 -1.35 -0.00 0.00 0.00 177.93 177.43 1wcg h PRO 258 N 0.18 0.77 0.02 5.26 0.11 -1.24 0.20 132.00 137.30 1wcg h PRO 258 Ca 0.07 -0.05 -0.22 0.00 0.11 0.00 0.00 66.00 65.91 1wcg h PRO 258 Cb 0.18 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 1wcg h PRO 258 CO -0.01 0.51 -1.03 -0.24 -0.21 0.00 0.00 178.00 177.03 1wcg h VAL 259 N 0.79 1.68 0.00 3.15 3.04 -1.50 -3.04 116.25 120.38 1wcg h VAL 259 Ca 0.25 -3.35 -0.27 0.00 -1.01 0.00 0.00 66.70 62.33 1wcg h VAL 259 Cb 0.03 2.85 -0.05 0.00 -2.01 0.00 0.00 31.29 32.11 1wcg h VAL 259 CO -0.07 0.96 -1.97 -1.22 -1.01 0.00 0.00 177.57 174.27 1wcg n TYR 260 N -3.39 0.00 -0.02 3.17 4.01 -0.22 -0.26 117.16 120.46 1wcg n TYR 260 Ca -0.01 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.76 1wcg n TYR 260 Cb 0.94 -0.64 -0.09 0.00 -0.31 0.00 0.00 39.34 39.24 1wcg n TYR 260 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1wcg n LYS 261 N -3.21 0.79 0.00 -0.72 5.02 0.47 -4.55 118.16 115.95 1wcg n LYS 261 Ca -0.31 -0.09 0.00 0.00 -2.02 0.00 0.00 58.31 55.89 1wcg n LYS 261 Cb 0.80 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.52 1wcg n LYS 261 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wcg n GLY 262 N 1.94 1.64 0.61 0.72 0.00 0.17 -5.00 105.19 105.27 1wcg n GLY 262 Ca -0.06 -1.22 0.08 0.00 0.00 0.00 0.00 46.02 44.82 1wcg n GLY 262 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1wcg n ASP 263 N 0.00 -3.63 -4.76 1.61 -0.08 -1.26 -4.64 116.55 103.79 1wcg n ASP 263 Ca 0.00 0.35 -0.31 0.00 -1.51 0.00 0.00 54.79 53.32 1wcg n ASP 263 Cb 0.00 -1.91 0.10 0.00 2.34 0.00 0.00 41.12 41.65 1wcg n ASP 263 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1wcg s TYR 264 N -2.10 2.53 0.24 -0.67 2.02 -1.26 -1.15 117.35 116.96 1wcg s TYR 264 Ca 0.00 1.55 -0.31 0.00 -0.37 0.00 0.00 57.07 57.94 1wcg s TYR 264 Cb 0.00 -3.06 -0.13 0.00 -0.40 0.00 0.00 41.96 38.37 1wcg s TYR 264 CO 0.00 -1.86 1.51 -2.30 -1.57 0.00 0.00 175.55 171.33 1wcg n PRO 265 N -3.57 2.29 -0.34 -1.71 -0.02 -1.26 -4.87 135.00 125.52 1wcg n PRO 265 Ca 0.09 0.82 0.18 0.00 -2.02 0.00 0.00 63.50 62.57 1wcg n PRO 265 Cb 0.53 -2.54 0.39 0.00 -0.02 0.00 0.00 33.50 31.86 1wcg n PRO 265 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1wcg h PRO 266 N 4.80 0.56 -0.07 0.52 0.11 -1.95 -1.36 132.00 134.61 1wcg h PRO 266 Ca -0.45 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 1wcg h PRO 266 Cb 1.25 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1wcg h PRO 266 CO 0.80 0.37 -0.31 0.97 -0.21 0.00 0.00 178.00 179.63 1wcg h ILE 267 N 0.58 1.25 -0.30 4.15 2.10 -1.99 -1.28 117.51 122.01 1wcg h ILE 267 Ca 0.63 -1.17 -0.08 0.00 1.08 0.00 0.00 64.86 65.33 1wcg h ILE 267 Cb 1.23 1.54 -0.01 0.00 -1.09 0.00 0.00 36.82 38.49 1wcg h ILE 267 CO -0.45 0.34 -0.11 0.24 -1.08 0.00 0.00 178.15 177.10 1wcg h MET 268 N 0.11 0.61 -0.43 2.19 2.86 -1.62 -1.36 114.93 117.29 1wcg h MET 268 Ca 0.01 -0.25 0.01 0.00 -2.06 0.00 0.00 59.70 57.41 1wcg h MET 268 Cb 0.60 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.21 1wcg h MET 268 CO 0.04 0.82 0.28 0.87 1.06 0.00 0.00 176.91 179.98 1wcg h LYS 269 N 0.36 0.56 0.23 1.72 1.57 -1.22 0.34 116.57 120.14 1wcg h LYS 269 Ca 0.07 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1wcg h LYS 269 Cb 0.62 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.80 1wcg h LYS 269 CO 0.04 0.37 -0.11 -0.22 -0.57 0.00 0.00 179.45 178.95 1wcg h LYS 270 N 0.57 -0.30 -0.08 3.15 3.64 -1.18 -1.61 116.57 120.76 1wcg h LYS 270 Ca 0.16 0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.45 1wcg h LYS 270 Cb -0.06 0.07 0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1wcg h LYS 270 CO -0.04 -0.20 -0.39 -1.49 -2.27 0.00 0.00 179.45 175.06 1wcg h TRP 271 N -0.32 0.55 -0.47 1.91 4.06 -1.14 -2.60 115.95 117.94 1wcg h TRP 271 Ca -0.03 -0.24 -0.10 0.00 2.06 0.00 0.00 58.89 60.57 1wcg h TRP 271 Cb 0.25 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.31 1wcg h TRP 271 CO -0.06 0.99 -0.12 0.28 -3.56 0.00 0.00 178.44 175.97 1wcg h VAL 272 N -0.05 1.27 -0.78 1.49 2.07 -0.99 -0.40 116.25 118.86 1wcg h VAL 272 Ca -0.03 -1.24 0.02 0.00 0.82 0.00 0.00 66.70 66.27 1wcg h VAL 272 Cb 1.04 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.87 1wcg h VAL 272 CO 0.08 0.43 0.51 0.44 0.02 0.00 0.00 177.57 179.05 1wcg h ASP 273 N 0.75 0.86 -0.16 0.57 5.19 -1.35 -0.08 116.42 122.20 1wcg h ASP 273 Ca 0.12 -0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 56.47 1wcg h ASP 273 Cb 0.67 -0.20 -0.00 0.00 0.18 0.00 0.00 39.33 39.97 1wcg h ASP 273 CO 0.05 0.61 -0.08 -0.61 -3.12 0.00 0.00 179.24 176.09 1wcg h GLN 274 N 1.01 0.34 -0.94 3.56 5.75 -1.25 -2.02 115.11 121.57 1wcg h GLN 274 Ca 0.30 -0.15 0.05 0.00 -0.15 0.00 0.00 58.65 58.70 1wcg h GLN 274 Cb -0.06 -0.01 -0.06 0.00 1.07 0.00 0.00 27.48 28.43 1wcg h GLN 274 CO -0.09 0.66 0.60 0.87 -2.65 0.00 0.00 178.83 178.22 1wcg h LYS 275 N 0.02 1.10 -0.62 1.69 1.79 -0.90 -1.20 116.57 118.44 1wcg h LYS 275 Ca 0.04 -0.07 -0.04 0.00 -2.18 0.00 0.00 60.65 58.40 1wcg h LYS 275 Cb 0.55 -0.25 -0.03 0.00 -1.58 0.00 0.00 32.23 30.93 1wcg h LYS 275 CO 0.02 0.73 0.24 0.77 -1.08 0.00 0.00 179.45 180.14 1wcg h SER 276 N 1.13 0.86 -0.63 0.86 0.02 -0.90 -1.30 113.55 113.59 1wcg h SER 276 Ca 0.39 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 1wcg h SER 276 Cb 0.08 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 1wcg h SER 276 CO -0.15 0.80 0.36 0.11 -1.14 0.00 0.00 176.83 176.81 1wcg h LYS 277 N 0.87 0.88 -0.32 3.45 1.57 -0.90 -2.00 116.57 120.12 1wcg h LYS 277 Ca 0.21 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 1wcg h LYS 277 Cb 0.21 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1wcg h LYS 277 CO -0.02 0.66 0.15 0.93 -0.57 0.00 0.00 179.45 180.60 1wcg h GLU 278 N 0.86 0.43 0.00 3.15 5.08 -0.80 -1.10 114.58 122.21 1wcg h GLU 278 Ca 0.22 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1wcg h GLU 278 Cb 0.03 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1wcg h GLU 278 CO -0.04 0.34 0.00 0.39 -1.00 0.00 0.00 179.01 178.70 1wcg n GLU 279 N -4.43 0.22 -1.27 2.33 1.02 -0.53 -4.91 120.64 113.07 1wcg n GLU 279 Ca 0.02 0.04 -0.03 0.00 -0.02 0.00 0.00 57.16 57.17 1wcg n GLU 279 Cb 0.11 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.02 1wcg n GLU 279 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wcg n GLY 280 N 1.06 0.53 3.79 0.62 0.00 -0.42 -5.03 105.19 105.74 1wcg n GLY 280 Ca 0.10 -0.92 -0.36 0.00 0.00 0.00 0.00 46.02 44.83 1wcg n GLY 280 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wcg s LEU 281 N -0.65 4.20 0.30 0.99 1.43 -0.78 -4.96 118.68 119.21 1wcg s LEU 281 Ca 0.00 1.93 0.26 0.00 -1.03 0.00 0.00 54.13 55.29 1wcg s LEU 281 Cb 0.00 -4.15 0.96 0.00 0.03 0.00 0.00 46.19 43.03 1wcg s LEU 281 CO 0.00 -0.31 1.77 1.55 0.23 0.00 0.00 176.35 179.58 1wcg h PRO 282 N 2.71 0.00 -3.47 1.29 0.13 -1.96 -3.43 132.00 127.27 1wcg h PRO 282 Ca -0.48 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 1wcg h PRO 282 Cb 1.20 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.20 1wcg h PRO 282 CO 0.63 0.00 -0.12 1.67 -0.23 0.00 0.00 178.00 179.95 1wcg s TRP 283 N -3.31 -0.12 0.47 1.56 -2.14 -1.26 -5.15 118.94 108.99 1wcg s TRP 283 Ca 0.06 -0.22 -0.24 0.00 2.66 0.00 0.00 56.10 58.35 1wcg s TRP 283 Cb 0.10 0.21 -0.07 0.00 -3.10 0.00 0.00 33.47 30.60 1wcg s TRP 283 CO 0.49 -0.70 1.37 0.45 -2.66 0.00 0.00 176.95 175.89 1wcg s SER 284 N -2.83 5.81 0.58 -2.66 0.15 -1.26 -4.90 113.70 108.59 1wcg s SER 284 Ca 0.04 2.79 0.33 0.00 0.70 0.00 0.00 55.95 59.81 1wcg s SER 284 Cb 0.02 -2.64 1.77 0.00 -1.71 0.00 0.00 66.02 63.45 1wcg s SER 284 CO -0.10 -1.21 2.18 0.11 1.20 0.00 0.00 173.24 175.41 1wcg h LYS 285 N 2.13 0.00 -5.48 5.44 1.57 -1.93 -3.40 116.57 114.90 1wcg h LYS 285 Ca -0.51 0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 57.64 1wcg h LYS 285 Cb 1.27 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.44 1wcg h LYS 285 CO 0.60 0.05 0.15 -1.17 -0.57 0.00 0.00 179.45 178.51 1wcg s LEU 286 N -6.94 4.31 0.76 2.94 2.96 -1.26 -4.61 118.68 116.85 1wcg s LEU 286 Ca -0.03 0.01 -0.15 0.00 -0.22 0.00 0.00 54.13 53.74 1wcg s LEU 286 Cb 0.13 -2.78 0.06 0.00 0.50 0.00 0.00 46.19 44.10 1wcg s LEU 286 CO 0.53 -0.66 1.23 -2.84 -1.32 0.00 0.00 176.35 173.29 1wcg s PRO 287 N 2.77 1.88 -0.22 0.98 0.02 -1.26 -4.99 135.00 134.18 1wcg s PRO 287 Ca 0.24 1.84 -0.09 0.00 0.02 0.00 0.00 61.00 63.02 1wcg s PRO 287 Cb -0.14 -1.79 -0.04 0.00 0.02 0.00 0.00 34.50 32.54 1wcg s PRO 287 CO 0.16 -2.05 0.10 0.15 -0.33 0.00 0.00 177.00 175.03 1wcg s LYS 288 N -3.94 3.96 0.38 5.54 1.02 -1.26 -5.06 119.74 120.39 1wcg s LYS 288 Ca 0.76 -0.34 -0.26 0.00 0.02 0.00 0.00 55.97 56.15 1wcg s LYS 288 Cb -0.31 -3.36 -0.09 0.00 -0.52 0.00 0.00 37.83 33.55 1wcg s LYS 288 CO 0.48 0.12 1.17 -0.06 -0.92 0.00 0.00 175.35 176.13 1wcg s PHE 289 N 0.83 3.13 0.77 3.18 0.08 -1.26 -5.05 117.98 119.66 1wcg s PHE 289 Ca 0.05 1.56 -0.12 0.00 0.12 0.00 0.00 56.93 58.55 1wcg s PHE 289 Cb -0.13 -3.40 0.05 0.00 -0.57 0.00 0.00 43.02 38.98 1wcg s PHE 289 CO 0.02 -1.25 1.11 0.95 -0.10 0.00 0.00 175.22 175.95 1wcg s THR 290 N -1.37 3.04 0.22 0.64 -4.23 -1.26 -4.87 115.64 107.80 1wcg s THR 290 Ca 0.55 0.34 -0.09 0.00 -1.18 0.00 0.00 61.69 61.31 1wcg s THR 290 Cb -0.31 -3.22 0.17 0.00 1.34 0.00 0.00 72.50 70.48 1wcg s THR 290 CO 0.40 -0.44 1.72 0.50 -0.54 0.00 0.00 174.62 176.26 1wcg h LYS 291 N -0.94 0.33 -0.60 3.99 3.64 -2.00 -0.80 116.57 120.19 1wcg h LYS 291 Ca -0.46 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 58.84 1wcg h LYS 291 Cb 1.27 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.99 1wcg h LYS 291 CO 0.62 0.22 0.15 -0.44 -2.27 0.00 0.00 179.45 177.73 1wcg h ASP 292 N 0.34 0.87 0.02 4.20 3.32 -1.99 -2.32 116.42 120.84 1wcg h ASP 292 Ca 0.33 -0.16 -0.13 0.00 0.02 0.00 0.00 57.03 57.09 1wcg h ASP 292 Cb 0.47 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1wcg h ASP 292 CO -0.37 0.84 -0.41 -0.33 -1.72 0.00 0.00 179.24 177.25 1wcg h GLU 293 N 0.89 0.50 -0.45 3.56 5.08 -1.74 0.57 114.58 122.98 1wcg h GLU 293 Ca 0.19 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1wcg h GLU 293 Cb 0.31 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 1wcg h GLU 293 CO -0.00 0.82 0.26 0.82 -1.00 0.00 0.00 179.01 179.91 1wcg h ILE 294 N 0.41 1.15 -0.63 3.13 2.04 -0.88 -1.81 117.51 120.93 1wcg h ILE 294 Ca 0.03 -0.36 -0.06 0.00 1.00 0.00 0.00 64.86 65.48 1wcg h ILE 294 Cb 0.89 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 1wcg h ILE 294 CO 0.08 0.15 0.17 0.50 0.00 0.00 0.00 178.15 179.05 1wcg h LYS 295 N 0.59 0.99 -0.63 2.37 3.64 -1.23 -1.26 116.57 121.05 1wcg h LYS 295 Ca 0.16 -0.23 0.12 0.00 -1.27 0.00 0.00 60.65 59.43 1wcg h LYS 295 Cb 0.02 -0.13 -0.09 0.00 -0.41 0.00 0.00 32.23 31.61 1wcg h LYS 295 CO -0.03 0.89 0.12 1.25 -2.27 0.00 0.00 179.45 179.42 1wcg h LEU 296 N 0.91 -0.04 0.04 5.20 5.85 -0.53 -3.20 115.31 123.55 1wcg h LEU 296 Ca 0.20 0.13 -0.29 0.00 0.84 0.00 0.00 57.88 58.76 1wcg h LEU 296 Cb 0.34 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1wcg h LEU 296 CO -0.00 -0.02 -1.55 -0.07 -0.34 0.00 0.00 178.44 176.46 1wcg h LEU 297 N 0.24 0.14 -9.15 2.25 3.38 -1.11 -3.45 115.31 107.61 1wcg h LEU 297 Ca 0.34 -0.23 -0.56 0.00 0.09 0.00 0.00 57.88 57.52 1wcg h LEU 297 Cb 0.53 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1wcg h LEU 297 CO -0.44 1.20 1.06 -0.75 0.09 0.00 0.00 178.44 179.59 1wcg s LYS 298 N -2.62 4.05 0.00 1.13 2.20 -0.49 -2.48 119.74 121.52 1wcg s LYS 298 Ca -0.06 1.87 0.00 0.00 -0.36 0.00 0.00 55.97 57.42 1wcg s LYS 298 Cb 0.08 -3.95 0.00 0.00 -1.51 0.00 0.00 37.83 32.45 1wcg s LYS 298 CO 0.83 -0.98 0.00 0.41 -0.36 0.00 0.00 175.35 175.25 1wcg n GLY 299 N 4.20 0.97 2.12 5.54 0.00 0.65 -4.95 105.19 113.71 1wcg n GLY 299 Ca 0.17 -0.02 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 1wcg n GLY 299 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wcg n THR 300 N -2.05 3.21 -3.65 2.61 -2.24 -1.04 -4.77 114.28 106.35 1wcg n THR 300 Ca 0.00 -2.31 -0.15 0.00 -2.27 0.00 0.00 64.05 59.32 1wcg n THR 300 Cb 0.00 -1.25 -0.14 0.00 -2.10 0.00 0.00 70.33 66.84 1wcg n THR 300 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wcg s ALA 301 N -2.82 -0.39 -0.83 6.98 0.00 -1.26 -4.74 121.76 118.70 1wcg s ALA 301 Ca 0.48 0.74 0.26 0.00 0.00 0.00 0.00 51.96 53.44 1wcg s ALA 301 Cb 0.38 -0.98 0.78 0.00 0.00 0.00 0.00 23.12 23.30 1wcg s ALA 301 CO -0.01 -0.67 1.66 -0.25 0.00 0.00 0.00 175.76 176.50 1wcg n ASP 302 N 5.34 0.50 -3.56 0.00 8.00 -0.06 -4.82 116.55 121.95 1wcg n ASP 302 Ca -0.05 0.32 -0.11 0.00 0.71 0.00 0.00 54.79 55.66 1wcg n ASP 302 Cb 0.50 -0.34 -0.03 0.00 -0.02 0.00 0.00 41.12 41.23 1wcg n ASP 302 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1wcg s PHE 303 N -3.07 -0.34 -0.12 1.24 -0.12 -1.26 -4.88 117.98 109.43 1wcg s PHE 303 Ca 0.11 0.06 -0.21 0.00 -0.05 0.00 0.00 56.93 56.84 1wcg s PHE 303 Cb 0.15 0.42 -0.03 0.00 -0.63 0.00 0.00 43.02 42.92 1wcg s PHE 303 CO 0.62 -0.80 0.63 -0.47 -0.05 0.00 0.00 175.22 175.14 1wcg s TYR 304 N -3.79 3.50 -0.26 3.49 5.04 0.79 -4.67 117.35 121.45 1wcg s TYR 304 Ca 0.03 1.07 -0.06 0.00 -2.44 0.00 0.00 57.07 55.67 1wcg s TYR 304 Cb 0.00 -2.74 -0.01 0.00 0.35 0.00 0.00 41.96 39.56 1wcg s TYR 304 CO -0.11 0.03 0.05 0.00 -1.34 0.00 0.00 175.55 174.18 1wcg s ALA 305 N 1.09 3.04 -0.18 3.97 0.00 -1.26 -0.35 121.76 128.08 1wcg s ALA 305 Ca 0.32 -1.27 -0.02 0.00 0.00 0.00 0.00 51.96 51.00 1wcg s ALA 305 Cb -0.16 -2.02 -0.01 0.00 0.00 0.00 0.00 23.12 20.93 1wcg s ALA 305 CO 0.14 -0.65 -0.10 -1.17 0.00 0.00 0.00 175.76 173.98 1wcg s LEU 306 N 1.54 2.72 -0.17 0.00 2.96 -0.35 -1.41 118.68 123.97 1wcg s LEU 306 Ca 0.05 -0.40 -0.09 0.00 -0.22 0.00 0.00 54.13 53.47 1wcg s LEU 306 Cb -0.16 -1.65 -0.05 0.00 0.50 0.00 0.00 46.19 44.84 1wcg s LEU 306 CO 0.01 0.06 0.13 0.20 -1.32 0.00 0.00 176.35 175.44 1wcg s ASN 307 N 0.96 6.25 -0.14 3.68 -0.87 -0.96 -0.03 114.94 123.83 1wcg s ASN 307 Ca -0.02 0.32 -0.12 0.00 -1.57 0.00 0.00 52.86 51.47 1wcg s ASN 307 Cb -0.15 -2.07 0.04 0.00 -0.02 0.00 0.00 41.25 39.05 1wcg s ASN 307 CO -0.01 0.27 0.37 -2.28 -2.57 0.00 0.00 177.10 172.88 1wcg s HIS 308 N -0.20 -0.42 0.03 2.20 2.46 -0.31 -4.17 115.29 114.88 1wcg s HIS 308 Ca 0.11 1.01 0.00 0.00 0.47 0.00 0.00 55.06 56.64 1wcg s HIS 308 Cb -0.11 0.15 0.00 0.00 -0.13 0.00 0.00 32.58 32.48 1wcg s HIS 308 CO 0.00 -0.21 0.00 0.66 -2.47 0.00 0.00 174.74 172.72 1wcg n TYR 309 N 3.09 -0.22 -4.01 3.88 4.01 -1.26 -4.15 117.16 118.50 1wcg n TYR 309 Ca -0.15 0.04 -0.12 0.00 -0.16 0.00 0.00 57.90 57.51 1wcg n TYR 309 Cb 0.57 0.29 -0.03 0.00 -0.31 0.00 0.00 39.34 39.86 1wcg n TYR 309 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1wcg s SER 310 N -5.06 0.49 0.06 7.72 0.15 -1.26 -4.71 113.70 111.09 1wcg s SER 310 Ca 0.00 -1.28 -0.00 0.00 0.70 0.00 0.00 55.95 55.36 1wcg s SER 310 Cb 0.00 0.68 -0.04 0.00 -1.71 0.00 0.00 66.02 64.95 1wcg s SER 310 CO 0.00 -1.33 -0.03 -0.44 1.20 0.00 0.00 173.24 172.63 1wcg s SER 311 N -3.15 0.61 0.04 5.45 0.01 -1.26 -2.14 113.70 113.26 1wcg s SER 311 Ca 0.26 -1.01 -0.00 0.00 1.31 0.00 0.00 55.95 56.51 1wcg s SER 311 Cb -0.01 0.18 -0.03 0.00 0.21 0.00 0.00 66.02 66.37 1wcg s SER 311 CO 0.16 -0.58 -0.03 -0.13 0.41 0.00 0.00 173.24 173.07 1wcg s ARG 312 N -3.91 0.49 0.32 12.44 1.81 0.19 -4.90 118.95 125.40 1wcg s ARG 312 Ca 0.08 -0.95 -0.18 0.00 -1.72 0.00 0.00 55.73 52.96 1wcg s ARG 312 Cb 0.07 0.12 -0.09 0.00 -0.45 0.00 0.00 34.95 34.60 1wcg s ARG 312 CO -0.09 -0.07 0.80 -0.51 -0.68 0.00 0.00 175.30 174.75 1wcg s LEU 313 N -2.25 4.12 0.04 2.53 1.43 -0.35 -1.61 118.68 122.58 1wcg s LEU 313 Ca -0.03 1.45 0.01 0.00 -1.03 0.00 0.00 54.13 54.53 1wcg s LEU 313 Cb -0.00 -4.07 -0.03 0.00 0.03 0.00 0.00 46.19 42.12 1wcg s LEU 313 CO -0.05 -0.17 -0.06 0.68 0.23 0.00 0.00 176.35 176.97 1wcg s VAL 314 N -1.89 0.40 0.13 -1.59 -7.23 0.00 -0.73 120.40 109.50 1wcg s VAL 314 Ca 0.53 -1.17 -0.10 0.00 -1.81 0.00 0.00 61.98 59.43 1wcg s VAL 314 Cb -0.12 -0.68 -0.00 0.00 0.56 0.00 0.00 36.38 36.13 1wcg s VAL 314 CO 0.18 -0.51 0.26 0.28 -0.31 0.00 0.00 175.10 175.00 1wcg s THR 315 N -1.83 0.10 0.29 5.32 -1.32 -1.04 -1.18 115.64 115.98 1wcg s THR 315 Ca -0.08 -1.21 -0.30 0.00 -1.21 0.00 0.00 61.69 58.88 1wcg s THR 315 Cb -0.07 -1.57 -0.12 0.00 -1.51 0.00 0.00 72.50 69.23 1wcg s THR 315 CO -0.01 -0.44 1.51 0.33 -2.21 0.00 0.00 174.62 173.80 1wcg n PHE 316 N -0.16 2.65 -2.83 9.09 7.35 -1.26 -1.03 117.46 131.27 1wcg n PHE 316 Ca -0.11 0.35 0.00 0.00 -0.76 0.00 0.00 57.45 56.92 1wcg n PHE 316 Cb 0.63 -2.54 0.00 0.00 0.35 0.00 0.00 39.48 37.92 1wcg n PHE 316 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1wcg n GLY 317 N 1.84 -0.51 3.08 7.13 0.00 -0.91 -4.61 105.19 111.22 1wcg n GLY 317 Ca 0.08 -0.97 -0.26 0.00 0.00 0.00 0.00 46.02 44.87 1wcg n GLY 317 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wcg s SER 318 N -4.00 2.08 -0.18 1.61 0.15 -1.26 -2.21 113.70 109.89 1wcg s SER 318 Ca 0.00 -0.36 -0.08 0.00 0.70 0.00 0.00 55.95 56.22 1wcg s SER 318 Cb 0.00 -0.87 -0.04 0.00 -1.71 0.00 0.00 66.02 63.39 1wcg s SER 318 CO 0.00 0.08 0.08 -0.62 1.20 0.00 0.00 173.24 173.98 1wcg s ASP 319 N 0.46 5.78 0.49 5.45 -1.08 -1.24 -4.68 116.67 121.85 1wcg s ASP 319 Ca -0.13 0.13 0.32 0.00 -0.52 0.00 0.00 52.55 52.35 1wcg s ASP 319 Cb -0.15 -1.98 1.33 0.00 -1.46 0.00 0.00 42.92 40.66 1wcg s ASP 319 CO 0.04 0.19 1.94 1.55 0.52 0.00 0.00 175.17 179.41 1wcg h PRO 320 N 6.58 0.00 -5.97 4.34 0.13 -1.96 -3.42 132.00 131.70 1wcg h PRO 320 Ca -0.39 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.15 1wcg h PRO 320 Cb 1.17 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.21 1wcg h PRO 320 CO 0.71 0.00 0.60 1.21 -0.23 0.00 0.00 178.00 180.29 1wcg s ASN 321 N -5.32 6.84 0.00 1.44 3.84 -1.26 -4.93 114.94 115.55 1wcg s ASN 321 Ca 0.01 0.96 0.09 0.00 0.21 0.00 0.00 52.86 54.14 1wcg s ASN 321 Cb 0.09 -2.47 0.41 0.00 -0.55 0.00 0.00 41.25 38.73 1wcg s ASN 321 CO 0.50 -0.67 1.29 -0.81 -2.79 0.00 0.00 177.10 174.61 1wcg n PRO 322 N 6.36 0.02 0.24 0.43 -0.04 -1.26 -2.10 135.00 138.64 1wcg n PRO 322 Ca 0.08 0.32 0.16 0.00 -0.04 0.00 0.00 63.50 64.02 1wcg n PRO 322 Cb 0.47 -1.50 0.77 0.00 -0.04 0.00 0.00 33.50 33.20 1wcg n PRO 322 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1wcg h ASN 323 N 0.00 0.00 -3.64 3.54 2.35 -1.95 -3.41 115.58 112.47 1wcg h ASN 323 Ca 0.00 0.00 -0.64 0.00 -0.55 0.00 0.00 56.30 55.11 1wcg h ASN 323 Cb 0.15 0.00 -0.21 0.00 0.05 0.00 0.00 38.32 38.31 1wcg h ASN 323 CO 0.00 0.00 -0.60 -0.36 -1.65 0.00 0.00 177.43 174.82 1wcg s PHE 324 N -3.69 3.13 -0.11 1.19 0.08 -0.89 -5.03 117.98 112.65 1wcg s PHE 324 Ca -0.01 -0.27 -0.29 0.00 0.12 0.00 0.00 56.93 56.49 1wcg s PHE 324 Cb 0.10 -2.24 -0.06 0.00 -0.57 0.00 0.00 43.02 40.25 1wcg s PHE 324 CO 0.40 -0.26 1.87 1.21 -0.10 0.00 0.00 175.22 178.34 1wcg s ASN 325 N 1.47 6.24 0.54 1.36 3.84 -1.26 -4.87 114.94 122.26 1wcg s ASN 325 Ca 0.06 2.12 0.32 0.00 0.21 0.00 0.00 52.86 55.57 1wcg s ASN 325 Cb -0.15 -2.53 1.47 0.00 -0.55 0.00 0.00 41.25 39.49 1wcg s ASN 325 CO 0.05 -1.30 2.03 1.55 -2.79 0.00 0.00 177.10 176.64 1wcg h PRO 326 N 11.49 0.00 0.00 0.43 0.13 -1.94 -2.30 132.00 139.81 1wcg h PRO 326 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1wcg h PRO 326 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1wcg h PRO 326 CO 0.97 0.06 0.00 -0.44 -0.23 0.00 0.00 178.00 178.36 1wcg h ASP 327 N 0.00 0.00 0.05 1.44 3.32 -1.98 -2.45 116.42 116.80 1wcg h ASP 327 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1wcg h ASP 327 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1wcg h ASP 327 CO 0.01 0.00 -0.38 0.00 -1.72 0.00 0.00 179.24 177.15 1wcg n ALA 328 N -1.94 3.35 -3.79 3.45 0.00 -0.86 -4.70 120.51 116.01 1wcg n ALA 328 Ca -0.01 -0.58 -0.33 0.00 0.00 0.00 0.00 53.44 52.52 1wcg n ALA 328 Cb 0.15 -0.90 0.03 0.00 0.00 0.00 0.00 19.45 18.73 1wcg n ALA 328 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1wcg n SER 329 N -0.11 -4.39 -4.15 0.00 7.64 -0.92 -4.84 113.62 106.84 1wcg n SER 329 Ca 0.11 -1.06 -0.20 0.00 1.01 0.00 0.00 58.87 58.72 1wcg n SER 329 Cb 0.44 -3.06 -0.13 0.00 -1.01 0.00 0.00 64.21 60.45 1wcg n SER 329 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1wcg s TYR 330 N -3.55 1.24 -0.10 1.43 -0.85 -0.94 -2.13 117.35 112.46 1wcg s TYR 330 Ca 0.41 -0.38 0.01 0.00 -0.52 0.00 0.00 57.07 56.59 1wcg s TYR 330 Cb -0.16 -0.73 -0.02 0.00 0.38 0.00 0.00 41.96 41.43 1wcg s TYR 330 CO 0.88 0.04 -0.12 0.54 -1.52 0.00 0.00 175.55 175.37 1wcg s VAL 331 N -0.95 3.18 0.36 -3.49 0.11 -0.19 -3.59 120.40 115.82 1wcg s VAL 331 Ca 0.01 -0.64 -0.04 0.00 -2.93 0.00 0.00 61.98 58.37 1wcg s VAL 331 Cb -0.08 -2.30 -0.05 0.00 -1.53 0.00 0.00 36.38 32.42 1wcg s VAL 331 CO 0.02 0.55 0.63 0.42 -3.33 0.00 0.00 175.10 173.39 1wcg s THR 332 N -0.15 4.99 0.21 5.04 -4.23 -1.26 -2.51 115.64 117.73 1wcg s THR 332 Ca -0.00 0.03 -0.12 0.00 -1.18 0.00 0.00 61.69 60.42 1wcg s THR 332 Cb -0.13 -3.79 -0.00 0.00 1.34 0.00 0.00 72.50 69.91 1wcg s THR 332 CO 0.03 -0.52 0.41 -0.94 -0.54 0.00 0.00 174.62 173.06 1wcg s SER 333 N -3.57 -0.06 -0.08 3.99 1.04 0.09 -4.98 113.70 110.13 1wcg s SER 333 Ca 0.45 -0.88 0.04 0.00 0.48 0.00 0.00 55.95 56.03 1wcg s SER 333 Cb -0.10 0.53 -0.01 0.00 0.10 0.00 0.00 66.02 66.53 1wcg s SER 333 CO 0.35 -1.04 -0.19 0.68 0.98 0.00 0.00 173.24 174.02 1wcg s VAL 334 N -3.99 2.57 0.15 5.02 -7.23 -1.26 -1.21 120.40 114.44 1wcg s VAL 334 Ca 0.20 -0.87 -0.31 0.00 -1.81 0.00 0.00 61.98 59.19 1wcg s VAL 334 Cb 0.01 -2.00 -0.10 0.00 0.56 0.00 0.00 36.38 34.85 1wcg s VAL 334 CO 0.05 0.56 1.55 -0.62 -0.31 0.00 0.00 175.10 176.33 1wcg s ASP 335 N -0.14 6.62 0.50 4.85 -1.08 -1.26 -4.89 116.67 121.27 1wcg s ASP 335 Ca -0.03 2.56 0.21 0.00 -0.52 0.00 0.00 52.55 54.78 1wcg s ASP 335 Cb -0.14 -2.59 1.27 0.00 -1.46 0.00 0.00 42.92 40.01 1wcg s ASP 335 CO 0.04 -0.81 2.00 -0.33 0.52 0.00 0.00 175.17 176.59 1wcg h GLU 336 N 6.94 0.12 0.00 4.34 4.39 -1.99 -0.16 114.58 128.23 1wcg h GLU 336 Ca -0.42 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.26 1wcg h GLU 336 Cb 1.20 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.83 1wcg h GLU 336 CO 0.91 0.08 -0.03 0.00 -1.16 0.00 0.00 179.01 178.81 1wcg h ALA 337 N 1.74 1.27 0.00 3.43 0.00 -2.03 -2.04 119.26 121.63 1wcg h ALA 337 Ca 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1wcg h ALA 337 Cb 0.80 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1wcg h ALA 337 CO -0.03 0.04 0.00 -1.49 0.00 0.00 0.00 179.25 177.77 1wcg h TRP 338 N 0.00 0.00 -2.87 0.00 6.55 -1.36 -3.45 115.95 114.83 1wcg h TRP 338 Ca -0.00 0.00 -0.63 0.00 0.95 0.00 0.00 58.89 59.21 1wcg h TRP 338 Cb 0.11 0.00 -0.06 0.00 -0.86 0.00 0.00 29.16 28.36 1wcg h TRP 338 CO 0.00 0.00 -0.34 -0.51 -1.05 0.00 0.00 178.44 176.54 1wcg s LEU 339 N -5.16 4.42 0.26 -4.49 1.43 -0.77 -4.71 118.68 109.65 1wcg s LEU 339 Ca 0.09 0.70 0.06 0.00 -1.03 0.00 0.00 54.13 53.94 1wcg s LEU 339 Cb 0.10 -2.45 -0.03 0.00 0.03 0.00 0.00 46.19 43.83 1wcg s LEU 339 CO 0.61 0.33 0.35 -0.54 0.23 0.00 0.00 176.35 177.32 1wcg s LYS 340 N -1.26 3.28 -0.78 1.70 1.02 -1.26 -5.00 119.74 117.44 1wcg s LYS 340 Ca 0.22 -0.87 -0.22 0.00 0.02 0.00 0.00 55.97 55.12 1wcg s LYS 340 Cb -0.14 -2.81 -0.16 0.00 -0.52 0.00 0.00 37.83 34.20 1wcg s LYS 340 CO 0.11 0.36 1.91 -0.35 -0.92 0.00 0.00 175.35 176.46 1wcg n PRO 341 N -1.41 1.45 -2.12 -1.68 -0.04 -1.26 -4.71 135.00 125.24 1wcg n PRO 341 Ca -0.07 -1.88 0.00 0.00 -0.04 0.00 0.00 63.50 61.52 1wcg n PRO 341 Cb 0.57 -2.98 0.00 0.00 -0.04 0.00 0.00 33.50 31.05 1wcg n PRO 341 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1wcg n ASN 342 N 8.26 -0.21 -4.77 3.54 0.23 -1.26 -5.15 115.26 115.90 1wcg n ASN 342 Ca 0.49 -1.06 -0.39 0.00 -0.53 0.00 0.00 54.58 53.09 1wcg n ASN 342 Cb 0.41 0.32 -0.01 0.00 -2.08 0.00 0.00 39.78 38.42 1wcg n ASN 342 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1wcg s GLU 343 N -2.00 4.03 0.08 -3.83 2.02 -1.26 -4.98 118.70 112.76 1wcg s GLU 343 Ca 0.05 2.11 -0.30 0.00 0.02 0.00 0.00 54.97 56.85 1wcg s GLU 343 Cb -0.00 -2.79 -0.06 0.00 0.10 0.00 0.00 34.13 31.38 1wcg s GLU 343 CO 0.00 -0.42 1.13 0.99 0.02 0.00 0.00 175.26 176.97 1wcg s THR 344 N -1.27 4.15 0.81 3.63 2.01 -1.26 -4.94 115.64 118.77 1wcg s THR 344 Ca 0.56 1.62 -0.11 0.00 0.31 0.00 0.00 61.69 64.07 1wcg s THR 344 Cb -0.37 -4.04 0.08 0.00 0.01 0.00 0.00 72.50 68.18 1wcg s THR 344 CO 0.48 0.17 1.09 -2.16 -0.69 0.00 0.00 174.62 173.51 1wcg s PRO 345 N 0.63 1.97 0.18 4.92 0.04 -1.26 -4.97 135.00 136.51 1wcg s PRO 345 Ca 0.55 0.82 -0.13 0.00 0.04 0.00 0.00 61.00 62.28 1wcg s PRO 345 Cb -0.28 -1.89 0.11 0.00 0.04 0.00 0.00 34.50 32.48 1wcg s PRO 345 CO 0.31 -1.74 1.83 -0.92 0.04 0.00 0.00 177.00 176.51 1wcg h TYR 346 N -1.19 0.66 -3.55 0.56 3.20 -1.96 -3.37 116.97 111.32 1wcg h TYR 346 Ca -0.47 0.02 -0.67 0.00 3.14 0.00 0.00 58.73 60.75 1wcg h TYR 346 Cb 1.26 -0.22 -0.28 0.00 1.54 0.00 0.00 36.73 39.04 1wcg h TYR 346 CO 0.49 0.39 -0.67 0.42 -1.64 0.00 0.00 178.16 177.14 1wcg s ILE 347 N -6.14 3.58 -0.17 1.81 -1.09 -1.26 -5.06 121.20 112.86 1wcg s ILE 347 Ca -0.13 -0.73 -0.29 0.00 -2.23 0.00 0.00 60.65 57.27 1wcg s ILE 347 Cb 0.13 -2.80 -0.01 0.00 -1.58 0.00 0.00 42.46 38.21 1wcg s ILE 347 CO 0.75 0.18 1.16 -0.63 -1.23 0.00 0.00 174.94 175.16 1wcg s ILE 348 N 1.45 4.46 -0.13 2.92 1.01 -1.26 -4.93 121.20 124.72 1wcg s ILE 348 Ca 0.03 1.76 -0.29 0.00 0.00 0.00 0.00 60.65 62.15 1wcg s ILE 348 Cb -0.16 -4.14 -0.04 0.00 0.01 0.00 0.00 42.46 38.13 1wcg s ILE 348 CO -0.00 -0.13 1.67 -2.84 0.00 0.00 0.00 174.94 173.64 1wcg s PRO 349 N 3.14 3.98 -0.45 2.79 0.02 -1.26 -4.60 135.00 138.62 1wcg s PRO 349 Ca 0.50 1.98 0.07 0.00 0.02 0.00 0.00 61.00 63.57 1wcg s PRO 349 Cb -0.19 -4.03 0.23 0.00 0.02 0.00 0.00 34.50 30.54 1wcg s PRO 349 CO 0.13 -1.09 0.53 0.28 -0.33 0.00 0.00 177.00 176.52 1wcg n VAL 350 N 5.96 -0.18 -0.13 3.83 0.31 -1.26 -4.89 118.33 121.97 1wcg n VAL 350 Ca 0.18 -4.15 0.07 0.00 -0.01 0.00 0.00 64.34 60.43 1wcg n VAL 350 Cb 0.44 -1.94 0.40 0.00 -0.91 0.00 0.00 33.84 31.82 1wcg n VAL 350 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1wcg h PRO 351 N 4.33 0.62 0.00 5.55 0.13 -1.91 -0.25 132.00 140.48 1wcg h PRO 351 Ca 0.13 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 65.20 1wcg h PRO 351 Cb 0.84 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 31.83 1wcg h PRO 351 CO 0.52 0.41 -0.08 1.49 -0.23 0.00 0.00 178.00 180.11 1wcg h GLU 352 N 0.64 0.00 -0.83 0.86 4.81 -1.94 -1.80 114.58 116.32 1wcg h GLU 352 Ca 0.27 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.49 1wcg h GLU 352 Cb 0.26 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 1wcg h GLU 352 CO -0.08 0.08 0.47 0.78 -0.73 0.00 0.00 179.01 179.52 1wcg h GLY 353 N 0.36 1.23 0.93 1.92 0.00 -1.47 -0.82 103.07 105.22 1wcg h GLY 353 Ca -0.00 -0.54 -0.06 0.00 0.00 0.00 0.00 47.33 46.73 1wcg h GLY 353 CO 0.01 0.52 -0.02 -2.00 0.00 0.00 0.00 176.54 175.05 1wcg h LEU 354 N 1.16 0.65 -0.18 3.11 5.85 -1.37 0.99 115.31 125.52 1wcg h LEU 354 Ca 0.30 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.72 1wcg h LEU 354 Cb 0.01 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 1wcg h LEU 354 CO -0.05 0.82 0.02 -0.09 -0.34 0.00 0.00 178.44 178.80 1wcg h ARG 355 N 0.47 0.08 -0.36 1.25 2.43 -1.36 -0.11 114.38 116.79 1wcg h ARG 355 Ca 0.10 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 1wcg h ARG 355 Cb 0.49 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 1wcg h ARG 355 CO 0.02 0.06 -0.10 0.87 -1.51 0.00 0.00 179.97 179.31 1wcg h LYS 356 N 0.09 0.62 -0.49 0.20 1.57 -1.06 -2.03 116.57 115.48 1wcg h LYS 356 Ca 0.08 -0.19 -0.06 0.00 -1.87 0.00 0.00 60.65 58.62 1wcg h LYS 356 Cb 0.09 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1wcg h LYS 356 CO -0.13 0.72 0.08 1.25 -0.57 0.00 0.00 179.45 180.80 1wcg h LEU 357 N 0.57 0.77 -0.88 2.94 5.85 -0.49 -0.29 115.31 123.77 1wcg h LEU 357 Ca 0.10 -0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.57 1wcg h LEU 357 Cb 0.52 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 1wcg h LEU 357 CO 0.03 0.83 0.57 -0.07 -0.34 0.00 0.00 178.44 179.46 1wcg h LEU 358 N 0.67 1.03 -0.50 2.25 3.38 -0.70 0.11 115.31 121.55 1wcg h LEU 358 Ca 0.15 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1wcg h LEU 358 Cb 0.38 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1wcg h LEU 358 CO 0.01 0.75 0.22 0.40 0.09 0.00 0.00 178.44 179.91 1wcg h ILE 359 N 1.20 1.20 -0.40 1.22 2.04 -1.21 -0.75 117.51 120.81 1wcg h ILE 359 Ca 0.32 -0.61 0.03 0.00 1.00 0.00 0.00 64.86 65.60 1wcg h ILE 359 Cb -0.12 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 1wcg h ILE 359 CO -0.07 0.23 0.20 -0.25 0.00 0.00 0.00 178.15 178.26 1wcg h TRP 360 N 0.66 0.37 -0.47 1.37 7.01 -0.34 -1.18 115.95 123.37 1wcg h TRP 360 Ca 0.17 0.02 -0.07 0.00 2.11 0.00 0.00 58.89 61.12 1wcg h TRP 360 Cb 0.16 -0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 27.10 1wcg h TRP 360 CO -0.00 0.19 0.03 -0.07 -2.79 0.00 0.00 178.44 175.80 1wcg h LEU 361 N 0.40 0.78 -0.30 0.65 3.38 -0.87 -0.09 115.31 119.27 1wcg h LEU 361 Ca 0.17 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 57.91 1wcg h LEU 361 Cb 0.08 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.56 1wcg h LEU 361 CO -0.12 0.88 -0.11 0.50 0.09 0.00 0.00 178.44 179.68 1wcg h LYS 362 N 0.66 -0.05 -0.09 1.13 3.64 -0.86 -1.26 116.57 119.74 1wcg h LYS 362 Ca 0.14 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.33 1wcg h LYS 362 Cb 0.46 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1wcg h LYS 362 CO 0.02 -0.04 -0.72 -0.91 -2.27 0.00 0.00 179.45 175.53 1wcg h ASN 363 N -0.06 0.52 0.09 4.20 2.35 -1.05 0.13 115.58 121.77 1wcg h ASN 363 Ca 0.15 -0.34 -0.19 0.00 -0.55 0.00 0.00 56.30 55.37 1wcg h ASN 363 Cb 0.29 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1wcg h ASN 363 CO -0.34 1.08 -0.72 -0.08 -1.65 0.00 0.00 177.43 175.72 1wcg h GLU 364 N 0.30 0.56 -0.08 0.81 4.57 -0.87 -3.36 114.58 116.51 1wcg h GLU 364 Ca -0.03 -0.44 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 1wcg h GLU 364 Cb 1.30 0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.98 1wcg h GLU 364 CO 0.13 1.07 0.00 0.66 -1.18 0.00 0.00 179.01 179.68 1wcg n TYR 365 N -3.89 0.15 -2.68 0.92 4.01 -0.49 -5.00 117.16 110.18 1wcg n TYR 365 Ca -0.05 -0.60 -0.06 0.00 -0.16 0.00 0.00 57.90 57.03 1wcg n TYR 365 Cb 0.71 -0.08 0.02 0.00 -0.31 0.00 0.00 39.34 39.68 1wcg n TYR 365 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wcg n GLY 366 N -0.46 0.56 3.67 2.72 0.00 -0.72 -4.19 105.19 106.77 1wcg n GLY 366 Ca 0.06 -0.49 -0.27 0.00 0.00 0.00 0.00 46.02 45.32 1wcg n GLY 366 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1wcg n ASN 367 N 0.52 -4.16 -4.75 1.61 5.15 0.37 -4.95 115.26 109.05 1wcg n ASN 367 Ca -0.00 -0.95 -0.35 0.00 -0.60 0.00 0.00 54.58 52.68 1wcg n ASN 367 Cb 0.52 -3.66 0.04 0.00 -0.53 0.00 0.00 39.78 36.15 1wcg n ASN 367 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1wcg s PRO 368 N -5.87 2.81 0.10 1.20 0.04 -1.26 -4.71 135.00 127.31 1wcg s PRO 368 Ca 0.34 1.71 -0.34 0.00 0.04 0.00 0.00 61.00 62.75 1wcg s PRO 368 Cb -0.11 -1.92 -0.13 0.00 0.04 0.00 0.00 34.50 32.38 1wcg s PRO 368 CO 0.84 -1.30 1.65 1.04 0.04 0.00 0.00 177.00 179.27 1wcg n GLN 369 N -1.94 2.14 -4.38 4.56 6.02 -1.26 -4.52 117.38 118.01 1wcg n GLN 369 Ca 0.13 0.78 -0.28 0.00 -0.01 0.00 0.00 57.00 57.61 1wcg n GLN 369 Cb 0.50 -2.56 -0.17 0.00 1.02 0.00 0.00 30.24 29.03 1wcg n GLN 369 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1wcg s LEU 370 N 1.67 1.68 -0.23 1.08 0.20 -0.09 -0.15 118.68 122.84 1wcg s LEU 370 Ca 0.82 -0.42 -0.06 0.00 0.69 0.00 0.00 54.13 55.16 1wcg s LEU 370 Cb -0.69 -1.07 -0.03 0.00 -0.43 0.00 0.00 46.19 43.98 1wcg s LEU 370 CO 0.41 -0.00 0.04 -0.22 -0.29 0.00 0.00 176.35 176.29 1wcg s LEU 371 N 1.07 3.33 -0.56 -0.68 2.96 0.53 -0.30 118.68 125.04 1wcg s LEU 371 Ca -0.05 -0.22 -0.28 0.00 -0.22 0.00 0.00 54.13 53.36 1wcg s LEU 371 Cb -0.15 -1.87 0.02 0.00 0.50 0.00 0.00 46.19 44.69 1wcg s LEU 371 CO -0.03 0.00 1.31 -0.63 -1.32 0.00 0.00 176.35 175.69 1wcg s ILE 372 N 1.38 3.90 -0.78 6.68 1.01 -0.75 -1.21 121.20 131.44 1wcg s ILE 372 Ca 0.05 0.80 0.25 0.00 0.00 0.00 0.00 60.65 61.75 1wcg s ILE 372 Cb -0.15 -4.55 0.08 0.00 0.01 0.00 0.00 42.46 37.86 1wcg s ILE 372 CO 0.02 -1.21 1.45 0.35 0.00 0.00 0.00 174.94 175.55 1wcg n THR 373 N 6.80 0.26 -3.68 2.92 -2.24 0.96 -0.91 114.28 118.38 1wcg n THR 373 Ca 0.11 -0.18 -0.12 0.00 -2.27 0.00 0.00 64.05 61.59 1wcg n THR 373 Cb 0.49 -0.12 -0.09 0.00 -2.10 0.00 0.00 70.33 68.51 1wcg n THR 373 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1wcg s GLU 374 N -3.10 0.60 -0.24 -0.78 2.02 -1.18 -4.72 118.70 111.30 1wcg s GLU 374 Ca 0.09 0.83 -0.22 0.00 0.02 0.00 0.00 54.97 55.68 1wcg s GLU 374 Cb 0.15 0.23 0.06 0.00 0.10 0.00 0.00 34.13 34.67 1wcg s GLU 374 CO 0.68 -0.10 0.65 1.21 0.02 0.00 0.00 175.26 177.72 1wcg s ASN 375 N 0.68 -0.69 0.00 -0.19 2.47 -0.75 -1.16 114.94 115.30 1wcg s ASN 375 Ca -0.03 1.32 0.00 0.00 0.42 0.00 0.00 52.86 54.56 1wcg s ASN 375 Cb -0.05 1.33 0.00 0.00 -1.45 0.00 0.00 41.25 41.08 1wcg s ASN 375 CO -0.05 -0.23 0.00 0.61 -3.72 0.00 0.00 177.10 173.72 1wcg n GLY 376 N 2.81 -0.88 2.85 1.21 0.00 -1.26 -0.63 105.19 109.28 1wcg n GLY 376 Ca -0.14 -1.05 -0.13 0.00 0.00 0.00 0.00 46.02 44.70 1wcg n GLY 376 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1wcg s TYR 377 N -2.00 -0.01 -0.05 1.61 5.04 -1.26 -4.91 117.35 115.76 1wcg s TYR 377 Ca 0.00 0.12 0.04 0.00 -2.44 0.00 0.00 57.07 54.80 1wcg s TYR 377 Cb 0.00 -0.10 -0.02 0.00 0.35 0.00 0.00 41.96 42.19 1wcg s TYR 377 CO 0.00 -0.06 -0.18 0.20 -1.34 0.00 0.00 175.55 174.18 1wcg s GLY 378 N 0.53 1.45 0.00 8.97 0.00 -1.26 -4.44 107.32 112.57 1wcg s GLY 378 Ca -0.04 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.67 1wcg s GLY 378 CO -0.02 -0.74 0.00 2.09 0.00 0.00 0.00 173.10 174.43 1wcg n ASP 379 N 2.50 0.17 0.00 1.64 5.68 -0.58 -4.41 116.55 121.56 1wcg n ASP 379 Ca -0.17 -0.42 0.15 0.00 -0.50 0.00 0.00 54.79 53.85 1wcg n ASP 379 Cb 0.52 0.00 0.84 0.00 -1.14 0.00 0.00 41.12 41.34 1wcg n ASP 379 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1wcg n ASP 380 N -1.19 0.00 0.00 -1.12 8.00 -1.26 -0.95 116.55 120.02 1wcg n ASP 380 Ca 0.00 -0.64 0.00 0.00 0.71 0.00 0.00 54.79 54.86 1wcg n ASP 380 Cb 0.00 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 40.99 1wcg n ASP 380 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wcg n GLY 381 N 1.02 0.72 3.51 0.44 0.00 -1.26 -4.90 105.19 104.72 1wcg n GLY 381 Ca 0.20 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.75 1wcg n GLY 381 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wcg n GLN 382 N -1.86 0.78 0.12 1.61 0.00 -1.26 -4.90 117.38 111.87 1wcg n GLN 382 Ca 0.00 0.27 -0.02 0.00 0.00 0.00 0.00 57.00 57.26 1wcg n GLN 382 Cb 0.00 -1.51 0.21 0.00 0.00 0.00 0.00 30.24 28.94 1wcg n GLN 382 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1wcg h LEU 383 N 1.69 0.16 -6.45 2.61 3.38 -1.97 -3.32 115.31 111.41 1wcg h LEU 383 Ca -0.35 -0.08 -0.76 0.00 0.09 0.00 0.00 57.88 56.79 1wcg h LEU 383 Cb 1.38 -0.04 -0.15 0.00 0.09 0.00 0.00 40.66 41.94 1wcg h LEU 383 CO 0.60 0.63 2.03 -0.90 0.09 0.00 0.00 178.44 180.89 1wcg n ASP 384 N -3.95 5.07 -3.62 -0.43 5.75 -1.26 -1.69 116.55 116.42 1wcg n ASP 384 Ca -0.02 -3.11 -0.41 0.00 -0.01 0.00 0.00 54.79 51.25 1wcg n ASP 384 Cb 0.53 -1.48 -0.00 0.00 -1.03 0.00 0.00 41.12 39.14 1wcg n ASP 384 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1wcg n ASP 385 N 3.91 6.88 0.12 -1.12 5.75 -1.25 -4.71 116.55 126.12 1wcg n ASP 385 Ca 0.40 -3.10 -0.03 0.00 -0.01 0.00 0.00 54.79 52.05 1wcg n ASP 385 Cb 0.36 -1.42 0.16 0.00 -1.03 0.00 0.00 41.12 39.19 1wcg n ASP 385 CO 0.00 0.00 0.00 -0.26 -0.11 0.00 0.00 177.20 176.83 1wcg h PHE 386 N 5.08 0.12 -0.63 2.11 0.04 -1.93 -2.06 116.94 119.69 1wcg h PHE 386 Ca 0.59 -0.05 -0.08 0.00 2.80 0.00 0.00 57.97 61.23 1wcg h PHE 386 Cb 0.43 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.54 1wcg h PHE 386 CO 1.48 0.67 0.06 0.93 -0.60 0.00 0.00 178.31 180.85 1wcg h GLU 387 N 0.07 1.05 -0.36 1.51 5.08 -2.00 -1.06 114.58 118.88 1wcg h GLU 387 Ca -0.01 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 1wcg h GLU 387 Cb 1.08 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.20 1wcg h GLU 387 CO 0.08 0.99 0.18 -0.22 -1.00 0.00 0.00 179.01 179.05 1wcg h LYS 388 N 0.98 0.51 -0.61 2.33 3.64 -1.84 -1.77 116.57 119.81 1wcg h LYS 388 Ca 0.19 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.53 1wcg h LYS 388 Cb 0.48 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.16 1wcg h LYS 388 CO 0.02 0.44 0.36 0.82 -2.27 0.00 0.00 179.45 178.82 1wcg h ILE 389 N 0.44 1.04 -0.62 2.00 2.04 -1.16 -1.10 117.51 120.16 1wcg h ILE 389 Ca 0.12 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.75 1wcg h ILE 389 Cb 0.09 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 1wcg h ILE 389 CO -0.02 0.13 0.40 -1.28 0.00 0.00 0.00 178.15 177.38 1wcg h SER 390 N 0.70 0.71 0.20 1.72 0.87 -0.97 0.35 113.55 117.13 1wcg h SER 390 Ca 0.25 -0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.78 1wcg h SER 390 Cb 0.06 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 1wcg h SER 390 CO -0.12 0.52 -0.14 0.22 -0.53 0.00 0.00 176.83 176.79 1wcg h TYR 391 N 0.84 -0.36 -0.34 2.24 3.20 -0.96 -1.15 116.97 120.45 1wcg h TYR 391 Ca 0.23 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.10 1wcg h TYR 391 Cb -0.09 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 1wcg h TYR 391 CO -0.03 -0.21 0.21 -0.07 -1.64 0.00 0.00 178.16 176.42 1wcg h LEU 392 N -0.33 0.36 -0.35 2.82 3.38 -0.89 -0.57 115.31 119.72 1wcg h LEU 392 Ca -0.01 -0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.01 1wcg h LEU 392 Cb 0.29 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 1wcg h LEU 392 CO 0.00 0.26 0.07 0.50 0.09 0.00 0.00 178.44 179.36 1wcg h LYS 393 N 0.43 0.18 -0.33 1.13 3.64 -0.85 0.49 116.57 121.27 1wcg h LYS 393 Ca 0.13 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.34 1wcg h LYS 393 Cb -0.03 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1wcg h LYS 393 CO -0.04 0.12 -0.40 -0.91 -2.27 0.00 0.00 179.45 175.94 1wcg h ASN 394 N 0.19 0.85 0.03 4.20 2.35 -0.85 -0.68 115.58 121.66 1wcg h ASN 394 Ca 0.17 -0.39 -0.16 0.00 -0.55 0.00 0.00 56.30 55.36 1wcg h ASN 394 Cb 0.19 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 1wcg h ASN 394 CO -0.22 1.15 -0.56 1.88 -1.65 0.00 0.00 177.43 178.02 1wcg h TYR 395 N 0.65 0.70 -0.65 1.19 -1.99 -0.93 -0.87 116.97 115.06 1wcg h TYR 395 Ca 0.05 -0.25 -0.04 0.00 2.00 0.00 0.00 58.73 60.49 1wcg h TYR 395 Cb 0.97 -0.13 -0.03 0.00 2.00 0.00 0.00 36.73 39.54 1wcg h TYR 395 CO 0.05 0.99 0.27 -0.07 -0.00 0.00 0.00 178.16 179.40 1wcg h LEU 396 N 0.42 0.89 -0.80 3.88 3.38 -0.77 -1.27 115.31 121.04 1wcg h LEU 396 Ca 0.01 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.72 1wcg h LEU 396 Cb 1.11 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 1wcg h LEU 396 CO 0.11 0.81 -0.04 0.78 0.09 0.00 0.00 178.44 180.19 1wcg h ASN 397 N 0.91 0.84 -0.92 -0.43 2.35 -0.97 -1.32 115.58 116.03 1wcg h ASN 397 Ca 0.22 -0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1wcg h ASN 397 Cb 0.19 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.29 1wcg h ASN 397 CO -0.02 0.93 0.55 0.00 -1.65 0.00 0.00 177.43 177.24 1wcg h ALA 398 N 1.16 1.17 -0.45 -0.83 0.00 -0.96 -1.16 119.26 118.19 1wcg h ALA 398 Ca 0.14 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1wcg h ALA 398 Cb 0.53 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1wcg h ALA 398 CO 0.03 0.63 0.22 1.15 0.00 0.00 0.00 179.25 181.29 1wcg h THR 399 N 1.27 1.18 -0.88 0.00 2.02 -0.85 -1.41 112.91 114.24 1wcg h THR 399 Ca 0.33 -0.51 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 1wcg h THR 399 Cb -0.05 0.68 -0.04 0.00 -1.74 0.00 0.00 68.15 67.00 1wcg h THR 399 CO -0.06 0.20 0.48 -0.07 0.37 0.00 0.00 175.52 176.43 1wcg h LEU 400 N 0.59 1.11 -0.45 2.58 3.38 -0.88 -0.83 115.31 120.81 1wcg h LEU 400 Ca 0.16 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1wcg h LEU 400 Cb 0.11 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1wcg h LEU 400 CO -0.02 0.90 0.25 1.56 0.09 0.00 0.00 178.44 181.22 1wcg h GLN 401 N 1.24 0.62 -0.87 1.13 4.20 -1.01 -0.08 115.11 120.34 1wcg h GLN 401 Ca 0.31 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.95 1wcg h GLN 401 Cb 0.04 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 27.65 1wcg h GLN 401 CO -0.05 0.48 0.53 0.00 -0.67 0.00 0.00 178.83 179.12 1wcg h ALA 402 N 1.10 1.30 0.28 3.87 0.00 -0.84 0.14 119.26 125.11 1wcg h ALA 402 Ca 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1wcg h ALA 402 Cb 0.03 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.48 1wcg h ALA 402 CO -0.03 0.61 -0.13 0.52 0.00 0.00 0.00 179.25 180.22 1wcg h MET 403 N 1.19 -0.36 0.06 0.00 2.86 -0.80 -0.61 114.93 117.28 1wcg h MET 403 Ca 0.31 0.02 -0.29 0.00 -2.06 0.00 0.00 59.70 57.69 1wcg h MET 403 Cb -0.06 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 1wcg h MET 403 CO -0.06 -0.01 -1.55 1.88 1.06 0.00 0.00 176.91 178.23 1wcg h TYR 404 N -0.82 0.23 0.07 -0.22 0.05 -0.98 -2.23 116.97 113.07 1wcg h TYR 404 Ca -0.04 -0.17 -0.30 0.00 0.05 0.00 0.00 58.73 58.28 1wcg h TYR 404 Cb 0.51 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 38.22 1wcg h TYR 404 CO 0.04 1.23 -1.62 0.93 -1.05 0.00 0.00 178.16 177.69 1wcg h GLU 405 N 0.03 0.16 -0.02 4.88 5.08 -1.16 -3.39 114.58 120.17 1wcg h GLU 405 Ca -0.24 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1wcg h GLU 405 Cb 1.98 0.10 0.00 0.00 0.50 0.00 0.00 28.75 31.33 1wcg h GLU 405 CO 0.12 1.13 -0.39 -0.25 -1.00 0.00 0.00 179.01 178.62 1wcg n ASP 406 N -3.93 1.92 -2.25 1.42 8.00 -1.05 -4.98 116.55 115.68 1wcg n ASP 406 Ca -0.31 -1.45 -0.18 0.00 0.71 0.00 0.00 54.79 53.57 1wcg n ASP 406 Cb 0.88 0.37 0.01 0.00 -0.02 0.00 0.00 41.12 42.36 1wcg n ASP 406 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1wcg n LYS 407 N -0.01 -2.94 -2.38 -1.24 4.76 -0.62 -4.95 118.16 110.77 1wcg n LYS 407 Ca 0.10 0.77 -0.42 0.00 -2.87 0.00 0.00 58.31 55.90 1wcg n LYS 407 Cb 0.46 -5.24 -0.03 0.00 -1.84 0.00 0.00 35.03 28.38 1wcg n LYS 407 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1wcg n ASN 409 N 3.18 8.54 -4.69 0.00 5.15 -1.26 -4.32 115.26 121.86 1wcg n ASN 409 Ca 0.07 -2.71 -0.41 0.00 -0.60 0.00 0.00 54.58 50.92 1wcg n ASN 409 Cb 0.45 -1.51 -0.04 0.00 -0.53 0.00 0.00 39.78 38.16 1wcg n ASN 409 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1wcg s VAL 410 N 1.32 4.88 -0.45 3.44 1.01 -1.26 -0.92 120.40 128.42 1wcg s VAL 410 Ca 0.66 1.78 0.14 0.00 0.00 0.00 0.00 61.98 64.56 1wcg s VAL 410 Cb 0.18 -4.20 -0.17 0.00 0.00 0.00 0.00 36.38 32.19 1wcg s VAL 410 CO -0.07 0.08 0.50 2.30 0.00 0.00 0.00 175.10 177.91 1wcg n ILE 411 N 4.38 0.00 -3.74 2.22 -5.35 0.59 -4.89 119.36 112.58 1wcg n ILE 411 Ca 0.05 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.31 1wcg n ILE 411 Cb 0.50 0.74 -0.00 0.00 -1.74 0.00 0.00 39.64 39.13 1wcg n ILE 411 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1wcg s GLY 412 N -2.73 -0.27 -0.09 3.28 0.00 -1.24 -1.71 107.32 104.56 1wcg s GLY 412 Ca 0.02 0.36 -0.07 0.00 0.00 0.00 0.00 44.72 45.03 1wcg s GLY 412 CO 0.58 1.31 0.22 -0.47 0.00 0.00 0.00 173.10 174.74 1wcg s TYR 413 N -2.48 -0.27 -0.14 1.90 5.04 0.06 -1.81 117.35 119.66 1wcg s TYR 413 Ca 0.17 0.65 0.00 0.00 -2.44 0.00 0.00 57.07 55.46 1wcg s TYR 413 Cb 0.02 0.06 0.02 0.00 0.35 0.00 0.00 41.96 42.41 1wcg s TYR 413 CO -0.01 -0.16 -0.13 0.99 -1.34 0.00 0.00 175.55 174.90 1wcg s THR 414 N 0.56 1.47 -0.10 4.34 2.01 -0.09 -1.03 115.64 122.79 1wcg s THR 414 Ca -0.04 -0.57 -0.26 0.00 0.31 0.00 0.00 61.69 61.13 1wcg s THR 414 Cb -0.05 -1.39 -0.02 0.00 0.01 0.00 0.00 72.50 71.05 1wcg s THR 414 CO -0.03 0.44 0.86 -0.69 -0.69 0.00 0.00 174.62 174.51 1wcg s VAL 415 N 1.47 4.91 -0.42 3.82 1.01 -0.73 -1.80 120.40 128.65 1wcg s VAL 415 Ca 0.04 1.74 -0.19 0.00 0.00 0.00 0.00 61.98 63.56 1wcg s VAL 415 Cb -0.13 -4.18 0.02 0.00 0.00 0.00 0.00 36.38 32.09 1wcg s VAL 415 CO -0.09 0.11 0.55 0.86 0.00 0.00 0.00 175.10 176.52 1wcg s TRP 416 N 1.55 3.12 0.10 5.22 -0.11 0.20 -2.04 118.94 126.97 1wcg s TRP 416 Ca 0.42 -0.16 -0.05 0.00 1.22 0.00 0.00 56.10 57.54 1wcg s TRP 416 Cb -0.18 -3.12 -0.02 0.00 -1.50 0.00 0.00 33.47 28.64 1wcg s TRP 416 CO 0.18 -0.77 0.11 0.45 -4.62 0.00 0.00 176.95 172.30 1wcg s SER 417 N 1.90 0.26 0.21 5.86 0.15 -0.97 -4.20 113.70 116.91 1wcg s SER 417 Ca 0.18 -0.90 -0.09 0.00 0.70 0.00 0.00 55.95 55.84 1wcg s SER 417 Cb -0.15 0.30 0.31 0.00 -1.71 0.00 0.00 66.02 64.77 1wcg s SER 417 CO 0.16 -0.72 1.73 0.25 1.20 0.00 0.00 173.24 175.87 1wcg h LEU 418 N 2.86 0.19 -8.62 3.45 5.85 -1.71 -0.98 115.31 116.35 1wcg h LEU 418 Ca -0.34 0.09 -0.56 0.00 0.84 0.00 0.00 57.88 57.91 1wcg h LEU 418 Cb 1.19 0.08 -0.23 0.00 0.37 0.00 0.00 40.66 42.07 1wcg h LEU 418 CO 0.58 0.10 -0.83 -0.76 -0.34 0.00 0.00 178.44 177.20 1wcg s LEU 419 N -10.43 2.25 0.56 2.25 1.43 -1.26 -1.62 118.68 111.85 1wcg s LEU 419 Ca -0.13 -0.62 -0.19 0.00 -1.03 0.00 0.00 54.13 52.16 1wcg s LEU 419 Cb 0.18 -0.90 -0.07 0.00 0.03 0.00 0.00 46.19 45.43 1wcg s LEU 419 CO 0.75 0.09 0.86 0.47 0.23 0.00 0.00 176.35 178.74 1wcg n ASP 420 N 1.37 0.38 -2.92 2.29 8.00 -0.69 -4.10 116.55 120.87 1wcg n ASP 420 Ca -0.19 0.83 -0.09 0.00 0.71 0.00 0.00 54.79 56.05 1wcg n ASP 420 Cb 0.53 -1.33 0.02 0.00 -0.02 0.00 0.00 41.12 40.33 1wcg n ASP 420 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1wcg s ASN 421 N -1.14 0.10 -0.60 -2.24 2.20 -1.26 -4.83 114.94 107.16 1wcg s ASN 421 Ca 0.72 -1.19 -0.28 0.00 -0.94 0.00 0.00 52.86 51.17 1wcg s ASN 421 Cb -0.45 0.84 0.01 0.00 -2.00 0.00 0.00 41.25 39.65 1wcg s ASN 421 CO 0.51 -1.67 1.44 0.12 -2.94 0.00 0.00 177.10 174.56 1wcg s PHE 422 N -2.32 2.21 -0.99 1.54 5.36 -0.70 -4.55 117.98 118.52 1wcg s PHE 422 Ca 0.17 0.40 -0.07 0.00 -0.96 0.00 0.00 56.93 56.47 1wcg s PHE 422 Cb -0.05 -4.40 -0.03 0.00 -0.34 0.00 0.00 43.02 38.20 1wcg s PHE 422 CO 0.12 -2.04 2.88 -1.91 -1.46 0.00 0.00 175.22 172.82 1wcg n GLU 423 N 8.87 3.41 0.00 10.12 4.07 0.37 -4.67 120.64 142.81 1wcg n GLU 423 Ca 0.11 -2.38 0.00 0.00 -0.06 0.00 0.00 57.16 54.83 1wcg n GLU 423 Cb 0.49 -2.47 0.00 0.00 -0.06 0.00 0.00 31.44 29.41 1wcg n GLU 423 CO 0.00 0.00 0.00 0.91 -0.06 0.00 0.00 177.13 177.98 1wcg n TRP 424 N 2.29 0.00 0.30 4.31 7.02 -1.26 -1.10 117.44 128.99 1wcg n TRP 424 Ca 0.61 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 57.23 1wcg n TRP 424 Cb 0.43 0.00 0.62 0.00 -2.42 0.00 0.00 31.31 29.94 1wcg n TRP 424 CO 0.00 0.00 0.00 0.74 -2.02 0.00 0.00 177.69 176.41 1wcg h PHE 425 N 0.00 0.00 -0.00 -5.99 -1.00 -1.89 -0.59 116.94 107.47 1wcg h PHE 425 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1wcg h PHE 425 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 1wcg h PHE 425 CO 0.00 0.00 -0.15 0.66 -1.61 0.00 0.00 178.31 177.21 1wcg n TYR 426 N -2.45 0.00 -4.96 -0.55 4.01 -0.26 -0.09 117.16 112.85 1wcg n TYR 426 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1wcg n TYR 426 Cb 0.17 -0.21 0.00 0.00 -0.31 0.00 0.00 39.34 38.99 1wcg n TYR 426 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wcg n GLY 427 N 1.32 1.97 0.12 2.72 0.00 -0.23 -2.43 105.19 108.66 1wcg n GLY 427 Ca 0.13 -0.50 0.15 0.00 0.00 0.00 0.00 46.02 45.80 1wcg n GLY 427 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1wcg n TYR 428 N 7.12 0.00 0.31 1.61 4.01 -1.26 -0.48 117.16 128.46 1wcg n TYR 428 Ca 0.00 0.00 0.20 0.00 -0.16 0.00 0.00 57.90 57.94 1wcg n TYR 428 Cb 0.00 -0.12 0.94 0.00 -0.31 0.00 0.00 39.34 39.85 1wcg n TYR 428 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1wcg h SER 429 N 0.59 0.00 -3.41 7.72 4.64 -1.82 -3.38 113.55 117.89 1wcg h SER 429 Ca 0.00 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.67 1wcg h SER 429 Cb 0.27 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.11 1wcg h SER 429 CO 0.00 0.01 -0.69 -0.63 -0.87 0.00 0.00 176.83 174.65 1wcg s ILE 430 N -3.93 3.65 -0.35 0.95 -1.09 -1.26 -4.63 121.20 114.56 1wcg s ILE 430 Ca -0.02 -0.41 -0.02 0.00 -2.23 0.00 0.00 60.65 57.96 1wcg s ILE 430 Cb 0.11 -2.64 0.07 0.00 -1.58 0.00 0.00 42.46 38.42 1wcg s ILE 430 CO 0.49 0.44 0.09 -1.00 -1.23 0.00 0.00 174.94 173.72 1wcg s HIS 431 N 1.09 3.41 -2.23 3.97 3.76 -0.13 -4.69 115.29 120.47 1wcg s HIS 431 Ca 0.02 -2.07 0.25 0.00 -0.15 0.00 0.00 55.06 53.10 1wcg s HIS 431 Cb -0.15 -2.58 0.36 0.00 1.11 0.00 0.00 32.58 31.32 1wcg s HIS 431 CO 0.00 -0.87 1.33 1.19 -0.85 0.00 0.00 174.74 175.55 1wcg n PHE 432 N 4.62 0.00 -2.49 1.40 3.72 -1.26 -1.52 117.46 121.93 1wcg n PHE 432 Ca -0.08 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.92 1wcg n PHE 432 Cb 0.43 -0.03 -0.04 0.00 -0.94 0.00 0.00 39.48 38.89 1wcg n PHE 432 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1wcg s GLY 433 N -2.32 3.02 0.51 1.37 0.00 -1.26 -2.30 107.32 106.34 1wcg s GLY 433 Ca 0.24 0.86 0.23 0.00 0.00 0.00 0.00 44.72 46.05 1wcg s GLY 433 CO 0.47 1.43 2.09 1.41 0.00 0.00 0.00 173.10 178.51 1wcg h LEU 434 N 3.60 0.00 -8.14 0.66 3.38 -1.05 -3.42 115.31 110.34 1wcg h LEU 434 Ca -0.47 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 56.84 1wcg h LEU 434 Cb 1.21 0.00 -0.34 0.00 0.09 0.00 0.00 40.66 41.62 1wcg h LEU 434 CO 0.66 0.11 -0.86 -0.69 0.09 0.00 0.00 178.44 177.75 1wcg s VAL 435 N -4.49 1.96 0.34 1.22 1.01 -0.64 -1.32 120.40 118.48 1wcg s VAL 435 Ca -0.04 -0.92 -0.27 0.00 0.00 0.00 0.00 61.98 60.75 1wcg s VAL 435 Cb 0.15 -1.75 -0.09 0.00 0.00 0.00 0.00 36.38 34.68 1wcg s VAL 435 CO 0.62 0.53 1.12 -0.75 0.00 0.00 0.00 175.10 176.62 1wcg s LYS 436 N 0.92 4.38 -0.10 2.72 2.36 0.77 -1.70 119.74 129.10 1wcg s LYS 436 Ca -0.05 1.78 0.04 0.00 -2.55 0.00 0.00 55.97 55.19 1wcg s LYS 436 Cb -0.15 -2.93 -0.01 0.00 -1.05 0.00 0.00 37.83 33.70 1wcg s LYS 436 CO -0.04 -0.01 -0.21 0.42 1.55 0.00 0.00 175.35 177.06 1wcg s ILE 437 N -1.32 2.31 -0.78 5.43 -1.09 -1.26 -0.91 121.20 123.58 1wcg s ILE 437 Ca 0.50 -0.94 -0.23 0.00 -2.23 0.00 0.00 60.65 57.75 1wcg s ILE 437 Cb -0.30 -1.89 0.07 0.00 -1.58 0.00 0.00 42.46 38.75 1wcg s ILE 437 CO 0.38 0.56 1.14 -0.62 -1.23 0.00 0.00 174.94 175.17 1wcg s ASP 438 N 0.20 6.30 0.00 3.58 -1.08 -0.71 -4.86 116.67 120.10 1wcg s ASP 438 Ca -0.13 -1.13 0.21 0.00 -0.52 0.00 0.00 52.55 50.98 1wcg s ASP 438 Cb -0.16 -2.47 0.99 0.00 -1.46 0.00 0.00 42.92 39.81 1wcg s ASP 438 CO 0.07 -1.47 1.68 0.49 0.52 0.00 0.00 175.17 176.46 1wcg n PHE 439 N 8.04 0.00 1.21 -5.34 3.72 -1.26 -2.21 117.46 121.62 1wcg n PHE 439 Ca 0.08 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.61 1wcg n PHE 439 Cb 0.48 -0.40 0.31 0.00 -0.94 0.00 0.00 39.48 38.92 1wcg n PHE 439 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1wcg n ASN 440 N -1.40 1.31 -4.51 4.37 3.02 -1.26 -4.86 115.26 111.93 1wcg n ASN 440 Ca 0.07 -1.09 -0.36 0.00 -0.03 0.00 0.00 54.58 53.17 1wcg n ASN 440 Cb 0.21 0.19 -0.12 0.00 -0.61 0.00 0.00 39.78 39.46 1wcg n ASN 440 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1wcg s ASP 441 N -2.44 5.34 0.53 6.41 2.15 -0.94 -4.99 116.67 122.73 1wcg s ASP 441 Ca 0.24 -0.10 0.30 0.00 0.43 0.00 0.00 52.55 53.41 1wcg s ASP 441 Cb 0.19 -1.95 1.45 0.00 -0.30 0.00 0.00 42.92 42.32 1wcg s ASP 441 CO 0.51 0.03 1.92 -0.65 -0.17 0.00 0.00 175.17 176.81 1wcg h PRO 442 N 7.76 0.00 -0.00 4.34 0.11 -1.89 0.19 132.00 142.51 1wcg h PRO 442 Ca -0.37 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1wcg h PRO 442 Cb 1.18 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1wcg h PRO 442 CO 0.61 0.00 -0.05 1.04 -0.21 0.00 0.00 178.00 179.39 1wcg n GLN 443 N -4.30 0.69 -3.88 1.05 6.02 -1.26 -4.95 117.38 110.74 1wcg n GLN 443 Ca 0.16 -0.15 -0.24 0.00 -0.01 0.00 0.00 57.00 56.76 1wcg n GLN 443 Cb 0.85 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.61 1wcg n GLN 443 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1wcg n ARG 444 N -1.03 -3.74 -1.72 -1.09 5.12 0.67 -4.81 116.66 110.06 1wcg n ARG 444 Ca 0.16 0.46 -0.43 0.00 -1.93 0.00 0.00 57.85 56.12 1wcg n ARG 444 Cb 0.24 -4.71 -0.02 0.00 -1.16 0.00 0.00 32.46 26.81 1wcg n ARG 444 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1wcg n THR 445 N -4.37 1.26 -3.30 0.55 -1.04 -1.26 -4.50 114.28 101.62 1wcg n THR 445 Ca -0.31 -0.32 -0.38 0.00 -2.04 0.00 0.00 64.05 61.00 1wcg n THR 445 Cb 0.68 -1.74 -0.06 0.00 -1.82 0.00 0.00 70.33 67.39 1wcg n THR 445 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1wcg s ARG 446 N -0.87 4.20 -0.07 -2.82 3.00 -1.26 -1.73 118.95 119.40 1wcg s ARG 446 Ca 0.63 0.62 -0.01 0.00 0.00 0.00 0.00 55.73 56.97 1wcg s ARG 446 Cb -0.56 -3.30 0.03 0.00 0.00 0.00 0.00 34.95 31.12 1wcg s ARG 446 CO 0.53 0.48 -0.01 0.99 0.00 0.00 0.00 175.30 177.28 1wcg s THR 447 N -0.50 0.45 0.21 0.02 2.01 -0.08 -4.97 115.64 112.77 1wcg s THR 447 Ca 0.28 0.05 -0.30 0.00 0.31 0.00 0.00 61.69 62.03 1wcg s THR 447 Cb -0.18 -0.57 -0.10 0.00 0.01 0.00 0.00 72.50 71.67 1wcg s THR 447 CO 0.16 0.26 1.43 -0.54 -0.69 0.00 0.00 174.62 175.24 1wcg s LYS 448 N 1.75 4.29 0.66 4.92 1.02 -1.26 -0.16 119.74 130.96 1wcg s LYS 448 Ca 0.02 2.24 -0.02 0.00 0.02 0.00 0.00 55.97 58.23 1wcg s LYS 448 Cb -0.13 -3.15 0.08 0.00 -0.52 0.00 0.00 37.83 34.12 1wcg s LYS 448 CO -0.05 -0.42 0.93 1.03 -0.92 0.00 0.00 175.35 175.92 1wcg s ARG 449 N 0.09 2.07 0.35 1.68 0.52 -0.44 -4.87 118.95 118.34 1wcg s ARG 449 Ca 0.61 -0.77 0.05 0.00 -0.52 0.00 0.00 55.73 55.10 1wcg s ARG 449 Cb -0.41 -2.33 0.69 0.00 0.52 0.00 0.00 34.95 33.43 1wcg s ARG 449 CO 0.39 -1.17 1.94 0.93 0.02 0.00 0.00 175.30 177.40 1wcg h GLU 450 N -0.37 0.80 0.00 3.54 4.39 -1.62 -1.89 114.58 119.43 1wcg h GLU 450 Ca -0.41 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.23 1wcg h GLU 450 Cb 1.29 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 29.76 1wcg h GLU 450 CO 0.49 0.53 -0.08 0.66 -1.16 0.00 0.00 179.01 179.45 1wcg h SER 451 N 0.82 0.00 0.03 1.42 4.64 -1.82 -1.84 113.55 116.79 1wcg h SER 451 Ca 0.35 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.67 1wcg h SER 451 Cb 0.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 1wcg h SER 451 CO -0.12 0.08 -0.07 0.22 -0.87 0.00 0.00 176.83 176.07 1wcg h TYR 452 N 0.00 -0.16 -0.64 4.77 3.20 -1.45 0.28 116.97 122.96 1wcg h TYR 452 Ca -0.00 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 1wcg h TYR 452 Cb 0.15 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 1wcg h TYR 452 CO 0.00 -0.10 0.14 1.15 -1.64 0.00 0.00 178.16 177.70 1wcg h THR 453 N -0.13 1.26 0.05 1.81 2.02 -1.49 -0.44 112.91 115.99 1wcg h THR 453 Ca 0.02 -0.97 0.02 0.00 0.77 0.00 0.00 66.41 66.25 1wcg h THR 453 Cb 0.15 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.18 1wcg h THR 453 CO -0.05 0.36 -0.19 0.22 0.37 0.00 0.00 175.52 176.23 1wcg h TYR 454 N 0.96 -0.50 -0.50 3.16 3.20 -1.13 -2.07 116.97 120.09 1wcg h TYR 454 Ca 0.20 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.97 1wcg h TYR 454 Cb 0.39 0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 1wcg h TYR 454 CO 0.03 -0.27 -0.14 0.35 -1.64 0.00 0.00 178.16 176.49 1wcg h PHE 455 N -0.33 1.07 -0.76 -3.82 3.57 -0.77 -1.63 116.94 114.27 1wcg h PHE 455 Ca 0.04 -0.22 0.12 0.00 3.53 0.00 0.00 57.97 61.44 1wcg h PHE 455 Cb 0.38 -0.26 -0.08 0.00 2.79 0.00 0.00 35.95 38.77 1wcg h PHE 455 CO -0.21 1.02 0.36 -0.22 -2.23 0.00 0.00 178.31 177.03 1wcg h LYS 456 N 0.85 0.55 -0.15 1.11 3.64 -0.95 -0.63 116.57 120.99 1wcg h LYS 456 Ca 0.13 -0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 59.31 1wcg h LYS 456 Cb 0.69 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 1wcg h LYS 456 CO 0.05 0.37 -0.60 -0.91 -2.27 0.00 0.00 179.45 176.09 1wcg h ASN 457 N 0.57 0.55 -0.52 4.20 2.35 -0.88 -2.16 115.58 119.68 1wcg h ASN 457 Ca 0.40 -0.31 -0.02 0.00 -0.55 0.00 0.00 56.30 55.81 1wcg h ASN 457 Cb 0.51 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 1wcg h ASN 457 CO -0.33 1.02 0.23 0.58 -1.65 0.00 0.00 177.43 177.28 1wcg h VAL 458 N 0.36 1.21 -0.77 2.81 2.07 -0.69 -0.88 116.25 120.35 1wcg h VAL 458 Ca -0.00 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 66.88 1wcg h VAL 458 Cb 1.14 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.53 1wcg h VAL 458 CO 0.11 0.24 0.36 0.58 0.02 0.00 0.00 177.57 178.87 1wcg h VAL 459 N 0.69 1.25 -0.21 2.57 2.07 -1.02 0.45 116.25 122.04 1wcg h VAL 459 Ca 0.18 -0.71 -0.14 0.00 0.82 0.00 0.00 66.70 66.85 1wcg h VAL 459 Cb 0.16 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1wcg h VAL 459 CO -0.02 0.30 -0.40 -1.28 0.02 0.00 0.00 177.57 176.19 1wcg h SER 460 N 1.10 0.72 0.21 0.57 0.87 -1.15 -3.36 113.55 112.51 1wcg h SER 460 Ca 0.27 -0.54 -0.13 0.00 -1.23 0.00 0.00 61.79 60.16 1wcg h SER 460 Cb 0.13 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.86 1wcg h SER 460 CO -0.03 1.12 -1.92 0.35 -0.53 0.00 0.00 176.83 175.82 1wcg n THR 461 N -4.23 0.64 -0.98 2.23 -2.24 -0.36 -4.98 114.28 104.36 1wcg n THR 461 Ca -0.06 -0.64 0.00 0.00 -2.27 0.00 0.00 64.05 61.09 1wcg n THR 461 Cb 0.53 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 1wcg n THR 461 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wcg n GLY 462 N 1.41 0.53 3.20 3.38 0.00 0.16 -4.83 105.19 109.04 1wcg n GLY 462 Ca -0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 1wcg n GLY 462 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wcg s LYS 463 N -0.25 2.78 0.00 1.61 1.02 -1.24 -0.47 119.74 123.19 1wcg s LYS 463 Ca 0.00 -1.01 0.04 0.00 0.02 0.00 0.00 55.97 55.01 1wcg s LYS 463 Cb 0.00 -3.02 0.22 0.00 -0.52 0.00 0.00 37.83 34.51 1wcg s LYS 463 CO 0.00 -0.43 0.70 -2.30 -0.92 0.00 0.00 175.35 172.40