#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jal s VAL 3 N 0.00 3.51 -0.69 3.44 -7.23 -1.26 -4.82 120.40 113.35 2jal s VAL 3 Ca 0.00 1.07 -0.11 0.00 -1.81 0.00 0.00 61.98 61.13 2jal s VAL 3 Cb 0.00 -3.69 0.18 0.00 0.56 0.00 0.00 36.38 33.43 2jal s VAL 3 CO 0.00 0.08 0.59 -0.54 -0.31 0.00 0.00 175.10 174.92 2jal s LYS 4 N 1.21 3.12 -0.06 4.82 -0.14 -0.75 -4.98 119.74 122.95 2jal s LYS 4 Ca 0.63 -2.27 -0.26 0.00 -1.36 0.00 0.00 55.97 52.71 2jal s LYS 4 Cb -0.35 -4.18 -0.03 0.00 -1.68 0.00 0.00 37.83 31.59 2jal s LYS 4 CO 0.30 -1.26 0.83 0.21 -0.76 0.00 0.00 175.35 174.67 2jal s LYS 5 N 0.50 4.46 0.55 1.68 2.47 -1.26 -1.87 119.74 126.26 2jal s LYS 5 Ca 0.14 1.11 -0.06 0.00 -1.56 0.00 0.00 55.97 55.60 2jal s LYS 5 Cb -0.18 -3.48 -0.02 0.00 -1.46 0.00 0.00 37.83 32.70 2jal s LYS 5 CO -0.05 -0.05 0.87 -0.06 0.16 0.00 0.00 175.35 176.22 2jal s PHE 6 N 1.13 3.45 1.00 4.03 0.40 -0.41 -5.01 117.98 122.57 2jal s PHE 6 Ca 0.43 0.82 -0.15 0.00 -0.60 0.00 0.00 56.93 57.44 2jal s PHE 6 Cb -0.19 -2.54 0.05 0.00 0.51 0.00 0.00 43.02 40.85 2jal s PHE 6 CO 0.21 -0.56 0.23 -2.30 0.70 0.00 0.00 175.22 173.49 2jal n PRO 7 N -2.47 -0.64 -2.69 0.24 -0.02 -1.26 -4.92 135.00 123.24 2jal n PRO 7 Ca 0.03 -0.16 -0.42 0.00 -2.02 0.00 0.00 63.50 60.93 2jal n PRO 7 Cb 0.56 -1.77 -0.03 0.00 -0.02 0.00 0.00 33.50 32.24 2jal n PRO 7 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 2jal s GLU 8 N -3.50 4.51 0.00 -0.52 4.04 -1.26 -3.20 118.70 118.77 2jal s GLU 8 Ca 0.56 1.43 0.00 0.00 0.04 0.00 0.00 54.97 57.00 2jal s GLU 8 Cb -0.18 -3.48 0.00 0.00 0.02 0.00 0.00 34.13 30.49 2jal s GLU 8 CO 0.68 -0.14 0.00 0.41 -1.84 0.00 0.00 175.26 174.36 2jal n GLY 9 N 2.98 0.75 3.62 -3.83 0.00 -1.26 -5.04 105.19 102.40 2jal n GLY 9 Ca 0.07 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.62 2jal n GLY 9 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2jal n PHE 10 N -2.32 1.73 -3.29 1.61 7.35 -1.19 -4.96 117.46 116.38 2jal n PHE 10 Ca 0.00 0.55 -0.40 0.00 -0.76 0.00 0.00 57.45 56.84 2jal n PHE 10 Cb 0.00 -2.38 -0.08 0.00 0.35 0.00 0.00 39.48 37.37 2jal n PHE 10 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 2jal s LEU 11 N 0.44 4.15 -0.25 -2.13 2.96 -0.76 -4.99 118.68 118.11 2jal s LEU 11 Ca 0.72 0.25 -0.09 0.00 -0.22 0.00 0.00 54.13 54.80 2jal s LEU 11 Cb -0.77 -2.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.34 2jal s LEU 11 CO 0.50 -0.31 0.11 0.26 -1.32 0.00 0.00 176.35 175.59 2jal s TRP 12 N 2.25 3.18 0.36 5.38 0.52 -1.26 -1.03 118.94 128.33 2jal s TRP 12 Ca 0.18 -0.10 0.03 0.00 0.02 0.00 0.00 56.10 56.23 2jal s TRP 12 Cb -0.16 -2.26 -0.04 0.00 -1.15 0.00 0.00 33.47 29.87 2jal s TRP 12 CO 0.11 -0.17 0.10 0.20 0.02 0.00 0.00 176.95 177.22 2jal s GLY 13 N 1.38 2.31 0.20 0.98 0.00 0.85 -1.51 107.32 111.54 2jal s GLY 13 Ca 0.06 -1.60 0.08 0.00 0.00 0.00 0.00 44.72 43.26 2jal s GLY 13 CO 0.05 -1.78 -0.15 -1.34 0.00 0.00 0.00 173.10 169.88 2jal s VAL 14 N -3.32 1.75 0.04 1.40 -7.23 -0.55 -2.10 120.40 110.39 2jal s VAL 14 Ca 0.30 -2.17 0.03 0.00 -1.81 0.00 0.00 61.98 58.33 2jal s VAL 14 Cb 0.05 -2.01 -0.02 0.00 0.56 0.00 0.00 36.38 34.96 2jal s VAL 14 CO 0.15 -0.56 -0.09 0.00 -0.31 0.00 0.00 175.10 174.29 2jal s ALA 15 N -2.83 0.71 0.35 1.32 0.00 -0.62 -0.72 121.76 119.97 2jal s ALA 15 Ca 0.21 -0.74 0.02 0.00 0.00 0.00 0.00 51.96 51.45 2jal s ALA 15 Cb -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.08 2jal s ALA 15 CO 0.07 0.05 0.42 0.95 0.00 0.00 0.00 175.76 177.25 2jal s THR 16 N -1.15 0.00 0.01 0.00 -4.23 -0.18 -2.92 115.64 107.17 2jal s THR 16 Ca -0.06 -1.74 0.00 0.00 -1.18 0.00 0.00 61.69 58.72 2jal s THR 16 Cb -0.09 -2.62 -0.01 0.00 1.34 0.00 0.00 72.50 71.12 2jal s THR 16 CO 0.01 0.00 -0.03 0.00 -0.54 0.00 0.00 174.62 174.06 2jal s ALA 17 N -3.08 0.16 0.17 3.99 0.00 -1.26 -3.98 121.76 117.76 2jal s ALA 17 Ca 0.34 -0.36 -0.22 0.00 0.00 0.00 0.00 51.96 51.72 2jal s ALA 17 Cb 0.00 0.06 0.07 0.00 0.00 0.00 0.00 23.12 23.25 2jal s ALA 17 CO 0.24 -0.06 1.59 0.66 0.00 0.00 0.00 175.76 178.20 2jal h SER 18 N 5.31 -1.11 0.71 0.00 4.64 -1.90 -1.67 113.55 119.53 2jal h SER 18 Ca -0.29 0.20 -0.03 0.00 -0.47 0.00 0.00 61.79 61.20 2jal h SER 18 Cb 1.21 0.53 -0.00 0.00 -0.31 0.00 0.00 62.40 63.82 2jal h SER 18 CO 0.45 -0.32 -0.15 0.22 -0.87 0.00 0.00 176.83 176.17 2jal h TYR 19 N -0.23 0.00 0.00 4.77 3.20 -1.93 -0.68 116.97 122.10 2jal h TYR 19 Ca 0.19 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.01 2jal h TYR 19 Cb 0.54 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.80 2jal h TYR 19 CO -0.57 0.15 -0.23 1.96 -1.64 0.00 0.00 178.16 177.84 2jal h GLN 20 N 0.00 0.00 0.00 1.82 4.20 -1.57 -3.40 115.11 116.16 2jal h GLN 20 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2jal h GLN 20 Cb 0.55 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.33 2jal h GLN 20 CO 0.02 0.23 -0.76 0.44 -0.67 0.00 0.00 178.83 178.09 2jal n ILE 21 N -3.18 0.00 -0.04 2.54 -5.35 -1.12 -0.95 119.36 111.26 2jal n ILE 21 Ca 0.03 0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.36 2jal n ILE 21 Cb 0.59 -0.37 -0.09 0.00 -1.74 0.00 0.00 39.64 38.03 2jal n ILE 21 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 2jal h GLU 22 N 0.00 0.34 0.00 6.28 5.08 -1.33 -1.93 114.58 123.03 2jal h GLU 22 Ca 0.00 -0.25 0.03 0.00 -1.00 0.00 0.00 59.36 58.14 2jal h GLU 22 Cb 0.50 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 2jal h GLU 22 CO 0.00 0.87 -0.04 0.41 -1.00 0.00 0.00 179.01 179.25 2jal n GLY 23 N 0.58 -0.90 3.94 -3.84 0.00 -1.21 -1.32 105.19 102.44 2jal n GLY 23 Ca -0.08 -0.90 -0.28 0.00 0.00 0.00 0.00 46.02 44.75 2jal n GLY 23 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jal n SER 24 N -3.20 -1.44 0.24 1.61 7.64 -0.50 -4.67 113.62 113.30 2jal n SER 24 Ca 0.00 -1.05 0.12 0.00 1.01 0.00 0.00 58.87 58.95 2jal n SER 24 Cb 0.05 -2.91 0.59 0.00 -1.01 0.00 0.00 64.21 60.93 2jal n SER 24 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2jal h PRO 25 N -1.90 0.00 -0.29 1.43 0.13 -1.82 -2.44 132.00 127.12 2jal h PRO 25 Ca -0.65 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.48 2jal h PRO 25 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 2jal h PRO 25 CO 0.59 0.17 0.00 1.28 -0.23 0.00 0.00 178.00 179.82 2jal n LEU 26 N -3.46 2.87 -4.76 1.56 4.77 -1.26 -4.63 117.00 112.09 2jal n LEU 26 Ca -0.01 -1.60 -0.38 0.00 -0.03 0.00 0.00 56.01 53.99 2jal n LEU 26 Cb 0.34 -0.19 0.02 0.00 -2.33 0.00 0.00 43.42 41.26 2jal n LEU 26 CO 0.31 0.65 0.95 0.00 -1.33 0.00 0.00 177.39 177.98 2jal s ALA 27 N -1.11 2.97 -1.46 -1.18 0.00 -0.92 -4.01 121.76 116.04 2jal s ALA 27 Ca 0.26 1.24 -0.11 0.00 0.00 0.00 0.00 51.96 53.35 2jal s ALA 27 Cb 0.15 -3.51 0.05 0.00 0.00 0.00 0.00 23.12 19.81 2jal s ALA 27 CO 0.21 -1.10 0.96 -0.25 0.00 0.00 0.00 175.76 175.58 2jal n ASP 28 N -0.64 -5.43 0.00 0.00 8.00 -1.26 -2.42 116.55 114.80 2jal n ASP 28 Ca 0.08 -0.61 0.00 0.00 0.71 0.00 0.00 54.79 54.97 2jal n ASP 28 Cb 0.45 -4.33 0.00 0.00 -0.02 0.00 0.00 41.12 37.22 2jal n ASP 28 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jal n GLY 29 N -1.73 0.70 3.76 0.44 0.00 -1.26 -4.62 105.19 102.48 2jal n GLY 29 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 2jal n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jal s ALA 30 N -2.26 3.47 0.69 4.61 0.00 -1.01 -4.75 121.76 122.51 2jal s ALA 30 Ca 0.00 1.12 -0.11 0.00 0.00 0.00 0.00 51.96 52.96 2jal s ALA 30 Cb 0.00 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.70 2jal s ALA 30 CO 0.00 -0.46 1.08 0.20 0.00 0.00 0.00 175.76 176.58 2jal s GLY 31 N -0.58 1.64 0.55 0.00 0.00 -0.06 -4.65 107.32 104.22 2jal s GLY 31 Ca 0.48 -0.27 -0.20 0.00 0.00 0.00 0.00 44.72 44.73 2jal s GLY 31 CO 0.48 0.08 1.20 1.06 0.00 0.00 0.00 173.10 175.92 2jal s MET 32 N -5.30 3.20 0.44 2.90 -1.94 -1.26 -4.61 119.30 112.73 2jal s MET 32 Ca 0.57 1.83 0.08 0.00 -1.71 0.00 0.00 55.69 56.46 2jal s MET 32 Cb -0.11 -2.06 0.00 0.00 2.01 0.00 0.00 34.83 34.67 2jal s MET 32 CO 0.52 -1.02 0.48 -1.54 -0.01 0.00 0.00 175.02 173.45 2jal s SER 33 N -1.51 5.21 0.49 3.03 1.04 -1.26 -0.75 113.70 119.95 2jal s SER 33 Ca 0.74 -0.69 0.26 0.00 0.48 0.00 0.00 55.95 56.74 2jal s SER 33 Cb -0.30 -0.43 1.24 0.00 0.10 0.00 0.00 66.02 66.63 2jal s SER 33 CO 0.34 -0.79 1.97 0.16 0.98 0.00 0.00 173.24 175.89 2jal h ILE 34 N 0.80 0.54 0.00 -1.02 3.07 -1.16 -2.56 117.51 117.17 2jal h ILE 34 Ca -0.39 -0.78 -0.17 0.00 1.55 0.00 0.00 64.86 65.07 2jal h ILE 34 Cb 1.28 1.52 -0.02 0.00 -0.27 0.00 0.00 36.82 39.32 2jal h ILE 34 CO 0.52 0.16 -0.81 -0.50 -1.05 0.00 0.00 178.15 176.47 2jal h TRP 35 N 0.00 0.00 0.27 0.16 4.06 -1.83 -0.49 115.95 118.12 2jal h TRP 35 Ca -0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 2jal h TRP 35 Cb 0.51 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.67 2jal h TRP 35 CO 0.00 0.81 -0.13 1.25 -3.56 0.00 0.00 178.44 176.81 2jal h HIS 36 N 0.00 -0.34 -0.30 0.49 2.76 -1.86 0.10 115.15 116.00 2jal h HIS 36 Ca -0.01 -0.01 -0.12 0.00 -2.20 0.00 0.00 60.37 58.03 2jal h HIS 36 Cb 1.48 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 30.54 2jal h HIS 36 CO 0.00 -0.07 -0.32 1.79 -1.30 0.00 0.00 177.93 178.03 2jal h THR 37 N -0.57 1.28 -0.30 6.26 1.35 -1.54 -0.24 112.91 119.15 2jal h THR 37 Ca -0.04 -1.44 -0.04 0.00 -0.55 0.00 0.00 66.41 64.34 2jal h THR 37 Cb 0.42 1.40 -0.01 0.00 -1.73 0.00 0.00 68.15 68.23 2jal h THR 37 CO 0.06 0.46 0.04 0.15 -0.25 0.00 0.00 175.52 175.99 2jal h PHE 38 N 0.54 0.53 0.00 4.73 3.57 -1.09 -2.72 116.94 122.50 2jal h PHE 38 Ca 0.06 -0.08 -0.10 0.00 3.53 0.00 0.00 57.97 61.39 2jal h PHE 38 Cb 0.81 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 2jal h PHE 38 CO 0.04 0.59 -0.47 0.66 -2.23 0.00 0.00 178.31 176.90 2jal h SER 39 N 0.31 0.00 0.00 0.41 4.64 -0.85 -2.58 113.55 115.48 2jal h SER 39 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2jal h SER 39 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2jal h SER 39 CO 0.01 0.47 0.00 1.41 -0.87 0.00 0.00 176.83 177.85 2jal n HIS 40 N -3.65 0.00 -3.20 4.77 8.25 -0.11 -4.70 115.22 116.58 2jal n HIS 40 Ca -0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.05 2jal n HIS 40 Cb 0.55 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.59 2jal n HIS 40 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2jal s THR 41 N -2.00 5.01 0.31 1.59 2.01 -0.97 -5.05 115.64 116.54 2jal s THR 41 Ca 0.42 0.75 -0.29 0.00 0.31 0.00 0.00 61.69 62.88 2jal s THR 41 Cb 0.19 -3.91 -0.12 0.00 0.01 0.00 0.00 72.50 68.67 2jal s THR 41 CO 0.33 -0.05 1.48 -2.65 -0.69 0.00 0.00 174.62 173.03 2jal n PRO 42 N 5.70 2.45 0.00 4.92 -0.02 -1.26 -2.82 135.00 143.96 2jal n PRO 42 Ca -0.03 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2jal n PRO 42 Cb 0.49 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 2jal n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jal n GLY 43 N 1.52 0.48 0.09 -1.23 0.00 -1.26 -4.94 105.19 99.85 2jal n GLY 43 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 2jal n GLY 43 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2jal h ASN 44 N 0.00 0.11 -4.36 1.61 2.35 -1.80 -3.47 115.58 110.02 2jal h ASN 44 Ca 0.00 -0.20 -0.63 0.00 -0.55 0.00 0.00 56.30 54.92 2jal h ASN 44 Cb 0.00 -0.04 -0.27 0.00 0.05 0.00 0.00 38.32 38.06 2jal h ASN 44 CO 0.00 1.18 -0.86 -0.69 -1.65 0.00 0.00 177.43 175.40 2jal s VAL 45 N -2.61 1.84 0.29 2.81 1.01 -1.26 -4.77 120.40 117.70 2jal s VAL 45 Ca -0.07 -1.16 -0.30 0.00 0.00 0.00 0.00 61.98 60.45 2jal s VAL 45 Cb 0.08 -1.56 -0.12 0.00 0.00 0.00 0.00 36.38 34.77 2jal s VAL 45 CO 0.82 0.36 1.44 0.29 0.00 0.00 0.00 175.10 178.01 2jal n LYS 46 N 2.08 2.29 -1.40 2.72 5.02 -0.35 -1.56 118.16 126.96 2jal n LYS 46 Ca -0.16 0.81 -0.14 0.00 -2.02 0.00 0.00 58.31 56.80 2jal n LYS 46 Cb 0.53 -2.49 -0.06 0.00 -0.02 0.00 0.00 35.03 32.98 2jal n LYS 46 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2jal n ASN 47 N 1.73 -5.69 -2.34 4.39 3.02 -1.26 -2.04 115.26 113.06 2jal n ASN 47 Ca 0.08 0.34 -0.18 0.00 -0.03 0.00 0.00 54.58 54.80 2jal n ASN 47 Cb 0.35 -4.40 -0.01 0.00 -0.61 0.00 0.00 39.78 35.10 2jal n ASN 47 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jal n GLY 48 N 0.08 -0.33 3.74 7.41 0.00 -0.60 -4.96 105.19 110.54 2jal n GLY 48 Ca -0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 2jal n GLY 48 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jal s ASP 49 N -2.08 4.66 0.29 1.61 1.01 -0.87 -4.99 116.67 116.30 2jal s ASP 49 Ca 0.00 2.22 0.04 0.00 0.71 0.00 0.00 52.55 55.52 2jal s ASP 49 Cb 0.00 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 2jal s ASP 49 CO 0.00 -1.95 0.19 0.42 0.21 0.00 0.00 175.17 174.04 2jal s THR 50 N -2.07 0.15 -0.37 -1.27 -4.23 -1.26 -4.80 115.64 101.79 2jal s THR 50 Ca 0.72 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 59.28 2jal s THR 50 Cb -0.26 -2.50 0.51 0.00 1.34 0.00 0.00 72.50 71.59 2jal s THR 50 CO 0.42 0.00 1.55 0.61 -0.54 0.00 0.00 174.62 176.66 2jal n GLY 51 N -0.53 3.33 0.35 3.99 0.00 -1.26 -4.53 105.19 106.54 2jal n GLY 51 Ca 0.03 -0.72 -0.04 0.00 0.00 0.00 0.00 46.02 45.28 2jal n GLY 51 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2jal h ASP 52 N 1.42 1.09 0.00 1.61 5.19 -1.95 -3.31 116.42 120.47 2jal h ASP 52 Ca 0.29 -0.11 -0.05 0.00 -0.62 0.00 0.00 57.03 56.54 2jal h ASP 52 Cb 2.05 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 41.28 2jal h ASP 52 CO 0.63 0.89 -0.98 0.52 -3.12 0.00 0.00 179.24 177.17 2jal n VAL 53 N -4.35 0.42 0.00 -1.35 0.31 -1.26 -1.42 118.33 110.68 2jal n VAL 53 Ca 0.09 0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 2jal n VAL 53 Cb 0.11 -1.58 0.00 0.00 -0.91 0.00 0.00 33.84 31.46 2jal n VAL 53 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jal n ALA 54 N -3.26 0.00 0.96 3.52 0.00 -1.26 -0.92 120.51 119.55 2jal n ALA 54 Ca -0.06 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.50 2jal n ALA 54 Cb 0.45 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.10 2jal n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jal n ASP 56 N 1.16 -4.83 0.22 0.00 2.03 -0.10 -4.86 116.55 110.17 2jal n ASP 56 Ca 0.16 -0.58 0.15 0.00 0.52 0.00 0.00 54.79 55.05 2jal n ASP 56 Cb 0.55 -3.89 0.64 0.00 -0.72 0.00 0.00 41.12 37.70 2jal n ASP 56 CO 0.00 0.00 0.00 -0.74 -1.92 0.00 0.00 177.20 174.54 2jal h HIS 57 N -1.69 0.00 -0.11 -0.67 -0.00 -1.19 -0.08 115.15 111.42 2jal h HIS 57 Ca -0.53 0.00 0.01 0.00 -0.00 0.00 0.00 60.37 59.85 2jal h HIS 57 Cb 1.35 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.76 2jal h HIS 57 CO 0.59 0.00 0.07 -0.92 -0.00 0.00 0.00 177.93 177.67 2jal h TYR 58 N 0.00 0.11 0.00 5.26 3.20 -1.44 -2.38 116.97 121.72 2jal h TYR 58 Ca 0.00 0.00 -0.22 0.00 3.14 0.00 0.00 58.73 61.66 2jal h TYR 58 Cb 0.42 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.62 2jal h TYR 58 CO 0.00 0.07 -1.93 0.09 -1.64 0.00 0.00 178.16 174.74 2jal n ASN 59 N -4.52 1.47 -1.58 -2.11 3.02 -0.82 -4.68 115.26 106.04 2jal n ASN 59 Ca -0.01 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.62 2jal n ASN 59 Cb 0.10 1.00 0.36 0.00 -0.61 0.00 0.00 39.78 40.63 2jal n ASN 59 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2jal n ARG 60 N -2.44 4.07 -0.37 3.52 1.74 -0.11 -4.67 116.66 118.40 2jal n ARG 60 Ca -0.20 -2.97 -0.02 0.00 -0.77 0.00 0.00 57.85 53.89 2jal n ARG 60 Cb 0.87 -2.01 0.10 0.00 -1.02 0.00 0.00 32.46 30.40 2jal n ARG 60 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 2jal h TRP 61 N 3.67 1.25 0.01 -1.55 5.08 -1.67 -1.53 115.95 121.21 2jal h TRP 61 Ca 0.00 0.02 -0.00 0.00 1.08 0.00 0.00 58.89 59.99 2jal h TRP 61 Cb 1.64 -0.42 0.00 0.00 -3.00 0.00 0.00 29.16 27.38 2jal h TRP 61 CO 0.84 0.80 -0.00 -0.22 -1.28 0.00 0.00 178.44 178.58 2jal h LYS 62 N 1.34 -0.01 -0.94 0.12 3.64 -1.88 -1.35 116.57 117.48 2jal h LYS 62 Ca 0.36 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.83 2jal h LYS 62 Cb -0.13 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 31.57 2jal h LYS 62 CO -0.07 0.17 -0.56 1.49 -2.27 0.00 0.00 179.45 178.20 2jal h GLU 63 N -0.19 -0.04 -0.70 1.90 4.22 -1.84 -1.86 114.58 116.07 2jal h GLU 63 Ca -0.00 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.41 2jal h GLU 63 Cb 0.18 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 2jal h GLU 63 CO 0.00 -0.03 0.33 -0.44 -2.18 0.00 0.00 179.01 176.70 2jal h ASP 64 N -0.04 0.91 -0.07 1.04 3.32 -1.01 -1.94 116.42 118.62 2jal h ASP 64 Ca 0.17 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 2jal h ASP 64 Cb 0.45 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2jal h ASP 64 CO -0.91 0.78 -0.23 0.40 -1.72 0.00 0.00 179.24 177.56 2jal h ILE 65 N 1.00 1.26 0.00 0.35 2.04 -0.90 -2.58 117.51 118.68 2jal h ILE 65 Ca 0.24 -1.22 -0.05 0.00 1.00 0.00 0.00 64.86 64.84 2jal h ILE 65 Cb 0.11 1.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2jal h ILE 65 CO -0.03 0.39 -0.22 -0.33 0.00 0.00 0.00 178.15 177.96 2jal h GLU 66 N 0.43 0.00 -0.28 2.37 5.08 -0.55 -0.91 114.58 120.72 2jal h GLU 66 Ca 0.07 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.28 2jal h GLU 66 Cb 0.63 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.88 2jal h GLU 66 CO 0.05 0.22 -0.40 0.82 -1.00 0.00 0.00 179.01 178.70 2jal h ILE 67 N 0.00 1.30 -0.04 3.13 2.04 -1.26 0.34 117.51 123.02 2jal h ILE 67 Ca -0.00 -1.59 0.02 0.00 1.00 0.00 0.00 64.86 64.29 2jal h ILE 67 Cb 0.48 1.63 -0.03 0.00 -0.74 0.00 0.00 36.82 38.17 2jal h ILE 67 CO 0.03 0.51 -0.09 0.40 0.00 0.00 0.00 178.15 179.00 2jal h ILE 68 N 0.52 0.75 0.15 -0.67 2.04 -1.27 0.79 117.51 119.83 2jal h ILE 68 Ca 0.03 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.91 2jal h ILE 68 Cb 0.99 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 2jal h ILE 68 CO 0.09 0.00 -0.29 -0.08 0.00 0.00 0.00 178.15 177.88 2jal h GLU 69 N -0.14 -0.50 -0.67 2.37 4.81 -1.08 0.14 114.58 119.51 2jal h GLU 69 Ca 0.05 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.42 2jal h GLU 69 Cb 0.21 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.66 2jal h GLU 69 CO -0.13 -0.33 0.44 0.87 -0.73 0.00 0.00 179.01 179.13 2jal h LYS 70 N -0.52 0.49 0.00 1.92 1.57 -0.18 0.15 116.57 119.99 2jal h LYS 70 Ca 0.02 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2jal h LYS 70 Cb 0.53 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2jal h LYS 70 CO -0.15 0.32 -0.12 1.28 -0.57 0.00 0.00 179.45 180.21 2jal n LEU 71 N -4.48 0.62 -0.08 2.94 4.77 0.26 -4.93 117.00 116.09 2jal n LEU 71 Ca 0.11 0.48 -0.01 0.00 -0.03 0.00 0.00 56.01 56.56 2jal n LEU 71 Cb 0.37 -0.33 -0.00 0.00 -2.33 0.00 0.00 43.42 41.12 2jal n LEU 71 CO 0.33 -0.11 -0.01 0.61 -1.33 0.00 0.00 177.39 176.88 2jal n GLY 72 N 1.36 0.39 3.75 -0.72 0.00 0.51 -4.51 105.19 105.97 2jal n GLY 72 Ca 0.05 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2jal n GLY 72 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2jal n VAL 73 N -2.61 1.63 0.53 1.61 0.31 -0.95 -4.92 118.33 113.93 2jal n VAL 73 Ca -0.01 -0.41 0.11 0.00 -0.01 0.00 0.00 64.34 64.03 2jal n VAL 73 Cb 0.21 -1.89 0.06 0.00 -0.91 0.00 0.00 33.84 31.31 2jal n VAL 73 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 2jal n LYS 74 N 1.09 0.31 -4.03 5.55 0.00 -0.57 -4.74 118.16 115.78 2jal n LYS 74 Ca 0.05 0.02 -0.11 0.00 -0.00 0.00 0.00 58.31 58.27 2jal n LYS 74 Cb 0.37 -1.63 -0.11 0.00 -0.00 0.00 0.00 35.03 33.66 2jal n LYS 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2jal s ALA 75 N -3.20 0.36 -0.16 0.58 0.00 -0.74 -1.08 121.76 117.51 2jal s ALA 75 Ca 0.04 -0.73 -0.01 0.00 0.00 0.00 0.00 51.96 51.26 2jal s ALA 75 Cb 0.14 0.11 0.05 0.00 0.00 0.00 0.00 23.12 23.42 2jal s ALA 75 CO 0.78 -0.12 -0.02 -0.47 0.00 0.00 0.00 175.76 175.93 2jal s TYR 76 N -1.65 1.43 -0.37 0.00 5.04 -0.71 -1.48 117.35 119.61 2jal s TYR 76 Ca -0.11 -0.94 -0.21 0.00 -2.44 0.00 0.00 57.07 53.37 2jal s TYR 76 Cb -0.08 -1.19 0.01 0.00 0.35 0.00 0.00 41.96 41.05 2jal s TYR 76 CO -0.01 -0.58 0.65 0.50 -1.34 0.00 0.00 175.55 174.76 2jal s ARG 77 N 1.72 3.62 0.17 4.97 3.52 0.10 -0.67 118.95 132.39 2jal s ARG 77 Ca 0.00 0.00 0.03 0.00 -0.13 0.00 0.00 55.73 55.64 2jal s ARG 77 Cb -0.16 -3.83 -0.05 0.00 -1.56 0.00 0.00 34.95 29.36 2jal s ARG 77 CO -0.07 -0.79 -0.04 -0.59 -0.81 0.00 0.00 175.30 172.99 2jal s PHE 78 N 2.76 1.30 0.26 5.12 -0.71 -0.70 -1.01 117.98 124.99 2jal s PHE 78 Ca 0.25 -0.89 0.09 0.00 -1.04 0.00 0.00 56.93 55.33 2jal s PHE 78 Cb -0.14 -0.72 -0.04 0.00 -1.21 0.00 0.00 43.02 40.91 2jal s PHE 78 CO 0.16 -0.05 0.07 -1.54 -1.34 0.00 0.00 175.22 172.51 2jal s SER 79 N -3.20 4.89 -0.17 1.98 1.04 -1.26 -0.71 113.70 116.28 2jal s SER 79 Ca 0.21 -0.50 -0.06 0.00 0.48 0.00 0.00 55.95 56.08 2jal s SER 79 Cb 0.05 -1.04 -0.03 0.00 0.10 0.00 0.00 66.02 65.09 2jal s SER 79 CO 0.03 -0.01 0.02 -0.63 0.98 0.00 0.00 173.24 173.63 2jal s ILE 80 N -2.24 4.40 -0.61 -1.02 1.01 -0.71 -4.09 121.20 117.94 2jal s ILE 80 Ca 0.32 -0.17 -0.28 0.00 0.00 0.00 0.00 60.65 60.52 2jal s ILE 80 Cb -0.07 -2.96 0.03 0.00 0.01 0.00 0.00 42.46 39.47 2jal s ILE 80 CO 0.22 0.48 1.24 -0.55 0.00 0.00 0.00 174.94 176.32 2jal s SER 81 N 0.36 6.34 0.21 3.58 0.15 -1.26 -4.68 113.70 118.40 2jal s SER 81 Ca -0.00 0.00 -0.19 0.00 0.70 0.00 0.00 55.95 56.46 2jal s SER 81 Cb -0.13 -2.55 0.18 0.00 -1.71 0.00 0.00 66.02 61.81 2jal s SER 81 CO 0.01 -1.59 1.57 -0.25 1.20 0.00 0.00 173.24 174.18 2jal h TRP 82 N 9.85 -1.01 0.00 3.44 2.91 -1.84 -1.34 115.95 127.95 2jal h TRP 82 Ca -0.26 0.09 0.00 0.00 1.13 0.00 0.00 58.89 59.85 2jal h TRP 82 Cb 1.06 0.56 0.00 0.00 -0.51 0.00 0.00 29.16 30.27 2jal h TRP 82 CO 1.06 -0.39 0.00 -0.35 -1.03 0.00 0.00 178.44 177.72 2jal n PRO 83 N -5.45 0.02 -0.05 2.65 -0.04 -1.26 -0.45 135.00 130.41 2jal n PRO 83 Ca 0.07 0.20 -0.06 0.00 -0.04 0.00 0.00 63.50 63.67 2jal n PRO 83 Cb 0.38 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.46 2jal n PRO 83 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jal h ARG 84 N 0.00 0.67 0.08 0.54 3.08 -1.50 -0.11 114.38 117.14 2jal h ARG 84 Ca 0.00 -0.27 -0.22 0.00 0.07 0.00 0.00 59.98 59.57 2jal h ARG 84 Cb 0.29 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 2jal h ARG 84 CO 0.00 0.85 -1.11 0.82 -1.07 0.00 0.00 179.97 179.45 2jal h ILE 85 N 0.59 1.17 -3.16 2.04 1.08 -0.93 -3.37 117.51 114.93 2jal h ILE 85 Ca 0.08 -2.36 -0.61 0.00 -0.39 0.00 0.00 64.86 61.58 2jal h ILE 85 Cb 0.71 2.76 -0.40 0.00 -3.07 0.00 0.00 36.82 36.82 2jal h ILE 85 CO 0.05 0.61 -0.73 -0.76 -0.69 0.00 0.00 178.15 176.64 2jal s LEU 86 N -7.74 3.03 0.45 1.44 1.43 0.40 -0.59 118.68 117.10 2jal s LEU 86 Ca -0.21 -2.37 0.14 0.00 -1.03 0.00 0.00 54.13 50.66 2jal s LEU 86 Cb 0.03 -1.14 1.07 0.00 0.03 0.00 0.00 46.19 46.18 2jal s LEU 86 CO 0.73 -0.31 2.02 -0.65 0.23 0.00 0.00 176.35 178.36 2jal h PRO 87 N 7.14 0.33 -0.52 1.29 0.11 -1.71 0.11 132.00 138.75 2jal h PRO 87 Ca -0.05 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.04 2jal h PRO 87 Cb 0.96 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2jal h PRO 87 CO 0.51 0.22 0.00 0.39 -0.21 0.00 0.00 178.00 178.91 2jal n GLU 88 N -4.47 2.24 0.00 1.05 1.02 -1.26 -4.19 120.64 115.04 2jal n GLU 88 Ca 0.07 -1.86 0.00 0.00 -0.02 0.00 0.00 57.16 55.35 2jal n GLU 88 Cb 0.30 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.30 2jal n GLU 88 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jal n GLY 89 N 1.29 1.33 3.31 0.62 0.00 0.39 -4.58 105.19 107.54 2jal n GLY 89 Ca 0.17 -0.08 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 2jal n GLY 89 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jal s THR 90 N -0.07 0.56 0.00 2.61 -4.23 -1.26 -4.80 115.64 108.44 2jal s THR 90 Ca 0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 2jal s THR 90 Cb 0.00 -2.60 0.00 0.00 1.34 0.00 0.00 72.50 71.24 2jal s THR 90 CO 0.00 -0.03 0.00 0.61 -0.54 0.00 0.00 174.62 174.66 2jal n GLY 91 N -0.45 1.45 3.70 3.99 0.00 -1.26 -4.86 105.19 107.77 2jal n GLY 91 Ca -0.00 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 2jal n GLY 91 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jal s ARG 92 N 0.00 4.23 0.02 1.61 3.52 -1.26 -5.00 118.95 122.06 2jal s ARG 92 Ca 0.00 2.28 -0.21 0.00 -0.13 0.00 0.00 55.73 57.67 2jal s ARG 92 Cb 0.00 -3.41 -0.06 0.00 -1.56 0.00 0.00 34.95 29.93 2jal s ARG 92 CO 0.00 -0.64 0.60 0.08 -0.81 0.00 0.00 175.30 174.53 2jal s VAL 93 N 1.94 4.86 -0.51 7.11 1.01 -1.26 -4.18 120.40 129.37 2jal s VAL 93 Ca 0.71 1.27 -0.18 0.00 0.00 0.00 0.00 61.98 63.77 2jal s VAL 93 Cb -0.40 -3.94 0.07 0.00 0.00 0.00 0.00 36.38 32.12 2jal s VAL 93 CO 0.31 0.44 0.55 0.21 0.00 0.00 0.00 175.10 176.61 2jal s ASN 94 N -0.37 6.19 0.26 3.32 2.47 0.25 -4.96 114.94 122.09 2jal s ASN 94 Ca 0.31 -1.19 -0.03 0.00 0.42 0.00 0.00 52.86 52.37 2jal s ASN 94 Cb -0.19 -2.25 0.44 0.00 -1.45 0.00 0.00 41.25 37.80 2jal s ASN 94 CO 0.18 -0.84 1.82 -0.61 -3.72 0.00 0.00 177.10 173.93 2jal h GLN 95 N 8.93 0.84 -0.38 0.43 5.75 -1.89 -0.43 115.11 128.36 2jal h GLN 95 Ca -0.28 -0.05 0.06 0.00 -0.15 0.00 0.00 58.65 58.22 2jal h GLN 95 Cb 1.10 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 29.44 2jal h GLN 95 CO 0.96 0.56 0.26 0.87 -2.65 0.00 0.00 178.83 178.83 2jal h LYS 96 N 0.87 0.28 -0.12 1.69 6.56 -1.91 0.88 116.57 124.81 2jal h LYS 96 Ca 0.43 -0.02 -0.07 0.00 -1.06 0.00 0.00 60.65 59.93 2jal h LYS 96 Cb 0.38 -0.06 -0.00 0.00 -0.57 0.00 0.00 32.23 31.98 2jal h LYS 96 CO -0.25 0.18 -0.21 0.78 -2.06 0.00 0.00 179.45 177.90 2jal h GLY 97 N 0.28 0.39 0.35 3.86 0.00 -1.26 -2.20 103.07 104.50 2jal h GLY 97 Ca 0.17 -0.45 0.09 0.00 0.00 0.00 0.00 47.33 47.14 2jal h GLY 97 CO -0.03 0.40 0.14 1.41 0.00 0.00 0.00 176.54 178.46 2jal h LEU 98 N -0.06 0.07 -0.19 3.11 3.38 -0.73 -2.83 115.31 118.06 2jal h LEU 98 Ca 0.01 0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.09 2jal h LEU 98 Cb 0.78 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 2jal h LEU 98 CO 0.05 0.06 0.02 0.44 0.09 0.00 0.00 178.44 179.10 2jal h ASP 99 N 0.29 -0.03 -1.00 -0.43 3.32 -0.77 -1.51 116.42 116.29 2jal h ASP 99 Ca 0.27 0.04 0.09 0.00 0.02 0.00 0.00 57.03 57.45 2jal h ASP 99 Cb 0.36 0.06 -0.08 0.00 0.22 0.00 0.00 39.33 39.89 2jal h ASP 99 CO -0.32 0.01 0.63 0.15 -1.72 0.00 0.00 179.24 177.99 2jal h PHE 100 N 0.09 1.16 0.11 4.55 3.57 -1.14 -1.55 116.94 123.73 2jal h PHE 100 Ca 0.09 0.03 -0.28 0.00 3.53 0.00 0.00 57.97 61.34 2jal h PHE 100 Cb 0.10 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.46 2jal h PHE 100 CO -0.16 0.54 -1.32 1.88 -2.23 0.00 0.00 178.31 177.02 2jal h TYR 101 N 1.08 0.41 -0.30 0.41 0.05 -1.46 -3.15 116.97 114.01 2jal h TYR 101 Ca 0.46 -0.30 0.02 0.00 0.05 0.00 0.00 58.73 58.96 2jal h TYR 101 Cb 0.31 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.02 2jal h TYR 101 CO -0.01 1.27 0.15 -0.91 -1.05 0.00 0.00 178.16 177.62 2jal h ASN 102 N 0.06 0.24 -0.62 3.88 2.35 -0.77 0.26 115.58 120.98 2jal h ASN 102 Ca -0.16 0.01 0.11 0.00 -0.55 0.00 0.00 56.30 55.71 2jal h ASN 102 Cb 1.96 -0.04 -0.08 0.00 0.05 0.00 0.00 38.32 40.22 2jal h ASN 102 CO 0.18 0.18 0.20 0.03 -1.65 0.00 0.00 177.43 176.36 2jal h ARG 103 N 0.32 0.35 -0.47 0.81 3.08 -1.42 0.18 114.38 117.23 2jal h ARG 103 Ca 0.12 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.07 2jal h ARG 103 Cb 0.03 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 2jal h ARG 103 CO -0.08 0.23 0.00 0.82 -1.07 0.00 0.00 179.97 179.87 2jal h ILE 104 N 0.36 1.26 -0.30 2.04 2.04 -1.37 -1.85 117.51 119.68 2jal h ILE 104 Ca 0.32 -1.06 0.02 0.00 1.00 0.00 0.00 64.86 65.15 2jal h ILE 104 Cb 0.44 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 2jal h ILE 104 CO -0.35 0.37 0.14 0.40 0.00 0.00 0.00 178.15 178.70 2jal h ILE 105 N 0.69 0.97 0.16 -0.67 2.04 0.04 -1.95 117.51 118.78 2jal h ILE 105 Ca 0.13 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 2jal h ILE 105 Cb 0.50 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 37.24 2jal h ILE 105 CO 0.02 0.05 -0.08 0.44 0.00 0.00 0.00 178.15 178.59 2jal h ASP 106 N 0.29 -0.18 -0.63 1.72 3.32 -0.54 -1.93 116.42 118.47 2jal h ASP 106 Ca 0.13 -0.17 0.12 0.00 0.02 0.00 0.00 57.03 57.14 2jal h ASP 106 Cb 0.06 0.05 -0.09 0.00 0.22 0.00 0.00 39.33 39.56 2jal h ASP 106 CO -0.10 0.07 0.11 0.74 -1.72 0.00 0.00 179.24 178.34 2jal h THR 107 N -0.42 0.59 -0.72 0.35 2.02 -1.30 0.60 112.91 114.03 2jal h THR 107 Ca -0.02 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.08 2jal h THR 107 Cb 0.33 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 67.04 2jal h THR 107 CO 0.04 0.04 0.45 -0.07 0.37 0.00 0.00 175.52 176.35 2jal h LEU 108 N 0.23 0.84 -0.13 2.58 3.38 -1.19 -2.54 115.31 118.49 2jal h LEU 108 Ca 0.33 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.24 2jal h LEU 108 Cb 0.52 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2jal h LEU 108 CO -0.44 0.64 0.00 -0.07 0.09 0.00 0.00 178.44 178.65 2jal h LEU 109 N 0.97 0.22 -2.07 1.67 4.07 -0.50 0.25 115.31 119.92 2jal h LEU 109 Ca 0.26 -0.30 0.00 0.00 0.08 0.00 0.00 57.88 57.92 2jal h LEU 109 Cb -0.07 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.61 2jal h LEU 109 CO -0.05 0.47 0.16 -0.08 -1.08 0.00 0.00 178.44 177.85 2jal h GLU 110 N -0.03 0.00 -0.15 1.13 4.57 -0.86 -1.83 114.58 117.40 2jal h GLU 110 Ca 0.04 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2jal h GLU 110 Cb 0.36 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.95 2jal h GLU 110 CO 0.01 0.00 0.00 1.63 -1.18 0.00 0.00 179.01 179.47 2jal n LYS 111 N -2.72 1.50 -1.57 1.92 5.02 -0.96 -5.00 118.16 116.35 2jal n LYS 111 Ca -0.02 -1.51 -0.10 0.00 -2.02 0.00 0.00 58.31 54.66 2jal n LYS 111 Cb 0.20 -1.22 -0.03 0.00 -0.02 0.00 0.00 35.03 33.96 2jal n LYS 111 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jal n GLY 112 N 0.54 0.81 3.68 0.72 0.00 -0.69 -5.02 105.19 105.22 2jal n GLY 112 Ca 0.08 -0.53 -0.37 0.00 0.00 0.00 0.00 46.02 45.21 2jal n GLY 112 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jal s ILE 113 N -2.42 5.31 -0.23 -0.61 1.01 0.04 -4.90 121.20 119.40 2jal s ILE 113 Ca 0.00 0.36 -0.29 0.00 0.00 0.00 0.00 60.65 60.72 2jal s ILE 113 Cb 0.00 -3.57 0.01 0.00 0.01 0.00 0.00 42.46 38.90 2jal s ILE 113 CO 0.00 0.33 1.08 -0.89 0.00 0.00 0.00 174.94 175.46 2jal s THR 114 N 1.02 4.59 -0.01 2.92 2.01 -0.24 -3.91 115.64 122.01 2jal s THR 114 Ca 0.12 1.92 -0.30 0.00 0.31 0.00 0.00 61.69 63.73 2jal s THR 114 Cb -0.14 -4.28 -0.04 0.00 0.01 0.00 0.00 72.50 68.06 2jal s THR 114 CO 0.05 -0.21 1.16 -2.16 -0.69 0.00 0.00 174.62 172.76 2jal s PRO 115 N 3.31 4.41 -0.36 4.92 0.04 -1.26 -1.74 135.00 144.33 2jal s PRO 115 Ca 0.46 1.66 -0.04 0.00 0.04 0.00 0.00 61.00 63.11 2jal s PRO 115 Cb -0.16 -3.47 0.07 0.00 0.04 0.00 0.00 34.50 30.98 2jal s PRO 115 CO 0.09 -0.32 0.12 -0.06 0.04 0.00 0.00 177.00 176.87 2jal s PHE 116 N 1.65 3.37 -0.22 0.56 0.40 0.16 -4.13 117.98 119.76 2jal s PHE 116 Ca 0.56 -1.86 -0.16 0.00 -0.60 0.00 0.00 56.93 54.87 2jal s PHE 116 Cb -0.25 -2.60 -0.04 0.00 0.51 0.00 0.00 43.02 40.64 2jal s PHE 116 CO 0.25 -0.84 0.40 0.08 0.70 0.00 0.00 175.22 175.81 2jal s VAL 117 N 1.28 5.19 -0.36 -0.44 1.01 -0.90 -1.72 120.40 124.46 2jal s VAL 117 Ca 0.01 0.67 -0.21 0.00 0.00 0.00 0.00 61.98 62.45 2jal s VAL 117 Cb -0.21 -3.72 0.01 0.00 0.00 0.00 0.00 36.38 32.45 2jal s VAL 117 CO -0.01 0.22 0.66 -0.89 0.00 0.00 0.00 175.10 175.09 2jal s THR 118 N 1.58 4.85 0.11 3.92 2.01 0.11 -1.22 115.64 127.01 2jal s THR 118 Ca 0.18 0.62 -0.18 0.00 0.31 0.00 0.00 61.69 62.61 2jal s THR 118 Cb -0.15 -4.11 -0.05 0.00 0.01 0.00 0.00 72.50 68.20 2jal s THR 118 CO 0.08 -0.35 1.67 0.40 -0.69 0.00 0.00 174.62 175.73 2jal h ILE 119 N 5.70 1.17 -3.53 1.82 2.04 -1.22 -1.89 117.51 121.61 2jal h ILE 119 Ca -0.26 -0.51 -0.59 0.00 1.00 0.00 0.00 64.86 64.50 2jal h ILE 119 Cb 1.11 0.96 -0.38 0.00 -0.74 0.00 0.00 36.82 37.76 2jal h ILE 119 CO 0.85 0.18 -0.78 -0.47 0.00 0.00 0.00 178.15 177.93 2jal s TYR 120 N -5.60 2.03 -0.41 1.37 5.04 -0.86 -4.39 117.35 114.54 2jal s TYR 120 Ca -0.13 -1.50 0.09 0.00 -2.44 0.00 0.00 57.07 53.09 2jal s TYR 120 Cb 0.09 -1.44 0.43 0.00 0.35 0.00 0.00 41.96 41.39 2jal s TYR 120 CO 0.73 -0.73 1.05 1.58 -1.34 0.00 0.00 175.55 176.85 2jal n HIS 121 N 4.77 2.72 -0.01 4.97 -0.00 -1.26 -1.44 115.22 124.98 2jal n HIS 121 Ca -0.11 -3.05 0.00 0.00 0.46 0.00 0.00 57.72 55.02 2jal n HIS 121 Cb 0.45 -0.18 0.00 0.00 -0.12 0.00 0.00 29.99 30.14 2jal n HIS 121 CO 0.00 0.00 0.00 0.91 0.46 0.00 0.00 176.34 177.71 2jal n TRP 122 N -0.34 0.00 -2.36 1.57 8.01 -1.26 -4.85 117.44 118.21 2jal n TRP 122 Ca 0.30 0.00 -0.42 0.00 -1.31 0.00 0.00 57.50 56.07 2jal n TRP 122 Cb 0.70 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.01 2jal n TRP 122 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.69 176.28 2jal n ASP 123 N 0.00 6.37 -4.77 -0.99 5.75 -1.26 -4.66 116.55 116.99 2jal n ASP 123 Ca 0.00 -3.21 -0.41 0.00 -0.01 0.00 0.00 54.79 51.16 2jal n ASP 123 Cb 0.00 -1.39 -0.00 0.00 -1.03 0.00 0.00 41.12 38.70 2jal n ASP 123 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2jal s LEU 124 N -1.49 4.31 0.23 -2.12 2.96 -1.26 -4.33 118.68 116.97 2jal s LEU 124 Ca 0.43 2.90 -0.32 0.00 -0.22 0.00 0.00 54.13 56.92 2jal s LEU 124 Cb 0.12 -3.72 -0.13 0.00 0.50 0.00 0.00 46.19 42.96 2jal s LEU 124 CO -0.02 -0.82 1.55 -2.65 -1.32 0.00 0.00 176.35 173.09 2jal n PRO 125 N 0.43 2.35 -0.12 0.98 -0.02 -1.26 -0.67 135.00 136.68 2jal n PRO 125 Ca 0.01 0.84 0.08 0.00 -2.02 0.00 0.00 63.50 62.41 2jal n PRO 125 Cb 0.41 -2.59 0.41 0.00 -0.02 0.00 0.00 33.50 31.71 2jal n PRO 125 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2jal h PHE 126 N 5.19 0.63 -0.66 6.00 3.57 -1.17 -1.89 116.94 128.61 2jal h PHE 126 Ca -0.45 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.17 2jal h PHE 126 Cb 1.25 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.74 2jal h PHE 126 CO 0.60 0.33 0.44 0.00 -2.23 0.00 0.00 178.31 177.44 2jal h ALA 127 N 1.66 1.97 0.14 2.41 0.00 -1.85 -1.69 119.26 121.90 2jal h ALA 127 Ca 0.28 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.89 2jal h ALA 127 Cb 0.30 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.01 2jal h ALA 127 CO -0.09 -0.11 -1.26 -0.07 0.00 0.00 0.00 179.25 177.71 2jal h LEU 128 N 0.48 0.61 -1.04 0.00 3.38 -1.60 -3.23 115.31 113.92 2jal h LEU 128 Ca 0.31 -0.62 0.11 0.00 0.09 0.00 0.00 57.88 57.77 2jal h LEU 128 Cb 0.55 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 41.02 2jal h LEU 128 CO -0.09 1.47 0.63 -0.61 0.09 0.00 0.00 178.44 179.92 2jal h GLN 129 N 0.14 0.98 0.00 1.13 5.75 -1.11 0.46 115.11 122.46 2jal h GLN 129 Ca -0.17 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.27 2jal h GLN 129 Cb 1.96 -0.22 -0.00 0.00 1.07 0.00 0.00 27.48 30.29 2jal h GLN 129 CO 0.22 0.65 -0.04 -0.07 -2.65 0.00 0.00 178.83 176.94 2jal h LEU 130 N 1.01 0.00 -3.25 -2.39 3.38 -1.35 0.13 115.31 112.84 2jal h LEU 130 Ca 0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.45 2jal h LEU 130 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2jal h LEU 130 CO -0.24 0.04 0.00 0.29 0.09 0.00 0.00 178.44 178.62 2jal n LYS 131 N -3.57 4.38 0.00 1.13 5.02 0.01 -4.92 118.16 120.21 2jal n LYS 131 Ca -0.02 -2.83 0.00 0.00 -2.02 0.00 0.00 58.31 53.44 2jal n LYS 131 Cb 0.14 -2.14 0.00 0.00 -0.02 0.00 0.00 35.03 33.01 2jal n LYS 131 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jal n GLY 132 N 0.66 0.21 7.00 0.72 0.00 0.47 -4.66 105.19 109.58 2jal n GLY 132 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 2jal n GLY 132 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jal n GLY 133 N -1.82 3.00 0.12 -0.02 0.00 -0.37 -0.93 105.19 105.16 2jal n GLY 133 Ca 0.00 -0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.11 2jal n GLY 133 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2jal n TRP 134 N 14.00 0.61 0.24 1.61 7.02 -1.26 -1.26 117.44 138.40 2jal n TRP 134 Ca 0.00 0.28 0.12 0.00 -1.02 0.00 0.00 57.50 56.88 2jal n TRP 134 Cb 0.00 -0.95 0.51 0.00 -2.42 0.00 0.00 31.31 28.45 2jal n TRP 134 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2jal h ALA 135 N 2.16 1.01 -2.85 6.99 0.00 -1.34 -3.33 119.26 121.89 2jal h ALA 135 Ca 0.00 -0.14 -0.60 0.00 0.00 0.00 0.00 54.91 54.17 2jal h ALA 135 Cb 0.17 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 17.83 2jal h ALA 135 CO 0.00 0.20 -0.19 1.21 0.00 0.00 0.00 179.25 180.47 2jal s ASN 136 N -6.06 6.45 0.49 0.00 3.84 -0.39 -4.85 114.94 114.42 2jal s ASN 136 Ca 0.01 0.54 0.28 0.00 0.21 0.00 0.00 52.86 53.90 2jal s ASN 136 Cb 0.10 -2.24 1.37 0.00 -0.55 0.00 0.00 41.25 39.93 2jal s ASN 136 CO 0.61 -0.08 1.83 0.03 -2.79 0.00 0.00 177.10 176.71 2jal h ARG 137 N 7.34 0.14 0.00 0.43 3.08 -1.87 -1.43 114.38 122.07 2jal h ARG 137 Ca -0.36 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.68 2jal h ARG 137 Cb 1.16 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.18 2jal h ARG 137 CO 0.72 0.09 0.00 0.39 -1.07 0.00 0.00 179.97 180.10 2jal n GLU 138 N -4.36 0.06 0.31 0.04 1.02 -1.26 -2.20 120.64 114.26 2jal n GLU 138 Ca 0.22 0.38 0.18 0.00 -0.02 0.00 0.00 57.16 57.92 2jal n GLU 138 Cb 0.99 -1.64 1.00 0.00 -0.02 0.00 0.00 31.44 31.77 2jal n GLU 138 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 2jal h ILE 139 N 0.00 0.33 -0.85 -3.67 2.10 -1.52 -0.78 117.51 113.12 2jal h ILE 139 Ca 0.00 -0.07 -0.03 0.00 1.08 0.00 0.00 64.86 65.84 2jal h ILE 139 Cb 0.20 1.05 -0.04 0.00 -1.09 0.00 0.00 36.82 36.94 2jal h ILE 139 CO 0.00 0.01 0.41 0.00 -1.08 0.00 0.00 178.15 177.50 2jal h ALA 140 N 1.99 1.12 -0.15 0.18 0.00 -1.67 0.15 119.26 120.88 2jal h ALA 140 Ca -0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2jal h ALA 140 Cb 0.05 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2jal h ALA 140 CO 0.00 0.67 0.02 -0.44 0.00 0.00 0.00 179.25 179.50 2jal h ASP 141 N 1.22 0.24 -0.67 0.00 3.32 -1.39 -2.39 116.42 116.73 2jal h ASP 141 Ca 0.29 -0.27 0.01 0.00 0.02 0.00 0.00 57.03 57.09 2jal h ASP 141 Cb 0.11 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 2jal h ASP 141 CO -0.04 0.44 0.45 -0.50 -1.72 0.00 0.00 179.24 177.87 2jal h TRP 142 N 0.02 0.84 -0.42 4.55 6.55 -1.07 -1.32 115.95 125.10 2jal h TRP 142 Ca 0.04 0.02 -0.14 0.00 0.95 0.00 0.00 58.89 59.77 2jal h TRP 142 Cb 0.31 -0.28 -0.01 0.00 -0.86 0.00 0.00 29.16 28.31 2jal h TRP 142 CO 0.02 0.53 -0.27 0.35 -1.05 0.00 0.00 178.44 178.02 2jal h PHE 143 N 0.91 1.05 -0.91 0.49 3.57 -0.72 -1.76 116.94 119.56 2jal h PHE 143 Ca 0.25 -0.27 0.01 0.00 3.53 0.00 0.00 57.97 61.49 2jal h PHE 143 Cb -0.10 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.36 2jal h PHE 143 CO -0.03 1.06 0.60 0.00 -2.23 0.00 0.00 178.31 177.72 2jal h ALA 144 N 0.92 1.16 -0.12 2.41 0.00 -1.17 0.96 119.26 123.41 2jal h ALA 144 Ca 0.09 -0.06 -0.23 0.00 0.00 0.00 0.00 54.91 54.71 2jal h ALA 144 Cb 0.83 -0.36 0.01 0.00 0.00 0.00 0.00 17.79 18.27 2jal h ALA 144 CO 0.07 0.54 -0.82 1.49 0.00 0.00 0.00 179.25 180.53 2jal h GLU 145 N 1.23 0.76 0.40 0.00 4.81 -0.99 -0.56 114.58 120.23 2jal h GLU 145 Ca 0.34 -0.65 -0.02 0.00 -0.13 0.00 0.00 59.36 58.89 2jal h GLU 145 Cb -0.13 0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.40 2jal h GLU 145 CO -0.08 1.26 -0.19 -0.92 -0.73 0.00 0.00 179.01 178.34 2jal h TYR 146 N 0.51 -0.50 -0.52 0.92 3.20 -1.25 -2.67 116.97 116.65 2jal h TYR 146 Ca -0.07 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 61.90 2jal h TYR 146 Cb 1.46 0.17 -0.10 0.00 1.54 0.00 0.00 36.73 39.79 2jal h TYR 146 CO 0.09 -0.25 -0.16 0.77 -1.64 0.00 0.00 178.16 176.97 2jal h SER 147 N -0.66 -0.58 -0.72 -2.11 0.02 -0.71 -1.15 113.55 107.64 2jal h SER 147 Ca -0.06 0.17 0.15 0.00 -0.84 0.00 0.00 61.79 61.21 2jal h SER 147 Cb 0.48 0.36 -0.10 0.00 0.14 0.00 0.00 62.40 63.27 2jal h SER 147 CO 0.09 -0.20 0.19 -0.09 -1.14 0.00 0.00 176.83 175.68 2jal h ARG 148 N -0.04 0.28 -0.44 3.45 2.43 -1.09 0.84 114.38 119.82 2jal h ARG 148 Ca 0.25 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.40 2jal h ARG 148 Cb 0.42 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 2jal h ARG 148 CO -0.55 0.19 0.26 0.28 -1.51 0.00 0.00 179.97 178.63 2jal h VAL 149 N 0.29 1.14 -0.62 0.20 2.07 -0.87 0.13 116.25 118.60 2jal h VAL 149 Ca 0.40 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 2jal h VAL 149 Cb 0.66 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 2jal h VAL 149 CO -0.48 0.14 0.34 -0.07 0.02 0.00 0.00 177.57 177.52 2jal h LEU 150 N 0.57 0.77 -0.17 2.57 3.38 -0.86 -0.72 115.31 120.85 2jal h LEU 150 Ca 0.16 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 2jal h LEU 150 Cb 0.01 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2jal h LEU 150 CO -0.03 0.64 -0.00 -0.26 0.09 0.00 0.00 178.44 178.88 2jal h PHE 151 N 0.84 0.34 0.00 1.13 0.04 -0.45 0.96 116.94 119.79 2jal h PHE 151 Ca 0.22 -0.06 -0.06 0.00 2.80 0.00 0.00 57.97 60.87 2jal h PHE 151 Cb 0.04 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.10 2jal h PHE 151 CO -0.01 0.52 -0.27 0.93 -0.60 0.00 0.00 178.31 178.88 2jal h GLU 152 N 0.05 0.00 0.00 1.51 5.08 -0.66 0.02 114.58 120.58 2jal h GLU 152 Ca 0.05 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.18 2jal h GLU 152 Cb 0.39 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 2jal h GLU 152 CO 0.01 0.27 -1.97 0.09 -1.00 0.00 0.00 179.01 176.41 2jal n ASN 153 N -3.78 0.32 0.00 1.42 3.02 -0.29 -4.65 115.26 111.30 2jal n ASN 153 Ca -0.01 0.14 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 2jal n ASN 153 Cb 0.37 0.88 0.00 0.00 -0.61 0.00 0.00 39.78 40.42 2jal n ASN 153 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2jal n PHE 154 N -2.71 0.00 1.00 3.10 3.72 0.32 -4.80 117.46 118.09 2jal n PHE 154 Ca -0.19 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.35 2jal n PHE 154 Cb 0.94 0.00 0.58 0.00 -0.94 0.00 0.00 39.48 40.06 2jal n PHE 154 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jal n GLY 155 N 1.32 -1.47 0.24 1.37 0.00 -0.01 -0.78 105.19 105.86 2jal n GLY 155 Ca 0.00 -0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.00 2jal n GLY 155 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2jal h ASP 156 N 0.00 0.00 0.00 1.61 2.03 -1.87 -3.37 116.42 114.82 2jal h ASP 156 Ca 0.00 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.28 2jal h ASP 156 Cb 0.50 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.99 2jal h ASP 156 CO 0.00 0.18 -1.08 0.54 -1.03 0.00 0.00 179.24 177.84 2jal n ARG 157 N -3.57 1.28 -3.23 4.15 1.74 -0.92 -5.00 116.66 111.10 2jal n ARG 157 Ca -0.01 0.01 -0.39 0.00 -0.77 0.00 0.00 57.85 56.69 2jal n ARG 157 Cb 0.32 -1.03 -0.06 0.00 -1.02 0.00 0.00 32.46 30.67 2jal n ARG 157 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2jal s VAL 158 N -2.03 5.12 0.00 1.55 1.01 0.04 -4.93 120.40 121.16 2jal s VAL 158 Ca -0.02 1.03 0.00 0.00 0.00 0.00 0.00 61.98 62.99 2jal s VAL 158 Cb 0.00 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.52 2jal s VAL 158 CO 0.04 0.23 0.39 0.29 0.00 0.00 0.00 175.10 176.04 2jal n LYS 159 N 4.34 0.29 -4.47 2.72 4.76 -1.26 -4.42 118.16 120.11 2jal n LYS 159 Ca -0.05 -0.39 -0.31 0.00 -2.87 0.00 0.00 58.31 54.69 2jal n LYS 159 Cb 0.51 -0.88 -0.16 0.00 -1.84 0.00 0.00 35.03 32.65 2jal n LYS 159 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2jal s ASN 160 N -0.15 2.91 0.02 4.39 0.01 -1.26 -0.29 114.94 120.58 2jal s ASN 160 Ca 0.00 -0.56 0.01 0.00 -0.71 0.00 0.00 52.86 51.60 2jal s ASN 160 Cb 0.00 -1.34 -0.01 0.00 0.41 0.00 0.00 41.25 40.31 2jal s ASN 160 CO 0.00 0.04 -0.05 0.26 -1.51 0.00 0.00 177.10 175.84 2jal s TRP 161 N 0.99 0.44 -0.06 2.20 0.52 -0.55 -2.13 118.94 120.36 2jal s TRP 161 Ca -0.04 -0.32 0.02 0.00 0.02 0.00 0.00 56.10 55.78 2jal s TRP 161 Cb -0.15 -0.28 0.02 0.00 -1.15 0.00 0.00 33.47 31.91 2jal s TRP 161 CO -0.04 -0.07 -0.10 0.42 0.02 0.00 0.00 176.95 177.18 2jal s ILE 162 N -0.86 0.96 -0.05 2.03 1.01 -0.36 -0.94 121.20 122.99 2jal s ILE 162 Ca -0.06 -0.36 -0.10 0.00 0.00 0.00 0.00 60.65 60.12 2jal s ILE 162 Cb -0.06 -0.90 -0.05 0.00 0.01 0.00 0.00 42.46 41.45 2jal s ILE 162 CO -0.00 0.32 0.42 0.71 0.00 0.00 0.00 174.94 176.39 2jal h THR 163 N 6.03 0.00 -3.45 2.92 1.35 -1.48 -0.70 112.91 117.58 2jal h THR 163 Ca -0.33 -0.71 -0.59 0.00 -0.55 0.00 0.00 66.41 64.24 2jal h THR 163 Cb 1.17 0.00 -0.33 0.00 -1.73 0.00 0.00 68.15 67.26 2jal h THR 163 CO 0.47 0.00 -0.85 -0.76 -0.25 0.00 0.00 175.52 174.13 2jal s LEU 164 N -8.77 1.87 -0.38 3.87 1.43 -1.26 -2.02 118.68 113.41 2jal s LEU 164 Ca -0.05 -0.42 -0.25 0.00 -1.03 0.00 0.00 54.13 52.38 2jal s LEU 164 Cb 0.01 -1.09 0.02 0.00 0.03 0.00 0.00 46.19 45.15 2jal s LEU 164 CO 0.16 0.10 0.90 0.21 0.23 0.00 0.00 176.35 177.95 2jal s ASN 165 N 0.44 6.63 -0.99 2.29 2.47 -0.52 -1.92 114.94 123.34 2jal s ASN 165 Ca -0.15 0.46 -0.09 0.00 0.42 0.00 0.00 52.86 53.50 2jal s ASN 165 Cb -0.16 -2.45 -0.02 0.00 -1.45 0.00 0.00 41.25 37.16 2jal s ASN 165 CO 0.06 -0.87 0.79 -0.62 -3.72 0.00 0.00 177.10 172.74 2jal n GLU 166 N 6.79 -1.58 0.30 0.43 1.02 0.65 -4.76 120.64 123.49 2jal n GLU 166 Ca 0.06 0.86 0.16 0.00 -0.02 0.00 0.00 57.16 58.22 2jal n GLU 166 Cb 0.48 -4.86 0.94 0.00 -0.02 0.00 0.00 31.44 27.98 2jal n GLU 166 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2jal h PRO 167 N -0.93 0.00 -0.62 3.49 0.13 -1.84 -0.85 132.00 131.38 2jal h PRO 167 Ca -0.49 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.68 2jal h PRO 167 Cb 1.26 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.35 2jal h PRO 167 CO 0.41 0.00 0.38 2.35 -0.23 0.00 0.00 178.00 180.91 2jal h TRP 168 N 0.00 0.70 -0.19 1.56 7.01 -1.92 -0.50 115.95 122.61 2jal h TRP 168 Ca -0.00 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.00 2jal h TRP 168 Cb 0.01 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 26.83 2jal h TRP 168 CO 0.00 0.39 0.05 0.28 -2.79 0.00 0.00 178.44 176.37 2jal h VAL 169 N 0.74 1.20 -0.33 2.65 2.07 -1.51 0.17 116.25 121.24 2jal h VAL 169 Ca 0.25 -0.65 0.07 0.00 0.82 0.00 0.00 66.70 67.19 2jal h VAL 169 Cb 0.04 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.03 2jal h VAL 169 CO -0.11 0.20 -0.07 0.58 0.02 0.00 0.00 177.57 178.19 2jal h VAL 170 N 0.12 0.68 0.35 2.57 2.07 -1.26 0.12 116.25 120.89 2jal h VAL 170 Ca 0.06 -0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.56 2jal h VAL 170 Cb 0.27 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 2jal h VAL 170 CO 0.00 0.00 -0.17 0.00 0.02 0.00 0.00 177.57 177.42 2jal h ALA 171 N 1.33 -0.50 0.15 1.67 0.00 -1.02 -3.09 119.26 117.80 2jal h ALA 171 Ca 0.16 -0.10 -0.22 0.00 0.00 0.00 0.00 54.91 54.75 2jal h ALA 171 Cb 0.24 0.18 0.02 0.00 0.00 0.00 0.00 17.79 18.24 2jal h ALA 171 CO -0.34 -0.46 -0.95 0.82 0.00 0.00 0.00 179.25 178.33 2jal h ILE 172 N -1.06 1.45 -0.01 0.00 1.08 -0.66 -0.75 117.51 117.56 2jal h ILE 172 Ca -0.05 -2.53 -0.15 0.00 -0.39 0.00 0.00 64.86 61.74 2jal h ILE 172 Cb 0.36 3.11 -0.02 0.00 -3.07 0.00 0.00 36.82 37.21 2jal h ILE 172 CO 0.08 0.73 -0.67 0.58 -0.69 0.00 0.00 178.15 178.18 2jal h VAL 173 N -0.23 1.47 0.00 1.67 2.07 -1.09 0.16 116.25 120.31 2jal h VAL 173 Ca -0.16 -2.26 -0.18 0.00 0.82 0.00 0.00 66.70 64.91 2jal h VAL 173 Cb 1.73 2.21 -0.03 0.00 -1.52 0.00 0.00 31.29 33.69 2jal h VAL 173 CO 0.18 0.65 -1.13 1.23 0.02 0.00 0.00 177.57 178.52 2jal h GLY 174 N 1.90 0.00 0.00 2.17 0.00 -1.37 -1.97 103.07 103.81 2jal h GLY 174 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2jal h GLY 174 CO 0.09 0.00 -0.22 1.42 0.00 0.00 0.00 176.54 177.84 2jal n HIS 175 N -3.12 0.00 -0.11 5.60 8.25 -0.29 -2.03 115.22 123.52 2jal n HIS 175 Ca -0.06 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.18 2jal n HIS 175 Cb 0.87 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.90 2jal n HIS 175 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2jal n LEU 176 N -0.71 1.85 0.17 2.41 7.94 -0.36 -0.61 117.00 127.69 2jal n LEU 176 Ca 0.00 0.20 0.10 0.00 -1.11 0.00 0.00 56.01 55.20 2jal n LEU 176 Cb 0.00 -0.68 0.09 0.00 0.53 0.00 0.00 43.42 43.37 2jal n LEU 176 CO 0.00 0.54 0.51 1.88 -1.11 0.00 0.00 177.39 179.21 2jal h TYR 177 N -0.65 0.00 -0.13 1.96 0.05 -1.16 -3.38 116.97 113.66 2jal h TYR 177 Ca -0.55 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.17 2jal h TYR 177 Cb 1.54 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 39.26 2jal h TYR 177 CO -0.05 0.10 -0.05 0.41 -1.05 0.00 0.00 178.16 177.51 2jal n GLY 178 N 1.15 0.44 0.11 3.88 0.00 -0.69 -4.88 105.19 105.20 2jal n GLY 178 Ca 0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 46.02 45.94 2jal n GLY 178 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2jal h VAL 179 N 0.00 1.23 -2.11 1.61 2.07 -1.67 -3.40 116.25 113.99 2jal h VAL 179 Ca -0.06 -2.65 -0.58 0.00 0.82 0.00 0.00 66.70 64.24 2jal h VAL 179 Cb 0.68 2.55 -0.11 0.00 -1.52 0.00 0.00 31.29 32.89 2jal h VAL 179 CO 0.08 0.68 -0.66 -1.00 0.02 0.00 0.00 177.57 176.70 2jal s HIS 180 N -2.94 2.56 0.42 1.57 3.76 -0.99 -4.69 115.29 114.98 2jal s HIS 180 Ca 0.02 -0.32 -0.25 0.00 -0.15 0.00 0.00 55.06 54.36 2jal s HIS 180 Cb 0.09 -1.25 -0.10 0.00 1.11 0.00 0.00 32.58 32.43 2jal s HIS 180 CO 0.77 0.59 1.23 0.00 -0.85 0.00 0.00 174.74 176.48 2jal n ALA 181 N -0.86 1.11 1.79 -1.40 0.00 -1.26 -0.69 120.51 119.19 2jal n ALA 181 Ca -0.05 0.26 0.08 0.00 0.00 0.00 0.00 53.44 53.73 2jal n ALA 181 Cb 0.60 -2.24 0.39 0.00 0.00 0.00 0.00 19.45 18.21 2jal n ALA 181 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2jal n PRO 182 N 0.08 1.19 -2.25 0.00 -0.04 -1.24 -4.53 135.00 128.20 2jal n PRO 182 Ca 0.07 -0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.25 2jal n PRO 182 Cb 0.39 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 2jal n PRO 182 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2jal n GLY 183 N 0.82 0.77 3.95 0.55 0.00 0.13 -5.02 105.19 106.39 2jal n GLY 183 Ca 0.12 -0.73 -0.26 0.00 0.00 0.00 0.00 46.02 45.15 2jal n GLY 183 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jal s MET 184 N -4.51 3.44 -0.54 1.61 -1.94 -0.86 -4.74 119.30 111.76 2jal s MET 184 Ca 0.00 -0.59 0.04 0.00 -1.71 0.00 0.00 55.69 53.42 2jal s MET 184 Cb 0.00 -2.95 0.16 0.00 2.01 0.00 0.00 34.83 34.05 2jal s MET 184 CO 0.00 0.50 0.37 1.03 -0.01 0.00 0.00 175.02 176.91 2jal s ARG 185 N -3.31 1.65 -0.19 2.03 0.52 -1.22 -1.70 118.95 116.75 2jal s ARG 185 Ca 0.35 -2.57 -0.05 0.00 -0.52 0.00 0.00 55.73 52.94 2jal s ARG 185 Cb -0.11 -2.53 0.09 0.00 0.52 0.00 0.00 34.95 32.93 2jal s ARG 185 CO 0.29 -1.27 0.32 0.34 0.02 0.00 0.00 175.30 175.00 2jal s ASP 186 N -0.45 0.33 0.36 0.23 -1.08 0.22 -4.96 116.67 111.32 2jal s ASP 186 Ca 0.25 0.47 0.18 0.00 -0.52 0.00 0.00 52.55 52.93 2jal s ASP 186 Cb -0.09 0.92 0.58 0.00 -1.46 0.00 0.00 42.92 42.87 2jal s ASP 186 CO -0.12 -0.27 1.69 -0.29 0.52 0.00 0.00 175.17 176.70 2jal h ILE 187 N 6.24 0.88 -0.29 4.11 2.10 -1.91 -0.97 117.51 127.66 2jal h ILE 187 Ca -0.16 -1.64 -0.14 0.00 1.08 0.00 0.00 64.86 64.00 2jal h ILE 187 Cb 1.13 2.01 -0.00 0.00 -1.09 0.00 0.00 36.82 38.87 2jal h ILE 187 CO 0.19 0.39 -0.35 1.88 -1.08 0.00 0.00 178.15 179.18 2jal h TYR 188 N 0.00 0.92 -0.45 2.19 -1.99 -1.94 -2.26 116.97 113.43 2jal h TYR 188 Ca -0.00 -0.29 -0.09 0.00 2.00 0.00 0.00 58.73 60.34 2jal h TYR 188 Cb 0.98 -0.19 -0.01 0.00 2.00 0.00 0.00 36.73 39.51 2jal h TYR 188 CO 0.00 1.06 -0.08 0.28 -0.00 0.00 0.00 178.16 179.42 2jal h VAL 189 N 0.51 1.27 -0.91 -2.88 2.07 -1.76 -2.48 116.25 112.06 2jal h VAL 189 Ca 0.04 -1.19 0.03 0.00 0.82 0.00 0.00 66.70 66.40 2jal h VAL 189 Cb 0.93 1.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.76 2jal h VAL 189 CO 0.08 0.41 0.60 0.00 0.02 0.00 0.00 177.57 178.68 2jal h ALA 190 N 0.88 1.19 -0.00 1.67 0.00 -1.08 0.63 119.26 122.54 2jal h ALA 190 Ca 0.12 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.82 2jal h ALA 190 Cb 0.62 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2jal h ALA 190 CO 0.04 0.49 -0.78 0.74 0.00 0.00 0.00 179.25 179.74 2jal h PHE 191 N 1.18 0.05 -0.39 0.00 0.04 -1.29 -0.87 116.94 115.66 2jal h PHE 191 Ca 0.35 -0.03 -0.07 0.00 2.80 0.00 0.00 57.97 61.03 2jal h PHE 191 Cb -0.04 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.08 2jal h PHE 191 CO -0.01 0.80 -0.04 0.00 -0.60 0.00 0.00 178.31 178.46 2jal h ARG 192 N 0.02 0.64 -0.29 1.51 3.08 -1.02 -1.67 114.38 116.66 2jal h ARG 192 Ca -0.01 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 2jal h ARG 192 Cb 1.37 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.33 2jal h ARG 192 CO 0.10 0.69 0.13 0.00 -1.07 0.00 0.00 179.97 179.82 2jal h ALA 193 N 1.36 0.37 -0.55 0.04 0.00 -0.60 0.24 119.26 120.12 2jal h ALA 193 Ca 0.12 -0.11 0.11 0.00 0.00 0.00 0.00 54.91 55.03 2jal h ALA 193 Cb 0.44 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.03 2jal h ALA 193 CO 0.02 -0.05 0.05 0.28 0.00 0.00 0.00 179.25 179.55 2jal h VAL 194 N 0.32 0.61 -0.26 0.00 2.07 -0.87 0.71 116.25 118.84 2jal h VAL 194 Ca 0.10 -0.06 -0.13 0.00 0.82 0.00 0.00 66.70 67.43 2jal h VAL 194 Cb 0.15 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.34 2jal h VAL 194 CO -0.01 0.03 -0.34 -0.74 0.02 0.00 0.00 177.57 176.53 2jal h HIS 195 N 0.17 0.84 0.00 1.57 6.17 -1.01 -2.75 115.15 120.15 2jal h HIS 195 Ca 0.29 -0.27 -0.10 0.00 0.71 0.00 0.00 60.37 61.00 2jal h HIS 195 Cb 0.43 -0.17 -0.01 0.00 2.52 0.00 0.00 27.41 30.18 2jal h HIS 195 CO -0.29 1.03 -0.46 -0.91 0.71 0.00 0.00 177.93 178.01 2jal h ASN 196 N 0.41 0.00 -0.50 3.26 2.35 -0.33 -2.03 115.58 118.75 2jal h ASN 196 Ca 0.03 0.00 0.04 0.00 -0.55 0.00 0.00 56.30 55.82 2jal h ASN 196 Cb 0.93 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.26 2jal h ASN 196 CO 0.08 0.46 0.27 -0.07 -1.65 0.00 0.00 177.43 176.51 2jal h LEU 197 N 0.00 0.40 -0.46 1.61 3.38 -0.75 0.55 115.31 120.04 2jal h LEU 197 Ca -0.00 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 2jal h LEU 197 Cb 0.82 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 2jal h LEU 197 CO 0.06 0.28 -0.11 -0.07 0.09 0.00 0.00 178.44 178.69 2jal h LEU 198 N 0.52 0.89 -0.43 1.67 3.38 -1.17 -0.84 115.31 119.33 2jal h LEU 198 Ca 0.21 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 2jal h LEU 198 Cb 0.09 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2jal h LEU 198 CO -0.13 1.04 0.25 0.03 0.09 0.00 0.00 178.44 179.72 2jal h ARG 199 N 0.72 0.58 -0.19 1.13 3.08 -1.21 -1.82 114.38 116.67 2jal h ARG 199 Ca 0.12 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2jal h ARG 199 Cb 0.65 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 2jal h ARG 199 CO 0.04 0.44 0.09 0.00 -1.07 0.00 0.00 179.97 179.48 2jal h ALA 200 N 1.11 0.25 -0.30 0.04 0.00 -0.77 -1.89 119.26 117.70 2jal h ALA 200 Ca 0.15 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.04 2jal h ALA 200 Cb 0.01 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.66 2jal h ALA 200 CO -0.03 -0.19 -0.14 1.25 0.00 0.00 0.00 179.25 180.14 2jal h HIS 201 N 0.18 -0.35 -0.71 0.00 -0.00 -1.08 -1.07 115.15 112.12 2jal h HIS 201 Ca 0.07 0.03 -0.06 0.00 -0.00 0.00 0.00 60.37 60.41 2jal h HIS 201 Cb 0.12 0.20 -0.03 0.00 -0.00 0.00 0.00 27.41 27.70 2jal h HIS 201 CO -0.02 -0.22 0.22 0.00 -0.00 0.00 0.00 177.93 177.91 2jal h ALA 202 N 1.13 1.06 -0.55 5.26 0.00 -1.24 -0.11 119.26 124.81 2jal h ALA 202 Ca 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2jal h ALA 202 Cb 0.34 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2jal h ALA 202 CO -0.36 0.64 0.29 0.00 0.00 0.00 0.00 179.25 179.82 2jal h ARG 203 N 1.05 0.76 -0.31 0.00 2.47 -1.16 -1.79 114.38 115.40 2jal h ARG 203 Ca 0.23 -0.08 -0.13 0.00 -1.26 0.00 0.00 59.98 58.74 2jal h ARG 203 Cb 0.29 -0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 28.45 2jal h ARG 203 CO -0.01 0.57 -0.29 0.00 0.56 0.00 0.00 179.97 180.80 2jal h ALA 204 N 1.55 0.46 -0.31 0.04 0.00 -0.21 -2.22 119.26 118.57 2jal h ALA 204 Ca 0.20 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2jal h ALA 204 Cb 0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2jal h ALA 204 CO -0.03 0.48 0.15 0.28 0.00 0.00 0.00 179.25 180.13 2jal h VAL 205 N 0.51 1.16 -0.72 0.00 2.07 -0.86 -0.50 116.25 117.90 2jal h VAL 205 Ca 0.05 -0.45 0.11 0.00 0.82 0.00 0.00 66.70 67.22 2jal h VAL 205 Cb 0.87 0.89 -0.08 0.00 -1.52 0.00 0.00 31.29 31.45 2jal h VAL 205 CO 0.07 0.16 0.34 0.50 0.02 0.00 0.00 177.57 178.67 2jal h LYS 206 N 0.36 0.54 -0.02 1.57 3.64 -1.32 -0.57 116.57 120.79 2jal h LYS 206 Ca 0.11 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.36 2jal h LYS 206 Cb 0.12 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 2jal h LYS 206 CO -0.01 0.36 -0.45 0.28 -2.27 0.00 0.00 179.45 177.36 2jal h VAL 207 N 0.56 1.32 -0.40 2.00 2.07 -1.09 -3.05 116.25 117.66 2jal h VAL 207 Ca 0.37 -1.55 -0.10 0.00 0.82 0.00 0.00 66.70 66.23 2jal h VAL 207 Cb 0.44 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 2jal h VAL 207 CO -0.30 0.45 -0.16 0.15 0.02 0.00 0.00 177.57 177.72 2jal h PHE 208 N 0.03 0.84 0.00 1.57 3.57 0.39 -2.44 116.94 120.90 2jal h PHE 208 Ca -0.00 -0.17 -0.03 0.00 3.53 0.00 0.00 57.97 61.30 2jal h PHE 208 Cb 0.81 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.33 2jal h PHE 208 CO 0.00 0.87 -0.15 0.00 -2.23 0.00 0.00 178.31 176.80 2jal h ARG 209 N 0.68 0.00 0.00 1.11 2.47 -1.13 -2.14 114.38 115.37 2jal h ARG 209 Ca 0.11 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.83 2jal h ARG 209 Cb 0.65 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.97 2jal h ARG 209 CO 0.05 0.15 -0.68 0.39 0.56 0.00 0.00 179.97 180.43 2jal n GLU 210 N -3.64 0.28 0.00 0.04 4.71 -0.95 -4.62 120.64 116.46 2jal n GLU 210 Ca -0.02 0.07 0.00 0.00 -0.01 0.00 0.00 57.16 57.20 2jal n GLU 210 Cb 0.27 -1.66 0.00 0.00 -1.01 0.00 0.00 31.44 29.04 2jal n GLU 210 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 2jal n THR 211 N -2.07 0.00 -4.19 2.62 -2.24 -0.88 -5.00 114.28 102.52 2jal n THR 211 Ca 0.03 -0.11 -0.27 0.00 -2.27 0.00 0.00 64.05 61.43 2jal n THR 211 Cb 0.44 0.56 -0.17 0.00 -2.10 0.00 0.00 70.33 69.06 2jal n THR 211 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2jal s VAL 212 N -1.32 1.27 0.00 2.28 1.01 -0.86 -4.78 120.40 118.01 2jal s VAL 212 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2jal s VAL 212 Cb 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 36.38 35.17 2jal s VAL 212 CO 0.00 0.40 0.73 0.29 0.00 0.00 0.00 175.10 176.52 2jal n LYS 213 N 4.52 0.00 -1.69 2.72 5.02 -1.26 -3.85 118.16 123.62 2jal n LYS 213 Ca -0.17 0.28 -0.28 0.00 -2.02 0.00 0.00 58.31 56.12 2jal n LYS 213 Cb 0.51 -1.23 0.05 0.00 -0.02 0.00 0.00 35.03 34.34 2jal n LYS 213 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2jal n ASP 214 N -1.26 5.99 -4.86 4.39 -0.08 -1.26 -5.03 116.55 114.44 2jal n ASP 214 Ca 0.00 -3.77 -0.31 0.00 -1.51 0.00 0.00 54.79 49.20 2jal n ASP 214 Cb 0.00 -0.62 -0.03 0.00 2.34 0.00 0.00 41.12 42.81 2jal n ASP 214 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 2jal s GLY 215 N -2.82 1.99 0.11 0.27 0.00 -1.25 -4.97 107.32 100.65 2jal s GLY 215 Ca 0.57 0.01 0.10 0.00 0.00 0.00 0.00 44.72 45.40 2jal s GLY 215 CO 0.02 0.26 -0.23 -1.59 0.00 0.00 0.00 173.10 171.56 2jal s LYS 216 N -4.07 1.64 0.00 2.90 -2.85 0.61 -5.03 119.74 112.94 2jal s LYS 216 Ca 0.56 -1.23 0.00 0.00 -1.00 0.00 0.00 55.97 54.30 2jal s LYS 216 Cb -0.10 -2.02 -0.00 0.00 -2.06 0.00 0.00 37.83 33.65 2jal s LYS 216 CO 0.33 0.48 -0.02 -1.50 0.10 0.00 0.00 175.35 174.74 2jal s ILE 217 N -1.06 0.14 0.00 3.79 2.07 -1.26 -1.48 121.20 123.40 2jal s ILE 217 Ca 0.15 -0.21 0.00 0.00 -1.41 0.00 0.00 60.65 59.19 2jal s ILE 217 Cb -0.10 -0.15 0.00 0.00 0.13 0.00 0.00 42.46 42.34 2jal s ILE 217 CO 0.07 -0.05 0.00 0.61 -1.91 0.00 0.00 174.94 173.67 2jal n GLY 218 N 2.81 3.22 3.11 1.50 0.00 -0.12 -1.30 105.19 114.40 2jal n GLY 218 Ca -0.14 -1.40 -0.10 0.00 0.00 0.00 0.00 46.02 44.38 2jal n GLY 218 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2jal s ILE 219 N -2.40 0.11 -0.08 -0.61 2.07 -1.22 -1.25 121.20 117.83 2jal s ILE 219 Ca 0.00 -0.93 0.05 0.00 -1.41 0.00 0.00 60.65 58.36 2jal s ILE 219 Cb 0.00 -0.70 -0.00 0.00 0.13 0.00 0.00 42.46 41.89 2jal s ILE 219 CO 0.00 -0.51 -0.24 -0.69 -1.91 0.00 0.00 174.94 171.59 2jal s VAL 220 N -2.11 2.02 0.00 4.00 1.01 -0.81 -0.16 120.40 124.35 2jal s VAL 220 Ca -0.09 -1.02 0.05 0.00 0.00 0.00 0.00 61.98 60.92 2jal s VAL 220 Cb -0.04 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 2jal s VAL 220 CO -0.02 0.56 -0.17 -0.36 0.00 0.00 0.00 175.10 175.11 2jal s PHE 221 N 0.10 1.47 0.44 5.22 0.08 -0.58 -0.25 117.98 124.46 2jal s PHE 221 Ca -0.11 -0.30 -0.22 0.00 0.12 0.00 0.00 56.93 56.42 2jal s PHE 221 Cb -0.16 -0.93 -0.09 0.00 -0.57 0.00 0.00 43.02 41.27 2jal s PHE 221 CO 0.06 0.00 1.01 0.54 -0.10 0.00 0.00 175.22 176.74 2jal s ASN 222 N -0.60 6.67 -0.04 1.36 4.22 -1.26 -0.78 114.94 124.51 2jal s ASN 222 Ca 0.06 1.90 -0.08 0.00 -2.14 0.00 0.00 52.86 52.60 2jal s ASN 222 Cb -0.07 -2.56 0.01 0.00 1.28 0.00 0.00 41.25 39.91 2jal s ASN 222 CO -0.00 -0.55 0.19 0.20 -2.04 0.00 0.00 177.10 174.90 2jal s ASN 223 N -1.87 -0.12 0.22 3.54 0.01 -0.71 -4.09 114.94 111.91 2jal s ASN 223 Ca 0.62 0.15 0.11 0.00 -0.71 0.00 0.00 52.86 53.03 2jal s ASN 223 Cb -0.17 0.33 -0.05 0.00 0.41 0.00 0.00 41.25 41.78 2jal s ASN 223 CO 0.21 -0.22 -0.22 -0.83 -1.51 0.00 0.00 177.10 174.52 2jal s GLY 224 N -0.60 1.75 -0.43 0.66 0.00 -1.26 -4.29 107.32 103.14 2jal s GLY 224 Ca -0.07 -1.71 -0.16 0.00 0.00 0.00 0.00 44.72 42.78 2jal s GLY 224 CO 0.01 -1.76 0.37 -0.47 0.00 0.00 0.00 173.10 171.25 2jal s TYR 225 N -1.96 3.22 -0.18 1.90 5.04 -1.00 -4.96 117.35 119.40 2jal s TYR 225 Ca 0.23 -0.62 -0.15 0.00 -2.44 0.00 0.00 57.07 54.09 2jal s TYR 225 Cb -0.07 -2.84 -0.04 0.00 0.35 0.00 0.00 41.96 39.36 2jal s TYR 225 CO 0.11 -0.68 0.34 -0.06 -1.34 0.00 0.00 175.55 173.92 2jal s PHE 226 N 1.81 3.41 0.12 4.97 0.08 -1.26 -1.17 117.98 125.94 2jal s PHE 226 Ca 0.07 0.59 0.11 0.00 0.12 0.00 0.00 56.93 57.82 2jal s PHE 226 Cb -0.20 -2.43 -0.04 0.00 -0.57 0.00 0.00 43.02 39.78 2jal s PHE 226 CO 0.10 0.11 -0.26 -1.21 -0.10 0.00 0.00 175.22 173.86 2jal s GLU 227 N 0.89 1.45 0.49 0.44 2.02 -0.40 -4.97 118.70 118.63 2jal s GLU 227 Ca 0.17 -1.32 -0.19 0.00 0.02 0.00 0.00 54.97 53.65 2jal s GLU 227 Cb -0.14 -1.92 -0.08 0.00 0.10 0.00 0.00 34.13 32.09 2jal s GLU 227 CO 0.06 0.46 1.00 -1.25 0.02 0.00 0.00 175.26 175.55 2jal s PRO 228 N -2.00 3.90 0.13 0.39 0.04 -1.26 -0.45 135.00 135.75 2jal s PRO 228 Ca 0.14 1.17 -0.06 0.00 0.04 0.00 0.00 61.00 62.29 2jal s PRO 228 Cb -0.10 -2.12 -0.08 0.00 0.04 0.00 0.00 34.50 32.24 2jal s PRO 228 CO 0.06 -0.32 1.32 0.00 0.04 0.00 0.00 177.00 178.10 2jal h ALA 229 N 1.36 0.39 -4.93 8.56 0.00 -0.98 -3.43 119.26 120.23 2jal h ALA 229 Ca -0.48 -0.67 -0.57 0.00 0.00 0.00 0.00 54.91 53.19 2jal h ALA 229 Cb 1.20 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.85 2jal h ALA 229 CO 0.60 0.77 -0.45 -1.13 0.00 0.00 0.00 179.25 179.03 2jal n SER 230 N -3.81 1.87 -1.11 0.00 3.41 -1.26 -5.02 113.62 107.69 2jal n SER 230 Ca -0.07 -3.11 0.08 0.00 -0.26 0.00 0.00 58.87 55.51 2jal n SER 230 Cb 0.80 0.80 0.25 0.00 -0.26 0.00 0.00 64.21 65.80 2jal n SER 230 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2jal n GLU 231 N -0.99 2.59 -2.14 4.33 0.00 -1.26 -4.61 120.64 118.56 2jal n GLU 231 Ca -0.10 -2.04 -0.38 0.00 0.00 0.00 0.00 57.16 54.63 2jal n GLU 231 Cb 0.60 -1.55 -0.00 0.00 0.00 0.00 0.00 31.44 30.48 2jal n GLU 231 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.13 175.54 2jal s LYS 232 N -1.47 3.84 0.18 5.31 0.00 -1.26 -4.92 119.74 121.43 2jal s LYS 232 Ca 0.37 1.99 -0.20 0.00 0.00 0.00 0.00 55.97 58.13 2jal s LYS 232 Cb 0.21 -2.59 0.12 0.00 0.00 0.00 0.00 37.83 35.57 2jal s LYS 232 CO 0.22 -0.54 1.61 1.05 0.00 0.00 0.00 175.35 177.69 2jal h GLU 233 N 2.37 -0.16 -0.85 1.78 9.09 -2.00 -2.27 114.58 122.54 2jal h GLU 233 Ca -0.49 0.01 0.09 0.00 0.05 0.00 0.00 59.36 59.01 2jal h GLU 233 Cb 1.25 0.04 -0.06 0.00 -1.65 0.00 0.00 28.75 28.33 2jal h GLU 233 CO 0.61 -0.10 0.55 1.05 0.05 0.00 0.00 179.01 181.17 2jal h GLU 234 N -0.16 0.83 -0.23 1.06 9.09 -1.98 -1.71 114.58 121.47 2jal h GLU 234 Ca 0.22 -0.05 -0.07 0.00 0.05 0.00 0.00 59.36 59.50 2jal h GLU 234 Cb 0.51 -0.19 -0.01 0.00 -1.65 0.00 0.00 28.75 27.42 2jal h GLU 234 CO -0.58 0.55 -0.14 -0.44 0.05 0.00 0.00 179.01 178.45 2jal h ASP 235 N 0.86 0.53 -0.66 3.06 5.19 -1.76 -1.67 116.42 121.97 2jal h ASP 235 Ca 0.39 -0.43 0.04 0.00 -0.62 0.00 0.00 57.03 56.41 2jal h ASP 235 Cb 0.37 -0.15 -0.04 0.00 0.18 0.00 0.00 39.33 39.69 2jal h ASP 235 CO -0.16 0.84 0.40 0.40 -3.12 0.00 0.00 179.24 177.61 2jal h ILE 236 N 0.21 1.06 -0.81 0.35 2.04 -0.98 -1.86 117.51 117.52 2jal h ILE 236 Ca 0.05 -0.27 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 2jal h ILE 236 Cb 0.65 0.21 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 2jal h ILE 236 CO 0.04 0.14 0.37 0.03 0.00 0.00 0.00 178.15 178.73 2jal h ARG 237 N 0.78 1.18 -0.71 2.37 3.08 -1.33 -1.89 114.38 117.86 2jal h ARG 237 Ca 0.27 -0.19 0.10 0.00 0.07 0.00 0.00 59.98 60.24 2jal h ARG 237 Cb 0.06 -0.21 -0.08 0.00 0.08 0.00 0.00 29.97 29.82 2jal h ARG 237 CO -0.12 0.93 0.34 0.00 -1.07 0.00 0.00 179.97 180.05 2jal h ALA 238 N 1.19 0.99 -0.61 0.04 0.00 -0.75 0.33 119.26 120.45 2jal h ALA 238 Ca 0.28 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.28 2jal h ALA 238 Cb 0.15 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2jal h ALA 238 CO -0.03 -0.09 0.37 0.28 0.00 0.00 0.00 179.25 179.79 2jal h VAL 239 N 0.56 1.07 -0.85 0.00 2.07 -0.86 -1.50 116.25 116.74 2jal h VAL 239 Ca 0.36 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.62 2jal h VAL 239 Cb 0.42 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 2jal h VAL 239 CO -0.30 0.13 0.48 -0.09 0.02 0.00 0.00 177.57 177.82 2jal h ARG 240 N 0.73 1.18 -0.58 1.57 2.43 -0.54 -0.47 114.38 118.70 2jal h ARG 240 Ca 0.25 -0.13 -0.09 0.00 -0.81 0.00 0.00 59.98 59.19 2jal h ARG 240 Cb 0.03 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.32 2jal h ARG 240 CO -0.11 0.86 -0.00 0.35 -1.51 0.00 0.00 179.97 179.56 2jal h PHE 241 N 1.19 1.11 -0.43 2.20 3.04 -0.68 -1.45 116.94 121.93 2jal h PHE 241 Ca 0.30 -0.19 -0.12 0.00 3.98 0.00 0.00 57.97 61.94 2jal h PHE 241 Cb 0.01 -0.29 -0.01 0.00 2.56 0.00 0.00 35.95 38.22 2jal h PHE 241 CO 0.00 0.99 -0.18 0.52 -2.02 0.00 0.00 178.31 177.62 2jal h MET 242 N 0.91 0.88 0.10 1.11 2.86 -0.66 0.58 114.93 120.70 2jal h MET 242 Ca 0.16 -0.38 -0.00 0.00 -2.06 0.00 0.00 59.70 57.42 2jal h MET 242 Cb 0.55 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.18 2jal h MET 242 CO 0.03 1.02 -0.05 1.25 1.06 0.00 0.00 176.91 180.22 2jal h HIS 243 N 0.71 -0.12 -0.16 -0.22 -0.00 -1.10 0.23 115.15 114.48 2jal h HIS 243 Ca 0.10 -0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.41 2jal h HIS 243 Cb 0.74 0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 28.18 2jal h HIS 243 CO 0.05 -0.03 -0.15 1.96 -0.00 0.00 0.00 177.93 179.76 2jal h GLN 244 N -0.18 0.25 0.00 5.26 4.20 -0.89 -1.82 115.11 121.93 2jal h GLN 244 Ca -0.01 -0.06 -0.25 0.00 0.06 0.00 0.00 58.65 58.39 2jal h GLN 244 Cb 0.15 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.86 2jal h GLN 244 CO 0.02 0.41 -1.42 0.34 -0.67 0.00 0.00 178.83 177.51 2jal n PHE 245 N -4.25 0.80 0.17 2.96 7.35 0.16 -2.08 117.46 122.57 2jal n PHE 245 Ca -0.01 0.35 0.05 0.00 -0.76 0.00 0.00 57.45 57.08 2jal n PHE 245 Cb 0.29 -1.04 0.18 0.00 0.35 0.00 0.00 39.48 39.26 2jal n PHE 245 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 2jal h ASN 246 N -1.00 0.00 -5.89 -2.13 2.35 -0.64 -3.42 115.58 104.84 2jal h ASN 246 Ca -0.37 0.00 -0.44 0.00 -0.55 0.00 0.00 56.30 54.94 2jal h ASN 246 Cb 1.28 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.65 2jal h ASN 246 CO -0.23 0.40 -0.13 0.59 -1.65 0.00 0.00 177.43 176.41 2jal n ASN 247 N -3.31 2.07 -0.56 5.81 3.02 -0.68 -4.62 115.26 116.99 2jal n ASN 247 Ca 0.01 -2.42 0.45 0.00 -0.03 0.00 0.00 54.58 52.60 2jal n ASN 247 Cb 0.62 -0.23 0.77 0.00 -0.61 0.00 0.00 39.78 40.34 2jal n ASN 247 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 2jal h TYR 248 N 0.31 0.10 -0.10 3.10 -0.00 -1.80 -2.75 116.97 115.83 2jal h TYR 248 Ca -0.26 0.00 0.01 0.00 0.00 0.00 0.00 58.73 58.49 2jal h TYR 248 Cb 1.06 -0.02 -0.00 0.00 0.00 0.00 0.00 36.73 37.76 2jal h TYR 248 CO 0.00 -0.03 0.07 -1.35 -0.00 0.00 0.00 178.16 176.84 2jal h PRO 249 N 0.02 0.09 -0.93 0.10 0.11 -1.78 0.18 132.00 129.80 2jal h PRO 249 Ca 0.81 -0.01 0.22 0.00 0.11 0.00 0.00 66.00 67.14 2jal h PRO 249 Cb 3.14 -0.02 -0.07 0.00 0.11 0.00 0.00 31.00 34.16 2jal h PRO 249 CO -0.08 0.06 0.62 1.25 -0.21 0.00 0.00 178.00 179.64 2jal h LEU 250 N 0.09 0.36 0.00 2.35 5.85 -1.10 0.04 115.31 122.91 2jal h LEU 250 Ca 0.04 0.04 -0.30 0.00 0.84 0.00 0.00 57.88 58.50 2jal h LEU 250 Cb 0.05 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.00 2jal h LEU 250 CO -0.01 0.13 -2.15 0.49 -0.34 0.00 0.00 178.44 176.57 2jal n PHE 251 N -4.50 0.00 0.13 1.25 3.72 -0.72 -4.44 117.46 112.91 2jal n PHE 251 Ca 0.20 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.60 2jal n PHE 251 Cb 0.76 -0.79 0.12 0.00 -0.94 0.00 0.00 39.48 38.63 2jal n PHE 251 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2jal h LEU 252 N 0.00 0.00 -0.35 4.37 3.38 -0.43 -1.61 115.31 120.66 2jal h LEU 252 Ca -0.45 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 2jal h LEU 252 Cb 1.82 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.55 2jal h LEU 252 CO -0.04 0.62 0.15 -1.13 0.09 0.00 0.00 178.44 178.14 2jal h ASN 253 N 0.00 0.48 0.07 -0.43 -1.24 -1.19 0.16 115.58 113.43 2jal h ASN 253 Ca -0.01 -0.15 0.02 0.00 0.71 0.00 0.00 56.30 56.87 2jal h ASN 253 Cb 1.26 -0.12 -0.03 0.00 0.73 0.00 0.00 38.32 40.16 2jal h ASN 253 CO 0.08 0.50 -0.20 -0.65 -1.29 0.00 0.00 177.43 175.87 2jal h PRO 254 N 0.42 -0.35 -0.67 6.67 0.11 -1.12 0.40 132.00 137.46 2jal h PRO 254 Ca 0.12 0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.25 2jal h PRO 254 Cb 0.16 0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.32 2jal h PRO 254 CO -0.01 -0.23 0.42 0.82 -0.21 0.00 0.00 178.00 178.78 2jal h ILE 255 N -0.36 1.19 0.00 4.15 2.04 -1.13 -1.73 117.51 121.67 2jal h ILE 255 Ca 0.04 -0.39 -0.25 0.00 1.00 0.00 0.00 64.86 65.26 2jal h ILE 255 Cb 0.40 0.24 -0.05 0.00 -0.74 0.00 0.00 36.82 36.67 2jal h ILE 255 CO -0.14 0.19 -2.08 -1.22 0.00 0.00 0.00 178.15 174.90 2jal n TYR 256 N -4.59 0.26 -0.00 1.37 4.01 0.03 -4.27 117.16 113.97 2jal n TYR 256 Ca 0.05 0.09 0.00 0.00 -0.16 0.00 0.00 57.90 57.88 2jal n TYR 256 Cb 0.04 -0.93 0.00 0.00 -0.31 0.00 0.00 39.34 38.14 2jal n TYR 256 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2jal n ARG 257 N -2.70 5.90 -1.40 -0.72 1.74 0.13 -5.04 116.66 114.57 2jal n ARG 257 Ca -0.22 -0.07 -0.03 0.00 -0.77 0.00 0.00 57.85 56.77 2jal n ARG 257 Cb 0.97 -0.56 -0.01 0.00 -1.02 0.00 0.00 32.46 31.84 2jal n ARG 257 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jal n GLY 258 N 0.86 0.47 3.58 -0.13 0.00 -0.53 -4.95 105.19 104.51 2jal n GLY 258 Ca 0.00 -0.90 -0.10 0.00 0.00 0.00 0.00 46.02 45.02 2jal n GLY 258 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jal s ASP 259 N -2.94 -0.45 0.74 1.61 -1.08 -1.20 -4.87 116.67 108.47 2jal s ASP 259 Ca 0.00 -0.23 -0.11 0.00 -0.52 0.00 0.00 52.55 51.69 2jal s ASP 259 Cb 0.00 0.65 0.04 0.00 -1.46 0.00 0.00 42.92 42.14 2jal s ASP 259 CO 0.00 -1.11 1.08 -0.31 0.52 0.00 0.00 175.17 175.35 2jal s TYR 260 N -3.82 2.78 0.61 -5.34 2.02 -1.26 -1.15 117.35 111.19 2jal s TYR 260 Ca 0.05 1.51 -0.19 0.00 -0.37 0.00 0.00 57.07 58.06 2jal s TYR 260 Cb -0.03 -2.99 -0.03 0.00 -0.40 0.00 0.00 41.96 38.51 2jal s TYR 260 CO -0.05 -1.58 1.22 -2.30 -1.57 0.00 0.00 175.55 171.26 2jal n PRO 261 N -3.35 1.21 -0.27 -1.71 -0.02 -1.26 -4.76 135.00 124.84 2jal n PRO 261 Ca 0.09 0.46 0.01 0.00 -2.02 0.00 0.00 63.50 62.04 2jal n PRO 261 Cb 0.53 -2.44 0.14 0.00 -0.02 0.00 0.00 33.50 31.71 2jal n PRO 261 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2jal h GLU 262 N 0.77 0.76 0.00 -0.52 4.81 -1.98 -1.17 114.58 117.25 2jal h GLU 262 Ca -0.50 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 58.66 2jal h GLU 262 Cb 1.34 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 2jal h GLU 262 CO 0.54 0.50 -0.12 -0.07 -0.73 0.00 0.00 179.01 179.13 2jal h LEU 263 N 0.78 0.00 -0.09 1.64 3.38 -1.95 -2.01 115.31 117.06 2jal h LEU 263 Ca 0.36 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.29 2jal h LEU 263 Cb 0.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 2jal h LEU 263 CO -0.21 0.12 -0.10 0.58 0.09 0.00 0.00 178.44 178.92 2jal h VAL 264 N 0.00 1.36 -0.65 1.22 2.07 -1.68 -2.67 116.25 115.90 2jal h VAL 264 Ca -0.00 -1.26 0.08 0.00 0.82 0.00 0.00 66.70 66.34 2jal h VAL 264 Cb 1.05 1.99 -0.07 0.00 -1.52 0.00 0.00 31.29 32.75 2jal h VAL 264 CO 0.02 0.36 0.30 -0.07 0.02 0.00 0.00 177.57 178.20 2jal h LEU 265 N -0.19 0.39 -1.07 2.57 3.38 -1.19 0.33 115.31 119.54 2jal h LEU 265 Ca 0.01 0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.10 2jal h LEU 265 Cb 0.62 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 2jal h LEU 265 CO 0.02 0.23 0.63 -0.33 0.09 0.00 0.00 178.44 179.08 2jal h GLU 266 N 0.54 1.11 -0.03 1.13 5.08 -1.35 -1.02 114.58 120.05 2jal h GLU 266 Ca 0.31 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.46 2jal h GLU 266 Cb 0.32 -0.25 0.01 0.00 0.50 0.00 0.00 28.75 29.33 2jal h GLU 266 CO -0.26 0.74 -0.54 0.35 -1.00 0.00 0.00 179.01 178.30 2jal h PHE 267 N 1.15 0.60 0.00 4.33 3.57 -1.00 -3.42 116.94 122.17 2jal h PHE 267 Ca 0.41 -0.31 0.00 0.00 3.53 0.00 0.00 57.97 61.60 2jal h PHE 267 Cb 0.13 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 38.79 2jal h PHE 267 CO -0.00 1.11 0.00 0.00 -2.23 0.00 0.00 178.31 177.19 2jal n ALA 268 N -2.57 1.90 -0.35 2.41 0.00 0.11 -4.74 120.51 117.27 2jal n ALA 268 Ca -0.10 -0.70 0.08 0.00 0.00 0.00 0.00 53.44 52.72 2jal n ALA 268 Cb 0.64 0.00 0.25 0.00 0.00 0.00 0.00 19.45 20.34 2jal n ALA 268 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2jal h ARG 269 N 0.00 0.94 0.00 0.00 2.43 -1.34 -1.23 114.38 115.18 2jal h ARG 269 Ca 0.00 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2jal h ARG 269 Cb 0.39 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2jal h ARG 269 CO 0.00 0.62 0.00 1.49 -1.51 0.00 0.00 179.97 180.57 2jal h GLU 270 N 0.97 0.00 0.00 0.20 4.57 -1.85 -2.93 114.58 115.54 2jal h GLU 270 Ca 0.50 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.68 2jal h GLU 270 Cb 0.52 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 2jal h GLU 270 CO -0.26 0.00 -1.59 0.66 -1.18 0.00 0.00 179.01 176.64 2jal n TYR 271 N -2.49 0.27 -2.53 0.92 4.01 -0.51 -4.95 117.16 111.89 2jal n TYR 271 Ca 0.01 0.08 -0.33 0.00 -0.16 0.00 0.00 57.90 57.50 2jal n TYR 271 Cb 0.24 -0.58 -0.04 0.00 -0.31 0.00 0.00 39.34 38.65 2jal n TYR 271 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2jal s LEU 272 N -4.58 3.79 0.58 7.72 1.43 -0.93 -4.33 118.68 122.36 2jal s LEU 272 Ca -0.04 1.80 -0.21 0.00 -1.03 0.00 0.00 54.13 54.66 2jal s LEU 272 Cb 0.13 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.77 2jal s LEU 272 CO 0.87 -0.70 1.34 -2.16 0.23 0.00 0.00 176.35 175.93 2jal s PRO 273 N -3.44 2.94 0.16 1.29 0.04 -1.26 -4.91 135.00 129.80 2jal s PRO 273 Ca 0.64 2.19 -0.34 0.00 0.04 0.00 0.00 61.00 63.54 2jal s PRO 273 Cb -0.13 -2.12 -0.15 0.00 0.04 0.00 0.00 34.50 32.14 2jal s PRO 273 CO 0.22 -1.34 1.46 -1.91 0.04 0.00 0.00 177.00 175.47 2jal n GLU 274 N -1.32 1.83 -1.84 4.56 2.13 -1.26 -1.78 120.64 122.95 2jal n GLU 274 Ca 0.12 0.66 -0.14 0.00 0.66 0.00 0.00 57.16 58.46 2jal n GLU 274 Cb 0.46 -2.36 -0.03 0.00 0.27 0.00 0.00 31.44 29.78 2jal n GLU 274 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2jal n ASN 275 N 2.87 -4.42 -0.13 4.31 3.02 -1.26 -4.88 115.26 114.77 2jal n ASN 275 Ca 0.16 0.16 0.15 0.00 -0.03 0.00 0.00 54.58 55.02 2jal n ASN 275 Cb 0.27 -3.36 0.51 0.00 -0.61 0.00 0.00 39.78 36.59 2jal n ASN 275 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 2jal h TYR 276 N 0.00 0.44 0.00 3.10 -0.00 -1.71 -2.05 116.97 116.76 2jal h TYR 276 Ca -0.30 0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.44 2jal h TYR 276 Cb 1.07 -0.14 0.00 0.00 0.00 0.00 0.00 36.73 37.66 2jal h TYR 276 CO 0.37 0.18 0.00 -0.22 -0.00 0.00 0.00 178.16 178.49 2jal h LYS 277 N 0.39 0.00 -0.01 0.10 3.64 -1.90 -1.65 116.57 117.14 2jal h LYS 277 Ca 0.34 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 2jal h LYS 277 Cb 0.77 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.59 2jal h LYS 277 CO -0.10 0.00 0.03 -0.44 -2.27 0.00 0.00 179.45 176.67 2jal h ASP 278 N 0.00 0.00 0.38 4.20 5.19 -1.76 -2.08 116.42 122.35 2jal h ASP 278 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2jal h ASP 278 Cb 0.30 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.81 2jal h ASP 278 CO 0.00 0.00 -0.81 0.47 -3.12 0.00 0.00 179.24 175.78 2jal n ASP 279 N -3.34 0.66 0.08 6.45 8.00 -0.62 -4.39 116.55 123.39 2jal n ASP 279 Ca -0.03 -0.38 0.02 0.00 0.71 0.00 0.00 54.79 55.11 2jal n ASP 279 Cb 0.10 0.61 0.37 0.00 -0.02 0.00 0.00 41.12 42.19 2jal n ASP 279 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 2jal h MET 280 N 0.00 0.33 -0.40 -1.24 2.86 -1.48 -1.76 114.93 113.23 2jal h MET 280 Ca 0.00 -0.07 -0.09 0.00 -2.06 0.00 0.00 59.70 57.48 2jal h MET 280 Cb 0.59 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.19 2jal h MET 280 CO 0.00 0.41 -0.13 0.66 1.06 0.00 0.00 176.91 178.91 2jal h SER 281 N 0.32 0.73 -0.09 1.22 4.64 -1.77 -2.04 113.55 116.56 2jal h SER 281 Ca 0.07 -0.22 -0.13 0.00 -0.47 0.00 0.00 61.79 61.03 2jal h SER 281 Cb 0.33 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 2jal h SER 281 CO 0.02 0.88 -0.38 -0.33 -0.87 0.00 0.00 176.83 176.14 2jal h GLU 282 N 0.66 0.61 0.00 4.77 3.07 -1.75 -3.15 114.58 118.79 2jal h GLU 282 Ca 0.11 -0.30 -0.02 0.00 -0.50 0.00 0.00 59.36 58.65 2jal h GLU 282 Cb 0.60 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.51 2jal h GLU 282 CO 0.04 0.89 -0.11 0.82 -1.40 0.00 0.00 179.01 179.25 2jal h ILE 283 N 0.50 0.55 0.00 3.13 2.04 -0.69 -3.04 117.51 120.00 2jal h ILE 283 Ca 0.05 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.40 2jal h ILE 283 Cb 0.88 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 2jal h ILE 283 CO 0.08 0.11 0.00 0.00 0.00 0.00 0.00 178.15 178.34 2jal n GLN 284 N -3.63 0.77 -1.64 2.37 6.02 -0.83 -4.54 117.38 115.90 2jal n GLN 284 Ca -0.02 0.00 -0.55 0.00 -0.01 0.00 0.00 57.00 56.42 2jal n GLN 284 Cb 0.23 -1.04 -0.07 0.00 1.02 0.00 0.00 30.24 30.38 2jal n GLN 284 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2jal n GLU 285 N -0.43 1.03 -1.98 -1.09 4.07 -1.15 -4.82 120.64 116.26 2jal n GLU 285 Ca 0.00 0.37 -0.42 0.00 -0.06 0.00 0.00 57.16 57.06 2jal n GLU 285 Cb 0.02 -2.02 -0.03 0.00 -0.06 0.00 0.00 31.44 29.36 2jal n GLU 285 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 2jal s LYS 286 N 1.73 4.25 0.22 5.31 2.20 -1.26 -5.02 119.74 127.16 2jal s LYS 286 Ca 0.91 2.32 0.06 0.00 -0.36 0.00 0.00 55.97 58.91 2jal s LYS 286 Cb -1.04 -3.13 -0.04 0.00 -1.51 0.00 0.00 37.83 32.11 2jal s LYS 286 CO 0.56 -0.50 0.15 0.96 -0.36 0.00 0.00 175.35 176.17 2jal s ILE 287 N 0.48 4.37 -0.09 5.43 -4.36 -1.26 -5.01 121.20 120.76 2jal s ILE 287 Ca 0.64 -1.31 0.05 0.00 -0.26 0.00 0.00 60.65 59.77 2jal s ILE 287 Cb -0.42 -3.30 -0.24 0.00 1.25 0.00 0.00 42.46 39.74 2jal s ILE 287 CO 0.38 -0.25 0.48 0.47 0.24 0.00 0.00 174.94 176.27 2jal n ASP 288 N -0.79 1.33 -3.73 4.36 8.00 -0.42 -4.92 116.55 120.38 2jal n ASP 288 Ca -0.08 0.29 -0.10 0.00 0.71 0.00 0.00 54.79 55.61 2jal n ASP 288 Cb 0.57 -0.31 -0.06 0.00 -0.02 0.00 0.00 41.12 41.29 2jal n ASP 288 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2jal s PHE 289 N -2.57 -0.07 -0.16 1.24 -0.71 -1.20 -3.85 117.98 110.65 2jal s PHE 289 Ca -0.13 -0.25 -0.01 0.00 -1.04 0.00 0.00 56.93 55.50 2jal s PHE 289 Cb 0.07 0.13 -0.01 0.00 -1.21 0.00 0.00 43.02 42.00 2jal s PHE 289 CO 0.80 -0.61 -0.10 0.08 -1.34 0.00 0.00 175.22 174.04 2jal s VAL 290 N -3.60 3.17 -0.14 -2.49 1.01 -0.82 -3.42 120.40 114.11 2jal s VAL 290 Ca 0.02 -0.60 -0.18 0.00 0.00 0.00 0.00 61.98 61.22 2jal s VAL 290 Cb 0.02 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 2jal s VAL 290 CO -0.10 0.50 0.47 -0.83 0.00 0.00 0.00 175.10 175.14 2jal s GLY 291 N 0.67 2.30 -0.14 4.51 0.00 0.78 -1.74 107.32 113.70 2jal s GLY 291 Ca -0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 44.72 44.40 2jal s GLY 291 CO 0.02 0.83 -0.11 1.08 0.00 0.00 0.00 173.10 174.92 2jal s LEU 292 N 0.87 2.79 -0.06 0.66 1.43 0.62 -1.53 118.68 123.46 2jal s LEU 292 Ca 0.25 -0.32 -0.04 0.00 -1.03 0.00 0.00 54.13 52.99 2jal s LEU 292 Cb -0.15 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.39 2jal s LEU 292 CO 0.10 0.14 0.13 0.20 0.23 0.00 0.00 176.35 177.15 2jal s ASN 293 N 0.48 6.14 -0.17 2.29 0.01 0.04 -1.00 114.94 122.74 2jal s ASN 293 Ca -0.08 0.34 -0.15 0.00 -0.71 0.00 0.00 52.86 52.25 2jal s ASN 293 Cb -0.15 -1.91 0.05 0.00 0.41 0.00 0.00 41.25 39.64 2jal s ASN 293 CO 0.04 0.33 0.45 -0.47 -1.51 0.00 0.00 177.10 175.94 2jal s TYR 294 N -1.15 -0.51 0.00 2.20 6.14 -0.88 -1.74 117.35 121.41 2jal s TYR 294 Ca 0.20 1.22 0.00 0.00 0.64 0.00 0.00 57.07 59.13 2jal s TYR 294 Cb -0.12 0.18 0.00 0.00 0.42 0.00 0.00 41.96 42.44 2jal s TYR 294 CO 0.11 -0.25 0.00 2.48 0.64 0.00 0.00 175.55 178.53 2jal n TYR 295 N 2.98 0.00 -3.84 4.97 4.11 -1.26 -4.29 117.16 119.82 2jal n TYR 295 Ca -0.14 0.00 -0.10 0.00 -0.00 0.00 0.00 57.90 57.66 2jal n TYR 295 Cb 0.57 0.00 -0.05 0.00 -0.00 0.00 0.00 39.34 39.85 2jal n TYR 295 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.86 175.32 2jal s SER 296 N -0.28 -0.10 0.33 9.48 1.04 -1.26 -4.71 113.70 118.20 2jal s SER 296 Ca 0.00 -0.66 0.09 0.00 0.48 0.00 0.00 55.95 55.85 2jal s SER 296 Cb 0.00 0.50 -0.05 0.00 0.10 0.00 0.00 66.02 66.57 2jal s SER 296 CO 0.00 -0.96 0.05 -0.83 0.98 0.00 0.00 173.24 172.49 2jal s GLY 297 N -2.91 2.00 -0.14 7.32 0.00 -1.10 -2.37 107.32 110.12 2jal s GLY 297 Ca 0.12 -1.90 -0.12 0.00 0.00 0.00 0.00 44.72 42.83 2jal s GLY 297 CO -0.02 -1.84 0.36 0.30 0.00 0.00 0.00 173.10 171.89 2jal s HIS 298 N -2.47 -0.41 -0.09 1.90 3.76 -0.32 -4.39 115.29 113.27 2jal s HIS 298 Ca 0.35 0.98 -0.13 0.00 -0.15 0.00 0.00 55.06 56.11 2jal s HIS 298 Cb -0.01 0.14 -0.05 0.00 1.11 0.00 0.00 32.58 33.77 2jal s HIS 298 CO 0.20 -0.20 0.31 -1.17 -0.85 0.00 0.00 174.74 173.03 2jal s LEU 299 N 0.33 4.37 0.08 0.89 2.96 -1.26 -1.28 118.68 124.78 2jal s LEU 299 Ca -0.01 0.69 0.02 0.00 -0.22 0.00 0.00 54.13 54.61 2jal s LEU 299 Cb -0.03 -2.40 -0.04 0.00 0.50 0.00 0.00 46.19 44.22 2jal s LEU 299 CO -0.01 0.25 -0.07 0.68 -1.32 0.00 0.00 176.35 175.88 2jal s VAL 300 N -0.45 0.68 -0.00 1.68 -7.23 0.40 -0.67 120.40 114.81 2jal s VAL 300 Ca 0.19 -1.64 -0.09 0.00 -1.81 0.00 0.00 61.98 58.63 2jal s VAL 300 Cb -0.14 -1.31 0.01 0.00 0.56 0.00 0.00 36.38 35.49 2jal s VAL 300 CO 0.08 -0.68 0.18 -1.59 -0.31 0.00 0.00 175.10 172.78 2jal s LYS 301 N -3.01 0.53 0.16 4.82 -2.85 -0.65 -0.31 119.74 118.43 2jal s LYS 301 Ca 0.04 -0.35 -0.31 0.00 -1.00 0.00 0.00 55.97 54.35 2jal s LYS 301 Cb -0.00 0.23 -0.10 0.00 -2.06 0.00 0.00 37.83 35.90 2jal s LYS 301 CO -0.03 -0.13 1.52 0.12 0.10 0.00 0.00 175.35 176.93 2jal s PHE 302 N -1.38 3.10 -0.21 1.78 5.36 -1.26 -1.62 117.98 123.75 2jal s PHE 302 Ca -0.14 0.72 -0.04 0.00 -0.96 0.00 0.00 56.93 56.51 2jal s PHE 302 Cb -0.07 -3.87 0.10 0.00 -0.34 0.00 0.00 43.02 38.85 2jal s PHE 302 CO 0.02 -3.14 0.28 0.34 -1.46 0.00 0.00 175.22 171.26 2jal s ASP 303 N 1.09 0.88 0.63 6.13 2.15 0.09 -4.88 116.67 122.76 2jal s ASP 303 Ca 0.68 0.02 0.41 0.00 0.43 0.00 0.00 52.55 54.09 2jal s ASP 303 Cb -0.42 0.67 2.14 0.00 -0.30 0.00 0.00 42.92 45.01 2jal s ASP 303 CO 0.32 -0.31 2.28 -0.65 -0.17 0.00 0.00 175.17 176.64 2jal h PRO 304 N 8.26 0.00 0.00 4.34 0.11 -1.96 -0.71 132.00 142.04 2jal h PRO 304 Ca -0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.93 2jal h PRO 304 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2jal h PRO 304 CO 0.26 0.01 -0.88 -0.25 -0.21 0.00 0.00 178.00 176.93 2jal n ASP 305 N -3.16 0.65 -4.77 -2.05 8.00 -1.26 -4.85 116.55 109.11 2jal n ASP 305 Ca -0.02 -0.05 -0.39 0.00 0.71 0.00 0.00 54.79 55.03 2jal n ASP 305 Cb 0.13 0.54 -0.04 0.00 -0.02 0.00 0.00 41.12 41.73 2jal n ASP 305 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jal s ALA 306 N -3.20 3.30 0.15 2.24 0.00 -0.27 -4.91 121.76 119.07 2jal s ALA 306 Ca 0.04 0.90 -0.05 0.00 0.00 0.00 0.00 51.96 52.85 2jal s ALA 306 Cb 0.14 -3.34 0.23 0.00 0.00 0.00 0.00 23.12 20.15 2jal s ALA 306 CO 0.77 -0.28 0.86 -2.30 0.00 0.00 0.00 175.76 174.81 2jal n PRO 307 N 0.71 -0.06 -0.19 0.00 -0.02 -1.26 0.41 135.00 134.59 2jal n PRO 307 Ca 0.01 0.86 0.09 0.00 -2.02 0.00 0.00 63.50 62.43 2jal n PRO 307 Cb 0.46 -1.28 0.17 0.00 -0.02 0.00 0.00 33.50 32.83 2jal n PRO 307 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jal n ALA 308 N -3.78 2.47 -1.04 3.55 0.00 -1.26 -4.95 120.51 115.50 2jal n ALA 308 Ca 0.08 -2.36 -0.01 0.00 0.00 0.00 0.00 53.44 51.15 2jal n ALA 308 Cb 0.27 -0.46 -0.01 0.00 0.00 0.00 0.00 19.45 19.25 2jal n ALA 308 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jal n LYS 309 N -1.01 -0.33 -4.45 0.00 4.01 0.17 -5.04 118.16 111.51 2jal n LYS 309 Ca 0.16 0.29 -0.22 0.00 -0.51 0.00 0.00 58.31 58.03 2jal n LYS 309 Cb 0.68 -3.71 -0.16 0.00 -0.51 0.00 0.00 35.03 31.33 2jal n LYS 309 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2jal s VAL 310 N -1.94 0.90 -0.04 -0.18 1.01 -1.25 -0.73 120.40 118.18 2jal s VAL 310 Ca 0.00 -0.38 0.07 0.00 0.00 0.00 0.00 61.98 61.67 2jal s VAL 310 Cb 0.00 -0.82 -0.01 0.00 0.00 0.00 0.00 36.38 35.54 2jal s VAL 310 CO 0.00 0.29 -0.24 -0.44 0.00 0.00 0.00 175.10 174.71 2jal s SER 311 N 0.46 2.92 0.57 3.32 0.01 -0.64 -4.56 113.70 115.78 2jal s SER 311 Ca -0.08 -0.47 -0.19 0.00 1.31 0.00 0.00 55.95 56.52 2jal s SER 311 Cb -0.12 -0.54 -0.05 0.00 0.21 0.00 0.00 66.02 65.52 2jal s SER 311 CO 0.02 0.27 1.13 -0.36 0.41 0.00 0.00 173.24 174.71 2jal s PHE 312 N -0.38 2.64 -0.05 2.43 0.08 -1.26 -1.64 117.98 119.80 2jal s PHE 312 Ca 0.04 1.54 0.02 0.00 0.12 0.00 0.00 56.93 58.65 2jal s PHE 312 Cb -0.11 -3.28 0.01 0.00 -0.57 0.00 0.00 43.02 39.07 2jal s PHE 312 CO 0.01 -1.63 -0.09 0.54 -0.10 0.00 0.00 175.22 173.94 2jal s VAL 313 N -1.86 0.91 0.57 -0.44 0.11 0.16 -4.90 120.40 114.94 2jal s VAL 313 Ca 0.72 -0.36 -0.20 0.00 -2.93 0.00 0.00 61.98 59.21 2jal s VAL 313 Cb -0.24 -0.85 -0.04 0.00 -1.53 0.00 0.00 36.38 33.73 2jal s VAL 313 CO 0.30 0.30 1.29 -1.83 -3.33 0.00 0.00 175.10 171.83 2jal s GLU 314 N 0.66 3.04 0.09 1.54 1.03 -1.26 -4.11 118.70 119.69 2jal s GLU 314 Ca -0.12 2.06 0.07 0.00 0.03 0.00 0.00 54.97 57.01 2jal s GLU 314 Cb -0.14 -2.11 -0.03 0.00 -0.80 0.00 0.00 34.13 31.04 2jal s GLU 314 CO 0.02 -1.22 -0.18 1.03 -1.33 0.00 0.00 175.26 173.58 2jal s ARG 315 N -3.08 1.01 -1.29 -4.83 0.52 -1.26 -5.03 118.95 104.99 2jal s ARG 315 Ca 0.75 -1.09 -0.05 0.00 -0.52 0.00 0.00 55.73 54.82 2jal s ARG 315 Cb -0.36 -1.19 0.13 0.00 0.52 0.00 0.00 34.95 34.05 2jal s ARG 315 CO 0.41 0.27 2.35 -0.25 0.02 0.00 0.00 175.30 178.11 2jal n ASP 316 N 1.16 7.99 -4.69 0.23 8.00 -1.26 -4.93 116.55 123.04 2jal n ASP 316 Ca -0.20 -3.18 -0.24 0.00 0.71 0.00 0.00 54.79 51.88 2jal n ASP 316 Cb 0.54 -1.35 -0.07 0.00 -0.02 0.00 0.00 41.12 40.22 2jal n ASP 316 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 2jal s LEU 317 N -2.29 3.11 0.20 0.64 2.34 -1.26 -5.09 118.68 116.33 2jal s LEU 317 Ca 0.53 -0.94 -0.32 0.00 0.06 0.00 0.00 54.13 53.45 2jal s LEU 317 Cb 0.19 -1.50 -0.14 0.00 -0.56 0.00 0.00 46.19 44.18 2jal s LEU 317 CO -0.10 -0.34 1.35 -0.81 -1.06 0.00 0.00 176.35 175.39 2jal n PRO 318 N -1.09 1.73 -4.39 1.48 -0.04 -1.26 -4.83 135.00 126.59 2jal n PRO 318 Ca -0.03 0.62 -0.25 0.00 -0.04 0.00 0.00 63.50 63.80 2jal n PRO 318 Cb 0.63 -2.24 -0.09 0.00 -0.04 0.00 0.00 33.50 31.76 2jal n PRO 318 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2jal s LYS 319 N -0.21 1.87 0.85 0.54 1.02 -1.26 -1.38 119.74 121.16 2jal s LYS 319 Ca 0.72 -1.56 -0.07 0.00 0.02 0.00 0.00 55.97 55.08 2jal s LYS 319 Cb -0.73 -1.94 0.18 0.00 -0.52 0.00 0.00 37.83 34.81 2jal s LYS 319 CO 0.49 0.37 1.16 0.95 -0.92 0.00 0.00 175.35 177.39 2jal s THR 320 N -2.19 2.01 0.43 2.17 -4.23 -0.46 -4.89 115.64 108.49 2jal s THR 320 Ca 0.28 -0.38 0.40 0.00 -1.18 0.00 0.00 61.69 60.81 2jal s THR 320 Cb -0.06 -2.63 0.41 0.00 1.34 0.00 0.00 72.50 71.56 2jal s THR 320 CO 0.15 0.00 2.21 0.00 -0.54 0.00 0.00 174.62 176.44 2jal h ALA 321 N -1.06 1.00 0.00 3.99 0.00 -1.49 0.97 119.26 122.67 2jal h ALA 321 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2jal h ALA 321 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2jal h ALA 321 CO 0.35 0.00 0.00 -1.33 0.00 0.00 0.00 179.25 178.27 2jal n MET 322 N -2.98 0.20 -0.98 0.00 2.81 -1.26 -4.89 117.12 110.02 2jal n MET 322 Ca -0.02 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.91 2jal n MET 322 Cb 0.12 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.13 2jal n MET 322 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jal n GLY 323 N 1.09 0.49 3.72 3.03 0.00 0.34 -5.02 105.19 108.84 2jal n GLY 323 Ca 0.10 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 2jal n GLY 323 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jal s TRP 324 N -2.00 3.63 -0.00 1.61 0.51 -1.26 -4.72 118.94 116.71 2jal s TRP 324 Ca 0.00 1.34 -0.30 0.00 -2.12 0.00 0.00 56.10 55.02 2jal s TRP 324 Cb 0.00 -2.83 -0.06 0.00 -0.81 0.00 0.00 33.47 29.77 2jal s TRP 324 CO 0.00 0.13 1.54 -1.21 -0.51 0.00 0.00 176.95 176.90 2jal s GLU 325 N 0.58 4.23 -0.61 4.98 2.02 -1.26 -1.35 118.70 127.29 2jal s GLU 325 Ca 0.39 2.12 -0.27 0.00 0.02 0.00 0.00 54.97 57.23 2jal s GLU 325 Cb -0.19 -3.71 0.03 0.00 0.10 0.00 0.00 34.13 30.37 2jal s GLU 325 CO 0.20 -0.70 1.18 0.42 0.02 0.00 0.00 175.26 176.37 2jal s ILE 326 N 2.98 4.01 -0.48 -1.63 1.01 -0.48 -2.72 121.20 123.89 2jal s ILE 326 Ca 0.69 0.73 0.04 0.00 0.00 0.00 0.00 60.65 62.11 2jal s ILE 326 Cb -0.34 -4.74 0.17 0.00 0.01 0.00 0.00 42.46 37.56 2jal s ILE 326 CO 0.28 -1.41 0.38 -0.69 0.00 0.00 0.00 174.94 173.50 2jal s VAL 327 N 4.97 0.95 0.37 2.92 1.01 -1.26 -4.77 120.40 124.59 2jal s VAL 327 Ca 0.40 -3.04 0.27 0.00 0.00 0.00 0.00 61.98 59.61 2jal s VAL 327 Cb -0.08 -1.65 0.29 0.00 0.00 0.00 0.00 36.38 34.93 2jal s VAL 327 CO 0.23 -1.18 2.04 -0.65 0.00 0.00 0.00 175.10 175.53 2jal h PRO 328 N 5.58 0.00 0.00 2.72 0.11 -1.91 -1.83 132.00 136.67 2jal h PRO 328 Ca 0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.35 2jal h PRO 328 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2jal h PRO 328 CO 0.45 0.13 0.00 -0.85 -0.21 0.00 0.00 178.00 177.53 2jal n GLU 329 N -3.59 0.08 0.08 1.05 0.00 -1.26 -1.93 120.64 115.07 2jal n GLU 329 Ca -0.01 0.43 0.00 0.00 0.00 0.00 0.00 57.16 57.58 2jal n GLU 329 Cb 0.26 -1.70 0.31 0.00 0.00 0.00 0.00 31.44 30.32 2jal n GLU 329 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.13 177.91 2jal h GLY 330 N 1.36 0.34 2.00 -1.84 0.00 -1.73 -1.55 103.07 101.66 2jal h GLY 330 Ca 0.00 -0.24 -0.10 0.00 0.00 0.00 0.00 47.33 46.99 2jal h GLY 330 CO 0.00 0.22 -0.48 1.19 0.00 0.00 0.00 176.54 177.47 2jal h ILE 331 N 0.29 1.32 0.00 2.60 2.10 -1.59 -2.08 117.51 120.15 2jal h ILE 331 Ca 0.05 -1.67 -0.00 0.00 1.08 0.00 0.00 64.86 64.32 2jal h ILE 331 Cb 0.50 1.91 0.00 0.00 -1.09 0.00 0.00 36.82 38.14 2jal h ILE 331 CO 0.03 0.47 -0.00 0.22 -1.08 0.00 0.00 178.15 177.80 2jal h TYR 332 N 0.00 -0.00 -0.44 2.19 3.20 -1.62 -3.08 116.97 117.22 2jal h TYR 332 Ca -0.00 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.95 2jal h TYR 332 Cb 0.87 0.00 -0.07 0.00 1.54 0.00 0.00 36.73 39.07 2jal h TYR 332 CO 0.00 0.56 0.03 2.35 -1.64 0.00 0.00 178.16 179.45 2jal h TRP 333 N -0.56 0.02 -0.02 -3.82 7.01 -1.15 -1.68 115.95 115.75 2jal h TRP 333 Ca -0.00 0.03 -0.10 0.00 2.11 0.00 0.00 58.89 60.93 2jal h TRP 333 Cb 0.56 0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.66 2jal h TRP 333 CO 0.12 -0.07 -0.44 0.97 -2.79 0.00 0.00 178.44 176.23 2jal h ILE 334 N 0.14 1.32 -0.08 2.65 6.09 -1.47 0.68 117.51 126.84 2jal h ILE 334 Ca 0.22 -1.54 -0.05 0.00 -1.37 0.00 0.00 64.86 62.12 2jal h ILE 334 Cb 0.31 1.80 0.00 0.00 0.47 0.00 0.00 36.82 39.40 2jal h ILE 334 CO -0.34 0.44 -0.16 -0.07 -3.07 0.00 0.00 178.15 174.95 2jal h LEU 335 N 0.04 0.28 0.10 2.19 3.38 -1.33 0.05 115.31 120.03 2jal h LEU 335 Ca 0.00 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.41 2jal h LEU 335 Cb 0.80 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2jal h LEU 335 CO 0.06 0.79 -0.09 0.11 0.09 0.00 0.00 178.44 179.40 2jal h LYS 336 N -0.21 -0.20 -0.90 1.13 1.79 -1.18 -2.81 116.57 114.18 2jal h LYS 336 Ca 0.00 0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.48 2jal h LYS 336 Cb 0.74 0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 31.39 2jal h LYS 336 CO 0.04 -0.14 0.53 -0.22 -1.08 0.00 0.00 179.45 178.58 2jal h LYS 337 N -0.21 1.24 -0.36 3.15 1.63 -0.84 -1.46 116.57 119.72 2jal h LYS 337 Ca 0.00 -0.12 -0.03 0.00 -0.85 0.00 0.00 60.65 59.65 2jal h LYS 337 Cb 0.20 -0.25 -0.02 0.00 -0.60 0.00 0.00 32.23 31.55 2jal h LYS 337 CO -0.02 0.88 0.09 -0.24 -3.45 0.00 0.00 179.45 176.71 2jal h VAL 338 N 1.25 1.17 -0.21 2.00 3.04 -0.88 -0.79 116.25 121.83 2jal h VAL 338 Ca 0.32 -0.59 -0.10 0.00 -1.01 0.00 0.00 66.70 65.31 2jal h VAL 338 Cb -0.02 0.80 -0.00 0.00 -2.01 0.00 0.00 31.29 30.06 2jal h VAL 338 CO -0.06 0.21 -0.27 0.50 -1.01 0.00 0.00 177.57 176.94 2jal h LYS 339 N 0.52 0.56 -0.86 4.17 3.64 -1.12 -1.60 116.57 121.88 2jal h LYS 339 Ca 0.12 -0.32 -0.02 0.00 -1.27 0.00 0.00 60.65 59.16 2jal h LYS 339 Cb 0.20 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.00 2jal h LYS 339 CO -0.00 0.92 0.46 0.93 -2.27 0.00 0.00 179.45 179.48 2jal h GLU 340 N 0.25 1.21 0.02 1.90 5.08 -0.92 -2.19 114.58 119.92 2jal h GLU 340 Ca 0.03 -0.15 -0.11 0.00 -1.00 0.00 0.00 59.36 58.12 2jal h GLU 340 Cb 0.84 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 2jal h GLU 340 CO 0.07 0.89 -0.60 0.93 -1.00 0.00 0.00 179.01 179.30 2jal h GLU 341 N 1.21 0.05 0.00 2.33 5.08 -1.12 -3.42 114.58 118.70 2jal h GLU 341 Ca 0.30 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2jal h GLU 341 Cb 0.05 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2jal h GLU 341 CO -0.05 1.04 -0.50 0.66 -1.00 0.00 0.00 179.01 179.17 2jal n TYR 342 N -4.45 0.00 -3.87 4.33 4.01 -0.65 -5.05 117.16 111.48 2jal n TYR 342 Ca -0.19 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.20 2jal n TYR 342 Cb 0.61 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.66 2jal n TYR 342 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2jal n ASN 343 N -1.20 -3.89 -4.77 7.72 5.15 -0.82 -4.91 115.26 112.54 2jal n ASN 343 Ca 0.00 -1.11 -0.38 0.00 -0.60 0.00 0.00 54.58 52.48 2jal n ASN 343 Cb 0.00 -2.73 -0.02 0.00 -0.53 0.00 0.00 39.78 36.50 2jal n ASN 343 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2jal s PRO 344 N -6.58 4.02 0.34 1.20 0.04 -1.26 -4.94 135.00 127.82 2jal s PRO 344 Ca 0.39 1.84 0.03 0.00 0.04 0.00 0.00 61.00 63.29 2jal s PRO 344 Cb -0.17 -2.65 0.62 0.00 0.04 0.00 0.00 34.50 32.35 2jal s PRO 344 CO 0.91 -0.35 1.96 -1.00 0.04 0.00 0.00 177.00 178.56 2jal h PRO 345 N 2.57 0.87 -3.62 0.56 0.13 -1.91 -3.43 132.00 127.18 2jal h PRO 345 Ca -0.49 -0.05 -0.23 0.00 -0.87 0.00 0.00 66.00 64.36 2jal h PRO 345 Cb 1.24 -0.20 -0.29 0.00 0.13 0.00 0.00 31.00 31.88 2jal h PRO 345 CO 0.62 0.58 -0.69 -1.21 -0.23 0.00 0.00 178.00 177.07 2jal s GLU 346 N -5.78 0.03 0.06 0.86 2.02 -1.25 -4.83 118.70 109.81 2jal s GLU 346 Ca -0.10 0.08 0.09 0.00 0.02 0.00 0.00 54.97 55.06 2jal s GLU 346 Cb 0.19 -0.03 -0.03 0.00 0.10 0.00 0.00 34.13 34.36 2jal s GLU 346 CO 0.78 -0.04 -0.25 0.08 0.02 0.00 0.00 175.26 175.85 2jal s VAL 347 N 0.23 2.06 0.12 2.63 1.01 -0.81 -1.94 120.40 123.70 2jal s VAL 347 Ca -0.02 -1.41 0.07 0.00 0.00 0.00 0.00 61.98 60.62 2jal s VAL 347 Cb -0.03 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 2jal s VAL 347 CO -0.01 0.29 -0.18 -0.31 0.00 0.00 0.00 175.10 174.89 2jal s TYR 348 N -0.85 1.64 -0.45 5.22 1.51 -0.71 -0.08 117.35 123.63 2jal s TYR 348 Ca 0.11 -0.47 -0.21 0.00 -1.01 0.00 0.00 57.07 55.49 2jal s TYR 348 Cb -0.10 -0.86 0.03 0.00 -0.11 0.00 0.00 41.96 40.92 2jal s TYR 348 CO 0.03 0.21 0.68 0.42 -1.11 0.00 0.00 175.55 175.78 2jal s ILE 349 N -1.70 4.77 -1.22 2.71 -1.09 -0.58 -0.28 121.20 123.82 2jal s ILE 349 Ca 0.09 0.11 0.25 0.00 -2.23 0.00 0.00 60.65 58.87 2jal s ILE 349 Cb -0.07 -4.26 0.04 0.00 -1.58 0.00 0.00 42.46 36.59 2jal s ILE 349 CO 0.04 -0.67 1.39 0.35 -1.23 0.00 0.00 174.94 174.82 2jal n THR 350 N 5.90 0.00 -3.49 2.92 -2.24 -0.17 -0.44 114.28 116.76 2jal n THR 350 Ca -0.01 -0.04 0.01 0.00 -2.27 0.00 0.00 64.05 61.73 2jal n THR 350 Cb 0.48 0.40 -0.04 0.00 -2.10 0.00 0.00 70.33 69.07 2jal n THR 350 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2jal s GLU 351 N -2.86 0.46 -0.16 -0.78 2.12 -1.22 -4.71 118.70 111.54 2jal s GLU 351 Ca 0.14 1.10 -0.12 0.00 0.36 0.00 0.00 54.97 56.46 2jal s GLU 351 Cb 0.18 0.66 0.05 0.00 0.26 0.00 0.00 34.13 35.28 2jal s GLU 351 CO 0.67 -0.20 0.40 1.21 -0.54 0.00 0.00 175.26 176.79 2jal s ASN 352 N 2.74 -0.46 0.00 -1.70 3.84 -0.74 -2.08 114.94 116.55 2jal s ASN 352 Ca -0.02 0.83 0.00 0.00 0.21 0.00 0.00 52.86 53.89 2jal s ASN 352 Cb -0.10 0.78 0.00 0.00 -0.55 0.00 0.00 41.25 41.38 2jal s ASN 352 CO -0.18 -0.16 0.00 0.61 -2.79 0.00 0.00 177.10 174.57 2jal n GLY 353 N 3.54 0.11 3.16 1.21 0.00 -1.26 0.28 105.19 112.22 2jal n GLY 353 Ca -0.18 -0.92 -0.11 0.00 0.00 0.00 0.00 46.02 44.82 2jal n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jal s ALA 354 N -2.00 -0.34 -0.16 4.61 0.00 -1.26 -4.87 121.76 117.75 2jal s ALA 354 Ca 0.00 -0.24 -0.07 0.00 0.00 0.00 0.00 51.96 51.65 2jal s ALA 354 Cb 0.00 0.21 -0.04 0.00 0.00 0.00 0.00 23.12 23.29 2jal s ALA 354 CO 0.00 -0.31 0.09 0.00 0.00 0.00 0.00 175.76 175.54 2jal s ALA 355 N -2.16 3.57 0.13 0.00 0.00 -1.26 -4.34 121.76 117.70 2jal s ALA 355 Ca -0.08 -0.71 -0.03 0.00 0.00 0.00 0.00 51.96 51.14 2jal s ALA 355 Cb -0.03 -1.92 -0.03 0.00 0.00 0.00 0.00 23.12 21.13 2jal s ALA 355 CO -0.02 0.35 0.09 -0.06 0.00 0.00 0.00 175.76 176.12 2jal s PHE 356 N -0.16 0.73 0.00 0.00 0.08 -1.17 -1.15 117.98 116.30 2jal s PHE 356 Ca 0.08 -1.12 0.00 0.00 0.12 0.00 0.00 56.93 56.02 2jal s PHE 356 Cb -0.12 -0.39 0.00 0.00 -0.57 0.00 0.00 43.02 41.95 2jal s PHE 356 CO 0.01 -0.54 1.11 -0.25 -0.10 0.00 0.00 175.22 175.45 2jal n ASP 357 N -0.09 3.08 -2.85 1.36 8.00 -1.26 -4.44 116.55 120.35 2jal n ASP 357 Ca -0.07 -1.75 -0.41 0.00 0.71 0.00 0.00 54.79 53.27 2jal n ASP 357 Cb 0.63 -0.61 -0.06 0.00 -0.02 0.00 0.00 41.12 41.06 2jal n ASP 357 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2jal n ASP 358 N 1.19 0.71 -4.47 -2.24 8.00 -1.26 -4.97 116.55 113.51 2jal n ASP 358 Ca 0.00 0.69 -0.31 0.00 0.71 0.00 0.00 54.79 55.88 2jal n ASP 358 Cb 0.36 -0.53 -0.12 0.00 -0.02 0.00 0.00 41.12 40.80 2jal n ASP 358 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2jal s VAL 359 N 1.99 2.86 -0.22 2.53 -7.23 -1.26 -5.09 120.40 113.98 2jal s VAL 359 Ca 0.64 -1.18 -0.29 0.00 -1.81 0.00 0.00 61.98 59.35 2jal s VAL 359 Cb -0.91 -2.22 -0.02 0.00 0.56 0.00 0.00 36.38 33.80 2jal s VAL 359 CO 0.49 0.32 1.47 -0.69 -0.31 0.00 0.00 175.10 176.38 2jal s VAL 360 N -0.95 3.92 0.62 1.32 1.01 -1.26 -4.37 120.40 120.69 2jal s VAL 360 Ca 0.15 1.05 -0.13 0.00 0.00 0.00 0.00 61.98 63.05 2jal s VAL 360 Cb -0.11 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.37 2jal s VAL 360 CO 0.06 -0.30 1.04 -0.44 0.00 0.00 0.00 175.10 175.45 2jal s SER 361 N 3.35 5.92 0.36 3.32 0.01 0.33 -4.92 113.70 122.06 2jal s SER 361 Ca 0.64 1.61 0.16 0.00 1.31 0.00 0.00 55.95 59.68 2jal s SER 361 Cb -0.23 -2.50 1.07 0.00 0.21 0.00 0.00 66.02 64.58 2jal s SER 361 CO 0.25 -1.08 1.71 -0.33 0.41 0.00 0.00 173.24 174.20 2jal h GLU 362 N -0.02 0.38 0.00 12.44 5.08 -1.95 0.25 114.58 130.76 2jal h GLU 362 Ca -0.45 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2jal h GLU 362 Cb 1.20 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2jal h GLU 362 CO 0.59 0.25 0.00 -0.40 -1.00 0.00 0.00 179.01 178.45 2jal n ASP 363 N -4.85 0.00 0.00 1.42 5.68 -1.26 -4.86 116.55 112.68 2jal n ASP 363 Ca 0.29 -0.22 0.00 0.00 -0.50 0.00 0.00 54.79 54.36 2jal n ASP 363 Cb 0.94 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.81 2jal n ASP 363 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jal n GLY 364 N -0.20 0.92 4.02 6.12 0.00 0.87 -5.04 105.19 111.88 2jal n GLY 364 Ca 0.08 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 2jal n GLY 364 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jal s ARG 365 N -0.32 2.39 -0.29 1.61 3.00 -1.25 -4.86 118.95 119.23 2jal s ARG 365 Ca 0.00 -1.61 0.02 0.00 -1.00 0.00 0.00 55.73 53.14 2jal s ARG 365 Cb 0.00 -2.61 0.08 0.00 0.00 0.00 0.00 34.95 32.42 2jal s ARG 365 CO 0.00 -0.73 -0.00 0.08 0.00 0.00 0.00 175.30 174.65 2jal s VAL 366 N -2.62 1.74 -0.68 7.11 1.01 -1.26 -0.52 120.40 125.18 2jal s VAL 366 Ca 0.58 -1.67 -0.25 0.00 0.00 0.00 0.00 61.98 60.64 2jal s VAL 366 Cb -0.06 -2.13 0.05 0.00 0.00 0.00 0.00 36.38 34.24 2jal s VAL 366 CO 0.36 -0.35 1.11 -1.00 0.00 0.00 0.00 175.10 175.22 2jal s HIS 367 N 1.23 2.51 -0.74 5.22 3.76 -1.26 -2.49 115.29 123.52 2jal s HIS 367 Ca 0.02 -0.23 0.04 0.00 -0.15 0.00 0.00 55.06 54.73 2jal s HIS 367 Cb -0.19 -4.43 0.24 0.00 1.11 0.00 0.00 32.58 29.31 2jal s HIS 367 CO -0.10 -1.81 0.80 -0.40 -0.85 0.00 0.00 174.74 172.38 2jal n ASP 368 N 8.46 4.03 0.19 1.40 5.68 -1.26 -4.84 116.55 130.22 2jal n ASP 368 Ca 0.00 -3.37 0.03 0.00 -0.50 0.00 0.00 54.79 50.95 2jal n ASP 368 Cb 0.47 -0.80 0.38 0.00 -1.14 0.00 0.00 41.12 40.03 2jal n ASP 368 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 2jal h GLN 369 N 4.73 0.01 -0.12 0.11 5.75 -1.99 -2.42 115.11 121.19 2jal h GLN 369 Ca 0.19 -0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.72 2jal h GLN 369 Cb 0.69 -0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.19 2jal h GLN 369 CO 0.88 0.35 -0.14 -0.91 -2.65 0.00 0.00 178.83 176.36 2jal h ASN 370 N 0.01 -0.44 -0.13 -0.69 2.35 -2.00 -0.27 115.58 114.41 2jal h ASN 370 Ca -0.00 0.08 -0.18 0.00 -0.55 0.00 0.00 56.30 55.65 2jal h ASN 370 Cb 0.60 0.21 -0.00 0.00 0.05 0.00 0.00 38.32 39.18 2jal h ASN 370 CO 0.04 -0.19 -0.60 -0.09 -1.65 0.00 0.00 177.43 174.95 2jal h ARG 371 N -0.18 0.73 -0.50 0.81 2.43 -1.94 -2.18 114.38 113.55 2jal h ARG 371 Ca 0.09 -0.49 0.03 0.00 -0.81 0.00 0.00 59.98 58.80 2jal h ARG 371 Cb 0.31 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.89 2jal h ARG 371 CO -0.23 1.12 0.27 0.82 -1.51 0.00 0.00 179.97 180.44 2jal h ILE 372 N 0.55 1.00 -0.44 1.20 2.04 -1.25 -0.71 117.51 119.90 2jal h ILE 372 Ca -0.00 -0.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 2jal h ILE 372 Cb 1.19 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 2jal h ILE 372 CO 0.12 0.10 0.14 0.44 0.00 0.00 0.00 178.15 178.95 2jal h ASP 373 N 0.54 0.63 0.21 1.72 3.32 -1.01 -1.82 116.42 120.01 2jal h ASP 373 Ca 0.21 -0.20 0.01 0.00 0.02 0.00 0.00 57.03 57.07 2jal h ASP 373 Cb 0.08 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.42 2jal h ASP 373 CO -0.12 0.66 -0.47 0.22 -1.72 0.00 0.00 179.24 177.81 2jal h TYR 374 N 0.56 -1.32 -0.77 4.55 5.03 -0.70 -1.47 116.97 122.85 2jal h TYR 374 Ca 0.14 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.45 2jal h TYR 374 Cb 0.25 0.55 -0.04 0.00 1.55 0.00 0.00 36.73 39.04 2jal h TYR 374 CO 0.01 -0.57 0.36 -0.07 -1.32 0.00 0.00 178.16 176.56 2jal h LEU 375 N -0.76 1.01 -0.46 2.82 3.38 -1.15 -2.52 115.31 117.62 2jal h LEU 375 Ca -0.00 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 57.87 2jal h LEU 375 Cb 0.75 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 2jal h LEU 375 CO -0.21 0.86 0.25 0.11 0.09 0.00 0.00 178.44 179.54 2jal h LYS 376 N 1.10 0.49 -0.50 1.13 1.79 -1.04 -0.89 116.57 118.65 2jal h LYS 376 Ca 0.26 -0.03 -0.10 0.00 -2.18 0.00 0.00 60.65 58.60 2jal h LYS 376 Cb 0.13 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 30.65 2jal h LYS 376 CO -0.03 0.32 -0.11 0.00 -1.08 0.00 0.00 179.45 178.55 2jal h ALA 377 N 1.23 0.87 0.01 3.86 0.00 -0.95 -2.30 119.26 121.98 2jal h ALA 377 Ca 0.19 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 2jal h ALA 377 Cb 0.07 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2jal h ALA 377 CO -0.12 0.64 -0.00 0.45 0.00 0.00 0.00 179.25 180.22 2jal h HIS 378 N 0.82 -0.01 -0.76 0.00 -0.00 -1.20 -2.61 115.15 111.39 2jal h HIS 378 Ca 0.13 -0.00 0.12 0.00 -0.00 0.00 0.00 60.37 60.62 2jal h HIS 378 Cb 0.64 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 28.00 2jal h HIS 378 CO 0.04 0.58 0.50 0.82 -0.00 0.00 0.00 177.93 179.87 2jal h ILE 379 N -0.60 0.87 -0.51 2.45 2.04 -1.23 -1.08 117.51 119.44 2jal h ILE 379 Ca -0.00 -0.19 -0.10 0.00 1.00 0.00 0.00 64.86 65.57 2jal h ILE 379 Cb 0.59 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 2jal h ILE 379 CO 0.00 0.10 -0.08 1.23 0.00 0.00 0.00 178.15 179.40 2jal h GLY 380 N 0.56 1.01 1.95 5.37 0.00 -1.35 -0.42 103.07 110.18 2jal h GLY 380 Ca 0.36 -0.77 -0.12 0.00 0.00 0.00 0.00 47.33 46.81 2jal h GLY 380 CO -0.13 0.70 -0.55 1.46 0.00 0.00 0.00 176.54 178.02 2jal h GLN 381 N 0.84 0.05 -0.07 4.80 1.08 -0.95 -2.19 115.11 118.68 2jal h GLN 381 Ca 0.14 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.29 2jal h GLN 381 Cb 0.61 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.04 2jal h GLN 381 CO 0.04 0.59 -0.02 0.00 -0.95 0.00 0.00 178.83 178.49 2jal h ALA 382 N 1.40 0.09 -0.66 3.87 0.00 -1.01 -1.27 119.26 121.69 2jal h ALA 382 Ca -0.00 -0.22 0.14 0.00 0.00 0.00 0.00 54.91 54.83 2jal h ALA 382 Cb 0.99 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.65 2jal h ALA 382 CO 0.07 -0.18 0.02 2.35 0.00 0.00 0.00 179.25 181.51 2jal h TRP 383 N -0.22 -0.02 -0.87 0.00 7.01 -1.05 -1.88 115.95 118.93 2jal h TRP 383 Ca 0.02 0.05 -0.01 0.00 2.11 0.00 0.00 58.89 61.06 2jal h TRP 383 Cb 0.43 0.11 -0.04 0.00 -2.10 0.00 0.00 29.16 27.56 2jal h TRP 383 CO 0.06 -0.17 0.52 -0.22 -2.79 0.00 0.00 178.44 175.84 2jal h LYS 384 N 0.13 1.19 -0.32 2.65 3.64 -1.12 -2.58 116.57 120.15 2jal h LYS 384 Ca 0.35 -0.11 0.05 0.00 -1.27 0.00 0.00 60.65 59.67 2jal h LYS 384 Cb 0.58 -0.25 -0.05 0.00 -0.41 0.00 0.00 32.23 32.10 2jal h LYS 384 CO -0.56 0.84 0.03 0.00 -2.27 0.00 0.00 179.45 177.49 2jal h ALA 385 N 1.28 0.31 -0.27 5.00 0.00 -0.42 -2.72 119.26 122.44 2jal h ALA 385 Ca 0.31 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.35 2jal h ALA 385 Cb -0.04 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 2jal h ALA 385 CO -0.06 -0.38 -0.05 0.82 0.00 0.00 0.00 179.25 179.59 2jal h ILE 386 N 0.13 0.75 -0.84 0.00 2.04 -1.12 -2.11 117.51 116.36 2jal h ILE 386 Ca 0.15 -0.01 0.21 0.00 1.00 0.00 0.00 64.86 66.21 2jal h ILE 386 Cb 0.19 0.73 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 2jal h ILE 386 CO -0.23 0.00 0.57 1.56 0.00 0.00 0.00 178.15 180.06 2jal h GLN 387 N 0.02 0.24 -0.70 2.37 1.08 -1.17 0.53 115.11 117.48 2jal h GLN 387 Ca 0.13 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.32 2jal h GLN 387 Cb 0.19 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 2jal h GLN 387 CO -0.26 0.16 0.00 0.39 -0.95 0.00 0.00 178.83 178.17 2jal n GLU 388 N -4.43 3.27 -0.23 1.46 1.02 -0.82 -4.93 120.64 115.98 2jal n GLU 388 Ca 0.17 -1.95 0.00 0.00 -0.02 0.00 0.00 57.16 55.37 2jal n GLU 388 Cb 0.74 -1.90 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 2jal n GLU 388 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jal n GLY 389 N 0.52 0.71 3.70 0.62 0.00 0.18 -5.06 105.19 105.86 2jal n GLY 389 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2jal n GLY 389 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jal s VAL 390 N -2.30 3.57 -0.29 1.61 1.01 -1.04 -4.90 120.40 118.06 2jal s VAL 390 Ca 0.00 1.04 -0.05 0.00 0.00 0.00 0.00 61.98 62.96 2jal s VAL 390 Cb 0.00 -3.67 -0.18 0.00 0.00 0.00 0.00 36.38 32.53 2jal s VAL 390 CO 0.00 0.03 2.89 -0.81 0.00 0.00 0.00 175.10 177.21 2jal n PRO 391 N 4.81 1.89 -1.97 2.72 -0.04 -1.26 -4.30 135.00 136.85 2jal n PRO 391 Ca 0.12 -1.03 -0.42 0.00 -0.04 0.00 0.00 63.50 62.13 2jal n PRO 391 Cb 0.43 -2.06 -0.03 0.00 -0.04 0.00 0.00 33.50 31.80 2jal n PRO 391 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2jal s LEU 392 N 0.03 4.33 -0.01 1.53 2.96 -1.26 -1.93 118.68 124.33 2jal s LEU 392 Ca 0.54 2.28 0.17 0.00 -0.22 0.00 0.00 54.13 56.90 2jal s LEU 392 Cb 0.23 -3.53 -0.22 0.00 0.50 0.00 0.00 46.19 43.17 2jal s LEU 392 CO -0.01 -0.95 0.60 0.29 -1.32 0.00 0.00 176.35 174.96 2jal n LYS 393 N 7.20 1.04 -3.62 1.98 4.76 0.89 -4.95 118.16 125.45 2jal n LYS 393 Ca 0.18 -0.06 -0.03 0.00 -2.87 0.00 0.00 58.31 55.53 2jal n LYS 393 Cb 0.43 -1.35 -0.01 0.00 -1.84 0.00 0.00 35.03 32.25 2jal n LYS 393 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2jal s GLY 394 N -3.15 -0.35 -0.13 0.72 0.00 -1.26 -1.83 107.32 101.33 2jal s GLY 394 Ca 0.02 0.85 -0.06 0.00 0.00 0.00 0.00 44.72 45.52 2jal s GLY 394 CO 0.72 0.23 0.30 -0.47 0.00 0.00 0.00 173.10 173.88 2jal s TYR 395 N -2.74 -0.46 -0.15 1.90 6.14 -0.19 -1.53 117.35 120.31 2jal s TYR 395 Ca 0.11 1.02 0.02 0.00 0.64 0.00 0.00 57.07 58.86 2jal s TYR 395 Cb 0.01 0.10 0.01 0.00 0.42 0.00 0.00 41.96 42.50 2jal s TYR 395 CO -0.04 -0.31 -0.21 -0.06 0.64 0.00 0.00 175.55 175.57 2jal s PHE 396 N 1.74 2.71 0.04 4.97 0.40 0.42 -0.10 117.98 128.15 2jal s PHE 396 Ca -0.06 -1.41 -0.30 0.00 -0.60 0.00 0.00 56.93 54.56 2jal s PHE 396 Cb -0.11 -1.85 -0.04 0.00 0.51 0.00 0.00 43.02 41.53 2jal s PHE 396 CO -0.10 -0.66 0.97 0.08 0.70 0.00 0.00 175.22 176.21 2jal s VAL 397 N 0.95 4.75 -0.31 -0.44 1.01 -0.89 -1.78 120.40 123.68 2jal s VAL 397 Ca -0.03 2.06 -0.12 0.00 0.00 0.00 0.00 61.98 63.88 2jal s VAL 397 Cb -0.15 -4.32 -0.03 0.00 0.00 0.00 0.00 36.38 31.88 2jal s VAL 397 CO -0.05 0.21 0.23 0.86 0.00 0.00 0.00 175.10 176.35 2jal s TRP 398 N 0.67 3.22 0.23 5.22 -0.11 0.14 -1.59 118.94 126.72 2jal s TRP 398 Ca 0.50 -0.05 0.01 0.00 1.22 0.00 0.00 56.10 57.78 2jal s TRP 398 Cb -0.22 -2.45 -0.05 0.00 -1.50 0.00 0.00 33.47 29.25 2jal s TRP 398 CO 0.29 -0.28 0.09 0.45 -4.62 0.00 0.00 176.95 172.87 2jal s SER 399 N 1.74 0.96 0.11 5.86 0.15 -1.03 -3.98 113.70 117.51 2jal s SER 399 Ca 0.07 -1.35 -0.23 0.00 0.70 0.00 0.00 55.95 55.14 2jal s SER 399 Cb -0.17 0.20 -0.08 0.00 -1.71 0.00 0.00 66.02 64.26 2jal s SER 399 CO 0.11 -0.73 1.70 0.25 1.20 0.00 0.00 173.24 175.77 2jal h LEU 400 N 2.49 -0.29 -8.93 3.45 5.85 -1.72 -1.39 115.31 114.78 2jal h LEU 400 Ca -0.37 0.05 -0.69 0.00 0.84 0.00 0.00 57.88 57.70 2jal h LEU 400 Cb 1.24 0.13 -0.23 0.00 0.37 0.00 0.00 40.66 42.17 2jal h LEU 400 CO 0.60 -0.14 -0.80 -0.76 -0.34 0.00 0.00 178.44 177.00 2jal s LEU 401 N -10.30 2.63 0.41 2.25 1.43 -1.26 -0.48 118.68 113.36 2jal s LEU 401 Ca -0.14 -0.35 -0.23 0.00 -1.03 0.00 0.00 54.13 52.38 2jal s LEU 401 Cb 0.08 -1.54 -0.13 0.00 0.03 0.00 0.00 46.19 44.64 2jal s LEU 401 CO 0.67 0.29 0.62 0.47 0.23 0.00 0.00 176.35 178.62 2jal n ASP 402 N 1.82 -0.56 -1.94 2.29 8.00 -0.81 -4.06 116.55 121.30 2jal n ASP 402 Ca -0.16 0.94 -0.04 0.00 0.71 0.00 0.00 54.79 56.24 2jal n ASP 402 Cb 0.52 -1.14 0.01 0.00 -0.02 0.00 0.00 41.12 40.49 2jal n ASP 402 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2jal n ASN 403 N 1.21 -1.05 -4.56 -2.24 0.23 -1.26 -4.83 115.26 102.76 2jal n ASN 403 Ca 0.11 -1.69 -0.40 0.00 -0.53 0.00 0.00 54.58 52.08 2jal n ASN 403 Cb 0.39 1.75 -0.03 0.00 -2.08 0.00 0.00 39.78 39.80 2jal n ASN 403 CO 0.00 0.00 0.00 0.12 -0.93 0.00 0.00 177.26 176.45 2jal s PHE 404 N -5.26 1.76 -0.04 -2.53 5.36 -0.12 -4.59 117.98 112.57 2jal s PHE 404 Ca 0.09 0.72 -0.06 0.00 -0.96 0.00 0.00 56.93 56.72 2jal s PHE 404 Cb -0.02 -4.13 -0.24 0.00 -0.34 0.00 0.00 43.02 38.29 2jal s PHE 404 CO 0.05 -2.38 3.53 -1.91 -1.46 0.00 0.00 175.22 173.05 2jal n GLU 405 N 8.99 2.01 0.00 10.12 4.07 -0.18 -4.66 120.64 140.99 2jal n GLU 405 Ca 0.20 -1.09 0.00 0.00 -0.06 0.00 0.00 57.16 56.21 2jal n GLU 405 Cb 0.51 -1.99 0.00 0.00 -0.06 0.00 0.00 31.44 29.90 2jal n GLU 405 CO 0.00 0.00 0.00 0.91 -0.06 0.00 0.00 177.13 177.98 2jal n TRP 406 N 2.35 0.00 0.29 4.31 5.03 -1.26 -1.37 117.44 126.79 2jal n TRP 406 Ca 0.43 0.00 0.14 0.00 3.03 0.00 0.00 57.50 61.09 2jal n TRP 406 Cb 0.88 0.00 0.65 0.00 -1.03 0.00 0.00 31.31 31.81 2jal n TRP 406 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 2jal h ALA 407 N -0.99 1.00 0.00 6.99 0.00 -1.86 -1.92 119.26 122.49 2jal h ALA 407 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jal h ALA 407 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2jal h ALA 407 CO 0.00 0.00 -0.25 0.39 0.00 0.00 0.00 179.25 179.39 2jal n GLU 408 N -2.48 0.15 0.00 0.00 -0.58 -0.47 -1.21 120.64 116.05 2jal n GLU 408 Ca 0.00 0.08 0.00 0.00 -0.42 0.00 0.00 57.16 56.82 2jal n GLU 408 Cb 0.15 -1.63 0.00 0.00 -0.57 0.00 0.00 31.44 29.39 2jal n GLU 408 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jal n GLY 409 N 1.40 1.71 0.14 0.62 0.00 -0.72 -3.19 105.19 105.15 2jal n GLY 409 Ca 0.05 -0.55 0.13 0.00 0.00 0.00 0.00 46.02 45.65 2jal n GLY 409 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2jal n TYR 410 N 6.25 0.03 0.36 1.61 4.01 -1.26 -1.01 117.16 127.15 2jal n TYR 410 Ca 0.00 -0.01 0.14 0.00 -0.16 0.00 0.00 57.90 57.87 2jal n TYR 410 Cb 0.00 0.00 0.54 0.00 -0.31 0.00 0.00 39.34 39.57 2jal n TYR 410 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2jal h SER 411 N 0.62 0.00 -3.12 7.72 4.64 -1.87 -3.42 113.55 118.13 2jal h SER 411 Ca 0.00 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.65 2jal h SER 411 Cb 0.13 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 61.88 2jal h SER 411 CO 0.00 0.00 -0.86 -0.54 -0.87 0.00 0.00 176.83 174.56 2jal s LYS 412 N -3.43 3.00 -0.28 4.77 -0.14 -1.26 -5.05 119.74 117.34 2jal s LYS 412 Ca 0.04 -0.84 -0.06 0.00 -1.36 0.00 0.00 55.97 53.74 2jal s LYS 412 Cb 0.09 -2.51 0.00 0.00 -1.68 0.00 0.00 37.83 33.73 2jal s LYS 412 CO 0.48 -0.13 0.07 1.03 -0.76 0.00 0.00 175.35 176.03 2jal s ARG 413 N 1.10 3.16 -0.00 1.68 0.52 -1.26 -4.57 118.95 119.58 2jal s ARG 413 Ca 0.00 -0.81 0.13 0.00 -0.52 0.00 0.00 55.73 54.54 2jal s ARG 413 Cb -0.14 -3.33 -0.15 0.00 0.52 0.00 0.00 34.95 31.85 2jal s ARG 413 CO -0.09 -0.40 0.54 1.19 0.02 0.00 0.00 175.30 176.57 2jal n PHE 414 N 4.86 0.00 -0.82 -0.53 3.01 -1.26 -3.05 117.46 119.67 2jal n PHE 414 Ca -0.15 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.01 2jal n PHE 414 Cb 0.48 -0.02 0.18 0.00 -0.01 0.00 0.00 39.48 40.11 2jal n PHE 414 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2jal s GLY 415 N -2.36 1.62 -0.00 1.37 0.00 -1.26 -2.45 107.32 104.24 2jal s GLY 415 Ca 0.04 0.16 0.15 0.00 0.00 0.00 0.00 44.72 45.08 2jal s GLY 415 CO 0.55 0.70 0.60 0.29 0.00 0.00 0.00 173.10 175.23 2jal n ILE 416 N -4.33 0.00 -4.31 0.90 -5.35 -0.52 -4.78 119.36 100.97 2jal n ILE 416 Ca 0.07 -0.17 -0.34 0.00 -0.27 0.00 0.00 62.75 62.04 2jal n ILE 416 Cb 0.54 0.88 -0.13 0.00 -1.74 0.00 0.00 39.64 39.19 2jal n ILE 416 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2jal s VAL 417 N -2.52 3.69 0.29 7.28 1.01 0.36 -0.06 120.40 130.47 2jal s VAL 417 Ca 0.04 -0.42 -0.25 0.00 0.00 0.00 0.00 61.98 61.35 2jal s VAL 417 Cb 0.11 -2.63 -0.09 0.00 0.00 0.00 0.00 36.38 33.77 2jal s VAL 417 CO 0.62 0.47 0.89 -0.47 0.00 0.00 0.00 175.10 176.62 2jal s TYR 418 N 0.68 3.72 -0.11 5.22 6.14 0.19 -1.93 117.35 131.26 2jal s TYR 418 Ca -0.02 1.71 0.01 0.00 0.64 0.00 0.00 57.07 59.41 2jal s TYR 418 Cb -0.15 -2.86 0.02 0.00 0.42 0.00 0.00 41.96 39.39 2jal s TYR 418 CO 0.02 0.27 -0.14 0.08 0.64 0.00 0.00 175.55 176.43 2jal s VAL 419 N -1.54 1.41 -0.55 3.14 1.01 -1.26 -0.73 120.40 121.87 2jal s VAL 419 Ca 0.47 -0.58 -0.19 0.00 0.00 0.00 0.00 61.98 61.68 2jal s VAL 419 Cb -0.19 -1.31 0.08 0.00 0.00 0.00 0.00 36.38 34.96 2jal s VAL 419 CO 0.24 0.42 0.69 -0.62 0.00 0.00 0.00 175.10 175.83 2jal s ASP 420 N 1.10 6.20 0.54 3.32 -1.08 -0.52 -4.93 116.67 121.30 2jal s ASP 420 Ca -0.05 -1.15 0.28 0.00 -0.52 0.00 0.00 52.55 51.11 2jal s ASP 420 Cb -0.14 -2.30 1.52 0.00 -1.46 0.00 0.00 42.92 40.53 2jal s ASP 420 CO -0.03 -1.03 2.11 1.88 0.52 0.00 0.00 175.17 178.62 2jal h TYR 421 N 9.12 0.00 -0.22 -5.34 0.05 -1.94 1.45 116.97 120.10 2jal h TYR 421 Ca -0.28 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.37 2jal h TYR 421 Cb 1.09 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.82 2jal h TYR 421 CO 0.80 0.09 -0.40 0.66 -1.05 0.00 0.00 178.16 178.26 2jal h SER 422 N 0.00 0.54 0.00 3.88 4.64 -1.99 -3.35 113.55 117.27 2jal h SER 422 Ca -0.00 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 2jal h SER 422 Cb 0.26 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2jal h SER 422 CO 0.01 0.88 -0.88 0.35 -0.87 0.00 0.00 176.83 176.33 2jal n THR 423 N -4.03 0.00 -1.39 2.95 -2.24 -0.50 -5.00 114.28 104.07 2jal n THR 423 Ca -0.02 -0.25 -0.14 0.00 -2.27 0.00 0.00 64.05 61.38 2jal n THR 423 Cb 0.51 0.66 -0.06 0.00 -2.10 0.00 0.00 70.33 69.34 2jal n THR 423 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jal n GLN 424 N -1.49 -1.23 -2.34 -0.78 1.13 0.49 -4.98 117.38 108.18 2jal n GLN 424 Ca 0.00 0.96 -0.42 0.00 -1.94 0.00 0.00 57.00 55.60 2jal n GLN 424 Cb 0.17 -5.16 -0.03 0.00 0.11 0.00 0.00 30.24 25.34 2jal n GLN 424 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2jal s LYS 425 N -3.07 4.37 0.01 -1.09 3.01 -1.19 -4.80 119.74 116.98 2jal s LYS 425 Ca 0.00 1.85 -0.23 0.00 -1.01 0.00 0.00 55.97 56.58 2jal s LYS 425 Cb 0.00 -3.42 -0.05 0.00 -1.01 0.00 0.00 37.83 33.35 2jal s LYS 425 CO 0.00 -0.39 0.71 1.03 0.51 0.00 0.00 175.35 177.21 2jal s ARG 426 N 1.56 4.44 -0.20 1.68 3.00 -1.26 -1.44 118.95 126.73 2jal s ARG 426 Ca 0.60 0.94 -0.02 0.00 0.00 0.00 0.00 55.73 57.26 2jal s ARG 426 Cb -0.30 -3.37 0.06 0.00 0.00 0.00 0.00 34.95 31.33 2jal s ARG 426 CO 0.27 0.27 0.01 0.42 0.00 0.00 0.00 175.30 176.27 2jal s ILE 427 N 0.04 0.84 0.14 1.52 1.01 0.09 -4.96 121.20 119.88 2jal s ILE 427 Ca 0.36 -0.74 -0.31 0.00 0.00 0.00 0.00 60.65 59.95 2jal s ILE 427 Cb -0.19 -1.26 -0.10 0.00 0.01 0.00 0.00 42.46 40.92 2jal s ILE 427 CO 0.21 -0.16 1.68 -0.69 0.00 0.00 0.00 174.94 175.98 2jal s VAL 428 N 1.71 2.58 0.72 2.92 1.01 -1.26 0.57 120.40 128.65 2jal s VAL 428 Ca -0.02 0.27 -0.10 0.00 0.00 0.00 0.00 61.98 62.13 2jal s VAL 428 Cb -0.17 -3.17 0.04 0.00 0.00 0.00 0.00 36.38 33.08 2jal s VAL 428 CO -0.07 0.01 1.08 -0.54 0.00 0.00 0.00 175.10 175.57 2jal s LYS 429 N 1.90 2.46 0.21 2.72 1.02 0.92 -4.52 119.74 124.44 2jal s LYS 429 Ca 0.75 0.14 -0.09 0.00 0.02 0.00 0.00 55.97 56.79 2jal s LYS 429 Cb -0.45 -2.07 0.16 0.00 -0.52 0.00 0.00 37.83 34.96 2jal s LYS 429 CO 0.33 -1.20 1.82 -0.44 -0.92 0.00 0.00 175.35 174.94 2jal h ASP 430 N -0.70 1.00 -0.98 2.83 3.32 -1.76 -1.06 116.42 119.06 2jal h ASP 430 Ca -0.45 -0.11 0.25 0.00 0.02 0.00 0.00 57.03 56.74 2jal h ASP 430 Cb 1.29 -0.25 -0.07 0.00 0.22 0.00 0.00 39.33 40.52 2jal h ASP 430 CO 0.63 0.82 0.66 0.77 -1.72 0.00 0.00 179.24 180.41 2jal h SER 431 N 1.09 0.27 -0.21 6.45 4.64 -1.86 0.42 113.55 124.36 2jal h SER 431 Ca 0.27 0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.59 2jal h SER 431 Cb 0.06 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 2jal h SER 431 CO -0.04 0.08 -0.03 1.23 -0.87 0.00 0.00 176.83 177.20 2jal h GLY 432 N 0.26 0.41 1.11 -0.77 0.00 -1.29 0.27 103.07 103.05 2jal h GLY 432 Ca 0.51 -0.32 -0.13 0.00 0.00 0.00 0.00 47.33 47.39 2jal h GLY 432 CO -0.15 0.30 -0.18 -0.97 0.00 0.00 0.00 176.54 175.54 2jal h TYR 433 N 0.12 1.16 -0.93 5.60 0.05 -0.88 -0.65 116.97 121.44 2jal h TYR 433 Ca 0.06 -0.27 -0.01 0.00 0.05 0.00 0.00 58.73 58.56 2jal h TYR 433 Cb 0.45 -0.28 -0.04 0.00 1.01 0.00 0.00 36.73 37.87 2jal h TYR 433 CO 0.04 1.10 0.55 2.35 -1.05 0.00 0.00 178.16 181.16 2jal h TRP 434 N 0.89 1.23 0.07 4.88 7.01 -0.18 -2.30 115.95 127.54 2jal h TRP 434 Ca 0.12 -0.01 -0.25 0.00 2.11 0.00 0.00 58.89 60.87 2jal h TRP 434 Cb 0.76 -0.40 -0.00 0.00 -2.10 0.00 0.00 29.16 27.41 2jal h TRP 434 CO 0.05 0.82 -1.10 -0.92 -2.79 0.00 0.00 178.44 174.50 2jal h TYR 435 N 1.28 0.47 -1.00 2.65 3.20 -0.85 -2.68 116.97 120.04 2jal h TYR 435 Ca 0.33 -0.30 0.21 0.00 3.14 0.00 0.00 58.73 62.10 2jal h TYR 435 Cb -0.05 -0.03 -0.11 0.00 1.54 0.00 0.00 36.73 38.08 2jal h TYR 435 CO 0.01 1.19 0.59 1.03 -1.64 0.00 0.00 178.16 179.34 2jal h SER 436 N 0.11 0.73 0.08 -2.11 0.87 -0.85 -1.98 113.55 110.41 2jal h SER 436 Ca -0.10 0.11 -0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2jal h SER 436 Cb 1.79 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.74 2jal h SER 436 CO 0.18 0.21 -0.04 0.78 -0.53 0.00 0.00 176.83 177.43 2jal h ASN 437 N 0.70 -0.09 -0.80 6.23 2.35 -1.26 -2.91 115.58 119.80 2jal h ASN 437 Ca 0.60 -0.26 0.19 0.00 -0.55 0.00 0.00 56.30 56.28 2jal h ASN 437 Cb 0.99 0.02 -0.13 0.00 0.05 0.00 0.00 38.32 39.26 2jal h ASN 437 CO -0.42 0.21 0.18 0.58 -1.65 0.00 0.00 177.43 176.33 2jal h VAL 438 N -0.40 0.41 -0.55 2.81 2.07 -1.10 0.30 116.25 119.79 2jal h VAL 438 Ca -0.01 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 2jal h VAL 438 Cb 0.34 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 2jal h VAL 438 CO 0.02 0.04 0.19 0.58 0.02 0.00 0.00 177.57 178.42 2jal h VAL 439 N 0.23 1.23 0.02 2.57 2.07 -1.41 0.87 116.25 121.83 2jal h VAL 439 Ca 0.47 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 2jal h VAL 439 Cb 0.86 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 2jal h VAL 439 CO -0.59 0.28 -0.01 0.11 0.02 0.00 0.00 177.57 177.38 2jal h LYS 440 N 0.76 -0.03 0.00 1.57 1.57 -0.94 -2.85 116.57 116.64 2jal h LYS 440 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2jal h LYS 440 Cb 0.25 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2jal h LYS 440 CO -0.01 0.35 0.00 0.09 -0.57 0.00 0.00 179.45 179.31 2jal n ASN 441 N -4.92 0.00 -3.99 0.86 5.03 0.92 -4.90 115.26 108.25 2jal n ASN 441 Ca -0.08 -1.31 -0.30 0.00 0.87 0.00 0.00 54.58 53.75 2jal n ASN 441 Cb 0.21 0.00 -0.07 0.00 -1.02 0.00 0.00 39.78 38.89 2jal n ASN 441 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 2jal n ASN 442 N -0.76 -0.30 0.00 6.41 5.15 0.02 -4.76 115.26 121.02 2jal n ASN 442 Ca 0.11 -1.04 0.00 0.00 -0.60 0.00 0.00 54.58 53.05 2jal n ASN 442 Cb 0.05 -1.31 0.00 0.00 -0.53 0.00 0.00 39.78 37.99 2jal n ASN 442 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2jal n GLY 443 N -1.66 -1.39 3.88 8.20 0.00 0.08 -1.29 105.19 113.02 2jal n GLY 443 Ca -0.09 -1.20 -0.36 0.00 0.00 0.00 0.00 46.02 44.37 2jal n GLY 443 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jal s LEU 444 N 0.00 4.39 0.00 0.99 1.02 -0.78 -4.32 118.68 119.98 2jal s LEU 444 Ca 0.00 0.51 0.00 0.00 0.02 0.00 0.00 54.13 54.66 2jal s LEU 444 Cb 0.00 -2.30 0.00 0.00 0.02 0.00 0.00 46.19 43.91 2jal s LEU 444 CO 0.00 0.35 0.00 -0.62 0.02 0.00 0.00 176.35 176.10