#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wgg s GLN 3 N 0.00 4.13 0.35 -1.46 -1.52 -1.26 -4.96 119.66 114.95 2wgg s GLN 3 Ca 0.00 2.58 -0.29 0.00 -1.95 0.00 0.00 55.36 55.71 2wgg s GLN 3 Cb 0.00 -3.14 -0.11 0.00 -0.22 0.00 0.00 33.01 29.54 2wgg s GLN 3 CO 0.00 -0.75 1.49 -1.25 -0.25 0.00 0.00 175.29 174.54 2wgg s PRO 4 N 1.34 4.14 0.21 2.91 0.04 -1.26 -4.97 135.00 137.41 2wgg s PRO 4 Ca 0.75 2.54 0.00 0.00 0.04 0.00 0.00 61.00 64.33 2wgg s PRO 4 Cb -0.49 -2.99 -0.05 0.00 0.04 0.00 0.00 34.50 31.02 2wgg s PRO 4 CO 0.32 -0.53 0.09 -1.54 0.04 0.00 0.00 177.00 175.39 2wgg s SER 5 N -0.02 0.73 0.13 6.66 1.04 -1.26 -4.83 113.70 116.15 2wgg s SER 5 Ca 0.55 -1.34 -0.14 0.00 0.48 0.00 0.00 55.95 55.49 2wgg s SER 5 Cb -0.46 0.25 -0.00 0.00 0.10 0.00 0.00 66.02 65.90 2wgg s SER 5 CO 0.59 -0.75 1.60 0.74 0.98 0.00 0.00 173.24 176.40 2wgg h THR 6 N 2.56 1.25 0.12 2.02 2.02 -1.30 0.33 112.91 119.91 2wgg h THR 6 Ca -0.37 -0.94 0.00 0.00 0.77 0.00 0.00 66.41 65.87 2wgg h THR 6 Cb 1.24 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 68.66 2wgg h THR 6 CO 0.58 0.32 -0.11 0.00 0.37 0.00 0.00 175.52 176.68 2wgg h ALA 7 N 0.92 -0.23 0.00 6.16 0.00 -1.70 -2.08 119.26 122.33 2wgg h ALA 7 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2wgg h ALA 7 Cb 0.42 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2wgg h ALA 7 CO 0.01 -0.64 0.00 0.27 0.00 0.00 0.00 179.25 178.89 2wgg n ASN 8 N -5.23 0.00 -0.19 0.00 0.23 -1.25 -4.86 115.26 103.97 2wgg n ASN 8 Ca -0.08 -0.96 -0.02 0.00 -0.53 0.00 0.00 54.58 52.99 2wgg n ASN 8 Cb 0.15 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 37.84 2wgg n ASN 8 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wgg n GLY 9 N 0.32 0.55 0.25 4.83 0.00 -0.78 -4.90 105.19 105.45 2wgg n GLY 9 Ca 0.10 -0.30 -0.04 0.00 0.00 0.00 0.00 46.02 45.79 2wgg n GLY 9 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wgg h GLY 10 N 0.00 0.59 -5.19 -0.02 0.00 -1.20 -3.42 103.07 93.83 2wgg h GLY 10 Ca -0.05 -0.46 -0.67 0.00 0.00 0.00 0.00 47.33 46.15 2wgg h GLY 10 CO 0.07 0.42 -0.60 -1.36 0.00 0.00 0.00 176.54 175.08 2wgg s PHE 11 N -4.59 3.23 0.57 5.60 0.08 -0.59 -4.79 117.98 117.49 2wgg s PHE 11 Ca -0.07 0.22 -0.21 0.00 0.12 0.00 0.00 56.93 56.99 2wgg s PHE 11 Cb 0.14 -1.77 -0.04 0.00 -0.57 0.00 0.00 43.02 40.78 2wgg s PHE 11 CO 0.79 0.52 1.33 -0.35 -0.10 0.00 0.00 175.22 177.42 2wgg n PRO 12 N 1.73 1.53 -2.24 0.24 -0.04 -1.26 -4.61 135.00 130.35 2wgg n PRO 12 Ca -0.17 0.57 -0.42 0.00 -0.04 0.00 0.00 63.50 63.44 2wgg n PRO 12 Cb 0.53 -2.56 -0.03 0.00 -0.04 0.00 0.00 33.50 31.41 2wgg n PRO 12 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2wgg s SER 13 N -1.03 6.88 -0.08 3.54 0.15 -1.26 -4.90 113.70 117.00 2wgg s SER 13 Ca 0.75 2.17 0.04 0.00 0.70 0.00 0.00 55.95 59.61 2wgg s SER 13 Cb -0.41 -2.57 -0.01 0.00 -1.71 0.00 0.00 66.02 61.32 2wgg s SER 13 CO 0.47 -0.65 -0.20 -0.69 1.20 0.00 0.00 173.24 173.37 2wgg s VAL 14 N 1.70 2.48 0.07 4.45 1.01 -1.26 -0.89 120.40 127.96 2wgg s VAL 14 Ca 0.63 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.77 2wgg s VAL 14 Cb -0.33 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 2wgg s VAL 14 CO 0.28 0.56 -0.16 0.68 0.00 0.00 0.00 175.10 176.46 2wgg s VAL 15 N -0.04 1.30 -0.18 2.92 -7.23 0.54 -1.44 120.40 116.27 2wgg s VAL 15 Ca -0.06 -1.29 -0.18 0.00 -1.81 0.00 0.00 61.98 58.64 2wgg s VAL 15 Cb -0.15 -1.20 -0.04 0.00 0.56 0.00 0.00 36.38 35.55 2wgg s VAL 15 CO 0.05 -0.10 0.50 -0.69 -0.31 0.00 0.00 175.10 174.54 2wgg s VAL 16 N -1.12 5.14 0.00 1.32 1.01 -0.15 -1.72 120.40 124.87 2wgg s VAL 16 Ca 0.02 0.93 0.00 0.00 0.00 0.00 0.00 61.98 62.93 2wgg s VAL 16 Cb -0.09 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.46 2wgg s VAL 16 CO 0.02 0.23 0.07 0.35 0.00 0.00 0.00 175.10 175.77 2wgg n THR 17 N 4.28 0.00 -3.60 3.92 -2.24 -0.59 0.91 114.28 116.96 2wgg n THR 17 Ca -0.06 -0.47 -0.12 0.00 -2.27 0.00 0.00 64.05 61.13 2wgg n THR 17 Cb 0.51 1.01 -0.06 0.00 -2.10 0.00 0.00 70.33 69.68 2wgg n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wgg s ALA 18 N -0.81 -1.89 0.01 6.98 0.00 -1.24 -4.78 121.76 120.04 2wgg s ALA 18 Ca 0.00 1.72 0.01 0.00 0.00 0.00 0.00 51.96 53.68 2wgg s ALA 18 Cb 0.00 -0.92 -0.01 0.00 0.00 0.00 0.00 23.12 22.18 2wgg s ALA 18 CO 0.00 -0.30 -0.03 0.14 0.00 0.00 0.00 175.76 175.57 2wgg s VAL 19 N -0.39 0.17 0.01 0.00 -7.23 -1.26 0.06 120.40 111.76 2wgg s VAL 19 Ca -0.01 -0.50 -0.05 0.00 -1.81 0.00 0.00 61.98 59.61 2wgg s VAL 19 Cb -0.03 -0.23 -0.01 0.00 0.56 0.00 0.00 36.38 36.67 2wgg s VAL 19 CO 0.00 -0.21 0.08 0.28 -0.31 0.00 0.00 175.10 174.95 2wgg s THR 20 N -0.71 0.10 -0.23 5.32 -1.32 -0.21 -4.93 115.64 113.66 2wgg s THR 20 Ca -0.07 -0.84 -0.27 0.00 -1.21 0.00 0.00 61.69 59.30 2wgg s THR 20 Cb -0.05 -0.47 0.13 0.00 -1.51 0.00 0.00 72.50 70.59 2wgg s THR 20 CO -0.00 -0.46 1.03 0.00 -2.21 0.00 0.00 174.62 172.97 2wgg s ALA 21 N -1.65 -1.96 -0.06 11.08 0.00 -1.26 -1.60 121.76 126.31 2wgg s ALA 21 Ca -0.13 1.73 0.06 0.00 0.00 0.00 0.00 51.96 53.62 2wgg s ALA 21 Cb -0.07 -1.11 -0.01 0.00 0.00 0.00 0.00 23.12 21.93 2wgg s ALA 21 CO -0.00 -0.27 -0.24 -0.08 0.00 0.00 0.00 175.76 175.17 2wgg s THR 22 N -0.40 2.15 0.32 0.00 -1.32 -0.44 -3.84 115.64 112.11 2wgg s THR 22 Ca 0.01 -1.03 0.07 0.00 -1.21 0.00 0.00 61.69 59.52 2wgg s THR 22 Cb -0.03 -1.79 -0.03 0.00 -1.51 0.00 0.00 72.50 69.14 2wgg s THR 22 CO -0.03 0.57 0.27 0.42 -2.21 0.00 0.00 174.62 173.64 2wgg s THR 23 N -0.18 0.01 -0.22 5.08 -4.23 -0.04 -2.28 115.64 113.77 2wgg s THR 23 Ca -0.03 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.77 2wgg s THR 23 Cb -0.14 -2.50 0.32 0.00 1.34 0.00 0.00 72.50 71.52 2wgg s THR 23 CO 0.03 0.00 1.84 0.77 -0.54 0.00 0.00 174.62 176.72 2wgg h SER 24 N 2.17 0.00 0.16 3.99 4.64 -1.69 -0.30 113.55 122.51 2wgg h SER 24 Ca -0.26 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 60.74 2wgg h SER 24 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2wgg h SER 24 CO 0.38 0.00 -1.64 0.40 -0.87 0.00 0.00 176.83 175.10 2wgg h ILE 25 N 0.00 0.96 -1.75 0.95 2.04 -1.85 -3.33 117.51 114.53 2wgg h ILE 25 Ca 0.00 -2.46 0.06 0.00 1.00 0.00 0.00 64.86 63.46 2wgg h ILE 25 Cb 0.46 2.74 -0.21 0.00 -0.74 0.00 0.00 36.82 39.07 2wgg h ILE 25 CO 0.00 0.81 0.47 -0.55 0.00 0.00 0.00 178.15 178.88 2wgg s SER 26 N -7.19 -0.42 0.00 1.72 0.15 -1.17 -4.81 113.70 101.97 2wgg s SER 26 Ca -0.18 0.40 0.26 0.00 0.70 0.00 0.00 55.95 57.14 2wgg s SER 26 Cb 0.05 0.36 1.20 0.00 -1.71 0.00 0.00 66.02 65.92 2wgg s SER 26 CO 0.82 -0.43 1.85 -0.81 1.20 0.00 0.00 173.24 175.87 2wgg n PRO 27 N 0.62 0.19 -3.90 5.44 -0.04 -1.26 -0.86 135.00 135.19 2wgg n PRO 27 Ca -0.12 0.05 -0.35 0.00 -0.04 0.00 0.00 63.50 63.04 2wgg n PRO 27 Cb 0.58 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.41 2wgg n PRO 27 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2wgg s ASP 28 N -2.79 4.53 0.20 3.54 -1.08 -1.26 -4.42 116.67 115.39 2wgg s ASP 28 Ca 0.18 -0.33 -0.11 0.00 -0.52 0.00 0.00 52.55 51.77 2wgg s ASP 28 Cb 0.17 -1.79 0.16 0.00 -1.46 0.00 0.00 42.92 40.00 2wgg s ASP 28 CO 0.43 -0.01 1.86 -0.29 0.52 0.00 0.00 175.17 177.68 2wgg h ILE 29 N 5.64 1.14 -0.76 4.11 6.09 -1.85 0.16 117.51 132.04 2wgg h ILE 29 Ca -0.40 -0.31 -0.02 0.00 -1.37 0.00 0.00 64.86 62.75 2wgg h ILE 29 Cb 1.17 0.16 -0.04 0.00 0.47 0.00 0.00 36.82 38.58 2wgg h ILE 29 CO 0.60 0.17 0.38 -0.33 -3.07 0.00 0.00 178.15 175.90 2wgg h GLU 30 N 0.91 1.08 -0.09 2.19 4.39 -1.94 0.28 114.58 121.40 2wgg h GLU 30 Ca 0.27 -0.15 -0.14 0.00 0.34 0.00 0.00 59.36 59.68 2wgg h GLU 30 Cb -0.06 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.38 2wgg h GLU 30 CO -0.08 0.83 -0.55 0.77 -1.16 0.00 0.00 179.01 178.83 2wgg h SER 31 N 1.06 0.29 -0.35 1.42 0.02 -1.85 -0.17 113.55 113.98 2wgg h SER 31 Ca 0.26 -0.16 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 2wgg h SER 31 Cb 0.09 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 2wgg h SER 31 CO -0.04 0.78 0.14 0.74 -1.14 0.00 0.00 176.83 177.32 2wgg h THR 32 N 0.21 1.18 -0.54 -2.27 2.02 -0.12 -0.54 112.91 112.85 2wgg h THR 32 Ca 0.00 -0.55 0.03 0.00 0.77 0.00 0.00 66.41 66.66 2wgg h THR 32 Cb 1.03 0.90 -0.04 0.00 -1.74 0.00 0.00 68.15 68.30 2wgg h THR 32 CO 0.09 0.20 0.30 -0.25 0.37 0.00 0.00 175.52 176.23 2wgg h TRP 33 N 0.42 0.57 -0.61 3.16 -0.00 -0.22 0.16 115.95 119.41 2wgg h TRP 33 Ca 0.12 0.02 -0.06 0.00 -0.00 0.00 0.00 58.89 58.97 2wgg h TRP 33 Cb 0.17 -0.18 -0.03 0.00 -0.00 0.00 0.00 29.16 29.13 2wgg h TRP 33 CO -0.01 0.30 0.16 0.87 -0.00 0.00 0.00 178.44 179.77 2wgg h LYS 34 N 0.60 0.97 -0.29 2.65 1.57 -0.97 -2.71 116.57 118.39 2wgg h LYS 34 Ca 0.23 -0.23 0.04 0.00 -1.87 0.00 0.00 60.65 58.82 2wgg h LYS 34 Cb 0.07 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 2wgg h LYS 34 CO -0.12 0.88 0.07 0.78 -0.57 0.00 0.00 179.45 180.49 2wgg h GLY 35 N 0.89 0.34 0.47 3.86 0.00 -0.56 -2.28 103.07 105.78 2wgg h GLY 35 Ca 0.19 -0.03 0.08 0.00 0.00 0.00 0.00 47.33 47.57 2wgg h GLY 35 CO -0.00 0.00 0.25 1.41 0.00 0.00 0.00 176.54 178.20 2wgg h LEU 36 N 0.19 0.28 -1.26 3.11 3.38 -0.58 -1.43 115.31 118.99 2wgg h LEU 36 Ca 0.13 0.07 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 2wgg h LEU 36 Cb 0.12 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2wgg h LEU 36 CO -0.16 0.17 -0.35 -0.07 0.09 0.00 0.00 178.44 178.13 2wgg h LEU 37 N 0.45 0.00 -0.05 1.67 3.38 -1.34 -2.08 115.31 117.33 2wgg h LEU 37 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 2wgg h LEU 37 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2wgg h LEU 37 CO -0.27 0.35 0.00 0.00 0.09 0.00 0.00 178.44 178.61 2wgg n ALA 38 N -2.40 2.57 -2.45 1.53 0.00 -0.87 -4.55 120.51 114.35 2wgg n ALA 38 Ca -0.01 -0.10 -0.18 0.00 0.00 0.00 0.00 53.44 53.15 2wgg n ALA 38 Cb 0.41 -1.20 -0.00 0.00 0.00 0.00 0.00 19.45 18.66 2wgg n ALA 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wgg n GLY 39 N 0.71 -0.37 3.80 0.00 0.00 -0.78 -5.02 105.19 103.54 2wgg n GLY 39 Ca 0.10 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 2wgg n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wgg s GLU 40 N -5.01 4.17 -0.06 1.61 2.02 -0.59 -5.03 118.70 115.81 2wgg s GLU 40 Ca 0.05 1.25 0.04 0.00 0.02 0.00 0.00 54.97 56.33 2wgg s GLU 40 Cb -0.02 -2.29 -0.02 0.00 0.10 0.00 0.00 34.13 31.90 2wgg s GLU 40 CO 0.06 -0.09 -0.20 0.45 0.02 0.00 0.00 175.26 175.50 2wgg s SER 41 N -1.98 3.55 0.00 -0.19 0.15 -1.26 -4.62 113.70 109.34 2wgg s SER 41 Ca 0.61 -0.37 0.30 0.00 0.70 0.00 0.00 55.95 57.19 2wgg s SER 41 Cb -0.13 -0.93 1.58 0.00 -1.71 0.00 0.00 66.02 64.82 2wgg s SER 41 CO 0.18 0.27 2.06 0.61 1.20 0.00 0.00 173.24 177.56 2wgg n GLY 42 N 2.79 -1.01 3.80 9.45 0.00 0.09 -4.92 105.19 115.40 2wgg n GLY 42 Ca -0.17 -0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.25 2wgg n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wgg s ILE 43 N -2.28 4.86 0.28 -0.61 -1.09 -1.26 -4.24 121.20 116.86 2wgg s ILE 43 Ca 0.37 1.14 0.02 0.00 -2.23 0.00 0.00 60.65 59.95 2wgg s ILE 43 Cb 0.21 -3.87 -0.03 0.00 -1.58 0.00 0.00 42.46 37.19 2wgg s ILE 43 CO 0.42 0.51 0.26 -1.38 -1.23 0.00 0.00 174.94 173.52 2wgg s HIS 44 N -0.76 1.38 0.27 3.97 -3.43 -0.17 -4.25 115.29 112.30 2wgg s HIS 44 Ca 0.28 -1.46 -0.29 0.00 -0.80 0.00 0.00 55.06 52.79 2wgg s HIS 44 Cb -0.18 -0.53 -0.10 0.00 -1.43 0.00 0.00 32.58 30.34 2wgg s HIS 44 CO 0.17 -0.83 1.30 0.00 -2.00 0.00 0.00 174.74 173.38 2wgg s ALA 45 N -3.68 3.51 0.08 -1.38 0.00 -1.26 -1.10 121.76 117.92 2wgg s ALA 45 Ca 0.38 1.18 -0.30 0.00 0.00 0.00 0.00 51.96 53.22 2wgg s ALA 45 Cb 0.04 -3.47 -0.06 0.00 0.00 0.00 0.00 23.12 19.62 2wgg s ALA 45 CO 0.20 -0.57 1.17 -0.51 0.00 0.00 0.00 175.76 176.06 2wgg s LEU 46 N -1.06 4.39 -0.00 0.00 1.02 0.08 -4.82 118.68 118.29 2wgg s LEU 46 Ca 0.52 2.02 0.10 0.00 0.02 0.00 0.00 54.13 56.79 2wgg s LEU 46 Cb -0.38 -3.58 -0.12 0.00 0.02 0.00 0.00 46.19 42.13 2wgg s LEU 46 CO 0.46 -0.42 0.41 1.21 0.02 0.00 0.00 176.35 178.02 2wgg n GLU 47 N 3.66 3.27 -1.63 1.70 4.07 -1.26 -4.94 120.64 125.51 2wgg n GLU 47 Ca 0.08 -0.01 -0.44 0.00 -0.06 0.00 0.00 57.16 56.73 2wgg n GLU 47 Cb 0.46 -1.01 -0.04 0.00 -0.06 0.00 0.00 31.44 30.80 2wgg n GLU 47 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2wgg n ASP 48 N -1.31 3.61 0.00 4.31 8.00 -1.26 -4.79 116.55 125.11 2wgg n ASP 48 Ca 0.01 0.64 0.00 0.00 0.71 0.00 0.00 54.79 56.16 2wgg n ASP 48 Cb 0.17 -1.49 0.00 0.00 -0.02 0.00 0.00 41.12 39.78 2wgg n ASP 48 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2wgg n GLU 49 N 7.86 0.00 0.00 -1.24 0.00 -1.26 0.19 120.64 126.18 2wgg n GLU 49 Ca 0.25 0.00 0.07 0.00 0.00 0.00 0.00 57.16 57.48 2wgg n GLU 49 Cb 0.39 0.00 0.33 0.00 0.00 0.00 0.00 31.44 32.17 2wgg n GLU 49 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.13 179.10 2wgg n PHE 50 N -3.38 0.00 -0.12 -1.84 -0.00 -1.26 -3.00 117.46 107.86 2wgg n PHE 50 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.45 57.35 2wgg n PHE 50 Cb 0.00 -0.44 -0.02 0.00 -0.00 0.00 0.00 39.48 39.03 2wgg n PHE 50 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 2wgg h VAL 51 N 0.00 1.22 -0.11 1.97 2.07 -0.61 0.06 116.25 120.85 2wgg h VAL 51 Ca 0.00 -0.75 -0.12 0.00 0.82 0.00 0.00 66.70 66.65 2wgg h VAL 51 Cb 0.22 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 2wgg h VAL 51 CO 0.00 0.26 -0.41 0.71 0.02 0.00 0.00 177.57 178.15 2wgg h THR 52 N 0.44 1.38 -0.92 2.57 1.35 -1.77 -2.65 112.91 113.31 2wgg h THR 52 Ca 0.11 -1.73 0.12 0.00 -0.55 0.00 0.00 66.41 64.36 2wgg h THR 52 Cb 0.30 2.17 -0.07 0.00 -1.73 0.00 0.00 68.15 68.81 2wgg h THR 52 CO 0.00 0.52 0.59 0.50 -0.25 0.00 0.00 175.52 176.88 2wgg h LYS 53 N 0.05 0.83 -0.23 4.72 3.64 -1.43 -2.92 116.57 121.22 2wgg h LYS 53 Ca -0.02 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2wgg h LYS 53 Cb 1.04 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 2wgg h LYS 53 CO 0.09 0.55 0.00 0.91 -2.27 0.00 0.00 179.45 178.72 2wgg n TRP 54 N -4.57 0.30 -1.56 1.91 5.03 -0.00 -5.03 117.44 113.52 2wgg n TRP 54 Ca 0.17 -0.29 -0.06 0.00 3.03 0.00 0.00 57.50 60.35 2wgg n TRP 54 Cb 0.37 -0.01 0.01 0.00 -1.03 0.00 0.00 31.31 30.65 2wgg n TRP 54 CO 0.00 0.00 0.00 -3.47 -0.03 0.00 0.00 177.69 174.19 2wgg n ASP 55 N 0.65 -1.96 -4.89 -0.99 -0.08 -1.01 -4.93 116.55 103.34 2wgg n ASP 55 Ca 0.10 0.05 -0.35 0.00 -1.51 0.00 0.00 54.79 53.08 2wgg n ASP 55 Cb 0.39 -0.51 -0.05 0.00 2.34 0.00 0.00 41.12 43.28 2wgg n ASP 55 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 2wgg s LEU 56 N -0.52 4.38 0.24 -2.67 1.43 -1.16 -4.97 118.68 115.41 2wgg s LEU 56 Ca 0.05 0.49 0.12 0.00 -1.03 0.00 0.00 54.13 53.76 2wgg s LEU 56 Cb -0.01 -2.41 0.12 0.00 0.03 0.00 0.00 46.19 43.93 2wgg s LEU 56 CO 0.12 0.32 1.46 0.00 0.23 0.00 0.00 176.35 178.49 2wgg h ALA 57 N 4.38 0.66 -2.61 4.21 0.00 -1.93 -3.42 119.26 120.55 2wgg h ALA 57 Ca -0.52 -0.61 -0.62 0.00 0.00 0.00 0.00 54.91 53.17 2wgg h ALA 57 Cb 1.21 -0.11 -0.13 0.00 0.00 0.00 0.00 17.79 18.76 2wgg h ALA 57 CO 0.63 0.84 -0.03 0.08 0.00 0.00 0.00 179.25 180.77 2wgg s VAL 58 N -3.08 5.08 -0.05 0.00 1.01 -1.26 -4.84 120.40 117.26 2wgg s VAL 58 Ca 0.02 0.86 0.07 0.00 0.00 0.00 0.00 61.98 62.93 2wgg s VAL 58 Cb 0.10 -3.82 0.11 0.00 0.00 0.00 0.00 36.38 32.77 2wgg s VAL 58 CO 0.76 0.10 0.99 0.29 0.00 0.00 0.00 175.10 177.24 2wgg n LYS 59 N 5.46 1.05 -4.23 2.72 5.02 -1.26 -5.03 118.16 121.89 2wgg n LYS 59 Ca -0.04 -1.64 -0.14 0.00 -2.02 0.00 0.00 58.31 54.46 2wgg n LYS 59 Cb 0.50 -0.98 -0.10 0.00 -0.02 0.00 0.00 35.03 34.42 2wgg n LYS 59 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2wgg s ILE 60 N -1.31 1.11 0.00 -0.18 -4.36 -1.26 -0.74 121.20 114.46 2wgg s ILE 60 Ca 0.13 -1.91 0.00 0.00 -0.26 0.00 0.00 60.65 58.61 2wgg s ILE 60 Cb 0.11 -1.68 0.00 0.00 1.25 0.00 0.00 42.46 42.14 2wgg s ILE 60 CO 0.01 -0.67 0.00 0.61 0.24 0.00 0.00 174.94 175.14 2wgg n GLY 61 N 0.09 1.67 3.23 6.27 0.00 -0.26 -4.69 105.19 111.50 2wgg n GLY 61 Ca -0.12 -1.00 -0.37 0.00 0.00 0.00 0.00 46.02 44.53 2wgg n GLY 61 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wgg s GLY 62 N 0.00 1.81 0.53 -0.02 0.00 -0.08 -1.00 107.32 108.56 2wgg s GLY 62 Ca 0.00 -1.76 -0.17 0.00 0.00 0.00 0.00 44.72 42.78 2wgg s GLY 62 CO 0.00 0.74 1.01 0.30 0.00 0.00 0.00 173.10 175.16 2wgg s HIS 63 N 1.34 3.22 0.27 1.90 3.76 -1.26 0.11 115.29 124.63 2wgg s HIS 63 Ca -0.03 1.51 -0.29 0.00 -0.15 0.00 0.00 55.06 56.10 2wgg s HIS 63 Cb -0.20 -2.91 -0.14 0.00 1.11 0.00 0.00 32.58 30.44 2wgg s HIS 63 CO 0.01 -0.65 1.03 1.28 -0.85 0.00 0.00 174.74 175.56 2wgg n LEU 64 N -1.55 1.72 -0.33 0.89 4.77 -1.26 -4.08 117.00 117.15 2wgg n LEU 64 Ca 0.08 1.17 -0.02 0.00 -0.03 0.00 0.00 56.01 57.21 2wgg n LEU 64 Cb 0.53 -1.27 0.10 0.00 -2.33 0.00 0.00 43.42 40.45 2wgg n LEU 64 CO 0.45 -1.40 1.24 0.50 -1.33 0.00 0.00 177.39 176.85 2wgg h LYS 65 N 2.22 1.14 -4.87 3.23 1.63 -1.16 -3.38 116.57 115.38 2wgg h LYS 65 Ca -0.40 -0.07 -0.67 0.00 -0.85 0.00 0.00 60.65 58.66 2wgg h LYS 65 Cb 1.34 -0.26 -0.37 0.00 -0.60 0.00 0.00 32.23 32.35 2wgg h LYS 65 CO 0.62 0.75 -0.79 0.34 -3.45 0.00 0.00 179.45 176.92 2wgg s ASP 66 N -5.97 4.46 0.40 4.20 2.15 -1.26 -5.00 116.67 115.65 2wgg s ASP 66 Ca -0.13 -1.37 -0.27 0.00 0.43 0.00 0.00 52.55 51.22 2wgg s ASP 66 Cb 0.17 -1.56 -0.09 0.00 -0.30 0.00 0.00 42.92 41.13 2wgg s ASP 66 CO 0.80 -0.19 1.36 -2.84 -0.17 0.00 0.00 175.17 174.13 2wgg s PRO 67 N 1.12 3.99 0.23 4.34 0.02 -1.26 -4.91 135.00 138.53 2wgg s PRO 67 Ca -0.08 2.29 -0.06 0.00 0.02 0.00 0.00 61.00 63.17 2wgg s PRO 67 Cb -0.20 -2.82 0.31 0.00 0.02 0.00 0.00 34.50 31.82 2wgg s PRO 67 CO -0.05 -0.53 1.84 0.28 -0.33 0.00 0.00 177.00 178.22 2wgg h VAL 68 N 2.60 1.03 0.00 3.83 2.07 -1.99 -2.81 116.25 120.98 2wgg h VAL 68 Ca -0.50 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 66.70 2wgg h VAL 68 Cb 1.25 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2wgg h VAL 68 CO 0.63 0.17 0.00 0.47 0.02 0.00 0.00 177.57 178.86 2wgg n ASP 69 N -4.65 0.00 0.12 0.57 8.00 -1.26 -1.45 116.55 117.88 2wgg n ASP 69 Ca 0.12 -0.30 0.12 0.00 0.71 0.00 0.00 54.79 55.44 2wgg n ASP 69 Cb 0.17 -0.20 0.46 0.00 -0.02 0.00 0.00 41.12 41.53 2wgg n ASP 69 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2wgg n SER 70 N -1.20 0.72 -1.12 -2.24 3.41 -1.06 -2.53 113.62 109.59 2wgg n SER 70 Ca 0.15 0.63 0.08 0.00 -0.26 0.00 0.00 58.87 59.46 2wgg n SER 70 Cb 0.17 -0.80 0.27 0.00 -0.26 0.00 0.00 64.21 63.60 2wgg n SER 70 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2wgg n HIS 71 N -2.24 1.06 -4.95 7.33 8.25 -0.53 -4.97 115.22 119.18 2wgg n HIS 71 Ca 0.04 -0.66 -0.32 0.00 -0.26 0.00 0.00 57.72 56.52 2wgg n HIS 71 Cb 0.31 -0.21 -0.17 0.00 1.12 0.00 0.00 29.99 31.04 2wgg n HIS 71 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2wgg s MET 72 N -1.93 2.91 0.94 -0.41 1.00 -1.05 -5.07 119.30 115.68 2wgg s MET 72 Ca 0.41 -0.82 -0.15 0.00 0.00 0.00 0.00 55.69 55.12 2wgg s MET 72 Cb 0.28 -2.27 0.17 0.00 0.00 0.00 0.00 34.83 33.01 2wgg s MET 72 CO 0.17 0.09 1.25 0.20 0.00 0.00 0.00 175.02 176.73 2wgg s GLY 73 N 0.56 1.70 0.25 -0.03 0.00 -1.26 -4.86 107.32 103.67 2wgg s GLY 73 Ca -0.14 -0.98 -0.04 0.00 0.00 0.00 0.00 44.72 43.57 2wgg s GLY 73 CO 0.04 -0.29 1.81 3.21 0.00 0.00 0.00 173.10 177.88 2wgg h ARG 74 N -1.57 0.79 0.38 2.90 -0.00 -1.99 -2.48 114.38 112.41 2wgg h ARG 74 Ca -0.45 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.98 58.96 2wgg h ARG 74 Cb 1.27 -0.18 0.00 0.00 0.00 0.00 0.00 29.97 31.07 2wgg h ARG 74 CO 0.47 0.52 -0.18 1.25 0.00 0.00 0.00 179.97 182.03 2wgg h LEU 75 N 0.81 -0.43 -1.72 3.04 5.85 -2.00 -2.61 115.31 118.25 2wgg h LEU 75 Ca 0.40 -0.08 0.14 0.00 0.84 0.00 0.00 57.88 59.18 2wgg h LEU 75 Cb 0.36 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.47 2wgg h LEU 75 CO -0.24 -0.17 0.44 0.44 -0.34 0.00 0.00 178.44 178.56 2wgg h ASP 76 N -0.70 0.26 0.61 1.25 3.32 -1.91 0.80 116.42 120.06 2wgg h ASP 76 Ca -0.05 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.94 2wgg h ASP 76 Cb 0.49 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 2wgg h ASP 76 CO 0.09 0.14 -0.32 0.24 -1.72 0.00 0.00 179.24 177.67 2wgg h MET 77 N 0.28 0.00 0.05 3.56 2.86 -1.11 -2.34 114.93 118.23 2wgg h MET 77 Ca 0.31 0.00 -0.29 0.00 -2.06 0.00 0.00 59.70 57.66 2wgg h MET 77 Cb 0.82 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.44 2wgg h MET 77 CO -0.07 0.32 -1.58 0.00 1.06 0.00 0.00 176.91 176.64 2wgg h ARG 78 N 0.00 0.10 -0.00 1.72 3.08 -0.55 -3.40 114.38 115.33 2wgg h ARG 78 Ca -0.00 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.87 2wgg h ARG 78 Cb 0.71 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.83 2wgg h ARG 78 CO 0.04 0.84 -0.51 2.89 -1.07 0.00 0.00 179.97 182.16 2wgg n ARG 79 N -3.26 2.66 -4.40 0.04 1.85 -0.39 -4.96 116.66 108.20 2wgg n ARG 79 Ca -0.16 -0.17 -0.21 0.00 -1.00 0.00 0.00 57.85 56.31 2wgg n ARG 79 Cb 1.03 -1.11 -0.13 0.00 -1.05 0.00 0.00 32.46 31.20 2wgg n ARG 79 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 2wgg s MET 80 N -2.04 1.03 0.90 2.89 -1.94 -0.89 -4.82 119.30 114.42 2wgg s MET 80 Ca 0.06 -0.82 -0.12 0.00 -1.71 0.00 0.00 55.69 53.10 2wgg s MET 80 Cb 0.10 -1.07 0.13 0.00 2.01 0.00 0.00 34.83 36.00 2wgg s MET 80 CO 0.47 0.26 1.11 -1.54 -0.01 0.00 0.00 175.02 175.31 2wgg s SER 81 N -1.21 3.58 0.18 3.03 1.04 -1.26 -4.80 113.70 114.27 2wgg s SER 81 Ca 0.03 1.15 -0.13 0.00 0.48 0.00 0.00 55.95 57.48 2wgg s SER 81 Cb -0.08 -1.80 0.17 0.00 0.10 0.00 0.00 66.02 64.41 2wgg s SER 81 CO 0.02 -2.53 1.72 0.22 0.98 0.00 0.00 173.24 173.65 2wgg h TYR 82 N -1.48 0.17 0.00 5.02 3.20 -1.93 -0.32 116.97 121.64 2wgg h TYR 82 Ca -0.50 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.33 2wgg h TYR 82 Cb 1.31 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.57 2wgg h TYR 82 CO 0.35 0.01 -0.32 -0.39 -1.64 0.00 0.00 178.16 176.18 2wgg h VAL 83 N 0.24 0.81 -0.20 1.81 -1.51 -1.89 0.13 116.25 115.63 2wgg h VAL 83 Ca 0.24 -1.31 -0.14 0.00 -1.23 0.00 0.00 66.70 64.26 2wgg h VAL 83 Cb 0.30 1.81 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 2wgg h VAL 83 CO -0.30 0.31 -0.43 1.56 -1.23 0.00 0.00 177.57 177.47 2wgg h GLN 84 N 0.00 0.65 -0.24 5.19 4.20 -1.80 -1.60 115.11 121.51 2wgg h GLN 84 Ca -0.00 -0.43 0.01 0.00 0.06 0.00 0.00 58.65 58.28 2wgg h GLN 84 Cb 0.78 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.61 2wgg h GLN 84 CO 0.04 1.05 0.14 0.00 -0.67 0.00 0.00 178.83 179.39 2wgg h ARG 85 N 0.35 0.29 -0.46 1.46 3.08 -0.09 -0.42 114.38 118.58 2wgg h ARG 85 Ca 0.00 -0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.10 2wgg h ARG 85 Cb 1.04 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.97 2wgg h ARG 85 CO 0.10 0.19 0.15 1.98 -1.07 0.00 0.00 179.97 181.31 2wgg h MET 86 N 0.29 0.30 -0.65 0.04 4.05 -0.85 -2.06 114.93 116.05 2wgg h MET 86 Ca 0.09 -0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.49 2wgg h MET 86 Cb -0.01 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 30.69 2wgg h MET 86 CO -0.04 0.20 0.40 0.78 0.23 0.00 0.00 176.91 178.47 2wgg h GLY 87 N 0.31 0.95 1.00 1.39 0.00 -1.04 -1.16 103.07 104.52 2wgg h GLY 87 Ca 0.22 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.16 2wgg h GLY 87 CO -0.24 0.38 0.33 1.70 0.00 0.00 0.00 176.54 178.71 2wgg h LYS 88 N 0.89 0.66 0.46 4.80 3.64 -1.01 0.26 116.57 126.27 2wgg h LYS 88 Ca 0.24 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.55 2wgg h LYS 88 Cb -0.03 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 2wgg h LYS 88 CO -0.04 0.44 -0.23 1.25 -2.27 0.00 0.00 179.45 178.59 2wgg h LEU 89 N 0.68 -0.56 -0.58 5.20 5.85 -1.18 -2.19 115.31 122.53 2wgg h LEU 89 Ca 0.18 0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.77 2wgg h LEU 89 Cb -0.08 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2wgg h LEU 89 CO -0.04 -0.39 -0.50 -0.07 -0.34 0.00 0.00 178.44 177.10 2wgg h LEU 90 N -0.64 0.60 -0.81 2.25 3.38 -1.17 -1.96 115.31 116.95 2wgg h LEU 90 Ca -0.06 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.65 2wgg h LEU 90 Cb 0.50 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 2wgg h LEU 90 CO 0.10 1.00 0.52 1.23 0.09 0.00 0.00 178.44 181.37 2wgg h GLY 91 N 1.08 1.18 1.17 0.83 0.00 -0.51 0.15 103.07 106.97 2wgg h GLY 91 Ca 0.02 -0.39 -0.17 0.00 0.00 0.00 0.00 47.33 46.79 2wgg h GLY 91 CO 0.09 0.32 -0.44 -1.33 0.00 0.00 0.00 176.54 175.18 2wgg h GLY 92 N 0.99 0.98 1.05 4.60 0.00 -1.26 -2.35 103.07 107.08 2wgg h GLY 92 Ca 0.33 -1.05 -0.07 0.00 0.00 0.00 0.00 47.33 46.54 2wgg h GLY 92 CO -0.12 0.94 0.11 1.46 0.00 0.00 0.00 176.54 178.93 2wgg h GLN 93 N 0.72 1.04 -0.40 4.80 4.20 -1.15 -2.12 115.11 122.19 2wgg h GLN 93 Ca 0.04 -0.27 -0.05 0.00 0.06 0.00 0.00 58.65 58.43 2wgg h GLN 93 Cb 1.04 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.68 2wgg h GLN 93 CO 0.10 0.96 0.05 1.25 -0.67 0.00 0.00 178.83 180.53 2wgg h LEU 94 N 0.95 0.65 -0.19 1.46 5.85 -0.96 -1.03 115.31 122.04 2wgg h LEU 94 Ca 0.19 -0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 2wgg h LEU 94 Cb 0.42 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2wgg h LEU 94 CO 0.01 0.76 0.10 -0.25 -0.34 0.00 0.00 178.44 178.72 2wgg h TRP 95 N 0.52 0.27 -0.26 1.25 2.91 -1.33 -1.42 115.95 117.89 2wgg h TRP 95 Ca 0.12 -0.01 0.06 0.00 1.13 0.00 0.00 58.89 60.19 2wgg h TRP 95 Cb 0.39 -0.09 -0.08 0.00 -0.51 0.00 0.00 29.16 28.88 2wgg h TRP 95 CO 0.03 0.26 -0.41 0.93 -1.03 0.00 0.00 178.44 178.21 2wgg h GLU 96 N 0.21 -0.39 -0.33 2.65 5.08 -1.26 0.81 114.58 121.35 2wgg h GLU 96 Ca 0.07 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.55 2wgg h GLU 96 Cb 0.08 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2wgg h GLU 96 CO -0.01 -0.26 0.30 0.77 -1.00 0.00 0.00 179.01 178.80 2wgg h SER 97 N -0.41 0.00 0.10 1.42 0.02 -0.83 -0.76 113.55 113.09 2wgg h SER 97 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2wgg h SER 97 Cb 0.60 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.14 2wgg h SER 97 CO -0.47 0.00 -0.05 0.00 -1.14 0.00 0.00 176.83 175.16 2wgg n ALA 98 N -2.45 2.69 -0.12 3.77 0.00 -0.57 -4.88 120.51 118.97 2wgg n ALA 98 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.15 2wgg n ALA 98 Cb 0.46 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2wgg n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wgg n GLY 99 N 1.17 0.94 4.03 0.00 0.00 -0.29 -4.28 105.19 106.76 2wgg n GLY 99 Ca 0.18 -0.04 -0.45 0.00 0.00 0.00 0.00 46.02 45.72 2wgg n GLY 99 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wgg n SER 100 N 0.08 -4.22 -4.75 1.61 7.64 0.20 -4.89 113.62 109.29 2wgg n SER 100 Ca 0.00 -1.26 -0.31 0.00 1.01 0.00 0.00 58.87 58.31 2wgg n SER 100 Cb 0.00 -1.91 0.11 0.00 -1.01 0.00 0.00 64.21 61.40 2wgg n SER 100 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2wgg s PRO 101 N -7.24 1.94 -0.27 1.43 0.04 -1.26 -5.01 135.00 124.63 2wgg s PRO 101 Ca 0.49 1.21 -0.05 0.00 0.04 0.00 0.00 61.00 62.68 2wgg s PRO 101 Cb -0.25 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.43 2wgg s PRO 101 CO 0.96 -1.88 0.03 -1.21 0.04 0.00 0.00 177.00 174.95 2wgg s GLU 102 N -4.86 3.18 0.36 4.56 0.41 -1.26 -5.08 118.70 116.00 2wgg s GLU 102 Ca 0.62 -0.78 0.09 0.00 -0.41 0.00 0.00 54.97 54.49 2wgg s GLU 102 Cb -0.18 -3.24 -0.07 0.00 -1.78 0.00 0.00 34.13 28.87 2wgg s GLU 102 CO 0.56 -0.36 -0.06 0.14 -0.49 0.00 0.00 175.26 175.05 2wgg s VAL 103 N 1.48 2.23 -0.35 2.63 -7.23 -1.26 -5.08 120.40 112.82 2wgg s VAL 103 Ca 0.03 -2.14 -0.29 0.00 -1.81 0.00 0.00 61.98 57.77 2wgg s VAL 103 Cb -0.16 -2.73 -0.01 0.00 0.56 0.00 0.00 36.38 34.04 2wgg s VAL 103 CO 0.00 -0.16 1.64 -0.62 -0.31 0.00 0.00 175.10 175.65 2wgg s ASP 104 N -3.64 6.09 0.48 4.85 -1.08 -1.26 -4.89 116.67 117.21 2wgg s ASP 104 Ca 0.33 1.14 0.19 0.00 -0.52 0.00 0.00 52.55 53.69 2wgg s ASP 104 Cb 0.04 -2.53 1.19 0.00 -1.46 0.00 0.00 42.92 40.16 2wgg s ASP 104 CO 0.17 -1.58 1.99 1.55 0.52 0.00 0.00 175.17 177.82 2wgg h PRO 105 N 11.94 0.21 -0.00 4.34 0.13 -1.93 -0.54 132.00 146.15 2wgg h PRO 105 Ca -0.31 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2wgg h PRO 105 Cb 1.14 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2wgg h PRO 105 CO 1.05 0.14 -0.00 -0.25 -0.23 0.00 0.00 178.00 178.71 2wgg n ASP 106 N -4.44 0.06 -0.07 1.44 8.00 -1.26 -0.39 116.55 119.88 2wgg n ASP 106 Ca 0.09 -0.94 0.06 0.00 0.71 0.00 0.00 54.79 54.71 2wgg n ASP 106 Cb 0.46 -0.02 0.08 0.00 -0.02 0.00 0.00 41.12 41.61 2wgg n ASP 106 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2wgg n ARG 107 N -0.98 1.73 -4.07 -1.24 5.12 -0.23 -4.41 116.66 112.58 2wgg n ARG 107 Ca 0.23 -2.04 -0.32 0.00 -1.93 0.00 0.00 57.85 53.80 2wgg n ARG 107 Cb 0.13 -1.23 -0.16 0.00 -1.16 0.00 0.00 32.46 30.04 2wgg n ARG 107 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 2wgg s PHE 108 N -1.95 2.70 0.25 -1.55 5.36 -1.00 -0.63 117.98 121.17 2wgg s PHE 108 Ca 0.18 -1.69 0.11 0.00 -0.96 0.00 0.00 56.93 54.56 2wgg s PHE 108 Cb 0.16 -1.82 -0.05 0.00 -0.34 0.00 0.00 43.02 40.97 2wgg s PHE 108 CO 0.02 -0.79 -0.11 0.00 -1.46 0.00 0.00 175.22 172.88 2wgg s ALA 109 N 1.31 2.93 -0.05 11.12 0.00 -0.56 -1.70 121.76 134.81 2wgg s ALA 109 Ca 0.01 -1.71 0.04 0.00 0.00 0.00 0.00 51.96 50.30 2wgg s ALA 109 Cb -0.15 -0.54 -0.00 0.00 0.00 0.00 0.00 23.12 22.43 2wgg s ALA 109 CO -0.10 0.31 -0.16 0.08 0.00 0.00 0.00 175.76 175.88 2wgg s VAL 110 N -2.26 1.40 -0.18 0.00 1.01 0.13 -2.25 120.40 118.25 2wgg s VAL 110 Ca 0.29 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.55 2wgg s VAL 110 Cb -0.06 -1.21 0.06 0.00 0.00 0.00 0.00 36.38 35.17 2wgg s VAL 110 CO 0.17 0.41 0.06 -0.69 0.00 0.00 0.00 175.10 175.04 2wgg s VAL 111 N 0.14 0.24 -0.08 2.92 1.01 -0.68 -0.49 120.40 123.47 2wgg s VAL 111 Ca -0.06 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 2wgg s VAL 111 Cb -0.12 -0.83 0.03 0.00 0.00 0.00 0.00 36.38 35.46 2wgg s VAL 111 CO 0.03 -0.25 -0.04 -0.69 0.00 0.00 0.00 175.10 174.15 2wgg s VAL 112 N 1.99 0.69 0.55 2.92 1.01 -0.60 -2.05 120.40 124.91 2wgg s VAL 112 Ca 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.85 2wgg s VAL 112 Cb -0.17 -0.77 0.01 0.00 0.00 0.00 0.00 36.38 35.46 2wgg s VAL 112 CO -0.09 0.30 0.82 -0.83 0.00 0.00 0.00 175.10 175.31 2wgg s GLY 113 N 1.68 1.61 0.18 4.51 0.00 -0.51 -4.30 107.32 110.48 2wgg s GLY 113 Ca 0.02 -0.87 -0.17 0.00 0.00 0.00 0.00 44.72 43.70 2wgg s GLY 113 CO -0.05 -0.62 0.50 -1.59 0.00 0.00 0.00 173.10 171.34 2wgg s THR 114 N -2.84 0.03 0.01 0.90 2.01 -1.26 -2.29 115.64 112.20 2wgg s THR 114 Ca 0.53 -0.70 -0.19 0.00 0.31 0.00 0.00 61.69 61.64 2wgg s THR 114 Cb -0.10 -1.46 -0.28 0.00 0.01 0.00 0.00 72.50 70.67 2wgg s THR 114 CO 0.42 -0.15 1.04 1.23 -0.69 0.00 0.00 174.62 176.47 2wgg h GLY 115 N 2.22 0.52 0.00 4.40 0.00 -1.84 -3.43 103.07 104.94 2wgg h GLY 115 Ca -0.30 -1.08 0.00 0.00 0.00 0.00 0.00 47.33 45.95 2wgg h GLY 115 CO 0.40 0.95 -0.24 -0.10 0.00 0.00 0.00 176.54 177.55 2wgg n LEU 116 N -4.03 0.05 0.00 3.11 0.00 -1.26 -4.74 117.00 110.12 2wgg n LEU 116 Ca -0.13 0.09 0.00 0.00 0.00 0.00 0.00 56.01 55.97 2wgg n LEU 116 Cb 0.83 0.04 0.00 0.00 0.00 0.00 0.00 43.42 44.30 2wgg n LEU 116 CO 0.52 -0.45 0.00 0.61 0.00 0.00 0.00 177.39 178.07 2wgg n GLY 117 N 1.99 0.21 2.62 -3.96 0.00 -1.26 -4.56 105.19 100.23 2wgg n GLY 117 Ca 0.00 -1.88 -0.36 0.00 0.00 0.00 0.00 46.02 43.79 2wgg n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wgg n GLY 118 N 0.00 5.15 0.25 -0.02 0.00 -1.16 -4.74 105.19 104.68 2wgg n GLY 118 Ca 0.00 -2.19 0.09 0.00 0.00 0.00 0.00 46.02 43.92 2wgg n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wgg h ALA 119 N 3.59 1.63 -0.87 4.61 0.00 -1.86 -1.76 119.26 124.60 2wgg h ALA 119 Ca 0.53 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 55.43 2wgg h ALA 119 Cb 0.38 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 2wgg h ALA 119 CO 1.21 0.14 0.57 0.93 0.00 0.00 0.00 179.25 182.09 2wgg h GLU 120 N 0.00 0.89 -0.01 0.00 3.07 -1.98 -2.20 114.58 114.35 2wgg h GLU 120 Ca -0.00 -0.05 -0.11 0.00 -0.50 0.00 0.00 59.36 58.70 2wgg h GLU 120 Cb 0.22 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 27.91 2wgg h GLU 120 CO 0.01 0.59 -0.50 0.00 -1.40 0.00 0.00 179.01 177.71 2wgg h ARG 121 N 0.92 0.03 0.56 2.33 2.47 -1.70 0.58 114.38 119.57 2wgg h ARG 121 Ca 0.39 -0.01 -0.02 0.00 -1.26 0.00 0.00 59.98 59.08 2wgg h ARG 121 Cb 0.31 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.63 2wgg h ARG 121 CO -0.15 0.52 -0.37 0.82 0.56 0.00 0.00 179.97 181.35 2wgg h ILE 122 N 0.02 0.24 -0.62 2.04 2.04 -1.41 0.20 117.51 120.03 2wgg h ILE 122 Ca -0.00 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.78 2wgg h ILE 122 Cb 0.90 0.24 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 2wgg h ILE 122 CO 0.07 0.00 0.08 -0.37 0.00 0.00 0.00 178.15 177.93 2wgg h VAL 123 N -0.89 1.26 0.17 1.67 -1.51 -1.35 -0.89 116.25 114.70 2wgg h VAL 123 Ca -0.07 -1.02 0.01 0.00 -1.23 0.00 0.00 66.70 64.39 2wgg h VAL 123 Cb 0.74 0.69 -0.03 0.00 -2.13 0.00 0.00 31.29 30.56 2wgg h VAL 123 CO 0.05 0.38 -0.25 -0.08 -1.23 0.00 0.00 177.57 176.44 2wgg h GLU 124 N 0.95 -0.47 -0.96 5.19 4.81 -0.87 -0.51 114.58 122.72 2wgg h GLU 124 Ca 0.19 0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.49 2wgg h GLU 124 Cb 0.44 0.11 -0.06 0.00 0.63 0.00 0.00 28.75 29.87 2wgg h GLU 124 CO 0.01 -0.31 0.62 0.77 -0.73 0.00 0.00 179.01 179.38 2wgg h SER 125 N -0.49 1.04 -0.26 1.04 0.02 -0.40 -0.01 113.55 114.50 2wgg h SER 125 Ca 0.02 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2wgg h SER 125 Cb 0.49 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 2wgg h SER 125 CO -0.11 0.71 0.15 0.22 -1.14 0.00 0.00 176.83 176.67 2wgg h TYR 126 N 1.21 0.34 -0.26 3.45 5.03 -0.99 -0.06 116.97 125.70 2wgg h TYR 126 Ca 0.38 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.69 2wgg h TYR 126 Cb 0.00 -0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.15 2wgg h TYR 126 CO -0.01 0.27 0.17 -0.44 -1.32 0.00 0.00 178.16 176.83 2wgg h ASP 127 N 0.32 0.29 -0.61 -2.11 3.45 -0.68 -1.88 116.42 115.20 2wgg h ASP 127 Ca 0.09 -0.01 -0.04 0.00 0.43 0.00 0.00 57.03 57.50 2wgg h ASP 127 Cb 0.03 -0.07 -0.03 0.00 -0.56 0.00 0.00 39.33 38.70 2wgg h ASP 127 CO -0.02 0.21 0.23 -0.07 -1.57 0.00 0.00 179.24 178.03 2wgg h LEU 128 N 0.34 0.88 0.14 1.55 3.38 -0.68 -1.93 115.31 118.99 2wgg h LEU 128 Ca 0.10 -0.13 -0.31 0.00 0.09 0.00 0.00 57.88 57.63 2wgg h LEU 128 Cb -0.04 -0.23 0.03 0.00 0.09 0.00 0.00 40.66 40.52 2wgg h LEU 128 CO -0.02 0.80 -1.29 -0.03 0.09 0.00 0.00 178.44 177.99 2wgg h MET 129 N 0.93 0.62 -0.88 1.13 4.05 -0.95 -2.39 114.93 117.44 2wgg h MET 129 Ca 0.22 -0.85 0.08 0.00 -0.28 0.00 0.00 59.70 58.86 2wgg h MET 129 Cb 0.22 0.29 -0.06 0.00 -0.80 0.00 0.00 31.60 31.24 2wgg h MET 129 CO -0.02 1.39 0.57 -0.91 0.23 0.00 0.00 176.91 178.18 2wgg h ASN 130 N 0.26 0.83 0.70 1.39 2.35 -1.25 0.85 115.58 120.70 2wgg h ASN 130 Ca -0.20 0.01 -0.26 0.00 -0.55 0.00 0.00 56.30 55.30 2wgg h ASN 130 Cb 1.96 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 40.15 2wgg h ASN 130 CO 0.25 0.51 -1.27 0.00 -1.65 0.00 0.00 177.43 175.26 2wgg h ALA 131 N 1.54 0.27 0.00 -0.83 0.00 -1.38 -3.42 119.26 115.44 2wgg h ALA 131 Ca 0.39 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2wgg h ALA 131 Cb 0.31 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2wgg h ALA 131 CO -0.16 1.15 -0.13 0.41 0.00 0.00 0.00 179.25 180.53 2wgg n GLY 132 N 1.51 -1.04 0.00 0.00 0.00 -0.90 -5.11 105.19 99.65 2wgg n GLY 132 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2wgg n GLY 132 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wgg n GLY 133 N 0.00 0.40 0.16 -0.02 0.00 0.29 -4.46 105.19 101.55 2wgg n GLY 133 Ca 0.00 -1.90 0.12 0.00 0.00 0.00 0.00 46.02 44.24 2wgg n GLY 133 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wgg h PRO 134 N 0.00 0.00 0.00 1.61 0.13 -1.91 -2.55 132.00 129.28 2wgg h PRO 134 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2wgg h PRO 134 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2wgg h PRO 134 CO 0.00 0.00 -0.48 -0.09 -0.23 0.00 0.00 178.00 177.20 2wgg h ARG 135 N 0.00 0.00 -0.12 0.86 9.65 -1.95 -3.15 114.38 119.67 2wgg h ARG 135 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2wgg h ARG 135 Cb 0.17 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.75 2wgg h ARG 135 CO 0.00 0.00 0.00 1.63 2.80 0.00 0.00 179.97 184.40 2wgg n LYS 136 N -2.28 1.69 -2.98 0.20 4.76 -0.96 -4.86 118.16 113.73 2wgg n LYS 136 Ca 0.03 -1.03 -0.40 0.00 -2.87 0.00 0.00 58.31 54.04 2wgg n LYS 136 Cb 0.46 -1.42 -0.05 0.00 -1.84 0.00 0.00 35.03 32.18 2wgg n LYS 136 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2wgg s VAL 137 N -1.85 4.80 0.33 -0.18 1.01 -1.19 -4.74 120.40 118.58 2wgg s VAL 137 Ca 0.34 1.62 -0.29 0.00 0.00 0.00 0.00 61.98 63.65 2wgg s VAL 137 Cb 0.18 -4.11 -0.11 0.00 0.00 0.00 0.00 36.38 32.35 2wgg s VAL 137 CO 0.28 0.33 1.43 -0.55 0.00 0.00 0.00 175.10 176.60 2wgg s SER 138 N 0.17 6.54 0.29 3.32 0.15 -1.26 -4.88 113.70 118.03 2wgg s SER 138 Ca 0.39 2.86 0.19 0.00 0.70 0.00 0.00 55.95 60.09 2wgg s SER 138 Cb -0.20 -2.65 1.02 0.00 -1.71 0.00 0.00 66.02 62.48 2wgg s SER 138 CO 0.22 -0.74 1.57 -2.65 1.20 0.00 0.00 173.24 172.84 2wgg n PRO 139 N 1.07 0.12 -0.04 5.44 -0.02 -1.26 -1.59 135.00 138.72 2wgg n PRO 139 Ca 0.02 0.62 0.09 0.00 -2.02 0.00 0.00 63.50 62.21 2wgg n PRO 139 Cb 0.40 -1.93 0.10 0.00 -0.02 0.00 0.00 33.50 32.05 2wgg n PRO 139 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wgg n LEU 140 N -2.16 2.64 -0.16 2.45 4.77 -1.26 -4.66 117.00 118.62 2wgg n LEU 140 Ca -0.01 -1.15 -0.02 0.00 -0.03 0.00 0.00 56.01 54.80 2wgg n LEU 140 Cb 0.05 -0.06 0.05 0.00 -2.33 0.00 0.00 43.42 41.14 2wgg n LEU 140 CO 0.08 0.50 0.80 0.00 -1.33 0.00 0.00 177.39 177.45 2wgg h ALA 141 N 3.48 0.41 -0.40 -1.18 0.00 -1.66 -2.24 119.26 117.66 2wgg h ALA 141 Ca 0.00 0.18 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 2wgg h ALA 141 Cb 0.77 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2wgg h ALA 141 CO 0.00 -0.42 0.01 -0.39 0.00 0.00 0.00 179.25 178.45 2wgg h VAL 142 N 0.05 1.26 0.00 0.00 -1.51 -1.83 -0.86 116.25 113.37 2wgg h VAL 142 Ca 0.25 -1.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.72 2wgg h VAL 142 Cb 0.39 1.11 0.00 0.00 -2.13 0.00 0.00 31.29 30.66 2wgg h VAL 142 CO -0.48 0.34 0.00 0.06 -1.23 0.00 0.00 177.57 176.26 2wgg h GLN 143 N 0.54 0.00 0.14 5.19 3.07 -1.85 -1.35 115.11 120.85 2wgg h GLN 143 Ca 0.12 0.00 -0.32 0.00 0.09 0.00 0.00 58.65 58.54 2wgg h GLN 143 Cb 0.47 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.03 2wgg h GLN 143 CO 0.02 0.00 -1.61 0.52 0.09 0.00 0.00 178.83 177.85 2wgg h MET 144 N 0.00 0.29 -0.05 0.06 2.86 -1.10 -3.39 114.93 113.60 2wgg h MET 144 Ca 0.00 -0.49 -0.21 0.00 -2.06 0.00 0.00 59.70 56.93 2wgg h MET 144 Cb 0.42 0.18 0.02 0.00 0.06 0.00 0.00 31.60 32.28 2wgg h MET 144 CO 0.00 1.16 -0.81 0.82 1.06 0.00 0.00 176.91 179.14 2wgg h ILE 145 N 0.08 1.32 -2.07 -1.22 2.04 -0.87 -3.34 117.51 113.45 2wgg h ILE 145 Ca -0.28 -2.09 -0.62 0.00 1.00 0.00 0.00 64.86 62.88 2wgg h ILE 145 Cb 2.04 2.32 0.04 0.00 -0.74 0.00 0.00 36.82 40.49 2wgg h ILE 145 CO 0.16 0.64 0.83 1.15 0.00 0.00 0.00 178.15 180.93 2wgg n MET 146 N -4.01 1.94 0.28 2.37 0.00 -0.53 -2.96 117.12 114.20 2wgg n MET 146 Ca -0.10 0.70 0.18 0.00 0.00 0.00 0.00 57.70 58.49 2wgg n MET 146 Cb 0.77 -2.47 0.96 0.00 0.00 0.00 0.00 33.22 32.48 2wgg n MET 146 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 175.97 174.62 2wgg h PRO 147 N 6.64 0.00 0.00 3.17 0.11 -1.90 0.42 132.00 140.44 2wgg h PRO 147 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2wgg h PRO 147 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2wgg h PRO 147 CO 0.89 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.95 2wgg n ASN 148 N -3.47 0.00 -0.01 -2.05 6.94 -1.26 -4.28 115.26 111.12 2wgg n ASN 148 Ca -0.01 -1.14 -0.10 0.00 -0.02 0.00 0.00 54.58 53.32 2wgg n ASN 148 Cb 0.21 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.59 2wgg n ASN 148 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 2wgg h GLY 149 N 5.13 0.09 0.95 4.83 0.00 -0.44 -1.04 103.07 112.59 2wgg h GLY 149 Ca 0.00 0.05 -0.06 0.00 0.00 0.00 0.00 47.33 47.32 2wgg h GLY 149 CO 0.00 -0.05 0.04 0.00 0.00 0.00 0.00 176.54 176.52 2wgg h ALA 150 N 1.13 0.55 -0.81 3.60 0.00 -1.80 0.56 119.26 122.48 2wgg h ALA 150 Ca 0.06 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2wgg h ALA 150 Cb 0.10 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2wgg h ALA 150 CO -0.14 0.29 0.49 0.00 0.00 0.00 0.00 179.25 179.89 2wgg h ALA 151 N 0.91 1.33 -0.23 0.00 0.00 -1.81 -2.12 119.26 117.34 2wgg h ALA 151 Ca 0.12 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2wgg h ALA 151 Cb 0.42 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2wgg h ALA 151 CO 0.01 0.58 -0.21 0.00 0.00 0.00 0.00 179.25 179.64 2wgg h ALA 152 N 1.42 0.33 -0.48 0.00 0.00 -0.68 -0.19 119.26 119.66 2wgg h ALA 152 Ca 0.29 -0.36 0.09 0.00 0.00 0.00 0.00 54.91 54.94 2wgg h ALA 152 Cb -0.04 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.59 2wgg h ALA 152 CO -0.05 0.27 -0.03 0.28 0.00 0.00 0.00 179.25 179.72 2wgg h VAL 153 N 0.23 0.59 -0.19 0.00 2.07 -0.73 -0.30 116.25 117.92 2wgg h VAL 153 Ca 0.04 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 2wgg h VAL 153 Cb 0.75 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 2wgg h VAL 153 CO 0.05 0.02 0.06 0.40 0.02 0.00 0.00 177.57 178.12 2wgg h ILE 154 N 0.08 1.18 -0.94 4.57 2.04 -1.22 0.14 117.51 123.36 2wgg h ILE 154 Ca 0.24 -0.57 0.07 0.00 1.00 0.00 0.00 64.86 65.61 2wgg h ILE 154 Cb 0.37 1.20 -0.07 0.00 -0.74 0.00 0.00 36.82 37.58 2wgg h ILE 154 CO -0.43 0.18 0.60 1.23 0.00 0.00 0.00 178.15 179.73 2wgg h GLY 155 N 0.14 1.45 1.34 5.37 0.00 -0.75 -0.29 103.07 110.33 2wgg h GLY 155 Ca 0.06 -0.43 -0.23 0.00 0.00 0.00 0.00 47.33 46.74 2wgg h GLY 155 CO -0.00 0.27 -0.87 -2.00 0.00 0.00 0.00 176.54 173.94 2wgg h LEU 156 N 1.06 0.77 -0.59 3.11 5.85 -0.88 0.84 115.31 125.46 2wgg h LEU 156 Ca 0.42 -0.55 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 2wgg h LEU 156 Cb 0.23 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 2wgg h LEU 156 CO -0.19 1.34 0.30 -0.61 -0.34 0.00 0.00 178.44 178.94 2wgg h GLN 157 N 0.39 0.84 0.00 1.25 4.15 -0.15 -3.26 115.11 118.33 2wgg h GLN 157 Ca -0.07 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.24 2wgg h GLN 157 Cb 1.50 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 29.03 2wgg h GLN 157 CO 0.17 0.66 -0.99 1.28 -1.93 0.00 0.00 178.83 178.01 2wgg n LEU 158 N -4.56 0.87 -0.34 -2.39 4.77 -0.17 -5.00 117.00 110.18 2wgg n LEU 158 Ca 0.04 -0.39 0.00 0.00 -0.03 0.00 0.00 56.01 55.62 2wgg n LEU 158 Cb 0.10 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2wgg n LEU 158 CO 0.37 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 2wgg n GLY 159 N 1.48 0.96 3.64 -0.72 0.00 0.04 -5.04 105.19 105.55 2wgg n GLY 159 Ca 0.04 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 2wgg n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wgg s ALA 160 N -2.68 3.63 0.00 4.61 0.00 0.07 -4.56 121.76 122.83 2wgg s ALA 160 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 51.96 51.87 2wgg s ALA 160 Cb 0.00 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.72 2wgg s ALA 160 CO 0.00 -1.05 0.90 0.54 0.00 0.00 0.00 175.76 176.14 2wgg n ARG 161 N 6.21 2.21 -0.48 0.00 1.74 0.48 -4.59 116.66 122.22 2wgg n ARG 161 Ca 0.08 -1.29 0.08 0.00 -0.77 0.00 0.00 57.85 55.95 2wgg n ARG 161 Cb 0.47 -0.99 0.29 0.00 -1.02 0.00 0.00 32.46 31.22 2wgg n ARG 161 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wgg n ALA 162 N -0.40 2.83 0.00 7.54 0.00 -0.69 -4.71 120.51 125.09 2wgg n ALA 162 Ca 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 53.44 51.82 2wgg n ALA 162 Cb 0.21 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 18.84 2wgg n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wgg n GLY 163 N 0.71 3.79 2.85 0.00 0.00 -1.26 -4.70 105.19 106.58 2wgg n GLY 163 Ca 0.22 -1.42 -0.28 0.00 0.00 0.00 0.00 46.02 44.54 2wgg n GLY 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wgg s VAL 164 N -0.97 0.97 0.10 1.61 1.01 -1.25 -0.69 120.40 121.18 2wgg s VAL 164 Ca 0.00 -0.60 0.09 0.00 0.00 0.00 0.00 61.98 61.47 2wgg s VAL 164 Cb 0.00 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 35.13 2wgg s VAL 164 CO 0.00 0.05 -0.24 -0.32 0.00 0.00 0.00 175.10 174.59 2wgg s MET 165 N 1.69 1.36 -0.33 2.72 1.75 0.36 -4.99 119.30 121.86 2wgg s MET 165 Ca 0.00 -1.20 -0.01 0.00 -1.25 0.00 0.00 55.69 53.23 2wgg s MET 165 Cb -0.16 -1.69 0.11 0.00 2.84 0.00 0.00 34.83 35.93 2wgg s MET 165 CO -0.07 0.41 0.13 0.99 -0.65 0.00 0.00 175.02 175.83 2wgg s THR 166 N -1.02 0.69 0.04 10.11 2.01 -1.26 -1.55 115.64 124.66 2wgg s THR 166 Ca 0.10 -1.44 -0.25 0.00 0.31 0.00 0.00 61.69 60.41 2wgg s THR 166 Cb -0.10 -1.52 -0.05 0.00 0.01 0.00 0.00 72.50 70.83 2wgg s THR 166 CO 0.04 -0.74 0.76 -2.16 -0.69 0.00 0.00 174.62 171.83 2wgg s PRO 167 N 1.51 4.49 -0.18 4.92 0.04 -1.26 -4.97 135.00 139.54 2wgg s PRO 167 Ca 0.11 1.05 -0.01 0.00 0.04 0.00 0.00 61.00 62.19 2wgg s PRO 167 Cb -0.18 -3.36 -0.00 0.00 0.04 0.00 0.00 34.50 30.99 2wgg s PRO 167 CO -0.22 0.29 -0.11 0.14 0.04 0.00 0.00 177.00 177.14 2wgg s VAL 168 N -0.07 2.96 -0.32 -0.36 -7.23 -1.26 -4.12 120.40 109.99 2wgg s VAL 168 Ca 0.38 -0.65 0.16 0.00 -1.81 0.00 0.00 61.98 60.06 2wgg s VAL 168 Cb -0.20 -2.29 0.45 0.00 0.56 0.00 0.00 36.38 34.89 2wgg s VAL 168 CO 0.23 0.48 1.22 -1.54 -0.31 0.00 0.00 175.10 175.18 2wgg n SER 169 N 4.35 0.10 0.00 4.85 3.41 -1.26 -5.00 113.62 120.07 2wgg n SER 169 Ca -0.19 -2.34 0.00 0.00 -0.26 0.00 0.00 58.87 56.08 2wgg n SER 169 Cb 0.51 0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 2wgg n SER 169 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wgg n ALA 170 N -0.69 0.00 0.95 7.33 0.00 -1.26 -2.53 120.51 124.32 2wgg n ALA 170 Ca -0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.53 2wgg n ALA 170 Cb 0.83 0.00 0.50 0.00 0.00 0.00 0.00 19.45 20.79 2wgg n ALA 170 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2wgg n GLN 171 N 14.00 0.31 -0.28 0.00 3.00 -1.26 -1.71 117.38 131.45 2wgg n GLN 171 Ca 0.00 0.09 0.10 0.00 -0.01 0.00 0.00 57.00 57.18 2wgg n GLN 171 Cb 0.00 -1.50 0.25 0.00 0.00 0.00 0.00 30.24 28.99 2wgg n GLN 171 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 2wgg n SER 172 N -1.26 3.55 -0.07 1.08 3.41 -1.05 -4.40 113.62 114.88 2wgg n SER 172 Ca 0.10 -1.98 0.02 0.00 -0.26 0.00 0.00 58.87 56.74 2wgg n SER 172 Cb 0.15 -0.37 0.33 0.00 -0.26 0.00 0.00 64.21 64.06 2wgg n SER 172 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2wgg h SER 173 N 3.66 0.61 -0.05 4.04 0.02 -1.47 0.65 113.55 121.01 2wgg h SER 173 Ca 0.00 -0.04 -0.18 0.00 -0.84 0.00 0.00 61.79 60.73 2wgg h SER 173 Cb 0.91 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 63.29 2wgg h SER 173 CO 0.00 0.50 -0.60 1.23 -1.14 0.00 0.00 176.83 176.82 2wgg h GLY 174 N 0.77 0.72 1.07 -3.77 0.00 -1.43 -1.11 103.07 99.32 2wgg h GLY 174 Ca 0.18 -0.89 -0.21 0.00 0.00 0.00 0.00 47.33 46.41 2wgg h GLY 174 CO -0.03 0.79 -0.76 1.76 0.00 0.00 0.00 176.54 178.30 2wgg h SER 175 N 0.49 0.82 -1.00 0.19 0.02 -1.64 -3.18 113.55 109.25 2wgg h SER 175 Ca -0.00 -0.67 0.03 0.00 -0.84 0.00 0.00 61.79 60.30 2wgg h SER 175 Cb 1.18 -0.25 -0.06 0.00 0.14 0.00 0.00 62.40 63.42 2wgg h SER 175 CO 0.12 1.37 0.66 -0.08 -1.14 0.00 0.00 176.83 177.76 2wgg h GLU 176 N 0.34 1.26 -0.65 3.45 4.81 -0.77 -1.60 114.58 121.41 2wgg h GLU 176 Ca -0.07 -0.08 0.09 0.00 -0.13 0.00 0.00 59.36 59.18 2wgg h GLU 176 Cb 1.41 -0.28 -0.07 0.00 0.63 0.00 0.00 28.75 30.44 2wgg h GLU 176 CO 0.15 0.83 0.29 0.00 -0.73 0.00 0.00 179.01 179.55 2wgg h ALA 177 N 1.40 0.88 -0.58 2.92 0.00 -1.23 -1.89 119.26 120.76 2wgg h ALA 177 Ca 0.39 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.31 2wgg h ALA 177 Cb -0.05 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2wgg h ALA 177 CO -0.11 -0.12 0.15 0.82 0.00 0.00 0.00 179.25 179.98 2wgg h ILE 178 N 0.50 1.23 -0.14 0.00 2.04 -1.37 -1.92 117.51 117.85 2wgg h ILE 178 Ca 0.33 -0.85 0.00 0.00 1.00 0.00 0.00 64.86 65.34 2wgg h ILE 178 Cb 0.37 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 2wgg h ILE 178 CO -0.29 0.32 0.09 0.00 0.00 0.00 0.00 178.15 178.27 2wgg h ALA 179 N 1.29 0.18 -0.13 1.87 0.00 -0.63 -2.12 119.26 119.73 2wgg h ALA 179 Ca 0.19 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 2wgg h ALA 179 Cb 0.31 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2wgg h ALA 179 CO -0.00 -0.32 -0.43 0.45 0.00 0.00 0.00 179.25 178.96 2wgg h HIS 180 N 0.17 0.34 -0.20 0.00 3.86 -1.22 -1.45 115.15 116.65 2wgg h HIS 180 Ca 0.05 -0.10 -0.00 0.00 -1.16 0.00 0.00 60.37 59.16 2wgg h HIS 180 Cb 0.01 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.40 2wgg h HIS 180 CO -0.06 0.67 0.11 0.00 0.86 0.00 0.00 177.93 179.51 2wgg h ALA 181 N 1.32 0.26 0.05 2.45 0.00 -1.28 -0.47 119.26 121.59 2wgg h ALA 181 Ca 0.02 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.90 2wgg h ALA 181 Cb 0.85 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 2wgg h ALA 181 CO 0.07 -0.22 -0.32 2.35 0.00 0.00 0.00 179.25 181.13 2wgg h TRP 182 N 0.22 -0.88 -0.98 0.00 7.01 -1.06 -1.61 115.95 118.65 2wgg h TRP 182 Ca 0.07 0.03 0.12 0.00 2.11 0.00 0.00 58.89 61.22 2wgg h TRP 182 Cb 0.06 0.38 -0.08 0.00 -2.10 0.00 0.00 29.16 27.42 2wgg h TRP 182 CO -0.04 -0.42 0.62 0.00 -2.79 0.00 0.00 178.44 175.81 2wgg h ARG 183 N -0.50 0.92 -0.38 2.65 3.08 -1.21 0.15 114.38 119.08 2wgg h ARG 183 Ca 0.05 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 59.95 2wgg h ARG 183 Cb 0.57 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 2wgg h ARG 183 CO -0.23 0.61 -0.13 0.37 -1.07 0.00 0.00 179.97 179.51 2wgg h GLN 184 N 0.95 0.67 0.06 0.04 5.75 -0.67 0.10 115.11 122.01 2wgg h GLN 184 Ca 0.48 -0.22 -0.00 0.00 -0.15 0.00 0.00 58.65 58.76 2wgg h GLN 184 Cb 0.51 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.01 2wgg h GLN 184 CO -0.25 0.78 -0.03 0.82 -2.65 0.00 0.00 178.83 177.51 2wgg h ILE 185 N 0.61 1.23 -0.26 2.39 2.04 -0.31 0.91 117.51 124.12 2wgg h ILE 185 Ca 0.10 -1.51 -0.03 0.00 1.00 0.00 0.00 64.86 64.43 2wgg h ILE 185 Cb 0.58 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 38.79 2wgg h ILE 185 CO 0.04 0.35 0.05 -0.37 0.00 0.00 0.00 178.15 178.21 2wgg h VAL 186 N -0.82 1.14 0.00 1.67 -1.51 -0.74 -1.55 116.25 114.44 2wgg h VAL 186 Ca -0.01 -0.49 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 2wgg h VAL 186 Cb 0.63 0.89 0.00 0.00 -2.13 0.00 0.00 31.29 30.68 2wgg h VAL 186 CO 0.01 0.17 0.00 0.23 -1.23 0.00 0.00 177.57 176.76 2wgg n MET 187 N -4.37 0.15 -0.55 5.19 2.81 0.35 -4.73 117.12 115.97 2wgg n MET 187 Ca 0.01 0.08 0.00 0.00 -1.81 0.00 0.00 57.70 55.98 2wgg n MET 187 Cb 0.17 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.18 2wgg n MET 187 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wgg n GLY 188 N 0.87 0.74 0.06 3.03 0.00 -0.58 -4.97 105.19 104.33 2wgg n GLY 188 Ca 0.08 -0.54 0.11 0.00 0.00 0.00 0.00 46.02 45.68 2wgg n GLY 188 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wgg n ASP 189 N 1.00 0.65 -3.76 1.61 8.00 0.30 -4.96 116.55 119.39 2wgg n ASP 189 Ca 0.00 0.01 -0.10 0.00 0.71 0.00 0.00 54.79 55.42 2wgg n ASP 189 Cb 0.02 0.63 -0.04 0.00 -0.02 0.00 0.00 41.12 41.72 2wgg n ASP 189 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wgg s ALA 190 N -3.25 -0.82 -0.07 2.24 0.00 -1.14 -4.78 121.76 113.93 2wgg s ALA 190 Ca 0.03 -0.30 0.04 0.00 0.00 0.00 0.00 51.96 51.73 2wgg s ALA 190 Cb 0.13 0.85 -0.05 0.00 0.00 0.00 0.00 23.12 24.05 2wgg s ALA 190 CO 0.79 -0.78 0.11 -0.25 0.00 0.00 0.00 175.76 175.63 2wgg n ASP 191 N -0.32 2.51 -3.81 0.00 8.00 0.20 -4.32 116.55 118.81 2wgg n ASP 191 Ca -0.10 -0.24 -0.12 0.00 0.71 0.00 0.00 54.79 55.04 2wgg n ASP 191 Cb 0.63 1.10 -0.10 0.00 -0.02 0.00 0.00 41.12 42.72 2wgg n ASP 191 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2wgg s VAL 192 N -1.89 0.04 -0.12 2.53 0.11 -1.05 -1.75 120.40 118.27 2wgg s VAL 192 Ca -0.00 -0.32 -0.11 0.00 -2.93 0.00 0.00 61.98 58.61 2wgg s VAL 192 Cb 0.03 -0.44 0.03 0.00 -1.53 0.00 0.00 36.38 34.47 2wgg s VAL 192 CO 0.16 -0.18 0.33 0.00 -3.33 0.00 0.00 175.10 172.08 2wgg s ALA 193 N -0.67 -0.81 -0.13 1.54 0.00 0.11 -1.49 121.76 120.31 2wgg s ALA 193 Ca -0.08 0.90 -0.17 0.00 0.00 0.00 0.00 51.96 52.61 2wgg s ALA 193 Cb -0.04 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.52 2wgg s ALA 193 CO 0.02 -0.16 0.43 0.08 0.00 0.00 0.00 175.76 176.13 2wgg s VAL 194 N 0.11 5.21 0.03 0.00 1.01 -0.95 -0.57 120.40 125.25 2wgg s VAL 194 Ca -0.01 0.85 -0.15 0.00 0.00 0.00 0.00 61.98 62.67 2wgg s VAL 194 Cb -0.02 -3.77 0.03 0.00 0.00 0.00 0.00 36.38 32.61 2wgg s VAL 194 CO 0.01 0.35 0.34 0.00 0.00 0.00 0.00 175.10 175.79 2wgg n GLY 196 N 0.70 -0.13 3.52 0.00 0.00 -0.87 -0.43 105.19 107.98 2wgg n GLY 196 Ca -0.19 -0.82 -0.12 0.00 0.00 0.00 0.00 46.02 44.89 2wgg n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wgg s GLY 197 N 0.00 -0.46 0.09 -0.02 0.00 -0.06 -1.43 107.32 105.44 2wgg s GLY 197 Ca 0.00 1.32 0.02 0.00 0.00 0.00 0.00 44.72 46.07 2wgg s GLY 197 CO 0.00 0.69 -0.08 -1.34 0.00 0.00 0.00 173.10 172.37 2wgg s VAL 198 N -2.09 0.73 0.11 1.40 -7.23 -0.97 -1.46 120.40 110.90 2wgg s VAL 198 Ca -0.02 -1.67 -0.13 0.00 -1.81 0.00 0.00 61.98 58.35 2wgg s VAL 198 Cb -0.01 -1.36 0.02 0.00 0.56 0.00 0.00 36.38 35.59 2wgg s VAL 198 CO -0.01 -0.68 0.32 -0.70 -0.31 0.00 0.00 175.10 173.72 2wgg s GLU 199 N -3.06 0.99 0.91 4.82 2.56 -1.24 -3.92 118.70 119.76 2wgg s GLU 199 Ca 0.05 -0.82 -0.14 0.00 0.00 0.00 0.00 54.97 54.06 2wgg s GLU 199 Cb -0.00 0.42 0.15 0.00 2.00 0.00 0.00 34.13 36.70 2wgg s GLU 199 CO -0.02 -0.36 1.22 0.20 -0.56 0.00 0.00 175.26 175.73 2wgg s GLY 200 N -2.83 1.66 0.84 -1.50 0.00 -1.26 -4.83 107.32 99.39 2wgg s GLY 200 Ca 0.04 -0.85 -0.13 0.00 0.00 0.00 0.00 44.72 43.79 2wgg s GLY 200 CO -0.11 -0.22 1.19 2.56 0.00 0.00 0.00 173.10 176.52 2wgg s PRO 201 N -5.63 1.68 0.19 2.90 0.04 -1.26 -4.86 135.00 128.06 2wgg s PRO 201 Ca 0.67 0.06 -0.32 0.00 0.04 0.00 0.00 61.00 61.46 2wgg s PRO 201 Cb -0.09 -1.92 -0.11 0.00 0.04 0.00 0.00 34.50 32.42 2wgg s PRO 201 CO 0.52 -1.78 1.66 0.42 0.04 0.00 0.00 177.00 177.85 2wgg s ILE 202 N -3.58 2.28 0.16 0.56 1.01 -1.26 -5.02 121.20 115.35 2wgg s ILE 202 Ca 0.64 0.20 -0.11 0.00 0.00 0.00 0.00 60.65 61.38 2wgg s ILE 202 Cb -0.11 -3.13 0.00 0.00 0.01 0.00 0.00 42.46 39.24 2wgg s ILE 202 CO 0.50 0.02 0.32 -1.61 0.00 0.00 0.00 174.94 174.16 2wgg s GLU 203 N 1.15 1.14 0.08 2.79 0.41 -1.26 -5.10 118.70 117.92 2wgg s GLU 203 Ca 0.73 -1.07 -0.26 0.00 -0.41 0.00 0.00 54.97 53.96 2wgg s GLU 203 Cb -0.47 0.40 -0.16 0.00 -1.78 0.00 0.00 34.13 32.12 2wgg s GLU 203 CO 0.32 -0.43 1.70 0.00 -0.49 0.00 0.00 175.26 176.36 2wgg h ALA 204 N 2.51 -0.25 0.18 5.21 0.00 -1.96 -2.51 119.26 122.44 2wgg h ALA 204 Ca -0.32 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.55 2wgg h ALA 204 Cb 1.23 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 19.08 2wgg h ALA 204 CO 0.47 -0.64 -0.38 1.25 0.00 0.00 0.00 179.25 179.96 2wgg h LEU 205 N -0.26 -1.09 -0.81 0.00 6.46 -1.99 0.61 115.31 118.23 2wgg h LEU 205 Ca -0.03 0.12 0.16 0.00 -0.12 0.00 0.00 57.88 58.01 2wgg h LEU 205 Cb 0.20 0.40 -0.10 0.00 -0.73 0.00 0.00 40.66 40.43 2wgg h LEU 205 CO 0.04 -0.47 0.36 -0.65 -0.62 0.00 0.00 178.44 177.10 2wgg h PRO 206 N -0.65 0.47 -0.13 5.25 0.11 -1.96 -0.41 132.00 134.69 2wgg h PRO 206 Ca 0.01 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 2wgg h PRO 206 Cb 0.65 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 2wgg h PRO 206 CO -0.19 0.31 0.04 0.82 -0.21 0.00 0.00 178.00 178.78 2wgg h ILE 207 N 0.49 1.17 -0.84 4.15 2.04 -0.98 -2.70 117.51 120.84 2wgg h ILE 207 Ca 0.46 -0.51 0.16 0.00 1.00 0.00 0.00 64.86 65.97 2wgg h ILE 207 Cb 0.72 1.27 -0.10 0.00 -0.74 0.00 0.00 36.82 37.97 2wgg h ILE 207 CO -0.42 0.15 0.40 0.00 0.00 0.00 0.00 178.15 178.28 2wgg h ALA 208 N 0.87 1.26 -0.14 1.87 0.00 0.08 -0.16 119.26 123.03 2wgg h ALA 208 Ca 0.04 0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 2wgg h ALA 208 Cb 0.20 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2wgg h ALA 208 CO -0.00 -0.16 -0.35 0.00 0.00 0.00 0.00 179.25 178.73 2wgg h ALA 209 N 1.58 0.24 -0.09 0.00 0.00 -0.89 -1.96 119.26 118.14 2wgg h ALA 209 Ca 0.47 -0.44 -0.21 0.00 0.00 0.00 0.00 54.91 54.74 2wgg h ALA 209 Cb 0.73 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2wgg h ALA 209 CO -0.40 0.30 -0.80 0.74 0.00 0.00 0.00 179.25 179.09 2wgg h PHE 210 N 0.11 0.78 0.00 0.00 0.04 -1.41 -3.22 116.94 113.24 2wgg h PHE 210 Ca -0.00 -0.36 0.00 0.00 2.80 0.00 0.00 57.97 60.41 2wgg h PHE 210 Cb 0.96 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 39.00 2wgg h PHE 210 CO 0.10 1.16 0.00 -1.13 -0.60 0.00 0.00 178.31 177.84 2wgg n SER 211 N -3.86 0.65 0.09 2.17 3.41 -0.08 -1.91 113.62 114.09 2wgg n SER 211 Ca -0.06 0.62 0.13 0.00 -0.26 0.00 0.00 58.87 59.30 2wgg n SER 211 Cb 0.75 -0.78 0.43 0.00 -0.26 0.00 0.00 64.21 64.35 2wgg n SER 211 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 2wgg n MET 212 N -2.18 0.22 0.00 4.33 2.81 -0.74 -2.42 117.12 119.14 2wgg n MET 212 Ca 0.03 0.18 0.14 0.00 -1.81 0.00 0.00 57.70 56.24 2wgg n MET 212 Cb 0.29 -1.75 0.53 0.00 -0.71 0.00 0.00 33.22 31.58 2wgg n MET 212 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 2wgg n MET 213 N -2.14 0.50 -1.90 0.03 2.00 -0.80 -4.92 117.12 109.89 2wgg n MET 213 Ca 0.06 -0.19 -0.18 0.00 0.00 0.00 0.00 57.70 57.39 2wgg n MET 213 Cb 0.42 -1.50 -0.04 0.00 0.00 0.00 0.00 33.22 32.10 2wgg n MET 213 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 2wgg n ARG 214 N -1.08 -1.31 0.04 0.03 0.63 -1.02 -4.92 116.66 109.03 2wgg n ARG 214 Ca 0.12 0.99 0.12 0.00 -0.92 0.00 0.00 57.85 58.17 2wgg n ARG 214 Cb 0.30 -5.35 0.25 0.00 0.45 0.00 0.00 32.46 28.11 2wgg n ARG 214 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wgg n ALA 215 N -0.17 3.01 -2.80 5.13 0.00 -1.14 -4.91 120.51 119.63 2wgg n ALA 215 Ca -0.19 -0.25 -0.33 0.00 0.00 0.00 0.00 53.44 52.67 2wgg n ALA 215 Cb 0.62 -1.21 -0.07 0.00 0.00 0.00 0.00 19.45 18.79 2wgg n ALA 215 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2wgg s MET 216 N -3.10 3.09 0.51 0.00 -1.94 -1.26 -1.10 119.30 115.50 2wgg s MET 216 Ca 0.09 -0.49 -0.23 0.00 -1.71 0.00 0.00 55.69 53.36 2wgg s MET 216 Cb 0.15 -2.87 -0.06 0.00 2.01 0.00 0.00 34.83 34.06 2wgg s MET 216 CO 0.69 0.64 1.31 0.45 -0.01 0.00 0.00 175.02 178.10 2wgg s SER 217 N -1.82 5.62 -0.16 3.03 0.15 -0.01 -4.62 113.70 115.89 2wgg s SER 217 Ca 0.24 2.65 0.15 0.00 0.70 0.00 0.00 55.95 59.68 2wgg s SER 217 Cb -0.12 -2.63 0.42 0.00 -1.71 0.00 0.00 66.02 61.98 2wgg s SER 217 CO 0.15 -1.32 1.21 0.35 1.20 0.00 0.00 173.24 174.83 2wgg n THR 218 N -0.75 1.66 -1.86 6.45 -2.24 -1.26 -4.78 114.28 111.49 2wgg n THR 218 Ca 0.09 -2.68 -0.42 0.00 -2.27 0.00 0.00 64.05 58.76 2wgg n THR 218 Cb 0.45 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 2wgg n THR 218 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2wgg n ARG 219 N -0.72 2.92 0.12 -0.78 0.63 -1.26 -4.75 116.66 112.82 2wgg n ARG 219 Ca 0.16 -2.72 -0.02 0.00 -0.92 0.00 0.00 57.85 54.35 2wgg n ARG 219 Cb 0.80 -3.31 0.08 0.00 0.45 0.00 0.00 32.46 30.49 2wgg n ARG 219 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 2wgg h ASN 220 N 6.21 0.00 0.85 6.15 -0.26 -1.91 -3.24 115.58 123.37 2wgg h ASN 220 Ca 0.55 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 56.24 2wgg h ASN 220 Cb 0.67 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.92 2wgg h ASN 220 CO 1.82 0.70 -0.25 0.44 -1.06 0.00 0.00 177.43 179.08 2wgg h ASP 221 N 0.00 0.00 -2.29 5.81 3.32 -1.98 -3.36 116.42 117.92 2wgg h ASP 221 Ca -0.01 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.46 2wgg h ASP 221 Cb 1.33 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 40.49 2wgg h ASP 221 CO 0.09 0.25 -0.93 -0.62 -1.72 0.00 0.00 179.24 176.31 2wgg n GLU 222 N -3.45 0.88 -0.23 3.56 1.02 -1.22 -5.02 120.64 116.18 2wgg n GLU 222 Ca -0.00 -3.54 -0.03 0.00 -0.02 0.00 0.00 57.16 53.56 2wgg n GLU 222 Cb 0.43 -1.64 0.08 0.00 -0.02 0.00 0.00 31.44 30.28 2wgg n GLU 222 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2wgg h PRO 223 N 4.79 0.74 0.00 3.49 0.11 -1.72 -1.24 132.00 138.16 2wgg h PRO 223 Ca 0.17 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.22 2wgg h PRO 223 Cb 0.85 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.79 2wgg h PRO 223 CO 0.51 0.49 -0.05 0.93 -0.21 0.00 0.00 178.00 179.66 2wgg h GLU 224 N 0.76 0.00 -0.00 1.05 5.08 -1.91 -2.78 114.58 116.77 2wgg h GLU 224 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 2wgg h GLU 224 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2wgg h GLU 224 CO -0.13 0.05 -0.46 0.54 -1.00 0.00 0.00 179.01 178.01 2wgg n ARG 225 N -3.21 0.10 -0.06 2.33 1.74 -0.49 -4.58 116.66 112.48 2wgg n ARG 225 Ca -0.00 -0.06 -0.11 0.00 -0.77 0.00 0.00 57.85 56.91 2wgg n ARG 225 Cb 0.29 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.18 2wgg n ARG 225 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wgg h ALA 226 N 3.08 0.24 -2.22 7.54 0.00 -1.23 -3.42 119.26 123.25 2wgg h ALA 226 Ca 0.00 -0.16 -0.63 0.00 0.00 0.00 0.00 54.91 54.12 2wgg h ALA 226 Cb 0.50 -0.07 -0.13 0.00 0.00 0.00 0.00 17.79 18.09 2wgg h ALA 226 CO 0.00 -0.10 0.24 0.45 0.00 0.00 0.00 179.25 179.83 2wgg s SER 227 N -5.71 6.44 -0.48 0.00 0.15 -1.26 -4.65 113.70 108.19 2wgg s SER 227 Ca -0.14 0.08 0.08 0.00 0.70 0.00 0.00 55.95 56.67 2wgg s SER 227 Cb 0.07 -2.35 0.29 0.00 -1.71 0.00 0.00 66.02 62.31 2wgg s SER 227 CO 0.72 -0.71 0.70 0.54 1.20 0.00 0.00 173.24 175.68 2wgg n ARG 228 N 6.29 1.62 -1.68 5.44 1.74 -1.26 -4.60 116.66 124.21 2wgg n ARG 228 Ca 0.00 -3.87 -0.45 0.00 -0.77 0.00 0.00 57.85 52.76 2wgg n ARG 228 Cb 0.48 -1.75 -0.04 0.00 -1.02 0.00 0.00 32.46 30.13 2wgg n ARG 228 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2wgg n PRO 229 N 0.73 2.32 -0.57 5.56 -0.04 -1.26 -1.86 135.00 139.88 2wgg n PRO 229 Ca 0.26 0.84 0.00 0.00 -0.04 0.00 0.00 63.50 64.56 2wgg n PRO 229 Cb 0.51 -2.64 0.00 0.00 -0.04 0.00 0.00 33.50 31.33 2wgg n PRO 229 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2wgg n PHE 230 N 4.24 0.00 -2.78 0.54 3.72 -1.26 -4.85 117.46 117.07 2wgg n PHE 230 Ca 0.18 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.25 2wgg n PHE 230 Cb 0.31 -0.25 -0.06 0.00 -0.94 0.00 0.00 39.48 38.54 2wgg n PHE 230 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2wgg s ASP 231 N -3.11 6.81 0.37 4.37 2.15 -0.78 -3.95 116.67 122.53 2wgg s ASP 231 Ca 0.00 1.56 0.15 0.00 0.43 0.00 0.00 52.55 54.68 2wgg s ASP 231 Cb 0.00 -2.49 0.71 0.00 -0.30 0.00 0.00 42.92 40.85 2wgg s ASP 231 CO 0.00 -0.39 1.79 0.50 -0.17 0.00 0.00 175.17 176.91 2wgg h LYS 232 N 1.71 0.00 -0.76 4.34 3.11 -1.12 -2.97 116.57 120.88 2wgg h LYS 232 Ca -0.48 0.00 -0.09 0.00 -2.81 0.00 0.00 60.65 57.27 2wgg h LYS 232 Cb 1.18 0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 32.36 2wgg h LYS 232 CO 0.62 0.39 0.11 -0.25 -2.81 0.00 0.00 179.45 177.52 2wgg n ASP 233 N -3.90 4.32 -4.77 4.20 8.00 -1.26 -4.97 116.55 118.17 2wgg n ASP 233 Ca -0.01 -2.81 -0.40 0.00 0.71 0.00 0.00 54.79 52.27 2wgg n ASP 233 Cb 0.45 -0.67 -0.02 0.00 -0.02 0.00 0.00 41.12 40.86 2wgg n ASP 233 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wgg s ARG 234 N -2.35 4.31 -0.10 -1.24 1.70 -1.12 -4.97 118.95 115.18 2wgg s ARG 234 Ca 0.41 2.16 0.17 0.00 -0.47 0.00 0.00 55.73 58.00 2wgg s ARG 234 Cb 0.32 -3.02 0.39 0.00 -0.57 0.00 0.00 34.95 32.07 2wgg s ARG 234 CO 0.11 -0.21 1.18 -0.40 -1.08 0.00 0.00 175.30 174.90 2wgg n ASP 235 N 0.70 1.33 0.00 -2.89 5.75 -1.24 -4.64 116.55 115.56 2wgg n ASP 235 Ca 0.01 -2.90 0.00 0.00 -0.01 0.00 0.00 54.79 51.88 2wgg n ASP 235 Cb 0.42 -0.40 0.00 0.00 -1.03 0.00 0.00 41.12 40.11 2wgg n ASP 235 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wgg n GLY 236 N -0.37 0.77 3.91 6.12 0.00 0.50 -3.09 105.19 113.04 2wgg n GLY 236 Ca 0.12 -2.26 -0.27 0.00 0.00 0.00 0.00 46.02 43.61 2wgg n GLY 236 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2wgg s PHE 237 N -1.03 3.31 -0.06 1.61 -0.12 -0.26 -3.63 117.98 117.81 2wgg s PHE 237 Ca 0.00 0.71 0.05 0.00 -0.05 0.00 0.00 56.93 57.64 2wgg s PHE 237 Cb 0.00 -2.69 -0.01 0.00 -0.63 0.00 0.00 43.02 39.69 2wgg s PHE 237 CO 0.00 -0.76 -0.21 0.08 -0.05 0.00 0.00 175.22 174.28 2wgg s VAL 238 N -2.98 1.76 0.09 -2.49 1.01 -1.26 -0.83 120.40 115.69 2wgg s VAL 238 Ca 0.53 -0.89 -0.31 0.00 0.00 0.00 0.00 61.98 61.31 2wgg s VAL 238 Cb -0.11 -1.50 -0.08 0.00 0.00 0.00 0.00 36.38 34.70 2wgg s VAL 238 CO 0.46 0.49 1.47 -0.36 0.00 0.00 0.00 175.10 177.16 2wgg s PHE 239 N 0.01 2.97 -0.22 5.22 0.08 -1.26 0.14 117.98 124.93 2wgg s PHE 239 Ca -0.06 0.76 -0.03 0.00 0.12 0.00 0.00 56.93 57.72 2wgg s PHE 239 Cb -0.13 -3.76 0.07 0.00 -0.57 0.00 0.00 43.02 38.62 2wgg s PHE 239 CO 0.04 -2.82 0.06 0.20 -0.10 0.00 0.00 175.22 172.60 2wgg s GLY 240 N 1.54 0.69 0.27 4.36 0.00 -0.64 -0.90 107.32 112.63 2wgg s GLY 240 Ca 0.67 -0.81 -0.30 0.00 0.00 0.00 0.00 44.72 44.28 2wgg s GLY 240 CO 0.30 1.55 1.30 1.18 0.00 0.00 0.00 173.10 177.42 2wgg n GLU 241 N 5.07 1.88 -3.64 2.90 1.02 0.12 -3.17 120.64 124.82 2wgg n GLU 241 Ca -0.08 0.67 -0.07 0.00 -0.02 0.00 0.00 57.16 57.66 2wgg n GLU 241 Cb 0.46 -2.25 -0.02 0.00 -0.02 0.00 0.00 31.44 29.62 2wgg n GLU 241 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2wgg s ALA 242 N -0.48 -1.65 -0.18 0.62 0.00 -1.26 -3.14 121.76 115.67 2wgg s ALA 242 Ca 0.64 0.42 -0.22 0.00 0.00 0.00 0.00 51.96 52.79 2wgg s ALA 242 Cb -0.65 0.63 0.06 0.00 0.00 0.00 0.00 23.12 23.15 2wgg s ALA 242 CO 0.55 -0.89 0.60 0.20 0.00 0.00 0.00 175.76 176.22 2wgg s GLY 243 N -2.76 -0.45 -0.11 0.00 0.00 -0.97 -3.73 107.32 99.30 2wgg s GLY 243 Ca 0.08 1.54 -0.10 0.00 0.00 0.00 0.00 44.72 46.24 2wgg s GLY 243 CO -0.03 1.29 0.29 0.00 0.00 0.00 0.00 173.10 174.65 2wgg s ALA 244 N -0.05 -0.73 0.12 3.20 0.00 -0.54 -1.33 121.76 122.44 2wgg s ALA 244 Ca -0.03 0.84 0.07 0.00 0.00 0.00 0.00 51.96 52.83 2wgg s ALA 244 Cb -0.04 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 2wgg s ALA 244 CO 0.03 -0.14 -0.16 -0.51 0.00 0.00 0.00 175.76 174.98 2wgg s LEU 245 N 0.18 2.38 0.09 0.00 1.43 -0.63 -0.88 118.68 121.25 2wgg s LEU 245 Ca -0.00 -0.78 0.04 0.00 -1.03 0.00 0.00 54.13 52.36 2wgg s LEU 245 Cb -0.02 -0.65 -0.03 0.00 0.03 0.00 0.00 46.19 45.51 2wgg s LEU 245 CO 0.00 -0.08 -0.11 0.00 0.23 0.00 0.00 176.35 176.39 2wgg s MET 246 N -2.47 0.82 -0.18 1.70 0.23 0.43 -1.04 119.30 118.79 2wgg s MET 246 Ca 0.09 -1.08 -0.11 0.00 -1.03 0.00 0.00 55.69 53.55 2wgg s MET 246 Cb -0.06 -0.58 -0.05 0.00 -1.53 0.00 0.00 34.83 32.61 2wgg s MET 246 CO 0.04 0.10 0.19 -1.17 -2.03 0.00 0.00 175.02 172.15 2wgg s LEU 247 N -2.22 4.23 0.09 0.18 2.96 0.11 -1.73 118.68 122.29 2wgg s LEU 247 Ca 0.03 0.34 0.07 0.00 -0.22 0.00 0.00 54.13 54.34 2wgg s LEU 247 Cb -0.05 -2.20 -0.03 0.00 0.50 0.00 0.00 46.19 44.41 2wgg s LEU 247 CO 0.01 0.15 -0.17 0.27 -1.32 0.00 0.00 176.35 175.29 2wgg s ILE 248 N 0.37 1.42 0.09 6.68 -4.36 0.27 -1.54 121.20 124.12 2wgg s ILE 248 Ca 0.11 -1.45 -0.26 0.00 -0.26 0.00 0.00 60.65 58.79 2wgg s ILE 248 Cb -0.12 -1.34 0.08 0.00 1.25 0.00 0.00 42.46 42.34 2wgg s ILE 248 CO 0.00 -0.16 0.74 -1.83 0.24 0.00 0.00 174.94 173.93 2wgg s GLU 249 N -1.89 1.08 0.62 0.37 -1.05 -0.70 0.07 118.70 117.19 2wgg s GLU 249 Ca 0.03 -0.40 -0.19 0.00 -0.15 0.00 0.00 54.97 54.26 2wgg s GLU 249 Cb -0.10 0.49 -0.02 0.00 -0.44 0.00 0.00 34.13 34.06 2wgg s GLU 249 CO 0.03 -0.47 1.26 0.95 0.95 0.00 0.00 175.26 177.98 2wgg s THR 250 N -3.46 2.32 0.15 1.83 -4.23 -0.72 -0.34 115.64 111.20 2wgg s THR 250 Ca 0.03 0.20 -0.18 0.00 -1.18 0.00 0.00 61.69 60.56 2wgg s THR 250 Cb -0.01 -3.08 0.04 0.00 1.34 0.00 0.00 72.50 70.79 2wgg s THR 250 CO -0.11 -0.04 1.68 -0.08 -0.54 0.00 0.00 174.62 175.53 2wgg h GLU 251 N 0.75 -0.00 -0.79 3.99 4.81 -1.35 -1.44 114.58 120.55 2wgg h GLU 251 Ca -0.51 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 58.87 2wgg h GLU 251 Cb 1.32 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 30.55 2wgg h GLU 251 CO 0.54 -0.00 -0.29 1.49 -0.73 0.00 0.00 179.01 180.02 2wgg h GLU 252 N -0.00 -0.05 -0.46 1.92 4.81 -1.91 0.21 114.58 119.09 2wgg h GLU 252 Ca 0.15 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.42 2wgg h GLU 252 Cb 0.23 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.58 2wgg h GLU 252 CO -0.32 -0.03 0.23 1.25 -0.73 0.00 0.00 179.01 179.41 2wgg h HIS 253 N -0.05 0.43 -0.32 0.92 2.76 -1.75 -1.78 115.15 115.36 2wgg h HIS 253 Ca 0.33 0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.39 2wgg h HIS 253 Cb 0.59 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.41 2wgg h HIS 253 CO -0.70 0.22 -0.33 0.00 -1.30 0.00 0.00 177.93 175.82 2wgg h ALA 254 N 1.25 0.83 0.91 5.26 0.00 -0.40 -3.08 119.26 124.03 2wgg h ALA 254 Ca 0.20 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 2wgg h ALA 254 Cb 0.10 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.77 2wgg h ALA 254 CO -0.14 0.64 -0.47 -0.22 0.00 0.00 0.00 179.25 179.06 2wgg h LYS 255 N 0.58 -1.22 0.00 0.00 3.11 -0.87 0.38 116.57 118.55 2wgg h LYS 255 Ca 0.06 0.08 0.00 0.00 -2.81 0.00 0.00 60.65 57.99 2wgg h LYS 255 Cb 0.84 0.28 0.00 0.00 -1.00 0.00 0.00 32.23 32.35 2wgg h LYS 255 CO 0.07 -0.81 0.19 0.00 -2.81 0.00 0.00 179.45 176.09 2wgg n ALA 256 N -2.67 0.72 -0.15 5.00 0.00 -0.68 -0.07 120.51 122.66 2wgg n ALA 256 Ca -0.16 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2wgg n ALA 256 Cb 0.51 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 19.12 2wgg n ALA 256 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2wgg n ARG 257 N -1.82 0.71 -1.07 0.00 1.85 -1.17 -5.02 116.66 110.13 2wgg n ARG 257 Ca -0.01 -0.85 -0.02 0.00 -1.00 0.00 0.00 57.85 55.97 2wgg n ARG 257 Cb 0.21 -0.93 -0.01 0.00 -1.05 0.00 0.00 32.46 30.68 2wgg n ARG 257 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2wgg n GLY 258 N -0.20 0.57 3.68 2.89 0.00 0.90 -5.00 105.19 108.04 2wgg n GLY 258 Ca 0.00 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 2wgg n GLY 258 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wgg s ALA 259 N -2.06 3.56 -0.32 4.61 0.00 0.12 -4.99 121.76 122.68 2wgg s ALA 259 Ca 0.00 0.73 -0.29 0.00 0.00 0.00 0.00 51.96 52.40 2wgg s ALA 259 Cb 0.00 -3.57 0.01 0.00 0.00 0.00 0.00 23.12 19.56 2wgg s ALA 259 CO 0.00 -0.90 1.11 0.21 0.00 0.00 0.00 175.76 176.18 2wgg s LYS 260 N 2.50 4.04 0.34 0.00 2.47 -1.26 -4.52 119.74 123.32 2wgg s LYS 260 Ca 0.60 1.09 -0.27 0.00 -1.56 0.00 0.00 55.97 55.83 2wgg s LYS 260 Cb -0.28 -3.76 -0.09 0.00 -1.46 0.00 0.00 37.83 32.24 2wgg s LYS 260 CO 0.23 -0.93 1.13 -2.14 0.16 0.00 0.00 175.35 173.80 2wgg s PRO 261 N 3.73 4.34 0.14 4.03 0.02 -1.26 -4.76 135.00 141.24 2wgg s PRO 261 Ca 0.47 1.80 0.19 0.00 0.02 0.00 0.00 61.00 63.48 2wgg s PRO 261 Cb -0.13 -2.89 -0.06 0.00 0.02 0.00 0.00 34.50 31.44 2wgg s PRO 261 CO 0.17 -0.06 0.96 -0.07 -0.33 0.00 0.00 177.00 177.67 2wgg h LEU 262 N 3.15 0.00 -7.65 -5.54 3.38 0.22 -3.47 115.31 105.41 2wgg h LEU 262 Ca -0.48 0.00 0.29 0.00 0.09 0.00 0.00 57.88 57.79 2wgg h LEU 262 Cb 1.22 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.89 2wgg h LEU 262 CO 0.64 0.32 0.79 0.00 0.09 0.00 0.00 178.44 180.28 2wgg s ALA 263 N -3.12 -2.17 -0.05 1.53 0.00 -1.22 -4.08 121.76 112.66 2wgg s ALA 263 Ca -0.01 0.24 0.01 0.00 0.00 0.00 0.00 51.96 52.19 2wgg s ALA 263 Cb 0.09 0.64 -0.03 0.00 0.00 0.00 0.00 23.12 23.82 2wgg s ALA 263 CO 0.80 -1.09 -0.06 1.03 0.00 0.00 0.00 175.76 176.44 2wgg s ARG 264 N -2.30 2.74 -0.36 0.00 0.52 0.13 -0.98 118.95 118.69 2wgg s ARG 264 Ca 0.21 -0.57 -0.09 0.00 -0.52 0.00 0.00 55.73 54.75 2wgg s ARG 264 Cb 0.01 -2.60 0.03 0.00 0.52 0.00 0.00 34.95 32.91 2wgg s ARG 264 CO -0.01 0.65 0.17 -1.17 0.02 0.00 0.00 175.30 174.97 2wgg s LEU 265 N -1.00 4.58 -0.07 2.53 2.96 -0.52 -0.67 118.68 126.49 2wgg s LEU 265 Ca 0.14 -1.04 0.18 0.00 -0.22 0.00 0.00 54.13 53.19 2wgg s LEU 265 Cb -0.11 -1.97 -0.27 0.00 0.50 0.00 0.00 46.19 44.34 2wgg s LEU 265 CO 0.03 -0.36 0.30 0.18 -1.32 0.00 0.00 176.35 175.19 2wgg n LEU 266 N 4.94 0.00 0.00 -0.68 4.77 0.26 -4.25 117.00 122.03 2wgg n LEU 266 Ca -0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 2wgg n LEU 266 Cb 0.46 0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 2wgg n LEU 266 CO 0.35 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 2wgg n GLY 267 N 1.59 0.36 3.39 -0.72 0.00 -1.13 -3.58 105.19 105.10 2wgg n GLY 267 Ca -0.11 -0.83 -0.12 0.00 0.00 0.00 0.00 46.02 44.96 2wgg n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wgg s ALA 268 N -2.00 -1.25 -0.03 4.61 0.00 -1.26 -1.37 121.76 120.46 2wgg s ALA 268 Ca 0.00 1.56 0.07 0.00 0.00 0.00 0.00 51.96 53.59 2wgg s ALA 268 Cb 0.00 -0.92 -0.02 0.00 0.00 0.00 0.00 23.12 22.18 2wgg s ALA 268 CO 0.00 -0.26 -0.26 0.20 0.00 0.00 0.00 175.76 175.44 2wgg s GLY 269 N 0.75 1.27 -0.10 0.00 0.00 -0.03 -4.27 107.32 104.94 2wgg s GLY 269 Ca -0.04 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.59 2wgg s GLY 269 CO -0.06 -0.85 -0.08 -0.42 0.00 0.00 0.00 173.10 171.69 2wgg s ILE 270 N -0.49 1.01 0.32 0.90 1.01 -1.26 -1.22 121.20 121.47 2wgg s ILE 270 Ca 0.06 -0.32 0.05 0.00 0.00 0.00 0.00 60.65 60.45 2wgg s ILE 270 Cb -0.11 -1.00 -0.02 0.00 0.01 0.00 0.00 42.46 41.34 2wgg s ILE 270 CO 0.00 0.35 0.18 0.35 0.00 0.00 0.00 174.94 175.83 2wgg n THR 271 N 4.59 0.00 -3.95 2.92 -2.24 -0.33 -4.94 114.28 110.33 2wgg n THR 271 Ca -0.16 -2.07 -0.09 0.00 -2.27 0.00 0.00 64.05 59.46 2wgg n THR 271 Cb 0.50 0.89 -0.10 0.00 -2.10 0.00 0.00 70.33 69.52 2wgg n THR 271 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2wgg s SER 272 N -3.08 0.19 0.01 3.42 1.04 -1.26 -1.48 113.70 112.53 2wgg s SER 272 Ca 0.26 -0.48 0.04 0.00 0.48 0.00 0.00 55.95 56.25 2wgg s SER 272 Cb 0.01 0.17 -0.25 0.00 0.10 0.00 0.00 66.02 66.06 2wgg s SER 272 CO 0.18 -0.41 0.86 0.44 0.98 0.00 0.00 173.24 175.30 2wgg h ASP 273 N 4.13 0.17 -7.03 7.02 3.32 -1.46 -3.46 116.42 119.11 2wgg h ASP 273 Ca -0.32 -0.27 -0.54 0.00 0.02 0.00 0.00 57.03 55.93 2wgg h ASP 273 Cb 1.19 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.66 2wgg h ASP 273 CO 0.46 1.22 -0.89 0.00 -1.72 0.00 0.00 179.24 178.31 2wgg n ALA 274 N -2.58 -2.40 0.07 3.45 0.00 -1.26 -4.91 120.51 112.88 2wgg n ALA 274 Ca -0.14 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.77 2wgg n ALA 274 Cb 1.02 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 18.28 2wgg n ALA 274 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2wgg n PHE 275 N -4.60 -0.77 -3.74 0.00 7.35 -1.26 -5.12 117.46 109.31 2wgg n PHE 275 Ca -0.10 0.14 -0.13 0.00 -0.76 0.00 0.00 57.45 56.60 2wgg n PHE 275 Cb 0.50 0.19 -0.08 0.00 0.35 0.00 0.00 39.48 40.44 2wgg n PHE 275 CO 0.00 0.00 0.00 -1.58 -0.76 0.00 0.00 176.76 174.42 2wgg s HIS 276 N -1.90 -0.17 0.29 -5.13 2.46 -1.26 -5.06 115.29 104.53 2wgg s HIS 276 Ca 0.00 0.17 0.05 0.00 0.47 0.00 0.00 55.06 55.75 2wgg s HIS 276 Cb 0.00 0.11 0.45 0.00 -0.13 0.00 0.00 32.58 33.02 2wgg s HIS 276 CO 0.00 -0.45 1.71 0.52 -2.47 0.00 0.00 174.74 174.05 2wgg h MET 277 N 3.52 0.32 0.00 2.88 2.86 -1.99 -3.37 114.93 119.15 2wgg h MET 277 Ca -0.30 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.20 2wgg h MET 277 Cb 1.19 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.84 2wgg h MET 277 CO 0.43 0.63 0.00 1.33 1.06 0.00 0.00 176.91 180.36 2wgg n VAL 278 N -4.07 0.17 -5.13 -2.22 0.24 -1.26 0.65 118.33 106.71 2wgg n VAL 278 Ca -0.01 -0.25 -0.29 0.00 -2.04 0.00 0.00 64.34 61.74 2wgg n VAL 278 Cb 0.45 1.23 -0.16 0.00 -1.47 0.00 0.00 33.84 33.89 2wgg n VAL 278 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wgg s ALA 279 N -0.17 1.94 0.54 2.33 0.00 -1.26 -4.97 121.76 120.16 2wgg s ALA 279 Ca 0.00 -0.95 -0.18 0.00 0.00 0.00 0.00 51.96 50.83 2wgg s ALA 279 Cb 0.00 -0.57 -0.06 0.00 0.00 0.00 0.00 23.12 22.49 2wgg s ALA 279 CO 0.00 0.41 1.05 -1.25 0.00 0.00 0.00 175.76 175.97 2wgg s PRO 280 N -0.26 3.55 0.11 0.00 0.04 -1.26 -4.00 135.00 133.19 2wgg s PRO 280 Ca 0.01 1.32 -0.33 0.00 0.04 0.00 0.00 61.00 62.04 2wgg s PRO 280 Cb -0.11 -2.06 -0.12 0.00 0.04 0.00 0.00 34.50 32.24 2wgg s PRO 280 CO 0.02 -0.63 1.74 0.00 0.04 0.00 0.00 177.00 178.16 2wgg n ALA 281 N -1.46 1.78 -0.09 8.56 0.00 -1.26 -4.86 120.51 123.17 2wgg n ALA 281 Ca 0.09 0.37 0.14 0.00 0.00 0.00 0.00 53.44 54.04 2wgg n ALA 281 Cb 0.52 -2.48 0.53 0.00 0.00 0.00 0.00 19.45 18.02 2wgg n ALA 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wgg h ALA 282 N 7.51 2.13 0.00 0.00 0.00 -1.94 -2.75 119.26 124.22 2wgg h ALA 282 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2wgg h ALA 282 Cb 1.24 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2wgg h ALA 282 CO 0.93 -0.29 0.00 0.38 0.00 0.00 0.00 179.25 180.27 2wgg h ASP 283 N 0.34 0.00 -1.69 0.00 3.04 -1.89 -3.40 116.42 112.82 2wgg h ASP 283 Ca 0.30 0.00 -0.41 0.00 -3.24 0.00 0.00 57.03 53.68 2wgg h ASP 283 Cb 0.72 0.00 -0.11 0.00 -1.04 0.00 0.00 39.33 38.90 2wgg h ASP 283 CO -0.08 0.00 -0.43 0.61 -2.04 0.00 0.00 179.24 177.30 2wgg n GLY 284 N 1.20 1.04 0.09 7.15 0.00 -1.04 -4.46 105.19 109.17 2wgg n GLY 284 Ca 0.05 -0.04 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 2wgg n GLY 284 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wgg h VAL 285 N 0.00 1.24 -0.55 1.61 2.07 -1.88 0.60 116.25 119.34 2wgg h VAL 285 Ca -0.44 -1.37 -0.10 0.00 0.82 0.00 0.00 66.70 65.61 2wgg h VAL 285 Cb 1.33 2.09 -0.02 0.00 -1.52 0.00 0.00 31.29 33.17 2wgg h VAL 285 CO 0.59 0.32 -0.04 0.03 0.02 0.00 0.00 177.57 178.49 2wgg h ARG 286 N -0.74 0.97 0.22 1.57 2.47 -1.90 -0.11 114.38 116.86 2wgg h ARG 286 Ca -0.01 -0.32 -0.00 0.00 -1.26 0.00 0.00 59.98 58.39 2wgg h ARG 286 Cb 0.60 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 28.83 2wgg h ARG 286 CO 0.01 0.98 -0.16 0.00 0.56 0.00 0.00 179.97 181.37 2wgg h ALA 287 N 1.06 -0.36 -0.90 0.04 0.00 -1.91 -1.36 119.26 115.82 2wgg h ALA 287 Ca 0.15 -0.06 0.16 0.00 0.00 0.00 0.00 54.91 55.16 2wgg h ALA 287 Cb 0.58 0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.51 2wgg h ALA 287 CO 0.03 -0.72 0.58 0.78 0.00 0.00 0.00 179.25 179.93 2wgg h GLY 288 N -0.38 1.18 1.94 0.00 0.00 -0.72 -2.09 103.07 102.99 2wgg h GLY 288 Ca -0.01 -0.28 -0.10 0.00 0.00 0.00 0.00 47.33 46.94 2wgg h GLY 288 CO -0.00 0.05 -0.43 -0.09 0.00 0.00 0.00 176.54 176.07 2wgg h ARG 289 N 0.63 0.06 -0.55 4.80 9.65 -0.39 -1.85 114.38 126.72 2wgg h ARG 289 Ca 0.46 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.32 2wgg h ARG 289 Cb 0.85 -0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.40 2wgg h ARG 289 CO -0.22 0.49 0.36 0.00 2.80 0.00 0.00 179.97 183.40 2wgg h ALA 290 N 1.51 0.70 -0.51 2.80 0.00 -0.55 -0.59 119.26 122.62 2wgg h ALA 290 Ca 0.00 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.91 2wgg h ALA 290 Cb 0.79 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 2wgg h ALA 290 CO 0.06 0.15 0.26 0.52 0.00 0.00 0.00 179.25 180.24 2wgg h MET 291 N 0.75 0.50 -0.43 0.00 2.86 -1.32 -2.22 114.93 115.07 2wgg h MET 291 Ca 0.20 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.75 2wgg h MET 291 Cb -0.08 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.45 2wgg h MET 291 CO -0.04 0.33 -0.01 1.15 1.06 0.00 0.00 176.91 179.40 2wgg h THR 292 N 0.51 1.23 -0.62 2.22 2.02 -1.07 -2.43 112.91 114.77 2wgg h THR 292 Ca 0.22 -0.95 -0.09 0.00 0.77 0.00 0.00 66.41 66.37 2wgg h THR 292 Cb 0.13 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 2wgg h THR 292 CO -0.15 0.33 0.02 -0.09 0.37 0.00 0.00 175.52 175.99 2wgg h ARG 293 N 0.66 1.07 -0.67 6.66 9.65 -0.82 0.18 114.38 131.10 2wgg h ARG 293 Ca 0.13 -0.33 -0.06 0.00 -1.10 0.00 0.00 59.98 58.62 2wgg h ARG 293 Cb 0.42 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.87 2wgg h ARG 293 CO 0.02 1.03 0.19 0.66 2.80 0.00 0.00 179.97 184.67 2wgg h SER 294 N 0.98 0.97 0.01 -3.80 4.64 -1.19 -1.53 113.55 113.64 2wgg h SER 294 Ca 0.18 -0.18 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wgg h SER 294 Cb 0.54 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 2wgg h SER 294 CO 0.03 0.92 -0.01 -0.07 -0.87 0.00 0.00 176.83 176.83 2wgg h LEU 295 N 1.00 -0.02 -0.18 5.97 3.38 -1.04 -0.95 115.31 123.47 2wgg h LEU 295 Ca 0.22 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 58.00 2wgg h LEU 295 Cb 0.31 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.99 2wgg h LEU 295 CO -0.00 0.22 -0.46 -0.33 0.09 0.00 0.00 178.44 177.96 2wgg h GLU 296 N -0.26 -0.47 0.00 1.13 5.08 -0.52 0.25 114.58 119.80 2wgg h GLU 296 Ca -0.00 0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2wgg h GLU 296 Cb 0.25 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 2wgg h GLU 296 CO 0.00 -0.31 -0.12 -0.07 -1.00 0.00 0.00 179.01 177.51 2wgg h LEU 297 N -0.49 0.00 -0.21 1.33 3.38 -1.25 -1.56 115.31 116.52 2wgg h LEU 297 Ca 0.07 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.84 2wgg h LEU 297 Cb 0.64 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2wgg h LEU 297 CO -0.44 0.12 -0.93 0.00 0.09 0.00 0.00 178.44 177.28 2wgg h ALA 298 N 1.88 0.45 0.00 1.53 0.00 -0.41 -1.53 119.26 121.17 2wgg h ALA 298 Ca -0.00 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.15 2wgg h ALA 298 Cb 0.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2wgg h ALA 298 CO 0.02 0.95 0.00 0.41 0.00 0.00 0.00 179.25 180.62 2wgg n GLY 299 N 0.99 1.31 3.73 0.00 0.00 0.73 -2.14 105.19 109.81 2wgg n GLY 299 Ca -0.04 -0.34 -0.23 0.00 0.00 0.00 0.00 46.02 45.41 2wgg n GLY 299 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wgg s LEU 300 N 0.00 3.37 0.28 0.99 1.43 -0.22 -4.87 118.68 119.66 2wgg s LEU 300 Ca 0.00 -0.61 0.06 0.00 -1.03 0.00 0.00 54.13 52.55 2wgg s LEU 300 Cb 0.00 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 2wgg s LEU 300 CO 0.00 -0.16 0.34 -0.94 0.23 0.00 0.00 176.35 175.82 2wgg s SER 301 N -3.80 5.91 0.48 2.29 1.04 -1.26 -4.43 113.70 113.93 2wgg s SER 301 Ca 0.35 -0.14 0.22 0.00 0.48 0.00 0.00 55.95 56.86 2wgg s SER 301 Cb -0.05 -1.49 1.24 0.00 0.10 0.00 0.00 66.02 65.82 2wgg s SER 301 CO 0.23 -0.18 1.93 -0.65 0.98 0.00 0.00 173.24 175.54 2wgg h PRO 302 N 1.19 0.20 0.00 4.02 0.11 -1.87 -2.39 132.00 133.27 2wgg h PRO 302 Ca -0.49 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 2wgg h PRO 302 Cb 1.24 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2wgg h PRO 302 CO 0.59 0.13 -0.23 0.00 -0.21 0.00 0.00 178.00 178.28 2wgg h ALA 303 N 1.65 1.13 0.00 -0.75 0.00 -1.94 -2.70 119.26 116.66 2wgg h ALA 303 Ca 0.36 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2wgg h ALA 303 Cb 1.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2wgg h ALA 303 CO -0.07 0.29 0.00 -0.44 0.00 0.00 0.00 179.25 179.03 2wgg h ASP 304 N 0.00 0.00 -3.48 0.00 3.32 -1.82 -3.43 116.42 111.00 2wgg h ASP 304 Ca -0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 2wgg h ASP 304 Cb 0.63 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.08 2wgg h ASP 304 CO 0.03 0.00 0.70 -0.63 -1.72 0.00 0.00 179.24 177.62 2wgg s ILE 305 N -3.51 4.33 -0.13 0.35 -1.09 -1.02 -4.25 121.20 115.89 2wgg s ILE 305 Ca 0.02 0.73 0.16 0.00 -2.23 0.00 0.00 60.65 59.34 2wgg s ILE 305 Cb 0.09 -4.54 -0.08 0.00 -1.58 0.00 0.00 42.46 36.35 2wgg s ILE 305 CO 0.47 -1.02 0.99 0.44 -1.23 0.00 0.00 174.94 174.59 2wgg h ASP 306 N 9.24 0.00 -3.63 3.58 3.32 -1.55 -3.38 116.42 123.99 2wgg h ASP 306 Ca -0.25 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.59 2wgg h ASP 306 Cb 1.07 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.33 2wgg h ASP 306 CO 1.08 0.55 -0.59 -2.28 -1.72 0.00 0.00 179.24 176.29 2wgg s HIS 307 N -2.94 -0.14 -0.20 4.55 5.04 -1.15 -2.28 115.29 118.15 2wgg s HIS 307 Ca -0.01 0.39 -0.01 0.00 -1.54 0.00 0.00 55.06 53.89 2wgg s HIS 307 Cb 0.08 -0.01 0.01 0.00 0.04 0.00 0.00 32.58 32.71 2wgg s HIS 307 CO 0.79 -0.11 -0.13 0.08 -2.34 0.00 0.00 174.74 173.03 2wgg s VAL 308 N 0.54 2.56 -0.63 0.89 1.01 -0.88 -0.63 120.40 123.27 2wgg s VAL 308 Ca -0.04 -0.83 -0.24 0.00 0.00 0.00 0.00 61.98 60.87 2wgg s VAL 308 Cb -0.05 -2.15 0.05 0.00 0.00 0.00 0.00 36.38 34.22 2wgg s VAL 308 CO -0.02 0.45 1.02 0.21 0.00 0.00 0.00 175.10 176.75 2wgg s ASN 309 N 1.35 6.25 0.28 3.32 3.84 0.92 -2.16 114.94 128.74 2wgg s ASN 309 Ca 0.04 -0.61 -0.29 0.00 0.21 0.00 0.00 52.86 52.22 2wgg s ASN 309 Cb -0.14 -2.46 -0.09 0.00 -0.55 0.00 0.00 41.25 38.01 2wgg s ASN 309 CO -0.09 -1.43 1.00 0.00 -2.79 0.00 0.00 177.10 173.79 2wgg s ALA 310 N 4.35 3.32 0.30 1.71 0.00 0.32 -1.47 121.76 130.29 2wgg s ALA 310 Ca 0.28 0.69 -0.01 0.00 0.00 0.00 0.00 51.96 52.93 2wgg s ALA 310 Cb -0.13 -3.25 0.47 0.00 0.00 0.00 0.00 23.12 20.21 2wgg s ALA 310 CO 0.15 0.06 1.95 1.25 0.00 0.00 0.00 175.76 179.18 2wgg h HIS 311 N 3.78 1.03 -4.50 0.00 2.76 -1.86 -3.41 115.15 112.95 2wgg h HIS 311 Ca -0.46 0.03 -0.16 0.00 -2.20 0.00 0.00 60.37 57.57 2wgg h HIS 311 Cb 1.20 -0.35 0.00 0.00 1.55 0.00 0.00 27.41 29.82 2wgg h HIS 311 CO 0.60 0.62 -0.43 0.41 -1.30 0.00 0.00 177.93 177.83 2wgg n GLY 312 N -1.41 -0.16 0.17 5.26 0.00 -1.26 -4.80 105.19 102.99 2wgg n GLY 312 Ca 0.10 0.34 0.05 0.00 0.00 0.00 0.00 46.02 46.52 2wgg n GLY 312 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2wgg h THR 313 N 0.67 0.83 0.00 2.61 1.35 -1.92 -3.42 112.91 113.04 2wgg h THR 313 Ca -0.22 -1.81 0.00 0.00 -0.55 0.00 0.00 66.41 63.83 2wgg h THR 313 Cb 0.52 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 2wgg h THR 313 CO 0.11 0.41 0.00 0.00 -0.25 0.00 0.00 175.52 175.79 2wgg n ALA 314 N -2.25 0.00 -1.84 6.62 0.00 -1.26 -3.75 120.51 118.02 2wgg n ALA 314 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.07 2wgg n ALA 314 Cb 0.61 -0.18 -0.06 0.00 0.00 0.00 0.00 19.45 19.82 2wgg n ALA 314 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2wgg s THR 315 N -2.00 4.24 0.12 0.00 -4.23 -1.26 -0.37 115.64 112.14 2wgg s THR 315 Ca 0.00 1.80 -0.30 0.00 -1.18 0.00 0.00 61.69 62.01 2wgg s THR 315 Cb 0.00 -4.09 -0.09 0.00 1.34 0.00 0.00 72.50 69.66 2wgg s THR 315 CO 0.00 0.29 1.59 -0.65 -0.54 0.00 0.00 174.62 175.31 2wgg h PRO 316 N 3.60 -0.58 -0.29 3.99 0.11 -1.93 -2.00 132.00 134.91 2wgg h PRO 316 Ca -0.46 0.04 -0.12 0.00 0.11 0.00 0.00 66.00 65.56 2wgg h PRO 316 Cb 1.20 0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 2wgg h PRO 316 CO 0.66 -0.38 -0.33 -0.84 -0.21 0.00 0.00 178.00 176.90 2wgg h ILE 317 N -0.60 1.28 0.03 4.15 3.07 -1.99 -3.14 117.51 120.31 2wgg h ILE 317 Ca 0.04 -1.45 -0.00 0.00 1.55 0.00 0.00 64.86 65.00 2wgg h ILE 317 Cb 0.66 1.42 0.00 0.00 -0.27 0.00 0.00 36.82 38.63 2wgg h ILE 317 CO -0.29 0.47 -0.02 1.23 -1.05 0.00 0.00 178.15 178.49 2wgg h GLY 318 N 1.02 -0.05 1.02 0.16 0.00 -1.93 -2.22 103.07 101.08 2wgg h GLY 318 Ca 0.06 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 2wgg h GLY 318 CO 0.07 -0.02 0.48 -0.55 0.00 0.00 0.00 176.54 176.53 2wgg h ASP 319 N -0.22 1.06 -0.14 0.19 5.19 -1.46 -2.59 116.42 118.44 2wgg h ASP 319 Ca -0.00 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 2wgg h ASP 319 Cb 0.21 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.44 2wgg h ASP 319 CO 0.01 0.84 0.09 0.00 -3.12 0.00 0.00 179.24 177.06 2wgg h ALA 320 N 1.26 0.18 -0.53 3.45 0.00 -1.49 -2.04 119.26 120.09 2wgg h ALA 320 Ca 0.30 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.20 2wgg h ALA 320 Cb 0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2wgg h ALA 320 CO -0.05 -0.33 0.34 0.00 0.00 0.00 0.00 179.25 179.22 2wgg h ALA 321 N 1.04 0.67 -0.23 0.00 0.00 -1.31 -2.50 119.26 116.93 2wgg h ALA 321 Ca 0.05 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2wgg h ALA 321 Cb -0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2wgg h ALA 321 CO -0.01 0.10 -0.13 1.49 0.00 0.00 0.00 179.25 180.70 2wgg h GLU 322 N 0.70 0.37 -0.22 0.00 4.81 -1.35 0.76 114.58 119.65 2wgg h GLU 322 Ca 0.20 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 2wgg h GLU 322 Cb -0.06 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 2wgg h GLU 322 CO -0.05 0.51 0.07 0.00 -0.73 0.00 0.00 179.01 178.80 2wgg h ALA 323 N 1.52 0.29 -0.90 2.92 0.00 -1.18 0.07 119.26 121.99 2wgg h ALA 323 Ca 0.07 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.89 2wgg h ALA 323 Cb 0.44 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 2wgg h ALA 323 CO 0.03 -0.08 0.59 -0.91 0.00 0.00 0.00 179.25 178.88 2wgg h ASN 324 N 0.19 0.91 -0.63 0.00 2.35 -1.08 -1.71 115.58 115.60 2wgg h ASN 324 Ca 0.07 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.74 2wgg h ASN 324 Cb 0.24 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 2wgg h ASN 324 CO -0.00 0.59 0.04 0.00 -1.65 0.00 0.00 177.43 176.42 2wgg h ALA 325 N 1.50 0.85 -0.73 -0.83 0.00 -0.45 0.13 119.26 119.73 2wgg h ALA 325 Ca 0.38 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2wgg h ALA 325 Cb 0.17 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2wgg h ALA 325 CO -0.14 0.66 0.32 0.82 0.00 0.00 0.00 179.25 180.91 2wgg h ILE 326 N 1.00 1.25 0.11 0.00 2.04 -0.56 -1.80 117.51 119.54 2wgg h ILE 326 Ca 0.19 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 2wgg h ILE 326 Cb 0.51 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 2wgg h ILE 326 CO 0.02 0.30 -0.05 0.03 0.00 0.00 0.00 178.15 178.46 2wgg h ARG 327 N 1.04 -0.14 -0.78 2.37 3.08 -1.15 -0.61 114.38 118.20 2wgg h ARG 327 Ca 0.25 0.01 0.17 0.00 0.07 0.00 0.00 59.98 60.48 2wgg h ARG 327 Cb 0.18 0.03 -0.11 0.00 0.08 0.00 0.00 29.97 30.15 2wgg h ARG 327 CO -0.02 -0.04 0.25 0.28 -1.07 0.00 0.00 179.97 179.36 2wgg h VAL 328 N -0.20 0.53 0.00 2.04 2.07 -0.87 -1.41 116.25 118.41 2wgg h VAL 328 Ca -0.01 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.39 2wgg h VAL 328 Cb 0.16 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 2wgg h VAL 328 CO 0.02 0.06 0.00 0.00 0.02 0.00 0.00 177.57 177.68 2wgg n ALA 329 N -2.60 2.58 -1.33 1.67 0.00 -0.69 -4.87 120.51 115.27 2wgg n ALA 329 Ca 0.16 -0.14 -0.06 0.00 0.00 0.00 0.00 53.44 53.39 2wgg n ALA 329 Cb 0.49 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.55 2wgg n ALA 329 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wgg n GLY 330 N 0.78 0.76 0.72 0.00 0.00 -0.53 -4.71 105.19 102.21 2wgg n GLY 330 Ca 0.17 -0.74 0.06 0.00 0.00 0.00 0.00 46.02 45.51 2wgg n GLY 330 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wgg n ASP 332 N 0.44 0.00 0.06 0.00 5.75 -1.21 -1.28 116.55 120.31 2wgg n ASP 332 Ca 0.14 -0.71 0.12 0.00 -0.01 0.00 0.00 54.79 54.33 2wgg n ASP 332 Cb 0.51 -0.02 0.26 0.00 -1.03 0.00 0.00 41.12 40.84 2wgg n ASP 332 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2wgg n GLN 333 N -1.02 0.23 -1.84 0.11 1.13 -1.26 -4.50 117.38 110.23 2wgg n GLN 333 Ca 0.18 0.10 -0.37 0.00 -1.94 0.00 0.00 57.00 54.97 2wgg n GLN 333 Cb 0.09 -1.67 0.05 0.00 0.11 0.00 0.00 30.24 28.82 2wgg n GLN 333 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2wgg s ALA 334 N -3.12 2.45 0.06 -1.58 0.00 -0.40 -4.96 121.76 114.21 2wgg s ALA 334 Ca 0.08 1.15 -0.30 0.00 0.00 0.00 0.00 51.96 52.89 2wgg s ALA 334 Cb 0.14 -3.52 -0.05 0.00 0.00 0.00 0.00 23.12 19.70 2wgg s ALA 334 CO 0.68 -1.43 1.02 0.00 0.00 0.00 0.00 175.76 176.03 2wgg s ALA 335 N -1.46 3.24 -0.13 0.00 0.00 -0.97 -4.33 121.76 118.11 2wgg s ALA 335 Ca 0.80 0.63 -0.02 0.00 0.00 0.00 0.00 51.96 53.37 2wgg s ALA 335 Cb -0.35 -3.34 -0.03 0.00 0.00 0.00 0.00 23.12 19.40 2wgg s ALA 335 CO 0.37 -0.21 -0.05 0.08 0.00 0.00 0.00 175.76 175.96 2wgg s VAL 336 N 0.63 3.82 -0.04 0.00 1.01 0.54 -2.07 120.40 124.29 2wgg s VAL 336 Ca 0.52 -0.39 0.05 0.00 0.00 0.00 0.00 61.98 62.15 2wgg s VAL 336 Cb -0.24 -2.65 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 2wgg s VAL 336 CO 0.29 0.52 -0.18 -0.47 0.00 0.00 0.00 175.10 175.26 2wgg s TYR 337 N 0.07 2.58 -0.55 5.22 5.04 -0.92 -1.06 117.35 127.73 2wgg s TYR 337 Ca -0.01 -0.27 0.04 0.00 -2.44 0.00 0.00 57.07 54.39 2wgg s TYR 337 Cb -0.14 -1.59 0.14 0.00 0.35 0.00 0.00 41.96 40.72 2wgg s TYR 337 CO 0.03 0.10 0.31 0.00 -1.34 0.00 0.00 175.55 174.65 2wgg s ALA 338 N -0.65 3.30 0.46 3.97 0.00 -1.26 -0.52 121.76 127.06 2wgg s ALA 338 Ca 0.10 -3.33 0.28 0.00 0.00 0.00 0.00 51.96 49.01 2wgg s ALA 338 Cb -0.11 -2.13 1.56 0.00 0.00 0.00 0.00 23.12 22.45 2wgg s ALA 338 CO 0.00 -2.04 2.13 -1.00 0.00 0.00 0.00 175.76 174.85 2wgg h PRO 339 N 6.27 0.00 0.00 0.00 0.14 -1.89 -1.88 132.00 134.64 2wgg h PRO 339 Ca -0.02 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.12 2wgg h PRO 339 Cb 0.86 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.00 2wgg h PRO 339 CO 0.67 0.08 0.10 0.87 0.14 0.00 0.00 178.00 179.87 2wgg h LYS 340 N 0.00 0.00 0.00 0.86 1.57 -1.80 -0.10 116.57 117.10 2wgg h LYS 340 Ca -0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2wgg h LYS 340 Cb 0.24 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 2wgg h LYS 340 CO 0.01 0.00 -0.08 0.66 -0.57 0.00 0.00 179.45 179.47 2wgg h SER 341 N 0.00 0.00 0.00 0.86 4.64 -1.59 -1.70 113.55 115.76 2wgg h SER 341 Ca 0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 2wgg h SER 341 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 2wgg h SER 341 CO 0.00 0.08 -1.28 0.00 -0.87 0.00 0.00 176.83 174.76 2wgg n ALA 342 N -2.37 1.89 0.34 5.18 0.00 -0.64 -4.68 120.51 120.24 2wgg n ALA 342 Ca -0.02 -0.21 0.11 0.00 0.00 0.00 0.00 53.44 53.32 2wgg n ALA 342 Cb 0.17 0.39 -0.04 0.00 0.00 0.00 0.00 19.45 19.96 2wgg n ALA 342 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wgg n LEU 343 N -2.65 0.52 0.00 0.00 4.77 -0.14 -0.73 117.00 118.77 2wgg n LEU 343 Ca -0.09 0.03 0.06 0.00 -0.03 0.00 0.00 56.01 55.98 2wgg n LEU 343 Cb 0.59 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.61 2wgg n LEU 343 CO 0.05 -0.00 -0.08 0.61 -1.33 0.00 0.00 177.39 176.63 2wgg n GLY 344 N 1.31 -2.00 3.58 -0.72 0.00 -0.64 -4.03 105.19 102.70 2wgg n GLY 344 Ca 0.00 -1.35 -0.40 0.00 0.00 0.00 0.00 46.02 44.27 2wgg n GLY 344 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2wgg s HIS 345 N -1.13 3.23 -0.25 1.61 2.46 0.12 -4.50 115.29 116.83 2wgg s HIS 345 Ca 0.00 0.31 0.12 0.00 0.47 0.00 0.00 55.06 55.96 2wgg s HIS 345 Cb 0.00 -2.69 0.55 0.00 -0.13 0.00 0.00 32.58 30.31 2wgg s HIS 345 CO 0.00 -0.35 1.51 -1.13 -2.47 0.00 0.00 174.74 172.31 2wgg n SER 346 N 5.47 3.45 0.00 9.88 3.41 -1.19 -1.62 113.62 133.01 2wgg n SER 346 Ca -0.07 -3.36 0.00 0.00 -0.26 0.00 0.00 58.87 55.17 2wgg n SER 346 Cb 0.50 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.83 2wgg n SER 346 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2wgg n ILE 347 N -0.74 0.00 0.26 -1.33 2.08 -1.26 -1.73 119.36 116.63 2wgg n ILE 347 Ca 0.30 0.00 0.11 0.00 0.56 0.00 0.00 62.75 63.72 2wgg n ILE 347 Cb 1.05 0.00 0.74 0.00 -0.75 0.00 0.00 39.64 40.68 2wgg n ILE 347 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2wgg h GLY 348 N 0.00 0.00 1.66 7.39 0.00 -1.83 -2.59 103.07 107.69 2wgg h GLY 348 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 2wgg h GLY 348 CO 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 176.54 175.89 2wgg h ALA 349 N 1.98 0.71 -0.43 3.60 0.00 -1.45 -0.97 119.26 122.70 2wgg h ALA 349 Ca 0.01 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 2wgg h ALA 349 Cb 0.05 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2wgg h ALA 349 CO -0.00 0.47 0.08 -0.24 0.00 0.00 0.00 179.25 179.56 2wgg h VAL 350 N 0.00 1.20 0.00 0.00 3.04 -1.51 -1.31 116.25 117.68 2wgg h VAL 350 Ca -0.04 -0.74 -0.07 0.00 -1.01 0.00 0.00 66.70 64.84 2wgg h VAL 350 Cb 1.29 0.79 -0.01 0.00 -2.01 0.00 0.00 31.29 31.36 2wgg h VAL 350 CO 0.04 0.27 -0.32 1.23 -1.01 0.00 0.00 177.57 177.78 2wgg h GLY 351 N 0.87 0.00 0.86 3.17 0.00 -1.77 -0.74 103.07 105.47 2wgg h GLY 351 Ca 0.14 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.29 2wgg h GLY 351 CO 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 176.54 175.82 2wgg h ALA 352 N 1.68 0.07 0.09 3.60 0.00 -1.36 -1.44 119.26 121.89 2wgg h ALA 352 Ca -0.00 -0.61 0.01 0.00 0.00 0.00 0.00 54.91 54.31 2wgg h ALA 352 Cb 0.57 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 2wgg h ALA 352 CO 0.04 0.42 -0.50 1.25 0.00 0.00 0.00 179.25 180.46 2wgg h LEU 353 N -0.03 -1.52 -1.96 0.00 5.85 -1.28 -0.99 115.31 115.37 2wgg h LEU 353 Ca -0.09 0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2wgg h LEU 353 Cb 1.43 0.57 -0.00 0.00 0.37 0.00 0.00 40.66 43.02 2wgg h LEU 353 CO 0.14 -0.52 -0.06 -0.33 -0.34 0.00 0.00 178.44 177.33 2wgg h GLU 354 N -0.69 0.00 -0.72 1.25 5.08 -1.20 0.09 114.58 118.39 2wgg h GLU 354 Ca -0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 2wgg h GLU 354 Cb 0.71 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 2wgg h GLU 354 CO -0.29 0.06 0.19 0.77 -1.00 0.00 0.00 179.01 178.74 2wgg h SER 355 N 0.00 1.07 0.32 1.42 0.02 -0.96 -0.24 113.55 115.19 2wgg h SER 355 Ca -0.00 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 60.71 2wgg h SER 355 Cb 0.11 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.37 2wgg h SER 355 CO 0.01 1.01 -0.17 0.58 -1.14 0.00 0.00 176.83 177.12 2wgg h VAL 356 N 1.07 0.64 -0.88 2.27 2.07 0.35 -1.30 116.25 120.48 2wgg h VAL 356 Ca 0.23 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.84 2wgg h VAL 356 Cb 0.35 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.69 2wgg h VAL 356 CO -0.00 0.00 0.53 -0.07 0.02 0.00 0.00 177.57 178.05 2wgg h LEU 357 N -0.46 0.78 -0.89 2.57 3.38 -1.18 -0.54 115.31 118.97 2wgg h LEU 357 Ca -0.04 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.06 2wgg h LEU 357 Cb 0.37 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 2wgg h LEU 357 CO 0.06 0.45 0.54 0.74 0.09 0.00 0.00 178.44 180.32 2wgg h THR 358 N 0.89 0.98 0.09 0.22 2.02 -0.87 -0.89 112.91 115.34 2wgg h THR 358 Ca 0.42 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 67.27 2wgg h THR 358 Cb 0.35 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.73 2wgg h THR 358 CO -0.24 0.17 -0.04 0.58 0.37 0.00 0.00 175.52 176.36 2wgg h VAL 359 N 0.93 0.94 -0.05 3.16 2.07 0.05 -2.80 116.25 120.56 2wgg h VAL 359 Ca 0.41 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 67.80 2wgg h VAL 359 Cb 0.29 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 2wgg h VAL 359 CO -0.22 0.02 -0.10 -0.07 0.02 0.00 0.00 177.57 177.23 2wgg h LEU 360 N -0.17 0.07 -0.28 2.57 3.38 -0.78 -0.53 115.31 119.57 2wgg h LEU 360 Ca -0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2wgg h LEU 360 Cb 0.13 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2wgg h LEU 360 CO 0.02 0.18 0.15 0.74 0.09 0.00 0.00 178.44 179.62 2wgg h THR 361 N 0.08 1.13 -0.45 0.22 2.02 -1.10 -1.85 112.91 112.96 2wgg h THR 361 Ca 0.02 -0.35 -0.11 0.00 0.77 0.00 0.00 66.41 66.74 2wgg h THR 361 Cb 0.23 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 2wgg h THR 361 CO 0.01 0.13 -0.15 -0.07 0.37 0.00 0.00 175.52 175.81 2wgg h LEU 362 N 0.33 0.90 -0.14 2.58 3.38 -0.96 0.27 115.31 121.68 2wgg h LEU 362 Ca 0.10 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 2wgg h LEU 362 Cb 0.07 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2wgg h LEU 362 CO -0.01 1.08 0.09 -0.09 0.09 0.00 0.00 178.44 179.59 2wgg h ARG 363 N 0.72 0.19 -0.08 1.13 2.43 -1.16 -3.31 114.38 114.31 2wgg h ARG 363 Ca 0.11 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2wgg h ARG 363 Cb 0.70 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 2wgg h ARG 363 CO 0.05 0.16 0.00 -0.25 -1.51 0.00 0.00 179.97 178.42 2wgg n ASP 364 N -4.97 2.93 -3.87 -3.80 8.00 -0.70 -4.99 116.55 109.15 2wgg n ASP 364 Ca -0.04 -1.94 -0.27 0.00 0.71 0.00 0.00 54.79 53.25 2wgg n ASP 364 Cb 0.04 -0.03 0.02 0.00 -0.02 0.00 0.00 41.12 41.13 2wgg n ASP 364 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wgg n GLY 365 N 1.28 -0.38 3.31 0.44 0.00 0.95 -4.94 105.19 105.84 2wgg n GLY 365 Ca 0.14 0.16 -0.14 0.00 0.00 0.00 0.00 46.02 46.18 2wgg n GLY 365 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wgg s VAL 366 N -3.53 0.02 -0.19 1.61 0.11 -1.15 -1.40 120.40 115.88 2wgg s VAL 366 Ca 0.34 -0.15 -0.01 0.00 -2.93 0.00 0.00 61.98 59.23 2wgg s VAL 366 Cb -0.17 -0.63 0.00 0.00 -1.53 0.00 0.00 36.38 34.05 2wgg s VAL 366 CO 0.84 -0.08 -0.13 -0.63 -3.33 0.00 0.00 175.10 171.77 2wgg s ILE 367 N -0.37 2.70 0.99 7.04 1.01 -0.68 -4.28 121.20 127.61 2wgg s ILE 367 Ca -0.05 -0.73 -0.11 0.00 0.00 0.00 0.00 60.65 59.75 2wgg s ILE 367 Cb -0.03 -2.17 0.17 0.00 0.01 0.00 0.00 42.46 40.43 2wgg s ILE 367 CO 0.02 0.49 1.00 -2.65 0.00 0.00 0.00 174.94 173.80 2wgg n PRO 368 N 4.49 -0.92 -2.65 2.79 -0.02 -1.26 -1.59 135.00 135.84 2wgg n PRO 368 Ca -0.19 -0.21 -0.41 0.00 -2.02 0.00 0.00 63.50 60.67 2wgg n PRO 368 Cb 0.51 -2.25 -0.05 0.00 -0.02 0.00 0.00 33.50 31.69 2wgg n PRO 368 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2wgg s PRO 369 N -4.43 4.73 -0.28 0.52 0.04 -1.26 -4.73 135.00 129.59 2wgg s PRO 369 Ca 0.66 1.58 -0.29 0.00 0.04 0.00 0.00 61.00 62.99 2wgg s PRO 369 Cb -0.23 -3.29 -0.02 0.00 0.04 0.00 0.00 34.50 31.00 2wgg s PRO 369 CO 0.61 0.30 1.75 0.99 0.04 0.00 0.00 177.00 180.69 2wgg s THR 370 N -0.68 3.52 0.74 1.26 2.01 0.28 -4.93 115.64 117.84 2wgg s THR 370 Ca 0.45 0.55 -0.14 0.00 0.31 0.00 0.00 61.69 62.87 2wgg s THR 370 Cb -0.27 -3.63 0.05 0.00 0.01 0.00 0.00 72.50 68.65 2wgg s THR 370 CO 0.33 -0.36 1.15 -0.76 -0.69 0.00 0.00 174.62 174.30 2wgg s LEU 371 N 6.30 3.23 -0.89 4.42 1.43 -1.26 -3.64 118.68 128.27 2wgg s LEU 371 Ca 0.78 2.14 0.00 0.00 -1.03 0.00 0.00 54.13 56.02 2wgg s LEU 371 Cb -0.24 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.42 2wgg s LEU 371 CO 0.33 -2.16 0.00 0.59 0.23 0.00 0.00 176.35 175.34 2wgg n ASN 372 N -2.97 -5.17 -4.45 2.29 3.02 -1.26 -4.69 115.26 102.02 2wgg n ASN 372 Ca 0.12 0.21 -0.43 0.00 -0.03 0.00 0.00 54.58 54.44 2wgg n ASN 372 Cb 0.51 -3.42 -0.03 0.00 -0.61 0.00 0.00 39.78 36.23 2wgg n ASN 372 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2wgg s TYR 373 N -1.92 2.83 0.00 3.10 5.04 -1.24 -4.76 117.35 120.39 2wgg s TYR 373 Ca 0.00 -0.83 0.00 0.00 -2.44 0.00 0.00 57.07 53.80 2wgg s TYR 373 Cb 0.00 -4.27 0.00 0.00 0.35 0.00 0.00 41.96 38.04 2wgg s TYR 373 CO 0.00 -1.58 0.00 0.39 -1.34 0.00 0.00 175.55 173.02 2wgg n GLU 374 N 7.27 3.12 -3.70 4.97 1.02 -1.26 -4.86 120.64 127.20 2wgg n GLU 374 Ca 0.04 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.88 2wgg n GLU 374 Cb 0.46 -0.92 -0.15 0.00 -0.02 0.00 0.00 31.44 30.81 2wgg n GLU 374 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2wgg s THR 375 N -1.85 0.81 0.59 2.62 2.01 -1.26 -5.07 115.64 113.49 2wgg s THR 375 Ca 0.00 -1.46 -0.18 0.00 0.31 0.00 0.00 61.69 60.35 2wgg s THR 375 Cb 0.00 -1.61 -0.06 0.00 0.01 0.00 0.00 72.50 70.83 2wgg s THR 375 CO 0.00 -0.72 0.78 -2.65 -0.69 0.00 0.00 174.62 171.34 2wgg n PRO 376 N 4.73 0.73 -4.12 4.92 -0.02 -1.26 -0.64 135.00 139.34 2wgg n PRO 376 Ca -0.01 0.28 -0.35 0.00 -2.02 0.00 0.00 63.50 61.41 2wgg n PRO 376 Cb 0.41 -1.97 -0.13 0.00 -0.02 0.00 0.00 33.50 31.79 2wgg n PRO 376 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2wgg s ASP 377 N -1.22 4.60 0.56 2.55 -1.08 -1.25 -4.57 116.67 116.27 2wgg s ASP 377 Ca 0.73 -0.26 0.25 0.00 -0.52 0.00 0.00 52.55 52.74 2wgg s ASP 377 Cb -0.43 -1.78 1.61 0.00 -1.46 0.00 0.00 42.92 40.86 2wgg s ASP 377 CO 0.50 0.06 2.20 -0.65 0.52 0.00 0.00 175.17 177.80 2wgg h PRO 378 N 7.54 0.00 -0.00 4.34 0.11 -1.95 -1.68 132.00 140.36 2wgg h PRO 378 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2wgg h PRO 378 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2wgg h PRO 378 CO 0.60 0.00 -0.31 0.39 -0.21 0.00 0.00 178.00 178.47 2wgg n GLU 379 N -4.10 0.50 -0.07 1.05 -0.58 -1.26 -4.08 120.64 112.11 2wgg n GLU 379 Ca -0.02 -0.27 -0.07 0.00 -0.42 0.00 0.00 57.16 56.38 2wgg n GLU 379 Cb 0.11 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.45 2wgg n GLU 379 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2wgg h ILE 380 N 0.67 0.27 -6.44 -3.67 1.08 -1.68 -3.46 117.51 104.28 2wgg h ILE 380 Ca 0.00 -1.28 -0.46 0.00 -0.39 0.00 0.00 64.86 62.73 2wgg h ILE 380 Cb 0.48 0.59 0.04 0.00 -3.07 0.00 0.00 36.82 34.86 2wgg h ILE 380 CO 0.00 0.09 -0.93 -0.67 -0.69 0.00 0.00 178.15 175.95 2wgg n ASP 381 N -4.63 -5.09 -4.18 1.72 2.03 -1.11 -4.84 116.55 100.44 2wgg n ASP 381 Ca -0.09 -1.04 -0.16 0.00 0.52 0.00 0.00 54.79 54.02 2wgg n ASP 381 Cb 0.27 -2.80 -0.11 0.00 -0.72 0.00 0.00 41.12 37.76 2wgg n ASP 381 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2wgg s LEU 382 N -6.44 2.36 -1.27 -2.67 1.43 -1.26 -5.07 118.68 105.76 2wgg s LEU 382 Ca 0.40 -0.74 -0.19 0.00 -1.03 0.00 0.00 54.13 52.57 2wgg s LEU 382 Cb -0.17 -0.39 0.06 0.00 0.03 0.00 0.00 46.19 45.72 2wgg s LEU 382 CO 0.89 -0.19 1.72 -0.62 0.23 0.00 0.00 176.35 178.38 2wgg s ASP 383 N -2.20 6.74 -0.22 2.29 2.15 -1.26 -4.96 116.67 119.21 2wgg s ASP 383 Ca 0.03 -2.33 -0.26 0.00 0.43 0.00 0.00 52.55 50.41 2wgg s ASP 383 Cb -0.06 -2.58 -0.00 0.00 -0.30 0.00 0.00 42.92 39.98 2wgg s ASP 383 CO 0.01 -1.27 0.90 -0.69 -0.17 0.00 0.00 175.17 173.95 2wgg s VAL 384 N 4.55 4.80 0.11 1.11 1.01 -1.26 -0.34 120.40 130.37 2wgg s VAL 384 Ca 0.54 1.74 -0.31 0.00 0.00 0.00 0.00 61.98 63.95 2wgg s VAL 384 Cb 0.03 -4.19 -0.08 0.00 0.00 0.00 0.00 36.38 32.14 2wgg s VAL 384 CO 0.07 -0.08 1.47 -0.69 0.00 0.00 0.00 175.10 175.86 2wgg s VAL 385 N 2.77 3.13 0.18 2.92 1.01 -0.23 -4.91 120.40 125.28 2wgg s VAL 385 Ca 0.39 0.77 -0.18 0.00 0.00 0.00 0.00 61.98 62.96 2wgg s VAL 385 Cb -0.16 -3.50 0.04 0.00 0.00 0.00 0.00 36.38 32.77 2wgg s VAL 385 CO 0.08 0.05 0.52 0.00 0.00 0.00 0.00 175.10 175.76 2wgg s ALA 386 N 1.40 -1.09 0.00 5.51 0.00 -1.26 -0.56 121.76 125.77 2wgg s ALA 386 Ca 0.67 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.58 2wgg s ALA 386 Cb -0.38 0.83 0.00 0.00 0.00 0.00 0.00 23.12 23.56 2wgg s ALA 386 CO 0.30 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.70 2wgg n GLY 387 N -0.33 1.35 3.47 0.00 0.00 -1.26 -4.82 105.19 103.59 2wgg n GLY 387 Ca -0.12 -0.06 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 2wgg n GLY 387 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wgg s GLU 388 N 0.00 1.32 0.39 1.61 1.03 -1.26 -4.99 118.70 116.79 2wgg s GLU 388 Ca 0.00 -0.60 -0.27 0.00 0.03 0.00 0.00 54.97 54.13 2wgg s GLU 388 Cb 0.00 0.57 -0.09 0.00 -0.80 0.00 0.00 34.13 33.81 2wgg s GLU 388 CO 0.00 -0.57 1.34 -2.14 -1.33 0.00 0.00 175.26 172.56 2wgg s PRO 389 N -3.79 4.04 -0.43 -4.83 0.02 -1.26 -4.12 135.00 124.64 2wgg s PRO 389 Ca 0.03 2.25 -0.16 0.00 0.02 0.00 0.00 61.00 63.14 2wgg s PRO 389 Cb -0.01 -2.84 0.03 0.00 0.02 0.00 0.00 34.50 31.69 2wgg s PRO 389 CO -0.10 -0.46 0.39 0.50 -0.33 0.00 0.00 177.00 177.00 2wgg s ARG 390 N -2.14 3.03 0.38 5.54 3.52 -0.62 -4.93 118.95 123.73 2wgg s ARG 390 Ca 0.55 -0.94 -0.21 0.00 -0.13 0.00 0.00 55.73 55.00 2wgg s ARG 390 Cb -0.40 -4.00 -0.10 0.00 -1.56 0.00 0.00 34.95 28.89 2wgg s ARG 390 CO 0.52 -0.85 0.90 0.71 -0.81 0.00 0.00 175.30 175.78 2wgg s TYR 391 N 1.92 3.40 0.06 5.12 2.02 -1.26 -1.68 117.35 126.92 2wgg s TYR 391 Ca 0.08 1.56 -0.28 0.00 -0.37 0.00 0.00 57.07 58.07 2wgg s TYR 391 Cb -0.19 -2.80 0.09 0.00 -0.40 0.00 0.00 41.96 38.66 2wgg s TYR 391 CO 0.11 -0.00 1.06 0.20 -1.57 0.00 0.00 175.55 175.35 2wgg s GLY 392 N -2.08 -0.32 -1.24 0.71 0.00 -0.49 -4.97 107.32 98.93 2wgg s GLY 392 Ca 0.58 0.52 -0.05 0.00 0.00 0.00 0.00 44.72 45.77 2wgg s GLY 392 CO 0.16 0.12 2.15 1.34 0.00 0.00 0.00 173.10 176.87 2wgg n ASP 393 N -0.42 7.42 -4.70 1.64 2.03 -1.26 -4.49 116.55 116.77 2wgg n ASP 393 Ca -0.07 -3.27 -0.42 0.00 0.52 0.00 0.00 54.79 51.56 2wgg n ASP 393 Cb 0.61 -1.33 -0.03 0.00 -0.72 0.00 0.00 41.12 39.65 2wgg n ASP 393 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2wgg s TYR 394 N -1.69 2.99 -0.15 -0.67 2.02 -1.26 -4.91 117.35 113.67 2wgg s TYR 394 Ca 0.48 0.87 0.01 0.00 -0.37 0.00 0.00 57.07 58.05 2wgg s TYR 394 Cb 0.17 -3.67 -0.10 0.00 -0.40 0.00 0.00 41.96 37.96 2wgg s TYR 394 CO -0.08 -2.42 -0.14 0.54 -1.57 0.00 0.00 175.55 171.89 2wgg n ARG 395 N 4.84 0.38 -3.86 -0.62 1.74 -1.26 -4.65 116.66 113.23 2wgg n ARG 395 Ca 0.12 0.09 -0.13 0.00 -0.77 0.00 0.00 57.85 57.17 2wgg n ARG 395 Cb 0.43 -1.30 -0.14 0.00 -1.02 0.00 0.00 32.46 30.42 2wgg n ARG 395 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2wgg s TYR 396 N -2.31 0.02 0.07 -1.55 2.02 -1.26 -0.14 117.35 114.20 2wgg s TYR 396 Ca -0.21 0.02 0.02 0.00 -0.37 0.00 0.00 57.07 56.52 2wgg s TYR 396 Cb 0.05 -0.04 -0.03 0.00 -0.40 0.00 0.00 41.96 41.54 2wgg s TYR 396 CO 0.35 -0.01 -0.07 0.00 -1.57 0.00 0.00 175.55 174.26 2wgg s ALA 397 N 0.15 0.73 -0.12 3.71 0.00 -0.09 -1.50 121.76 124.64 2wgg s ALA 397 Ca -0.01 -1.06 0.03 0.00 0.00 0.00 0.00 51.96 50.91 2wgg s ALA 397 Cb -0.02 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.23 2wgg s ALA 397 CO -0.00 -0.15 -0.22 0.08 0.00 0.00 0.00 175.76 175.46 2wgg s VAL 398 N -2.63 2.16 -0.23 0.00 1.01 0.20 -0.51 120.40 120.40 2wgg s VAL 398 Ca 0.01 -0.96 -0.12 0.00 0.00 0.00 0.00 61.98 60.91 2wgg s VAL 398 Cb -0.01 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.46 2wgg s VAL 398 CO -0.03 0.55 0.21 0.21 0.00 0.00 0.00 175.10 176.04 2wgg s ASN 399 N 0.59 6.18 -0.11 3.32 2.47 -0.12 -0.05 114.94 127.22 2wgg s ASN 399 Ca -0.12 0.19 -0.06 0.00 0.42 0.00 0.00 52.86 53.29 2wgg s ASN 399 Cb -0.17 -2.13 -0.04 0.00 -1.45 0.00 0.00 41.25 37.47 2wgg s ASN 399 CO 0.03 0.04 0.11 0.20 -3.72 0.00 0.00 177.10 173.76 2wgg s ASN 400 N 1.06 6.11 0.00 -4.21 0.01 -0.54 -0.98 114.94 116.39 2wgg s ASN 400 Ca 0.10 0.39 0.01 0.00 -0.71 0.00 0.00 52.86 52.64 2wgg s ASN 400 Cb -0.14 -1.92 -0.00 0.00 0.41 0.00 0.00 41.25 39.60 2wgg s ASN 400 CO 0.05 0.40 -0.02 -0.44 -1.51 0.00 0.00 177.10 175.58 2wgg s SER 401 N -1.03 0.23 0.13 -1.22 0.01 0.44 -3.23 113.70 109.03 2wgg s SER 401 Ca 0.15 -0.10 0.04 0.00 1.31 0.00 0.00 55.95 57.35 2wgg s SER 401 Cb -0.12 -0.01 -0.04 0.00 0.21 0.00 0.00 66.02 66.06 2wgg s SER 401 CO 0.04 -0.02 -0.11 -0.36 0.41 0.00 0.00 173.24 173.20 2wgg s PHE 402 N -0.25 1.23 -0.01 2.43 0.08 -1.26 -0.30 117.98 119.90 2wgg s PHE 402 Ca -0.02 -0.70 -0.14 0.00 0.12 0.00 0.00 56.93 56.20 2wgg s PHE 402 Cb -0.02 -0.64 0.02 0.00 -0.57 0.00 0.00 43.02 41.81 2wgg s PHE 402 CO -0.00 0.07 0.28 0.20 -0.10 0.00 0.00 175.22 175.67 2wgg s GLY 403 N -2.86 -0.12 0.35 4.36 0.00 -0.48 -2.74 107.32 105.83 2wgg s GLY 403 Ca 0.12 0.24 -0.25 0.00 0.00 0.00 0.00 44.72 44.83 2wgg s GLY 403 CO 0.01 0.04 0.82 0.69 0.00 0.00 0.00 173.10 174.66 2wgg n PHE 404 N 1.28 0.55 0.00 1.90 3.72 -1.26 -1.68 117.46 121.97 2wgg n PHE 404 Ca -0.22 0.67 0.00 0.00 -0.05 0.00 0.00 57.45 57.85 2wgg n PHE 404 Cb 0.56 -2.14 0.00 0.00 -0.94 0.00 0.00 39.48 36.96 2wgg n PHE 404 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wgg n GLY 405 N 1.46 2.89 0.32 1.37 0.00 0.21 -4.55 105.19 106.88 2wgg n GLY 405 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2wgg n GLY 405 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wgg n GLY 406 N -1.08 1.01 3.75 -0.02 0.00 -0.83 -4.81 105.19 103.22 2wgg n GLY 406 Ca 0.00 -0.17 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 2wgg n GLY 406 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wgg s HIS 407 N -2.00 3.67 -0.15 1.61 3.76 -0.67 -1.16 115.29 120.35 2wgg s HIS 407 Ca 0.00 1.29 0.01 0.00 -0.15 0.00 0.00 55.06 56.21 2wgg s HIS 407 Cb 0.00 -2.72 0.02 0.00 1.11 0.00 0.00 32.58 30.99 2wgg s HIS 407 CO 0.00 0.27 -0.15 -0.80 -0.85 0.00 0.00 174.74 173.21 2wgg s ASN 408 N 0.08 2.73 -0.09 1.40 0.01 -0.55 -1.38 114.94 117.13 2wgg s ASN 408 Ca 0.35 -0.50 0.01 0.00 -0.71 0.00 0.00 52.86 52.00 2wgg s ASN 408 Cb -0.19 -1.21 0.02 0.00 0.41 0.00 0.00 41.25 40.28 2wgg s ASN 408 CO 0.19 -0.04 -0.11 -0.69 -1.51 0.00 0.00 177.10 174.94 2wgg s VAL 409 N 1.43 1.12 -0.06 1.60 1.01 0.59 -1.19 120.40 124.90 2wgg s VAL 409 Ca 0.04 -0.42 0.04 0.00 0.00 0.00 0.00 61.98 61.65 2wgg s VAL 409 Cb -0.13 -1.07 0.00 0.00 0.00 0.00 0.00 36.38 35.18 2wgg s VAL 409 CO -0.10 0.37 -0.19 0.00 0.00 0.00 0.00 175.10 175.18 2wgg s ALA 410 N 1.12 1.71 -0.12 5.51 0.00 -0.36 -0.42 121.76 129.21 2wgg s ALA 410 Ca -0.06 -0.74 0.02 0.00 0.00 0.00 0.00 51.96 51.18 2wgg s ALA 410 Cb -0.14 -0.62 -0.00 0.00 0.00 0.00 0.00 23.12 22.36 2wgg s ALA 410 CO -0.02 0.26 -0.20 -0.51 0.00 0.00 0.00 175.76 175.30 2wgg s LEU 411 N 0.23 2.30 -0.30 0.00 1.43 -0.15 -0.85 118.68 121.34 2wgg s LEU 411 Ca -0.10 -0.50 -0.16 0.00 -1.03 0.00 0.00 54.13 52.34 2wgg s LEU 411 Cb -0.14 -1.49 -0.03 0.00 0.03 0.00 0.00 46.19 44.56 2wgg s LEU 411 CO 0.04 0.14 0.40 0.00 0.23 0.00 0.00 176.35 177.16 2wgg s ALA 412 N 0.50 3.54 0.23 4.21 0.00 -0.47 -0.95 121.76 128.82 2wgg s ALA 412 Ca -0.13 -0.92 0.09 0.00 0.00 0.00 0.00 51.96 51.00 2wgg s ALA 412 Cb -0.17 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.11 2wgg s ALA 412 CO 0.05 -0.85 -0.03 -0.06 0.00 0.00 0.00 175.76 174.88 2wgg s PHE 413 N 2.13 2.70 0.03 0.00 0.08 0.33 -0.57 117.98 122.68 2wgg s PHE 413 Ca 0.15 -0.21 0.00 0.00 0.12 0.00 0.00 56.93 57.00 2wgg s PHE 413 Cb -0.16 -1.24 -0.03 0.00 -0.57 0.00 0.00 43.02 41.02 2wgg s PHE 413 CO 0.11 0.58 -0.04 0.20 -0.10 0.00 0.00 175.22 175.97 2wgg s GLY 414 N -3.36 0.34 0.32 4.36 0.00 0.16 -0.91 107.32 108.22 2wgg s GLY 414 Ca 0.29 -0.76 -0.29 0.00 0.00 0.00 0.00 44.72 43.96 2wgg s GLY 414 CO 0.19 -0.84 1.47 -1.60 0.00 0.00 0.00 173.10 172.32 2wgg s ARG 415 N -2.04 4.19 0.00 2.90 3.52 0.80 0.17 118.95 128.49 2wgg s ARG 415 Ca -0.10 2.46 0.28 0.00 -0.13 0.00 0.00 55.73 58.24 2wgg s ARG 415 Cb -0.06 -3.03 1.03 0.00 -1.56 0.00 0.00 34.95 31.33 2wgg s ARG 415 CO -0.03 -0.48 1.73 0.98 -0.81 0.00 0.00 175.30 176.70