#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wge s GLN 3 N 0.00 4.20 0.45 4.33 -1.52 -1.26 -5.03 119.66 120.83 2wge s GLN 3 Ca 0.00 0.91 -0.25 0.00 -1.95 0.00 0.00 55.36 54.07 2wge s GLN 3 Cb 0.00 -2.53 -0.08 0.00 -0.22 0.00 0.00 33.01 30.18 2wge s GLN 3 CO 0.00 0.19 1.44 -0.35 -0.25 0.00 0.00 175.29 176.31 2wge n PRO 4 N -0.04 2.27 -4.07 2.91 -0.04 -1.26 -4.97 135.00 129.80 2wge n PRO 4 Ca 0.03 0.81 -0.10 0.00 -0.04 0.00 0.00 63.50 64.20 2wge n PRO 4 Cb 0.52 -2.64 -0.08 0.00 -0.04 0.00 0.00 33.50 31.26 2wge n PRO 4 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2wge s SER 5 N -0.46 0.15 0.12 3.54 1.04 -1.26 -4.84 113.70 111.99 2wge s SER 5 Ca 0.61 -1.07 -0.15 0.00 0.48 0.00 0.00 55.95 55.82 2wge s SER 5 Cb -0.45 0.39 -0.02 0.00 0.10 0.00 0.00 66.02 66.04 2wge s SER 5 CO 0.58 -0.84 1.59 0.74 0.98 0.00 0.00 173.24 176.28 2wge h THR 6 N 2.66 1.25 -0.59 2.02 2.02 -1.20 -0.88 112.91 118.19 2wge h THR 6 Ca -0.33 -0.93 -0.01 0.00 0.77 0.00 0.00 66.41 65.90 2wge h THR 6 Cb 1.22 1.08 -0.03 0.00 -1.74 0.00 0.00 68.15 68.68 2wge h THR 6 CO 0.52 0.32 0.31 0.00 0.37 0.00 0.00 175.52 177.04 2wge h ALA 7 N 0.91 1.43 -0.24 6.16 0.00 -1.61 -2.46 119.26 123.44 2wge h ALA 7 Ca 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2wge h ALA 7 Cb 0.42 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2wge h ALA 7 CO 0.01 0.46 0.00 0.27 0.00 0.00 0.00 179.25 179.99 2wge n ASN 8 N -4.38 2.10 0.00 0.00 0.23 -1.20 -4.93 115.26 107.08 2wge n ASN 8 Ca 0.05 -1.81 0.00 0.00 -0.53 0.00 0.00 54.58 52.30 2wge n ASN 8 Cb 0.11 -0.16 0.00 0.00 -2.08 0.00 0.00 39.78 37.65 2wge n ASN 8 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wge n GLY 9 N 1.21 0.80 0.22 4.83 0.00 -0.93 -4.86 105.19 106.45 2wge n GLY 9 Ca 0.16 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.23 2wge n GLY 9 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wge h GLY 10 N 0.00 0.00 -4.43 -0.02 0.00 -1.42 -3.41 103.07 93.79 2wge h GLY 10 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.66 2wge h GLY 10 CO 0.00 0.00 -0.73 -1.36 0.00 0.00 0.00 176.54 174.45 2wge s PHE 11 N -4.58 2.77 0.71 5.60 0.08 -0.93 -4.74 117.98 116.89 2wge s PHE 11 Ca -0.04 -0.13 -0.15 0.00 0.12 0.00 0.00 56.93 56.74 2wge s PHE 11 Cb 0.16 -1.49 0.03 0.00 -0.57 0.00 0.00 43.02 41.15 2wge s PHE 11 CO 0.70 0.40 1.16 -1.25 -0.10 0.00 0.00 175.22 176.13 2wge s PRO 12 N -1.94 2.36 0.11 0.24 0.04 -1.26 -4.61 135.00 129.94 2wge s PRO 12 Ca 0.20 1.59 -0.31 0.00 0.04 0.00 0.00 61.00 62.52 2wge s PRO 12 Cb -0.11 -1.88 -0.07 0.00 0.04 0.00 0.00 34.50 32.48 2wge s PRO 12 CO 0.12 -1.63 1.27 0.45 0.04 0.00 0.00 177.00 177.25 2wge s SER 13 N -2.30 6.98 -0.10 6.66 0.15 -1.26 -4.94 113.70 118.89 2wge s SER 13 Ca 0.71 2.18 0.04 0.00 0.70 0.00 0.00 55.95 59.57 2wge s SER 13 Cb -0.25 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.47 2wge s SER 13 CO 0.44 -0.52 -0.22 -0.69 1.20 0.00 0.00 173.24 173.45 2wge s VAL 14 N 0.85 1.91 0.18 4.45 1.01 -1.26 -0.73 120.40 126.82 2wge s VAL 14 Ca 0.60 -0.93 0.11 0.00 0.00 0.00 0.00 61.98 61.75 2wge s VAL 14 Cb -0.33 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 2wge s VAL 14 CO 0.31 0.53 -0.23 0.68 0.00 0.00 0.00 175.10 176.39 2wge s VAL 15 N 0.43 2.19 -0.23 2.92 -7.23 0.10 -1.40 120.40 117.18 2wge s VAL 15 Ca -0.17 -1.97 -0.16 0.00 -1.81 0.00 0.00 61.98 57.87 2wge s VAL 15 Cb -0.17 -2.03 -0.04 0.00 0.56 0.00 0.00 36.38 34.70 2wge s VAL 15 CO 0.07 -0.15 0.39 -0.69 -0.31 0.00 0.00 175.10 174.41 2wge s VAL 16 N -1.71 5.18 -0.14 1.32 1.01 -0.23 -1.47 120.40 124.36 2wge s VAL 16 Ca 0.19 0.66 0.04 0.00 0.00 0.00 0.00 61.98 62.86 2wge s VAL 16 Cb -0.08 -3.72 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 2wge s VAL 16 CO 0.09 0.20 0.15 0.35 0.00 0.00 0.00 175.10 175.89 2wge n THR 17 N 4.71 0.00 -3.52 3.92 -2.24 -0.29 0.23 114.28 117.10 2wge n THR 17 Ca -0.08 -0.32 -0.14 0.00 -2.27 0.00 0.00 64.05 61.23 2wge n THR 17 Cb 0.51 0.85 -0.04 0.00 -2.10 0.00 0.00 70.33 69.54 2wge n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wge s ALA 18 N -1.62 -1.49 0.01 6.98 0.00 -1.23 -4.79 121.76 119.62 2wge s ALA 18 Ca 0.01 0.69 -0.04 0.00 0.00 0.00 0.00 51.96 52.62 2wge s ALA 18 Cb 0.03 0.47 -0.01 0.00 0.00 0.00 0.00 23.12 23.61 2wge s ALA 18 CO 0.17 -0.56 0.06 0.14 0.00 0.00 0.00 175.76 175.56 2wge s VAL 19 N -2.64 0.08 -0.03 0.00 -7.23 -1.26 -0.91 120.40 108.41 2wge s VAL 19 Ca -0.04 -0.69 -0.11 0.00 -1.81 0.00 0.00 61.98 59.33 2wge s VAL 19 Cb -0.01 -0.32 0.02 0.00 0.56 0.00 0.00 36.38 36.64 2wge s VAL 19 CO -0.03 -0.38 0.25 0.28 -0.31 0.00 0.00 175.10 174.91 2wge s THR 20 N -1.22 0.05 -0.11 5.32 -1.32 -0.29 -4.87 115.64 113.20 2wge s THR 20 Ca -0.13 -0.40 -0.28 0.00 -1.21 0.00 0.00 61.69 59.66 2wge s THR 20 Cb -0.08 -0.50 0.07 0.00 -1.51 0.00 0.00 72.50 70.48 2wge s THR 20 CO 0.00 -0.22 0.67 0.00 -2.21 0.00 0.00 174.62 172.86 2wge s ALA 21 N -0.93 -1.72 -0.10 11.08 0.00 -1.26 -1.50 121.76 127.32 2wge s ALA 21 Ca -0.10 1.47 0.01 0.00 0.00 0.00 0.00 51.96 53.34 2wge s ALA 21 Cb -0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 2wge s ALA 21 CO 0.02 -0.35 -0.12 -0.08 0.00 0.00 0.00 175.76 175.23 2wge s THR 22 N -0.74 3.23 0.28 0.00 -1.32 -0.53 -3.84 115.64 112.72 2wge s THR 22 Ca -0.08 -0.62 0.04 0.00 -1.21 0.00 0.00 61.69 59.82 2wge s THR 22 Cb -0.02 -2.33 -0.03 0.00 -1.51 0.00 0.00 72.50 68.60 2wge s THR 22 CO 0.07 0.55 0.21 0.42 -2.21 0.00 0.00 174.62 173.66 2wge s THR 23 N -0.07 0.07 -0.39 5.08 -4.23 -0.58 -2.18 115.64 113.33 2wge s THR 23 Ca -0.02 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.73 2wge s THR 23 Cb -0.14 -2.50 0.25 0.00 1.34 0.00 0.00 72.50 71.46 2wge s THR 23 CO 0.04 0.00 1.72 -1.54 -0.54 0.00 0.00 174.62 174.30 2wge n SER 24 N -1.03 0.69 -0.04 3.99 3.41 -1.21 -1.74 113.62 117.70 2wge n SER 24 Ca 0.04 0.70 -0.22 0.00 -0.26 0.00 0.00 58.87 59.13 2wge n SER 24 Cb 0.64 -0.83 -0.13 0.00 -0.26 0.00 0.00 64.21 63.63 2wge n SER 24 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2wge n ILE 25 N -2.29 1.69 -3.52 -1.33 5.41 -1.26 -3.87 119.36 114.20 2wge n ILE 25 Ca 0.01 -0.49 -0.14 0.00 1.00 0.00 0.00 62.75 63.13 2wge n ILE 25 Cb 0.20 -1.79 -0.05 0.00 -0.71 0.00 0.00 39.64 37.29 2wge n ILE 25 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2wge s SER 26 N -6.98 -0.54 0.06 4.38 0.15 -1.21 -4.80 113.70 104.76 2wge s SER 26 Ca -0.25 0.44 0.23 0.00 0.70 0.00 0.00 55.95 57.06 2wge s SER 26 Cb 0.07 0.47 0.94 0.00 -1.71 0.00 0.00 66.02 65.79 2wge s SER 26 CO 0.70 -0.60 1.72 -0.81 1.20 0.00 0.00 173.24 175.45 2wge n PRO 27 N 0.52 0.06 -3.71 5.44 -0.04 -1.26 -1.52 135.00 134.49 2wge n PRO 27 Ca -0.15 0.17 -0.38 0.00 -0.04 0.00 0.00 63.50 63.10 2wge n PRO 27 Cb 0.59 -1.59 -0.12 0.00 -0.04 0.00 0.00 33.50 32.34 2wge n PRO 27 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2wge s ASP 28 N -3.39 5.34 0.31 3.54 3.68 -1.26 -4.42 116.67 120.48 2wge s ASP 28 Ca 0.10 -0.42 0.02 0.00 2.13 0.00 0.00 52.55 54.38 2wge s ASP 28 Cb 0.14 -1.96 0.59 0.00 -1.45 0.00 0.00 42.92 40.24 2wge s ASP 28 CO 0.43 -0.13 1.91 -0.29 0.13 0.00 0.00 175.17 177.22 2wge h ILE 29 N 5.64 1.03 0.00 4.11 6.09 -1.85 0.17 117.51 132.70 2wge h ILE 29 Ca -0.34 -0.33 -0.09 0.00 -1.37 0.00 0.00 64.86 62.73 2wge h ILE 29 Cb 1.15 -0.01 -0.01 0.00 0.47 0.00 0.00 36.82 38.43 2wge h ILE 29 CO 0.60 0.17 -0.44 -0.33 -3.07 0.00 0.00 178.15 175.08 2wge h GLU 30 N 0.95 0.00 -0.02 2.19 4.39 -1.94 -1.63 114.58 118.53 2wge h GLU 30 Ca 0.39 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.90 2wge h GLU 30 Cb 0.27 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 2wge h GLU 30 CO -0.15 0.44 -0.82 0.77 -1.16 0.00 0.00 179.01 178.08 2wge h SER 31 N 0.00 0.33 -0.19 1.42 0.02 -1.54 -1.73 113.55 111.87 2wge h SER 31 Ca -0.00 -0.25 0.03 0.00 -0.84 0.00 0.00 61.79 60.72 2wge h SER 31 Cb 0.81 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 2wge h SER 31 CO 0.06 1.02 0.01 0.74 -1.14 0.00 0.00 176.83 177.52 2wge h THR 32 N 0.16 0.88 -0.17 -2.27 2.02 -0.78 -1.56 112.91 111.19 2wge h THR 32 Ca -0.04 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.11 2wge h THR 32 Cb 1.43 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 68.63 2wge h THR 32 CO 0.13 0.01 0.11 -0.25 0.37 0.00 0.00 175.52 175.90 2wge h TRP 33 N 0.08 0.21 -0.66 3.16 -0.00 -1.23 0.15 115.95 117.66 2wge h TRP 33 Ca 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.98 2wge h TRP 33 Cb 0.10 -0.07 -0.03 0.00 -0.00 0.00 0.00 29.16 29.16 2wge h TRP 33 CO -0.16 0.13 0.39 0.87 -0.00 0.00 0.00 178.44 179.67 2wge h LYS 34 N 0.23 0.89 -0.34 2.65 1.57 -1.28 -1.75 116.57 118.54 2wge h LYS 34 Ca 0.06 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 2wge h LYS 34 Cb -0.03 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 2wge h LYS 34 CO -0.01 0.63 0.06 0.78 -0.57 0.00 0.00 179.45 180.34 2wge h GLY 35 N 0.95 0.61 0.66 3.86 0.00 -0.58 -2.00 103.07 106.56 2wge h GLY 35 Ca 0.24 -0.40 0.04 0.00 0.00 0.00 0.00 47.33 47.21 2wge h GLY 35 CO -0.04 0.37 0.09 1.41 0.00 0.00 0.00 176.54 178.36 2wge h LEU 36 N 0.40 0.06 -1.88 3.11 3.38 -0.38 -0.80 115.31 119.20 2wge h LEU 36 Ca 0.10 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2wge h LEU 36 Cb 0.34 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2wge h LEU 36 CO 0.01 0.07 0.08 -0.07 0.09 0.00 0.00 178.44 178.62 2wge h LEU 37 N 0.21 0.14 -0.33 1.67 3.38 -1.21 -0.76 115.31 118.41 2wge h LEU 37 Ca 0.15 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2wge h LEU 37 Cb 0.15 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2wge h LEU 37 CO -0.18 0.10 0.00 0.00 0.09 0.00 0.00 178.44 178.45 2wge n ALA 38 N -2.52 2.61 -1.25 1.53 0.00 -0.76 -4.57 120.51 115.55 2wge n ALA 38 Ca -0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 53.44 53.14 2wge n ALA 38 Cb 0.08 -1.30 -0.01 0.00 0.00 0.00 0.00 19.45 18.22 2wge n ALA 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wge n GLY 39 N 0.96 0.53 3.79 0.00 0.00 -0.29 -5.03 105.19 105.15 2wge n GLY 39 Ca 0.18 -0.93 -0.36 0.00 0.00 0.00 0.00 46.02 44.91 2wge n GLY 39 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wge s GLU 40 N -2.56 4.22 0.01 1.61 2.12 -0.37 -5.02 118.70 118.70 2wge s GLU 40 Ca 0.00 1.44 0.03 0.00 0.36 0.00 0.00 54.97 56.81 2wge s GLU 40 Cb 0.00 -2.53 -0.03 0.00 0.26 0.00 0.00 34.13 31.83 2wge s GLU 40 CO 0.00 -0.08 -0.06 0.45 -0.54 0.00 0.00 175.26 175.03 2wge s SER 41 N -1.64 4.66 0.00 -1.70 0.15 -1.26 -4.61 113.70 109.30 2wge s SER 41 Ca 0.57 -0.15 0.19 0.00 0.70 0.00 0.00 55.95 57.27 2wge s SER 41 Cb -0.20 -1.09 0.54 0.00 -1.71 0.00 0.00 66.02 63.55 2wge s SER 41 CO 0.25 0.28 1.43 0.61 1.20 0.00 0.00 173.24 177.01 2wge n GLY 42 N 1.49 1.10 3.67 9.45 0.00 -0.26 -4.92 105.19 115.72 2wge n GLY 42 Ca -0.15 -0.55 -0.37 0.00 0.00 0.00 0.00 46.02 44.95 2wge n GLY 42 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wge s ILE 43 N -1.52 5.34 0.33 -0.61 -1.09 -1.26 -4.14 121.20 118.25 2wge s ILE 43 Ca 0.34 0.26 0.04 0.00 -2.23 0.00 0.00 60.65 59.07 2wge s ILE 43 Cb 0.19 -3.53 -0.03 0.00 -1.58 0.00 0.00 42.46 37.50 2wge s ILE 43 CO 0.26 0.34 0.17 -1.00 -1.23 0.00 0.00 174.94 173.49 2wge s HIS 44 N 1.01 1.66 0.29 3.97 3.76 -0.63 -3.79 115.29 121.56 2wge s HIS 44 Ca 0.09 -1.40 -0.30 0.00 -0.15 0.00 0.00 55.06 53.30 2wge s HIS 44 Cb -0.13 -0.89 -0.11 0.00 1.11 0.00 0.00 32.58 32.55 2wge s HIS 44 CO 0.04 -0.54 1.56 0.00 -0.85 0.00 0.00 174.74 174.96 2wge s ALA 45 N -3.50 3.71 0.06 -1.40 0.00 -1.26 -1.61 121.76 117.75 2wge s ALA 45 Ca 0.34 1.53 -0.30 0.00 0.00 0.00 0.00 51.96 53.53 2wge s ALA 45 Cb 0.04 -3.63 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 2wge s ALA 45 CO 0.19 -0.95 1.11 -0.51 0.00 0.00 0.00 175.76 175.60 2wge s LEU 46 N -0.60 4.39 0.00 0.00 1.43 -0.16 -4.84 118.68 118.90 2wge s LEU 46 Ca 0.62 1.91 0.19 0.00 -1.03 0.00 0.00 54.13 55.81 2wge s LEU 46 Cb -0.47 -3.58 0.22 0.00 0.03 0.00 0.00 46.19 42.39 2wge s LEU 46 CO 0.48 -0.35 1.17 -0.62 0.23 0.00 0.00 176.35 177.26 2wge n GLU 47 N 3.66 1.87 -1.83 1.70 1.02 -1.26 -4.90 120.64 120.90 2wge n GLU 47 Ca 0.07 -1.79 -0.41 0.00 -0.02 0.00 0.00 57.16 55.01 2wge n GLU 47 Cb 0.48 -1.39 -0.00 0.00 -0.02 0.00 0.00 31.44 30.51 2wge n GLU 47 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2wge s ASP 48 N -1.50 6.33 0.51 1.62 1.01 -1.26 -4.89 116.67 118.49 2wge s ASP 48 Ca 0.26 3.01 0.20 0.00 0.71 0.00 0.00 52.55 56.72 2wge s ASP 48 Cb 0.17 -2.67 1.32 0.00 1.01 0.00 0.00 42.92 42.75 2wge s ASP 48 CO 0.25 -0.88 2.10 -0.08 0.21 0.00 0.00 175.17 176.78 2wge h GLU 49 N 2.96 0.00 0.00 8.23 4.22 -2.01 -2.66 114.58 125.32 2wge h GLU 49 Ca -0.51 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 58.91 2wge h GLU 49 Cb 1.24 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.49 2wge h GLU 49 CO 0.64 0.08 -0.12 0.27 -2.18 0.00 0.00 179.01 177.71 2wge h PHE 50 N 0.00 0.00 -0.11 0.92 -5.15 -1.99 0.31 116.94 110.92 2wge h PHE 50 Ca -0.00 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.75 2wge h PHE 50 Cb 0.17 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.33 2wge h PHE 50 CO 0.00 0.12 -0.01 0.28 -2.00 0.00 0.00 178.31 176.70 2wge h VAL 51 N 0.00 1.26 -0.00 0.88 2.07 -1.85 -2.51 116.25 116.10 2wge h VAL 51 Ca -0.00 -0.85 -0.26 0.00 0.82 0.00 0.00 66.70 66.42 2wge h VAL 51 Cb 0.35 1.62 0.02 0.00 -1.52 0.00 0.00 31.29 31.75 2wge h VAL 51 CO 0.01 0.24 -1.02 0.71 0.02 0.00 0.00 177.57 177.54 2wge h THR 52 N -0.09 1.31 -0.66 2.57 1.35 -1.62 0.59 112.91 116.36 2wge h THR 52 Ca 0.03 -2.31 0.14 0.00 -0.55 0.00 0.00 66.41 63.72 2wge h THR 52 Cb 0.38 2.39 -0.10 0.00 -1.73 0.00 0.00 68.15 69.09 2wge h THR 52 CO 0.01 0.71 0.11 0.50 -0.25 0.00 0.00 175.52 176.60 2wge h LYS 53 N 0.35 0.22 -0.09 4.72 3.64 -0.98 -2.37 116.57 122.07 2wge h LYS 53 Ca -0.12 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 2wge h LYS 53 Cb 1.66 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.43 2wge h LYS 53 CO 0.19 0.14 0.00 0.91 -2.27 0.00 0.00 179.45 178.43 2wge n TRP 54 N -5.18 0.08 -4.19 1.91 7.02 -0.95 -4.97 117.44 111.16 2wge n TRP 54 Ca 0.11 -0.04 -0.37 0.00 -1.02 0.00 0.00 57.50 56.19 2wge n TRP 54 Cb 0.39 0.00 -0.05 0.00 -2.42 0.00 0.00 31.31 29.23 2wge n TRP 54 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 2wge n ASP 55 N 1.32 -1.16 -4.75 -0.99 2.03 0.12 -4.85 116.55 108.27 2wge n ASP 55 Ca 0.15 -1.26 -0.40 0.00 0.52 0.00 0.00 54.79 53.80 2wge n ASP 55 Cb 0.59 -1.77 0.02 0.00 -0.72 0.00 0.00 41.12 39.24 2wge n ASP 55 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2wge n LEU 56 N -4.74 5.04 -0.14 -2.67 4.77 -0.72 -4.90 117.00 113.63 2wge n LEU 56 Ca -0.24 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.84 2wge n LEU 56 Cb 0.65 -1.59 0.26 0.00 -2.33 0.00 0.00 43.42 40.41 2wge n LEU 56 CO 0.80 -0.29 1.13 0.00 -1.33 0.00 0.00 177.39 177.70 2wge h ALA 57 N 2.13 1.43 -2.84 -1.18 0.00 -1.93 -3.40 119.26 113.47 2wge h ALA 57 Ca -0.50 -0.10 -0.60 0.00 0.00 0.00 0.00 54.91 53.70 2wge h ALA 57 Cb 1.28 -0.25 -0.11 0.00 0.00 0.00 0.00 17.79 18.71 2wge h ALA 57 CO 0.60 0.47 -0.17 0.08 0.00 0.00 0.00 179.25 180.23 2wge s VAL 58 N -5.55 5.19 -0.08 0.00 1.01 -1.26 -4.84 120.40 114.87 2wge s VAL 58 Ca -0.10 0.76 0.15 0.00 0.00 0.00 0.00 61.98 62.79 2wge s VAL 58 Cb 0.17 -3.75 0.30 0.00 0.00 0.00 0.00 36.38 33.10 2wge s VAL 58 CO 0.78 0.25 1.14 0.29 0.00 0.00 0.00 175.10 177.55 2wge n LYS 59 N 4.45 0.66 -4.06 2.72 5.02 -1.26 -5.01 118.16 120.68 2wge n LYS 59 Ca -0.08 -2.22 -0.08 0.00 -2.02 0.00 0.00 58.31 53.91 2wge n LYS 59 Cb 0.51 -0.82 -0.10 0.00 -0.02 0.00 0.00 35.03 34.59 2wge n LYS 59 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2wge s ILE 60 N -1.39 0.21 0.00 -0.18 -4.36 -1.26 -0.99 121.20 113.22 2wge s ILE 60 Ca 0.27 -1.50 0.00 0.00 -0.26 0.00 0.00 60.65 59.16 2wge s ILE 60 Cb 0.27 -1.09 0.00 0.00 1.25 0.00 0.00 42.46 42.89 2wge s ILE 60 CO -0.07 -0.82 0.00 0.61 0.24 0.00 0.00 174.94 174.91 2wge n GLY 61 N 0.62 1.75 3.07 6.27 0.00 -0.64 -4.70 105.19 111.57 2wge n GLY 61 Ca -0.17 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.48 2wge n GLY 61 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wge s GLY 62 N 0.00 2.05 0.60 -0.02 0.00 -0.06 -1.60 107.32 108.29 2wge s GLY 62 Ca 0.00 -2.65 -0.17 0.00 0.00 0.00 0.00 44.72 41.90 2wge s GLY 62 CO 0.00 1.00 1.10 0.30 0.00 0.00 0.00 173.10 175.50 2wge s HIS 63 N 0.85 2.76 0.26 1.90 3.76 -1.26 0.36 115.29 123.92 2wge s HIS 63 Ca 0.11 1.54 -0.30 0.00 -0.15 0.00 0.00 55.06 56.26 2wge s HIS 63 Cb -0.21 -3.15 -0.14 0.00 1.11 0.00 0.00 32.58 30.19 2wge s HIS 63 CO -0.05 -1.45 1.19 1.28 -0.85 0.00 0.00 174.74 174.86 2wge n LEU 64 N -1.93 2.37 -0.25 0.89 4.77 -1.26 -4.25 117.00 117.33 2wge n LEU 64 Ca 0.10 1.17 0.00 0.00 -0.03 0.00 0.00 56.01 57.25 2wge n LEU 64 Cb 0.52 -1.34 0.12 0.00 -2.33 0.00 0.00 43.42 40.39 2wge n LEU 64 CO 0.46 -0.99 1.10 0.50 -1.33 0.00 0.00 177.39 177.12 2wge h LYS 65 N 2.92 0.68 -4.73 3.23 1.63 -1.45 -3.38 116.57 115.48 2wge h LYS 65 Ca -0.43 -0.04 -0.66 0.00 -0.85 0.00 0.00 60.65 58.67 2wge h LYS 65 Cb 1.31 -0.15 -0.39 0.00 -0.60 0.00 0.00 32.23 32.40 2wge h LYS 65 CO 0.67 0.45 -0.74 0.34 -3.45 0.00 0.00 179.45 176.72 2wge s ASP 66 N -5.58 4.71 0.38 4.20 2.15 -1.26 -4.99 116.67 116.27 2wge s ASP 66 Ca -0.13 -2.00 -0.28 0.00 0.43 0.00 0.00 52.55 50.57 2wge s ASP 66 Cb 0.17 -1.61 -0.11 0.00 -0.30 0.00 0.00 42.92 41.07 2wge s ASP 66 CO 0.77 -0.34 1.48 -2.84 -0.17 0.00 0.00 175.17 174.07 2wge s PRO 67 N 0.94 4.11 0.24 4.34 0.02 -1.26 -4.88 135.00 138.52 2wge s PRO 67 Ca 0.07 2.57 -0.05 0.00 0.02 0.00 0.00 61.00 63.61 2wge s PRO 67 Cb -0.19 -2.97 0.44 0.00 0.02 0.00 0.00 34.50 31.80 2wge s PRO 67 CO -0.07 -0.53 1.72 0.28 -0.33 0.00 0.00 177.00 178.07 2wge h VAL 68 N 2.98 0.64 0.00 3.83 2.07 -1.99 -2.53 116.25 121.25 2wge h VAL 68 Ca -0.51 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.87 2wge h VAL 68 Cb 1.24 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2wge h VAL 68 CO 0.64 0.08 0.00 0.47 0.02 0.00 0.00 177.57 178.78 2wge n ASP 69 N -5.03 0.00 0.09 0.57 8.00 -1.26 -1.35 116.55 117.57 2wge n ASP 69 Ca 0.14 0.45 0.10 0.00 0.71 0.00 0.00 54.79 56.19 2wge n ASP 69 Cb 0.41 -0.48 0.43 0.00 -0.02 0.00 0.00 41.12 41.45 2wge n ASP 69 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2wge n SER 70 N -1.48 0.44 -0.87 -2.24 7.64 -0.95 -1.94 113.62 114.21 2wge n SER 70 Ca 0.06 0.63 0.08 0.00 1.01 0.00 0.00 58.87 60.66 2wge n SER 70 Cb 0.27 -0.72 0.18 0.00 -1.01 0.00 0.00 64.21 62.93 2wge n SER 70 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2wge n HIS 71 N -2.01 0.45 -4.97 1.43 8.25 -0.46 -5.00 115.22 112.92 2wge n HIS 71 Ca 0.02 -0.32 -0.32 0.00 -0.26 0.00 0.00 57.72 56.83 2wge n HIS 71 Cb 0.17 -0.01 -0.15 0.00 1.12 0.00 0.00 29.99 31.11 2wge n HIS 71 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2wge s MET 72 N -1.15 3.20 0.78 -0.41 1.00 -0.82 -5.11 119.30 116.79 2wge s MET 72 Ca 0.30 -0.77 -0.09 0.00 0.00 0.00 0.00 55.69 55.13 2wge s MET 72 Cb 0.17 -2.48 0.17 0.00 0.00 0.00 0.00 34.83 32.69 2wge s MET 72 CO 0.23 0.22 1.06 0.41 0.00 0.00 0.00 175.02 176.94 2wge n GLY 73 N 3.46 -0.67 0.32 -0.03 0.00 -1.26 -4.85 105.19 102.16 2wge n GLY 73 Ca -0.18 -1.82 -0.06 0.00 0.00 0.00 0.00 46.02 43.95 2wge n GLY 73 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2wge h ARG 74 N 0.00 1.12 0.04 1.61 2.43 -1.99 -1.53 114.38 116.05 2wge h ARG 74 Ca -0.34 -0.22 -0.00 0.00 -0.81 0.00 0.00 59.98 58.61 2wge h ARG 74 Cb 1.05 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.43 2wge h ARG 74 CO 0.28 0.93 -0.02 -0.07 -1.51 0.00 0.00 179.97 179.58 2wge h LEU 75 N 1.07 -0.05 -1.13 3.80 3.38 -1.99 -2.26 115.31 118.12 2wge h LEU 75 Ca 0.24 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2wge h LEU 75 Cb 0.25 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 2wge h LEU 75 CO -0.02 0.11 0.35 0.44 0.09 0.00 0.00 178.44 179.42 2wge h ASP 76 N -0.20 0.86 0.19 -0.43 3.32 -1.92 -1.04 116.42 117.20 2wge h ASP 76 Ca -0.01 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 2wge h ASP 76 Cb 0.18 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 2wge h ASP 76 CO 0.01 0.71 -0.13 0.24 -1.72 0.00 0.00 179.24 178.35 2wge h MET 77 N 0.96 0.00 0.00 3.56 2.86 -1.04 -2.40 114.93 118.87 2wge h MET 77 Ca 0.24 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.84 2wge h MET 77 Cb 0.06 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 2wge h MET 77 CO -0.04 0.13 -1.96 0.54 1.06 0.00 0.00 176.91 176.65 2wge n ARG 78 N -4.12 0.66 -0.01 1.72 1.74 -0.87 -4.60 116.66 111.18 2wge n ARG 78 Ca -0.02 -0.15 0.01 0.00 -0.77 0.00 0.00 57.85 56.92 2wge n ARG 78 Cb 0.21 -1.55 0.01 0.00 -1.02 0.00 0.00 32.46 30.11 2wge n ARG 78 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2wge n ARG 79 N -2.36 0.77 -4.06 5.56 1.74 -0.45 -5.01 116.66 112.86 2wge n ARG 79 Ca -0.07 -0.99 -0.13 0.00 -0.77 0.00 0.00 57.85 55.89 2wge n ARG 79 Cb 0.64 -1.03 -0.12 0.00 -1.02 0.00 0.00 32.46 30.93 2wge n ARG 79 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2wge s MET 80 N -0.48 0.49 0.94 5.56 -1.94 -0.91 -4.80 119.30 118.15 2wge s MET 80 Ca 0.02 -0.67 -0.12 0.00 -1.71 0.00 0.00 55.69 53.21 2wge s MET 80 Cb 0.01 -0.25 0.16 0.00 2.01 0.00 0.00 34.83 36.75 2wge s MET 80 CO 0.02 0.04 1.11 -1.54 -0.01 0.00 0.00 175.02 174.64 2wge s SER 81 N -1.40 3.16 0.13 3.03 1.04 -1.26 -4.80 113.70 113.60 2wge s SER 81 Ca -0.09 1.14 -0.19 0.00 0.48 0.00 0.00 55.95 57.29 2wge s SER 81 Cb -0.09 -1.78 -0.04 0.00 0.10 0.00 0.00 66.02 64.20 2wge s SER 81 CO 0.00 -2.79 1.75 0.22 0.98 0.00 0.00 173.24 173.40 2wge h TYR 82 N -1.66 0.12 0.00 5.02 3.20 -1.95 -1.27 116.97 120.43 2wge h TYR 82 Ca -0.52 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.30 2wge h TYR 82 Cb 1.32 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 39.56 2wge h TYR 82 CO 0.32 0.05 -0.28 -0.39 -1.64 0.00 0.00 178.16 176.22 2wge h VAL 83 N 0.16 1.03 -0.46 1.81 -1.51 -1.89 -0.14 116.25 115.24 2wge h VAL 83 Ca 0.09 -1.02 -0.09 0.00 -1.23 0.00 0.00 66.70 64.45 2wge h VAL 83 Cb 0.06 1.58 -0.02 0.00 -2.13 0.00 0.00 31.29 30.78 2wge h VAL 83 CO -0.09 0.27 -0.07 1.56 -1.23 0.00 0.00 177.57 178.01 2wge h GLN 84 N 0.00 0.87 -0.46 5.19 4.20 -1.75 -1.00 115.11 122.15 2wge h GLN 84 Ca -0.00 -0.31 -0.03 0.00 0.06 0.00 0.00 58.65 58.36 2wge h GLN 84 Cb 0.55 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 2wge h GLN 84 CO 0.04 0.95 0.16 0.00 -0.67 0.00 0.00 178.83 179.31 2wge h ARG 85 N 0.71 0.71 -0.60 1.46 3.08 -0.53 0.20 114.38 119.41 2wge h ARG 85 Ca 0.12 -0.14 0.02 0.00 0.07 0.00 0.00 59.98 60.05 2wge h ARG 85 Cb 0.60 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.51 2wge h ARG 85 CO 0.04 0.66 0.38 1.98 -1.07 0.00 0.00 179.97 181.96 2wge h MET 86 N 0.61 0.75 -0.30 0.04 4.05 -1.01 -1.51 114.93 117.56 2wge h MET 86 Ca 0.15 -0.05 0.02 0.00 -0.28 0.00 0.00 59.70 59.55 2wge h MET 86 Cb 0.24 -0.17 -0.03 0.00 -0.80 0.00 0.00 31.60 30.84 2wge h MET 86 CO -0.01 0.50 0.14 0.78 0.23 0.00 0.00 176.91 178.55 2wge h GLY 87 N 0.77 0.40 0.78 1.39 0.00 -0.88 -0.38 103.07 105.14 2wge h GLY 87 Ca 0.23 -0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.50 2wge h GLY 87 CO -0.07 0.07 0.28 1.70 0.00 0.00 0.00 176.54 178.52 2wge h LYS 88 N 0.29 0.54 0.31 4.80 3.64 -0.77 0.38 116.57 125.76 2wge h LYS 88 Ca 0.13 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 2wge h LYS 88 Cb 0.06 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 2wge h LYS 88 CO -0.10 0.36 -0.15 1.25 -2.27 0.00 0.00 179.45 178.54 2wge h LEU 89 N 0.55 -0.36 -0.61 5.20 5.85 -1.02 -2.12 115.31 122.82 2wge h LEU 89 Ca 0.22 -0.08 -0.12 0.00 0.84 0.00 0.00 57.88 58.75 2wge h LEU 89 Cb 0.10 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 2wge h LEU 89 CO -0.13 -0.14 -0.15 -0.07 -0.34 0.00 0.00 178.44 177.61 2wge h LEU 90 N -0.56 0.96 -0.52 2.25 3.38 -0.97 -2.05 115.31 117.79 2wge h LEU 90 Ca -0.04 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 57.64 2wge h LEU 90 Cb 0.41 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 2wge h LEU 90 CO 0.07 1.09 0.29 1.23 0.09 0.00 0.00 178.44 181.21 2wge h GLY 91 N 0.94 0.73 1.02 0.83 0.00 -0.18 -0.52 103.07 105.89 2wge h GLY 91 Ca 0.13 -0.21 -0.07 0.00 0.00 0.00 0.00 47.33 47.18 2wge h GLY 91 CO 0.05 0.15 0.06 -1.33 0.00 0.00 0.00 176.54 175.48 2wge h GLY 92 N 0.56 0.99 0.95 4.60 0.00 -1.26 -1.79 103.07 107.13 2wge h GLY 92 Ca 0.22 -0.68 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 2wge h GLY 92 CO -0.13 0.63 0.13 1.46 0.00 0.00 0.00 176.54 178.63 2wge h GLN 93 N 0.80 0.34 -0.52 4.80 4.20 -1.18 -2.24 115.11 121.31 2wge h GLN 93 Ca 0.16 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.83 2wge h GLN 93 Cb 0.44 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 2wge h GLN 93 CO 0.02 0.31 0.32 1.25 -0.67 0.00 0.00 178.83 180.05 2wge h LEU 94 N 0.28 0.61 -0.80 1.46 5.85 -1.05 -0.87 115.31 120.79 2wge h LEU 94 Ca 0.08 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 2wge h LEU 94 Cb 0.07 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 2wge h LEU 94 CO -0.01 0.47 0.22 -0.25 -0.34 0.00 0.00 178.44 178.52 2wge h TRP 95 N 0.70 1.15 -0.56 1.25 2.91 -1.21 -1.12 115.95 119.07 2wge h TRP 95 Ca 0.19 -0.12 -0.07 0.00 1.13 0.00 0.00 58.89 60.02 2wge h TRP 95 Cb -0.04 -0.33 -0.02 0.00 -0.51 0.00 0.00 29.16 28.26 2wge h TRP 95 CO -0.03 0.92 0.08 1.49 -1.03 0.00 0.00 178.44 179.86 2wge h GLU 96 N 1.07 0.94 0.00 2.65 4.81 -1.23 0.11 114.58 122.93 2wge h GLU 96 Ca 0.23 -0.26 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 2wge h GLU 96 Cb 0.31 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 2wge h GLU 96 CO -0.01 0.91 -0.16 1.03 -0.73 0.00 0.00 179.01 180.05 2wge h SER 97 N 0.83 0.00 -0.02 1.04 0.87 -0.64 -1.43 113.55 114.19 2wge h SER 97 Ca 0.17 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 2wge h SER 97 Cb 0.43 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 2wge h SER 97 CO 0.01 0.16 0.00 0.00 -0.53 0.00 0.00 176.83 176.47 2wge n ALA 98 N -2.44 2.62 -1.14 6.23 0.00 -0.47 -4.89 120.51 120.42 2wge n ALA 98 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2wge n ALA 98 Cb 0.23 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.35 2wge n ALA 98 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wge n GLY 99 N 0.98 0.61 4.07 0.00 0.00 -0.54 -4.37 105.19 105.94 2wge n GLY 99 Ca 0.19 -0.79 -0.30 0.00 0.00 0.00 0.00 46.02 45.12 2wge n GLY 99 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wge n SER 100 N 1.57 -0.67 -4.78 1.61 7.64 -0.01 -4.89 113.62 114.09 2wge n SER 100 Ca 0.00 -1.13 -0.34 0.00 1.01 0.00 0.00 58.87 58.40 2wge n SER 100 Cb 0.18 -2.43 -0.00 0.00 -1.01 0.00 0.00 64.21 60.94 2wge n SER 100 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2wge s PRO 101 N -6.89 3.43 -0.44 1.43 0.04 -1.26 -4.99 135.00 126.32 2wge s PRO 101 Ca 0.09 1.46 -0.18 0.00 0.04 0.00 0.00 61.00 62.41 2wge s PRO 101 Cb -0.04 -2.03 0.03 0.00 0.04 0.00 0.00 34.50 32.50 2wge s PRO 101 CO 0.93 -0.76 0.49 -1.21 0.04 0.00 0.00 177.00 176.50 2wge s GLU 102 N -3.45 3.11 0.34 4.56 2.02 -1.26 -5.06 118.70 118.96 2wge s GLU 102 Ca 0.69 -0.78 0.08 0.00 0.02 0.00 0.00 54.97 54.99 2wge s GLU 102 Cb -0.20 -4.00 -0.04 0.00 0.10 0.00 0.00 34.13 29.99 2wge s GLU 102 CO 0.27 -0.95 0.18 0.14 0.02 0.00 0.00 175.26 174.93 2wge s VAL 103 N 2.27 3.18 -0.29 2.63 -7.23 -1.26 -5.06 120.40 114.63 2wge s VAL 103 Ca 0.13 -1.61 -0.29 0.00 -1.81 0.00 0.00 61.98 58.41 2wge s VAL 103 Cb -0.18 -3.04 -0.01 0.00 0.56 0.00 0.00 36.38 33.71 2wge s VAL 103 CO 0.13 -0.18 1.58 -0.62 -0.31 0.00 0.00 175.10 175.70 2wge s ASP 104 N -3.88 6.28 0.53 4.85 -1.08 -1.26 -4.88 116.67 117.23 2wge s ASP 104 Ca 0.38 1.34 0.22 0.00 -0.52 0.00 0.00 52.55 53.97 2wge s ASP 104 Cb -0.03 -2.53 1.38 0.00 -1.46 0.00 0.00 42.92 40.27 2wge s ASP 104 CO 0.24 -1.38 2.07 -0.65 0.52 0.00 0.00 175.17 175.96 2wge h PRO 105 N 11.08 0.00 0.00 4.34 0.11 -1.94 -0.67 132.00 144.92 2wge h PRO 105 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2wge h PRO 105 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2wge h PRO 105 CO 1.03 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.57 2wge n ASP 106 N -4.37 0.00 -0.29 -2.05 8.00 -1.26 -0.42 116.55 116.16 2wge n ASP 106 Ca 0.04 0.18 0.05 0.00 0.71 0.00 0.00 54.79 55.77 2wge n ASP 106 Cb 0.38 -0.38 0.10 0.00 -0.02 0.00 0.00 41.12 41.20 2wge n ASP 106 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2wge n ARG 107 N -1.38 2.58 -4.04 -1.24 5.12 -0.27 -4.36 116.66 113.08 2wge n ARG 107 Ca 0.09 -2.05 -0.34 0.00 -1.93 0.00 0.00 57.85 53.63 2wge n ARG 107 Cb 0.24 -1.29 -0.15 0.00 -1.16 0.00 0.00 32.46 30.10 2wge n ARG 107 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 2wge s PHE 108 N -1.66 2.96 0.26 -1.55 5.36 -1.01 -0.70 117.98 121.63 2wge s PHE 108 Ca 0.18 -1.62 0.09 0.00 -0.96 0.00 0.00 56.93 54.62 2wge s PHE 108 Cb 0.14 -1.99 -0.04 0.00 -0.34 0.00 0.00 43.02 40.79 2wge s PHE 108 CO 0.06 -0.76 0.07 0.00 -1.46 0.00 0.00 175.22 173.13 2wge s ALA 109 N 1.30 3.32 -0.05 11.12 0.00 -0.55 -1.26 121.76 135.64 2wge s ALA 109 Ca 0.02 -1.57 0.03 0.00 0.00 0.00 0.00 51.96 50.44 2wge s ALA 109 Cb -0.15 -0.97 0.01 0.00 0.00 0.00 0.00 23.12 22.01 2wge s ALA 109 CO -0.08 0.26 -0.13 0.08 0.00 0.00 0.00 175.76 175.89 2wge s VAL 110 N -2.26 1.16 -0.17 0.00 1.01 -0.29 -1.59 120.40 118.27 2wge s VAL 110 Ca 0.32 -0.53 -0.03 0.00 0.00 0.00 0.00 61.98 61.74 2wge s VAL 110 Cb -0.07 -1.04 0.05 0.00 0.00 0.00 0.00 36.38 35.33 2wge s VAL 110 CO 0.22 0.35 0.04 -0.69 0.00 0.00 0.00 175.10 175.02 2wge s VAL 111 N 0.41 0.42 -0.07 2.92 1.01 -0.44 -0.78 120.40 123.87 2wge s VAL 111 Ca -0.10 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.48 2wge s VAL 111 Cb -0.13 -0.89 0.03 0.00 0.00 0.00 0.00 36.38 35.38 2wge s VAL 111 CO 0.03 -0.14 -0.00 -0.69 0.00 0.00 0.00 175.10 174.29 2wge s VAL 112 N 1.91 0.38 0.45 2.92 1.01 -0.57 -1.88 120.40 124.63 2wge s VAL 112 Ca 0.00 0.10 -0.09 0.00 0.00 0.00 0.00 61.98 61.99 2wge s VAL 112 Cb -0.16 -0.52 -0.06 0.00 0.00 0.00 0.00 36.38 35.64 2wge s VAL 112 CO -0.08 0.25 0.81 -0.83 0.00 0.00 0.00 175.10 175.25 2wge s GLY 113 N 1.82 1.80 0.29 4.51 0.00 0.13 -4.35 107.32 111.53 2wge s GLY 113 Ca 0.03 -0.26 0.03 0.00 0.00 0.00 0.00 44.72 44.52 2wge s GLY 113 CO -0.05 -0.06 0.07 -0.51 0.00 0.00 0.00 173.10 172.56 2wge s THR 114 N -2.56 0.90 0.00 0.90 -4.23 -1.26 -1.65 115.64 107.75 2wge s THR 114 Ca 0.51 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 2wge s THR 114 Cb -0.10 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 71.02 2wge s THR 114 CO 0.37 -0.01 0.00 0.61 -0.54 0.00 0.00 174.62 175.05 2wge n GLY 115 N -0.58 1.38 3.27 3.99 0.00 -1.25 -4.62 105.19 107.37 2wge n GLY 115 Ca -0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 2wge n GLY 115 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wge n LEU 116 N 0.00 5.69 0.00 0.99 7.99 -1.26 -4.77 117.00 125.63 2wge n LEU 116 Ca 0.00 -5.08 0.00 0.00 -0.01 0.00 0.00 56.01 50.92 2wge n LEU 116 Cb 0.00 -1.43 0.00 0.00 -0.11 0.00 0.00 43.42 41.88 2wge n LEU 116 CO 0.00 1.42 0.00 0.61 -1.51 0.00 0.00 177.39 177.91 2wge n GLY 117 N 2.39 1.12 3.48 -0.72 0.00 -1.26 -4.85 105.19 105.35 2wge n GLY 117 Ca 0.24 -0.75 -0.17 0.00 0.00 0.00 0.00 46.02 45.34 2wge n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wge n GLY 118 N 0.00 -1.20 0.70 -0.02 0.00 -1.26 -4.68 105.19 98.74 2wge n GLY 118 Ca 0.00 0.52 0.04 0.00 0.00 0.00 0.00 46.02 46.57 2wge n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wge n ALA 119 N -2.77 3.63 0.16 4.61 0.00 -1.26 -4.76 120.51 120.12 2wge n ALA 119 Ca -0.13 -3.12 0.01 0.00 0.00 0.00 0.00 53.44 50.19 2wge n ALA 119 Cb 0.59 -0.48 0.30 0.00 0.00 0.00 0.00 19.45 19.86 2wge n ALA 119 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2wge h GLU 120 N 0.90 0.04 0.00 0.00 9.09 -1.98 -3.36 114.58 119.27 2wge h GLU 120 Ca 0.06 -0.02 -0.00 0.00 0.05 0.00 0.00 59.36 59.45 2wge h GLU 120 Cb 1.21 -0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.31 2wge h GLU 120 CO 0.12 0.46 -0.01 0.00 0.05 0.00 0.00 179.01 179.63 2wge h ARG 121 N 0.03 0.00 -0.34 1.06 2.47 -1.88 -3.22 114.38 112.50 2wge h ARG 121 Ca -0.00 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 58.65 2wge h ARG 121 Cb 0.77 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.08 2wge h ARG 121 CO 0.06 0.01 -0.07 -0.84 0.56 0.00 0.00 179.97 179.69 2wge h ILE 122 N 0.00 1.28 -0.51 2.04 -2.65 -1.92 -3.15 117.51 112.59 2wge h ILE 122 Ca -0.00 -1.11 -0.05 0.00 1.03 0.00 0.00 64.86 64.73 2wge h ILE 122 Cb 0.75 1.30 -0.02 0.00 -2.05 0.00 0.00 36.82 36.80 2wge h ILE 122 CO 0.00 0.36 0.13 0.58 0.03 0.00 0.00 178.15 179.25 2wge h VAL 123 N 0.43 1.24 -0.25 0.16 2.07 -1.82 -2.56 116.25 115.52 2wge h VAL 123 Ca 0.09 -0.84 0.05 0.00 0.82 0.00 0.00 66.70 66.81 2wge h VAL 123 Cb 0.56 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2wge h VAL 123 CO 0.03 0.31 0.18 -0.08 0.02 0.00 0.00 177.57 178.02 2wge h GLU 124 N 0.70 0.13 -0.05 1.57 4.81 -1.63 -1.92 114.58 118.19 2wge h GLU 124 Ca 0.16 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.29 2wge h GLU 124 Cb 0.32 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.68 2wge h GLU 124 CO 0.00 0.09 -0.32 0.77 -0.73 0.00 0.00 179.01 178.82 2wge h SER 125 N 0.13 0.38 -0.37 1.04 0.02 -1.42 -2.62 113.55 110.70 2wge h SER 125 Ca 0.11 -0.67 0.08 0.00 -0.84 0.00 0.00 61.79 60.47 2wge h SER 125 Cb 0.28 -0.11 -0.09 0.00 0.14 0.00 0.00 62.40 62.63 2wge h SER 125 CO -0.02 0.98 -0.26 1.88 -1.14 0.00 0.00 176.83 178.28 2wge h TYR 126 N -0.21 -0.70 -0.30 3.45 0.05 -1.17 -2.51 116.97 115.60 2wge h TYR 126 Ca -0.02 0.05 0.05 0.00 0.05 0.00 0.00 58.73 58.86 2wge h TYR 126 Cb 0.99 0.36 -0.05 0.00 1.01 0.00 0.00 36.73 39.04 2wge h TYR 126 CO 0.14 -0.33 -0.02 -0.44 -1.05 0.00 0.00 178.16 176.45 2wge h ASP 127 N -0.20 -0.16 -0.92 3.88 3.32 -1.39 0.20 116.42 121.15 2wge h ASP 127 Ca 0.18 0.07 0.19 0.00 0.02 0.00 0.00 57.03 57.49 2wge h ASP 127 Cb 0.49 0.14 -0.11 0.00 0.22 0.00 0.00 39.33 40.07 2wge h ASP 127 CO -0.49 -0.05 0.49 -0.07 -1.72 0.00 0.00 179.24 177.40 2wge h LEU 128 N 0.06 0.55 0.11 1.55 4.07 -1.23 -2.47 115.31 117.95 2wge h LEU 128 Ca 0.14 0.12 -0.23 0.00 0.08 0.00 0.00 57.88 57.99 2wge h LEU 128 Cb 0.20 0.04 0.02 0.00 1.08 0.00 0.00 40.66 42.00 2wge h LEU 128 CO -0.26 0.15 -0.96 -0.03 -1.08 0.00 0.00 178.44 176.26 2wge h MET 129 N 0.58 0.46 -0.93 1.13 4.05 -0.75 -0.29 114.93 119.19 2wge h MET 129 Ca 0.54 -0.64 0.12 0.00 -0.28 0.00 0.00 59.70 59.45 2wge h MET 129 Cb 0.91 0.22 -0.09 0.00 -0.80 0.00 0.00 31.60 31.84 2wge h MET 129 CO -0.43 1.27 0.56 -0.91 0.23 0.00 0.00 176.91 177.63 2wge h ASN 130 N -0.04 0.79 0.00 1.39 -0.26 -0.44 0.26 115.58 117.28 2wge h ASN 130 Ca -0.15 0.06 -0.04 0.00 -0.56 0.00 0.00 56.30 55.61 2wge h ASN 130 Cb 1.69 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 38.85 2wge h ASN 130 CO 0.18 0.40 -0.28 0.00 -1.06 0.00 0.00 177.43 176.68 2wge h ALA 131 N 1.53 0.04 -0.01 -0.83 0.00 -1.48 -3.42 119.26 115.09 2wge h ALA 131 Ca 0.47 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2wge h ALA 131 Cb 0.52 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2wge h ALA 131 CO -0.29 0.19 -0.51 0.41 0.00 0.00 0.00 179.25 179.05 2wge n GLY 132 N 1.64 -0.06 0.00 0.00 0.00 -0.12 -5.10 105.19 101.55 2wge n GLY 132 Ca -0.10 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.30 2wge n GLY 132 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wge n GLY 133 N 1.40 -0.81 0.32 -0.02 0.00 0.08 -4.30 105.19 101.87 2wge n GLY 133 Ca 0.08 -1.69 0.14 0.00 0.00 0.00 0.00 46.02 44.56 2wge n GLY 133 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wge h PRO 134 N 0.00 0.00 0.00 1.61 0.13 -1.91 0.20 132.00 132.03 2wge h PRO 134 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2wge h PRO 134 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2wge h PRO 134 CO 0.00 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.31 2wge n ARG 135 N -4.44 0.37 0.00 0.86 1.74 -1.26 -2.69 116.66 111.24 2wge n ARG 135 Ca 0.04 0.07 0.12 0.00 -0.77 0.00 0.00 57.85 57.31 2wge n ARG 135 Cb 0.36 -1.50 0.18 0.00 -1.02 0.00 0.00 32.46 30.48 2wge n ARG 135 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2wge n LYS 136 N -1.23 1.10 -2.35 5.56 4.01 0.71 -4.89 118.16 121.09 2wge n LYS 136 Ca 0.11 -0.81 -0.36 0.00 -0.51 0.00 0.00 58.31 56.74 2wge n LYS 136 Cb 0.14 -1.48 -0.01 0.00 -0.51 0.00 0.00 35.03 33.17 2wge n LYS 136 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2wge s VAL 137 N -2.46 3.32 0.35 -0.18 1.01 -1.09 -4.70 120.40 116.65 2wge s VAL 137 Ca 0.22 0.91 -0.21 0.00 0.00 0.00 0.00 61.98 62.90 2wge s VAL 137 Cb 0.19 -3.42 -0.10 0.00 0.00 0.00 0.00 36.38 33.05 2wge s VAL 137 CO 0.53 -0.09 0.87 -0.55 0.00 0.00 0.00 175.10 175.86 2wge s SER 138 N -1.62 7.01 0.06 3.32 0.15 -1.26 -4.92 113.70 116.43 2wge s SER 138 Ca 0.66 1.59 0.11 0.00 0.70 0.00 0.00 55.95 59.02 2wge s SER 138 Cb -0.24 -2.49 0.50 0.00 -1.71 0.00 0.00 66.02 62.07 2wge s SER 138 CO 0.29 -0.20 1.35 -2.65 1.20 0.00 0.00 173.24 173.23 2wge n PRO 139 N -0.09 0.03 0.00 5.44 -0.02 -1.26 -1.37 135.00 137.73 2wge n PRO 139 Ca 0.04 0.38 0.14 0.00 -2.02 0.00 0.00 63.50 62.04 2wge n PRO 139 Cb 0.52 -1.58 0.55 0.00 -0.02 0.00 0.00 33.50 32.98 2wge n PRO 139 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wge n LEU 140 N -1.64 0.78 -0.30 2.45 4.77 -1.26 -4.41 117.00 117.39 2wge n LEU 140 Ca 0.02 -0.16 -0.01 0.00 -0.03 0.00 0.00 56.01 55.83 2wge n LEU 140 Cb 0.11 -0.12 0.11 0.00 -2.33 0.00 0.00 43.42 41.19 2wge n LEU 140 CO 0.09 0.14 1.19 0.00 -1.33 0.00 0.00 177.39 177.48 2wge h ALA 141 N 3.79 1.10 -0.32 -1.18 0.00 -1.60 -3.04 119.26 118.01 2wge h ALA 141 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2wge h ALA 141 Cb 0.40 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2wge h ALA 141 CO 0.00 0.31 0.10 0.28 0.00 0.00 0.00 179.25 179.94 2wge h VAL 142 N 0.99 1.20 0.00 0.00 2.07 -1.80 -1.87 116.25 116.84 2wge h VAL 142 Ca 0.34 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 2wge h VAL 142 Cb 0.07 1.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 2wge h VAL 142 CO -0.13 0.22 -0.13 0.06 0.02 0.00 0.00 177.57 177.61 2wge h GLN 143 N 0.36 0.00 0.00 1.57 3.07 -1.84 -1.35 115.11 116.91 2wge h GLN 143 Ca 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.83 2wge h GLN 143 Cb 0.24 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.80 2wge h GLN 143 CO -0.00 0.13 -0.65 0.52 0.09 0.00 0.00 178.83 178.92 2wge h MET 144 N 0.00 0.00 0.00 0.06 2.86 -1.34 -3.38 114.93 113.13 2wge h MET 144 Ca -0.00 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.32 2wge h MET 144 Cb 0.44 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.04 2wge h MET 144 CO 0.02 0.05 -2.24 -0.89 1.06 0.00 0.00 176.91 174.91 2wge n ILE 145 N -2.87 1.18 -1.86 -1.22 5.41 -0.75 -4.49 119.36 114.76 2wge n ILE 145 Ca 0.01 -0.76 -0.42 0.00 1.00 0.00 0.00 62.75 62.58 2wge n ILE 145 Cb 0.57 -0.47 -0.02 0.00 -0.71 0.00 0.00 39.64 39.01 2wge n ILE 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2wge s MET 146 N -2.50 4.18 0.05 0.38 0.23 -0.54 -4.85 119.30 116.23 2wge s MET 146 Ca -0.09 2.47 0.19 0.00 -1.03 0.00 0.00 55.69 57.24 2wge s MET 146 Cb 0.06 -3.06 0.81 0.00 -1.53 0.00 0.00 34.83 31.10 2wge s MET 146 CO 0.76 -0.57 1.61 -0.35 -2.03 0.00 0.00 175.02 174.44 2wge n PRO 147 N 2.47 0.04 -0.01 3.16 -0.04 -1.26 -1.12 135.00 138.24 2wge n PRO 147 Ca 0.09 0.22 0.09 0.00 -0.04 0.00 0.00 63.50 63.86 2wge n PRO 147 Cb 0.38 -1.57 0.51 0.00 -0.04 0.00 0.00 33.50 32.79 2wge n PRO 147 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2wge n ASN 148 N -1.64 0.19 -0.33 3.54 6.94 -1.26 -4.56 115.26 118.13 2wge n ASN 148 Ca 0.04 -1.47 -0.03 0.00 -0.02 0.00 0.00 54.58 53.10 2wge n ASN 148 Cb 0.23 -0.01 0.09 0.00 -2.36 0.00 0.00 39.78 37.72 2wge n ASN 148 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 2wge h GLY 149 N 5.39 1.26 0.63 4.83 0.00 -1.42 -1.31 103.07 112.45 2wge h GLY 149 Ca 0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 47.33 46.84 2wge h GLY 149 CO 0.00 0.48 -0.00 0.00 0.00 0.00 0.00 176.54 177.01 2wge h ALA 150 N 1.31 -0.01 -0.91 3.60 0.00 -1.84 -0.64 119.26 120.77 2wge h ALA 150 Ca 0.32 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 55.09 2wge h ALA 150 Cb -0.11 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 2wge h ALA 150 CO -0.07 -0.32 0.60 0.00 0.00 0.00 0.00 179.25 179.46 2wge h ALA 151 N 0.60 1.45 -0.43 0.00 0.00 -1.80 -2.22 119.26 116.86 2wge h ALA 151 Ca -0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2wge h ALA 151 Cb 0.37 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2wge h ALA 151 CO 0.00 0.45 0.23 0.00 0.00 0.00 0.00 179.25 179.93 2wge h ALA 152 N 1.48 0.55 -0.42 0.00 0.00 -1.02 0.73 119.26 120.58 2wge h ALA 152 Ca 0.37 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.22 2wge h ALA 152 Cb 0.07 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2wge h ALA 152 CO -0.12 0.07 0.23 0.28 0.00 0.00 0.00 179.25 179.71 2wge h VAL 153 N 0.56 1.00 -0.37 0.00 2.07 -0.87 -0.99 116.25 117.65 2wge h VAL 153 Ca 0.15 -0.16 -0.08 0.00 0.82 0.00 0.00 66.70 67.44 2wge h VAL 153 Cb 0.06 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2wge h VAL 153 CO -0.02 0.08 -0.07 0.40 0.02 0.00 0.00 177.57 177.98 2wge h ILE 154 N 0.46 1.27 -0.99 4.57 2.04 -1.14 0.07 117.51 123.79 2wge h ILE 154 Ca 0.18 -1.13 0.05 0.00 1.00 0.00 0.00 64.86 64.96 2wge h ILE 154 Cb 0.06 1.25 -0.06 0.00 -0.74 0.00 0.00 36.82 37.33 2wge h ILE 154 CO -0.11 0.37 0.64 1.23 0.00 0.00 0.00 178.15 180.29 2wge h GLY 155 N 0.51 1.48 1.13 5.37 0.00 -0.62 -1.23 103.07 109.70 2wge h GLY 155 Ca 0.10 -0.48 -0.21 0.00 0.00 0.00 0.00 47.33 46.74 2wge h GLY 155 CO 0.03 0.37 -0.73 -2.00 0.00 0.00 0.00 176.54 174.21 2wge h LEU 156 N 1.19 0.91 -0.52 3.11 5.85 -1.00 0.14 115.31 124.99 2wge h LEU 156 Ca 0.41 -0.63 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 2wge h LEU 156 Cb 0.11 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 2wge h LEU 156 CO -0.15 1.39 0.26 -0.61 -0.34 0.00 0.00 178.44 178.99 2wge h GLN 157 N 0.49 0.74 0.00 1.25 4.15 -0.73 -3.22 115.11 117.80 2wge h GLN 157 Ca -0.05 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.27 2wge h GLN 157 Cb 1.36 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.91 2wge h GLN 157 CO 0.15 0.60 -1.14 1.28 -1.93 0.00 0.00 178.83 177.79 2wge n LEU 158 N -4.61 0.76 -0.74 -2.39 4.77 -0.49 -5.01 117.00 109.29 2wge n LEU 158 Ca 0.02 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.67 2wge n LEU 158 Cb 0.11 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2wge n LEU 158 CO 0.37 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 2wge n GLY 159 N 1.45 0.63 3.58 -0.72 0.00 -0.09 -5.04 105.19 105.00 2wge n GLY 159 Ca 0.03 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 2wge n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wge s ALA 160 N -2.84 3.48 -0.69 4.61 0.00 -0.45 -4.49 121.76 121.39 2wge s ALA 160 Ca 0.00 -0.73 0.07 0.00 0.00 0.00 0.00 51.96 51.30 2wge s ALA 160 Cb 0.00 -3.18 0.18 0.00 0.00 0.00 0.00 23.12 20.12 2wge s ALA 160 CO 0.00 -1.26 1.10 0.54 0.00 0.00 0.00 175.76 176.14 2wge n ARG 161 N 6.05 2.43 -0.86 0.00 1.74 0.44 -4.55 116.66 121.90 2wge n ARG 161 Ca -0.00 -1.72 -0.05 0.00 -0.77 0.00 0.00 57.85 55.30 2wge n ARG 161 Cb 0.49 -1.18 0.24 0.00 -1.02 0.00 0.00 32.46 30.99 2wge n ARG 161 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wge n ALA 162 N 0.23 4.32 0.00 7.54 0.00 -0.39 -4.78 120.51 127.44 2wge n ALA 162 Ca 0.07 -2.69 0.00 0.00 0.00 0.00 0.00 53.44 50.82 2wge n ALA 162 Cb 0.34 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.79 2wge n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wge n GLY 163 N -0.72 3.38 2.82 0.00 0.00 -1.26 -4.53 105.19 104.88 2wge n GLY 163 Ca 0.37 -1.49 -0.29 0.00 0.00 0.00 0.00 46.02 44.61 2wge n GLY 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wge s VAL 164 N -0.80 0.99 0.11 1.61 1.01 -1.25 -1.14 120.40 120.93 2wge s VAL 164 Ca 0.00 -0.98 0.10 0.00 0.00 0.00 0.00 61.98 61.10 2wge s VAL 164 Cb 0.00 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 2wge s VAL 164 CO 0.00 -0.25 -0.25 -0.32 0.00 0.00 0.00 175.10 174.28 2wge s MET 165 N 1.63 1.57 -0.27 2.72 1.75 0.04 -4.95 119.30 121.78 2wge s MET 165 Ca -0.01 -1.26 -0.02 0.00 -1.25 0.00 0.00 55.69 53.14 2wge s MET 165 Cb -0.18 -1.97 0.09 0.00 2.84 0.00 0.00 34.83 35.62 2wge s MET 165 CO -0.10 0.47 0.10 0.99 -0.65 0.00 0.00 175.02 175.82 2wge s THR 166 N -1.03 0.46 0.17 10.11 2.01 -1.26 -1.51 115.64 124.59 2wge s THR 166 Ca 0.14 -0.97 -0.23 0.00 0.31 0.00 0.00 61.69 60.95 2wge s THR 166 Cb -0.10 -1.27 -0.08 0.00 0.01 0.00 0.00 72.50 71.06 2wge s THR 166 CO 0.06 -0.58 0.73 -2.16 -0.69 0.00 0.00 174.62 171.98 2wge s PRO 167 N 1.85 4.43 -0.16 4.92 0.04 -1.26 -5.00 135.00 139.81 2wge s PRO 167 Ca 0.07 1.02 0.01 0.00 0.04 0.00 0.00 61.00 62.14 2wge s PRO 167 Cb -0.17 -3.14 0.02 0.00 0.04 0.00 0.00 34.50 31.25 2wge s PRO 167 CO -0.25 0.53 -0.18 0.14 0.04 0.00 0.00 177.00 177.28 2wge s VAL 168 N -1.25 1.89 -0.30 -0.36 -7.23 -1.26 -3.99 120.40 107.89 2wge s VAL 168 Ca 0.37 -0.84 0.18 0.00 -1.81 0.00 0.00 61.98 59.88 2wge s VAL 168 Cb -0.21 -1.72 0.46 0.00 0.56 0.00 0.00 36.38 35.48 2wge s VAL 168 CO 0.24 0.51 1.25 -1.54 -0.31 0.00 0.00 175.10 175.25 2wge n SER 169 N 4.58 0.31 0.00 4.85 3.41 -1.26 -5.00 113.62 120.51 2wge n SER 169 Ca -0.20 -2.21 0.00 0.00 -0.26 0.00 0.00 58.87 56.21 2wge n SER 169 Cb 0.50 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 2wge n SER 169 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wge n ALA 170 N -0.83 0.00 0.30 7.33 0.00 -1.26 -2.19 120.51 123.85 2wge n ALA 170 Ca -0.01 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.60 2wge n ALA 170 Cb 0.83 0.00 0.86 0.00 0.00 0.00 0.00 19.45 21.14 2wge n ALA 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wge n SER 172 N -2.84 2.40 -0.31 0.00 3.41 -0.93 -4.26 113.62 111.09 2wge n SER 172 Ca -0.01 -1.82 -0.01 0.00 -0.26 0.00 0.00 58.87 56.77 2wge n SER 172 Cb 0.16 -0.13 0.16 0.00 -0.26 0.00 0.00 64.21 64.13 2wge n SER 172 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2wge h SER 173 N 3.26 1.04 -0.20 4.04 0.02 -1.50 0.14 113.55 120.37 2wge h SER 173 Ca 0.00 -0.04 -0.14 0.00 -0.84 0.00 0.00 61.79 60.77 2wge h SER 173 Cb 0.71 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 2wge h SER 173 CO 0.00 0.77 -0.38 1.23 -1.14 0.00 0.00 176.83 177.31 2wge h GLY 174 N 1.22 0.79 0.98 -3.77 0.00 -1.49 -0.96 103.07 99.84 2wge h GLY 174 Ca 0.33 -0.79 -0.13 0.00 0.00 0.00 0.00 47.33 46.73 2wge h GLY 174 CO -0.07 0.71 -0.36 1.76 0.00 0.00 0.00 176.54 178.58 2wge h SER 175 N 0.60 0.75 -0.68 0.19 0.02 -1.65 -3.10 113.55 109.69 2wge h SER 175 Ca 0.05 -0.51 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2wge h SER 175 Cb 0.92 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.21 2wge h SER 175 CO 0.08 1.12 0.45 -0.08 -1.14 0.00 0.00 176.83 177.26 2wge h GLU 176 N 0.41 0.90 -0.50 3.45 4.81 -0.59 -0.68 114.58 122.38 2wge h GLU 176 Ca 0.03 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.26 2wge h GLU 176 Cb 0.95 -0.20 -0.05 0.00 0.63 0.00 0.00 28.75 30.08 2wge h GLU 176 CO 0.08 0.61 0.21 0.00 -0.73 0.00 0.00 179.01 179.17 2wge h ALA 177 N 1.56 0.63 -0.86 2.92 0.00 -1.18 -1.06 119.26 121.27 2wge h ALA 177 Ca 0.25 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 2wge h ALA 177 Cb -0.10 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2wge h ALA 177 CO -0.05 -0.18 0.42 0.82 0.00 0.00 0.00 179.25 180.26 2wge h ILE 178 N 0.40 1.26 -0.22 0.00 2.04 -1.28 -1.54 117.51 118.18 2wge h ILE 178 Ca 0.23 -0.72 0.03 0.00 1.00 0.00 0.00 64.86 65.41 2wge h ILE 178 Cb 0.22 0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 2wge h ILE 178 CO -0.21 0.31 0.01 0.00 0.00 0.00 0.00 178.15 178.26 2wge h ALA 179 N 1.24 0.20 -0.27 1.87 0.00 -0.59 -1.01 119.26 120.69 2wge h ALA 179 Ca 0.30 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 55.15 2wge h ALA 179 Cb 0.11 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2wge h ALA 179 CO -0.04 -0.41 -0.28 0.45 0.00 0.00 0.00 179.25 178.97 2wge h HIS 180 N 0.09 0.63 -0.43 0.00 3.86 -1.07 -1.68 115.15 116.55 2wge h HIS 180 Ca 0.10 -0.15 -0.00 0.00 -1.16 0.00 0.00 60.37 59.16 2wge h HIS 180 Cb 0.12 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 2wge h HIS 180 CO -0.17 0.78 0.26 0.00 0.86 0.00 0.00 177.93 179.66 2wge h ALA 181 N 1.22 0.55 -0.23 2.45 0.00 -1.08 -0.24 119.26 121.93 2wge h ALA 181 Ca 0.06 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2wge h ALA 181 Cb 0.73 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2wge h ALA 181 CO 0.06 0.05 0.12 2.35 0.00 0.00 0.00 179.25 181.83 2wge h TRP 182 N 0.58 0.23 -0.69 0.00 7.01 -0.92 -2.10 115.95 120.06 2wge h TRP 182 Ca 0.16 0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.25 2wge h TRP 182 Cb -0.00 -0.07 -0.07 0.00 -2.10 0.00 0.00 29.16 26.92 2wge h TRP 182 CO -0.03 0.14 0.35 0.00 -2.79 0.00 0.00 178.44 176.10 2wge h ARG 183 N 0.26 0.59 -0.83 2.65 3.08 -1.08 -0.44 114.38 118.62 2wge h ARG 183 Ca 0.09 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2wge h ARG 183 Cb 0.01 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 29.88 2wge h ARG 183 CO -0.05 0.39 0.53 0.37 -1.07 0.00 0.00 179.97 180.14 2wge h GLN 184 N 0.61 1.11 0.04 0.04 5.75 -0.79 -0.17 115.11 121.69 2wge h GLN 184 Ca 0.33 -0.08 -0.00 0.00 -0.15 0.00 0.00 58.65 58.75 2wge h GLN 184 Cb 0.31 -0.24 0.00 0.00 1.07 0.00 0.00 27.48 28.62 2wge h GLN 184 CO -0.24 0.75 -0.02 0.82 -2.65 0.00 0.00 178.83 177.49 2wge h ILE 185 N 1.13 1.37 0.00 2.39 2.04 -1.00 -0.17 117.51 123.28 2wge h ILE 185 Ca 0.30 -1.50 -0.05 0.00 1.00 0.00 0.00 64.86 64.61 2wge h ILE 185 Cb -0.09 2.34 -0.01 0.00 -0.74 0.00 0.00 36.82 38.33 2wge h ILE 185 CO -0.06 0.37 -0.21 -0.37 0.00 0.00 0.00 178.15 177.87 2wge h VAL 186 N -0.73 0.68 -0.00 1.67 -1.51 -0.93 -0.36 116.25 115.06 2wge h VAL 186 Ca -0.00 -0.93 0.00 0.00 -1.23 0.00 0.00 66.70 64.54 2wge h VAL 186 Cb 0.64 1.59 0.00 0.00 -2.13 0.00 0.00 31.29 31.39 2wge h VAL 186 CO 0.01 0.21 -0.03 0.23 -1.23 0.00 0.00 177.57 176.76 2wge n MET 187 N -3.60 0.23 -0.40 5.19 2.81 -0.09 -4.72 117.12 116.55 2wge n MET 187 Ca -0.01 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 2wge n MET 187 Cb 0.35 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.36 2wge n MET 187 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wge n GLY 188 N 1.39 0.79 0.13 3.03 0.00 -0.15 -4.96 105.19 105.43 2wge n GLY 188 Ca 0.11 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.18 2wge n GLY 188 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wge h ASP 189 N 0.00 0.00 -5.10 1.61 3.32 -1.23 -3.47 116.42 111.55 2wge h ASP 189 Ca 0.00 -0.05 -0.06 0.00 0.02 0.00 0.00 57.03 56.94 2wge h ASP 189 Cb 0.00 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.42 2wge h ASP 189 CO 0.00 0.02 -0.18 0.00 -1.72 0.00 0.00 179.24 177.37 2wge s ALA 190 N -3.20 -0.69 -0.20 3.45 0.00 -0.97 -4.80 121.76 115.35 2wge s ALA 190 Ca 0.06 -0.23 0.07 0.00 0.00 0.00 0.00 51.96 51.87 2wge s ALA 190 Cb 0.10 0.61 -0.09 0.00 0.00 0.00 0.00 23.12 23.73 2wge s ALA 190 CO 0.69 -0.59 0.25 -0.25 0.00 0.00 0.00 175.76 175.85 2wge n ASP 191 N -0.13 1.58 -3.76 0.00 8.00 0.12 -4.21 116.55 118.16 2wge n ASP 191 Ca -0.16 -0.39 -0.13 0.00 0.71 0.00 0.00 54.79 54.82 2wge n ASP 191 Cb 0.63 1.14 -0.10 0.00 -0.02 0.00 0.00 41.12 42.77 2wge n ASP 191 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2wge s VAL 192 N -2.03 0.01 -0.10 2.53 0.11 -1.07 -1.61 120.40 118.25 2wge s VAL 192 Ca 0.00 -0.08 -0.09 0.00 -2.93 0.00 0.00 61.98 58.89 2wge s VAL 192 Cb 0.05 -0.50 0.03 0.00 -1.53 0.00 0.00 36.38 34.43 2wge s VAL 192 CO 0.30 -0.04 0.27 0.00 -3.33 0.00 0.00 175.10 172.29 2wge s ALA 193 N -0.07 -0.65 -0.15 1.54 0.00 0.26 -1.48 121.76 121.21 2wge s ALA 193 Ca -0.02 0.80 -0.13 0.00 0.00 0.00 0.00 51.96 52.61 2wge s ALA 193 Cb -0.03 -0.47 -0.05 0.00 0.00 0.00 0.00 23.12 22.57 2wge s ALA 193 CO 0.01 -0.14 0.28 0.08 0.00 0.00 0.00 175.76 175.99 2wge s VAL 194 N 0.33 5.31 0.02 0.00 1.01 -0.62 -1.23 120.40 125.21 2wge s VAL 194 Ca -0.02 0.52 -0.14 0.00 0.00 0.00 0.00 61.98 62.35 2wge s VAL 194 Cb -0.03 -3.61 0.02 0.00 0.00 0.00 0.00 36.38 32.76 2wge s VAL 194 CO -0.01 0.42 0.30 0.00 0.00 0.00 0.00 175.10 175.80 2wge n GLY 196 N 0.90 -0.29 3.29 0.00 0.00 -0.79 -0.43 105.19 107.87 2wge n GLY 196 Ca -0.20 -0.83 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 2wge n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wge s GLY 197 N 0.00 -0.21 0.17 -0.02 0.00 -0.35 -0.69 107.32 106.22 2wge s GLY 197 Ca 0.00 0.28 0.04 0.00 0.00 0.00 0.00 44.72 45.04 2wge s GLY 197 CO 0.00 0.04 -0.07 -1.34 0.00 0.00 0.00 173.10 171.73 2wge s VAL 198 N -2.10 1.08 -0.03 1.40 -7.23 -0.66 -1.61 120.40 111.25 2wge s VAL 198 Ca -0.08 -2.04 -0.28 0.00 -1.81 0.00 0.00 61.98 57.77 2wge s VAL 198 Cb -0.02 -1.98 0.06 0.00 0.56 0.00 0.00 36.38 35.00 2wge s VAL 198 CO -0.00 -0.63 0.62 -0.70 -0.31 0.00 0.00 175.10 174.08 2wge s GLU 199 N -3.79 1.02 1.14 4.82 2.56 -1.25 -3.88 118.70 119.32 2wge s GLU 199 Ca 0.20 0.14 -0.16 0.00 0.00 0.00 0.00 54.97 55.15 2wge s GLU 199 Cb 0.04 0.48 0.26 0.00 2.00 0.00 0.00 34.13 36.90 2wge s GLU 199 CO 0.02 -0.32 1.09 0.20 -0.56 0.00 0.00 175.26 175.69 2wge s GLY 200 N -1.32 1.56 0.89 -1.50 0.00 -1.26 -4.84 107.32 100.85 2wge s GLY 200 Ca -0.10 -0.69 -0.14 0.00 0.00 0.00 0.00 44.72 43.79 2wge s GLY 200 CO 0.08 0.10 1.23 2.56 0.00 0.00 0.00 173.10 177.07 2wge s PRO 201 N -5.17 1.28 0.11 2.90 0.04 -1.26 -4.86 135.00 128.05 2wge s PRO 201 Ca 0.69 -0.09 -0.31 0.00 0.04 0.00 0.00 61.00 61.32 2wge s PRO 201 Cb -0.14 -1.89 -0.08 0.00 0.04 0.00 0.00 34.50 32.42 2wge s PRO 201 CO 0.57 -2.03 1.49 0.42 0.04 0.00 0.00 177.00 177.49 2wge s ILE 202 N -3.67 3.06 0.16 0.56 1.01 -1.26 -4.96 121.20 116.11 2wge s ILE 202 Ca 0.67 0.71 0.01 0.00 0.00 0.00 0.00 60.65 62.05 2wge s ILE 202 Cb -0.08 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.89 2wge s ILE 202 CO 0.51 0.04 0.01 -1.61 0.00 0.00 0.00 174.94 173.89 2wge s GLU 203 N 1.46 1.06 0.19 2.79 2.02 -1.26 -5.08 118.70 119.88 2wge s GLU 203 Ca 0.68 -1.51 -0.11 0.00 0.02 0.00 0.00 54.97 54.05 2wge s GLU 203 Cb -0.39 -0.17 0.11 0.00 0.10 0.00 0.00 34.13 33.78 2wge s GLU 203 CO 0.30 -0.15 1.79 0.00 0.02 0.00 0.00 175.26 177.23 2wge h ALA 204 N 2.74 0.86 -0.13 5.21 0.00 -1.95 -3.14 119.26 122.84 2wge h ALA 204 Ca -0.36 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 2wge h ALA 204 Cb 1.20 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 2wge h ALA 204 CO 0.62 0.39 -0.01 1.25 0.00 0.00 0.00 179.25 181.51 2wge h LEU 205 N 0.92 0.24 -1.05 0.00 5.85 -1.99 -0.54 115.31 118.74 2wge h LEU 205 Ca 0.23 -0.32 0.09 0.00 0.84 0.00 0.00 57.88 58.72 2wge h LEU 205 Cb 0.07 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 40.96 2wge h LEU 205 CO -0.03 0.50 0.63 -0.65 -0.34 0.00 0.00 178.44 178.55 2wge h PRO 206 N -0.03 1.03 -0.19 5.25 0.11 -1.98 0.24 132.00 136.43 2wge h PRO 206 Ca 0.04 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 2wge h PRO 206 Cb 0.38 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 2wge h PRO 206 CO 0.01 0.68 0.07 0.82 -0.21 0.00 0.00 178.00 179.37 2wge h ILE 207 N 1.06 1.17 -0.49 4.15 2.04 -1.43 -1.54 117.51 122.47 2wge h ILE 207 Ca 0.45 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.82 2wge h ILE 207 Cb 0.32 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 2wge h ILE 207 CO -0.20 0.16 0.31 0.00 0.00 0.00 0.00 178.15 178.42 2wge h ALA 208 N 0.91 0.62 -0.45 1.87 0.00 -0.67 0.98 119.26 122.53 2wge h ALA 208 Ca 0.06 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2wge h ALA 208 Cb 0.19 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2wge h ALA 208 CO -0.00 0.04 0.06 0.00 0.00 0.00 0.00 179.25 179.35 2wge h ALA 209 N 1.19 0.59 0.07 0.00 0.00 -0.84 -1.37 119.26 118.91 2wge h ALA 209 Ca 0.19 -0.23 -0.24 0.00 0.00 0.00 0.00 54.91 54.62 2wge h ALA 209 Cb -0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2wge h ALA 209 CO -0.06 0.33 -1.11 0.74 0.00 0.00 0.00 179.25 179.15 2wge h PHE 210 N 0.61 0.37 -1.00 0.00 0.04 -1.21 -3.23 116.94 112.51 2wge h PHE 210 Ca 0.13 -0.25 0.02 0.00 2.80 0.00 0.00 57.97 60.68 2wge h PHE 210 Cb 0.40 -0.02 -0.05 0.00 2.20 0.00 0.00 35.95 38.47 2wge h PHE 210 CO 0.03 1.16 0.66 0.77 -0.60 0.00 0.00 178.31 180.33 2wge h SER 211 N 0.07 1.12 0.71 2.17 0.02 -0.73 -2.01 113.55 114.91 2wge h SER 211 Ca -0.09 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2wge h SER 211 Cb 1.83 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 64.10 2wge h SER 211 CO 0.17 0.79 0.00 1.15 -1.14 0.00 0.00 176.83 177.81 2wge n MET 212 N -4.42 0.00 -0.01 3.45 0.00 -0.52 -1.33 117.12 114.30 2wge n MET 212 Ca 0.13 0.14 0.14 0.00 0.00 0.00 0.00 57.70 58.11 2wge n MET 212 Cb 0.05 -1.50 0.52 0.00 0.00 0.00 0.00 33.22 32.29 2wge n MET 212 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 175.97 174.64 2wge n MET 213 N -1.50 1.66 -2.64 3.17 2.00 -0.79 -4.94 117.12 114.07 2wge n MET 213 Ca 0.05 -0.95 -0.18 0.00 0.00 0.00 0.00 57.70 56.62 2wge n MET 213 Cb 0.24 -1.47 0.01 0.00 0.00 0.00 0.00 33.22 32.00 2wge n MET 213 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 2wge n ARG 214 N 0.16 -2.87 0.01 0.03 0.63 -0.44 -4.93 116.66 109.25 2wge n ARG 214 Ca 0.19 0.79 0.11 0.00 -0.92 0.00 0.00 57.85 58.02 2wge n ARG 214 Cb 0.35 -5.28 0.04 0.00 0.45 0.00 0.00 32.46 28.02 2wge n ARG 214 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wge n ALA 215 N -2.62 3.93 -2.48 5.13 0.00 -0.98 -4.86 120.51 118.63 2wge n ALA 215 Ca -0.14 -0.46 -0.31 0.00 0.00 0.00 0.00 53.44 52.53 2wge n ALA 215 Cb 0.62 -0.94 -0.12 0.00 0.00 0.00 0.00 19.45 19.01 2wge n ALA 215 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2wge s MET 216 N -3.07 2.14 0.36 0.00 -1.94 -1.26 -0.65 119.30 114.88 2wge s MET 216 Ca 0.07 -0.95 -0.27 0.00 -1.71 0.00 0.00 55.69 52.83 2wge s MET 216 Cb 0.16 -2.24 -0.09 0.00 2.01 0.00 0.00 34.83 34.67 2wge s MET 216 CO 0.79 0.55 1.19 0.45 -0.01 0.00 0.00 175.02 177.99 2wge s SER 217 N -1.49 6.73 -0.17 3.03 0.15 -0.18 -4.58 113.70 117.18 2wge s SER 217 Ca 0.15 2.43 0.14 0.00 0.70 0.00 0.00 55.95 59.37 2wge s SER 217 Cb -0.11 -2.63 0.37 0.00 -1.71 0.00 0.00 66.02 61.95 2wge s SER 217 CO 0.06 -0.54 1.19 0.35 1.20 0.00 0.00 173.24 175.50 2wge n THR 218 N 0.48 2.01 -1.44 6.45 -2.24 -1.26 -4.79 114.28 113.49 2wge n THR 218 Ca 0.02 -2.80 -0.41 0.00 -2.27 0.00 0.00 64.05 58.59 2wge n THR 218 Cb 0.45 -0.20 -0.02 0.00 -2.10 0.00 0.00 70.33 68.46 2wge n THR 218 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2wge n ARG 219 N -1.18 2.37 0.24 -0.78 0.63 -1.26 -4.71 116.66 111.97 2wge n ARG 219 Ca 0.17 -2.24 0.15 0.00 -0.92 0.00 0.00 57.85 55.01 2wge n ARG 219 Cb 0.68 -3.08 0.45 0.00 0.45 0.00 0.00 32.46 30.97 2wge n ARG 219 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 2wge h ASN 220 N 6.65 0.00 1.62 6.15 2.35 -1.91 -3.14 115.58 127.30 2wge h ASN 220 Ca 0.53 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.28 2wge h ASN 220 Cb 0.60 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.97 2wge h ASN 220 CO 1.89 0.00 -0.14 0.44 -1.65 0.00 0.00 177.43 177.97 2wge h ASP 221 N 0.00 0.00 -2.12 5.81 3.32 -1.98 -3.36 116.42 118.08 2wge h ASP 221 Ca 0.00 -0.02 -0.57 0.00 0.02 0.00 0.00 57.03 56.46 2wge h ASP 221 Cb 0.72 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.88 2wge h ASP 221 CO 0.00 0.01 -0.98 -0.62 -1.72 0.00 0.00 179.24 175.93 2wge n GLU 222 N -2.67 1.02 -0.28 3.56 1.02 -1.18 -5.01 120.64 117.10 2wge n GLU 222 Ca 0.04 -3.53 0.07 0.00 -0.02 0.00 0.00 57.16 53.72 2wge n GLU 222 Cb 0.49 -1.51 0.22 0.00 -0.02 0.00 0.00 31.44 30.62 2wge n GLU 222 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2wge h PRO 223 N 4.30 0.50 0.00 3.49 0.11 -1.73 0.10 132.00 138.78 2wge h PRO 223 Ca 0.12 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2wge h PRO 223 Cb 0.84 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.84 2wge h PRO 223 CO 0.53 0.33 0.00 0.93 -0.21 0.00 0.00 178.00 179.58 2wge h GLU 224 N 0.51 0.00 -0.04 1.05 3.07 -1.91 -2.67 114.58 114.59 2wge h GLU 224 Ca 0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.31 2wge h GLU 224 Cb 0.69 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 2wge h GLU 224 CO -0.40 0.00 0.00 0.54 -1.40 0.00 0.00 179.01 177.75 2wge n ARG 225 N -3.00 2.09 -0.03 2.33 1.74 0.33 -4.59 116.66 115.54 2wge n ARG 225 Ca -0.00 -1.59 -0.16 0.00 -0.77 0.00 0.00 57.85 55.33 2wge n ARG 225 Cb 0.25 -1.47 -0.08 0.00 -1.02 0.00 0.00 32.46 30.14 2wge n ARG 225 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wge h ALA 226 N 4.56 0.21 -1.86 7.54 0.00 -1.30 -3.42 119.26 124.99 2wge h ALA 226 Ca 0.00 -0.52 -0.60 0.00 0.00 0.00 0.00 54.91 53.78 2wge h ALA 226 Cb 0.81 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.49 2wge h ALA 226 CO 0.00 0.43 0.60 0.45 0.00 0.00 0.00 179.25 180.73 2wge s SER 227 N -6.75 6.44 -0.52 0.00 0.15 -1.26 -4.67 113.70 107.08 2wge s SER 227 Ca -0.12 -0.05 0.07 0.00 0.70 0.00 0.00 55.95 56.55 2wge s SER 227 Cb 0.06 -2.45 0.28 0.00 -1.71 0.00 0.00 66.02 62.20 2wge s SER 227 CO 0.84 -1.13 0.73 0.54 1.20 0.00 0.00 173.24 175.42 2wge n ARG 228 N 7.33 1.98 -1.72 5.44 1.74 -1.26 -4.59 116.66 125.58 2wge n ARG 228 Ca 0.05 -4.14 -0.42 0.00 -0.77 0.00 0.00 57.85 52.56 2wge n ARG 228 Cb 0.48 -1.90 -0.03 0.00 -1.02 0.00 0.00 32.46 30.00 2wge n ARG 228 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2wge n PRO 229 N 0.67 2.75 -0.59 5.56 -0.02 -1.26 -1.87 135.00 140.24 2wge n PRO 229 Ca 0.27 0.99 0.00 0.00 -2.02 0.00 0.00 63.50 62.74 2wge n PRO 229 Cb 0.47 -2.82 0.00 0.00 -0.02 0.00 0.00 33.50 31.13 2wge n PRO 229 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2wge n PHE 230 N 3.58 0.00 -2.69 6.00 3.72 -1.26 -4.84 117.46 121.97 2wge n PHE 230 Ca 0.14 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.18 2wge n PHE 230 Cb 0.35 -0.41 -0.06 0.00 -0.94 0.00 0.00 39.48 38.43 2wge n PHE 230 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2wge s ASP 231 N -2.91 7.12 0.42 4.37 2.15 -0.78 -4.12 116.67 122.93 2wge s ASP 231 Ca 0.00 1.92 0.20 0.00 0.43 0.00 0.00 52.55 55.10 2wge s ASP 231 Cb 0.00 -2.58 1.16 0.00 -0.30 0.00 0.00 42.92 41.19 2wge s ASP 231 CO 0.00 -0.23 1.81 0.50 -0.17 0.00 0.00 175.17 177.08 2wge h LYS 232 N 2.92 0.33 -0.55 4.34 3.64 -0.81 -2.84 116.57 123.61 2wge h LYS 232 Ca -0.47 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2wge h LYS 232 Cb 1.20 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 2wge h LYS 232 CO 0.64 0.22 0.00 -0.25 -2.27 0.00 0.00 179.45 177.79 2wge n ASP 233 N -4.53 4.88 -4.73 4.20 8.00 -1.26 -4.99 116.55 118.12 2wge n ASP 233 Ca 0.23 -2.68 -0.37 0.00 0.71 0.00 0.00 54.79 52.68 2wge n ASP 233 Cb 0.85 -0.59 0.07 0.00 -0.02 0.00 0.00 41.12 41.43 2wge n ASP 233 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wge s ARG 234 N -2.27 2.57 -0.06 -1.24 1.70 -1.07 -4.97 118.95 113.61 2wge s ARG 234 Ca 0.50 2.06 0.22 0.00 -0.47 0.00 0.00 55.73 58.04 2wge s ARG 234 Cb 0.35 -1.85 0.40 0.00 -0.57 0.00 0.00 34.95 33.28 2wge s ARG 234 CO 0.19 -1.58 1.15 -0.40 -1.08 0.00 0.00 175.30 173.58 2wge n ASP 235 N -1.89 0.84 0.00 -2.89 5.75 -1.25 -4.78 116.55 112.33 2wge n ASP 235 Ca 0.16 -2.01 0.00 0.00 -0.01 0.00 0.00 54.79 52.93 2wge n ASP 235 Cb 0.48 -0.25 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 2wge n ASP 235 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wge n GLY 236 N 0.19 0.06 3.92 6.12 0.00 -0.53 -2.94 105.19 112.02 2wge n GLY 236 Ca 0.02 -2.30 -0.26 0.00 0.00 0.00 0.00 46.02 43.49 2wge n GLY 236 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2wge s PHE 237 N -0.98 3.30 -0.03 1.61 -0.12 0.17 -3.82 117.98 118.11 2wge s PHE 237 Ca 0.00 0.57 0.06 0.00 -0.05 0.00 0.00 56.93 57.51 2wge s PHE 237 Cb 0.00 -2.56 -0.01 0.00 -0.63 0.00 0.00 43.02 39.81 2wge s PHE 237 CO 0.00 -0.62 -0.21 0.08 -0.05 0.00 0.00 175.22 174.42 2wge s VAL 238 N -2.84 1.70 0.18 -2.49 1.01 -1.26 -1.01 120.40 115.69 2wge s VAL 238 Ca 0.51 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 61.29 2wge s VAL 238 Cb -0.10 -1.43 -0.08 0.00 0.00 0.00 0.00 36.38 34.77 2wge s VAL 238 CO 0.43 0.48 1.07 -0.36 0.00 0.00 0.00 175.10 176.73 2wge s PHE 239 N -0.34 3.64 -0.06 5.22 0.08 -1.26 0.33 117.98 125.59 2wge s PHE 239 Ca 0.04 1.65 -0.02 0.00 0.12 0.00 0.00 56.93 58.71 2wge s PHE 239 Cb -0.10 -3.23 0.04 0.00 -0.57 0.00 0.00 43.02 39.16 2wge s PHE 239 CO 0.01 -0.44 0.12 0.20 -0.10 0.00 0.00 175.22 175.00 2wge s GLY 240 N -0.21 0.04 0.48 4.36 0.00 -0.65 -0.88 107.32 110.46 2wge s GLY 240 Ca 0.48 0.53 -0.22 0.00 0.00 0.00 0.00 44.72 45.52 2wge s GLY 240 CO 0.34 1.18 1.14 -0.54 0.00 0.00 0.00 173.10 175.23 2wge s GLU 241 N 1.59 3.67 0.05 2.90 2.02 0.16 -3.20 118.70 125.89 2wge s GLU 241 Ca -0.04 1.68 -0.27 0.00 0.02 0.00 0.00 54.97 56.36 2wge s GLU 241 Cb -0.12 -2.28 0.09 0.00 0.10 0.00 0.00 34.13 31.92 2wge s GLU 241 CO -0.05 -0.60 0.82 0.00 0.02 0.00 0.00 175.26 175.45 2wge s ALA 242 N -1.65 -1.75 -0.05 5.21 0.00 -1.26 -3.35 121.76 118.91 2wge s ALA 242 Ca 0.66 0.80 -0.12 0.00 0.00 0.00 0.00 51.96 53.30 2wge s ALA 242 Cb -0.26 0.55 0.02 0.00 0.00 0.00 0.00 23.12 23.44 2wge s ALA 242 CO 0.31 -0.74 0.29 0.20 0.00 0.00 0.00 175.76 175.82 2wge s GLY 243 N -2.59 -0.17 -0.20 0.00 0.00 -0.93 -3.93 107.32 99.51 2wge s GLY 243 Ca 0.05 0.51 -0.19 0.00 0.00 0.00 0.00 44.72 45.08 2wge s GLY 243 CO -0.09 0.34 0.54 0.00 0.00 0.00 0.00 173.10 173.89 2wge s ALA 244 N -0.72 -1.33 0.02 3.20 0.00 -0.64 -1.45 121.76 120.85 2wge s ALA 244 Ca -0.08 1.51 0.01 0.00 0.00 0.00 0.00 51.96 53.39 2wge s ALA 244 Cb -0.04 -0.87 -0.02 0.00 0.00 0.00 0.00 23.12 22.19 2wge s ALA 244 CO 0.02 -0.25 -0.05 -0.51 0.00 0.00 0.00 175.76 174.97 2wge s LEU 245 N 0.26 2.21 0.12 0.00 1.43 -0.56 -1.21 118.68 120.93 2wge s LEU 245 Ca -0.00 -0.45 0.05 0.00 -1.03 0.00 0.00 54.13 52.71 2wge s LEU 245 Cb -0.04 -0.02 -0.04 0.00 0.03 0.00 0.00 46.19 46.12 2wge s LEU 245 CO 0.01 -0.22 -0.13 0.00 0.23 0.00 0.00 176.35 176.24 2wge s MET 246 N -1.29 1.00 -0.23 1.70 0.23 0.43 -1.14 119.30 120.00 2wge s MET 246 Ca -0.11 -1.25 -0.08 0.00 -1.03 0.00 0.00 55.69 53.22 2wge s MET 246 Cb -0.09 -0.83 -0.04 0.00 -1.53 0.00 0.00 34.83 32.34 2wge s MET 246 CO -0.00 0.15 0.10 -1.17 -2.03 0.00 0.00 175.02 172.06 2wge s LEU 247 N -2.51 3.71 0.13 0.18 2.96 -0.09 -1.09 118.68 121.97 2wge s LEU 247 Ca 0.09 -0.06 0.11 0.00 -0.22 0.00 0.00 54.13 54.05 2wge s LEU 247 Cb -0.04 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.63 2wge s LEU 247 CO 0.02 0.04 -0.26 0.27 -1.32 0.00 0.00 176.35 175.10 2wge s ILE 248 N 1.21 2.19 0.18 6.68 -4.36 -0.37 -1.14 121.20 125.59 2wge s ILE 248 Ca 0.05 -1.74 -0.23 0.00 -0.26 0.00 0.00 60.65 58.48 2wge s ILE 248 Cb -0.14 -1.94 0.06 0.00 1.25 0.00 0.00 42.46 41.68 2wge s ILE 248 CO 0.04 0.07 0.65 -1.83 0.24 0.00 0.00 174.94 174.11 2wge s GLU 249 N -2.05 1.39 0.71 0.37 -1.05 -0.54 -0.58 118.70 116.94 2wge s GLU 249 Ca 0.13 -0.60 -0.16 0.00 -0.15 0.00 0.00 54.97 54.19 2wge s GLU 249 Cb -0.10 0.58 0.02 0.00 -0.44 0.00 0.00 34.13 34.20 2wge s GLU 249 CO 0.06 -0.62 1.23 0.95 0.95 0.00 0.00 175.26 177.83 2wge s THR 250 N -3.75 2.22 0.31 1.83 -4.23 -0.63 -0.72 115.64 110.66 2wge s THR 250 Ca 0.04 0.12 -0.00 0.00 -1.18 0.00 0.00 61.69 60.67 2wge s THR 250 Cb -0.02 -2.80 0.21 0.00 1.34 0.00 0.00 72.50 71.23 2wge s THR 250 CO -0.07 -0.05 1.92 -0.08 -0.54 0.00 0.00 174.62 175.79 2wge h GLU 251 N -0.04 0.88 -0.32 3.99 4.81 -1.27 -1.71 114.58 120.92 2wge h GLU 251 Ca -0.49 -0.11 0.01 0.00 -0.13 0.00 0.00 59.36 58.64 2wge h GLU 251 Cb 1.31 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.50 2wge h GLU 251 CO 0.51 0.68 0.19 1.49 -0.73 0.00 0.00 179.01 181.15 2wge h GLU 252 N 0.89 0.39 -0.65 1.92 4.81 -1.91 0.12 114.58 120.14 2wge h GLU 252 Ca 0.22 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.37 2wge h GLU 252 Cb 0.08 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 2wge h GLU 252 CO -0.03 0.26 0.20 1.25 -0.73 0.00 0.00 179.01 179.95 2wge h HIS 253 N 0.40 1.06 -0.28 0.92 2.76 -1.80 -0.52 115.15 117.69 2wge h HIS 253 Ca 0.12 -0.11 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 2wge h HIS 253 Cb -0.02 -0.31 -0.01 0.00 1.55 0.00 0.00 27.41 28.63 2wge h HIS 253 CO -0.07 0.86 0.13 0.00 -1.30 0.00 0.00 177.93 177.55 2wge h ALA 254 N 1.08 0.36 -0.37 5.26 0.00 -1.09 -2.99 119.26 121.50 2wge h ALA 254 Ca 0.21 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2wge h ALA 254 Cb 0.31 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2wge h ALA 254 CO -0.00 -0.08 0.22 -0.22 0.00 0.00 0.00 179.25 179.17 2wge h LYS 255 N 0.31 0.44 0.00 0.00 1.63 -0.77 -1.39 116.57 116.79 2wge h LYS 255 Ca 0.09 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.86 2wge h LYS 255 Cb 0.13 -0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 31.66 2wge h LYS 255 CO -0.01 0.29 -0.05 0.00 -3.45 0.00 0.00 179.45 176.23 2wge h ALA 256 N 1.15 1.91 -0.45 5.00 0.00 -1.04 -2.23 119.26 123.60 2wge h ALA 256 Ca 0.14 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2wge h ALA 256 Cb -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2wge h ALA 256 CO -0.06 0.06 0.00 2.89 0.00 0.00 0.00 179.25 182.15 2wge n ARG 257 N -4.47 2.52 -2.01 0.00 1.85 -0.98 -4.99 116.66 108.59 2wge n ARG 257 Ca -0.03 -2.23 -0.11 0.00 -1.00 0.00 0.00 57.85 54.48 2wge n ARG 257 Cb 0.13 -1.42 -0.01 0.00 -1.05 0.00 0.00 32.46 30.11 2wge n ARG 257 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2wge n GLY 258 N 1.15 0.21 3.74 2.89 0.00 -0.68 -5.02 105.19 107.47 2wge n GLY 258 Ca 0.17 -0.46 -0.40 0.00 0.00 0.00 0.00 46.02 45.34 2wge n GLY 258 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wge s ALA 259 N -2.51 3.36 -0.29 4.61 0.00 -0.61 -5.03 121.76 121.29 2wge s ALA 259 Ca 0.00 0.22 -0.21 0.00 0.00 0.00 0.00 51.96 51.97 2wge s ALA 259 Cb 0.00 -2.97 -0.01 0.00 0.00 0.00 0.00 23.12 20.14 2wge s ALA 259 CO 0.00 0.01 0.65 0.21 0.00 0.00 0.00 175.76 176.63 2wge s LYS 260 N 0.26 3.96 0.49 0.00 2.20 -1.26 -4.53 119.74 120.85 2wge s LYS 260 Ca 0.38 0.39 -0.24 0.00 -0.36 0.00 0.00 55.97 56.15 2wge s LYS 260 Cb -0.19 -3.71 -0.07 0.00 -1.51 0.00 0.00 37.83 32.35 2wge s LYS 260 CO 0.21 -0.55 1.39 -2.14 -0.36 0.00 0.00 175.35 173.90 2wge s PRO 261 N 2.63 3.46 0.03 4.03 0.02 -1.26 -4.77 135.00 139.13 2wge s PRO 261 Ca 0.26 2.33 0.18 0.00 0.02 0.00 0.00 61.00 63.78 2wge s PRO 261 Cb -0.15 -2.48 -0.16 0.00 0.02 0.00 0.00 34.50 31.72 2wge s PRO 261 CO 0.11 -0.97 0.71 1.28 -0.33 0.00 0.00 177.00 177.81 2wge n LEU 262 N -0.55 0.69 -3.81 -5.54 4.77 0.14 -4.95 117.00 107.76 2wge n LEU 262 Ca 0.07 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 2wge n LEU 262 Cb 0.43 0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 2wge n LEU 262 CO 0.56 0.16 0.97 0.00 -1.33 0.00 0.00 177.39 177.75 2wge s ALA 263 N -2.94 -2.08 -0.11 -1.18 0.00 -1.22 -4.29 121.76 109.95 2wge s ALA 263 Ca -0.04 0.18 -0.03 0.00 0.00 0.00 0.00 51.96 52.07 2wge s ALA 263 Cb 0.09 0.65 -0.03 0.00 0.00 0.00 0.00 23.12 23.82 2wge s ALA 263 CO 0.82 -1.08 0.01 1.03 0.00 0.00 0.00 175.76 176.54 2wge s ARG 264 N -2.35 3.20 -0.38 0.00 0.52 0.21 -1.06 118.95 119.08 2wge s ARG 264 Ca 0.20 -0.40 -0.13 0.00 -0.52 0.00 0.00 55.73 54.88 2wge s ARG 264 Cb 0.01 -2.87 0.02 0.00 0.52 0.00 0.00 34.95 32.62 2wge s ARG 264 CO 0.00 0.60 0.25 -1.17 0.02 0.00 0.00 175.30 175.00 2wge s LEU 265 N -0.60 4.83 -0.18 2.53 2.96 -0.49 -0.75 118.68 126.98 2wge s LEU 265 Ca 0.10 -0.84 0.18 0.00 -0.22 0.00 0.00 54.13 53.35 2wge s LEU 265 Cb -0.12 -2.10 -0.25 0.00 0.50 0.00 0.00 46.19 44.22 2wge s LEU 265 CO 0.02 -0.38 0.09 0.18 -1.32 0.00 0.00 176.35 174.94 2wge n LEU 266 N 5.09 0.00 -3.61 -0.68 4.77 0.49 -4.33 117.00 118.73 2wge n LEU 266 Ca -0.12 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.85 2wge n LEU 266 Cb 0.47 0.46 -0.01 0.00 -2.33 0.00 0.00 43.42 42.01 2wge n LEU 266 CO 0.38 0.46 1.05 -0.83 -1.33 0.00 0.00 177.39 177.12 2wge s GLY 267 N -5.35 -0.35 -0.07 -0.72 0.00 -1.15 -3.59 107.32 96.09 2wge s GLY 267 Ca -0.10 1.21 -0.10 0.00 0.00 0.00 0.00 44.72 45.74 2wge s GLY 267 CO 0.81 0.35 0.25 0.00 0.00 0.00 0.00 173.10 174.51 2wge s ALA 268 N -2.39 -0.61 -0.05 3.20 0.00 -1.26 -1.25 121.76 119.41 2wge s ALA 268 Ca 0.12 0.53 0.03 0.00 0.00 0.00 0.00 51.96 52.64 2wge s ALA 268 Cb 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.88 2wge s ALA 268 CO -0.04 -0.16 -0.14 0.20 0.00 0.00 0.00 175.76 175.62 2wge s GLY 269 N -0.33 0.81 -0.12 0.00 0.00 0.18 -4.20 107.32 103.66 2wge s GLY 269 Ca -0.04 -0.53 -0.00 0.00 0.00 0.00 0.00 44.72 44.14 2wge s GLY 269 CO 0.01 -0.13 -0.09 -0.42 0.00 0.00 0.00 173.10 172.46 2wge s ILE 270 N 0.30 1.17 0.30 0.90 1.01 -1.26 -1.49 121.20 122.12 2wge s ILE 270 Ca -0.08 -0.38 0.05 0.00 0.00 0.00 0.00 60.65 60.24 2wge s ILE 270 Cb -0.13 -1.16 -0.02 0.00 0.01 0.00 0.00 42.46 41.16 2wge s ILE 270 CO 0.03 0.39 0.18 0.35 0.00 0.00 0.00 174.94 175.89 2wge n THR 271 N 4.90 0.00 -3.84 2.92 -2.24 -0.47 -4.96 114.28 110.58 2wge n THR 271 Ca -0.14 -1.99 -0.12 0.00 -2.27 0.00 0.00 64.05 59.54 2wge n THR 271 Cb 0.50 0.87 -0.10 0.00 -2.10 0.00 0.00 70.33 69.50 2wge n THR 271 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2wge s SER 272 N -2.99 -0.04 0.06 3.42 1.04 -1.26 -1.38 113.70 112.54 2wge s SER 272 Ca 0.26 -0.08 -0.03 0.00 0.48 0.00 0.00 55.95 56.58 2wge s SER 272 Cb 0.01 0.25 -0.28 0.00 0.10 0.00 0.00 66.02 66.11 2wge s SER 272 CO 0.18 -0.35 1.06 0.44 0.98 0.00 0.00 173.24 175.55 2wge h ASP 273 N 4.38 0.38 -7.01 7.02 3.32 -1.28 -3.47 116.42 119.77 2wge h ASP 273 Ca -0.30 -0.44 -0.61 0.00 0.02 0.00 0.00 57.03 55.70 2wge h ASP 273 Cb 1.19 -0.12 -0.09 0.00 0.22 0.00 0.00 39.33 40.53 2wge h ASP 273 CO 0.40 1.35 -1.00 0.00 -1.72 0.00 0.00 179.24 178.28 2wge n ALA 274 N -2.56 -2.39 0.01 3.45 0.00 -1.26 -4.88 120.51 112.88 2wge n ALA 274 Ca -0.10 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.81 2wge n ALA 274 Cb 1.03 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2wge n ALA 274 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2wge n PHE 275 N -4.90 -0.07 -3.50 0.00 7.35 -1.26 -5.13 117.46 109.95 2wge n PHE 275 Ca -0.19 0.01 -0.15 0.00 -0.76 0.00 0.00 57.45 56.35 2wge n PHE 275 Cb 0.61 0.12 -0.05 0.00 0.35 0.00 0.00 39.48 40.52 2wge n PHE 275 CO 0.00 0.00 0.00 -1.58 -0.76 0.00 0.00 176.76 174.42 2wge s HIS 276 N -2.00 -0.58 0.24 -5.13 5.04 -1.26 -5.06 115.29 106.54 2wge s HIS 276 Ca 0.00 0.77 0.20 0.00 -1.54 0.00 0.00 55.06 54.48 2wge s HIS 276 Cb 0.00 0.44 0.83 0.00 0.04 0.00 0.00 32.58 33.90 2wge s HIS 276 CO 0.00 -0.69 1.81 0.52 -2.34 0.00 0.00 174.74 174.04 2wge h MET 277 N 2.66 0.00 0.00 2.88 2.86 -2.00 -3.39 114.93 117.94 2wge h MET 277 Ca -0.30 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.34 2wge h MET 277 Cb 1.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.87 2wge h MET 277 CO 0.39 0.32 0.00 1.33 1.06 0.00 0.00 176.91 180.01 2wge n VAL 278 N -3.63 0.00 -4.62 -2.22 0.24 -1.26 -1.17 118.33 105.67 2wge n VAL 278 Ca -0.01 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 61.98 2wge n VAL 278 Cb 0.44 1.13 -0.12 0.00 -1.47 0.00 0.00 33.84 33.82 2wge n VAL 278 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wge s ALA 279 N 0.00 2.76 0.57 2.33 0.00 -1.26 -4.88 121.76 121.28 2wge s ALA 279 Ca 0.00 -1.10 -0.16 0.00 0.00 0.00 0.00 51.96 50.70 2wge s ALA 279 Cb 0.00 -0.91 -0.05 0.00 0.00 0.00 0.00 23.12 22.16 2wge s ALA 279 CO 0.00 0.59 1.04 -1.25 0.00 0.00 0.00 175.76 176.14 2wge s PRO 280 N -1.33 3.47 0.16 0.00 0.04 -1.26 -4.25 135.00 131.82 2wge s PRO 280 Ca 0.15 1.16 -0.31 0.00 0.04 0.00 0.00 61.00 62.04 2wge s PRO 280 Cb -0.11 -2.06 -0.09 0.00 0.04 0.00 0.00 34.50 32.29 2wge s PRO 280 CO 0.05 -0.68 1.46 0.00 0.04 0.00 0.00 177.00 177.88 2wge s ALA 281 N -2.47 3.67 0.39 8.56 0.00 -1.26 -4.91 121.76 125.73 2wge s ALA 281 Ca 0.63 1.25 0.11 0.00 0.00 0.00 0.00 51.96 53.95 2wge s ALA 281 Cb -0.15 -3.57 0.78 0.00 0.00 0.00 0.00 23.12 20.18 2wge s ALA 281 CO 0.35 -0.69 1.88 0.00 0.00 0.00 0.00 175.76 177.30 2wge h ALA 282 N 6.49 1.46 0.00 0.00 0.00 -1.94 -2.55 119.26 122.72 2wge h ALA 282 Ca -0.43 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.21 2wge h ALA 282 Cb 1.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2wge h ALA 282 CO 0.87 0.39 0.00 -0.40 0.00 0.00 0.00 179.25 180.11 2wge n ASP 283 N -4.19 0.49 -1.06 0.00 5.68 -1.26 -4.41 116.55 111.79 2wge n ASP 283 Ca -0.02 0.60 -0.14 0.00 -0.50 0.00 0.00 54.79 54.74 2wge n ASP 283 Cb 0.34 -0.71 -0.06 0.00 -1.14 0.00 0.00 41.12 39.54 2wge n ASP 283 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wge n GLY 284 N 0.26 1.29 0.07 6.12 0.00 -0.96 -4.43 105.19 107.55 2wge n GLY 284 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 2wge n GLY 284 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wge h VAL 285 N 0.00 1.42 -0.13 1.61 2.07 -1.88 0.02 116.25 119.36 2wge h VAL 285 Ca -0.28 -1.30 -0.13 0.00 0.82 0.00 0.00 66.70 65.80 2wge h VAL 285 Cb 1.21 2.24 -0.01 0.00 -1.52 0.00 0.00 31.29 33.21 2wge h VAL 285 CO 0.41 0.35 -0.50 0.03 0.02 0.00 0.00 177.57 177.87 2wge h ARG 286 N -0.45 0.35 -0.32 1.57 2.47 -1.90 -0.65 114.38 115.45 2wge h ARG 286 Ca 0.00 -0.20 -0.02 0.00 -1.26 0.00 0.00 59.98 58.50 2wge h ARG 286 Cb 0.58 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.91 2wge h ARG 286 CO 0.01 0.77 0.10 0.00 0.56 0.00 0.00 179.97 181.42 2wge h ALA 287 N 1.19 0.41 -0.80 0.04 0.00 -1.91 -1.90 119.26 116.29 2wge h ALA 287 Ca 0.01 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.86 2wge h ALA 287 Cb 0.99 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.58 2wge h ALA 287 CO 0.08 0.04 0.46 0.78 0.00 0.00 0.00 179.25 180.62 2wge h GLY 288 N 0.36 1.23 2.00 0.00 0.00 -0.77 -2.07 103.07 103.81 2wge h GLY 288 Ca 0.10 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 2wge h GLY 288 CO -0.00 0.15 -0.22 -0.09 0.00 0.00 0.00 176.54 176.38 2wge h ARG 289 N 0.80 0.00 -0.50 4.80 9.65 -0.63 -0.97 114.38 127.53 2wge h ARG 289 Ca 0.38 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 59.25 2wge h ARG 289 Cb 0.30 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.86 2wge h ARG 289 CO -0.23 0.22 0.27 0.00 2.80 0.00 0.00 179.97 183.03 2wge h ALA 290 N 1.78 0.64 -0.03 2.80 0.00 -0.64 0.19 119.26 124.01 2wge h ALA 290 Ca -0.00 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2wge h ALA 290 Cb 0.39 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2wge h ALA 290 CO 0.03 0.17 -0.09 0.52 0.00 0.00 0.00 179.25 179.88 2wge h MET 291 N 0.66 -0.13 -0.81 0.00 2.86 -1.13 -1.86 114.93 114.52 2wge h MET 291 Ca 0.18 0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.86 2wge h MET 291 Cb 0.06 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 31.70 2wge h MET 291 CO -0.03 -0.09 0.51 1.15 1.06 0.00 0.00 176.91 179.52 2wge h THR 292 N -0.14 1.11 -0.73 2.22 2.02 -0.97 -2.05 112.91 114.37 2wge h THR 292 Ca 0.04 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 2wge h THR 292 Cb 0.20 0.03 -0.03 0.00 -1.74 0.00 0.00 68.15 66.61 2wge h THR 292 CO -0.11 0.18 0.37 -0.09 0.37 0.00 0.00 175.52 176.24 2wge h ARG 293 N 0.99 1.04 -0.91 6.66 9.65 -0.73 0.30 114.38 131.37 2wge h ARG 293 Ca 0.33 -0.14 0.02 0.00 -1.10 0.00 0.00 59.98 59.08 2wge h ARG 293 Cb 0.04 -0.19 -0.05 0.00 -1.39 0.00 0.00 29.97 28.37 2wge h ARG 293 CO -0.12 0.80 0.60 0.66 2.80 0.00 0.00 179.97 184.71 2wge h SER 294 N 1.02 1.03 -0.44 -3.80 4.64 -0.69 -1.71 113.55 113.59 2wge h SER 294 Ca 0.25 -0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 61.47 2wge h SER 294 Cb 0.09 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 2wge h SER 294 CO -0.04 0.73 -0.04 -0.07 -0.87 0.00 0.00 176.83 176.54 2wge h LEU 295 N 1.20 0.80 -0.60 5.97 3.38 -0.78 -1.58 115.31 123.71 2wge h LEU 295 Ca 0.34 -0.33 0.03 0.00 0.09 0.00 0.00 57.88 58.01 2wge h LEU 295 Cb -0.09 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.41 2wge h LEU 295 CO -0.09 0.94 0.36 -0.33 0.09 0.00 0.00 178.44 179.42 2wge h GLU 296 N 0.64 0.70 -0.17 1.13 5.08 -0.53 0.61 114.58 122.04 2wge h GLU 296 Ca 0.12 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.28 2wge h GLU 296 Cb 0.55 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2wge h GLU 296 CO 0.03 0.46 -0.56 -0.07 -1.00 0.00 0.00 179.01 177.87 2wge h LEU 297 N 0.72 0.57 -1.11 1.33 3.38 -1.28 -2.96 115.31 115.95 2wge h LEU 297 Ca 0.24 -0.31 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 2wge h LEU 297 Cb 0.02 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2wge h LEU 297 CO -0.10 1.01 -0.41 0.00 0.09 0.00 0.00 178.44 179.03 2wge h ALA 298 N 1.00 1.17 -0.57 1.53 0.00 -1.02 -0.82 119.26 120.55 2wge h ALA 298 Ca 0.01 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 2wge h ALA 298 Cb 1.09 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2wge h ALA 298 CO 0.10 0.51 -0.02 0.41 0.00 0.00 0.00 179.25 180.25 2wge n GLY 299 N -0.12 0.57 3.66 0.00 0.00 0.05 -1.78 105.19 107.58 2wge n GLY 299 Ca -0.01 -0.77 -0.24 0.00 0.00 0.00 0.00 46.02 45.00 2wge n GLY 299 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wge s LEU 300 N -0.66 3.28 0.25 0.99 1.43 -0.31 -4.79 118.68 118.87 2wge s LEU 300 Ca 0.01 -0.52 0.07 0.00 -1.03 0.00 0.00 54.13 52.66 2wge s LEU 300 Cb -0.00 -1.85 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 2wge s LEU 300 CO 0.01 0.03 0.16 -0.94 0.23 0.00 0.00 176.35 175.84 2wge s SER 301 N -3.39 5.34 0.51 2.29 1.04 -1.26 -4.44 113.70 113.79 2wge s SER 301 Ca 0.30 -0.32 0.27 0.00 0.48 0.00 0.00 55.95 56.68 2wge s SER 301 Cb -0.08 -1.30 1.38 0.00 0.10 0.00 0.00 66.02 66.13 2wge s SER 301 CO 0.20 -0.03 1.91 -0.65 0.98 0.00 0.00 173.24 175.65 2wge h PRO 302 N 1.59 0.08 0.00 4.02 0.11 -1.87 -0.56 132.00 135.38 2wge h PRO 302 Ca -0.48 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.59 2wge h PRO 302 Cb 1.24 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2wge h PRO 302 CO 0.61 0.05 -0.17 0.00 -0.21 0.00 0.00 178.00 178.28 2wge h ALA 303 N 1.61 1.27 0.00 -0.75 0.00 -1.94 -2.07 119.26 117.37 2wge h ALA 303 Ca 0.39 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2wge h ALA 303 Cb 1.44 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.20 2wge h ALA 303 CO -0.04 0.22 0.00 -0.44 0.00 0.00 0.00 179.25 178.99 2wge h ASP 304 N 0.00 0.00 -3.49 0.00 3.32 -1.50 -3.43 116.42 111.32 2wge h ASP 304 Ca -0.00 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.44 2wge h ASP 304 Cb 0.44 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.88 2wge h ASP 304 CO 0.02 0.00 0.56 -0.63 -1.72 0.00 0.00 179.24 177.47 2wge s ILE 305 N -3.43 4.45 -0.31 0.35 -1.09 -0.78 -4.13 121.20 116.26 2wge s ILE 305 Ca 0.04 0.55 0.22 0.00 -2.23 0.00 0.00 60.65 59.23 2wge s ILE 305 Cb 0.09 -4.46 0.13 0.00 -1.58 0.00 0.00 42.46 36.64 2wge s ILE 305 CO 0.51 -0.93 1.27 0.44 -1.23 0.00 0.00 174.94 175.00 2wge h ASP 306 N 9.16 0.00 -3.79 3.58 3.32 -1.69 -3.40 116.42 123.61 2wge h ASP 306 Ca -0.25 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.69 2wge h ASP 306 Cb 1.08 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.38 2wge h ASP 306 CO 1.04 0.04 -0.21 -2.28 -1.72 0.00 0.00 179.24 176.10 2wge s HIS 307 N -3.28 -0.51 -0.13 4.55 2.46 -1.18 -1.30 115.29 115.92 2wge s HIS 307 Ca 0.02 1.20 0.01 0.00 0.47 0.00 0.00 55.06 56.77 2wge s HIS 307 Cb 0.08 0.18 0.02 0.00 -0.13 0.00 0.00 32.58 32.73 2wge s HIS 307 CO 0.74 -0.25 -0.16 0.08 -2.47 0.00 0.00 174.74 172.69 2wge s VAL 308 N 0.42 1.59 -0.57 0.89 1.01 -0.66 -1.76 120.40 121.32 2wge s VAL 308 Ca -0.02 -0.68 -0.21 0.00 0.00 0.00 0.00 61.98 61.08 2wge s VAL 308 Cb -0.04 -1.46 0.07 0.00 0.00 0.00 0.00 36.38 34.95 2wge s VAL 308 CO -0.02 0.46 0.77 0.21 0.00 0.00 0.00 175.10 176.52 2wge s ASN 309 N 1.15 6.22 0.61 3.32 3.84 -0.10 -1.88 114.94 128.10 2wge s ASN 309 Ca -0.02 -0.98 -0.16 0.00 0.21 0.00 0.00 52.86 51.90 2wge s ASN 309 Cb -0.14 -2.34 -0.03 0.00 -0.55 0.00 0.00 41.25 38.19 2wge s ASN 309 CO -0.05 -1.12 1.08 0.00 -2.79 0.00 0.00 177.10 174.22 2wge s ALA 310 N 3.15 2.64 0.07 1.71 0.00 0.18 -1.09 121.76 128.43 2wge s ALA 310 Ca 0.18 0.51 -0.21 0.00 0.00 0.00 0.00 51.96 52.44 2wge s ALA 310 Cb -0.19 -3.28 -0.12 0.00 0.00 0.00 0.00 23.12 19.54 2wge s ALA 310 CO 0.11 -0.95 1.54 1.25 0.00 0.00 0.00 175.76 177.71 2wge h HIS 311 N 0.43 0.27 -6.77 0.00 2.76 -1.87 -3.43 115.15 106.53 2wge h HIS 311 Ca -0.47 -0.04 -0.51 0.00 -2.20 0.00 0.00 60.37 57.15 2wge h HIS 311 Cb 1.23 -0.07 -0.00 0.00 1.55 0.00 0.00 27.41 30.12 2wge h HIS 311 CO 0.56 0.42 -1.05 0.41 -1.30 0.00 0.00 177.93 176.96 2wge n GLY 312 N -0.45 -1.19 0.13 5.26 0.00 -1.26 -4.79 105.19 102.88 2wge n GLY 312 Ca -0.05 0.53 0.12 0.00 0.00 0.00 0.00 46.02 46.63 2wge n GLY 312 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2wge h THR 313 N -0.89 0.00 0.00 2.61 1.35 -1.92 -3.41 112.91 110.65 2wge h THR 313 Ca -0.65 -0.70 0.00 0.00 -0.55 0.00 0.00 66.41 64.51 2wge h THR 313 Cb 1.39 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 69.36 2wge h THR 313 CO 0.41 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.68 2wge n ALA 314 N -1.94 0.00 -1.79 6.62 0.00 -1.26 -3.70 120.51 118.43 2wge n ALA 314 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.13 2wge n ALA 314 Cb 0.48 -0.07 -0.05 0.00 0.00 0.00 0.00 19.45 19.81 2wge n ALA 314 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2wge s THR 315 N -2.00 3.98 0.14 0.00 -4.23 -1.26 -1.45 115.64 110.81 2wge s THR 315 Ca 0.00 1.42 -0.25 0.00 -1.18 0.00 0.00 61.69 61.68 2wge s THR 315 Cb 0.00 -3.69 -0.01 0.00 1.34 0.00 0.00 72.50 70.14 2wge s THR 315 CO 0.00 -0.08 1.61 -0.65 -0.54 0.00 0.00 174.62 174.96 2wge h PRO 316 N 2.34 -0.35 0.00 3.99 0.11 -1.93 -2.75 132.00 133.40 2wge h PRO 316 Ca -0.48 0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.50 2wge h PRO 316 Cb 1.20 0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.37 2wge h PRO 316 CO 0.62 -0.23 -0.70 -0.84 -0.21 0.00 0.00 178.00 176.64 2wge h ILE 317 N -0.36 1.32 0.01 4.15 3.07 -2.00 -3.15 117.51 120.54 2wge h ILE 317 Ca 0.11 -2.56 -0.00 0.00 1.55 0.00 0.00 64.86 63.96 2wge h ILE 317 Cb 0.53 2.45 0.00 0.00 -0.27 0.00 0.00 36.82 39.53 2wge h ILE 317 CO -0.37 0.68 -0.00 1.23 -1.05 0.00 0.00 178.15 178.64 2wge h GLY 318 N 2.74 -0.01 1.16 0.16 0.00 -1.95 -1.79 103.07 103.38 2wge h GLY 318 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 2wge h GLY 318 CO 0.09 -0.00 -0.03 -0.55 0.00 0.00 0.00 176.54 176.05 2wge h ASP 319 N -0.26 0.98 -0.59 0.19 3.32 -1.59 -1.45 116.42 117.02 2wge h ASP 319 Ca -0.00 -0.28 -0.00 0.00 0.02 0.00 0.00 57.03 56.76 2wge h ASP 319 Cb 0.25 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.51 2wge h ASP 319 CO 0.00 1.05 0.35 0.00 -1.72 0.00 0.00 179.24 178.93 2wge h ALA 320 N 1.04 0.76 -0.61 3.45 0.00 -1.52 -1.15 119.26 121.23 2wge h ALA 320 Ca 0.16 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2wge h ALA 320 Cb 0.57 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2wge h ALA 320 CO 0.03 0.24 0.23 0.00 0.00 0.00 0.00 179.25 179.76 2wge h ALA 321 N 1.18 0.79 -0.38 0.00 0.00 -1.09 -2.57 119.26 117.18 2wge h ALA 321 Ca 0.21 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 2wge h ALA 321 Cb -0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2wge h ALA 321 CO -0.04 0.42 -0.21 1.49 0.00 0.00 0.00 179.25 180.91 2wge h GLU 322 N 0.85 0.75 -0.69 0.00 4.81 -0.98 -1.04 114.58 118.27 2wge h GLU 322 Ca 0.20 -0.29 0.06 0.00 -0.13 0.00 0.00 59.36 59.20 2wge h GLU 322 Cb 0.22 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.51 2wge h GLU 322 CO -0.01 0.90 0.39 0.00 -0.73 0.00 0.00 179.01 179.55 2wge h ALA 323 N 1.11 0.93 -0.76 2.92 0.00 -1.11 0.94 119.26 123.29 2wge h ALA 323 Ca 0.09 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2wge h ALA 323 Cb 0.71 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 2wge h ALA 323 CO 0.05 0.07 0.42 -0.91 0.00 0.00 0.00 179.25 178.89 2wge h ASN 324 N 0.72 0.95 -0.51 0.00 2.35 -1.11 -2.29 115.58 115.69 2wge h ASN 324 Ca 0.31 -0.09 0.01 0.00 -0.55 0.00 0.00 56.30 55.98 2wge h ASN 324 Cb 0.19 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.29 2wge h ASN 324 CO -0.18 0.77 0.33 0.00 -1.65 0.00 0.00 177.43 176.69 2wge h ALA 325 N 1.22 0.65 -0.58 -0.83 0.00 -0.33 0.02 119.26 119.41 2wge h ALA 325 Ca 0.27 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 2wge h ALA 325 Cb 0.03 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2wge h ALA 325 CO -0.04 0.06 0.13 0.82 0.00 0.00 0.00 179.25 180.21 2wge h ILE 326 N 0.66 1.24 0.09 0.00 2.04 -0.71 -1.19 117.51 119.63 2wge h ILE 326 Ca 0.20 -0.88 -0.00 0.00 1.00 0.00 0.00 64.86 65.18 2wge h ILE 326 Cb -0.03 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 2wge h ILE 326 CO -0.06 0.33 -0.04 0.03 0.00 0.00 0.00 178.15 178.40 2wge h ARG 327 N 0.87 -0.11 -0.88 2.37 3.08 -1.19 -1.05 114.38 117.47 2wge h ARG 327 Ca 0.19 0.01 0.18 0.00 0.07 0.00 0.00 59.98 60.43 2wge h ARG 327 Cb 0.33 0.03 -0.11 0.00 0.08 0.00 0.00 29.97 30.30 2wge h ARG 327 CO 0.00 0.04 0.43 0.28 -1.07 0.00 0.00 179.97 179.65 2wge h VAL 328 N -0.24 0.62 0.00 2.04 2.07 -0.67 -0.56 116.25 119.51 2wge h VAL 328 Ca -0.01 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2wge h VAL 328 Cb 0.20 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.01 2wge h VAL 328 CO 0.02 0.10 0.00 0.00 0.02 0.00 0.00 177.57 177.71 2wge n ALA 329 N -2.44 2.55 -1.24 1.67 0.00 -0.48 -4.90 120.51 115.67 2wge n ALA 329 Ca 0.20 -0.16 -0.03 0.00 0.00 0.00 0.00 53.44 53.44 2wge n ALA 329 Cb 0.54 -1.50 -0.01 0.00 0.00 0.00 0.00 19.45 18.48 2wge n ALA 329 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wge n GLY 330 N 1.17 0.56 0.95 0.00 0.00 -0.22 -4.71 105.19 102.94 2wge n GLY 330 Ca 0.18 -0.91 0.08 0.00 0.00 0.00 0.00 46.02 45.37 2wge n GLY 330 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wge n ASP 332 N -0.11 0.00 -0.55 0.00 5.75 -1.23 -1.87 116.55 118.54 2wge n ASP 332 Ca 0.20 -0.72 0.13 0.00 -0.01 0.00 0.00 54.79 54.38 2wge n ASP 332 Cb 0.81 -0.09 0.45 0.00 -1.03 0.00 0.00 41.12 41.26 2wge n ASP 332 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2wge n GLN 333 N -1.09 1.76 -2.56 0.11 1.13 -1.26 -4.44 117.38 111.03 2wge n GLN 333 Ca 0.21 -1.11 -0.33 0.00 -1.94 0.00 0.00 57.00 53.83 2wge n GLN 333 Cb 0.15 -1.46 -0.04 0.00 0.11 0.00 0.00 30.24 28.99 2wge n GLN 333 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2wge s ALA 334 N -1.93 3.00 -0.06 -1.58 0.00 -0.78 -4.97 121.76 115.44 2wge s ALA 334 Ca 0.36 0.35 -0.30 0.00 0.00 0.00 0.00 51.96 52.37 2wge s ALA 334 Cb 0.20 -3.16 -0.03 0.00 0.00 0.00 0.00 23.12 20.13 2wge s ALA 334 CO 0.31 -0.15 1.20 0.00 0.00 0.00 0.00 175.76 177.13 2wge s ALA 335 N -2.33 3.50 -0.15 0.00 0.00 -0.42 -4.28 121.76 118.07 2wge s ALA 335 Ca 0.62 0.62 -0.06 0.00 0.00 0.00 0.00 51.96 53.14 2wge s ALA 335 Cb -0.11 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 2wge s ALA 335 CO 0.23 -0.76 0.06 0.08 0.00 0.00 0.00 175.76 175.36 2wge s VAL 336 N 2.22 4.80 -0.04 0.00 1.01 0.72 -1.66 120.40 127.45 2wge s VAL 336 Ca 0.56 -0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.56 2wge s VAL 336 Cb -0.25 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.00 2wge s VAL 336 CO 0.22 0.52 -0.24 -0.47 0.00 0.00 0.00 175.10 175.13 2wge s TYR 337 N -0.15 2.25 -0.55 5.22 5.04 -0.79 -0.70 117.35 127.67 2wge s TYR 337 Ca 0.07 -0.56 0.03 0.00 -2.44 0.00 0.00 57.07 54.18 2wge s TYR 337 Cb -0.12 -1.46 0.14 0.00 0.35 0.00 0.00 41.96 40.86 2wge s TYR 337 CO 0.01 -0.13 0.30 0.00 -1.34 0.00 0.00 175.55 174.39 2wge s ALA 338 N -0.33 3.38 0.52 3.97 0.00 -1.26 -0.64 121.76 127.39 2wge s ALA 338 Ca 0.02 -3.32 0.33 0.00 0.00 0.00 0.00 51.96 49.00 2wge s ALA 338 Cb -0.11 -2.22 1.83 0.00 0.00 0.00 0.00 23.12 22.62 2wge s ALA 338 CO 0.01 -2.04 2.21 -1.00 0.00 0.00 0.00 175.76 174.95 2wge h PRO 339 N 6.48 0.00 0.00 0.00 0.13 -1.88 -1.85 132.00 134.88 2wge h PRO 339 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2wge h PRO 339 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2wge h PRO 339 CO 0.70 0.04 0.03 0.87 -0.23 0.00 0.00 178.00 179.40 2wge h LYS 340 N 0.00 0.00 -0.38 0.86 1.57 -1.79 -0.32 116.57 116.51 2wge h LYS 340 Ca -0.00 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.86 2wge h LYS 340 Cb 0.14 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 2wge h LYS 340 CO 0.00 0.00 0.26 0.66 -0.57 0.00 0.00 179.45 179.81 2wge h SER 341 N 0.00 0.14 0.00 0.86 4.64 -1.58 -1.83 113.55 115.78 2wge h SER 341 Ca 0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 2wge h SER 341 Cb 0.06 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.09 2wge h SER 341 CO 0.00 0.09 -1.64 0.00 -0.87 0.00 0.00 176.83 174.41 2wge n ALA 342 N -2.56 1.76 0.67 5.18 0.00 -0.38 -4.64 120.51 120.53 2wge n ALA 342 Ca 0.05 -0.53 0.07 0.00 0.00 0.00 0.00 53.44 53.03 2wge n ALA 342 Cb 0.34 0.16 -0.07 0.00 0.00 0.00 0.00 19.45 19.89 2wge n ALA 342 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wge n LEU 343 N -2.63 0.80 0.00 0.00 4.77 -0.27 -1.10 117.00 118.57 2wge n LEU 343 Ca -0.18 -0.54 0.05 0.00 -0.03 0.00 0.00 56.01 55.31 2wge n LEU 343 Cb 0.75 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.82 2wge n LEU 343 CO 0.15 0.19 -0.07 0.61 -1.33 0.00 0.00 177.39 176.93 2wge n GLY 344 N 1.30 -1.65 3.57 -0.72 0.00 -0.69 -3.98 105.19 103.02 2wge n GLY 344 Ca 0.03 -1.21 -0.37 0.00 0.00 0.00 0.00 46.02 44.47 2wge n GLY 344 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2wge s HIS 345 N -0.76 3.20 -0.20 1.61 2.46 0.15 -4.49 115.29 117.26 2wge s HIS 345 Ca 0.00 -0.02 0.13 0.00 0.47 0.00 0.00 55.06 55.65 2wge s HIS 345 Cb 0.00 -2.29 0.41 0.00 -0.13 0.00 0.00 32.58 30.57 2wge s HIS 345 CO 0.00 -0.14 1.26 -1.13 -2.47 0.00 0.00 174.74 172.26 2wge n SER 346 N 4.74 2.19 0.00 9.88 3.41 -1.20 -1.64 113.62 131.00 2wge n SER 346 Ca -0.15 -3.60 0.00 0.00 -0.26 0.00 0.00 58.87 54.86 2wge n SER 346 Cb 0.52 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2wge n SER 346 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2wge n ILE 347 N -1.16 0.00 0.24 -1.33 2.08 -1.26 -1.07 119.36 116.86 2wge n ILE 347 Ca 0.21 0.00 0.10 0.00 0.56 0.00 0.00 62.75 63.62 2wge n ILE 347 Cb 0.75 0.00 0.62 0.00 -0.75 0.00 0.00 39.64 40.27 2wge n ILE 347 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2wge h GLY 348 N 0.00 0.00 1.01 7.39 0.00 -1.81 -2.84 103.07 106.81 2wge h GLY 348 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2wge h GLY 348 CO 0.00 0.00 -0.98 0.00 0.00 0.00 0.00 176.54 175.56 2wge h ALA 349 N 1.83 0.50 -0.31 3.60 0.00 -1.21 -1.41 119.26 122.26 2wge h ALA 349 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 2wge h ALA 349 Cb 0.43 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2wge h ALA 349 CO 0.02 0.00 -0.26 -0.24 0.00 0.00 0.00 179.25 178.77 2wge h VAL 350 N 0.00 1.27 -0.37 0.00 3.04 -1.52 -1.58 116.25 117.09 2wge h VAL 350 Ca 0.00 -1.34 -0.06 0.00 -1.01 0.00 0.00 66.70 64.29 2wge h VAL 350 Cb 0.99 1.32 -0.02 0.00 -2.01 0.00 0.00 31.29 31.58 2wge h VAL 350 CO 0.00 0.43 -0.01 1.23 -1.01 0.00 0.00 177.57 178.21 2wge h GLY 351 N 1.01 0.63 0.70 3.17 0.00 -1.77 0.57 103.07 107.37 2wge h GLY 351 Ca 0.07 -0.39 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 2wge h GLY 351 CO 0.06 0.36 -0.10 0.00 0.00 0.00 0.00 176.54 176.86 2wge h ALA 352 N 1.44 0.17 -0.42 3.60 0.00 -1.47 -1.34 119.26 121.24 2wge h ALA 352 Ca 0.12 -0.29 0.06 0.00 0.00 0.00 0.00 54.91 54.79 2wge h ALA 352 Cb 0.37 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 2wge h ALA 352 CO 0.01 0.00 0.11 1.25 0.00 0.00 0.00 179.25 180.63 2wge h LEU 353 N -0.11 0.08 -1.45 0.00 5.85 -1.04 -1.55 115.31 117.09 2wge h LEU 353 Ca 0.02 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 2wge h LEU 353 Cb 0.60 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 2wge h LEU 353 CO 0.03 0.08 -0.25 -0.33 -0.34 0.00 0.00 178.44 177.63 2wge h GLU 354 N 0.26 0.00 -0.36 1.25 5.08 -0.85 -0.90 114.58 119.06 2wge h GLU 354 Ca 0.20 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.46 2wge h GLU 354 Cb 0.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2wge h GLU 354 CO -0.23 0.25 -0.15 0.77 -1.00 0.00 0.00 179.01 178.64 2wge h SER 355 N 0.00 0.76 -0.36 1.42 0.02 -0.77 -1.19 113.55 113.43 2wge h SER 355 Ca -0.00 -0.40 0.02 0.00 -0.84 0.00 0.00 61.79 60.57 2wge h SER 355 Cb 0.58 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.88 2wge h SER 355 CO 0.03 0.98 0.19 0.58 -1.14 0.00 0.00 176.83 177.48 2wge h VAL 356 N 0.52 1.00 -0.58 2.27 2.07 -0.72 -1.71 116.25 119.11 2wge h VAL 356 Ca 0.08 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.47 2wge h VAL 356 Cb 0.69 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 2wge h VAL 356 CO 0.05 0.07 0.37 -0.07 0.02 0.00 0.00 177.57 178.01 2wge h LEU 357 N 0.39 0.67 -0.66 2.57 3.38 -1.07 -1.35 115.31 119.24 2wge h LEU 357 Ca 0.15 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 2wge h LEU 357 Cb 0.04 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2wge h LEU 357 CO -0.09 0.50 -0.08 0.74 0.09 0.00 0.00 178.44 179.60 2wge h THR 358 N 0.79 1.26 -0.26 0.22 2.02 -0.91 -0.08 112.91 115.95 2wge h THR 358 Ca 0.21 -1.21 -0.00 0.00 0.77 0.00 0.00 66.41 66.18 2wge h THR 358 Cb -0.07 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 2wge h THR 358 CO -0.04 0.43 0.15 0.58 0.37 0.00 0.00 175.52 177.00 2wge h VAL 359 N 0.87 1.11 -0.37 3.16 2.07 -0.64 -2.05 116.25 120.40 2wge h VAL 359 Ca 0.14 -0.28 -0.09 0.00 0.82 0.00 0.00 66.70 67.29 2wge h VAL 359 Cb 0.62 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2wge h VAL 359 CO 0.04 0.11 -0.15 -0.07 0.02 0.00 0.00 177.57 177.52 2wge h LEU 360 N 0.32 0.66 -0.68 2.57 3.38 -0.93 -0.27 115.31 120.36 2wge h LEU 360 Ca 0.09 -0.20 0.03 0.00 0.09 0.00 0.00 57.88 57.89 2wge h LEU 360 Cb 0.04 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 2wge h LEU 360 CO -0.02 0.82 0.42 0.74 0.09 0.00 0.00 178.44 180.50 2wge h THR 361 N 0.60 1.09 -0.19 0.22 2.02 -0.87 -0.24 112.91 115.55 2wge h THR 361 Ca 0.10 -0.28 -0.07 0.00 0.77 0.00 0.00 66.41 66.93 2wge h THR 361 Cb 0.59 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 67.19 2wge h THR 361 CO 0.04 0.15 -0.14 -0.07 0.37 0.00 0.00 175.52 175.87 2wge h LEU 362 N 0.83 0.45 -0.52 2.58 3.38 -1.06 -0.28 115.31 120.68 2wge h LEU 362 Ca 0.27 -0.45 0.05 0.00 0.09 0.00 0.00 57.88 57.84 2wge h LEU 362 Cb 0.02 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 2wge h LEU 362 CO -0.11 0.81 0.25 -0.09 0.09 0.00 0.00 178.44 179.39 2wge h ARG 363 N 0.10 0.48 -0.01 1.13 2.43 -0.88 -3.24 114.38 114.38 2wge h ARG 363 Ca 0.04 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2wge h ARG 363 Cb 0.66 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 2wge h ARG 363 CO 0.04 0.31 -0.53 -0.25 -1.51 0.00 0.00 179.97 178.03 2wge n ASP 364 N -4.90 1.84 -3.57 -3.80 8.00 -0.12 -4.98 116.55 109.02 2wge n ASP 364 Ca 0.05 -1.41 -0.24 0.00 0.71 0.00 0.00 54.79 53.90 2wge n ASP 364 Cb 0.15 0.52 0.08 0.00 -0.02 0.00 0.00 41.12 41.85 2wge n ASP 364 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wge n GLY 365 N 1.43 -0.55 3.36 0.44 0.00 -0.13 -4.96 105.19 104.78 2wge n GLY 365 Ca 0.09 0.25 -0.14 0.00 0.00 0.00 0.00 46.02 46.23 2wge n GLY 365 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wge s VAL 366 N -3.31 0.01 -0.14 1.61 0.11 -1.14 -1.02 120.40 116.52 2wge s VAL 366 Ca 0.58 -0.04 -0.00 0.00 -2.93 0.00 0.00 61.98 59.58 2wge s VAL 366 Cb -0.25 -0.66 -0.01 0.00 -1.53 0.00 0.00 36.38 33.92 2wge s VAL 366 CO 0.71 -0.02 -0.14 -0.63 -3.33 0.00 0.00 175.10 171.69 2wge s ILE 367 N 0.03 2.95 0.94 7.04 1.01 -0.52 -4.37 121.20 128.29 2wge s ILE 367 Ca -0.02 -0.69 -0.12 0.00 0.00 0.00 0.00 60.65 59.83 2wge s ILE 367 Cb -0.03 -2.24 0.16 0.00 0.01 0.00 0.00 42.46 40.35 2wge s ILE 367 CO 0.01 0.52 1.09 -2.84 0.00 0.00 0.00 174.94 173.72 2wge s PRO 368 N 0.49 0.89 0.27 2.79 0.02 -1.26 -1.09 135.00 137.11 2wge s PRO 368 Ca -0.09 0.85 -0.29 0.00 0.02 0.00 0.00 61.00 61.49 2wge s PRO 368 Cb -0.16 -1.76 -0.09 0.00 0.02 0.00 0.00 34.50 32.50 2wge s PRO 368 CO 0.04 -2.51 1.20 -1.25 -0.33 0.00 0.00 177.00 174.16 2wge s PRO 369 N -4.85 4.51 -0.27 5.54 0.04 -1.26 -4.74 135.00 133.96 2wge s PRO 369 Ca 0.64 1.97 -0.29 0.00 0.04 0.00 0.00 61.00 63.36 2wge s PRO 369 Cb -0.19 -3.16 -0.02 0.00 0.04 0.00 0.00 34.50 31.17 2wge s PRO 369 CO 0.58 -0.00 1.63 0.99 0.04 0.00 0.00 177.00 180.23 2wge s THR 370 N -0.85 3.68 0.60 1.26 2.01 0.79 -4.91 115.64 118.23 2wge s THR 370 Ca 0.48 0.75 -0.19 0.00 0.31 0.00 0.00 61.69 63.04 2wge s THR 370 Cb -0.35 -3.76 -0.03 0.00 0.01 0.00 0.00 72.50 68.37 2wge s THR 370 CO 0.44 -0.37 1.26 -0.76 -0.69 0.00 0.00 174.62 174.49 2wge s LEU 371 N 5.57 3.67 -0.16 4.42 1.43 -1.26 -3.43 118.68 128.92 2wge s LEU 371 Ca 0.72 2.53 0.00 0.00 -1.03 0.00 0.00 54.13 56.35 2wge s LEU 371 Cb -0.23 -4.55 0.00 0.00 0.03 0.00 0.00 46.19 41.44 2wge s LEU 371 CO 0.30 -1.73 0.00 0.59 0.23 0.00 0.00 176.35 175.74 2wge n ASN 372 N -1.60 -4.79 -4.49 2.29 3.02 -1.26 -4.63 115.26 103.80 2wge n ASN 372 Ca 0.14 0.04 -0.43 0.00 -0.03 0.00 0.00 54.58 54.30 2wge n ASN 372 Cb 0.48 -2.42 -0.03 0.00 -0.61 0.00 0.00 39.78 37.20 2wge n ASN 372 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2wge s TYR 373 N -1.52 2.72 -0.02 3.10 5.04 -1.22 -4.73 117.35 120.71 2wge s TYR 373 Ca 0.00 -0.78 0.02 0.00 -2.44 0.00 0.00 57.07 53.87 2wge s TYR 373 Cb 0.00 -4.43 -0.03 0.00 0.35 0.00 0.00 41.96 37.85 2wge s TYR 373 CO 0.00 -1.73 0.02 0.39 -1.34 0.00 0.00 175.55 172.89 2wge n GLU 374 N 7.86 2.90 -3.67 4.97 1.02 -1.26 -4.82 120.64 127.65 2wge n GLU 374 Ca 0.13 -0.01 -0.30 0.00 -0.02 0.00 0.00 57.16 56.97 2wge n GLU 374 Cb 0.48 -1.07 -0.15 0.00 -0.02 0.00 0.00 31.44 30.69 2wge n GLU 374 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2wge s THR 375 N -2.09 0.55 0.56 2.62 2.01 -1.26 -5.08 115.64 112.95 2wge s THR 375 Ca -0.01 -1.17 -0.20 0.00 0.31 0.00 0.00 61.69 60.62 2wge s THR 375 Cb 0.01 -1.43 -0.06 0.00 0.01 0.00 0.00 72.50 71.03 2wge s THR 375 CO 0.11 -0.69 1.01 -2.65 -0.69 0.00 0.00 174.62 171.71 2wge n PRO 376 N 4.99 1.08 -3.97 4.92 -0.02 -1.26 -0.17 135.00 140.57 2wge n PRO 376 Ca -0.03 0.41 -0.35 0.00 -2.02 0.00 0.00 63.50 61.50 2wge n PRO 376 Cb 0.42 -2.18 -0.13 0.00 -0.02 0.00 0.00 33.50 31.59 2wge n PRO 376 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2wge s ASP 377 N -1.10 4.72 0.46 2.55 -1.08 -1.26 -4.57 116.67 116.38 2wge s ASP 377 Ca 0.73 -0.26 0.22 0.00 -0.52 0.00 0.00 52.55 52.71 2wge s ASP 377 Cb -0.44 -1.82 1.22 0.00 -1.46 0.00 0.00 42.92 40.42 2wge s ASP 377 CO 0.49 0.02 1.86 -0.65 0.52 0.00 0.00 175.17 177.41 2wge h PRO 378 N 7.83 0.26 0.00 4.34 0.11 -1.96 0.94 132.00 143.52 2wge h PRO 378 Ca -0.38 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2wge h PRO 378 Cb 1.17 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2wge h PRO 378 CO 0.60 0.17 0.00 0.39 -0.21 0.00 0.00 178.00 178.95 2wge n GLU 379 N -4.44 0.15 -0.09 1.05 -0.58 -1.26 -3.90 120.64 111.57 2wge n GLU 379 Ca 0.19 0.23 -0.12 0.00 -0.42 0.00 0.00 57.16 57.05 2wge n GLU 379 Cb 0.80 -1.71 -0.05 0.00 -0.57 0.00 0.00 31.44 29.91 2wge n GLU 379 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 2wge n ILE 380 N -1.98 1.47 -3.81 -3.67 2.08 0.29 -4.84 119.36 108.90 2wge n ILE 380 Ca 0.05 0.10 -0.29 0.00 0.56 0.00 0.00 62.75 63.17 2wge n ILE 380 Cb 0.32 -2.26 0.02 0.00 -0.75 0.00 0.00 39.64 36.97 2wge n ILE 380 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 2wge n ASP 381 N -4.52 -2.84 -4.48 4.38 2.03 -1.01 -4.88 116.55 105.22 2wge n ASP 381 Ca -0.18 -1.01 -0.24 0.00 0.52 0.00 0.00 54.79 53.88 2wge n ASP 381 Cb 0.46 -3.25 -0.10 0.00 -0.72 0.00 0.00 41.12 37.51 2wge n ASP 381 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2wge s LEU 382 N -6.73 2.61 -1.10 -2.67 1.43 -1.26 -5.04 118.68 105.93 2wge s LEU 382 Ca 0.24 -1.03 -0.15 0.00 -1.03 0.00 0.00 54.13 52.16 2wge s LEU 382 Cb -0.09 -1.11 0.16 0.00 0.03 0.00 0.00 46.19 45.18 2wge s LEU 382 CO 0.87 0.03 1.31 -0.62 0.23 0.00 0.00 176.35 178.17 2wge s ASP 383 N -3.52 6.92 -0.22 2.29 2.15 -1.26 -4.99 116.67 118.04 2wge s ASP 383 Ca 0.30 -2.67 -0.22 0.00 0.43 0.00 0.00 52.55 50.39 2wge s ASP 383 Cb -0.05 -2.39 -0.02 0.00 -0.30 0.00 0.00 42.92 40.16 2wge s ASP 383 CO 0.15 -0.85 0.70 -0.69 -0.17 0.00 0.00 175.17 174.31 2wge s VAL 384 N 1.89 4.95 0.17 1.11 1.01 -1.26 -0.20 120.40 128.06 2wge s VAL 384 Ca 0.39 1.31 -0.30 0.00 0.00 0.00 0.00 61.98 63.37 2wge s VAL 384 Cb -0.04 -4.00 -0.08 0.00 0.00 0.00 0.00 36.38 32.26 2wge s VAL 384 CO -0.04 0.04 1.34 -0.69 0.00 0.00 0.00 175.10 175.76 2wge s VAL 385 N 2.30 3.24 0.20 2.92 1.01 0.12 -4.91 120.40 125.28 2wge s VAL 385 Ca 0.31 0.96 -0.21 0.00 0.00 0.00 0.00 61.98 63.04 2wge s VAL 385 Cb -0.16 -3.62 0.05 0.00 0.00 0.00 0.00 36.38 32.65 2wge s VAL 385 CO 0.09 0.12 0.62 0.00 0.00 0.00 0.00 175.10 175.93 2wge s ALA 386 N 0.50 -1.34 0.00 5.51 0.00 -1.26 -0.15 121.76 125.02 2wge s ALA 386 Ca 0.60 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.65 2wge s ALA 386 Cb -0.37 0.87 0.00 0.00 0.00 0.00 0.00 23.12 23.62 2wge s ALA 386 CO 0.35 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.66 2wge n GLY 387 N -0.39 1.99 3.46 0.00 0.00 -1.26 -4.80 105.19 104.18 2wge n GLY 387 Ca -0.12 -0.27 -0.10 0.00 0.00 0.00 0.00 46.02 45.54 2wge n GLY 387 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wge s GLU 388 N 0.00 1.29 0.39 1.61 -1.05 -1.26 -4.96 118.70 114.72 2wge s GLU 388 Ca 0.00 -0.86 -0.26 0.00 -0.15 0.00 0.00 54.97 53.71 2wge s GLU 388 Cb 0.00 0.50 -0.11 0.00 -0.44 0.00 0.00 34.13 34.08 2wge s GLU 388 CO 0.00 -0.54 1.14 -2.30 0.95 0.00 0.00 175.26 174.51 2wge n PRO 389 N -0.31 1.66 -3.56 -4.83 -0.02 -1.26 -4.36 135.00 122.31 2wge n PRO 389 Ca -0.11 0.59 -0.41 0.00 -2.02 0.00 0.00 63.50 61.55 2wge n PRO 389 Cb 0.63 -2.17 -0.11 0.00 -0.02 0.00 0.00 33.50 31.83 2wge n PRO 389 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2wge s ARG 390 N -2.00 3.14 -0.00 -0.52 3.52 -0.25 -4.94 118.95 117.90 2wge s ARG 390 Ca 0.61 -0.88 -0.30 0.00 -0.13 0.00 0.00 55.73 55.03 2wge s ARG 390 Cb -0.56 -3.77 -0.03 0.00 -1.56 0.00 0.00 34.95 29.03 2wge s ARG 390 CO 0.58 -0.58 0.97 0.71 -0.81 0.00 0.00 175.30 176.17 2wge s TYR 391 N 1.64 3.66 0.21 5.12 2.02 -1.26 -1.43 117.35 127.30 2wge s TYR 391 Ca 0.04 1.68 -0.19 0.00 -0.37 0.00 0.00 57.07 58.23 2wge s TYR 391 Cb -0.18 -3.10 0.03 0.00 -0.40 0.00 0.00 41.96 38.31 2wge s TYR 391 CO 0.08 -0.00 0.58 0.20 -1.57 0.00 0.00 175.55 174.84 2wge s GLY 392 N 0.99 -0.20 -1.32 0.71 0.00 -0.19 -4.99 107.32 102.33 2wge s GLY 392 Ca 0.51 -0.10 -0.12 0.00 0.00 0.00 0.00 44.72 45.02 2wge s GLY 392 CO 0.28 -0.14 1.90 1.34 0.00 0.00 0.00 173.10 176.47 2wge n ASP 393 N -0.38 4.76 -4.61 1.64 2.03 -1.26 -4.48 116.55 114.25 2wge n ASP 393 Ca -0.10 -3.00 -0.42 0.00 0.52 0.00 0.00 54.79 51.79 2wge n ASP 393 Cb 0.62 -1.57 -0.04 0.00 -0.72 0.00 0.00 41.12 39.41 2wge n ASP 393 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2wge s TYR 394 N 1.68 3.18 -0.26 -0.67 2.02 -1.26 -4.88 117.35 117.16 2wge s TYR 394 Ca 0.43 0.83 0.02 0.00 -0.37 0.00 0.00 57.07 57.98 2wge s TYR 394 Cb 0.08 -3.32 -0.17 0.00 -0.40 0.00 0.00 41.96 38.15 2wge s TYR 394 CO -0.01 -0.63 -0.23 0.54 -1.57 0.00 0.00 175.55 173.65 2wge n ARG 395 N 6.35 0.65 -4.09 -0.62 1.74 -1.26 -4.68 116.66 114.75 2wge n ARG 395 Ca 0.05 0.15 -0.14 0.00 -0.77 0.00 0.00 57.85 57.14 2wge n ARG 395 Cb 0.48 -1.52 -0.12 0.00 -1.02 0.00 0.00 32.46 30.28 2wge n ARG 395 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2wge s TYR 396 N -2.52 0.59 0.03 -1.55 2.02 -1.26 -1.10 117.35 113.56 2wge s TYR 396 Ca -0.35 -0.37 -0.06 0.00 -0.37 0.00 0.00 57.07 55.92 2wge s TYR 396 Cb 0.09 -0.36 -0.01 0.00 -0.40 0.00 0.00 41.96 41.28 2wge s TYR 396 CO 0.60 -0.06 0.11 0.00 -1.57 0.00 0.00 175.55 174.63 2wge s ALA 397 N -0.98 -0.14 -0.13 3.71 0.00 -0.34 -2.00 121.76 121.88 2wge s ALA 397 Ca -0.06 -0.43 0.02 0.00 0.00 0.00 0.00 51.96 51.49 2wge s ALA 397 Cb -0.07 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.26 2wge s ALA 397 CO 0.00 -0.29 -0.20 0.08 0.00 0.00 0.00 175.76 175.36 2wge s VAL 398 N -2.25 2.33 -0.23 0.00 1.01 -0.72 -0.79 120.40 119.75 2wge s VAL 398 Ca -0.08 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 60.88 2wge s VAL 398 Cb -0.03 -1.94 -0.05 0.00 0.00 0.00 0.00 36.38 34.36 2wge s VAL 398 CO -0.03 0.54 0.25 0.21 0.00 0.00 0.00 175.10 176.07 2wge s ASN 399 N 0.64 6.21 -0.03 3.32 2.47 -0.05 -0.92 114.94 126.58 2wge s ASN 399 Ca -0.10 0.23 -0.08 0.00 0.42 0.00 0.00 52.86 53.34 2wge s ASN 399 Cb -0.16 -2.15 -0.05 0.00 -1.45 0.00 0.00 41.25 37.44 2wge s ASN 399 CO 0.02 -0.00 0.24 0.20 -3.72 0.00 0.00 177.10 173.84 2wge s ASN 400 N 1.15 6.50 -0.19 -4.21 0.01 -0.25 -1.57 114.94 116.38 2wge s ASN 400 Ca 0.11 0.57 -0.06 0.00 -0.71 0.00 0.00 52.86 52.78 2wge s ASN 400 Cb -0.14 -2.10 0.09 0.00 0.41 0.00 0.00 41.25 39.51 2wge s ASN 400 CO 0.06 0.31 0.38 -0.55 -1.51 0.00 0.00 177.10 175.80 2wge s SER 401 N -1.44 -0.08 0.13 -1.22 0.15 -0.41 -3.23 113.70 107.60 2wge s SER 401 Ca 0.23 0.84 0.10 0.00 0.70 0.00 0.00 55.95 57.82 2wge s SER 401 Cb -0.13 1.20 -0.04 0.00 -1.71 0.00 0.00 66.02 65.34 2wge s SER 401 CO 0.12 -0.24 -0.20 -0.36 1.20 0.00 0.00 173.24 173.76 2wge s PHE 402 N 2.57 2.47 0.04 3.44 0.08 -1.26 -1.09 117.98 124.23 2wge s PHE 402 Ca 0.00 -0.29 0.04 0.00 0.12 0.00 0.00 56.93 56.80 2wge s PHE 402 Cb -0.12 -1.31 -0.02 0.00 -0.57 0.00 0.00 43.02 40.99 2wge s PHE 402 CO -0.12 0.39 -0.12 0.20 -0.10 0.00 0.00 175.22 175.46 2wge s GLY 403 N -2.18 0.69 0.21 4.36 0.00 0.64 -3.87 107.32 107.18 2wge s GLY 403 Ca 0.17 -0.78 -0.30 0.00 0.00 0.00 0.00 44.72 43.82 2wge s GLY 403 CO 0.09 -0.78 0.79 0.69 0.00 0.00 0.00 173.10 173.89 2wge n PHE 404 N 1.82 0.35 0.00 1.90 3.72 -1.26 -1.20 117.46 122.78 2wge n PHE 404 Ca -0.19 0.86 0.00 0.00 -0.05 0.00 0.00 57.45 58.07 2wge n PHE 404 Cb 0.55 -2.10 0.00 0.00 -0.94 0.00 0.00 39.48 36.99 2wge n PHE 404 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wge n GLY 405 N 1.73 0.50 1.74 1.37 0.00 -0.32 -4.55 105.19 105.67 2wge n GLY 405 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.16 2wge n GLY 405 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wge n GLY 406 N -1.62 0.69 3.61 -0.02 0.00 -0.59 -4.69 105.19 102.57 2wge n GLY 406 Ca 0.00 -0.72 -0.39 0.00 0.00 0.00 0.00 46.02 44.91 2wge n GLY 406 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wge s HIS 407 N -2.65 3.25 -0.18 1.61 3.76 -0.34 -0.85 115.29 119.88 2wge s HIS 407 Ca 0.01 0.33 -0.01 0.00 -0.15 0.00 0.00 55.06 55.24 2wge s HIS 407 Cb -0.01 -2.50 -0.00 0.00 1.11 0.00 0.00 32.58 31.18 2wge s HIS 407 CO 0.02 -0.18 -0.12 -0.80 -0.85 0.00 0.00 174.74 172.81 2wge s ASN 408 N 1.61 3.85 -0.07 1.40 0.01 -0.48 -0.26 114.94 121.01 2wge s ASN 408 Ca 0.12 -0.45 0.02 0.00 -0.71 0.00 0.00 52.86 51.84 2wge s ASN 408 Cb -0.16 -1.62 0.01 0.00 0.41 0.00 0.00 41.25 39.90 2wge s ASN 408 CO 0.10 0.04 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.92 2wge s VAL 409 N 1.09 1.16 -0.07 1.60 1.01 -0.25 -1.37 120.40 123.56 2wge s VAL 409 Ca 0.00 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 61.54 2wge s VAL 409 Cb -0.15 -1.07 0.00 0.00 0.00 0.00 0.00 36.38 35.17 2wge s VAL 409 CO -0.03 0.36 -0.17 0.00 0.00 0.00 0.00 175.10 175.26 2wge s ALA 410 N 0.76 1.59 -0.11 5.51 0.00 -0.56 -1.28 121.76 127.67 2wge s ALA 410 Ca -0.13 -0.66 0.03 0.00 0.00 0.00 0.00 51.96 51.20 2wge s ALA 410 Cb -0.16 -0.61 -0.00 0.00 0.00 0.00 0.00 23.12 22.35 2wge s ALA 410 CO 0.03 0.22 -0.20 -0.51 0.00 0.00 0.00 175.76 175.29 2wge s LEU 411 N 0.35 2.29 -0.26 0.00 1.43 -0.61 -0.65 118.68 121.24 2wge s LEU 411 Ca -0.12 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 52.39 2wge s LEU 411 Cb -0.15 -1.48 -0.05 0.00 0.03 0.00 0.00 46.19 44.55 2wge s LEU 411 CO 0.04 0.16 0.18 0.00 0.23 0.00 0.00 176.35 176.96 2wge s ALA 412 N 0.36 3.57 0.15 4.21 0.00 -0.38 -0.87 121.76 128.80 2wge s ALA 412 Ca -0.16 -0.98 0.11 0.00 0.00 0.00 0.00 51.96 50.93 2wge s ALA 412 Cb -0.17 -2.40 -0.04 0.00 0.00 0.00 0.00 23.12 20.50 2wge s ALA 412 CO 0.08 -0.36 -0.26 -0.06 0.00 0.00 0.00 175.76 175.16 2wge s PHE 413 N 1.39 2.32 0.10 0.00 0.08 0.03 -0.38 117.98 121.52 2wge s PHE 413 Ca 0.07 -0.37 0.06 0.00 0.12 0.00 0.00 56.93 56.81 2wge s PHE 413 Cb -0.15 -1.22 -0.03 0.00 -0.57 0.00 0.00 43.02 41.05 2wge s PHE 413 CO 0.08 0.39 -0.15 0.20 -0.10 0.00 0.00 175.22 175.64 2wge s GLY 414 N -2.26 1.00 0.40 4.36 0.00 0.07 -1.20 107.32 109.69 2wge s GLY 414 Ca 0.16 -1.17 -0.27 0.00 0.00 0.00 0.00 44.72 43.45 2wge s GLY 414 CO 0.07 -1.21 1.41 -1.60 0.00 0.00 0.00 173.10 171.77 2wge s ARG 415 N -2.21 4.00 0.00 2.90 3.52 -0.26 -0.62 118.95 126.27 2wge s ARG 415 Ca 0.04 2.39 0.28 0.00 -0.13 0.00 0.00 55.73 58.31 2wge s ARG 415 Cb -0.07 -2.85 0.96 0.00 -1.56 0.00 0.00 34.95 31.42 2wge s ARG 415 CO 0.03 -0.56 1.69 0.98 -0.81 0.00 0.00 175.30 176.63