#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 4.22 0.48 -1.46 1.11 -1.26 -5.00 119.66 117.74 2wgg s GLN 3 Ca 0.00 2.17 -0.23 0.00 0.01 0.00 0.00 55.36 57.30 2wgg s GLN 3 Cb 0.00 -2.95 -0.07 0.00 -1.01 0.00 0.00 33.01 28.99 2wgg s GLN 3 CO 0.00 -0.29 1.30 -2.14 0.01 0.00 0.00 175.29 174.17 2wgg s PRO 4 N -1.97 3.58 0.15 2.91 0.02 -1.26 -4.96 135.00 133.47 2wgg s PRO 4 Ca 0.52 2.10 -0.06 0.00 0.02 0.00 0.00 61.00 63.58 2wgg s PRO 4 Cb -0.39 -2.46 -0.02 0.00 0.02 0.00 0.00 34.50 31.65 2wgg s PRO 4 CO 0.51 -0.79 0.19 -1.54 -0.33 0.00 0.00 177.00 175.03 2wgg s SER 5 N -0.97 0.15 0.08 2.53 1.04 -1.26 -4.81 113.70 110.46 2wgg s SER 5 Ca 0.65 -1.01 -0.19 0.00 0.48 0.00 0.00 55.95 55.87 2wgg s SER 5 Cb -0.37 0.38 -0.09 0.00 0.10 0.00 0.00 66.02 66.04 2wgg s SER 5 CO 0.45 -0.82 1.55 0.74 0.98 0.00 0.00 173.24 176.14 2wgg h THR 6 N 2.68 1.23 -0.35 2.02 2.02 -1.32 0.03 112.91 119.22 2wgg h THR 6 Ca -0.33 -0.75 0.07 0.00 0.77 0.00 0.00 66.41 66.17 2wgg h THR 6 Cb 1.22 1.30 -0.07 0.00 -1.74 0.00 0.00 68.15 68.86 2wgg h THR 6 CO 0.53 0.23 -0.10 0.00 0.37 0.00 0.00 175.52 176.55 2wgg h ALA 7 N 0.84 0.21 -0.22 6.16 0.00 -1.66 -2.18 119.26 122.41 2wgg h ALA 7 Ca 0.07 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2wgg h ALA 7 Cb 0.32 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2wgg h ALA 7 CO 0.00 -0.47 0.00 0.27 0.00 0.00 0.00 179.25 179.05 2wgg n ASN 8 N -5.29 1.19 0.00 0.00 6.94 -1.22 -4.89 115.26 111.99 2wgg n ASN 8 Ca 0.01 -1.98 0.00 0.00 -0.02 0.00 0.00 54.58 52.59 2wgg n ASN 8 Cb 0.21 -0.15 0.00 0.00 -2.36 0.00 0.00 39.78 37.48 2wgg n ASN 8 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2wgg n GLY 9 N 0.86 1.36 0.23 4.83 0.00 -0.82 -4.86 105.19 106.78 2wgg n GLY 9 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 0.31 -4.88 -0.02 0.00 -1.22 -3.41 103.07 93.84 2wgg h GLY 10 Ca 0.00 -0.23 -0.66 0.00 0.00 0.00 0.00 47.33 46.44 2wgg h GLY 10 CO 0.00 0.21 -0.64 -1.36 0.00 0.00 0.00 176.54 174.75 2wgg s PHE 11 N -4.52 3.08 0.65 5.60 0.08 -0.88 -4.78 117.98 117.21 2wgg s PHE 11 Ca -0.05 0.08 -0.17 0.00 0.12 0.00 0.00 56.93 56.90 2wgg s PHE 11 Cb 0.15 -1.67 -0.00 0.00 -0.57 0.00 0.00 43.02 40.92 2wgg s PHE 11 CO 0.75 0.46 1.24 -1.25 -0.10 0.00 0.00 175.22 176.33 2wgg s PRO 12 N -1.59 2.56 0.06 0.24 0.04 -1.26 -4.61 135.00 130.44 2wgg s PRO 12 Ca 0.20 1.90 -0.31 0.00 0.04 0.00 0.00 61.00 62.84 2wgg s PRO 12 Cb -0.12 -1.87 -0.06 0.00 0.04 0.00 0.00 34.50 32.50 2wgg s PRO 12 CO 0.11 -1.55 1.26 0.45 0.04 0.00 0.00 177.00 177.31 2wgg s SER 13 N -1.64 7.00 -0.09 6.66 0.15 -1.26 -4.91 113.70 119.61 2wgg s SER 13 Ca 0.79 2.08 0.04 0.00 0.70 0.00 0.00 55.95 59.55 2wgg s SER 13 Cb -0.33 -2.58 -0.00 0.00 -1.71 0.00 0.00 66.02 61.40 2wgg s SER 13 CO 0.39 -0.54 -0.23 -0.69 1.20 0.00 0.00 173.24 173.38 2wgg s VAL 14 N 1.26 2.21 0.06 4.45 1.01 -1.26 -1.27 120.40 126.87 2wgg s VAL 14 Ca 0.60 -0.98 0.09 0.00 0.00 0.00 0.00 61.98 61.70 2wgg s VAL 14 Cb -0.31 -1.85 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 2wgg s VAL 14 CO 0.29 0.56 -0.24 0.68 0.00 0.00 0.00 175.10 176.38 2wgg s VAL 15 N 0.22 1.98 -0.28 2.92 -7.23 0.56 -1.46 120.40 117.13 2wgg s VAL 15 Ca -0.14 -1.41 -0.25 0.00 -1.81 0.00 0.00 61.98 58.37 2wgg s VAL 15 Cb -0.17 -1.72 0.00 0.00 0.56 0.00 0.00 36.38 35.05 2wgg s VAL 15 CO 0.07 0.24 0.85 -0.69 -0.31 0.00 0.00 175.10 175.27 2wgg s VAL 16 N -0.87 4.77 -0.39 1.32 1.01 0.18 -2.11 120.40 124.30 2wgg s VAL 16 Ca 0.10 1.46 0.10 0.00 0.00 0.00 0.00 61.98 63.64 2wgg s VAL 16 Cb -0.10 -4.18 -0.12 0.00 0.00 0.00 0.00 36.38 31.99 2wgg s VAL 16 CO 0.03 -0.20 0.39 0.35 0.00 0.00 0.00 175.10 175.67 2wgg n THR 17 N 5.45 0.00 -3.52 3.92 -2.24 -0.31 0.67 114.28 118.24 2wgg n THR 17 Ca 0.06 -0.26 -0.17 0.00 -2.27 0.00 0.00 64.05 61.41 2wgg n THR 17 Cb 0.48 0.87 -0.06 0.00 -2.10 0.00 0.00 70.33 69.51 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 -2.09 -1.78 0.03 6.98 0.00 -1.23 -4.79 121.76 118.88 2wgg s ALA 18 Ca 0.02 1.33 -0.00 0.00 0.00 0.00 0.00 51.96 53.31 2wgg s ALA 18 Cb 0.07 -0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.13 2wgg s ALA 18 CO 0.42 -0.37 -0.03 0.14 0.00 0.00 0.00 175.76 175.92 2wgg s VAL 19 N -1.22 0.14 -0.04 0.00 -7.23 -1.26 -0.81 120.40 109.98 2wgg s VAL 19 Ca -0.10 -1.16 -0.12 0.00 -1.81 0.00 0.00 61.98 58.78 2wgg s VAL 19 Cb -0.00 -0.62 0.02 0.00 0.56 0.00 0.00 36.38 36.34 2wgg s VAL 19 CO 0.09 -0.64 0.27 0.28 -0.31 0.00 0.00 175.10 174.79 2wgg s THR 20 N -2.16 0.04 -0.03 5.32 -1.32 -0.30 -4.90 115.64 112.29 2wgg s THR 20 Ca -0.09 -0.36 -0.26 0.00 -1.21 0.00 0.00 61.69 59.77 2wgg s THR 20 Cb -0.05 -0.52 0.06 0.00 -1.51 0.00 0.00 72.50 70.48 2wgg s THR 20 CO -0.04 -0.20 0.56 0.00 -2.21 0.00 0.00 174.62 172.74 2wgg s ALA 21 N -0.86 -1.45 0.01 11.08 0.00 -1.26 -1.28 121.76 128.00 2wgg s ALA 21 Ca -0.09 0.97 0.07 0.00 0.00 0.00 0.00 51.96 52.91 2wgg s ALA 21 Cb -0.05 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 23.11 2wgg s ALA 21 CO 0.03 -0.35 -0.22 -0.08 0.00 0.00 0.00 175.76 175.13 2wgg s THR 22 N -1.35 2.42 0.21 0.00 -1.32 -0.47 -3.73 115.64 111.40 2wgg s THR 22 Ca -0.11 -1.14 -0.10 0.00 -1.21 0.00 0.00 61.69 59.13 2wgg s THR 22 Cb -0.02 -1.93 -0.01 0.00 -1.51 0.00 0.00 72.50 69.03 2wgg s THR 22 CO 0.07 0.47 0.35 -0.89 -2.21 0.00 0.00 174.62 172.41 2wgg s THR 23 N -0.76 0.02 -0.57 5.08 2.01 -0.62 -2.01 115.64 118.80 2wgg s THR 23 Ca 0.12 -1.49 0.23 0.00 0.31 0.00 0.00 61.69 60.86 2wgg s THR 23 Cb -0.10 -2.12 0.24 0.00 0.01 0.00 0.00 72.50 70.53 2wgg s THR 23 CO 0.02 -0.10 1.69 -1.54 -0.69 0.00 0.00 174.62 174.00 2wgg n SER 24 N -0.30 0.60 -0.05 3.53 3.41 -1.22 -1.02 113.62 118.57 2wgg n SER 24 Ca -0.03 0.64 -0.22 0.00 -0.26 0.00 0.00 58.87 59.00 2wgg n SER 24 Cb 0.63 -0.77 -0.13 0.00 -0.26 0.00 0.00 64.21 63.68 2wgg n SER 24 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2wgg n ILE 25 N -2.15 1.67 -3.49 -1.33 5.41 -1.26 -3.83 119.36 114.37 2wgg n ILE 25 Ca 0.03 -0.47 -0.14 0.00 1.00 0.00 0.00 62.75 63.16 2wgg n ILE 25 Cb 0.24 -1.78 -0.04 0.00 -0.71 0.00 0.00 39.64 37.35 2wgg n ILE 25 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2wgg s SER 26 N -6.96 -0.56 0.00 4.38 0.15 -1.22 -4.81 113.70 104.68 2wgg s SER 26 Ca -0.27 0.37 0.29 0.00 0.70 0.00 0.00 55.95 57.04 2wgg s SER 26 Cb 0.07 0.51 1.46 0.00 -1.71 0.00 0.00 66.02 66.35 2wgg s SER 26 CO 0.69 -0.69 2.01 -0.81 1.20 0.00 0.00 173.24 175.63 2wgg n PRO 27 N 0.35 0.39 -3.77 5.44 -0.04 -1.26 -1.58 135.00 134.53 2wgg n PRO 27 Ca -0.16 0.01 -0.37 0.00 -0.04 0.00 0.00 63.50 62.94 2wgg n PRO 27 Cb 0.60 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.44 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 -2.59 5.05 0.37 3.54 -1.08 -1.26 -4.47 116.67 116.23 2wgg s ASP 28 Ca 0.27 -0.39 0.10 0.00 -0.52 0.00 0.00 52.55 52.01 2wgg s ASP 28 Cb 0.19 -1.89 0.86 0.00 -1.46 0.00 0.00 42.92 40.62 2wgg s ASP 28 CO 0.45 -0.09 1.90 -0.29 0.52 0.00 0.00 175.17 177.66 2wgg h ILE 29 N 5.66 0.86 -0.24 4.11 6.09 -1.85 -0.16 117.51 131.98 2wgg h ILE 29 Ca -0.36 -0.22 -0.11 0.00 -1.37 0.00 0.00 64.86 62.80 2wgg h ILE 29 Cb 1.16 0.17 -0.01 0.00 0.47 0.00 0.00 36.82 38.60 2wgg h ILE 29 CO 0.59 0.12 -0.31 -0.33 -3.07 0.00 0.00 178.15 175.14 2wgg h GLU 30 N 0.64 0.50 -0.10 2.19 4.39 -1.95 -0.75 114.58 119.51 2wgg h GLU 30 Ca 0.40 -0.22 -0.20 0.00 0.34 0.00 0.00 59.36 59.69 2wgg h GLU 30 Cb 0.66 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.29 2wgg h GLU 30 CO -0.16 0.76 -0.75 0.77 -1.16 0.00 0.00 179.01 178.47 2wgg h SER 31 N 0.43 0.62 -0.13 1.42 0.02 -1.77 -1.68 113.55 112.46 2wgg h SER 31 Ca 0.05 -0.41 0.04 0.00 -0.84 0.00 0.00 61.79 60.63 2wgg h SER 31 Cb 0.76 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 63.08 2wgg h SER 31 CO 0.06 1.17 -0.11 0.74 -1.14 0.00 0.00 176.83 177.55 2wgg h THR 32 N 0.36 0.68 -0.50 -2.27 2.02 -0.91 -1.00 112.91 111.28 2wgg h THR 32 Ca -0.04 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.16 2wgg h THR 32 Cb 1.34 0.68 -0.03 0.00 -1.74 0.00 0.00 68.15 68.41 2wgg h THR 32 CO 0.14 0.00 0.31 -0.25 0.37 0.00 0.00 175.52 176.09 2wgg h TRP 33 N -0.13 0.58 -0.44 3.16 -0.00 -1.05 0.18 115.95 118.25 2wgg h TRP 33 Ca 0.08 0.02 -0.04 0.00 -0.00 0.00 0.00 58.89 58.95 2wgg h TRP 33 Cb 0.25 -0.19 -0.02 0.00 -0.00 0.00 0.00 29.16 29.20 2wgg h TRP 33 CO -0.23 0.34 0.10 0.87 -0.00 0.00 0.00 178.44 179.52 2wgg h LYS 34 N 0.62 0.70 -0.71 2.65 1.57 -1.29 -2.23 116.57 117.89 2wgg h LYS 34 Ca 0.20 -0.17 0.11 0.00 -1.87 0.00 0.00 60.65 58.91 2wgg h LYS 34 Cb -0.01 -0.09 -0.08 0.00 0.08 0.00 0.00 32.23 32.13 2wgg h LYS 34 CO -0.08 0.71 0.33 0.78 -0.57 0.00 0.00 179.45 180.62 2wgg h GLY 35 N 0.57 1.07 0.93 3.86 0.00 -0.58 -1.63 103.07 107.30 2wgg h GLY 35 Ca 0.14 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 2wgg h GLY 35 CO 0.00 0.00 0.13 1.41 0.00 0.00 0.00 176.54 178.08 2wgg h LEU 36 N 0.53 0.52 -1.25 3.11 3.38 -0.79 0.15 115.31 120.95 2wgg h LEU 36 Ca 0.37 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 2wgg h LEU 36 Cb 0.45 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 2wgg h LEU 36 CO -0.31 0.57 0.33 -0.07 0.09 0.00 0.00 178.44 179.05 2wgg h LEU 37 N 0.44 0.75 0.00 1.67 3.38 -1.18 -1.11 115.31 119.26 2wgg h LEU 37 Ca 0.12 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2wgg h LEU 37 Cb 0.23 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2wgg h LEU 37 CO -0.01 0.61 0.00 0.00 0.09 0.00 0.00 178.44 179.13 2wgg n ALA 38 N -2.44 2.27 -1.32 1.53 0.00 -0.63 -4.31 120.51 115.60 2wgg n ALA 38 Ca 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2wgg n ALA 38 Cb 0.10 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.17 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 0.57 0.57 3.83 0.00 0.00 -0.42 -5.05 105.19 104.69 2wgg n GLY 39 Ca 0.14 -0.82 -0.33 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.73 4.17 -0.04 1.61 2.02 0.47 -5.01 118.70 119.18 2wgg s GLU 40 Ca 0.00 1.04 0.06 0.00 0.02 0.00 0.00 54.97 56.09 2wgg s GLU 40 Cb 0.00 -2.21 -0.02 0.00 0.10 0.00 0.00 34.13 32.00 2wgg s GLU 40 CO 0.00 -0.03 -0.23 0.45 0.02 0.00 0.00 175.26 175.47 2wgg s SER 41 N -2.30 3.29 0.00 -0.19 0.15 -1.26 -4.63 113.70 108.76 2wgg s SER 41 Ca 0.61 -0.42 0.22 0.00 0.70 0.00 0.00 55.95 57.05 2wgg s SER 41 Cb -0.09 -0.66 0.72 0.00 -1.71 0.00 0.00 66.02 64.27 2wgg s SER 41 CO 0.16 0.29 1.54 0.61 1.20 0.00 0.00 173.24 177.04 2wgg n GLY 42 N 2.63 0.47 3.72 9.45 0.00 0.41 -4.92 105.19 116.94 2wgg n GLY 42 Ca -0.17 -0.47 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.78 5.20 0.21 -0.61 -1.09 -1.26 -4.27 121.20 117.60 2wgg s ILE 43 Ca 0.34 0.91 0.03 0.00 -2.23 0.00 0.00 60.65 59.69 2wgg s ILE 43 Cb 0.19 -3.80 -0.01 0.00 -1.58 0.00 0.00 42.46 37.26 2wgg s ILE 43 CO 0.28 0.32 0.11 0.00 -1.23 0.00 0.00 174.94 174.42 2wgg n HIS 44 N 3.76 -0.13 -2.81 3.97 1.44 -0.56 -4.01 115.22 116.90 2wgg n HIS 44 Ca -0.07 -1.49 -0.40 0.00 -2.01 0.00 0.00 57.72 53.74 2wgg n HIS 44 Cb 0.52 0.06 -0.05 0.00 0.12 0.00 0.00 29.99 30.64 2wgg n HIS 44 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2wgg s ALA 45 N -2.67 3.30 0.17 1.59 0.00 -1.26 -1.69 121.76 121.21 2wgg s ALA 45 Ca 0.16 0.51 -0.30 0.00 0.00 0.00 0.00 51.96 52.32 2wgg s ALA 45 Cb 0.01 -3.18 -0.08 0.00 0.00 0.00 0.00 23.12 19.87 2wgg s ALA 45 CO 0.11 0.06 1.26 -0.51 0.00 0.00 0.00 175.76 176.68 2wgg s LEU 46 N -0.34 4.42 0.00 0.00 1.43 -0.42 -4.87 118.68 118.91 2wgg s LEU 46 Ca 0.43 2.27 0.00 0.00 -1.03 0.00 0.00 54.13 55.80 2wgg s LEU 46 Cb -0.23 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.39 2wgg s LEU 46 CO 0.29 -0.47 0.32 -0.62 0.23 0.00 0.00 176.35 176.10 2wgg n GLU 47 N 2.87 0.83 -1.71 1.70 -0.58 -1.26 -4.95 120.64 117.54 2wgg n GLU 47 Ca 0.06 -0.32 -0.43 0.00 -0.42 0.00 0.00 57.16 56.05 2wgg n GLU 47 Cb 0.44 -0.80 -0.03 0.00 -0.57 0.00 0.00 31.44 30.48 2wgg n GLU 47 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2wgg s ASP 48 N -0.21 5.63 0.04 1.62 1.01 -1.26 -4.79 116.67 118.71 2wgg s ASP 48 Ca 0.00 1.79 0.02 0.00 0.71 0.00 0.00 52.55 55.07 2wgg s ASP 48 Cb 0.00 -2.52 0.13 0.00 1.01 0.00 0.00 42.92 41.54 2wgg s ASP 48 CO 0.00 -1.84 0.15 -0.62 0.21 0.00 0.00 175.17 173.07 2wgg n GLU 49 N 8.59 -0.01 0.07 8.23 1.02 -1.26 -0.37 120.64 136.91 2wgg n GLU 49 Ca 0.27 0.13 0.04 0.00 -0.02 0.00 0.00 57.16 57.58 2wgg n GLU 49 Cb 0.45 -0.23 0.21 0.00 -0.02 0.00 0.00 31.44 31.85 2wgg n GLU 49 CO 0.00 0.00 0.00 1.97 1.18 0.00 0.00 177.13 180.28 2wgg n PHE 50 N -3.15 0.26 -0.03 -0.32 1.16 -1.26 -1.97 117.46 112.15 2wgg n PHE 50 Ca 0.04 0.14 -0.15 0.00 -1.87 0.00 0.00 57.45 55.60 2wgg n PHE 50 Cb 0.13 -0.64 -0.08 0.00 -1.61 0.00 0.00 39.48 37.27 2wgg n PHE 50 CO 0.00 0.00 0.00 0.28 -1.87 0.00 0.00 176.76 175.17 2wgg h VAL 51 N 0.00 1.38 -0.07 1.97 2.07 -1.07 0.62 116.25 121.15 2wgg h VAL 51 Ca 0.00 -1.76 -0.13 0.00 0.82 0.00 0.00 66.70 65.63 2wgg h VAL 51 Cb 0.18 2.19 0.01 0.00 -1.52 0.00 0.00 31.29 32.15 2wgg h VAL 51 CO 0.00 0.52 -0.46 0.71 0.02 0.00 0.00 177.57 178.36 2wgg h THR 52 N 0.05 1.40 -0.88 2.57 1.35 -1.71 -1.06 112.91 114.63 2wgg h THR 52 Ca -0.02 -1.85 0.17 0.00 -0.55 0.00 0.00 66.41 64.15 2wgg h THR 52 Cb 1.06 2.34 -0.16 0.00 -1.73 0.00 0.00 68.15 69.65 2wgg h THR 52 CO 0.09 0.54 -0.26 0.50 -0.25 0.00 0.00 175.52 176.14 2wgg h LYS 53 N -0.03 -0.02 -0.02 4.72 3.64 -1.36 -2.67 116.57 120.83 2wgg h LYS 53 Ca -0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2wgg h LYS 53 Cb 1.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 2wgg h LYS 53 CO 0.09 -0.01 -0.30 0.91 -2.27 0.00 0.00 179.45 177.87 2wgg n TRP 54 N -5.54 0.00 -2.91 1.91 7.02 0.20 -5.01 117.44 113.11 2wgg n TRP 54 Ca 0.12 0.00 -0.26 0.00 -1.02 0.00 0.00 57.50 56.34 2wgg n TRP 54 Cb 0.43 0.00 0.02 0.00 -2.42 0.00 0.00 31.31 29.34 2wgg n TRP 54 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 2wgg n ASP 55 N 0.18 -3.75 -4.78 -0.99 2.03 -0.43 -4.91 116.55 103.89 2wgg n ASP 55 Ca 0.08 -0.24 -0.39 0.00 0.52 0.00 0.00 54.79 54.76 2wgg n ASP 55 Cb 0.41 -1.12 -0.06 0.00 -0.72 0.00 0.00 41.12 39.63 2wgg n ASP 55 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2wgg s LEU 56 N -2.22 4.57 0.51 -2.67 1.43 -1.05 -4.97 118.68 114.29 2wgg s LEU 56 Ca 0.22 1.53 0.30 0.00 -1.03 0.00 0.00 54.13 55.15 2wgg s LEU 56 Cb -0.02 -3.18 1.16 0.00 0.03 0.00 0.00 46.19 44.18 2wgg s LEU 56 CO 0.62 0.22 1.91 0.00 0.23 0.00 0.00 176.35 179.34 2wgg h ALA 57 N 4.45 1.01 -2.63 4.21 0.00 -1.93 -3.39 119.26 120.97 2wgg h ALA 57 Ca -0.48 -0.06 -0.68 0.00 0.00 0.00 0.00 54.91 53.70 2wgg h ALA 57 Cb 1.21 -0.01 -0.18 0.00 0.00 0.00 0.00 17.79 18.80 2wgg h ALA 57 CO 0.65 0.08 -0.38 0.08 0.00 0.00 0.00 179.25 179.68 2wgg s VAL 58 N -3.63 5.22 -0.16 0.00 1.01 -1.26 -4.81 120.40 116.78 2wgg s VAL 58 Ca 0.01 -0.16 0.17 0.00 0.00 0.00 0.00 61.98 62.00 2wgg s VAL 58 Cb 0.09 -3.80 0.35 0.00 0.00 0.00 0.00 36.38 33.02 2wgg s VAL 58 CO 0.58 -0.10 1.20 0.29 0.00 0.00 0.00 175.10 177.08 2wgg n LYS 59 N 5.25 1.53 -4.17 2.72 5.02 -1.26 -5.03 118.16 122.22 2wgg n LYS 59 Ca -0.11 -2.79 -0.14 0.00 -2.02 0.00 0.00 58.31 53.26 2wgg n LYS 59 Cb 0.49 -1.57 -0.11 0.00 -0.02 0.00 0.00 35.03 33.82 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 -2.97 0.90 0.00 -0.18 -4.36 -1.26 -1.30 121.20 112.02 2wgg s ILE 60 Ca 0.35 -1.64 0.00 0.00 -0.26 0.00 0.00 60.65 59.10 2wgg s ILE 60 Cb 0.31 -1.36 0.00 0.00 1.25 0.00 0.00 42.46 42.67 2wgg s ILE 60 CO 0.01 -0.58 0.00 0.61 0.24 0.00 0.00 174.94 175.22 2wgg n GLY 61 N 0.54 -0.66 3.06 6.27 0.00 -0.68 -4.64 105.19 109.09 2wgg n GLY 61 Ca -0.16 -1.19 -0.32 0.00 0.00 0.00 0.00 46.02 44.35 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 1.83 0.70 -0.02 0.00 -0.29 -1.49 107.32 108.04 2wgg s GLY 62 Ca 0.00 -2.19 -0.13 0.00 0.00 0.00 0.00 44.72 42.40 2wgg s GLY 62 CO 0.00 0.81 1.10 0.30 0.00 0.00 0.00 173.10 175.31 2wgg s HIS 63 N 1.03 2.64 0.32 1.90 3.76 -1.26 0.17 115.29 123.86 2wgg s HIS 63 Ca 0.02 1.55 -0.29 0.00 -0.15 0.00 0.00 55.06 56.19 2wgg s HIS 63 Cb -0.20 -3.11 -0.12 0.00 1.11 0.00 0.00 32.58 30.26 2wgg s HIS 63 CO -0.06 -1.68 1.31 1.28 -0.85 0.00 0.00 174.74 174.75 2wgg n LEU 64 N -2.80 3.49 -0.25 0.89 4.77 -1.26 -4.25 117.00 117.59 2wgg n LEU 64 Ca 0.10 1.20 -0.02 0.00 -0.03 0.00 0.00 56.01 57.25 2wgg n LEU 64 Cb 0.52 -1.48 0.10 0.00 -2.33 0.00 0.00 43.42 40.23 2wgg n LEU 64 CO 0.50 -0.47 1.13 0.50 -1.33 0.00 0.00 177.39 177.72 2wgg h LYS 65 N 2.87 0.79 -4.80 3.23 1.63 -1.18 -3.36 116.57 115.75 2wgg h LYS 65 Ca -0.46 -0.05 -0.66 0.00 -0.85 0.00 0.00 60.65 58.63 2wgg h LYS 65 Cb 1.28 -0.18 -0.38 0.00 -0.60 0.00 0.00 32.23 32.36 2wgg h LYS 65 CO 0.65 0.53 -0.79 0.34 -3.45 0.00 0.00 179.45 176.73 2wgg s ASP 66 N -5.70 4.46 0.34 4.20 2.15 -1.26 -4.99 116.67 115.88 2wgg s ASP 66 Ca -0.13 -1.51 -0.29 0.00 0.43 0.00 0.00 52.55 51.05 2wgg s ASP 66 Cb 0.16 -1.54 -0.12 0.00 -0.30 0.00 0.00 42.92 41.13 2wgg s ASP 66 CO 0.77 -0.23 1.43 -0.81 -0.17 0.00 0.00 175.17 176.16 2wgg n PRO 67 N 4.42 2.43 -0.26 4.34 -0.04 -1.26 -4.90 135.00 139.72 2wgg n PRO 67 Ca -0.11 0.86 0.04 0.00 -0.04 0.00 0.00 63.50 64.24 2wgg n PRO 67 Cb 0.42 -2.54 0.17 0.00 -0.04 0.00 0.00 33.50 31.52 2wgg n PRO 67 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2wgg h VAL 68 N 2.88 0.78 0.00 0.52 2.07 -1.99 -2.38 116.25 118.14 2wgg h VAL 68 Ca -0.48 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 66.84 2wgg h VAL 68 Cb 1.26 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2wgg h VAL 68 CO 0.67 0.11 0.00 0.47 0.02 0.00 0.00 177.57 178.84 2wgg n ASP 69 N -4.89 0.00 -0.00 0.57 8.00 -1.26 -1.51 116.55 117.46 2wgg n ASP 69 Ca 0.13 -0.73 0.14 0.00 0.71 0.00 0.00 54.79 55.05 2wgg n ASP 69 Cb 0.34 -0.00 0.64 0.00 -0.02 0.00 0.00 41.12 42.08 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 -1.00 0.01 -0.55 -2.24 3.41 -0.89 -2.80 113.62 109.55 2wgg n SER 70 Ca 0.18 0.36 0.06 0.00 -0.26 0.00 0.00 58.87 59.20 2wgg n SER 70 Cb 0.08 -0.44 0.16 0.00 -0.26 0.00 0.00 64.21 63.75 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 -1.46 0.48 -4.81 7.33 8.25 -0.57 -5.01 115.22 119.44 2wgg n HIS 71 Ca 0.08 -0.66 -0.33 0.00 -0.26 0.00 0.00 57.72 56.56 2wgg n HIS 71 Cb 0.32 -0.13 -0.16 0.00 1.12 0.00 0.00 29.99 31.14 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 -1.71 3.11 0.81 -0.41 1.00 -1.12 -5.08 119.30 115.90 2wgg s MET 72 Ca 0.26 -0.82 -0.05 0.00 0.00 0.00 0.00 55.69 55.07 2wgg s MET 72 Cb 0.18 -2.46 0.17 0.00 0.00 0.00 0.00 34.83 32.72 2wgg s MET 72 CO 0.10 0.07 1.11 0.20 0.00 0.00 0.00 175.02 176.50 2wgg s GLY 73 N 0.63 1.77 0.27 -0.03 0.00 -1.26 -4.83 107.32 103.87 2wgg s GLY 73 Ca -0.11 -1.71 -0.01 0.00 0.00 0.00 0.00 44.72 42.90 2wgg s GLY 73 CO 0.02 -1.03 1.87 3.21 0.00 0.00 0.00 173.10 177.18 2wgg h ARG 74 N -0.91 1.10 0.09 2.90 3.08 -1.99 -1.94 114.38 116.71 2wgg h ARG 74 Ca -0.37 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 59.61 2wgg h ARG 74 Cb 1.25 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 31.05 2wgg h ARG 74 CO 0.36 0.73 -0.04 1.25 -1.07 0.00 0.00 179.97 181.20 2wgg h LEU 75 N 1.13 -0.10 -0.98 3.04 7.12 -2.00 -2.24 115.31 121.29 2wgg h LEU 75 Ca 0.45 -0.09 -0.10 0.00 0.13 0.00 0.00 57.88 58.26 2wgg h LEU 75 Cb 0.24 0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 40.39 2wgg h LEU 75 CO -0.19 0.03 -0.35 0.44 -0.13 0.00 0.00 178.44 178.23 2wgg h ASP 76 N -0.23 0.30 0.51 1.25 3.32 -1.90 -1.16 116.42 118.51 2wgg h ASP 76 Ca -0.01 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 2wgg h ASP 76 Cb 0.19 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 2wgg h ASP 76 CO 0.02 0.64 -0.08 0.24 -1.72 0.00 0.00 179.24 178.35 2wgg h MET 77 N 0.25 0.00 0.03 3.56 2.86 -1.10 -2.77 114.93 117.77 2wgg h MET 77 Ca 0.03 0.00 -0.33 0.00 -2.06 0.00 0.00 59.70 57.34 2wgg h MET 77 Cb 0.75 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.36 2wgg h MET 77 CO 0.06 0.08 -1.93 -2.13 1.06 0.00 0.00 176.91 174.05 2wgg n ARG 78 N -3.37 0.68 0.00 1.72 0.63 -0.66 -4.65 116.66 111.00 2wgg n ARG 78 Ca -0.01 0.24 0.07 0.00 -0.92 0.00 0.00 57.85 57.22 2wgg n ARG 78 Cb 0.24 -1.72 -0.01 0.00 0.45 0.00 0.00 32.46 31.42 2wgg n ARG 78 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 2wgg n ARG 79 N -3.14 2.00 -4.13 -0.14 1.85 -0.53 -4.97 116.66 107.60 2wgg n ARG 79 Ca -0.25 -0.60 -0.16 0.00 -1.00 0.00 0.00 57.85 55.85 2wgg n ARG 79 Cb 1.06 -1.18 -0.12 0.00 -1.05 0.00 0.00 32.46 31.17 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 -1.77 0.67 0.90 2.89 -1.94 -1.06 -4.80 119.30 114.18 2wgg s MET 80 Ca 0.10 -0.80 -0.14 0.00 -1.71 0.00 0.00 55.69 53.14 2wgg s MET 80 Cb 0.11 -0.56 0.15 0.00 2.01 0.00 0.00 34.83 36.54 2wgg s MET 80 CO 0.38 0.12 1.26 -1.54 -0.01 0.00 0.00 175.02 175.22 2wgg s SER 81 N -1.53 3.65 0.20 3.03 1.04 -1.26 -4.80 113.70 114.03 2wgg s SER 81 Ca -0.05 0.42 -0.11 0.00 0.48 0.00 0.00 55.95 56.68 2wgg s SER 81 Cb -0.09 -0.64 0.13 0.00 0.10 0.00 0.00 66.02 65.52 2wgg s SER 81 CO 0.01 -2.40 1.87 0.22 0.98 0.00 0.00 173.24 173.91 2wgg h TYR 82 N -1.39 0.89 -0.09 5.02 3.20 -1.94 -1.87 116.97 120.79 2wgg h TYR 82 Ca -0.45 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.34 2wgg h TYR 82 Cb 1.27 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.23 2wgg h TYR 82 CO -0.60 0.57 -0.42 -0.39 -1.64 0.00 0.00 178.16 175.68 2wgg h VAL 83 N 0.95 1.31 -0.47 1.81 -1.51 -1.89 -0.18 116.25 116.27 2wgg h VAL 83 Ca 0.26 -1.52 -0.10 0.00 -1.23 0.00 0.00 66.70 64.10 2wgg h VAL 83 Cb -0.10 1.71 -0.01 0.00 -2.13 0.00 0.00 31.29 30.76 2wgg h VAL 83 CO -0.05 0.45 -0.12 1.56 -1.23 0.00 0.00 177.57 178.18 2wgg h GLN 84 N 0.17 0.91 -0.13 5.19 4.20 -1.84 0.82 115.11 124.43 2wgg h GLN 84 Ca 0.01 -0.35 -0.00 0.00 0.06 0.00 0.00 58.65 58.38 2wgg h GLN 84 Cb 0.81 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 2wgg h GLN 84 CO 0.06 1.00 0.08 0.00 -0.67 0.00 0.00 178.83 179.30 2wgg h ARG 85 N 0.75 0.18 -0.53 1.46 3.08 -1.01 0.68 114.38 118.99 2wgg h ARG 85 Ca 0.12 -0.02 0.10 0.00 0.07 0.00 0.00 59.98 60.25 2wgg h ARG 85 Cb 0.67 -0.04 -0.08 0.00 0.08 0.00 0.00 29.97 30.60 2wgg h ARG 85 CO 0.05 0.16 0.05 1.98 -1.07 0.00 0.00 179.97 181.13 2wgg h MET 86 N 0.15 0.16 -0.40 0.04 4.05 -0.93 -1.89 114.93 116.11 2wgg h MET 86 Ca 0.05 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.45 2wgg h MET 86 Cb 0.02 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.77 2wgg h MET 86 CO -0.01 0.11 0.20 0.78 0.23 0.00 0.00 176.91 178.22 2wgg h GLY 87 N 0.17 0.60 0.73 1.39 0.00 -0.48 -0.98 103.07 104.50 2wgg h GLY 87 Ca 0.27 -0.29 0.03 0.00 0.00 0.00 0.00 47.33 47.34 2wgg h GLY 87 CO -0.41 0.28 -0.05 1.70 0.00 0.00 0.00 176.54 178.06 2wgg h LYS 88 N 0.50 -0.04 0.26 4.80 3.64 -0.72 0.38 116.57 125.40 2wgg h LYS 88 Ca 0.14 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 2wgg h LYS 88 Cb 0.10 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 2wgg h LYS 88 CO -0.02 -0.03 -0.34 1.25 -2.27 0.00 0.00 179.45 178.05 2wgg h LEU 89 N -0.04 -0.94 -0.83 5.20 5.85 -1.14 -1.70 115.31 121.71 2wgg h LEU 89 Ca 0.06 0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 2wgg h LEU 89 Cb 0.13 0.33 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 2wgg h LEU 89 CO -0.13 -0.46 -0.02 -0.07 -0.34 0.00 0.00 178.44 177.42 2wgg h LEU 90 N -0.66 0.83 -0.37 2.25 3.38 -1.10 -1.66 115.31 117.98 2wgg h LEU 90 Ca -0.00 -0.22 0.06 0.00 0.09 0.00 0.00 57.88 57.81 2wgg h LEU 90 Cb 0.62 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 2wgg h LEU 90 CO -0.11 0.90 0.03 1.23 0.09 0.00 0.00 178.44 180.59 2wgg h GLY 91 N 0.98 0.40 0.93 0.83 0.00 -0.05 0.11 103.07 106.27 2wgg h GLY 91 Ca 0.15 0.01 -0.12 0.00 0.00 0.00 0.00 47.33 47.37 2wgg h GLY 91 CO 0.03 -0.06 -0.30 -1.33 0.00 0.00 0.00 176.54 174.87 2wgg h GLY 92 N 0.14 0.68 0.43 4.60 0.00 -1.14 -1.85 103.07 105.94 2wgg h GLY 92 Ca 0.18 -0.73 0.07 0.00 0.00 0.00 0.00 47.33 46.85 2wgg h GLY 92 CO -0.27 0.66 0.08 1.46 0.00 0.00 0.00 176.54 178.48 2wgg h GLN 93 N 0.33 0.21 -0.54 4.80 4.20 -1.14 -1.39 115.11 121.58 2wgg h GLN 93 Ca 0.03 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 2wgg h GLN 93 Cb 0.88 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.59 2wgg h GLN 93 CO 0.07 0.14 0.04 1.25 -0.67 0.00 0.00 178.83 179.66 2wgg h LEU 94 N 0.21 0.89 -0.00 1.46 5.85 -0.66 -1.78 115.31 121.28 2wgg h LEU 94 Ca 0.22 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 2wgg h LEU 94 Cb 0.28 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.07 2wgg h LEU 94 CO -0.29 0.96 0.00 -0.25 -0.34 0.00 0.00 178.44 178.52 2wgg h TRP 95 N 0.80 0.00 -0.64 1.25 2.91 -1.08 -1.77 115.95 117.43 2wgg h TRP 95 Ca 0.16 -0.00 0.12 0.00 1.13 0.00 0.00 58.89 60.30 2wgg h TRP 95 Cb 0.48 -0.00 -0.09 0.00 -0.51 0.00 0.00 29.16 29.03 2wgg h TRP 95 CO 0.04 0.13 0.14 1.49 -1.03 0.00 0.00 178.44 179.20 2wgg h GLU 96 N -0.12 0.26 -0.08 2.65 4.81 -1.20 -0.23 114.58 120.67 2wgg h GLU 96 Ca 0.00 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 2wgg h GLU 96 Cb 0.13 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.44 2wgg h GLU 96 CO -0.00 0.17 0.06 0.77 -0.73 0.00 0.00 179.01 179.28 2wgg h SER 97 N 0.27 0.00 -0.07 1.04 0.02 -0.85 -0.80 113.55 113.16 2wgg h SER 97 Ca 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 2wgg h SER 97 Cb 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 2wgg h SER 97 CO -0.43 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.26 2wgg n ALA 98 N -2.55 2.57 -0.87 3.77 0.00 -0.55 -4.86 120.51 118.02 2wgg n ALA 98 Ca -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2wgg n ALA 98 Cb 0.17 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.40 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 0.97 0.47 3.94 0.00 0.00 -0.31 -4.28 105.19 105.98 2wgg n GLY 99 Ca 0.16 -0.91 -0.35 0.00 0.00 0.00 0.00 46.02 44.92 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 1.65 -3.17 -4.73 1.61 7.64 -0.21 -4.86 113.62 111.55 2wgg n SER 100 Ca 0.00 -1.14 -0.37 0.00 1.01 0.00 0.00 58.87 58.37 2wgg n SER 100 Cb 0.00 -2.53 0.07 0.00 -1.01 0.00 0.00 64.21 60.74 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 -6.76 2.55 -0.42 1.43 0.04 -1.26 -4.96 135.00 125.62 2wgg s PRO 101 Ca 0.33 2.06 -0.21 0.00 0.04 0.00 0.00 61.00 63.22 2wgg s PRO 101 Cb -0.15 -1.85 0.02 0.00 0.04 0.00 0.00 34.50 32.56 2wgg s PRO 101 CO 0.92 -1.60 0.65 -1.21 0.04 0.00 0.00 177.00 175.80 2wgg s GLU 102 N -3.39 3.36 0.27 4.56 0.41 -1.26 -5.06 118.70 117.59 2wgg s GLU 102 Ca 0.82 -0.28 0.10 0.00 -0.41 0.00 0.00 54.97 55.21 2wgg s GLU 102 Cb -0.37 -3.92 -0.04 0.00 -1.78 0.00 0.00 34.13 28.01 2wgg s GLU 102 CO 0.40 -0.97 -0.03 0.14 -0.49 0.00 0.00 175.26 174.31 2wgg s VAL 103 N 2.83 3.32 -0.19 2.63 -7.23 -1.26 -5.07 120.40 115.42 2wgg s VAL 103 Ca 0.23 -1.98 -0.29 0.00 -1.81 0.00 0.00 61.98 58.14 2wgg s VAL 103 Cb -0.14 -2.77 -0.04 0.00 0.56 0.00 0.00 36.38 33.99 2wgg s VAL 103 CO 0.18 -0.38 1.75 -0.62 -0.31 0.00 0.00 175.10 175.73 2wgg s ASP 104 N -3.65 6.24 0.53 4.85 -1.08 -1.26 -4.89 116.67 117.40 2wgg s ASP 104 Ca 0.31 1.77 0.19 0.00 -0.52 0.00 0.00 52.55 54.30 2wgg s ASP 104 Cb -0.06 -2.53 1.37 0.00 -1.46 0.00 0.00 42.92 40.24 2wgg s ASP 104 CO 0.19 -1.35 2.15 -0.65 0.52 0.00 0.00 175.17 176.03 2wgg h PRO 105 N 11.42 0.00 0.00 4.34 0.10 -1.94 -1.26 132.00 144.66 2wgg h PRO 105 Ca -0.37 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.73 2wgg h PRO 105 Cb 1.18 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.28 2wgg h PRO 105 CO 0.99 0.03 0.00 -0.25 0.10 0.00 0.00 178.00 178.87 2wgg n ASP 106 N -4.31 0.00 -0.30 -2.05 8.00 -1.26 -0.70 116.55 115.92 2wgg n ASP 106 Ca -0.03 0.06 0.06 0.00 0.71 0.00 0.00 54.79 55.59 2wgg n ASP 106 Cb 0.11 -0.35 0.12 0.00 -0.02 0.00 0.00 41.12 40.99 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 -1.35 2.40 -3.92 -1.24 5.12 -0.49 -4.30 116.66 112.89 2wgg n ARG 107 Ca 0.11 -2.20 -0.35 0.00 -1.93 0.00 0.00 57.85 53.48 2wgg n ARG 107 Cb 0.25 -1.37 -0.14 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 -1.96 3.02 0.29 -1.55 5.36 -1.00 -0.21 117.98 121.94 2wgg s PHE 108 Ca 0.22 -1.20 0.10 0.00 -0.96 0.00 0.00 56.93 55.08 2wgg s PHE 108 Cb 0.18 -2.10 -0.05 0.00 -0.34 0.00 0.00 43.02 40.71 2wgg s PHE 108 CO 0.05 -0.63 -0.01 0.00 -1.46 0.00 0.00 175.22 173.17 2wgg s ALA 109 N 1.42 3.16 -0.08 11.12 0.00 -0.33 -0.79 121.76 136.25 2wgg s ALA 109 Ca 0.03 -1.76 0.02 0.00 0.00 0.00 0.00 51.96 50.25 2wgg s ALA 109 Cb -0.15 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.35 2wgg s ALA 109 CO -0.03 0.20 -0.13 0.08 0.00 0.00 0.00 175.76 175.88 2wgg s VAL 110 N -2.40 1.22 -0.24 0.00 1.01 -0.08 -1.37 120.40 118.55 2wgg s VAL 110 Ca 0.33 -0.51 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 2wgg s VAL 110 Cb -0.05 -1.12 0.07 0.00 0.00 0.00 0.00 36.38 35.29 2wgg s VAL 110 CO 0.19 0.38 0.02 -0.69 0.00 0.00 0.00 175.10 175.00 2wgg s VAL 111 N 0.77 1.03 -0.11 2.92 1.01 0.05 -0.91 120.40 125.16 2wgg s VAL 111 Ca -0.12 -1.05 -0.00 0.00 0.00 0.00 0.00 61.98 60.80 2wgg s VAL 111 Cb -0.16 -1.51 0.02 0.00 0.00 0.00 0.00 36.38 34.74 2wgg s VAL 111 CO 0.02 -0.29 -0.08 -0.69 0.00 0.00 0.00 175.10 174.06 2wgg s VAL 112 N 1.60 1.07 0.45 2.92 1.01 -0.70 -1.48 120.40 125.28 2wgg s VAL 112 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 2wgg s VAL 112 Cb -0.18 -1.07 -0.01 0.00 0.00 0.00 0.00 36.38 35.12 2wgg s VAL 112 CO -0.11 0.37 0.69 -0.83 0.00 0.00 0.00 175.10 175.22 2wgg s GLY 113 N 1.60 1.54 0.06 4.51 0.00 -0.10 -4.29 107.32 110.63 2wgg s GLY 113 Ca 0.03 -0.96 -0.26 0.00 0.00 0.00 0.00 44.72 43.53 2wgg s GLY 113 CO -0.07 -0.79 0.72 -1.08 0.00 0.00 0.00 173.10 171.87 2wgg s THR 114 N -2.58 0.00 0.04 0.90 -1.32 -1.26 -1.81 115.64 109.61 2wgg s THR 114 Ca 0.48 0.00 -0.21 0.00 -1.21 0.00 0.00 61.69 60.75 2wgg s THR 114 Cb -0.10 -1.00 -0.14 0.00 -1.51 0.00 0.00 72.50 69.75 2wgg s THR 114 CO 0.39 0.00 1.40 1.23 -2.21 0.00 0.00 174.62 175.43 2wgg h GLY 115 N 2.20 0.32 0.00 6.08 0.00 -1.82 -3.43 103.07 106.40 2wgg h GLY 115 Ca -0.28 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 46.76 2wgg h GLY 115 CO 0.36 0.26 -0.28 -0.10 0.00 0.00 0.00 176.54 176.77 2wgg n LEU 116 N -4.66 0.34 0.00 3.11 0.00 -1.26 -4.70 117.00 109.82 2wgg n LEU 116 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.95 2wgg n LEU 116 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.71 2wgg n LEU 116 CO 0.37 -0.16 0.00 0.61 0.00 0.00 0.00 177.39 178.21 2wgg n GLY 117 N 1.98 0.08 2.24 -3.96 0.00 -1.26 -4.46 105.19 99.80 2wgg n GLY 117 Ca 0.00 -2.16 -0.27 0.00 0.00 0.00 0.00 46.02 43.59 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 3.91 0.24 -0.02 0.00 -1.07 -4.72 105.19 103.53 2wgg n GLY 118 Ca 0.00 -1.51 0.08 0.00 0.00 0.00 0.00 46.02 44.59 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 3.94 1.60 0.00 4.61 0.00 -1.86 -1.84 119.26 125.70 2wgg h ALA 119 Ca 0.53 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 2wgg h ALA 119 Cb 0.81 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2wgg h ALA 119 CO 1.04 0.18 -0.05 1.05 0.00 0.00 0.00 179.25 181.47 2wgg h GLU 120 N 0.00 0.00 0.00 0.00 9.09 -1.97 -1.94 114.58 119.76 2wgg h GLU 120 Ca -0.00 0.00 -0.12 0.00 0.05 0.00 0.00 59.36 59.29 2wgg h GLU 120 Cb 0.29 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.37 2wgg h GLU 120 CO 0.02 0.05 -0.76 0.00 0.05 0.00 0.00 179.01 178.37 2wgg h ARG 121 N 0.00 0.00 0.20 1.06 2.47 -1.69 -1.95 114.38 114.47 2wgg h ARG 121 Ca -0.00 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 2wgg h ARG 121 Cb 0.15 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.47 2wgg h ARG 121 CO 0.01 0.45 -0.10 0.82 0.56 0.00 0.00 179.97 181.71 2wgg h ILE 122 N 0.00 0.83 -0.05 2.04 2.04 -1.38 -1.51 117.51 119.49 2wgg h ILE 122 Ca -0.05 -0.16 -0.14 0.00 1.00 0.00 0.00 64.86 65.51 2wgg h ILE 122 Cb 1.44 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.44 2wgg h ILE 122 CO 0.06 0.04 -0.61 -0.37 0.00 0.00 0.00 178.15 177.27 2wgg h VAL 123 N -0.35 1.40 -0.34 1.67 -1.51 -1.48 -1.63 116.25 114.01 2wgg h VAL 123 Ca -0.03 -2.02 -0.03 0.00 -1.23 0.00 0.00 66.70 63.40 2wgg h VAL 123 Cb 0.27 2.04 -0.01 0.00 -2.13 0.00 0.00 31.29 31.46 2wgg h VAL 123 CO 0.05 0.59 0.10 -0.08 -1.23 0.00 0.00 177.57 177.00 2wgg h GLU 124 N 0.12 0.53 -0.37 5.19 4.81 -1.38 -1.38 114.58 122.10 2wgg h GLU 124 Ca -0.01 -0.12 -0.06 0.00 -0.13 0.00 0.00 59.36 59.04 2wgg h GLU 124 Cb 1.10 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.39 2wgg h GLU 124 CO 0.09 0.57 -0.03 0.77 -0.73 0.00 0.00 179.01 179.67 2wgg h SER 125 N 0.39 0.57 -0.05 1.04 0.02 -1.07 -0.88 113.55 113.57 2wgg h SER 125 Ca 0.11 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2wgg h SER 125 Cb 0.26 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 2wgg h SER 125 CO -0.00 0.67 0.02 0.22 -1.14 0.00 0.00 176.83 176.60 2wgg h TYR 126 N 0.57 0.07 -0.67 3.45 5.03 -1.18 -1.72 116.97 122.51 2wgg h TYR 126 Ca 0.11 -0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.38 2wgg h TYR 126 Cb 0.41 -0.02 -0.03 0.00 1.55 0.00 0.00 36.73 38.64 2wgg h TYR 126 CO 0.02 0.17 0.24 -0.44 -1.32 0.00 0.00 178.16 176.83 2wgg h ASP 127 N -0.05 0.94 -0.25 -2.11 3.32 -0.91 -1.24 116.42 116.12 2wgg h ASP 127 Ca 0.02 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 56.87 2wgg h ASP 127 Cb 0.13 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 2wgg h ASP 127 CO -0.00 0.88 0.14 -0.07 -1.72 0.00 0.00 179.24 178.46 2wgg h LEU 128 N 0.96 0.31 -0.53 1.55 4.07 -1.14 -2.25 115.31 118.28 2wgg h LEU 128 Ca 0.22 -0.08 -0.16 0.00 0.08 0.00 0.00 57.88 57.94 2wgg h LEU 128 Cb 0.25 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 41.90 2wgg h LEU 128 CO -0.01 0.30 -0.57 -0.03 -1.08 0.00 0.00 178.44 177.05 2wgg h MET 129 N 0.30 0.49 -0.59 1.13 4.05 -1.21 -0.76 114.93 118.34 2wgg h MET 129 Ca 0.09 -0.32 -0.05 0.00 -0.28 0.00 0.00 59.70 59.14 2wgg h MET 129 Cb 0.06 0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 30.87 2wgg h MET 129 CO -0.01 0.93 0.15 -0.91 0.23 0.00 0.00 176.91 177.29 2wgg h ASN 130 N 0.37 0.84 0.72 1.39 2.35 -1.14 0.48 115.58 120.60 2wgg h ASN 130 Ca 0.00 -0.15 -0.26 0.00 -0.55 0.00 0.00 56.30 55.34 2wgg h ASN 130 Cb 1.11 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 39.23 2wgg h ASN 130 CO 0.10 0.82 -1.35 0.00 -1.65 0.00 0.00 177.43 175.35 2wgg h ALA 131 N 1.29 0.49 0.00 -0.83 0.00 -1.36 -3.42 119.26 115.43 2wgg h ALA 131 Ca 0.19 -1.15 0.00 0.00 0.00 0.00 0.00 54.91 53.96 2wgg h ALA 131 Cb 0.30 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2wgg h ALA 131 CO -0.00 1.35 0.00 0.41 0.00 0.00 0.00 179.25 181.01 2wgg n GLY 132 N 1.48 -0.31 0.00 0.00 0.00 -0.30 -5.10 105.19 100.96 2wgg n GLY 132 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.04 -0.26 0.25 -0.02 0.00 0.15 -4.53 105.19 100.75 2wgg n GLY 133 Ca 0.00 -1.84 0.05 0.00 0.00 0.00 0.00 46.02 44.23 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 0.15 0.00 1.61 0.13 -1.92 -2.35 132.00 129.62 2wgg h PRO 134 Ca 0.00 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2wgg h PRO 134 Cb 0.00 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.10 2wgg h PRO 134 CO 0.00 0.24 0.00 0.54 -0.23 0.00 0.00 178.00 178.55 2wgg n ARG 135 N -4.37 0.59 0.05 0.86 1.74 -1.26 -2.71 116.66 111.56 2wgg n ARG 135 Ca -0.01 0.02 0.12 0.00 -0.77 0.00 0.00 57.85 57.21 2wgg n ARG 135 Cb 0.20 -1.50 0.26 0.00 -1.02 0.00 0.00 32.46 30.40 2wgg n ARG 135 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2wgg n LYS 136 N -1.15 0.20 -2.58 5.56 4.76 -0.88 -4.86 118.16 119.21 2wgg n LYS 136 Ca 0.16 0.08 -0.42 0.00 -2.87 0.00 0.00 58.31 55.27 2wgg n LYS 136 Cb 0.15 -1.65 -0.03 0.00 -1.84 0.00 0.00 35.03 31.66 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 -3.11 4.33 0.36 -0.18 1.01 -1.10 -4.81 120.40 116.90 2wgg s VAL 137 Ca 0.09 1.79 -0.26 0.00 0.00 0.00 0.00 61.98 63.59 2wgg s VAL 137 Cb 0.15 -4.14 -0.09 0.00 0.00 0.00 0.00 36.38 32.29 2wgg s VAL 137 CO 0.68 0.20 1.14 -0.55 0.00 0.00 0.00 175.10 176.57 2wgg s SER 138 N 0.57 6.78 0.37 3.32 0.15 -1.26 -4.90 113.70 118.73 2wgg s SER 138 Ca 0.52 2.29 0.23 0.00 0.70 0.00 0.00 55.95 59.69 2wgg s SER 138 Cb -0.26 -2.61 1.25 0.00 -1.71 0.00 0.00 66.02 62.69 2wgg s SER 138 CO 0.30 -0.49 1.69 -0.65 1.20 0.00 0.00 173.24 175.29 2wgg h PRO 139 N 2.96 0.00 -0.02 5.44 0.11 -1.96 -1.08 132.00 137.45 2wgg h PRO 139 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2wgg h PRO 139 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2wgg h PRO 139 CO 0.64 0.00 -0.06 1.28 -0.21 0.00 0.00 178.00 179.65 2wgg n LEU 140 N -2.33 1.96 0.03 2.35 4.77 -1.26 -4.56 117.00 117.96 2wgg n LEU 140 Ca -0.02 -0.65 -0.13 0.00 -0.03 0.00 0.00 56.01 55.19 2wgg n LEU 140 Cb 0.09 -0.01 -0.08 0.00 -2.33 0.00 0.00 43.42 41.08 2wgg n LEU 140 CO 0.10 0.33 0.77 0.00 -1.33 0.00 0.00 177.39 177.26 2wgg h ALA 141 N 4.37 -0.03 -0.30 -1.18 0.00 -1.56 -2.71 119.26 117.84 2wgg h ALA 141 Ca 0.00 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.87 2wgg h ALA 141 Cb 0.68 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 2wgg h ALA 141 CO 0.00 -0.42 -0.09 0.28 0.00 0.00 0.00 179.25 179.02 2wgg h VAL 142 N -0.23 0.67 0.00 0.00 2.07 -1.80 -1.14 116.25 115.82 2wgg h VAL 142 Ca -0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2wgg h VAL 142 Cb 0.22 0.67 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 2wgg h VAL 142 CO 0.01 0.00 -0.09 0.06 0.02 0.00 0.00 177.57 177.56 2wgg h GLN 143 N -0.02 0.00 0.00 1.57 3.07 -1.86 -1.08 115.11 116.79 2wgg h GLN 143 Ca 0.15 0.00 -0.19 0.00 0.09 0.00 0.00 58.65 58.70 2wgg h GLN 143 Cb 0.25 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.78 2wgg h GLN 143 CO -0.32 0.09 -1.09 0.52 0.09 0.00 0.00 178.83 178.12 2wgg h MET 144 N 0.00 0.00 0.11 0.06 2.86 -1.14 -3.39 114.93 113.43 2wgg h MET 144 Ca -0.00 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.40 2wgg h MET 144 Cb 0.35 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.01 2wgg h MET 144 CO 0.01 0.63 -1.20 0.82 1.06 0.00 0.00 176.91 178.23 2wgg h ILE 145 N 0.00 1.18 -1.78 -1.22 2.04 -0.64 -3.31 117.51 113.79 2wgg h ILE 145 Ca -0.09 -2.43 -0.67 0.00 1.00 0.00 0.00 64.86 62.68 2wgg h ILE 145 Cb 1.68 2.84 0.05 0.00 -0.74 0.00 0.00 36.82 40.66 2wgg h ILE 145 CO 0.09 0.69 0.55 1.15 0.00 0.00 0.00 178.15 180.62 2wgg n MET 146 N -4.02 1.33 0.31 2.37 0.00 -0.46 -2.59 117.12 114.06 2wgg n MET 146 Ca -0.22 0.48 0.19 0.00 0.00 0.00 0.00 57.70 58.15 2wgg n MET 146 Cb 0.86 -2.15 1.00 0.00 0.00 0.00 0.00 33.22 32.93 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 5.01 0.00 0.00 3.17 0.11 -1.92 0.27 132.00 138.65 2wgg h PRO 147 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2wgg h PRO 147 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2wgg h PRO 147 CO 0.81 0.02 0.00 0.27 -0.21 0.00 0.00 178.00 178.89 2wgg n ASN 148 N -3.28 0.00 -0.11 -2.05 6.94 -1.26 -4.28 115.26 111.22 2wgg n ASN 148 Ca -0.02 -0.32 -0.05 0.00 -0.02 0.00 0.00 54.58 54.17 2wgg n ASN 148 Cb 0.14 -0.19 0.01 0.00 -2.36 0.00 0.00 39.78 37.39 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 4.03 0.29 0.86 4.83 0.00 -0.71 -0.08 103.07 112.28 2wgg h GLY 149 Ca 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.44 2wgg h GLY 149 CO 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 176.54 176.35 2wgg h ALA 150 N 1.37 -0.15 -0.59 3.60 0.00 -1.81 0.60 119.26 122.28 2wgg h ALA 150 Ca 0.18 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.09 2wgg h ALA 150 Cb 0.28 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.05 2wgg h ALA 150 CO -0.38 -0.51 0.19 0.00 0.00 0.00 0.00 179.25 178.56 2wgg h ALA 151 N 0.57 0.74 -0.64 0.00 0.00 -1.80 -1.46 119.26 116.68 2wgg h ALA 151 Ca -0.02 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.02 2wgg h ALA 151 Cb 0.24 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 2wgg h ALA 151 CO 0.03 -0.23 0.39 0.00 0.00 0.00 0.00 179.25 179.44 2wgg h ALA 152 N 1.42 0.83 -0.66 0.00 0.00 -0.77 0.16 119.26 120.24 2wgg h ALA 152 Ca 0.30 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2wgg h ALA 152 Cb 0.38 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2wgg h ALA 152 CO -0.32 0.13 0.41 0.28 0.00 0.00 0.00 179.25 179.75 2wgg h VAL 153 N 0.76 1.19 -0.27 0.00 2.07 -0.41 -1.49 116.25 118.09 2wgg h VAL 153 Ca 0.26 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 2wgg h VAL 153 Cb 0.03 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 2wgg h VAL 153 CO -0.11 0.19 0.07 0.40 0.02 0.00 0.00 177.57 178.14 2wgg h ILE 154 N 0.90 1.21 -0.66 4.57 2.04 -0.87 -0.54 117.51 124.16 2wgg h ILE 154 Ca 0.24 -0.70 0.04 0.00 1.00 0.00 0.00 64.86 65.44 2wgg h ILE 154 Cb -0.04 1.15 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 2wgg h ILE 154 CO -0.05 0.23 0.39 1.23 0.00 0.00 0.00 178.15 179.96 2wgg h GLY 155 N 0.27 0.96 1.01 5.37 0.00 -0.79 -0.60 103.07 109.29 2wgg h GLY 155 Ca 0.09 -0.29 -0.12 0.00 0.00 0.00 0.00 47.33 47.01 2wgg h GLY 155 CO 0.00 0.22 -0.24 -2.00 0.00 0.00 0.00 176.54 174.53 2wgg h LEU 156 N 0.76 0.82 -0.60 3.11 5.85 -1.14 0.23 115.31 124.33 2wgg h LEU 156 Ca 0.28 -0.43 0.03 0.00 0.84 0.00 0.00 57.88 58.60 2wgg h LEU 156 Cb 0.08 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 2wgg h LEU 156 CO -0.13 1.08 0.36 -0.61 -0.34 0.00 0.00 178.44 178.80 2wgg h GLN 157 N 0.57 0.69 0.00 1.25 4.15 -0.89 -3.27 115.11 117.60 2wgg h GLN 157 Ca 0.07 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.42 2wgg h GLN 157 Cb 0.80 -0.15 -0.00 0.00 0.21 0.00 0.00 27.48 28.33 2wgg h GLN 157 CO 0.06 0.45 -1.63 1.28 -1.93 0.00 0.00 178.83 177.06 2wgg n LEU 158 N -4.75 0.35 0.00 -2.39 4.77 -0.25 -5.00 117.00 109.73 2wgg n LEU 158 Ca 0.06 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 2wgg n LEU 158 Cb 0.09 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2wgg n LEU 158 CO 0.32 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 2wgg n GLY 159 N 1.26 1.62 3.64 -0.72 0.00 0.62 -5.06 105.19 106.55 2wgg n GLY 159 Ca -0.04 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.00 3.54 -0.00 4.61 0.00 -0.12 -4.57 121.76 123.21 2wgg s ALA 160 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.04 2wgg s ALA 160 Cb 0.00 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.46 2wgg s ALA 160 CO 0.00 -1.40 0.67 0.54 0.00 0.00 0.00 175.76 175.57 2wgg n ARG 161 N 6.79 0.36 -0.72 0.00 1.74 0.12 -4.61 116.66 120.34 2wgg n ARG 161 Ca 0.13 -0.84 0.04 0.00 -0.77 0.00 0.00 57.85 56.40 2wgg n ARG 161 Cb 0.47 -1.00 0.30 0.00 -1.02 0.00 0.00 32.46 31.21 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 -0.17 3.67 0.00 7.54 0.00 0.03 -4.77 120.51 126.81 2wgg n ALA 162 Ca 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 53.44 51.91 2wgg n ALA 162 Cb 0.09 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 0.40 3.85 2.97 0.00 0.00 -1.26 -4.64 105.19 106.51 2wgg n GLY 163 Ca 0.23 -1.36 -0.30 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.32 1.52 0.06 1.61 1.01 -1.26 -0.90 120.40 122.13 2wgg s VAL 164 Ca 0.00 -0.97 0.08 0.00 0.00 0.00 0.00 61.98 61.09 2wgg s VAL 164 Cb 0.00 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 2wgg s VAL 164 CO 0.00 0.12 -0.22 -0.32 0.00 0.00 0.00 175.10 174.67 2wgg s MET 165 N 1.44 1.41 -0.31 2.72 1.75 -0.09 -4.96 119.30 121.27 2wgg s MET 165 Ca -0.02 -1.06 -0.01 0.00 -1.25 0.00 0.00 55.69 53.35 2wgg s MET 165 Cb -0.16 -1.61 0.10 0.00 2.84 0.00 0.00 34.83 36.00 2wgg s MET 165 CO -0.08 0.40 0.10 0.99 -0.65 0.00 0.00 175.02 175.79 2wgg s THR 166 N -0.90 0.73 -0.02 10.11 2.01 -1.26 -1.71 115.64 124.59 2wgg s THR 166 Ca 0.09 -1.30 -0.24 0.00 0.31 0.00 0.00 61.69 60.54 2wgg s THR 166 Cb -0.09 -1.56 -0.04 0.00 0.01 0.00 0.00 72.50 70.81 2wgg s THR 166 CO 0.03 -0.69 0.74 -2.16 -0.69 0.00 0.00 174.62 171.85 2wgg s PRO 167 N 1.69 4.46 -0.24 4.92 0.04 -1.26 -4.97 135.00 139.64 2wgg s PRO 167 Ca 0.10 0.98 -0.05 0.00 0.04 0.00 0.00 61.00 62.06 2wgg s PRO 167 Cb -0.17 -3.41 -0.01 0.00 0.04 0.00 0.00 34.50 30.95 2wgg s PRO 167 CO -0.27 0.15 0.00 0.14 0.04 0.00 0.00 177.00 177.07 2wgg s VAL 168 N 0.45 3.71 -0.29 -0.36 -7.23 -1.26 -4.15 120.40 111.27 2wgg s VAL 168 Ca 0.39 -0.42 0.20 0.00 -1.81 0.00 0.00 61.98 60.33 2wgg s VAL 168 Cb -0.19 -2.73 0.49 0.00 0.56 0.00 0.00 36.38 34.51 2wgg s VAL 168 CO 0.20 0.36 1.06 -1.54 -0.31 0.00 0.00 175.10 174.87 2wgg n SER 169 N 4.84 1.82 0.00 4.85 3.41 -1.26 -4.99 113.62 122.29 2wgg n SER 169 Ca -0.17 -2.42 0.00 0.00 -0.26 0.00 0.00 58.87 56.02 2wgg n SER 169 Cb 0.51 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 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 -0.41 0.00 0.57 7.33 0.00 -1.26 -2.22 120.51 124.52 2wgg n ALA 170 Ca 0.11 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.63 2wgg n ALA 170 Cb 0.81 0.00 0.35 0.00 0.00 0.00 0.00 19.45 20.61 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 0.03 -0.13 0.00 3.00 -1.26 -1.88 117.38 131.15 2wgg n GLN 171 Ca 0.00 0.22 0.12 0.00 -0.01 0.00 0.00 57.00 57.32 2wgg n GLN 171 Cb 0.00 -1.50 0.19 0.00 0.00 0.00 0.00 30.24 28.93 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 -1.47 3.23 -0.22 1.08 3.41 -0.94 -4.34 113.62 114.37 2wgg n SER 172 Ca 0.04 -1.98 0.01 0.00 -0.26 0.00 0.00 58.87 56.68 2wgg n SER 172 Cb 0.18 -0.17 0.12 0.00 -0.26 0.00 0.00 64.21 64.08 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 4.44 0.35 -0.21 4.04 0.02 -1.46 -0.58 113.55 120.14 2wgg h SER 173 Ca 0.00 0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 2wgg h SER 173 Cb 0.97 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.51 2wgg h SER 173 CO 0.00 0.20 -0.08 1.23 -1.14 0.00 0.00 176.83 177.04 2wgg h GLY 174 N 0.50 0.62 1.39 -3.77 0.00 -1.51 -0.03 103.07 100.29 2wgg h GLY 174 Ca 0.33 -0.42 -0.23 0.00 0.00 0.00 0.00 47.33 47.00 2wgg h GLY 174 CO -0.28 0.39 -0.89 1.76 0.00 0.00 0.00 176.54 177.52 2wgg h SER 175 N 0.54 0.71 -0.21 0.19 0.02 -1.62 -3.27 113.55 109.90 2wgg h SER 175 Ca 0.10 -0.52 -0.09 0.00 -0.84 0.00 0.00 61.79 60.44 2wgg h SER 175 Cb 0.47 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 2wgg h SER 175 CO 0.03 1.31 -0.15 -0.08 -1.14 0.00 0.00 176.83 176.80 2wgg h GLU 176 N 0.35 0.62 -0.46 3.45 4.81 -0.65 -1.64 114.58 121.07 2wgg h GLU 176 Ca -0.08 -0.21 0.09 0.00 -0.13 0.00 0.00 59.36 59.03 2wgg h GLU 176 Cb 1.52 -0.05 -0.08 0.00 0.63 0.00 0.00 28.75 30.77 2wgg h GLU 176 CO 0.17 0.75 -0.01 0.00 -0.73 0.00 0.00 179.01 179.19 2wgg h ALA 177 N 1.27 0.42 -0.46 2.92 0.00 -1.08 -0.90 119.26 121.43 2wgg h ALA 177 Ca 0.10 0.14 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 2wgg h ALA 177 Cb 0.58 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2wgg h ALA 177 CO 0.04 -0.39 -0.13 0.82 0.00 0.00 0.00 179.25 179.58 2wgg h ILE 178 N 0.10 1.26 -0.20 0.00 2.04 -1.54 -1.78 117.51 117.39 2wgg h ILE 178 Ca 0.23 -1.24 0.05 0.00 1.00 0.00 0.00 64.86 64.89 2wgg h ILE 178 Cb 0.33 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.41 2wgg h ILE 178 CO -0.38 0.43 -0.14 0.00 0.00 0.00 0.00 178.15 178.05 2wgg h ALA 179 N 1.07 0.01 0.00 1.87 0.00 -0.83 -1.45 119.26 119.92 2wgg h ALA 179 Ca 0.12 0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 2wgg h ALA 179 Cb 0.65 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2wgg h ALA 179 CO 0.05 -0.57 -0.23 0.45 0.00 0.00 0.00 179.25 178.94 2wgg h HIS 180 N -0.14 0.00 -0.14 0.00 3.86 -1.02 -1.76 115.15 115.95 2wgg h HIS 180 Ca 0.12 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.18 2wgg h HIS 180 Cb 0.32 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.79 2wgg h HIS 180 CO -0.30 0.23 -0.51 0.00 0.86 0.00 0.00 177.93 178.22 2wgg h ALA 181 N 1.77 0.25 -0.42 2.45 0.00 -1.14 -0.85 119.26 121.31 2wgg h ALA 181 Ca -0.00 -0.50 0.03 0.00 0.00 0.00 0.00 54.91 54.44 2wgg h ALA 181 Cb 0.73 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 2wgg h ALA 181 CO 0.03 0.43 0.21 2.35 0.00 0.00 0.00 179.25 182.27 2wgg h TRP 182 N 0.22 0.39 -0.60 0.00 7.01 -1.09 -1.71 115.95 120.16 2wgg h TRP 182 Ca -0.02 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.02 2wgg h TRP 182 Cb 1.14 -0.11 -0.04 0.00 -2.10 0.00 0.00 29.16 28.04 2wgg h TRP 182 CO 0.10 0.20 0.36 0.00 -2.79 0.00 0.00 178.44 176.31 2wgg h ARG 183 N 0.42 0.68 -0.97 2.65 3.08 -1.25 0.06 114.38 119.06 2wgg h ARG 183 Ca 0.18 -0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.25 2wgg h ARG 183 Cb 0.09 -0.15 -0.06 0.00 0.08 0.00 0.00 29.97 29.92 2wgg h ARG 183 CO -0.13 0.45 0.63 1.96 -1.07 0.00 0.00 179.97 181.81 2wgg h GLN 184 N 0.70 1.10 0.02 0.04 1.08 -0.63 0.12 115.11 117.54 2wgg h GLN 184 Ca 0.25 -0.07 -0.00 0.00 -1.45 0.00 0.00 58.65 57.38 2wgg h GLN 184 Cb 0.05 -0.25 0.00 0.00 -0.05 0.00 0.00 27.48 27.23 2wgg h GLN 184 CO -0.11 0.73 -0.01 0.82 -0.95 0.00 0.00 178.83 179.30 2wgg h ILE 185 N 1.13 1.47 -0.06 2.54 2.04 -0.91 0.38 117.51 124.11 2wgg h ILE 185 Ca 0.41 -1.67 -0.06 0.00 1.00 0.00 0.00 64.86 64.54 2wgg h ILE 185 Cb 0.16 2.57 -0.01 0.00 -0.74 0.00 0.00 36.82 38.81 2wgg h ILE 185 CO -0.16 0.42 -0.23 -0.37 0.00 0.00 0.00 178.15 177.81 2wgg h VAL 186 N -0.77 1.20 0.00 1.67 -1.51 -0.80 -1.21 116.25 114.82 2wgg h VAL 186 Ca -0.00 -0.92 0.00 0.00 -1.23 0.00 0.00 66.70 64.55 2wgg h VAL 186 Cb 0.71 1.41 0.00 0.00 -2.13 0.00 0.00 31.29 31.28 2wgg h VAL 186 CO 0.00 0.27 0.00 0.23 -1.23 0.00 0.00 177.57 176.85 2wgg n MET 187 N -4.22 0.53 -0.61 5.19 2.81 0.41 -4.71 117.12 116.52 2wgg n MET 187 Ca -0.02 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 2wgg n MET 187 Cb 0.31 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.32 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 0.77 0.69 0.13 3.03 0.00 -0.46 -4.94 105.19 104.40 2wgg n GLY 188 Ca 0.15 -0.09 0.05 0.00 0.00 0.00 0.00 46.02 46.12 2wgg n GLY 188 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wgg h ASP 189 N 0.00 0.00 -5.11 1.61 3.32 -1.12 -3.47 116.42 111.65 2wgg h ASP 189 Ca 0.00 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 2wgg h ASP 189 Cb 0.00 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 39.40 2wgg h ASP 189 CO 0.00 0.36 -0.29 0.00 -1.72 0.00 0.00 179.24 177.60 2wgg s ALA 190 N -3.06 -0.48 -0.12 3.45 0.00 -0.92 -4.82 121.76 115.81 2wgg s ALA 190 Ca 0.01 -0.33 0.15 0.00 0.00 0.00 0.00 51.96 51.79 2wgg s ALA 190 Cb 0.08 0.47 -0.22 0.00 0.00 0.00 0.00 23.12 23.45 2wgg s ALA 190 CO 0.77 -0.50 0.15 -3.47 0.00 0.00 0.00 175.76 172.71 2wgg n ASP 191 N 0.13 1.07 -3.81 0.00 2.03 0.71 -4.16 116.55 112.52 2wgg n ASP 191 Ca -0.16 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.02 2wgg n ASP 191 Cb 0.62 1.16 -0.11 0.00 -0.72 0.00 0.00 41.12 42.07 2wgg n ASP 191 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2wgg s VAL 192 N -2.63 0.02 -0.08 5.18 0.11 -0.95 -1.81 120.40 120.25 2wgg s VAL 192 Ca -0.07 -0.20 -0.04 0.00 -2.93 0.00 0.00 61.98 58.74 2wgg s VAL 192 Cb 0.07 -0.36 0.04 0.00 -1.53 0.00 0.00 36.38 34.60 2wgg s VAL 192 CO 0.67 -0.11 0.18 0.00 -3.33 0.00 0.00 175.10 172.51 2wgg s ALA 193 N -0.35 -0.36 -0.01 1.54 0.00 0.10 -1.19 121.76 121.49 2wgg s ALA 193 Ca -0.04 0.76 -0.26 0.00 0.00 0.00 0.00 51.96 52.41 2wgg s ALA 193 Cb -0.03 -0.50 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 2wgg s ALA 193 CO 0.01 -0.16 0.82 0.08 0.00 0.00 0.00 175.76 176.51 2wgg s VAL 194 N 1.12 4.89 -0.03 0.00 1.01 -0.47 -1.47 120.40 125.45 2wgg s VAL 194 Ca -0.09 1.72 -0.21 0.00 0.00 0.00 0.00 61.98 63.41 2wgg s VAL 194 Cb -0.10 -4.17 0.04 0.00 0.00 0.00 0.00 36.38 32.15 2wgg s VAL 194 CO -0.06 0.25 0.45 0.00 0.00 0.00 0.00 175.10 175.74 2wgg n GLY 196 N 1.15 -0.46 3.27 0.00 0.00 -0.55 0.32 105.19 108.91 2wgg n GLY 196 Ca -0.21 -0.68 -0.12 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.16 0.19 -0.02 0.00 -0.65 -0.93 107.32 105.76 2wgg s GLY 197 Ca 0.00 0.08 0.03 0.00 0.00 0.00 0.00 44.72 44.83 2wgg s GLY 197 CO 0.00 -0.15 -0.01 -1.34 0.00 0.00 0.00 173.10 171.60 2wgg s VAL 198 N -2.54 0.87 -0.08 1.40 -7.23 -0.75 -1.74 120.40 110.33 2wgg s VAL 198 Ca -0.05 -2.01 -0.30 0.00 -1.81 0.00 0.00 61.98 57.81 2wgg s VAL 198 Cb -0.01 -2.16 0.07 0.00 0.56 0.00 0.00 36.38 34.84 2wgg s VAL 198 CO -0.03 -0.46 0.69 -0.70 -0.31 0.00 0.00 175.10 174.29 2wgg s GLU 199 N -3.87 1.02 1.18 4.82 2.56 -1.26 -3.62 118.70 119.53 2wgg s GLU 199 Ca 0.24 0.35 -0.14 0.00 0.00 0.00 0.00 54.97 55.42 2wgg s GLU 199 Cb 0.05 0.48 0.28 0.00 2.00 0.00 0.00 34.13 36.95 2wgg s GLU 199 CO 0.05 -0.30 1.03 0.20 -0.56 0.00 0.00 175.26 175.68 2wgg s GLY 200 N -0.99 1.53 0.64 -1.50 0.00 -1.26 -4.83 107.32 100.91 2wgg s GLY 200 Ca -0.09 -0.34 -0.08 0.00 0.00 0.00 0.00 44.72 44.21 2wgg s GLY 200 CO 0.09 0.42 0.98 2.56 0.00 0.00 0.00 173.10 177.14 2wgg s PRO 201 N -4.69 2.74 0.13 2.90 0.04 -1.26 -4.85 135.00 130.02 2wgg s PRO 201 Ca 0.68 0.06 -0.32 0.00 0.04 0.00 0.00 61.00 61.47 2wgg s PRO 201 Cb -0.22 -2.18 -0.11 0.00 0.04 0.00 0.00 34.50 32.03 2wgg s PRO 201 CO 0.62 -0.90 1.81 -0.89 0.04 0.00 0.00 177.00 177.68 2wgg n ILE 202 N -2.77 0.29 -3.93 0.56 5.41 -1.26 -4.98 119.36 112.68 2wgg n ILE 202 Ca 0.06 -0.05 -0.09 0.00 1.00 0.00 0.00 62.75 63.66 2wgg n ILE 202 Cb 0.58 -2.06 -0.07 0.00 -0.71 0.00 0.00 39.64 37.38 2wgg n ILE 202 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 2wgg s GLU 203 N 2.43 1.17 0.18 0.38 0.41 -1.26 -5.08 118.70 116.93 2wgg s GLU 203 Ca 0.81 -1.13 -0.12 0.00 -0.41 0.00 0.00 54.97 54.12 2wgg s GLU 203 Cb -0.50 0.39 0.10 0.00 -1.78 0.00 0.00 34.13 32.33 2wgg s GLU 203 CO 0.37 -0.43 1.78 0.00 -0.49 0.00 0.00 175.26 176.49 2wgg h ALA 204 N 2.51 0.82 -0.22 5.21 0.00 -1.96 -2.20 119.26 123.41 2wgg h ALA 204 Ca -0.31 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.38 2wgg h ALA 204 Cb 1.23 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2wgg h ALA 204 CO 0.47 0.36 -0.21 1.25 0.00 0.00 0.00 179.25 181.12 2wgg h LEU 205 N 0.87 0.57 -0.72 0.00 5.85 -1.99 -0.87 115.31 119.03 2wgg h LEU 205 Ca 0.22 -0.47 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 2wgg h LEU 205 Cb 0.09 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 2wgg h LEU 205 CO -0.03 0.93 0.43 -0.65 -0.34 0.00 0.00 178.44 178.78 2wgg h PRO 206 N 0.23 0.97 -0.48 5.25 0.11 -1.94 -0.83 132.00 135.31 2wgg h PRO 206 Ca 0.04 -0.09 0.02 0.00 0.11 0.00 0.00 66.00 66.08 2wgg h PRO 206 Cb 0.76 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.64 2wgg h PRO 206 CO 0.05 0.69 0.29 0.82 -0.21 0.00 0.00 178.00 179.64 2wgg h ILE 207 N 0.98 1.05 0.13 4.15 2.04 -1.31 -1.81 117.51 122.74 2wgg h ILE 207 Ca 0.26 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.92 2wgg h ILE 207 Cb -0.03 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 36.48 2wgg h ILE 207 CO -0.05 0.10 -0.08 0.00 0.00 0.00 0.00 178.15 178.13 2wgg h ALA 208 N 1.21 -0.19 0.10 1.87 0.00 -0.93 0.16 119.26 121.47 2wgg h ALA 208 Ca 0.19 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2wgg h ALA 208 Cb 0.01 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2wgg h ALA 208 CO -0.08 -0.61 -0.16 0.00 0.00 0.00 0.00 179.25 178.40 2wgg h ALA 209 N 0.67 -0.27 -0.34 0.00 0.00 -1.08 0.08 119.26 118.33 2wgg h ALA 209 Ca -0.01 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 2wgg h ALA 209 Cb 0.17 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2wgg h ALA 209 CO 0.01 -0.68 -0.25 0.74 0.00 0.00 0.00 179.25 179.07 2wgg h PHE 210 N -0.32 0.77 0.00 0.00 0.04 -1.35 -3.16 116.94 112.93 2wgg h PHE 210 Ca 0.02 -0.18 -0.09 0.00 2.80 0.00 0.00 57.97 60.52 2wgg h PHE 210 Cb 0.33 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.28 2wgg h PHE 210 CO -0.16 0.87 -0.43 0.66 -0.60 0.00 0.00 178.31 178.64 2wgg h SER 211 N 0.59 0.00 0.32 2.17 4.64 -0.53 -2.70 113.55 118.04 2wgg h SER 211 Ca 0.08 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.38 2wgg h SER 211 Cb 0.74 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.83 2wgg h SER 211 CO 0.06 0.43 -0.11 0.24 -0.87 0.00 0.00 176.83 176.58 2wgg h MET 212 N 0.00 0.00 0.00 4.77 2.86 -0.94 -0.00 114.93 121.62 2wgg h MET 212 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2wgg h MET 212 Cb 1.04 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.70 2wgg h MET 212 CO 0.06 0.11 0.00 -1.33 1.06 0.00 0.00 176.91 176.80 2wgg n MET 213 N -3.69 0.14 -2.91 1.72 2.00 -1.02 -4.91 117.12 108.45 2wgg n MET 213 Ca -0.02 0.06 -0.21 0.00 0.00 0.00 0.00 57.70 57.53 2wgg n MET 213 Cb 0.22 -1.50 0.03 0.00 0.00 0.00 0.00 33.22 31.97 2wgg n MET 213 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 2wgg n ARG 214 N -1.42 -4.32 -0.00 0.03 1.74 -0.02 -4.89 116.66 107.78 2wgg n ARG 214 Ca 0.08 0.87 0.10 0.00 -0.77 0.00 0.00 57.85 58.13 2wgg n ARG 214 Cb 0.26 -5.59 -0.13 0.00 -1.02 0.00 0.00 32.46 25.98 2wgg n ARG 214 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wgg n ALA 215 N -3.31 3.93 -2.64 7.54 0.00 -1.25 -4.99 120.51 119.79 2wgg n ALA 215 Ca -0.12 -0.53 -0.33 0.00 0.00 0.00 0.00 53.44 52.45 2wgg n ALA 215 Cb 0.62 -0.71 -0.05 0.00 0.00 0.00 0.00 19.45 19.31 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 -3.06 3.67 0.37 0.00 -1.94 -1.26 -1.83 119.30 115.25 2wgg s MET 216 Ca 0.02 0.03 -0.28 0.00 -1.71 0.00 0.00 55.69 53.75 2wgg s MET 216 Cb 0.14 -2.95 -0.11 0.00 2.01 0.00 0.00 34.83 33.92 2wgg s MET 216 CO 0.82 0.54 1.52 0.45 -0.01 0.00 0.00 175.02 178.34 2wgg n SER 217 N 0.62 3.87 -0.53 3.03 2.88 -0.42 -4.65 113.62 118.42 2wgg n SER 217 Ca -0.06 1.22 0.07 0.00 -1.33 0.00 0.00 58.87 58.76 2wgg n SER 217 Cb 0.52 -1.63 0.19 0.00 -0.75 0.00 0.00 64.21 62.54 2wgg n SER 217 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2wgg n THR 218 N 0.71 2.04 -1.13 2.46 -2.24 -1.26 -4.81 114.28 110.05 2wgg n THR 218 Ca 0.02 -2.95 -0.35 0.00 -2.27 0.00 0.00 64.05 58.51 2wgg n THR 218 Cb 0.39 -0.19 -0.03 0.00 -2.10 0.00 0.00 70.33 68.40 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 -1.11 2.26 0.21 -0.78 0.63 -1.26 -4.70 116.66 111.91 2wgg n ARG 219 Ca 0.18 -1.89 0.14 0.00 -0.92 0.00 0.00 57.85 55.36 2wgg n ARG 219 Cb 0.70 -2.80 0.50 0.00 0.45 0.00 0.00 32.46 31.31 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 6.60 0.00 0.23 6.15 -0.26 -1.92 -3.09 115.58 123.29 2wgg h ASN 220 Ca 0.54 0.00 -0.11 0.00 -0.56 0.00 0.00 56.30 56.17 2wgg h ASN 220 Cb 0.43 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.68 2wgg h ASN 220 CO 1.74 0.00 -0.42 -2.24 -1.06 0.00 0.00 177.43 175.45 2wgg h ASP 221 N 0.00 0.26 -2.64 5.81 2.03 -1.99 -3.38 116.42 116.51 2wgg h ASP 221 Ca 0.00 -0.11 -0.59 0.00 -0.73 0.00 0.00 57.03 55.60 2wgg h ASP 221 Cb 0.60 -0.07 -0.39 0.00 -0.83 0.00 0.00 39.33 38.64 2wgg h ASP 221 CO 0.00 0.66 -0.87 -1.61 -1.03 0.00 0.00 179.24 176.39 2wgg s GLU 222 N -4.12 0.87 0.21 4.15 2.02 -1.17 -5.03 118.70 115.64 2wgg s GLU 222 Ca -0.05 -1.81 -0.09 0.00 0.02 0.00 0.00 54.97 53.04 2wgg s GLU 222 Cb 0.13 -1.58 0.25 0.00 0.10 0.00 0.00 34.13 33.03 2wgg s GLU 222 CO 0.77 -1.28 1.81 -1.35 0.02 0.00 0.00 175.26 175.24 2wgg h PRO 223 N 6.37 0.69 0.00 0.39 0.11 -1.76 -1.83 132.00 135.97 2wgg h PRO 223 Ca 0.14 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.18 2wgg h PRO 223 Cb 0.93 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.88 2wgg h PRO 223 CO 0.35 0.46 -0.13 0.93 -0.21 0.00 0.00 178.00 179.41 2wgg h GLU 224 N 0.71 0.00 -0.01 1.05 5.08 -1.92 -2.71 114.58 116.79 2wgg h GLU 224 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 2wgg h GLU 224 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2wgg h GLU 224 CO -0.18 0.13 -0.44 0.54 -1.00 0.00 0.00 179.01 178.05 2wgg n ARG 225 N -3.43 0.78 -0.04 2.33 1.74 -0.71 -4.56 116.66 112.77 2wgg n ARG 225 Ca -0.01 -0.56 -0.14 0.00 -0.77 0.00 0.00 57.85 56.37 2wgg n ARG 225 Cb 0.30 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 30.17 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 3.60 0.18 -1.73 7.54 0.00 -1.25 -3.41 119.26 124.19 2wgg h ALA 226 Ca 0.00 -0.42 -0.56 0.00 0.00 0.00 0.00 54.91 53.93 2wgg h ALA 226 Cb 0.59 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 2wgg h ALA 226 CO 0.00 0.20 1.10 0.45 0.00 0.00 0.00 179.25 181.00 2wgg s SER 227 N -6.36 6.22 -0.50 0.00 0.15 -1.26 -4.68 113.70 107.28 2wgg s SER 227 Ca -0.14 0.68 0.08 0.00 0.70 0.00 0.00 55.95 57.27 2wgg s SER 227 Cb 0.05 -2.54 0.34 0.00 -1.71 0.00 0.00 66.02 62.16 2wgg s SER 227 CO 0.78 -1.55 0.85 0.54 1.20 0.00 0.00 173.24 175.06 2wgg n ARG 228 N 8.29 2.31 -1.75 5.44 1.74 -1.26 -4.64 116.66 126.79 2wgg n ARG 228 Ca 0.16 -4.26 -0.42 0.00 -0.77 0.00 0.00 57.85 52.56 2wgg n ARG 228 Cb 0.48 -2.02 -0.01 0.00 -1.02 0.00 0.00 32.46 29.90 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 0.02 2.59 -0.13 5.56 -0.04 -1.26 -1.83 135.00 139.90 2wgg n PRO 229 Ca 0.28 0.91 0.00 0.00 -0.04 0.00 0.00 63.50 64.66 2wgg n PRO 229 Cb 0.50 -2.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.31 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 1.25 0.00 -2.45 0.54 3.72 -1.26 -4.82 117.46 114.44 2wgg n PHE 230 Ca 0.05 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.09 2wgg n PHE 230 Cb 0.37 -0.59 -0.03 0.00 -0.94 0.00 0.00 39.48 38.29 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 -2.84 6.60 0.37 4.37 2.15 -0.76 -3.91 116.67 122.65 2wgg s ASP 231 Ca 0.00 2.13 0.04 0.00 0.43 0.00 0.00 52.55 55.15 2wgg s ASP 231 Cb 0.00 -2.59 0.72 0.00 -0.30 0.00 0.00 42.92 40.75 2wgg s ASP 231 CO 0.00 -0.61 2.03 0.50 -0.17 0.00 0.00 175.17 176.92 2wgg h LYS 232 N 2.42 0.73 -0.64 4.34 1.63 -1.06 -2.51 116.57 121.47 2wgg h LYS 232 Ca -0.49 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.27 2wgg h LYS 232 Cb 1.22 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.69 2wgg h LYS 232 CO 0.62 0.48 0.00 -0.25 -3.45 0.00 0.00 179.45 176.85 2wgg n ASP 233 N -4.45 3.66 -4.78 4.20 8.00 -1.26 -4.96 116.55 116.96 2wgg n ASP 233 Ca 0.05 -2.40 -0.41 0.00 0.71 0.00 0.00 54.79 52.75 2wgg n ASP 233 Cb 0.05 -0.52 -0.00 0.00 -0.02 0.00 0.00 41.12 40.62 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 -1.88 4.08 -0.20 -1.24 1.70 -0.95 -4.96 118.95 115.50 2wgg s ARG 234 Ca 0.36 2.47 0.20 0.00 -0.47 0.00 0.00 55.73 58.29 2wgg s ARG 234 Cb 0.24 -2.93 0.48 0.00 -0.57 0.00 0.00 34.95 32.17 2wgg s ARG 234 CO 0.15 -0.51 1.14 -0.40 -1.08 0.00 0.00 175.30 174.61 2wgg n ASP 235 N 0.40 2.00 0.00 -2.89 5.75 -1.24 -4.72 116.55 115.85 2wgg n ASP 235 Ca 0.01 -2.43 0.00 0.00 -0.01 0.00 0.00 54.79 52.36 2wgg n ASP 235 Cb 0.40 -0.42 0.00 0.00 -1.03 0.00 0.00 41.12 40.07 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 -0.40 1.59 3.93 6.12 0.00 -0.07 -3.05 105.19 113.31 2wgg n GLY 236 Ca 0.14 -2.19 -0.26 0.00 0.00 0.00 0.00 46.02 43.71 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 -1.55 3.32 -0.06 1.61 -0.12 -0.76 -3.77 117.98 116.64 2wgg s PHE 237 Ca 0.00 0.55 0.05 0.00 -0.05 0.00 0.00 56.93 57.49 2wgg s PHE 237 Cb 0.00 -2.49 -0.01 0.00 -0.63 0.00 0.00 43.02 39.90 2wgg s PHE 237 CO 0.00 -0.53 -0.23 0.08 -0.05 0.00 0.00 175.22 174.49 2wgg s VAL 238 N -2.79 1.92 0.21 -2.49 1.01 -1.26 -1.30 120.40 115.70 2wgg s VAL 238 Ca 0.50 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 61.20 2wgg s VAL 238 Cb -0.10 -1.63 -0.09 0.00 0.00 0.00 0.00 36.38 34.56 2wgg s VAL 238 CO 0.43 0.53 1.32 -0.36 0.00 0.00 0.00 175.10 177.02 2wgg s PHE 239 N -0.03 3.23 -0.06 5.22 0.08 -1.26 -0.32 117.98 124.84 2wgg s PHE 239 Ca -0.06 1.20 -0.03 0.00 0.12 0.00 0.00 56.93 58.17 2wgg s PHE 239 Cb -0.14 -3.63 0.04 0.00 -0.57 0.00 0.00 43.02 38.72 2wgg s PHE 239 CO 0.04 -1.97 0.08 0.20 -0.10 0.00 0.00 175.22 173.47 2wgg s GLY 240 N 0.33 0.20 0.50 4.36 0.00 -0.97 -1.14 107.32 110.61 2wgg s GLY 240 Ca 0.57 0.19 -0.22 0.00 0.00 0.00 0.00 44.72 45.25 2wgg s GLY 240 CO 0.39 1.47 1.26 -0.54 0.00 0.00 0.00 173.10 175.68 2wgg s GLU 241 N 2.18 3.47 -0.07 2.90 2.02 0.13 -3.16 118.70 126.17 2wgg s GLU 241 Ca 0.04 2.00 -0.31 0.00 0.02 0.00 0.00 54.97 56.73 2wgg s GLU 241 Cb -0.12 -2.34 0.12 0.00 0.10 0.00 0.00 34.13 31.88 2wgg s GLU 241 CO -0.04 -0.86 1.00 0.00 0.02 0.00 0.00 175.26 175.39 2wgg s ALA 242 N -1.42 -1.91 0.01 5.21 0.00 -1.26 -3.37 121.76 119.01 2wgg s ALA 242 Ca 0.67 1.23 -0.10 0.00 0.00 0.00 0.00 51.96 53.77 2wgg s ALA 242 Cb -0.34 0.20 0.01 0.00 0.00 0.00 0.00 23.12 22.99 2wgg s ALA 242 CO 0.41 -0.65 0.19 0.20 0.00 0.00 0.00 175.76 175.92 2wgg s GLY 243 N -2.34 -0.01 -0.15 0.00 0.00 -0.85 -4.02 107.32 99.94 2wgg s GLY 243 Ca 0.06 -0.06 -0.19 0.00 0.00 0.00 0.00 44.72 44.54 2wgg s GLY 243 CO -0.07 -0.22 0.50 0.00 0.00 0.00 0.00 173.10 173.30 2wgg s ALA 244 N -1.65 -1.24 0.12 3.20 0.00 -0.71 -1.37 121.76 120.11 2wgg s ALA 244 Ca -0.12 1.27 0.07 0.00 0.00 0.00 0.00 51.96 53.17 2wgg s ALA 244 Cb -0.05 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 2wgg s ALA 244 CO 0.01 -0.26 -0.16 -0.51 0.00 0.00 0.00 175.76 174.85 2wgg s LEU 245 N -0.10 2.39 0.13 0.00 1.43 -0.40 -1.63 118.68 120.50 2wgg s LEU 245 Ca -0.03 -0.79 0.04 0.00 -1.03 0.00 0.00 54.13 52.33 2wgg s LEU 245 Cb -0.03 -0.64 -0.04 0.00 0.03 0.00 0.00 46.19 45.51 2wgg s LEU 245 CO 0.02 -0.09 -0.10 0.00 0.23 0.00 0.00 176.35 176.40 2wgg s MET 246 N -2.52 1.00 -0.19 1.70 0.23 0.15 -1.15 119.30 118.53 2wgg s MET 246 Ca 0.09 -1.36 -0.04 0.00 -1.03 0.00 0.00 55.69 53.35 2wgg s MET 246 Cb -0.06 -0.61 -0.02 0.00 -1.53 0.00 0.00 34.83 32.61 2wgg s MET 246 CO 0.04 0.08 -0.04 -1.17 -2.03 0.00 0.00 175.02 171.90 2wgg s LEU 247 N -2.94 3.05 0.12 0.18 2.96 0.01 -1.12 118.68 120.95 2wgg s LEU 247 Ca 0.13 -0.27 0.08 0.00 -0.22 0.00 0.00 54.13 53.86 2wgg s LEU 247 Cb 0.01 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.91 2wgg s LEU 247 CO 0.00 0.08 -0.20 0.27 -1.32 0.00 0.00 176.35 175.18 2wgg s ILE 248 N 0.91 1.76 0.11 6.68 -4.36 -0.54 -1.17 121.20 124.60 2wgg s ILE 248 Ca -0.00 -1.68 -0.24 0.00 -0.26 0.00 0.00 60.65 58.47 2wgg s ILE 248 Cb -0.15 -1.67 0.07 0.00 1.25 0.00 0.00 42.46 41.97 2wgg s ILE 248 CO 0.01 -0.15 0.60 -1.61 0.24 0.00 0.00 174.94 174.04 2wgg s GLU 249 N -2.22 1.22 0.62 0.37 2.02 -0.90 -0.72 118.70 119.09 2wgg s GLU 249 Ca 0.10 -0.33 -0.17 0.00 0.02 0.00 0.00 54.97 54.58 2wgg s GLU 249 Cb -0.08 0.56 -0.02 0.00 0.10 0.00 0.00 34.13 34.69 2wgg s GLU 249 CO 0.05 -0.50 1.16 0.95 0.02 0.00 0.00 175.26 176.93 2wgg s THR 250 N -3.21 2.92 0.39 3.63 -4.23 -0.75 -0.32 115.64 114.07 2wgg s THR 250 Ca -0.01 0.51 0.07 0.00 -1.18 0.00 0.00 61.69 61.08 2wgg s THR 250 Cb -0.01 -3.12 0.22 0.00 1.34 0.00 0.00 72.50 70.94 2wgg s THR 250 CO -0.08 -0.18 1.99 -0.08 -0.54 0.00 0.00 174.62 175.73 2wgg h GLU 251 N 0.56 0.48 -0.45 3.99 4.81 -1.52 -0.88 114.58 121.57 2wgg h GLU 251 Ca -0.49 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 58.75 2wgg h GLU 251 Cb 1.27 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 30.50 2wgg h GLU 251 CO 0.55 0.40 0.14 1.49 -0.73 0.00 0.00 179.01 180.86 2wgg h GLU 252 N 0.48 0.30 -0.46 1.92 4.81 -1.91 -0.88 114.58 118.83 2wgg h GLU 252 Ca 0.12 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.26 2wgg h GLU 252 Cb 0.10 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 2wgg h GLU 252 CO -0.01 0.20 0.01 1.25 -0.73 0.00 0.00 179.01 179.73 2wgg h HIS 253 N 0.30 0.88 -0.14 0.92 2.76 -1.56 -2.66 115.15 115.65 2wgg h HIS 253 Ca 0.22 -0.15 -0.02 0.00 -2.20 0.00 0.00 60.37 58.22 2wgg h HIS 253 Cb 0.23 -0.23 -0.00 0.00 1.55 0.00 0.00 27.41 28.96 2wgg h HIS 253 CO -0.17 0.84 -0.00 0.00 -1.30 0.00 0.00 177.93 177.30 2wgg h ALA 254 N 0.92 0.18 -0.34 5.26 0.00 -1.14 -3.09 119.26 121.07 2wgg h ALA 254 Ca 0.13 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.93 2wgg h ALA 254 Cb 0.48 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.14 2wgg h ALA 254 CO 0.02 -0.12 -0.25 -0.22 0.00 0.00 0.00 179.25 178.68 2wgg h LYS 255 N -0.02 -0.21 -0.43 0.00 3.11 -1.18 -0.88 116.57 116.96 2wgg h LYS 255 Ca 0.04 0.01 0.09 0.00 -2.81 0.00 0.00 60.65 57.98 2wgg h LYS 255 Cb 0.37 0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 31.62 2wgg h LYS 255 CO 0.01 -0.14 0.30 0.00 -2.81 0.00 0.00 179.45 176.80 2wgg h ALA 256 N 0.89 2.16 -0.44 5.00 0.00 -1.46 -0.57 119.26 124.84 2wgg h ALA 256 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2wgg h ALA 256 Cb 0.48 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2wgg h ALA 256 CO -0.46 -0.26 0.00 2.89 0.00 0.00 0.00 179.25 181.42 2wgg n ARG 257 N -4.46 2.51 -1.55 0.00 1.85 -1.02 -4.97 116.66 109.03 2wgg n ARG 257 Ca 0.06 -2.32 -0.12 0.00 -1.00 0.00 0.00 57.85 54.47 2wgg n ARG 257 Cb 0.37 -1.51 -0.04 0.00 -1.05 0.00 0.00 32.46 30.23 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 1.46 1.00 3.72 2.89 0.00 -0.22 -5.00 105.19 109.04 2wgg n GLY 258 Ca 0.20 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.49 3.34 -0.22 4.61 0.00 -0.46 -5.00 121.76 121.54 2wgg s ALA 259 Ca 0.00 0.77 -0.19 0.00 0.00 0.00 0.00 51.96 52.55 2wgg s ALA 259 Cb 0.00 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 2wgg s ALA 259 CO 0.00 -0.32 0.54 0.21 0.00 0.00 0.00 175.76 176.19 2wgg s LYS 260 N 0.59 4.15 0.35 0.00 2.47 -1.26 -4.47 119.74 121.56 2wgg s LYS 260 Ca 0.54 0.41 -0.27 0.00 -1.56 0.00 0.00 55.97 55.09 2wgg s LYS 260 Cb -0.28 -3.60 -0.09 0.00 -1.46 0.00 0.00 37.83 32.40 2wgg s LYS 260 CO 0.31 -0.24 1.22 -2.14 0.16 0.00 0.00 175.35 174.65 2wgg s PRO 261 N 1.95 4.26 0.15 4.03 0.02 -1.26 -4.77 135.00 139.37 2wgg s PRO 261 Ca 0.24 2.00 0.22 0.00 0.02 0.00 0.00 61.00 63.48 2wgg s PRO 261 Cb -0.15 -2.92 -0.08 0.00 0.02 0.00 0.00 34.50 31.37 2wgg s PRO 261 CO 0.09 -0.19 0.91 1.28 -0.33 0.00 0.00 177.00 178.77 2wgg n LEU 262 N 0.55 0.68 -3.93 -5.54 4.77 0.21 -4.89 117.00 108.85 2wgg n LEU 262 Ca 0.02 0.27 0.01 0.00 -0.03 0.00 0.00 56.01 56.27 2wgg n LEU 262 Cb 0.44 -0.04 0.01 0.00 -2.33 0.00 0.00 43.42 41.51 2wgg n LEU 262 CO 0.55 -0.13 1.01 0.00 -1.33 0.00 0.00 177.39 177.49 2wgg s ALA 263 N -3.36 -2.19 -0.04 -1.18 0.00 -1.23 -3.93 121.76 109.82 2wgg s ALA 263 Ca -0.02 -0.03 0.02 0.00 0.00 0.00 0.00 51.96 51.93 2wgg s ALA 263 Cb 0.10 0.82 -0.03 0.00 0.00 0.00 0.00 23.12 24.01 2wgg s ALA 263 CO 0.81 -1.12 -0.08 1.03 0.00 0.00 0.00 175.76 176.41 2wgg s ARG 264 N -2.10 2.63 -0.37 0.00 0.52 0.78 -0.65 118.95 119.77 2wgg s ARG 264 Ca 0.26 -0.64 -0.10 0.00 -0.52 0.00 0.00 55.73 54.73 2wgg s ARG 264 Cb -0.01 -2.52 0.03 0.00 0.52 0.00 0.00 34.95 32.97 2wgg s ARG 264 CO 0.01 0.63 0.19 -1.17 0.02 0.00 0.00 175.30 174.99 2wgg s LEU 265 N -1.03 4.65 -0.13 2.53 2.96 -0.53 -1.39 118.68 125.74 2wgg s LEU 265 Ca 0.14 -1.00 0.18 0.00 -0.22 0.00 0.00 54.13 53.23 2wgg s LEU 265 Cb -0.11 -2.00 -0.25 0.00 0.50 0.00 0.00 46.19 44.32 2wgg s LEU 265 CO 0.04 -0.37 0.27 0.18 -1.32 0.00 0.00 176.35 175.15 2wgg n LEU 266 N 4.97 0.15 -3.62 -0.68 4.77 0.28 -4.33 117.00 118.55 2wgg n LEU 266 Ca -0.12 0.07 -0.01 0.00 -0.03 0.00 0.00 56.01 55.92 2wgg n LEU 266 Cb 0.46 0.33 -0.02 0.00 -2.33 0.00 0.00 43.42 41.86 2wgg n LEU 266 CO 0.36 0.35 1.16 -0.83 -1.33 0.00 0.00 177.39 177.10 2wgg s GLY 267 N -5.19 -0.28 -0.01 -0.72 0.00 -1.15 -3.58 107.32 96.39 2wgg s GLY 267 Ca -0.08 1.63 0.01 0.00 0.00 0.00 0.00 44.72 46.28 2wgg s GLY 267 CO 0.84 0.51 -0.02 0.00 0.00 0.00 0.00 173.10 174.44 2wgg s ALA 268 N -2.11 0.21 -0.08 3.20 0.00 -1.26 -0.45 121.76 121.28 2wgg s ALA 268 Ca 0.12 -0.05 0.05 0.00 0.00 0.00 0.00 51.96 52.08 2wgg s ALA 268 Cb 0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.03 2wgg s ALA 268 CO -0.03 0.03 -0.25 0.20 0.00 0.00 0.00 175.76 175.71 2wgg s GLY 269 N 0.14 1.31 -0.11 0.00 0.00 0.52 -4.23 107.32 104.95 2wgg s GLY 269 Ca -0.01 -1.01 0.01 0.00 0.00 0.00 0.00 44.72 43.71 2wgg s GLY 269 CO -0.00 -0.50 -0.12 -0.42 0.00 0.00 0.00 173.10 172.05 2wgg s ILE 270 N 0.06 1.31 0.27 0.90 1.01 -1.26 -1.34 121.20 122.16 2wgg s ILE 270 Ca -0.11 -0.51 0.05 0.00 0.00 0.00 0.00 60.65 60.09 2wgg s ILE 270 Cb -0.16 -1.24 -0.02 0.00 0.01 0.00 0.00 42.46 41.06 2wgg s ILE 270 CO 0.06 0.41 0.19 0.35 0.00 0.00 0.00 174.94 175.95 2wgg n THR 271 N 4.43 0.00 -3.90 2.92 -2.24 -0.77 -4.94 114.28 109.78 2wgg n THR 271 Ca -0.18 -1.88 -0.10 0.00 -2.27 0.00 0.00 64.05 59.62 2wgg n THR 271 Cb 0.51 0.88 -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 -2.84 0.10 0.04 3.42 1.04 -1.26 -1.94 113.70 112.27 2wgg s SER 272 Ca 0.27 -0.35 0.05 0.00 0.48 0.00 0.00 55.95 56.39 2wgg s SER 272 Cb 0.01 0.20 -0.24 0.00 0.10 0.00 0.00 66.02 66.10 2wgg s SER 272 CO 0.19 -0.41 1.00 0.44 0.98 0.00 0.00 173.24 175.44 2wgg h ASP 273 N 4.08 0.14 -6.98 7.02 3.32 -0.96 -3.46 116.42 119.59 2wgg h ASP 273 Ca -0.32 -0.19 -0.58 0.00 0.02 0.00 0.00 57.03 55.96 2wgg h ASP 273 Cb 1.19 -0.05 -0.15 0.00 0.22 0.00 0.00 39.33 40.54 2wgg h ASP 273 CO 0.44 1.16 -0.93 0.00 -1.72 0.00 0.00 179.24 178.19 2wgg n ALA 274 N -2.51 -2.10 0.00 3.45 0.00 -1.26 -4.89 120.51 113.21 2wgg n ALA 274 Ca -0.09 -0.44 -0.03 0.00 0.00 0.00 0.00 53.44 52.87 2wgg n ALA 274 Cb 1.00 -1.18 -0.01 0.00 0.00 0.00 0.00 19.45 19.27 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 -4.51 0.00 -3.64 0.00 7.35 -1.26 -5.12 117.46 110.29 2wgg n PHE 275 Ca -0.26 0.00 -0.14 0.00 -0.76 0.00 0.00 57.45 56.29 2wgg n PHE 275 Cb 0.63 -0.16 -0.07 0.00 0.35 0.00 0.00 39.48 40.23 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 -2.28 -0.36 0.16 -5.13 2.46 -1.26 -5.06 115.29 103.82 2wgg s HIS 276 Ca -0.09 0.47 -0.11 0.00 0.47 0.00 0.00 55.06 55.80 2wgg s HIS 276 Cb 0.01 0.26 0.03 0.00 -0.13 0.00 0.00 32.58 32.75 2wgg s HIS 276 CO 0.14 -0.55 1.60 0.52 -2.47 0.00 0.00 174.74 173.97 2wgg h MET 277 N 3.16 0.97 0.00 2.88 2.86 -1.99 -3.37 114.93 119.43 2wgg h MET 277 Ca -0.30 -0.34 -0.02 0.00 -2.06 0.00 0.00 59.70 56.98 2wgg h MET 277 Cb 1.19 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 32.72 2wgg h MET 277 CO 0.41 1.01 -0.37 1.33 1.06 0.00 0.00 176.91 180.34 2wgg n VAL 278 N -4.23 1.14 -3.81 -2.22 0.24 -1.26 0.12 118.33 108.31 2wgg n VAL 278 Ca 0.01 -1.61 -0.12 0.00 -2.04 0.00 0.00 64.34 60.58 2wgg n VAL 278 Cb 0.36 0.14 -0.12 0.00 -1.47 0.00 0.00 33.84 32.75 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 -1.71 -0.43 0.49 2.33 0.00 -1.26 -5.02 121.76 116.16 2wgg s ALA 279 Ca 0.24 0.47 -0.20 0.00 0.00 0.00 0.00 51.96 52.47 2wgg s ALA 279 Cb 0.23 -0.27 -0.08 0.00 0.00 0.00 0.00 23.12 23.00 2wgg s ALA 279 CO -0.02 -0.09 1.04 -1.25 0.00 0.00 0.00 175.76 175.44 2wgg s PRO 280 N 0.03 3.75 0.03 0.00 0.04 -1.26 -4.04 135.00 133.55 2wgg s PRO 280 Ca -0.01 1.37 -0.34 0.00 0.04 0.00 0.00 61.00 62.06 2wgg s PRO 280 Cb -0.01 -2.09 -0.12 0.00 0.04 0.00 0.00 34.50 32.31 2wgg s PRO 280 CO 0.00 -0.48 1.76 0.00 0.04 0.00 0.00 177.00 178.32 2wgg n ALA 281 N -1.04 1.16 -0.07 8.56 0.00 -1.26 -4.88 120.51 122.97 2wgg n ALA 281 Ca 0.09 0.35 0.04 0.00 0.00 0.00 0.00 53.44 53.92 2wgg n ALA 281 Cb 0.52 -2.45 0.38 0.00 0.00 0.00 0.00 19.45 17.90 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 7.85 1.66 0.00 0.00 0.00 -1.94 -2.56 119.26 124.27 2wgg h ALA 282 Ca -0.47 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2wgg h ALA 282 Cb 1.26 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2wgg h ALA 282 CO 0.92 0.30 0.00 0.38 0.00 0.00 0.00 179.25 180.86 2wgg h ASP 283 N 0.68 0.00 -0.65 0.00 3.04 -1.89 -3.40 116.42 114.20 2wgg h ASP 283 Ca 0.20 0.00 -0.28 0.00 -3.24 0.00 0.00 57.03 53.71 2wgg h ASP 283 Cb -0.03 0.00 -0.11 0.00 -1.04 0.00 0.00 39.33 38.15 2wgg h ASP 283 CO -0.05 0.00 -0.25 0.61 -2.04 0.00 0.00 179.24 177.51 2wgg n GLY 284 N -0.26 1.36 0.13 7.15 0.00 -0.96 -4.37 105.19 108.23 2wgg n GLY 284 Ca 0.01 -0.13 -0.14 0.00 0.00 0.00 0.00 46.02 45.76 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 1.39 -0.05 1.61 2.07 -1.88 -0.13 116.25 119.26 2wgg h VAL 285 Ca -0.28 -1.53 -0.19 0.00 0.82 0.00 0.00 66.70 65.52 2wgg h VAL 285 Cb 1.09 2.10 -0.00 0.00 -1.52 0.00 0.00 31.29 32.95 2wgg h VAL 285 CO 0.41 0.44 -0.79 0.03 0.02 0.00 0.00 177.57 177.68 2wgg h ARG 286 N -0.07 0.36 -0.54 1.57 2.47 -1.91 -1.57 114.38 114.69 2wgg h ARG 286 Ca 0.00 -0.33 -0.01 0.00 -1.26 0.00 0.00 59.98 58.39 2wgg h ARG 286 Cb 0.83 0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 29.20 2wgg h ARG 286 CO 0.05 0.98 0.32 0.00 0.56 0.00 0.00 179.97 181.88 2wgg h ALA 287 N 0.92 0.69 -0.61 0.04 0.00 -1.91 -1.87 119.26 116.52 2wgg h ALA 287 Ca -0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2wgg h ALA 287 Cb 1.38 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2wgg h ALA 287 CO 0.13 0.18 0.29 0.78 0.00 0.00 0.00 179.25 180.63 2wgg h GLY 288 N 0.73 0.92 1.37 0.00 0.00 -0.91 -2.72 103.07 102.46 2wgg h GLY 288 Ca 0.19 -0.44 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 2wgg h GLY 288 CO -0.03 0.42 0.15 -0.09 0.00 0.00 0.00 176.54 176.99 2wgg h ARG 289 N 0.86 0.80 -0.55 4.80 9.65 -0.78 0.38 114.38 129.55 2wgg h ARG 289 Ca 0.21 -0.15 0.03 0.00 -1.10 0.00 0.00 59.98 58.97 2wgg h ARG 289 Cb 0.10 -0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 28.51 2wgg h ARG 289 CO -0.03 0.70 0.32 0.00 2.80 0.00 0.00 179.97 183.77 2wgg h ALA 290 N 1.39 0.70 -0.14 2.80 0.00 -1.04 0.16 119.26 123.13 2wgg h ALA 290 Ca 0.18 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2wgg h ALA 290 Cb 0.25 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2wgg h ALA 290 CO -0.01 0.03 0.06 0.52 0.00 0.00 0.00 179.25 179.86 2wgg h MET 291 N 0.64 0.21 -0.27 0.00 2.86 -1.22 -2.25 114.93 114.90 2wgg h MET 291 Ca 0.22 -0.04 0.05 0.00 -2.06 0.00 0.00 59.70 57.88 2wgg h MET 291 Cb 0.04 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.61 2wgg h MET 291 CO -0.10 0.30 -0.05 1.15 1.06 0.00 0.00 176.91 179.26 2wgg h THR 292 N 0.08 0.74 -0.62 2.22 2.02 -0.69 -2.40 112.91 114.27 2wgg h THR 292 Ca 0.05 -0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.32 2wgg h THR 292 Cb 0.16 0.73 -0.07 0.00 -1.74 0.00 0.00 68.15 67.23 2wgg h THR 292 CO -0.00 0.00 0.24 -0.09 0.37 0.00 0.00 175.52 176.03 2wgg h ARG 293 N 0.01 0.41 -1.00 6.66 9.65 -0.61 0.11 114.38 129.61 2wgg h ARG 293 Ca 0.13 -0.02 0.05 0.00 -1.10 0.00 0.00 59.98 59.04 2wgg h ARG 293 Cb 0.19 -0.09 -0.06 0.00 -1.39 0.00 0.00 29.97 28.62 2wgg h ARG 293 CO -0.27 0.27 0.65 0.66 2.80 0.00 0.00 179.97 184.08 2wgg h SER 294 N 0.42 1.06 -0.14 -3.80 4.64 -1.08 -0.75 113.55 113.89 2wgg h SER 294 Ca 0.31 -0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.47 2wgg h SER 294 Cb 0.39 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 2wgg h SER 294 CO -0.31 0.70 -0.48 -0.07 -0.87 0.00 0.00 176.83 175.80 2wgg h LEU 295 N 1.21 0.77 -0.00 5.97 3.38 -0.91 0.62 115.31 126.35 2wgg h LEU 295 Ca 0.42 -0.38 0.03 0.00 0.09 0.00 0.00 57.88 58.03 2wgg h LEU 295 Cb 0.09 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 2wgg h LEU 295 CO -0.15 1.12 -0.19 -0.33 0.09 0.00 0.00 178.44 178.98 2wgg h GLU 296 N 0.56 -0.29 -0.17 1.13 5.08 -0.19 0.14 114.58 120.84 2wgg h GLU 296 Ca 0.03 0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.30 2wgg h GLU 296 Cb 1.04 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 2wgg h GLU 296 CO 0.10 -0.20 -0.38 -0.07 -1.00 0.00 0.00 179.01 177.46 2wgg h LEU 297 N -0.31 0.38 -0.78 1.33 3.38 -1.15 -2.80 115.31 115.37 2wgg h LEU 297 Ca 0.06 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 2wgg h LEU 297 Cb 0.38 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 2wgg h LEU 297 CO -0.18 0.73 0.06 0.00 0.09 0.00 0.00 178.44 179.14 2wgg h ALA 298 N 1.29 0.99 0.00 1.53 0.00 -0.66 -1.68 119.26 120.73 2wgg h ALA 298 Ca 0.03 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2wgg h ALA 298 Cb 0.81 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2wgg h ALA 298 CO 0.06 0.63 0.00 0.41 0.00 0.00 0.00 179.25 180.36 2wgg n GLY 299 N -0.60 1.41 3.62 0.00 0.00 0.33 -2.01 105.19 107.94 2wgg n GLY 299 Ca 0.04 -0.26 -0.24 0.00 0.00 0.00 0.00 46.02 45.56 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 3.05 0.29 0.99 1.43 -0.20 -4.86 118.68 119.38 2wgg s LEU 300 Ca 0.00 -0.80 0.08 0.00 -1.03 0.00 0.00 54.13 52.38 2wgg s LEU 300 Cb 0.00 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.66 2wgg s LEU 300 CO 0.00 -0.07 0.19 -0.94 0.23 0.00 0.00 176.35 175.75 2wgg s SER 301 N -3.67 5.19 0.48 2.29 1.04 -1.26 -4.36 113.70 113.40 2wgg s SER 301 Ca 0.32 -0.45 0.20 0.00 0.48 0.00 0.00 55.95 56.50 2wgg s SER 301 Cb -0.04 -1.10 1.21 0.00 0.10 0.00 0.00 66.02 66.18 2wgg s SER 301 CO 0.19 -0.16 1.97 -0.65 0.98 0.00 0.00 173.24 175.57 2wgg h PRO 302 N 1.49 0.22 0.00 4.02 0.11 -1.86 -0.67 132.00 135.30 2wgg h PRO 302 Ca -0.46 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 2wgg h PRO 302 Cb 1.25 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 2wgg h PRO 302 CO 0.60 0.14 -0.03 0.00 -0.21 0.00 0.00 178.00 178.50 2wgg h ALA 303 N 1.70 1.24 0.00 -0.75 0.00 -1.93 -2.72 119.26 116.80 2wgg h ALA 303 Ca 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2wgg h ALA 303 Cb 0.85 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2wgg h ALA 303 CO -0.06 0.04 0.00 -0.44 0.00 0.00 0.00 179.25 178.80 2wgg h ASP 304 N 0.00 0.00 -3.30 0.00 3.32 -1.52 -3.45 116.42 111.48 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 0.14 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.62 2wgg h ASP 304 CO 0.00 0.00 0.67 -0.63 -1.72 0.00 0.00 179.24 177.57 2wgg s ILE 305 N -3.29 4.66 -0.19 0.35 -1.09 -1.03 -4.30 121.20 116.31 2wgg s ILE 305 Ca 0.06 1.62 0.22 0.00 -2.23 0.00 0.00 60.65 60.32 2wgg s ILE 305 Cb 0.06 -4.29 -0.17 0.00 -1.58 0.00 0.00 42.46 36.48 2wgg s ILE 305 CO 0.64 -0.31 0.78 0.47 -1.23 0.00 0.00 174.94 175.29 2wgg n ASP 306 N 6.48 0.44 -3.73 3.58 8.00 -0.25 -4.51 116.55 126.56 2wgg n ASP 306 Ca 0.09 0.10 -0.12 0.00 0.71 0.00 0.00 54.79 55.57 2wgg n ASP 306 Cb 0.47 1.21 -0.12 0.00 -0.02 0.00 0.00 41.12 42.66 2wgg n ASP 306 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2wgg s HIS 307 N -3.41 -0.38 -0.18 1.24 5.04 -1.16 -1.68 115.29 114.75 2wgg s HIS 307 Ca -0.03 0.89 -0.01 0.00 -1.54 0.00 0.00 55.06 54.37 2wgg s HIS 307 Cb 0.12 0.11 -0.00 0.00 0.04 0.00 0.00 32.58 32.85 2wgg s HIS 307 CO 0.85 -0.23 -0.13 0.08 -2.34 0.00 0.00 174.74 172.96 2wgg s VAL 308 N 0.99 2.77 -0.56 0.89 1.01 -0.70 -0.24 120.40 124.56 2wgg s VAL 308 Ca -0.07 -0.72 -0.23 0.00 0.00 0.00 0.00 61.98 60.96 2wgg s VAL 308 Cb -0.08 -2.20 0.05 0.00 0.00 0.00 0.00 36.38 34.16 2wgg s VAL 308 CO -0.07 0.50 0.89 0.21 0.00 0.00 0.00 175.10 176.63 2wgg s ASN 309 N 1.05 6.29 0.26 3.32 3.84 0.94 -1.95 114.94 128.69 2wgg s ASN 309 Ca -0.01 -0.57 -0.23 0.00 0.21 0.00 0.00 52.86 52.27 2wgg s ASN 309 Cb -0.15 -2.41 -0.09 0.00 -0.55 0.00 0.00 41.25 38.06 2wgg s ASN 309 CO -0.03 -1.21 0.81 0.00 -2.79 0.00 0.00 177.10 173.88 2wgg s ALA 310 N 3.74 3.34 0.21 1.71 0.00 1.00 -1.64 121.76 130.12 2wgg s ALA 310 Ca 0.26 0.32 -0.10 0.00 0.00 0.00 0.00 51.96 52.44 2wgg s ALA 310 Cb -0.14 -2.97 0.16 0.00 0.00 0.00 0.00 23.12 20.16 2wgg s ALA 310 CO 0.16 0.27 1.87 1.25 0.00 0.00 0.00 175.76 179.31 2wgg h HIS 311 N 3.41 0.89 -5.56 0.00 2.76 -1.86 -3.40 115.15 111.39 2wgg h HIS 311 Ca -0.47 0.02 -0.30 0.00 -2.20 0.00 0.00 60.37 57.41 2wgg h HIS 311 Cb 1.19 -0.30 0.01 0.00 1.55 0.00 0.00 27.41 29.86 2wgg h HIS 311 CO 0.63 0.55 -0.85 0.41 -1.30 0.00 0.00 177.93 177.37 2wgg n GLY 312 N -1.30 -0.19 0.11 5.26 0.00 -1.26 -4.78 105.19 103.03 2wgg n GLY 312 Ca 0.07 0.71 0.12 0.00 0.00 0.00 0.00 46.02 46.92 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 1.05 0.00 0.00 2.61 1.35 -1.92 -3.41 112.91 112.60 2wgg h THR 313 Ca -0.43 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 64.75 2wgg h THR 313 Cb 1.00 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.81 2wgg h THR 313 CO 0.19 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.46 2wgg n ALA 314 N -1.94 0.00 -1.95 6.62 0.00 -1.26 -3.77 120.51 118.20 2wgg n ALA 314 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.12 2wgg n ALA 314 Cb 0.48 -0.22 -0.06 0.00 0.00 0.00 0.00 19.45 19.65 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 4.46 0.12 0.00 -4.23 -1.26 -0.89 115.64 111.83 2wgg s THR 315 Ca 0.00 1.40 -0.20 0.00 -1.18 0.00 0.00 61.69 61.71 2wgg s THR 315 Cb 0.00 -3.77 -0.07 0.00 1.34 0.00 0.00 72.50 70.00 2wgg s THR 315 CO 0.00 -0.04 1.75 -0.65 -0.54 0.00 0.00 174.62 175.14 2wgg h PRO 316 N 2.69 0.15 -0.06 3.99 0.11 -1.95 -2.61 132.00 134.32 2wgg h PRO 316 Ca -0.48 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.47 2wgg h PRO 316 Cb 1.18 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2wgg h PRO 316 CO 0.64 0.10 -0.64 0.97 -0.21 0.00 0.00 178.00 178.86 2wgg h ILE 317 N 0.15 1.40 0.51 4.15 6.09 -1.99 -3.07 117.51 124.75 2wgg h ILE 317 Ca 0.07 -2.06 -0.03 0.00 -1.37 0.00 0.00 64.86 61.48 2wgg h ILE 317 Cb 0.04 2.06 0.01 0.00 0.47 0.00 0.00 36.82 39.39 2wgg h ILE 317 CO -0.07 0.61 -0.25 1.23 -3.07 0.00 0.00 178.15 176.60 2wgg h GLY 318 N 1.51 -0.72 1.03 8.18 0.00 -1.93 -0.33 103.07 110.81 2wgg h GLY 318 Ca -0.01 0.27 -0.06 0.00 0.00 0.00 0.00 47.33 47.53 2wgg h GLY 318 CO 0.10 -0.26 0.19 -0.55 0.00 0.00 0.00 176.54 176.02 2wgg h ASP 319 N -0.76 0.96 -0.45 0.19 3.32 -1.58 -1.86 116.42 116.24 2wgg h ASP 319 Ca -0.07 -0.21 0.04 0.00 0.02 0.00 0.00 57.03 56.80 2wgg h ASP 319 Cb 0.56 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.82 2wgg h ASP 319 CO 0.12 0.92 0.22 0.00 -1.72 0.00 0.00 179.24 178.78 2wgg h ALA 320 N 1.08 0.56 -0.39 3.45 0.00 -1.45 -0.65 119.26 121.86 2wgg h ALA 320 Ca 0.21 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 2wgg h ALA 320 Cb 0.31 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2wgg h ALA 320 CO -0.00 -0.13 -0.18 0.00 0.00 0.00 0.00 179.25 178.93 2wgg h ALA 321 N 1.24 0.54 -0.67 0.00 0.00 -0.76 -2.66 119.26 116.96 2wgg h ALA 321 Ca 0.20 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2wgg h ALA 321 Cb 0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2wgg h ALA 321 CO -0.14 0.49 0.16 1.49 0.00 0.00 0.00 179.25 181.24 2wgg h GLU 322 N 0.61 1.07 -0.79 0.00 4.81 -1.15 -0.45 114.58 118.69 2wgg h GLU 322 Ca 0.09 -0.26 0.07 0.00 -0.13 0.00 0.00 59.36 59.13 2wgg h GLU 322 Cb 0.73 -0.14 -0.06 0.00 0.63 0.00 0.00 28.75 29.91 2wgg h GLU 322 CO 0.06 0.96 0.46 0.00 -0.73 0.00 0.00 179.01 179.75 2wgg h ALA 323 N 1.07 1.09 -0.90 2.92 0.00 -1.04 -0.19 119.26 122.20 2wgg h ALA 323 Ca 0.21 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 2wgg h ALA 323 Cb 0.37 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 2wgg h ALA 323 CO 0.00 0.14 0.50 -0.91 0.00 0.00 0.00 179.25 178.98 2wgg h ASN 324 N 0.81 1.12 -0.63 0.00 2.35 -1.10 -1.93 115.58 116.20 2wgg h ASN 324 Ca 0.36 -0.10 -0.09 0.00 -0.55 0.00 0.00 56.30 55.92 2wgg h ASN 324 Cb 0.24 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.31 2wgg h ASN 324 CO -0.20 0.90 0.05 0.00 -1.65 0.00 0.00 177.43 176.53 2wgg h ALA 325 N 1.28 0.89 -0.69 -0.83 0.00 -0.18 -1.12 119.26 118.62 2wgg h ALA 325 Ca 0.32 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2wgg h ALA 325 Cb 0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2wgg h ALA 325 CO -0.05 0.67 0.24 0.82 0.00 0.00 0.00 179.25 180.93 2wgg h ILE 326 N 1.00 1.25 -0.39 0.00 2.04 -0.83 -1.61 117.51 118.97 2wgg h ILE 326 Ca 0.19 -0.83 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 2wgg h ILE 326 Cb 0.50 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2wgg h ILE 326 CO 0.02 0.33 0.11 0.03 0.00 0.00 0.00 178.15 178.63 2wgg h ARG 327 N 1.00 0.61 -0.75 2.37 3.08 -1.11 -0.02 114.38 119.56 2wgg h ARG 327 Ca 0.23 -0.14 0.14 0.00 0.07 0.00 0.00 59.98 60.27 2wgg h ARG 327 Cb 0.26 -0.08 -0.09 0.00 0.08 0.00 0.00 29.97 30.14 2wgg h ARG 327 CO -0.01 0.63 0.31 0.28 -1.07 0.00 0.00 179.97 180.11 2wgg h VAL 328 N 0.48 0.67 0.00 2.04 2.07 -1.00 0.20 116.25 120.72 2wgg h VAL 328 Ca 0.12 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2wgg h VAL 328 Cb 0.29 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 2wgg h VAL 328 CO -0.00 0.08 0.00 0.00 0.02 0.00 0.00 177.57 177.67 2wgg n ALA 329 N -2.50 2.12 -2.20 1.67 0.00 -0.62 -4.90 120.51 114.08 2wgg n ALA 329 Ca 0.14 -0.09 -0.05 0.00 0.00 0.00 0.00 53.44 53.44 2wgg n ALA 329 Cb 0.40 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.48 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 0.79 0.23 0.65 0.00 0.00 0.06 -4.68 105.19 102.24 2wgg n GLY 330 Ca 0.08 -0.65 0.07 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.31 0.00 0.02 0.00 5.75 -1.24 -1.60 116.55 119.16 2wgg n ASP 332 Ca 0.16 -0.18 0.13 0.00 -0.01 0.00 0.00 54.79 54.89 2wgg n ASP 332 Cb 0.67 -0.27 0.38 0.00 -1.03 0.00 0.00 41.12 40.87 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 -1.27 0.09 -1.91 0.11 1.13 -1.26 -4.44 117.38 109.84 2wgg n GLN 333 Ca 0.14 0.04 -0.34 0.00 -1.94 0.00 0.00 57.00 54.91 2wgg n GLN 333 Cb 0.22 -1.57 0.04 0.00 0.11 0.00 0.00 30.24 29.04 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 -3.04 2.51 0.08 -1.58 0.00 -0.63 -4.93 121.76 114.17 2wgg s ALA 334 Ca 0.11 0.73 -0.30 0.00 0.00 0.00 0.00 51.96 52.50 2wgg s ALA 334 Cb 0.17 -3.36 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 2wgg s ALA 334 CO 0.63 -1.17 1.07 0.00 0.00 0.00 0.00 175.76 176.30 2wgg s ALA 335 N -2.03 3.30 -0.16 0.00 0.00 -0.68 -4.33 121.76 117.86 2wgg s ALA 335 Ca 0.71 0.71 -0.02 0.00 0.00 0.00 0.00 51.96 53.36 2wgg s ALA 335 Cb -0.24 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.51 2wgg s ALA 335 CO 0.36 -0.25 -0.10 0.08 0.00 0.00 0.00 175.76 175.85 2wgg s VAL 336 N 0.52 3.20 -0.07 0.00 1.01 0.46 -1.72 120.40 123.80 2wgg s VAL 336 Ca 0.52 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.94 2wgg s VAL 336 Cb -0.26 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.71 2wgg s VAL 336 CO 0.30 0.49 -0.14 -0.47 0.00 0.00 0.00 175.10 175.29 2wgg s TYR 337 N 0.69 2.72 -0.55 5.22 5.04 -0.82 -1.04 117.35 128.60 2wgg s TYR 337 Ca -0.05 -0.28 0.04 0.00 -2.44 0.00 0.00 57.07 54.34 2wgg s TYR 337 Cb -0.15 -1.68 0.14 0.00 0.35 0.00 0.00 41.96 40.62 2wgg s TYR 337 CO 0.02 0.09 0.31 0.00 -1.34 0.00 0.00 175.55 174.63 2wgg s ALA 338 N -0.48 3.27 0.20 3.97 0.00 -1.26 -0.00 121.76 127.46 2wgg s ALA 338 Ca 0.06 -3.32 0.35 0.00 0.00 0.00 0.00 51.96 49.05 2wgg s ALA 338 Cb -0.12 -2.12 1.71 0.00 0.00 0.00 0.00 23.12 22.59 2wgg s ALA 338 CO 0.02 -2.04 2.05 -1.00 0.00 0.00 0.00 175.76 174.79 2wgg h PRO 339 N 6.25 0.00 0.00 0.00 0.13 -1.88 -1.83 132.00 134.66 2wgg h PRO 339 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2wgg h PRO 339 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 2wgg h PRO 339 CO 0.67 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.07 2wgg n LYS 340 N -2.83 0.10 0.25 0.86 5.02 -1.26 -1.67 118.16 118.63 2wgg n LYS 340 Ca -0.01 0.45 0.11 0.00 -2.02 0.00 0.00 58.31 56.84 2wgg n LYS 340 Cb 0.16 -1.74 0.67 0.00 -0.02 0.00 0.00 35.03 34.09 2wgg n LYS 340 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2wgg h SER 341 N 0.00 0.00 0.00 4.39 4.64 -1.59 -1.91 113.55 119.08 2wgg h SER 341 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 2wgg h SER 341 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 2wgg h SER 341 CO 0.00 0.14 -1.30 0.00 -0.87 0.00 0.00 176.83 174.80 2wgg n ALA 342 N -2.32 1.89 0.89 5.18 0.00 -0.70 -4.56 120.51 120.89 2wgg n ALA 342 Ca -0.02 -0.25 0.09 0.00 0.00 0.00 0.00 53.44 53.26 2wgg n ALA 342 Cb 0.25 0.28 -0.11 0.00 0.00 0.00 0.00 19.45 19.87 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 -2.43 0.89 0.00 0.00 7.99 -0.67 -0.45 117.00 122.33 2wgg n LEU 343 Ca -0.08 -0.49 0.00 0.00 -0.01 0.00 0.00 56.01 55.43 2wgg n LEU 343 Cb 0.62 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.93 2wgg n LEU 343 CO 0.07 0.22 0.00 0.61 -1.51 0.00 0.00 177.39 176.78 2wgg n GLY 344 N 1.45 -0.37 3.25 -0.72 0.00 -0.72 -3.93 105.19 104.16 2wgg n GLY 344 Ca 0.03 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.68 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 0.00 3.03 -0.24 1.61 2.46 0.57 -4.43 115.29 118.30 2wgg s HIS 345 Ca 0.00 -1.28 0.14 0.00 0.47 0.00 0.00 55.06 54.39 2wgg s HIS 345 Cb 0.00 -2.10 0.64 0.00 -0.13 0.00 0.00 32.58 30.99 2wgg s HIS 345 CO 0.00 -0.65 1.59 -1.13 -2.47 0.00 0.00 174.74 172.07 2wgg n SER 346 N 4.74 4.38 0.00 9.88 3.41 -1.19 -2.28 113.62 132.56 2wgg n SER 346 Ca -0.17 -3.12 0.00 0.00 -0.26 0.00 0.00 58.87 55.32 2wgg n SER 346 Cb 0.48 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 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 -0.24 0.00 0.26 -1.33 2.08 -1.26 -2.06 119.36 116.80 2wgg n ILE 347 Ca 0.28 0.00 0.09 0.00 0.56 0.00 0.00 62.75 63.68 2wgg n ILE 347 Cb 1.09 0.00 0.66 0.00 -0.75 0.00 0.00 39.64 40.64 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 1.20 7.39 0.00 -1.82 -2.92 103.07 106.92 2wgg h GLY 348 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2wgg h GLY 348 CO 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 176.54 175.82 2wgg h ALA 349 N 1.92 0.60 -0.15 3.60 0.00 -1.48 -1.37 119.26 122.39 2wgg h ALA 349 Ca -0.00 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 2wgg h ALA 349 Cb 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2wgg h ALA 349 CO 0.01 0.00 -0.47 -0.24 0.00 0.00 0.00 179.25 178.55 2wgg h VAL 350 N 0.00 1.32 0.00 0.00 3.04 -1.62 -2.02 116.25 116.97 2wgg h VAL 350 Ca 0.00 -1.67 -0.08 0.00 -1.01 0.00 0.00 66.70 63.95 2wgg h VAL 350 Cb 0.90 1.72 -0.01 0.00 -2.01 0.00 0.00 31.29 31.89 2wgg h VAL 350 CO 0.00 0.51 -0.36 1.23 -1.01 0.00 0.00 177.57 177.93 2wgg h GLY 351 N 1.20 0.00 1.02 3.17 0.00 -1.78 -1.25 103.07 105.44 2wgg h GLY 351 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.11 2wgg h GLY 351 CO 0.08 0.00 -0.97 0.00 0.00 0.00 0.00 176.54 175.65 2wgg h ALA 352 N 1.64 0.02 -0.33 3.60 0.00 -1.48 -1.41 119.26 121.29 2wgg h ALA 352 Ca -0.00 -0.69 0.05 0.00 0.00 0.00 0.00 54.91 54.26 2wgg h ALA 352 Cb 0.75 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 2wgg h ALA 352 CO 0.05 0.55 0.07 1.25 0.00 0.00 0.00 179.25 181.16 2wgg h LEU 353 N 0.10 0.03 -0.94 0.00 5.85 -1.28 -1.68 115.31 117.38 2wgg h LEU 353 Ca -0.14 0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.53 2wgg h LEU 353 Cb 1.67 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.76 2wgg h LEU 353 CO 0.19 0.05 -0.46 -0.33 -0.34 0.00 0.00 178.44 177.55 2wgg h GLU 354 N 0.19 0.00 -0.49 1.25 5.08 -1.25 -1.88 114.58 117.48 2wgg h GLU 354 Ca 0.15 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.42 2wgg h GLU 354 Cb 0.16 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2wgg h GLU 354 CO -0.20 0.46 -0.06 0.77 -1.00 0.00 0.00 179.01 178.98 2wgg h SER 355 N 0.00 0.85 0.02 1.42 0.02 -1.05 -1.28 113.55 113.54 2wgg h SER 355 Ca -0.00 -0.24 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2wgg h SER 355 Cb 0.92 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.23 2wgg h SER 355 CO 0.06 0.95 -0.04 0.58 -1.14 0.00 0.00 176.83 177.24 2wgg h VAL 356 N 0.79 0.91 -0.75 2.27 2.07 -0.72 -1.54 116.25 119.28 2wgg h VAL 356 Ca 0.14 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.67 2wgg h VAL 356 Cb 0.56 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 2wgg h VAL 356 CO 0.03 0.00 0.49 -0.07 0.02 0.00 0.00 177.57 178.05 2wgg h LEU 357 N -0.08 0.85 -0.33 2.57 3.38 -1.25 -0.35 115.31 120.09 2wgg h LEU 357 Ca 0.01 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2wgg h LEU 357 Cb 0.09 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2wgg h LEU 357 CO -0.02 0.61 0.16 0.74 0.09 0.00 0.00 178.44 180.01 2wgg h THR 358 N 1.00 1.16 -0.35 0.22 2.02 -1.10 -0.31 112.91 115.55 2wgg h THR 358 Ca 0.28 -0.45 0.07 0.00 0.77 0.00 0.00 66.41 67.07 2wgg h THR 358 Cb -0.09 0.85 -0.06 0.00 -1.74 0.00 0.00 68.15 67.10 2wgg h THR 358 CO -0.06 0.17 -0.08 0.58 0.37 0.00 0.00 175.52 176.50 2wgg h VAL 359 N 0.40 0.67 -0.47 3.16 2.07 -0.45 -2.51 116.25 119.11 2wgg h VAL 359 Ca 0.11 -0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.55 2wgg h VAL 359 Cb 0.12 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 2wgg h VAL 359 CO -0.01 0.00 -0.04 -0.07 0.02 0.00 0.00 177.57 177.47 2wgg h LEU 360 N 0.01 0.79 -0.55 2.57 3.38 -0.85 0.11 115.31 120.77 2wgg h LEU 360 Ca 0.17 -0.21 0.10 0.00 0.09 0.00 0.00 57.88 58.03 2wgg h LEU 360 Cb 0.25 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 40.71 2wgg h LEU 360 CO -0.35 0.88 0.10 0.74 0.09 0.00 0.00 178.44 179.90 2wgg h THR 361 N 0.75 0.66 -0.22 0.22 2.02 -0.96 0.14 112.91 115.52 2wgg h THR 361 Ca 0.14 -0.08 -0.18 0.00 0.77 0.00 0.00 66.41 67.05 2wgg h THR 361 Cb 0.51 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 2wgg h THR 361 CO 0.03 0.04 -0.58 -0.07 0.37 0.00 0.00 175.52 175.31 2wgg h LEU 362 N 0.23 0.90 -1.16 2.58 3.38 -1.19 0.11 115.31 120.16 2wgg h LEU 362 Ca 0.28 -0.57 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 2wgg h LEU 362 Cb 0.41 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2wgg h LEU 362 CO -0.38 1.31 0.32 -0.09 0.09 0.00 0.00 178.44 179.69 2wgg h ARG 363 N 0.53 0.91 -0.07 1.13 2.43 -0.67 -3.24 114.38 115.40 2wgg h ARG 363 Ca -0.01 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 2wgg h ARG 363 Cb 1.20 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 2wgg h ARG 363 CO 0.13 0.69 0.00 -0.25 -1.51 0.00 0.00 179.97 179.03 2wgg n ASP 364 N -4.36 2.20 -3.90 -3.80 8.00 0.47 -5.00 116.55 110.16 2wgg n ASP 364 Ca 0.06 -1.60 -0.30 0.00 0.71 0.00 0.00 54.79 53.67 2wgg n ASP 364 Cb 0.12 -0.04 0.03 0.00 -0.02 0.00 0.00 41.12 41.21 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 0.70 -0.48 3.11 0.44 0.00 0.36 -4.95 105.19 104.37 2wgg n GLY 365 Ca 0.08 0.19 -0.11 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 -3.34 0.08 -0.12 1.61 0.11 -0.94 -1.61 120.40 116.18 2wgg s VAL 366 Ca 0.60 -0.63 0.01 0.00 -2.93 0.00 0.00 61.98 59.03 2wgg s VAL 366 Cb -0.30 -0.42 0.02 0.00 -1.53 0.00 0.00 36.38 34.14 2wgg s VAL 366 CO 0.83 -0.35 -0.14 -0.63 -3.33 0.00 0.00 175.10 171.48 2wgg s ILE 367 N -1.27 1.49 1.06 7.04 1.01 -0.77 -4.09 121.20 125.66 2wgg s ILE 367 Ca -0.14 -0.62 -0.12 0.00 0.00 0.00 0.00 60.65 59.78 2wgg s ILE 367 Cb -0.07 -1.38 0.22 0.00 0.01 0.00 0.00 42.46 41.25 2wgg s ILE 367 CO 0.02 0.44 1.07 -2.84 0.00 0.00 0.00 174.94 173.62 2wgg s PRO 368 N 1.18 -0.07 0.21 2.79 0.02 -1.26 -1.15 135.00 136.72 2wgg s PRO 368 Ca -0.02 0.94 -0.30 0.00 0.02 0.00 0.00 61.00 61.64 2wgg s PRO 368 Cb -0.14 -1.64 -0.08 0.00 0.02 0.00 0.00 34.50 32.65 2wgg s PRO 368 CO -0.05 -3.18 0.93 -1.25 -0.33 0.00 0.00 177.00 173.12 2wgg s PRO 369 N -4.63 4.81 -0.28 5.54 0.04 -1.26 -4.71 135.00 134.51 2wgg s PRO 369 Ca 0.67 1.46 -0.29 0.00 0.04 0.00 0.00 61.00 62.88 2wgg s PRO 369 Cb -0.23 -3.29 -0.01 0.00 0.04 0.00 0.00 34.50 31.00 2wgg s PRO 369 CO 0.61 0.48 1.57 0.99 0.04 0.00 0.00 177.00 180.69 2wgg s THR 370 N -0.99 3.75 0.67 1.26 2.01 0.63 -4.92 115.64 118.05 2wgg s THR 370 Ca 0.41 0.82 -0.16 0.00 0.31 0.00 0.00 61.69 63.07 2wgg s THR 370 Cb -0.25 -3.84 0.01 0.00 0.01 0.00 0.00 72.50 68.42 2wgg s THR 370 CO 0.31 -0.42 1.20 -0.76 -0.69 0.00 0.00 174.62 174.26 2wgg s LEU 371 N 5.45 3.45 0.00 4.42 1.43 -1.26 -3.71 118.68 128.46 2wgg s LEU 371 Ca 0.69 2.33 0.00 0.00 -1.03 0.00 0.00 54.13 56.12 2wgg s LEU 371 Cb -0.21 -4.59 0.00 0.00 0.03 0.00 0.00 46.19 41.42 2wgg s LEU 371 CO 0.30 -1.95 0.00 0.59 0.23 0.00 0.00 176.35 175.52 2wgg n ASN 372 N -2.28 -3.94 -4.48 2.29 3.02 -1.26 -4.65 115.26 103.95 2wgg n ASN 372 Ca 0.13 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.25 2wgg n ASN 372 Cb 0.50 -1.53 -0.03 0.00 -0.61 0.00 0.00 39.78 38.11 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 -1.69 2.75 0.00 3.10 5.04 -1.24 -4.71 117.35 120.60 2wgg s TYR 373 Ca 0.00 -0.84 0.00 0.00 -2.44 0.00 0.00 57.07 53.79 2wgg s TYR 373 Cb 0.00 -4.41 0.00 0.00 0.35 0.00 0.00 41.96 37.90 2wgg s TYR 373 CO 0.00 -1.70 0.00 0.39 -1.34 0.00 0.00 175.55 172.90 2wgg n GLU 374 N 7.74 3.16 -3.85 4.97 1.02 -1.26 -4.86 120.64 127.55 2wgg n GLU 374 Ca 0.14 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.98 2wgg n GLU 374 Cb 0.48 -0.90 -0.16 0.00 -0.02 0.00 0.00 31.44 30.85 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 -1.79 1.24 0.53 2.62 2.01 -1.26 -5.07 115.64 113.92 2wgg s THR 375 Ca 0.00 -1.27 -0.20 0.00 0.31 0.00 0.00 61.69 60.53 2wgg s THR 375 Cb 0.00 -1.71 -0.07 0.00 0.01 0.00 0.00 72.50 70.72 2wgg s THR 375 CO 0.00 -0.34 0.90 -2.65 -0.69 0.00 0.00 174.62 171.84 2wgg n PRO 376 N 4.75 0.98 -3.90 4.92 -0.02 -1.26 -0.55 135.00 139.92 2wgg n PRO 376 Ca -0.07 0.37 -0.35 0.00 -2.02 0.00 0.00 63.50 61.43 2wgg n PRO 376 Cb 0.44 -2.04 -0.13 0.00 -0.02 0.00 0.00 33.50 31.75 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 -1.06 4.65 0.51 2.55 -1.08 -1.25 -4.56 116.67 116.43 2wgg s ASP 377 Ca 0.70 -0.30 0.24 0.00 -0.52 0.00 0.00 52.55 52.67 2wgg s ASP 377 Cb -0.47 -1.81 1.38 0.00 -1.46 0.00 0.00 42.92 40.56 2wgg s ASP 377 CO 0.52 -0.01 2.08 1.55 0.52 0.00 0.00 175.17 179.83 2wgg h PRO 378 N 8.03 0.00 -0.00 4.34 0.13 -1.94 -0.62 132.00 141.94 2wgg h PRO 378 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2wgg h PRO 378 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2wgg h PRO 378 CO 0.60 0.12 -0.14 0.39 -0.23 0.00 0.00 178.00 178.74 2wgg n GLU 379 N -3.90 0.63 -0.00 0.86 -0.58 -1.26 -3.99 120.64 112.40 2wgg n GLU 379 Ca -0.02 -0.23 -0.00 0.00 -0.42 0.00 0.00 57.16 56.48 2wgg n GLU 379 Cb 0.21 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 29.58 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 0.57 0.00 -4.93 -3.67 1.08 -1.48 -3.46 117.51 105.61 2wgg h ILE 380 Ca 0.00 -0.08 -0.24 0.00 -0.39 0.00 0.00 64.86 64.16 2wgg h ILE 380 Cb 0.39 0.00 0.15 0.00 -3.07 0.00 0.00 36.82 34.28 2wgg h ILE 380 CO 0.00 0.00 -0.65 -0.67 -0.69 0.00 0.00 178.15 176.14 2wgg n ASP 381 N -2.27 -3.61 -4.32 1.72 2.03 -1.12 -4.85 116.55 104.12 2wgg n ASP 381 Ca -0.00 -0.53 -0.18 0.00 0.52 0.00 0.00 54.79 54.60 2wgg n ASP 381 Cb 0.01 -4.22 -0.10 0.00 -0.72 0.00 0.00 41.12 36.08 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 -5.23 2.53 -1.15 -2.67 1.43 -1.26 -5.04 118.68 107.28 2wgg s LEU 382 Ca 0.16 -0.98 -0.17 0.00 -1.03 0.00 0.00 54.13 52.10 2wgg s LEU 382 Cb -0.02 -0.62 0.11 0.00 0.03 0.00 0.00 46.19 45.70 2wgg s LEU 382 CO 0.59 -0.18 1.46 -0.62 0.23 0.00 0.00 176.35 177.83 2wgg s ASP 383 N -3.15 6.83 -0.16 2.29 2.15 -1.26 -4.97 116.67 118.39 2wgg s ASP 383 Ca 0.20 -2.40 -0.25 0.00 0.43 0.00 0.00 52.55 50.52 2wgg s ASP 383 Cb -0.01 -2.48 -0.02 0.00 -0.30 0.00 0.00 42.92 40.12 2wgg s ASP 383 CO 0.05 -1.05 0.83 -0.69 -0.17 0.00 0.00 175.17 174.14 2wgg s VAL 384 N 3.11 4.88 -0.05 1.11 1.01 -1.26 -0.41 120.40 128.80 2wgg s VAL 384 Ca 0.45 1.63 -0.30 0.00 0.00 0.00 0.00 61.98 63.76 2wgg s VAL 384 Cb -0.01 -4.14 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 2wgg s VAL 384 CO -0.01 0.03 1.45 -0.69 0.00 0.00 0.00 175.10 175.89 2wgg s VAL 385 N 2.10 3.78 0.19 2.92 1.01 -0.21 -4.88 120.40 125.30 2wgg s VAL 385 Ca 0.38 1.06 -0.14 0.00 0.00 0.00 0.00 61.98 63.28 2wgg s VAL 385 Cb -0.17 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.54 2wgg s VAL 385 CO 0.13 -0.05 0.44 0.00 0.00 0.00 0.00 175.10 175.62 2wgg s ALA 386 N 3.12 -0.57 0.00 5.51 0.00 -1.26 -0.27 121.76 128.29 2wgg s ALA 386 Ca 0.65 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.11 2wgg s ALA 386 Cb -0.30 0.87 0.00 0.00 0.00 0.00 0.00 23.12 23.69 2wgg s ALA 386 CO 0.25 -0.76 0.00 0.41 0.00 0.00 0.00 175.76 175.66 2wgg n GLY 387 N -0.30 2.08 3.17 0.00 0.00 -1.26 -4.80 105.19 104.07 2wgg n GLY 387 Ca -0.08 -0.25 -0.11 0.00 0.00 0.00 0.00 46.02 45.59 2wgg n GLY 387 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wgg s GLU 388 N 0.00 0.84 0.90 1.61 8.01 -1.26 -4.93 118.70 123.87 2wgg s GLU 388 Ca 0.00 -1.34 -0.11 0.00 0.01 0.00 0.00 54.97 53.53 2wgg s GLU 388 Cb 0.00 -0.20 0.14 0.00 -4.31 0.00 0.00 34.13 29.76 2wgg s GLU 388 CO 0.00 -0.02 1.14 -2.30 0.01 0.00 0.00 175.26 174.09 2wgg n PRO 389 N -0.05 -0.36 -4.06 0.39 -0.02 -1.26 -4.29 135.00 125.34 2wgg n PRO 389 Ca -0.12 -0.04 -0.32 0.00 -2.02 0.00 0.00 63.50 61.01 2wgg n PRO 389 Cb 0.61 -2.38 -0.15 0.00 -0.02 0.00 0.00 33.50 31.56 2wgg n PRO 389 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2wgg s ARG 390 N -4.53 2.37 0.45 -0.52 3.52 -0.30 -4.95 118.95 114.99 2wgg s ARG 390 Ca 0.68 -1.12 -0.19 0.00 -0.13 0.00 0.00 55.73 54.97 2wgg s ARG 390 Cb -0.24 -2.72 -0.10 0.00 -1.56 0.00 0.00 34.95 30.33 2wgg s ARG 390 CO 0.57 -0.46 0.94 0.71 -0.81 0.00 0.00 175.30 176.26 2wgg s TYR 391 N 1.21 3.37 -0.03 5.12 2.02 -1.26 -1.85 117.35 125.92 2wgg s TYR 391 Ca -0.04 1.52 -0.31 0.00 -0.37 0.00 0.00 57.07 57.87 2wgg s TYR 391 Cb -0.18 -2.80 0.13 0.00 -0.40 0.00 0.00 41.96 38.71 2wgg s TYR 391 CO -0.08 -0.19 1.31 0.20 -1.57 0.00 0.00 175.55 175.23 2wgg s GLY 392 N -2.53 -0.43 -1.25 0.71 0.00 -0.64 -4.99 107.32 98.20 2wgg s GLY 392 Ca 0.60 0.76 -0.09 0.00 0.00 0.00 0.00 44.72 45.99 2wgg s GLY 392 CO 0.20 0.14 1.78 1.34 0.00 0.00 0.00 173.10 176.56 2wgg n ASP 393 N -0.48 5.28 -4.61 1.64 2.03 -1.26 -4.57 116.55 114.58 2wgg n ASP 393 Ca -0.09 -3.14 -0.42 0.00 0.52 0.00 0.00 54.79 51.66 2wgg n ASP 393 Cb 0.63 -1.46 -0.04 0.00 -0.72 0.00 0.00 41.12 39.53 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 0.05 3.12 -0.19 -0.67 2.02 -1.26 -4.90 117.35 115.53 2wgg s TYR 394 Ca 0.39 0.80 0.18 0.00 -0.37 0.00 0.00 57.07 58.07 2wgg s TYR 394 Cb 0.08 -3.52 -0.25 0.00 -0.40 0.00 0.00 41.96 37.87 2wgg s TYR 394 CO 0.02 -0.75 0.10 0.54 -1.57 0.00 0.00 175.55 173.89 2wgg n ARG 395 N 6.60 0.69 -3.81 -0.62 1.74 -1.26 -4.56 116.66 115.44 2wgg n ARG 395 Ca 0.06 -0.01 -0.12 0.00 -0.77 0.00 0.00 57.85 57.01 2wgg n ARG 395 Cb 0.48 -1.53 -0.11 0.00 -1.02 0.00 0.00 32.46 30.28 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 -2.52 -0.16 0.03 -1.55 2.02 -1.26 -0.51 117.35 113.40 2wgg s TYR 396 Ca -0.10 0.36 -0.10 0.00 -0.37 0.00 0.00 57.07 56.86 2wgg s TYR 396 Cb 0.06 0.05 0.01 0.00 -0.40 0.00 0.00 41.96 41.68 2wgg s TYR 396 CO 0.83 -0.20 0.20 0.00 -1.57 0.00 0.00 175.55 174.82 2wgg s ALA 397 N -0.47 -0.41 -0.12 3.71 0.00 -0.52 -1.09 121.76 122.86 2wgg s ALA 397 Ca -0.06 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 51.70 2wgg s ALA 397 Cb -0.04 0.25 -0.01 0.00 0.00 0.00 0.00 23.12 23.32 2wgg s ALA 397 CO 0.01 -0.34 -0.15 0.08 0.00 0.00 0.00 175.76 175.36 2wgg s VAL 398 N -2.37 2.89 -0.25 0.00 1.01 0.67 -1.09 120.40 121.27 2wgg s VAL 398 Ca -0.07 -0.72 -0.12 0.00 0.00 0.00 0.00 61.98 61.07 2wgg s VAL 398 Cb -0.02 -2.20 -0.05 0.00 0.00 0.00 0.00 36.38 34.12 2wgg s VAL 398 CO -0.03 0.53 0.22 0.21 0.00 0.00 0.00 175.10 176.04 2wgg s ASN 399 N 0.34 6.14 -0.08 3.32 2.47 -0.37 -0.04 114.94 126.71 2wgg s ASN 399 Ca -0.12 0.15 -0.07 0.00 0.42 0.00 0.00 52.86 53.24 2wgg s ASN 399 Cb -0.16 -2.14 -0.04 0.00 -1.45 0.00 0.00 41.25 37.46 2wgg s ASN 399 CO 0.06 -0.02 0.17 0.20 -3.72 0.00 0.00 177.10 173.80 2wgg s ASN 400 N 1.34 6.42 -0.04 -4.21 0.01 -0.65 -1.09 114.94 116.72 2wgg s ASN 400 Ca 0.10 0.48 -0.04 0.00 -0.71 0.00 0.00 52.86 52.69 2wgg s ASN 400 Cb -0.15 -2.07 0.01 0.00 0.41 0.00 0.00 41.25 39.45 2wgg s ASN 400 CO 0.07 0.37 0.10 -0.44 -1.51 0.00 0.00 177.10 175.69 2wgg s SER 401 N -1.26 -0.09 0.08 -1.22 0.01 -0.04 -3.30 113.70 107.87 2wgg s SER 401 Ca 0.19 0.16 0.03 0.00 1.31 0.00 0.00 55.95 57.65 2wgg s SER 401 Cb -0.12 0.21 -0.03 0.00 0.21 0.00 0.00 66.02 66.29 2wgg s SER 401 CO 0.08 -0.07 -0.10 -0.36 0.41 0.00 0.00 173.24 173.20 2wgg s PHE 402 N -0.09 0.98 0.04 2.43 0.08 -1.26 -0.22 117.98 119.94 2wgg s PHE 402 Ca -0.01 -0.59 -0.03 0.00 0.12 0.00 0.00 56.93 56.41 2wgg s PHE 402 Cb -0.01 -0.55 -0.02 0.00 -0.57 0.00 0.00 43.02 41.86 2wgg s PHE 402 CO 0.00 -0.02 0.03 0.20 -0.10 0.00 0.00 175.22 175.34 2wgg s GLY 403 N -2.12 0.29 0.26 4.36 0.00 -0.62 -2.83 107.32 106.67 2wgg s GLY 403 Ca 0.00 -0.81 -0.30 0.00 0.00 0.00 0.00 44.72 43.62 2wgg s GLY 403 CO 0.00 -0.93 1.23 0.69 0.00 0.00 0.00 173.10 174.10 2wgg n PHE 404 N 0.61 1.79 0.00 1.90 3.72 -1.26 -1.99 117.46 122.24 2wgg n PHE 404 Ca -0.18 0.57 0.00 0.00 -0.05 0.00 0.00 57.45 57.80 2wgg n PHE 404 Cb 0.59 -2.36 0.00 0.00 -0.94 0.00 0.00 39.48 36.77 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 1.60 0.62 1.47 1.37 0.00 0.32 -4.59 105.19 105.97 2wgg n GLY 405 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.29 0.73 3.76 -0.02 0.00 -0.84 -4.78 105.19 102.75 2wgg n GLY 406 Ca 0.00 -0.69 -0.40 0.00 0.00 0.00 0.00 46.02 44.93 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 3.76 -0.19 1.61 3.76 -0.99 -0.29 115.29 120.95 2wgg s HIS 407 Ca 0.00 1.44 0.01 0.00 -0.15 0.00 0.00 55.06 56.36 2wgg s HIS 407 Cb 0.00 -2.75 0.03 0.00 1.11 0.00 0.00 32.58 30.97 2wgg s HIS 407 CO 0.00 0.35 -0.15 -0.80 -0.85 0.00 0.00 174.74 173.28 2wgg s ASN 408 N -0.32 3.24 -0.16 1.40 0.01 -0.82 -1.59 114.94 116.70 2wgg s ASN 408 Ca 0.36 -0.76 0.02 0.00 -0.71 0.00 0.00 52.86 51.77 2wgg s ASN 408 Cb -0.20 -1.36 0.01 0.00 0.41 0.00 0.00 41.25 40.11 2wgg s ASN 408 CO 0.22 -0.07 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.84 2wgg s VAL 409 N 1.34 2.05 -0.07 1.60 1.01 0.69 -1.85 120.40 125.17 2wgg s VAL 409 Ca 0.02 -0.95 0.05 0.00 0.00 0.00 0.00 61.98 61.10 2wgg s VAL 409 Cb -0.15 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.40 2wgg s VAL 409 CO -0.10 0.54 -0.24 0.00 0.00 0.00 0.00 175.10 175.30 2wgg s ALA 410 N 1.05 2.07 -0.11 5.51 0.00 -0.45 -0.86 121.76 128.96 2wgg s ALA 410 Ca -0.01 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 51.01 2wgg s ALA 410 Cb -0.14 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.30 2wgg s ALA 410 CO -0.07 0.37 -0.23 -0.51 0.00 0.00 0.00 175.76 175.31 2wgg s LEU 411 N -0.01 2.09 -0.28 0.00 1.43 -0.25 -0.36 118.68 121.31 2wgg s LEU 411 Ca -0.07 -0.58 -0.12 0.00 -1.03 0.00 0.00 54.13 52.33 2wgg s LEU 411 Cb -0.14 -1.42 -0.04 0.00 0.03 0.00 0.00 46.19 44.61 2wgg s LEU 411 CO 0.05 0.13 0.25 0.00 0.23 0.00 0.00 176.35 177.00 2wgg s ALA 412 N 0.52 3.54 0.15 4.21 0.00 0.40 -1.24 121.76 129.34 2wgg s ALA 412 Ca -0.14 -1.05 0.08 0.00 0.00 0.00 0.00 51.96 50.85 2wgg s ALA 412 Cb -0.17 -2.56 -0.04 0.00 0.00 0.00 0.00 23.12 20.34 2wgg s ALA 412 CO 0.05 -0.63 -0.11 -0.06 0.00 0.00 0.00 175.76 175.01 2wgg s PHE 413 N 1.84 2.65 0.07 0.00 0.08 -0.25 -0.56 117.98 121.82 2wgg s PHE 413 Ca 0.09 -0.21 0.06 0.00 0.12 0.00 0.00 56.93 56.99 2wgg s PHE 413 Cb -0.16 -1.33 -0.03 0.00 -0.57 0.00 0.00 43.02 40.93 2wgg s PHE 413 CO 0.11 0.47 -0.16 0.20 -0.10 0.00 0.00 175.22 175.74 2wgg s GLY 414 N -2.57 0.96 0.50 4.36 0.00 -0.49 -1.44 107.32 108.65 2wgg s GLY 414 Ca 0.23 -1.04 -0.23 0.00 0.00 0.00 0.00 44.72 43.68 2wgg s GLY 414 CO 0.14 -1.05 1.33 -1.60 0.00 0.00 0.00 173.10 171.93 2wgg s ARG 415 N -1.66 3.40 0.00 2.90 3.52 0.33 -0.16 118.95 127.29 2wgg s ARG 415 Ca 0.01 2.18 0.28 0.00 -0.13 0.00 0.00 55.73 58.08 2wgg s ARG 415 Cb -0.10 -2.39 1.06 0.00 -1.56 0.00 0.00 34.95 31.96 2wgg s ARG 415 CO 0.03 -0.97 1.75 0.98 -0.81 0.00 0.00 175.30 176.28