#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jad s LYS 3 N 0.00 1.30 2.54 1.43 2.47 -1.26 -4.58 119.74 121.64 2jad s LYS 3 Ca 0.00 -1.34 0.00 0.00 -1.56 0.00 0.00 55.97 53.07 2jad s LYS 3 Cb 0.00 -1.56 0.00 0.00 -1.46 0.00 0.00 37.83 34.81 2jad s LYS 3 CO 0.00 0.35 0.00 0.41 0.16 0.00 0.00 175.35 176.27 2jad n GLY 4 N 0.65 2.42 0.33 5.54 0.00 -0.85 -2.37 105.19 110.90 2jad n GLY 4 Ca -0.16 -0.16 0.18 0.00 0.00 0.00 0.00 46.02 45.88 2jad n GLY 4 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2jad h GLU 5 N 0.00 0.00 -0.50 1.61 4.11 -1.91 -2.32 114.58 115.58 2jad h GLU 5 Ca 0.00 0.00 0.08 0.00 0.07 0.00 0.00 59.36 59.51 2jad h GLU 5 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 2jad h GLU 5 CO 0.00 0.00 0.34 0.93 0.07 0.00 0.00 179.01 180.35 2jad h GLU 6 N 0.00 0.32 0.00 1.06 5.08 -1.84 -0.35 114.58 118.84 2jad h GLU 6 Ca 0.03 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2jad h GLU 6 Cb 0.33 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2jad h GLU 6 CO -0.00 0.21 0.00 1.28 -1.00 0.00 0.00 179.01 179.50 2jad n LEU 7 N -4.47 0.00 -0.27 1.33 4.77 -0.87 -3.06 117.00 114.43 2jad n LEU 7 Ca 0.07 0.46 0.03 0.00 -0.03 0.00 0.00 56.01 56.54 2jad n LEU 7 Cb 0.33 -0.46 0.06 0.00 -2.33 0.00 0.00 43.42 41.01 2jad n LEU 7 CO 0.35 -0.26 0.51 0.49 -1.33 0.00 0.00 177.39 177.14 2jad n PHE 8 N -1.46 0.16 0.01 -1.77 3.01 -0.14 -4.74 117.46 112.53 2jad n PHE 8 Ca 0.04 -0.39 0.13 0.00 1.01 0.00 0.00 57.45 58.24 2jad n PHE 8 Cb 0.14 -0.03 0.58 0.00 -0.01 0.00 0.00 39.48 40.16 2jad n PHE 8 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 2jad h THR 9 N 0.94 0.88 -3.03 4.37 1.35 -1.56 -3.38 112.91 112.47 2jad h THR 9 Ca 0.00 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 2jad h THR 9 Cb 0.52 0.64 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 2jad h THR 9 CO 0.00 0.04 0.00 0.61 -0.25 0.00 0.00 175.52 175.92 2jad n GLY 10 N -1.56 5.85 3.69 5.82 0.00 -1.26 -4.79 105.19 112.95 2jad n GLY 10 Ca 0.07 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 2jad n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jad s VAL 11 N 1.27 4.82 -0.10 1.61 1.01 -1.26 -4.52 120.40 123.22 2jad s VAL 11 Ca 0.00 2.03 0.01 0.00 0.00 0.00 0.00 61.98 64.01 2jad s VAL 11 Cb 0.00 -4.31 -0.02 0.00 0.00 0.00 0.00 36.38 32.05 2jad s VAL 11 CO 0.00 0.05 -0.12 -0.69 0.00 0.00 0.00 175.10 174.35 2jad s VAL 12 N 1.71 3.21 0.37 2.92 1.01 0.82 -4.92 120.40 125.53 2jad s VAL 12 Ca 0.49 -0.63 -0.26 0.00 0.00 0.00 0.00 61.98 61.58 2jad s VAL 12 Cb -0.19 -2.33 -0.09 0.00 0.00 0.00 0.00 36.38 33.78 2jad s VAL 12 CO 0.21 0.55 1.14 -2.84 0.00 0.00 0.00 175.10 174.16 2jad s PRO 13 N -0.10 4.20 0.02 2.72 0.02 -1.26 0.23 135.00 140.82 2jad s PRO 13 Ca -0.01 1.79 0.05 0.00 0.02 0.00 0.00 61.00 62.85 2jad s PRO 13 Cb -0.14 -2.77 -0.02 0.00 0.02 0.00 0.00 34.50 31.60 2jad s PRO 13 CO 0.03 -0.18 -0.16 0.42 -0.33 0.00 0.00 177.00 176.79 2jad s ILE 14 N -1.40 1.23 -0.04 2.83 1.01 -0.65 -1.72 121.20 122.46 2jad s ILE 14 Ca 0.54 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 60.36 2jad s ILE 14 Cb -0.30 -1.06 0.01 0.00 0.01 0.00 0.00 42.46 41.12 2jad s ILE 14 CO 0.38 0.20 -0.09 -0.76 0.00 0.00 0.00 174.94 174.66 2jad s LEU 15 N -0.76 1.68 -0.03 2.97 1.02 -0.52 -2.34 118.68 120.69 2jad s LEU 15 Ca 0.05 -0.20 0.04 0.00 0.02 0.00 0.00 54.13 54.04 2jad s LEU 15 Cb -0.07 -0.59 -0.00 0.00 0.02 0.00 0.00 46.19 45.54 2jad s LEU 15 CO 0.00 0.04 -0.15 -0.69 0.02 0.00 0.00 176.35 175.57 2jad s VAL 16 N 0.41 1.28 -0.04 -1.59 1.01 0.33 -0.33 120.40 121.47 2jad s VAL 16 Ca -0.07 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.27 2jad s VAL 16 Cb -0.11 -1.10 0.02 0.00 0.00 0.00 0.00 36.38 35.19 2jad s VAL 16 CO 0.01 0.37 -0.04 -1.61 0.00 0.00 0.00 175.10 173.84 2jad s GLU 17 N -0.01 0.74 -0.02 2.72 0.41 0.29 -1.01 118.70 121.81 2jad s GLU 17 Ca -0.02 -0.07 0.01 0.00 -0.41 0.00 0.00 54.97 54.48 2jad s GLU 17 Cb -0.10 -0.80 0.02 0.00 -1.78 0.00 0.00 34.13 31.47 2jad s GLU 17 CO 0.01 -0.10 -0.01 -1.17 -0.49 0.00 0.00 175.26 173.49 2jad s LEU 18 N 1.01 1.42 -0.19 1.80 0.20 -0.77 0.11 118.68 122.25 2jad s LEU 18 Ca -0.10 -0.05 -0.00 0.00 0.69 0.00 0.00 54.13 54.67 2jad s LEU 18 Cb -0.14 -0.23 0.01 0.00 -0.43 0.00 0.00 46.19 45.40 2jad s LEU 18 CO -0.01 -0.06 -0.16 -1.81 -0.29 0.00 0.00 176.35 174.03 2jad s ASP 19 N 0.70 3.47 0.09 3.68 1.01 -0.72 -1.19 116.67 123.71 2jad s ASP 19 Ca -0.07 -0.57 0.04 0.00 0.71 0.00 0.00 52.55 52.66 2jad s ASP 19 Cb -0.10 -1.55 -0.03 0.00 1.01 0.00 0.00 42.92 42.24 2jad s ASP 19 CO -0.01 0.01 -0.11 -0.83 0.21 0.00 0.00 175.17 174.44 2jad s GLY 20 N 1.28 0.85 -0.28 0.21 0.00 -0.29 -1.56 107.32 107.53 2jad s GLY 20 Ca 0.04 -1.14 -0.03 0.00 0.00 0.00 0.00 44.72 43.59 2jad s GLY 20 CO -0.09 -1.21 0.19 -0.35 0.00 0.00 0.00 173.10 171.64 2jad s ASP 21 N -2.29 2.70 -0.23 1.64 2.15 -0.51 -1.01 116.67 119.12 2jad s ASP 21 Ca 0.04 -1.00 -0.08 0.00 0.43 0.00 0.00 52.55 51.94 2jad s ASP 21 Cb -0.05 -0.00 -0.03 0.00 -0.30 0.00 0.00 42.92 42.54 2jad s ASP 21 CO 0.01 -0.41 0.08 -0.69 -0.17 0.00 0.00 175.17 173.98 2jad s VAL 22 N 2.21 4.55 -1.65 1.11 1.01 -1.12 -1.02 120.40 125.49 2jad s VAL 22 Ca 0.09 -0.10 -0.17 0.00 0.00 0.00 0.00 61.98 61.79 2jad s VAL 22 Cb -0.15 -3.10 0.14 0.00 0.00 0.00 0.00 36.38 33.27 2jad s VAL 22 CO -0.33 0.37 0.83 0.59 0.00 0.00 0.00 175.10 176.56 2jad n ASN 23 N 4.44 -3.72 0.00 3.32 4.13 0.43 -0.22 115.26 123.65 2jad n ASN 23 Ca -0.16 -0.93 0.00 0.00 1.68 0.00 0.00 54.58 55.17 2jad n ASN 23 Cb 0.52 -3.02 0.00 0.00 -1.54 0.00 0.00 39.78 35.73 2jad n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2jad n GLY 24 N -1.44 2.64 3.50 7.41 0.00 -1.26 -4.98 105.19 111.06 2jad n GLY 24 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2jad n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jad s HIS 25 N -2.20 2.66 0.54 1.61 3.76 0.69 -5.01 115.29 117.35 2jad s HIS 25 Ca 0.00 -0.73 -0.19 0.00 -0.15 0.00 0.00 55.06 53.99 2jad s HIS 25 Cb 0.00 -4.47 -0.06 0.00 1.11 0.00 0.00 32.58 29.16 2jad s HIS 25 CO 0.00 -1.78 1.10 0.15 -0.85 0.00 0.00 174.74 173.36 2jad s LYS 26 N 4.32 3.40 -0.08 1.40 1.02 -1.26 -2.78 119.74 125.77 2jad s LYS 26 Ca 0.34 1.51 -0.31 0.00 0.02 0.00 0.00 55.97 57.53 2jad s LYS 26 Cb -0.08 -2.02 0.12 0.00 -0.52 0.00 0.00 37.83 35.33 2jad s LYS 26 CO 0.01 -0.79 1.04 -0.59 -0.92 0.00 0.00 175.35 174.11 2jad s PHE 27 N -1.91 -0.23 -0.14 3.18 -0.12 -0.18 -4.97 117.98 113.61 2jad s PHE 27 Ca 0.70 0.13 -0.12 0.00 -0.05 0.00 0.00 56.93 57.59 2jad s PHE 27 Cb -0.21 0.53 0.04 0.00 -0.63 0.00 0.00 43.02 42.75 2jad s PHE 27 CO 0.27 -0.40 0.36 -1.54 -0.05 0.00 0.00 175.22 173.86 2jad s SER 28 N -2.40 -0.38 0.15 1.98 1.04 -1.26 -1.13 113.70 111.70 2jad s SER 28 Ca 0.08 0.72 0.11 0.00 0.48 0.00 0.00 55.95 57.34 2jad s SER 28 Cb -0.01 0.72 -0.04 0.00 0.10 0.00 0.00 66.02 66.79 2jad s SER 28 CO -0.06 -0.13 -0.26 -0.69 0.98 0.00 0.00 173.24 173.08 2jad s VAL 29 N 0.30 2.31 0.02 5.02 1.01 -0.33 -1.04 120.40 127.69 2jad s VAL 29 Ca -0.01 -1.84 0.07 0.00 0.00 0.00 0.00 61.98 60.20 2jad s VAL 29 Cb -0.03 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 2jad s VAL 29 CO -0.01 0.02 -0.22 -0.44 0.00 0.00 0.00 175.10 174.45 2jad s SER 30 N -2.27 2.63 0.00 3.32 0.01 -0.01 -1.85 113.70 115.53 2jad s SER 30 Ca 0.16 -0.47 -0.11 0.00 1.31 0.00 0.00 55.95 56.84 2jad s SER 30 Cb -0.09 -0.26 0.01 0.00 0.21 0.00 0.00 66.02 65.89 2jad s SER 30 CO 0.07 0.23 0.21 -0.83 0.41 0.00 0.00 173.24 173.34 2jad s GLY 31 N -0.87 -0.03 0.10 3.44 0.00 -0.18 0.20 107.32 109.97 2jad s GLY 31 Ca 0.09 0.02 -0.05 0.00 0.00 0.00 0.00 44.72 44.78 2jad s GLY 31 CO 0.01 -0.15 0.11 -1.83 0.00 0.00 0.00 173.10 171.24 2jad s GLU 32 N -1.53 0.84 0.00 2.90 -1.05 -0.47 -0.51 118.70 118.87 2jad s GLU 32 Ca -0.13 -1.17 0.00 0.00 -0.15 0.00 0.00 54.97 53.52 2jad s GLU 32 Cb -0.06 0.29 0.00 0.00 -0.44 0.00 0.00 34.13 33.92 2jad s GLU 32 CO 0.02 -0.24 0.00 0.41 0.95 0.00 0.00 175.26 176.40 2jad n GLY 33 N -0.04 -0.70 3.38 -3.83 0.00 -0.99 -0.35 105.19 102.67 2jad n GLY 33 Ca -0.12 -0.42 -0.13 0.00 0.00 0.00 0.00 46.02 45.35 2jad n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2jad s GLU 34 N -0.92 1.05 0.13 1.61 -1.05 -0.47 -1.64 118.70 117.40 2jad s GLU 34 Ca 0.00 -0.30 0.11 0.00 -0.15 0.00 0.00 54.97 54.63 2jad s GLU 34 Cb 0.00 0.48 -0.04 0.00 -0.44 0.00 0.00 34.13 34.13 2jad s GLU 34 CO 0.00 -0.38 -0.26 0.20 0.95 0.00 0.00 175.26 175.76 2jad s GLY 35 N -2.09 1.56 -0.40 -3.83 0.00 0.13 -2.29 107.32 100.39 2jad s GLY 35 Ca -0.04 -1.46 0.06 0.00 0.00 0.00 0.00 44.72 43.28 2jad s GLY 35 CO -0.03 -1.44 0.42 1.34 0.00 0.00 0.00 173.10 173.39 2jad n ASP 36 N 0.91 -0.31 -0.42 1.64 4.64 -0.69 -0.13 116.55 122.19 2jad n ASP 36 Ca -0.18 -2.51 0.39 0.00 -1.38 0.00 0.00 54.79 51.11 2jad n ASP 36 Cb 0.53 -0.53 0.75 0.00 -1.04 0.00 0.00 41.12 40.83 2jad n ASP 36 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2jad h ALA 37 N 4.98 3.22 0.00 -1.67 0.00 -1.74 0.30 119.26 124.35 2jad h ALA 37 Ca 0.19 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2jad h ALA 37 Cb 0.90 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 2jad h ALA 37 CO 0.40 -1.63 -0.08 1.15 0.00 0.00 0.00 179.25 179.09 2jad h THR 38 N 0.03 0.97 -0.06 0.00 2.02 -1.86 -1.99 112.91 112.02 2jad h THR 38 Ca 0.67 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 67.58 2jad h THR 38 Cb 2.58 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 70.14 2jad h THR 38 CO -0.05 0.08 0.00 -1.22 0.37 0.00 0.00 175.52 174.70 2jad n TYR 39 N -4.33 0.07 -3.14 3.16 4.01 -0.01 -4.94 117.16 111.97 2jad n TYR 39 Ca -0.03 -0.12 -0.22 0.00 -0.16 0.00 0.00 57.90 57.38 2jad n TYR 39 Cb 0.16 -0.01 0.05 0.00 -0.31 0.00 0.00 39.34 39.23 2jad n TYR 39 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jad n GLY 40 N 0.37 -0.48 3.88 2.72 0.00 -0.55 -4.79 105.19 106.34 2jad n GLY 40 Ca 0.05 0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2jad n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jad s LYS 41 N -5.82 3.62 -0.06 1.61 1.02 -1.03 -1.61 119.74 117.47 2jad s LYS 41 Ca 0.37 -0.00 -0.02 0.00 0.02 0.00 0.00 55.97 56.33 2jad s LYS 41 Cb -0.16 -3.10 0.04 0.00 -0.52 0.00 0.00 37.83 34.09 2jad s LYS 41 CO 0.45 0.66 0.12 -0.51 -0.92 0.00 0.00 175.35 175.15 2jad s LEU 42 N -1.62 0.71 -0.15 3.17 1.43 -0.63 -1.71 118.68 119.87 2jad s LEU 42 Ca 0.26 0.24 -0.03 0.00 -1.03 0.00 0.00 54.13 53.58 2jad s LEU 42 Cb -0.13 0.25 0.05 0.00 0.03 0.00 0.00 46.19 46.39 2jad s LEU 42 CO 0.15 -0.16 0.03 0.42 0.23 0.00 0.00 176.35 177.02 2jad s THR 43 N 1.28 0.42 0.13 5.49 -4.23 -0.97 -1.78 115.64 115.98 2jad s THR 43 Ca -0.08 -0.32 0.04 0.00 -1.18 0.00 0.00 61.69 60.16 2jad s THR 43 Cb -0.12 -0.84 -0.04 0.00 1.34 0.00 0.00 72.50 72.84 2jad s THR 43 CO -0.05 -0.07 -0.10 -0.76 -0.54 0.00 0.00 174.62 173.09 2jad s LEU 44 N 1.92 2.50 -0.06 4.79 1.43 -0.38 -1.37 118.68 127.51 2jad s LEU 44 Ca 0.01 -0.97 -0.01 0.00 -1.03 0.00 0.00 54.13 52.13 2jad s LEU 44 Cb -0.15 -0.32 0.03 0.00 0.03 0.00 0.00 46.19 45.77 2jad s LEU 44 CO -0.07 -0.32 0.00 -0.75 0.23 0.00 0.00 176.35 175.44 2jad s LYS 45 N -3.54 0.50 0.01 1.70 2.20 0.53 -1.03 119.74 120.10 2jad s LYS 45 Ca 0.14 0.11 0.02 0.00 -0.36 0.00 0.00 55.97 55.88 2jad s LYS 45 Cb 0.02 -0.82 -0.04 0.00 -1.51 0.00 0.00 37.83 35.48 2jad s LYS 45 CO 0.00 -0.25 -0.03 -0.06 -0.36 0.00 0.00 175.35 174.65 2jad s PHE 46 N 1.71 2.98 -0.03 4.03 0.40 0.91 -1.37 117.98 126.62 2jad s PHE 46 Ca 0.01 0.02 0.01 0.00 -0.60 0.00 0.00 56.93 56.36 2jad s PHE 46 Cb -0.13 -1.63 0.02 0.00 0.51 0.00 0.00 43.02 41.79 2jad s PHE 46 CO -0.04 0.42 -0.03 0.42 0.70 0.00 0.00 175.22 176.70 2jad s ILE 47 N -1.06 0.34 -0.19 0.64 1.01 0.13 -1.49 121.20 120.58 2jad s ILE 47 Ca 0.19 -0.05 -0.26 0.00 0.00 0.00 0.00 60.65 60.53 2jad s ILE 47 Cb -0.11 -0.38 -0.01 0.00 0.01 0.00 0.00 42.46 41.97 2jad s ILE 47 CO 0.10 0.16 0.86 0.54 0.00 0.00 0.00 174.94 176.60 2jad s VAL 48 N 0.74 4.85 0.13 2.92 0.11 -0.69 -0.83 120.40 127.62 2jad s VAL 48 Ca -0.08 1.67 0.03 0.00 -2.93 0.00 0.00 61.98 60.67 2jad s VAL 48 Cb -0.12 -4.16 -0.20 0.00 -1.53 0.00 0.00 36.38 30.38 2jad s VAL 48 CO -0.01 -0.02 1.29 0.74 -3.33 0.00 0.00 175.10 173.78 2jad h THR 49 N 5.27 1.58 -0.01 5.04 2.02 -1.43 -3.35 112.91 122.01 2jad h THR 49 Ca -0.27 -3.00 0.00 0.00 0.77 0.00 0.00 66.41 63.91 2jad h THR 49 Cb 1.12 2.71 0.00 0.00 -1.74 0.00 0.00 68.15 70.24 2jad h THR 49 CO 0.86 0.87 -0.01 0.35 0.37 0.00 0.00 175.52 177.96 2jad n THR 50 N -3.52 0.00 0.00 3.16 -2.24 -1.24 -5.01 114.28 105.43 2jad n THR 50 Ca -0.03 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 2jad n THR 50 Cb 0.90 0.45 0.00 0.00 -2.10 0.00 0.00 70.33 69.58 2jad n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jad n GLY 51 N 1.17 1.09 3.47 3.38 0.00 -1.26 -5.00 105.19 108.04 2jad n GLY 51 Ca 0.19 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.54 2jad n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jad s LYS 52 N 0.00 1.78 -0.16 1.61 -2.85 -1.26 -4.35 119.74 114.51 2jad s LYS 52 Ca 0.00 -2.05 -0.16 0.00 -1.00 0.00 0.00 55.97 52.77 2jad s LYS 52 Cb 0.00 -0.64 -0.04 0.00 -2.06 0.00 0.00 37.83 35.08 2jad s LYS 52 CO 0.00 -0.37 0.38 -1.17 0.10 0.00 0.00 175.35 174.29 2jad s LEU 53 N -3.53 4.23 0.00 2.77 2.96 -1.26 -4.95 118.68 118.90 2jad s LEU 53 Ca 0.29 0.61 0.31 0.00 -0.22 0.00 0.00 54.13 55.12 2jad s LEU 53 Cb 0.05 -2.52 1.61 0.00 0.50 0.00 0.00 46.19 45.84 2jad s LEU 53 CO 0.15 0.02 2.07 -0.81 -1.32 0.00 0.00 176.35 176.46 2jad n PRO 54 N 3.85 0.96 -4.18 0.98 -0.04 -1.26 -4.82 135.00 130.49 2jad n PRO 54 Ca -0.09 -0.18 -0.11 0.00 -0.04 0.00 0.00 63.50 63.08 2jad n PRO 54 Cb 0.52 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 2jad n PRO 54 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2jad s VAL 55 N -2.16 0.61 0.39 0.52 -7.23 -1.26 -4.49 120.40 106.78 2jad s VAL 55 Ca 0.40 -1.94 -0.26 0.00 -1.81 0.00 0.00 61.98 58.38 2jad s VAL 55 Cb 0.21 -1.81 -0.09 0.00 0.56 0.00 0.00 36.38 35.25 2jad s VAL 55 CO 0.40 -0.75 1.25 -2.84 -0.31 0.00 0.00 175.10 172.85 2jad s PRO 56 N -3.88 4.07 0.17 4.82 0.02 -1.26 -4.95 135.00 133.99 2jad s PRO 56 Ca 0.15 2.05 -0.14 0.00 0.02 0.00 0.00 61.00 63.08 2jad s PRO 56 Cb 0.06 -2.79 0.10 0.00 0.02 0.00 0.00 34.50 31.89 2jad s PRO 56 CO -0.02 -0.37 1.80 -1.49 -0.33 0.00 0.00 177.00 176.58 2jad h TRP 57 N 2.79 0.48 -0.92 6.54 4.06 -1.96 -2.69 115.95 124.25 2jad h TRP 57 Ca -0.49 0.02 0.27 0.00 2.06 0.00 0.00 58.89 60.74 2jad h TRP 57 Cb 1.24 -0.15 -0.04 0.00 -1.00 0.00 0.00 29.16 29.21 2jad h TRP 57 CO 0.54 0.26 0.71 -1.35 -3.56 0.00 0.00 178.44 175.05 2jad h PRO 58 N 0.52 0.00 -0.03 0.49 0.11 -1.90 0.30 132.00 131.49 2jad h PRO 58 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 2jad h PRO 58 Cb 0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.18 2jad h PRO 58 CO -0.12 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.92 2jad n THR 59 N -4.08 0.04 0.10 -1.15 -2.24 -1.01 -3.30 114.28 102.64 2jad n THR 59 Ca 0.19 -0.06 0.01 0.00 -2.27 0.00 0.00 64.05 61.92 2jad n THR 59 Cb 1.03 -0.13 -0.00 0.00 -2.10 0.00 0.00 70.33 69.13 2jad n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2jad n LEU 60 N -0.55 0.53 -0.07 3.22 4.77 0.11 -4.77 117.00 120.25 2jad n LEU 60 Ca 0.12 -0.70 -0.07 0.00 -0.03 0.00 0.00 56.01 55.33 2jad n LEU 60 Cb 0.10 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.18 2jad n LEU 60 CO 0.09 0.12 0.72 0.58 -1.33 0.00 0.00 177.39 177.57 2jad h VAL 61 N 0.18 0.44 -0.31 4.08 2.07 -1.54 0.73 116.25 121.90 2jad h VAL 61 Ca 0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 2jad h VAL 61 Cb 0.07 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 2jad h VAL 61 CO 0.00 0.00 0.05 0.71 0.02 0.00 0.00 177.57 178.35 2jad h THR 62 N -0.19 1.16 -0.27 2.57 1.35 -1.86 -2.54 112.91 113.12 2jad h THR 62 Ca 0.15 -0.57 -0.12 0.00 -0.55 0.00 0.00 66.41 65.32 2jad h THR 62 Cb 0.42 0.87 -0.00 0.00 -1.73 0.00 0.00 68.15 67.70 2jad h THR 62 CO -0.39 0.20 -0.30 0.74 -0.25 0.00 0.00 175.52 175.52 2jad h THR 63 N 0.44 1.31 0.00 6.82 2.02 -1.64 -3.45 112.91 118.41 2jad h THR 63 Ca 0.10 -1.47 -0.21 0.00 0.77 0.00 0.00 66.41 65.60 2jad h THR 63 Cb 0.21 1.63 -0.01 0.00 -1.74 0.00 0.00 68.15 68.23 2jad h THR 63 CO -0.00 0.47 1.16 0.49 0.37 0.00 0.00 175.52 178.01 2jad n PHE 64 N -4.27 0.56 0.00 3.16 0.99 0.16 -5.04 117.46 113.03 2jad n PHE 64 Ca -0.04 -1.24 0.00 0.00 -0.00 0.00 0.00 57.45 56.17 2jad n PHE 64 Cb 0.48 -1.25 0.00 0.00 -1.00 0.00 0.00 39.48 37.70 2jad n PHE 64 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 2jad n LEU 68 N 3.47 0.00 0.00 4.37 4.77 -1.26 -5.07 117.00 123.28 2jad n LEU 68 Ca 0.30 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.34 2jad n LEU 68 Cb 0.30 0.00 0.34 0.00 -2.33 0.00 0.00 43.42 41.73 2jad n LEU 68 CO 0.41 0.00 0.63 0.00 -1.33 0.00 0.00 177.39 177.11 2jad n GLN 69 N 0.00 0.26 0.00 3.23 6.02 -1.26 -2.03 117.38 123.60 2jad n GLN 69 Ca 0.00 0.11 0.12 0.00 -0.01 0.00 0.00 57.00 57.22 2jad n GLN 69 Cb 0.00 -1.50 0.70 0.00 1.02 0.00 0.00 30.24 30.46 2jad n GLN 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jad n PHE 71 N -1.12 0.10 -1.78 0.00 3.72 -0.86 -4.68 117.46 112.84 2jad n PHE 71 Ca 0.16 -0.07 -0.34 0.00 -0.05 0.00 0.00 57.45 57.15 2jad n PHE 71 Cb 0.13 -0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.72 2jad n PHE 71 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2jad s ALA 72 N -1.47 2.41 -0.23 4.37 0.00 -1.11 -4.02 121.76 121.71 2jad s ALA 72 Ca 0.24 0.81 -0.21 0.00 0.00 0.00 0.00 51.96 52.80 2jad s ALA 72 Cb 0.16 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.85 2jad s ALA 72 CO 0.24 -1.37 0.64 0.50 0.00 0.00 0.00 175.76 175.76 2jad s ARG 73 N -3.74 4.15 -0.29 0.00 3.52 0.25 -4.76 118.95 118.08 2jad s ARG 73 Ca 0.73 0.59 -0.08 0.00 -0.13 0.00 0.00 55.73 56.84 2jad s ARG 73 Cb -0.26 -3.62 -0.00 0.00 -1.56 0.00 0.00 34.95 29.50 2jad s ARG 73 CO 0.39 -0.36 0.10 0.71 -0.81 0.00 0.00 175.30 175.33 2jad s TYR 74 N 2.31 3.14 0.79 5.12 1.51 -1.26 -0.43 117.35 128.54 2jad s TYR 74 Ca 0.27 -0.78 -0.15 0.00 -1.01 0.00 0.00 57.07 55.40 2jad s TYR 74 Cb -0.16 -2.28 -0.00 0.00 -0.11 0.00 0.00 41.96 39.41 2jad s TYR 74 CO 0.09 -0.51 0.63 -2.30 -1.11 0.00 0.00 175.55 172.35 2jad n PRO 75 N 4.91 0.17 0.18 -1.71 -0.02 -1.26 -4.75 135.00 132.51 2jad n PRO 75 Ca -0.15 0.11 0.18 0.00 -2.02 0.00 0.00 63.50 61.62 2jad n PRO 75 Cb 0.49 -1.96 0.71 0.00 -0.02 0.00 0.00 33.50 32.72 2jad n PRO 75 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2jad h ASP 76 N -0.72 0.00 -0.60 2.55 3.45 -2.00 0.81 116.42 119.91 2jad h ASP 76 Ca -0.45 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.01 2jad h ASP 76 Cb 1.32 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.09 2jad h ASP 76 CO 0.41 0.00 0.00 0.00 -1.57 0.00 0.00 179.24 178.08 2jad n HIS 77 N -3.27 0.79 -1.41 4.55 1.44 -1.26 -4.29 115.22 111.76 2jad n HIS 77 Ca 0.04 -0.39 0.06 0.00 -2.01 0.00 0.00 57.72 55.42 2jad n HIS 77 Cb 0.61 0.00 0.09 0.00 0.12 0.00 0.00 29.99 30.81 2jad n HIS 77 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 2jad n MET 78 N 1.51 0.82 0.22 -1.40 2.81 0.27 -4.81 117.12 116.55 2jad n MET 78 Ca 0.22 -2.01 0.07 0.00 -1.81 0.00 0.00 57.70 54.17 2jad n MET 78 Cb 0.59 -1.14 0.59 0.00 -0.71 0.00 0.00 33.22 32.56 2jad n MET 78 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2jad h LYS 79 N 0.00 0.06 0.00 0.03 1.79 -1.74 -1.98 116.57 114.73 2jad h LYS 79 Ca -0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2jad h LYS 79 Cb 1.15 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.78 2jad h LYS 79 CO 0.00 0.07 0.00 -2.13 -1.08 0.00 0.00 179.45 176.31 2jad n ARG 80 N -4.50 0.12 -0.23 3.15 0.63 -1.26 -2.95 116.66 111.61 2jad n ARG 80 Ca -0.02 0.34 0.09 0.00 -0.92 0.00 0.00 57.85 57.34 2jad n ARG 80 Cb 0.11 -1.73 0.21 0.00 0.45 0.00 0.00 32.46 31.51 2jad n ARG 80 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 2jad n HIS 81 N -1.95 0.61 -2.68 -0.14 8.25 -0.75 -4.61 115.22 113.95 2jad n HIS 81 Ca 0.03 -0.42 -0.43 0.00 -0.26 0.00 0.00 57.72 56.64 2jad n HIS 81 Cb 0.22 -0.01 -0.01 0.00 1.12 0.00 0.00 29.99 31.31 2jad n HIS 81 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2jad s ASP 82 N -1.07 6.80 0.14 0.41 -1.08 -1.15 -4.46 116.67 116.25 2jad s ASP 82 Ca 0.34 -2.32 -0.15 0.00 -0.52 0.00 0.00 52.55 49.90 2jad s ASP 82 Cb 0.18 -2.53 0.01 0.00 -1.46 0.00 0.00 42.92 39.13 2jad s ASP 82 CO 0.24 -1.14 1.69 0.15 0.52 0.00 0.00 175.17 176.63 2jad h PHE 83 N 8.06 0.66 -0.21 -5.34 3.57 -1.88 -3.13 116.94 118.67 2jad h PHE 83 Ca 0.35 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.85 2jad h PHE 83 Cb 0.91 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 39.40 2jad h PHE 83 CO 1.31 0.57 -0.12 0.74 -2.23 0.00 0.00 178.31 178.57 2jad h PHE 84 N 0.56 -0.30 0.00 0.41 -1.00 -1.87 -2.47 116.94 112.27 2jad h PHE 84 Ca 0.15 0.03 -0.08 0.00 2.81 0.00 0.00 57.97 60.87 2jad h PHE 84 Cb 0.18 0.16 -0.01 0.00 3.61 0.00 0.00 35.95 39.90 2jad h PHE 84 CO 0.00 -0.19 -0.38 0.87 -1.61 0.00 0.00 178.31 177.01 2jad h LYS 85 N -0.11 0.00 0.00 1.51 1.57 -1.83 -2.94 116.57 114.77 2jad h LYS 85 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2jad h LYS 85 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 2jad h LYS 85 CO -0.28 0.38 0.00 0.66 -0.57 0.00 0.00 179.45 179.64 2jad h SER 86 N 0.00 0.00 1.40 0.86 4.64 -1.39 -2.44 113.55 116.63 2jad h SER 86 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jad h SER 86 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 2jad h SER 86 CO 0.05 0.00 -0.33 0.00 -0.87 0.00 0.00 176.83 175.68 2jad h ALA 87 N 2.14 0.81 -2.29 5.18 0.00 -1.38 -3.43 119.26 120.30 2jad h ALA 87 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 2jad h ALA 87 Cb 0.42 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.26 2jad h ALA 87 CO 0.00 0.00 0.38 -1.64 0.00 0.00 0.00 179.25 177.99 2jad s MET 88 N -3.20 3.55 0.35 0.00 1.00 -0.92 -0.74 119.30 119.34 2jad s MET 88 Ca 0.06 1.04 0.25 0.00 0.00 0.00 0.00 55.69 57.04 2jad s MET 88 Cb 0.10 -2.07 0.69 0.00 0.00 0.00 0.00 34.83 33.54 2jad s MET 88 CO 0.68 -0.61 1.72 -1.00 0.00 0.00 0.00 175.02 175.81 2jad h PRO 89 N 0.42 0.00 -0.84 2.03 0.13 -1.87 -2.27 132.00 129.60 2jad h PRO 89 Ca -0.46 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 64.76 2jad h PRO 89 Cb 1.20 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.27 2jad h PRO 89 CO 0.59 0.00 0.55 0.93 -0.23 0.00 0.00 178.00 179.84 2jad h GLU 90 N 0.00 0.79 0.00 0.86 5.08 -1.90 -2.83 114.58 116.59 2jad h GLU 90 Ca 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2jad h GLU 90 Cb 0.79 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2jad h GLU 90 CO 0.00 0.53 0.00 0.41 -1.00 0.00 0.00 179.01 178.95 2jad n GLY 91 N -1.43 -1.79 3.35 -3.84 0.00 0.08 -4.71 105.19 96.86 2jad n GLY 91 Ca 0.14 -1.99 -0.10 0.00 0.00 0.00 0.00 46.02 44.07 2jad n GLY 91 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jad s TYR 92 N -0.03 0.07 -0.12 1.61 -0.85 -0.72 -0.90 117.35 116.40 2jad s TYR 92 Ca 0.00 -0.43 -0.04 0.00 -0.52 0.00 0.00 57.07 56.08 2jad s TYR 92 Cb 0.00 0.14 -0.03 0.00 0.38 0.00 0.00 41.96 42.44 2jad s TYR 92 CO 0.00 -0.73 0.02 0.08 -1.52 0.00 0.00 175.55 173.39 2jad s VAL 93 N -3.88 4.41 -0.20 -3.49 1.01 0.13 -1.15 120.40 117.23 2jad s VAL 93 Ca 0.09 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 61.87 2jad s VAL 93 Cb 0.02 -2.91 0.01 0.00 0.00 0.00 0.00 36.38 33.50 2jad s VAL 93 CO -0.06 0.55 -0.14 -1.58 0.00 0.00 0.00 175.10 173.88 2jad s GLN 94 N -0.34 3.14 0.01 2.72 0.74 0.26 -1.64 119.66 124.56 2jad s GLN 94 Ca 0.07 -0.75 0.06 0.00 0.05 0.00 0.00 55.36 54.79 2jad s GLN 94 Cb -0.12 -2.75 -0.03 0.00 1.10 0.00 0.00 33.01 31.21 2jad s GLN 94 CO 0.02 -0.21 -0.17 -1.21 -0.55 0.00 0.00 175.29 173.17 2jad s GLU 95 N 1.37 2.20 0.04 1.67 2.02 -0.28 -0.79 118.70 124.93 2jad s GLU 95 Ca 0.05 -0.90 -0.15 0.00 0.02 0.00 0.00 54.97 53.99 2jad s GLU 95 Cb -0.14 -2.24 0.02 0.00 0.10 0.00 0.00 34.13 31.88 2jad s GLU 95 CO -0.09 0.56 0.33 1.03 0.02 0.00 0.00 175.26 177.12 2jad s ARG 96 N -1.22 0.84 -0.14 1.61 0.52 -0.23 -1.02 118.95 119.30 2jad s ARG 96 Ca 0.14 -0.46 -0.02 0.00 -0.52 0.00 0.00 55.73 54.86 2jad s ARG 96 Cb -0.11 0.37 0.05 0.00 0.52 0.00 0.00 34.95 35.78 2jad s ARG 96 CO 0.04 -0.27 0.02 0.99 0.02 0.00 0.00 175.30 176.10 2jad s THR 97 N -2.51 0.45 -0.34 0.02 2.01 -0.95 0.41 115.64 114.73 2jad s THR 97 Ca -0.05 -0.27 -0.08 0.00 0.31 0.00 0.00 61.69 61.60 2jad s THR 97 Cb -0.01 -0.82 0.03 0.00 0.01 0.00 0.00 72.50 71.71 2jad s THR 97 CO -0.03 -0.02 0.12 -0.63 -0.69 0.00 0.00 174.62 173.37 2jad s ILE 98 N 1.91 4.02 -0.19 1.82 1.01 0.20 -2.13 121.20 127.85 2jad s ILE 98 Ca 0.02 -0.96 -0.20 0.00 0.00 0.00 0.00 60.65 59.51 2jad s ILE 98 Cb -0.15 -3.22 -0.03 0.00 0.01 0.00 0.00 42.46 39.07 2jad s ILE 98 CO -0.07 -0.13 0.59 -0.36 0.00 0.00 0.00 174.94 174.97 2jad s PHE 99 N 1.46 3.39 -0.37 3.97 0.40 0.08 -1.35 117.98 125.57 2jad s PHE 99 Ca 0.00 0.89 -0.17 0.00 -0.60 0.00 0.00 56.93 57.05 2jad s PHE 99 Cb -0.19 -2.74 -0.00 0.00 0.51 0.00 0.00 43.02 40.60 2jad s PHE 99 CO 0.04 -0.12 0.46 -0.06 0.70 0.00 0.00 175.22 176.24 2jad s PHE 100 N 1.69 3.18 -0.10 0.36 0.40 -0.54 -0.77 117.98 122.20 2jad s PHE 100 Ca 0.27 -0.00 -0.38 0.00 -0.60 0.00 0.00 56.93 56.22 2jad s PHE 100 Cb -0.16 -2.86 -0.16 0.00 0.51 0.00 0.00 43.02 40.35 2jad s PHE 100 CO 0.10 -0.55 1.58 1.17 0.70 0.00 0.00 175.22 178.22 2jad n LYS 101 N 5.63 1.25 -3.08 0.44 3.00 -0.45 -0.48 118.16 124.47 2jad n LYS 101 Ca -0.06 0.45 -0.21 0.00 -0.00 0.00 0.00 58.31 58.49 2jad n LYS 101 Cb 0.49 -2.13 0.04 0.00 0.00 0.00 0.00 35.03 33.43 2jad n LYS 101 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2jad n ASP 102 N 4.19 -5.76 -0.19 3.14 10.43 -1.26 -4.75 116.55 122.34 2jad n ASP 102 Ca 0.23 -0.32 0.00 0.00 2.57 0.00 0.00 54.79 57.27 2jad n ASP 102 Cb 0.17 -4.54 0.00 0.00 1.84 0.00 0.00 41.12 38.59 2jad n ASP 102 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 2jad n ASP 103 N -2.20 0.00 -3.71 -2.24 4.64 0.37 -4.92 116.55 108.49 2jad n ASP 103 Ca -0.08 -0.19 -0.28 0.00 -1.38 0.00 0.00 54.79 52.87 2jad n ASP 103 Cb 0.60 0.00 0.21 0.00 -1.04 0.00 0.00 41.12 40.88 2jad n ASP 103 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2jad n GLY 104 N 0.00 -1.86 3.18 0.27 0.00 -1.02 -4.53 105.19 101.23 2jad n GLY 104 Ca 0.00 -1.64 -0.14 0.00 0.00 0.00 0.00 46.02 44.24 2jad n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jad s ASN 105 N -5.22 1.44 0.04 1.61 2.20 -1.03 -1.47 114.94 112.50 2jad s ASN 105 Ca 0.70 -0.84 0.03 0.00 -0.94 0.00 0.00 52.86 51.82 2jad s ASN 105 Cb -0.03 0.01 -0.04 0.00 -2.00 0.00 0.00 41.25 39.20 2jad s ASN 105 CO 0.50 -0.28 -0.03 -0.31 -2.94 0.00 0.00 177.10 174.04 2jad s TYR 106 N -2.59 2.96 -0.11 1.54 2.02 -0.46 -2.16 117.35 118.56 2jad s TYR 106 Ca 0.07 -0.01 0.01 0.00 -0.37 0.00 0.00 57.07 56.77 2jad s TYR 106 Cb -0.02 -1.59 0.02 0.00 -0.40 0.00 0.00 41.96 39.97 2jad s TYR 106 CO -0.00 0.44 -0.13 0.15 -1.57 0.00 0.00 175.55 174.44 2jad s LYS 107 N -1.79 1.96 0.08 -0.62 1.02 -0.53 -0.63 119.74 119.24 2jad s LYS 107 Ca 0.21 -0.46 0.06 0.00 0.02 0.00 0.00 55.97 55.80 2jad s LYS 107 Cb -0.11 -1.75 -0.03 0.00 -0.52 0.00 0.00 37.83 35.41 2jad s LYS 107 CO 0.12 -0.12 -0.16 0.95 -0.92 0.00 0.00 175.35 175.22 2jad s THR 108 N 1.17 1.26 -0.01 2.17 -4.23 0.17 -1.75 115.64 114.42 2jad s THR 108 Ca -0.04 -1.35 0.01 0.00 -1.18 0.00 0.00 61.69 59.13 2jad s THR 108 Cb -0.14 -1.18 0.01 0.00 1.34 0.00 0.00 72.50 72.52 2jad s THR 108 CO -0.04 -0.18 -0.02 -0.60 -0.54 0.00 0.00 174.62 173.25 2jad s ARG 109 N -1.76 0.20 -0.12 3.99 3.52 -0.67 -1.07 118.95 123.04 2jad s ARG 109 Ca 0.00 -0.04 -0.16 0.00 -0.13 0.00 0.00 55.73 55.40 2jad s ARG 109 Cb -0.10 -0.24 0.04 0.00 -1.56 0.00 0.00 34.95 33.09 2jad s ARG 109 CO 0.03 0.00 0.42 0.00 -0.81 0.00 0.00 175.30 174.94 2jad s ALA 110 N 0.20 -1.05 -0.19 6.12 0.00 0.03 -1.01 121.76 125.87 2jad s ALA 110 Ca -0.02 1.02 -0.02 0.00 0.00 0.00 0.00 51.96 52.94 2jad s ALA 110 Cb -0.04 -0.48 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 2jad s ALA 110 CO -0.01 -0.23 -0.09 -1.21 0.00 0.00 0.00 175.76 174.23 2jad s GLU 111 N -0.22 3.32 -0.15 0.00 2.02 -0.81 0.89 118.70 123.75 2jad s GLU 111 Ca -0.04 -0.67 -0.04 0.00 0.02 0.00 0.00 54.97 54.25 2jad s GLU 111 Cb -0.03 -2.85 -0.03 0.00 0.10 0.00 0.00 34.13 31.32 2jad s GLU 111 CO 0.02 -0.11 -0.04 0.08 0.02 0.00 0.00 175.26 175.24 2jad s VAL 112 N 1.19 3.88 0.04 2.63 1.01 -0.30 -2.45 120.40 126.40 2jad s VAL 112 Ca 0.02 -0.36 -0.28 0.00 0.00 0.00 0.00 61.98 61.36 2jad s VAL 112 Cb -0.14 -2.70 0.09 0.00 0.00 0.00 0.00 36.38 33.63 2jad s VAL 112 CO -0.03 0.50 0.95 -1.59 0.00 0.00 0.00 175.10 174.93 2jad s LYS 113 N 0.32 0.89 0.06 2.72 -2.85 -0.96 -1.76 119.74 118.16 2jad s LYS 113 Ca -0.04 -0.40 -0.24 0.00 -1.00 0.00 0.00 55.97 54.29 2jad s LYS 113 Cb -0.14 0.36 -0.06 0.00 -2.06 0.00 0.00 37.83 35.93 2jad s LYS 113 CO 0.03 -0.40 0.74 -0.06 0.10 0.00 0.00 175.35 175.76 2jad s PHE 114 N -3.10 3.77 -0.52 1.78 0.40 -1.07 -0.20 117.98 119.04 2jad s PHE 114 Ca 0.08 1.47 0.03 0.00 -0.60 0.00 0.00 56.93 57.91 2jad s PHE 114 Cb -0.01 -2.78 0.15 0.00 0.51 0.00 0.00 43.02 40.90 2jad s PHE 114 CO -0.05 0.34 0.33 -1.21 0.70 0.00 0.00 175.22 175.33 2jad s GLU 115 N -0.31 1.62 3.20 0.44 2.02 0.21 -4.93 118.70 120.95 2jad s GLU 115 Ca 0.37 -2.47 0.00 0.00 0.02 0.00 0.00 54.97 52.89 2jad s GLU 115 Cb -0.21 -2.57 0.00 0.00 0.10 0.00 0.00 34.13 31.46 2jad s GLU 115 CO 0.23 -1.24 0.00 0.41 0.02 0.00 0.00 175.26 174.68 2jad n GLY 116 N 2.92 0.61 1.31 -1.39 0.00 -1.26 -3.21 105.19 104.16 2jad n GLY 116 Ca 0.15 -1.03 0.10 0.00 0.00 0.00 0.00 46.02 45.25 2jad n GLY 116 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jad n ASP 117 N 3.70 3.80 -4.59 1.61 8.00 -1.26 -4.91 116.55 122.90 2jad n ASP 117 Ca 0.00 -2.09 -0.34 0.00 0.71 0.00 0.00 54.79 53.07 2jad n ASP 117 Cb 0.00 -0.48 -0.11 0.00 -0.02 0.00 0.00 41.12 40.51 2jad n ASP 117 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2jad s THR 118 N -1.26 3.94 -0.23 -3.53 2.01 -1.20 -4.26 115.64 111.12 2jad s THR 118 Ca 0.46 -0.37 -0.18 0.00 0.31 0.00 0.00 61.69 61.90 2jad s THR 118 Cb 0.25 -2.66 -0.03 0.00 0.01 0.00 0.00 72.50 70.07 2jad s THR 118 CO 0.29 0.57 0.52 -0.22 -0.69 0.00 0.00 174.62 175.09 2jad s LEU 119 N -0.51 4.11 -0.10 4.42 1.98 -0.70 0.65 118.68 128.53 2jad s LEU 119 Ca 0.08 0.61 0.02 0.00 -2.89 0.00 0.00 54.13 51.96 2jad s LEU 119 Cb -0.12 -2.69 -0.01 0.00 0.66 0.00 0.00 46.19 44.02 2jad s LEU 119 CO 0.02 -0.23 -0.17 -0.69 -1.89 0.00 0.00 176.35 173.39 2jad s VAL 120 N 1.93 2.73 -0.38 1.68 1.01 0.72 -1.44 120.40 126.65 2jad s VAL 120 Ca 0.23 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.38 2jad s VAL 120 Cb -0.15 -2.09 0.09 0.00 0.00 0.00 0.00 36.38 34.22 2jad s VAL 120 CO 0.09 0.55 0.15 0.21 0.00 0.00 0.00 175.10 176.10 2jad s ASN 121 N 0.03 5.17 -0.32 3.32 2.47 0.55 -2.28 114.94 123.89 2jad s ASN 121 Ca -0.06 -1.81 -0.11 0.00 0.42 0.00 0.00 52.86 51.30 2jad s ASN 121 Cb -0.15 -1.80 -0.02 0.00 -1.45 0.00 0.00 41.25 37.84 2jad s ASN 121 CO 0.05 -0.46 0.19 -0.13 -3.72 0.00 0.00 177.10 173.03 2jad s ARG 122 N 1.18 3.46 0.15 0.43 0.52 -1.02 -0.55 118.95 123.12 2jad s ARG 122 Ca 0.05 -0.65 0.10 0.00 -0.52 0.00 0.00 55.73 54.71 2jad s ARG 122 Cb -0.22 -3.68 -0.04 0.00 0.52 0.00 0.00 34.95 31.53 2jad s ARG 122 CO -0.03 -0.41 -0.19 0.42 0.02 0.00 0.00 175.30 175.11 2jad s ILE 123 N 1.67 2.71 -0.08 1.52 1.01 0.29 -1.93 121.20 126.40 2jad s ILE 123 Ca 0.05 -1.71 0.00 0.00 0.00 0.00 0.00 60.65 58.99 2jad s ILE 123 Cb -0.17 -2.28 0.02 0.00 0.01 0.00 0.00 42.46 40.05 2jad s ILE 123 CO 0.09 -0.01 -0.07 -1.61 0.00 0.00 0.00 174.94 173.34 2jad s GLU 124 N -2.42 1.24 -0.02 2.79 2.02 -0.18 -1.76 118.70 120.37 2jad s GLU 124 Ca 0.20 -0.19 0.03 0.00 0.02 0.00 0.00 54.97 55.02 2jad s GLU 124 Cb -0.09 -1.26 0.00 0.00 0.10 0.00 0.00 34.13 32.87 2jad s GLU 124 CO 0.11 -0.16 -0.09 -1.17 0.02 0.00 0.00 175.26 173.96 2jad s LEU 125 N 1.34 1.84 -0.06 1.80 0.20 -0.60 -1.68 118.68 121.52 2jad s LEU 125 Ca -0.03 -0.19 0.01 0.00 0.69 0.00 0.00 54.13 54.61 2jad s LEU 125 Cb -0.14 -0.55 0.02 0.00 -0.43 0.00 0.00 46.19 45.09 2jad s LEU 125 CO -0.03 0.08 -0.07 -0.75 -0.29 0.00 0.00 176.35 175.29 2jad s LYS 126 N 0.10 1.20 0.02 1.98 2.20 -0.71 -1.42 119.74 123.10 2jad s LYS 126 Ca -0.02 -0.22 0.04 0.00 -0.36 0.00 0.00 55.97 55.42 2jad s LYS 126 Cb -0.08 -1.12 -0.03 0.00 -1.51 0.00 0.00 37.83 35.09 2jad s LYS 126 CO 0.00 -0.07 -0.08 0.20 -0.36 0.00 0.00 175.35 175.04 2jad s GLY 127 N 0.95 1.74 0.11 5.54 0.00 -0.19 -1.45 107.32 114.03 2jad s GLY 127 Ca -0.10 -1.07 -0.05 0.00 0.00 0.00 0.00 44.72 43.49 2jad s GLY 127 CO 0.00 -0.96 0.14 -0.26 0.00 0.00 0.00 173.10 172.03 2jad s ILE 128 N -1.03 0.13 -1.51 0.90 -4.36 -0.92 -0.42 121.20 113.98 2jad s ILE 128 Ca 0.18 -1.53 -0.13 0.00 -0.26 0.00 0.00 60.65 58.90 2jad s ILE 128 Cb -0.11 -1.68 0.09 0.00 1.25 0.00 0.00 42.46 42.01 2jad s ILE 128 CO 0.08 -0.57 0.84 0.47 0.24 0.00 0.00 174.94 176.00 2jad n ASP 129 N -0.08 -4.50 -4.79 4.36 8.00 -1.26 -2.46 116.55 115.81 2jad n ASP 129 Ca -0.10 -0.70 -0.38 0.00 0.71 0.00 0.00 54.79 54.31 2jad n ASP 129 Cb 0.63 -3.62 -0.06 0.00 -0.02 0.00 0.00 41.12 38.04 2jad n ASP 129 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2jad s PHE 130 N -3.21 3.66 0.02 1.24 0.40 -1.26 -2.44 117.98 116.38 2jad s PHE 130 Ca 0.61 0.97 -0.30 0.00 -0.60 0.00 0.00 56.93 57.60 2jad s PHE 130 Cb -0.31 -2.39 -0.05 0.00 0.51 0.00 0.00 43.02 40.78 2jad s PHE 130 CO 0.75 0.48 1.33 0.15 0.70 0.00 0.00 175.22 178.63 2jad s LYS 131 N -0.51 4.32 0.36 0.44 1.02 -1.26 -4.89 119.74 119.22 2jad s LYS 131 Ca 0.24 1.90 0.25 0.00 0.02 0.00 0.00 55.97 58.39 2jad s LYS 131 Cb -0.16 -3.49 1.29 0.00 -0.52 0.00 0.00 37.83 34.95 2jad s LYS 131 CO 0.13 -0.48 1.77 0.93 -0.92 0.00 0.00 175.35 176.78 2jad h GLU 132 N 7.46 0.00 -0.02 1.68 5.08 -1.96 -1.15 114.58 125.67 2jad h GLU 132 Ca -0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 2jad h GLU 132 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2jad h GLU 132 CO 0.88 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.49 2jad n ASP 133 N -2.39 1.87 -2.89 1.42 5.75 -1.26 -4.06 116.55 114.98 2jad n ASP 133 Ca -0.01 -1.44 -0.08 0.00 -0.01 0.00 0.00 54.79 53.25 2jad n ASP 133 Cb 0.09 -0.01 0.07 0.00 -1.03 0.00 0.00 41.12 40.25 2jad n ASP 133 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jad n GLY 134 N 0.56 -3.02 0.13 6.12 0.00 -0.43 -4.65 105.19 103.89 2jad n GLY 134 Ca 0.06 -1.38 -0.01 0.00 0.00 0.00 0.00 46.02 44.70 2jad n GLY 134 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2jad h ASN 135 N -1.85 0.00 0.00 1.61 2.35 -1.93 -1.85 115.58 113.91 2jad h ASN 135 Ca -0.11 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 2jad h ASN 135 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 2jad h ASN 135 CO 0.07 0.64 0.00 -0.38 -1.65 0.00 0.00 177.43 176.11 2jad n ILE 136 N -3.57 0.00 0.21 2.81 -0.00 -1.26 -0.97 119.36 116.58 2jad n ILE 136 Ca -0.00 0.53 0.14 0.00 -0.00 0.00 0.00 62.75 63.42 2jad n ILE 136 Cb 0.68 -1.19 0.76 0.00 -0.00 0.00 0.00 39.64 39.89 2jad n ILE 136 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 2jad h LEU 137 N 0.00 0.00 -0.45 1.39 3.38 -1.74 -0.16 115.31 117.73 2jad h LEU 137 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2jad h LEU 137 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2jad h LEU 137 CO 0.00 0.00 -0.01 0.61 0.09 0.00 0.00 178.44 179.13 2jad n GLY 138 N -1.47 -0.55 3.46 0.83 0.00 -0.69 -4.93 105.19 101.84 2jad n GLY 138 Ca 0.00 -0.32 -0.16 0.00 0.00 0.00 0.00 46.02 45.55 2jad n GLY 138 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2jad n HIS 139 N -0.47 -2.41 -0.90 1.61 8.25 -0.07 -4.94 115.22 116.27 2jad n HIS 139 Ca 0.21 0.89 0.07 0.00 -0.26 0.00 0.00 57.72 58.63 2jad n HIS 139 Cb 0.24 -3.47 0.10 0.00 1.12 0.00 0.00 29.99 27.97 2jad n HIS 139 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2jad n LYS 140 N -2.58 1.54 -4.07 -0.41 5.02 -0.14 -5.04 118.16 112.48 2jad n LYS 140 Ca -0.14 -2.23 -0.36 0.00 -2.02 0.00 0.00 58.31 53.57 2jad n LYS 140 Cb 0.59 -1.32 -0.08 0.00 -0.02 0.00 0.00 35.03 34.20 2jad n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2jad s LEU 141 N -2.27 3.97 0.67 -0.35 1.43 -1.26 -2.63 118.68 118.24 2jad s LEU 141 Ca 0.23 0.25 -0.17 0.00 -1.03 0.00 0.00 54.13 53.41 2jad s LEU 141 Cb 0.20 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.46 2jad s LEU 141 CO 0.02 0.33 1.27 -1.61 0.23 0.00 0.00 176.35 176.59 2jad s GLU 142 N -0.55 2.42 -1.30 1.70 2.02 0.06 -4.88 118.70 118.17 2jad s GLU 142 Ca 0.11 1.99 -0.09 0.00 0.02 0.00 0.00 54.97 57.00 2jad s GLU 142 Cb -0.12 -1.84 0.15 0.00 0.10 0.00 0.00 34.13 32.43 2jad s GLU 142 CO 0.02 -1.68 1.96 0.98 0.02 0.00 0.00 175.26 176.56 2jad n TYR 143 N -2.13 2.92 -4.05 1.61 9.36 -1.26 -4.81 117.16 118.81 2jad n TYR 143 Ca 0.15 -2.80 -0.14 0.00 3.32 0.00 0.00 57.90 58.43 2jad n TYR 143 Cb 0.49 -1.98 -0.03 0.00 -0.63 0.00 0.00 39.34 37.19 2jad n TYR 143 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 2jad n ASN 144 N 3.82 -1.50 -3.71 2.98 0.23 -1.26 -4.82 115.26 111.00 2jad n ASN 144 Ca 0.43 -2.92 -0.12 0.00 -0.53 0.00 0.00 54.58 51.44 2jad n ASN 144 Cb 0.35 2.75 -0.10 0.00 -2.08 0.00 0.00 39.78 40.70 2jad n ASN 144 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 2jad s TYR 145 N -2.78 -0.56 0.31 -2.53 5.04 -1.26 -4.89 117.35 110.68 2jad s TYR 145 Ca 0.29 1.27 -0.16 0.00 -2.44 0.00 0.00 57.07 56.02 2jad s TYR 145 Cb -0.01 0.23 -0.09 0.00 0.35 0.00 0.00 41.96 42.44 2jad s TYR 145 CO 0.21 -0.29 0.74 -0.80 -1.34 0.00 0.00 175.55 174.06 2jad s ASN 146 N 0.82 6.81 0.21 4.32 0.01 -1.26 -4.69 114.94 121.16 2jad s ASN 146 Ca -0.05 1.31 -0.07 0.00 -0.71 0.00 0.00 52.86 53.35 2jad s ASN 146 Cb -0.06 -2.38 -0.06 0.00 0.41 0.00 0.00 41.25 39.16 2jad s ASN 146 CO -0.06 -0.18 0.48 -0.44 -1.51 0.00 0.00 177.10 175.38 2jad s SER 147 N -2.20 6.54 0.00 -1.22 0.01 -1.26 -4.74 113.70 110.82 2jad s SER 147 Ca 0.53 0.75 0.00 0.00 1.31 0.00 0.00 55.95 58.54 2jad s SER 147 Cb -0.11 -2.15 0.00 0.00 0.21 0.00 0.00 66.02 63.97 2jad s SER 147 CO 0.18 -0.05 0.00 0.00 0.41 0.00 0.00 173.24 173.78 2jad n HIS 148 N -0.21 0.00 -4.34 2.43 1.44 -1.01 -5.01 115.22 108.52 2jad n HIS 148 Ca -0.01 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.39 2jad n HIS 148 Cb 0.52 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.53 2jad n HIS 148 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2jad s VAL 150 N -1.13 2.60 -0.52 0.00 -7.23 0.16 -4.92 120.40 109.37 2jad s VAL 150 Ca 0.20 -1.46 -0.26 0.00 -1.81 0.00 0.00 61.98 58.64 2jad s VAL 150 Cb -0.11 -2.14 0.03 0.00 0.56 0.00 0.00 36.38 34.73 2jad s VAL 150 CO 0.11 0.20 1.03 -0.47 -0.31 0.00 0.00 175.10 175.66 2jad s TYR 151 N -1.02 2.79 -0.13 2.82 5.04 -1.26 -1.42 117.35 124.18 2jad s TYR 151 Ca 0.15 0.35 -0.18 0.00 -2.44 0.00 0.00 57.07 54.95 2jad s TYR 151 Cb -0.10 -4.22 -0.04 0.00 0.35 0.00 0.00 41.96 37.95 2jad s TYR 151 CO 0.07 -1.31 0.45 0.42 -1.34 0.00 0.00 175.55 173.83 2jad s ILE 152 N 4.22 5.20 0.02 3.14 -1.09 0.47 -4.58 121.20 128.58 2jad s ILE 152 Ca 0.39 0.90 0.02 0.00 -2.23 0.00 0.00 60.65 59.73 2jad s ILE 152 Cb -0.09 -3.79 -0.01 0.00 -1.58 0.00 0.00 42.46 36.98 2jad s ILE 152 CO 0.25 0.33 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.53 2jad s VAL 153 N 0.62 0.59 0.38 2.92 1.01 -1.03 -2.13 120.40 122.76 2jad s VAL 153 Ca 0.25 -0.67 -0.16 0.00 0.00 0.00 0.00 61.98 61.40 2jad s VAL 153 Cb -0.15 -0.57 -0.09 0.00 0.00 0.00 0.00 36.38 35.58 2jad s VAL 153 CO 0.09 -0.08 0.81 0.00 0.00 0.00 0.00 175.10 175.92 2jad s ALA 154 N -0.71 3.24 -0.68 5.51 0.00 -1.26 0.51 121.76 128.37 2jad s ALA 154 Ca -0.02 0.09 0.05 0.00 0.00 0.00 0.00 51.96 52.08 2jad s ALA 154 Cb -0.06 -2.87 0.17 0.00 0.00 0.00 0.00 23.12 20.36 2jad s ALA 154 CO 0.00 0.19 0.50 -3.47 0.00 0.00 0.00 175.76 172.98 2jad n ASP 155 N -0.68 2.80 -0.32 0.00 -0.08 0.98 -4.66 116.55 114.59 2jad n ASP 155 Ca 0.04 -3.16 0.20 0.00 -1.51 0.00 0.00 54.79 50.36 2jad n ASP 155 Cb 0.54 -0.74 0.46 0.00 2.34 0.00 0.00 41.12 43.72 2jad n ASP 155 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2jad h LYS 156 N 5.35 0.46 -0.00 -0.67 1.57 -1.95 0.25 116.57 121.58 2jad h LYS 156 Ca 0.16 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2jad h LYS 156 Cb 0.76 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 2jad h LYS 156 CO 0.70 0.31 -0.07 1.96 -0.57 0.00 0.00 179.45 181.77 2jad h GLN 157 N 0.48 -0.12 -0.00 3.15 4.20 -1.94 -2.42 115.11 118.45 2jad h GLN 157 Ca 0.59 0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.31 2jad h GLN 157 Cb 1.35 0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.15 2jad h GLN 157 CO -0.32 -0.08 -0.13 1.63 -0.67 0.00 0.00 178.83 179.25 2jad n LYS 158 N -5.19 0.75 -2.43 1.46 4.76 -0.51 -4.93 118.16 112.07 2jad n LYS 158 Ca -0.06 -0.30 -0.15 0.00 -2.87 0.00 0.00 58.31 54.93 2jad n LYS 158 Cb 0.12 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.82 2jad n LYS 158 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2jad n ASN 159 N -0.87 -4.52 0.00 4.39 5.15 0.76 -4.72 115.26 115.46 2jad n ASN 159 Ca 0.14 -0.07 0.00 0.00 -0.60 0.00 0.00 54.58 54.05 2jad n ASN 159 Cb 0.29 -3.58 0.00 0.00 -0.53 0.00 0.00 39.78 35.96 2jad n ASN 159 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2jad n GLY 160 N -1.10 5.11 3.19 8.20 0.00 -1.01 -4.51 105.19 115.06 2jad n GLY 160 Ca -0.14 -0.70 -0.13 0.00 0.00 0.00 0.00 46.02 45.04 2jad n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2jad s ILE 161 N 1.33 0.92 0.14 -0.61 -5.25 -1.06 -0.01 121.20 116.65 2jad s ILE 161 Ca 0.00 -1.78 0.10 0.00 -0.99 0.00 0.00 60.65 57.98 2jad s ILE 161 Cb 0.00 -1.51 -0.04 0.00 2.95 0.00 0.00 42.46 43.86 2jad s ILE 161 CO 0.00 -0.67 -0.24 -0.54 -1.79 0.00 0.00 174.94 171.71 2jad s LYS 162 N -3.20 1.32 -0.22 0.37 1.02 0.18 -1.28 119.74 117.93 2jad s LYS 162 Ca 0.09 -1.33 -0.13 0.00 0.02 0.00 0.00 55.97 54.62 2jad s LYS 162 Cb -0.00 -1.67 0.07 0.00 -0.52 0.00 0.00 37.83 35.71 2jad s LYS 162 CO -0.01 0.38 0.55 0.08 -0.92 0.00 0.00 175.35 175.43 2jad s VAL 163 N -1.32 -0.01 -0.21 3.17 1.01 -0.51 -2.47 120.40 120.06 2jad s VAL 163 Ca 0.13 0.05 -0.01 0.00 0.00 0.00 0.00 61.98 62.15 2jad s VAL 163 Cb -0.09 -0.80 0.06 0.00 0.00 0.00 0.00 36.38 35.55 2jad s VAL 163 CO 0.06 0.02 -0.01 0.20 0.00 0.00 0.00 175.10 175.38 2jad s ASN 164 N 1.51 3.30 0.06 3.32 0.02 -1.26 0.61 114.94 122.51 2jad s ASN 164 Ca -0.10 -0.96 -0.02 0.00 -1.02 0.00 0.00 52.86 50.76 2jad s ASN 164 Cb -0.07 -0.86 -0.03 0.00 0.02 0.00 0.00 41.25 40.31 2jad s ASN 164 CO -0.16 -0.27 0.02 0.72 0.02 0.00 0.00 177.10 177.42 2jad s PHE 165 N 1.65 0.48 -0.08 2.20 -0.12 -0.87 -4.83 117.98 116.43 2jad s PHE 165 Ca -0.03 -1.00 0.03 0.00 -0.05 0.00 0.00 56.93 55.89 2jad s PHE 165 Cb -0.18 -0.34 -0.02 0.00 -0.63 0.00 0.00 43.02 41.86 2jad s PHE 165 CO -0.07 -0.42 -0.18 0.15 -0.05 0.00 0.00 175.22 174.65 2jad s LYS 166 N -3.92 2.80 -0.11 1.99 1.02 -1.26 -0.10 119.74 120.17 2jad s LYS 166 Ca 0.08 -0.77 -0.03 0.00 0.02 0.00 0.00 55.97 55.27 2jad s LYS 166 Cb 0.07 -2.38 -0.03 0.00 -0.52 0.00 0.00 37.83 34.97 2jad s LYS 166 CO -0.09 0.40 0.01 0.42 -0.92 0.00 0.00 175.35 175.17 2jad s ILE 167 N -0.18 4.36 -0.23 2.17 -1.09 0.11 -4.96 121.20 121.39 2jad s ILE 167 Ca -0.01 -0.22 -0.04 0.00 -2.23 0.00 0.00 60.65 58.15 2jad s ILE 167 Cb -0.13 -2.86 -0.00 0.00 -1.58 0.00 0.00 42.46 37.88 2jad s ILE 167 CO 0.03 0.58 -0.03 -0.13 -1.23 0.00 0.00 174.94 174.16 2jad s ARG 168 N -0.60 3.30 -0.22 2.79 1.81 -1.26 -0.45 118.95 124.31 2jad s ARG 168 Ca 0.10 -0.68 -0.09 0.00 -1.72 0.00 0.00 55.73 53.34 2jad s ARG 168 Cb -0.12 -3.05 -0.04 0.00 -0.45 0.00 0.00 34.95 31.29 2jad s ARG 168 CO 0.02 -0.24 0.12 -1.01 -0.68 0.00 0.00 175.30 173.51 2jad s HIS 169 N 1.47 3.27 0.23 -0.53 3.76 -0.30 -4.60 115.29 118.59 2jad s HIS 169 Ca 0.05 0.11 -0.30 0.00 -0.15 0.00 0.00 55.06 54.77 2jad s HIS 169 Cb -0.15 -2.21 -0.09 0.00 1.11 0.00 0.00 32.58 31.25 2jad s HIS 169 CO -0.03 0.05 1.26 -0.80 -0.85 0.00 0.00 174.74 174.37 2jad s ASN 170 N 0.90 6.97 -0.01 1.40 0.01 -1.26 -0.22 114.94 122.73 2jad s ASN 170 Ca 0.06 2.40 -0.01 0.00 -0.71 0.00 0.00 52.86 54.60 2jad s ASN 170 Cb -0.13 -2.62 -0.04 0.00 0.41 0.00 0.00 41.25 38.87 2jad s ASN 170 CO 0.03 -0.44 0.10 -0.63 -1.51 0.00 0.00 177.10 174.64 2jad s ILE 171 N -0.30 4.86 0.58 0.60 1.01 -0.96 -0.76 121.20 126.22 2jad s ILE 171 Ca 0.53 -0.35 0.30 0.00 0.00 0.00 0.00 60.65 61.13 2jad s ILE 171 Cb -0.36 -3.23 0.42 0.00 0.01 0.00 0.00 42.46 39.31 2jad s ILE 171 CO 0.41 0.35 1.80 1.05 0.00 0.00 0.00 174.94 178.55 2jad h GLU 172 N 4.08 0.00 -0.83 2.79 4.11 -1.83 -1.44 114.58 121.46 2jad h GLU 172 Ca -0.49 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 58.84 2jad h GLU 172 Cb 1.18 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.38 2jad h GLU 172 CO 0.63 0.00 0.12 -0.40 0.07 0.00 0.00 179.01 179.43 2jad n ASP 173 N -3.77 3.71 0.00 3.06 3.85 -1.26 -4.89 116.55 117.25 2jad n ASP 173 Ca 0.14 -2.68 0.00 0.00 -0.71 0.00 0.00 54.79 51.54 2jad n ASP 173 Cb 0.90 -0.64 0.00 0.00 -1.35 0.00 0.00 41.12 40.03 2jad n ASP 173 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2jad n GLY 174 N 0.11 2.82 0.00 6.12 0.00 -0.54 -5.01 105.19 108.69 2jad n GLY 174 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2jad n GLY 174 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jad n SER 175 N 0.00 0.00 -3.71 1.61 3.41 -1.25 -4.83 113.62 108.86 2jad n SER 175 Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.47 2jad n SER 175 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 2jad n SER 175 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2jad s VAL 176 N 0.28 0.02 -0.25 -3.33 1.01 -1.26 -2.27 120.40 114.60 2jad s VAL 176 Ca 0.00 -0.16 -0.09 0.00 0.00 0.00 0.00 61.98 61.73 2jad s VAL 176 Cb 0.00 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 2jad s VAL 176 CO 0.00 -0.09 0.12 -1.58 0.00 0.00 0.00 175.10 173.55 2jad s GLN 177 N -0.48 3.85 -0.09 2.72 2.00 0.70 -4.91 119.66 123.45 2jad s GLN 177 Ca -0.06 -0.38 -0.26 0.00 -2.00 0.00 0.00 55.36 52.67 2jad s GLN 177 Cb -0.03 -3.46 -0.03 0.00 0.80 0.00 0.00 33.01 30.29 2jad s GLN 177 CO 0.03 -0.09 0.81 -1.17 -0.50 0.00 0.00 175.29 174.37 2jad s LEU 178 N 1.43 4.28 -0.33 3.68 1.98 -1.26 -1.15 118.68 127.30 2jad s LEU 178 Ca 0.06 1.29 0.04 0.00 -2.89 0.00 0.00 54.13 52.63 2jad s LEU 178 Cb -0.15 -3.25 0.10 0.00 0.66 0.00 0.00 46.19 43.55 2jad s LEU 178 CO 0.06 -0.25 0.05 0.00 -1.89 0.00 0.00 176.35 174.32 2jad s ALA 179 N 1.34 2.78 -0.45 5.97 0.00 0.40 -1.34 121.76 130.46 2jad s ALA 179 Ca 0.41 -2.44 -0.23 0.00 0.00 0.00 0.00 51.96 49.70 2jad s ALA 179 Cb -0.18 -1.93 0.03 0.00 0.00 0.00 0.00 23.12 21.04 2jad s ALA 179 CO 0.18 -1.67 0.78 0.34 0.00 0.00 0.00 175.76 175.39 2jad s ASP 180 N 0.96 6.40 -0.06 0.00 2.15 0.05 0.10 116.67 126.27 2jad s ASP 180 Ca 0.10 -0.15 -0.13 0.00 0.43 0.00 0.00 52.55 52.80 2jad s ASP 180 Cb -0.19 -2.38 -0.05 0.00 -0.30 0.00 0.00 42.92 40.00 2jad s ASP 180 CO -0.09 -0.92 0.34 -1.00 -0.17 0.00 0.00 175.17 173.33 2jad s HIS 181 N 3.27 3.64 -0.27 -5.34 3.76 0.86 -0.74 115.29 120.47 2jad s HIS 181 Ca 0.29 0.83 0.00 0.00 -0.15 0.00 0.00 55.06 56.04 2jad s HIS 181 Cb -0.12 -2.26 0.08 0.00 1.11 0.00 0.00 32.58 31.39 2jad s HIS 181 CO 0.22 0.55 0.03 0.71 -0.85 0.00 0.00 174.74 175.40 2jad s TYR 182 N -0.65 2.26 -0.10 1.40 1.51 -0.90 -2.04 117.35 118.83 2jad s TYR 182 Ca 0.21 -1.88 -0.02 0.00 -1.01 0.00 0.00 57.07 54.38 2jad s TYR 182 Cb -0.15 -1.81 -0.03 0.00 -0.11 0.00 0.00 41.96 39.86 2jad s TYR 182 CO 0.10 -0.82 -0.02 -1.14 -1.11 0.00 0.00 175.55 172.55 2jad s GLN 183 N 1.43 3.09 -0.05 -0.62 0.74 0.20 -2.23 119.66 122.22 2jad s GLN 183 Ca 0.03 -0.47 -0.00 0.00 0.05 0.00 0.00 55.36 54.97 2jad s GLN 183 Cb -0.18 -2.77 0.03 0.00 1.10 0.00 0.00 33.01 31.18 2jad s GLN 183 CO -0.13 0.58 -0.01 -0.65 -0.55 0.00 0.00 175.29 174.54 2jad s GLN 184 N -0.57 0.50 -0.08 1.67 -1.52 -0.19 -1.42 119.66 118.06 2jad s GLN 184 Ca 0.09 0.06 0.05 0.00 -1.95 0.00 0.00 55.36 53.61 2jad s GLN 184 Cb -0.12 -0.72 -0.01 0.00 -0.22 0.00 0.00 33.01 31.94 2jad s GLN 184 CO 0.02 -0.18 -0.24 -0.80 -0.25 0.00 0.00 175.29 173.84 2jad s ASN 185 N 1.35 3.16 -0.02 5.90 -0.87 -0.40 -1.13 114.94 122.93 2jad s ASN 185 Ca -0.05 -0.51 0.02 0.00 -1.57 0.00 0.00 52.86 50.75 2jad s ASN 185 Cb -0.13 -1.11 0.00 0.00 -0.02 0.00 0.00 41.25 39.99 2jad s ASN 185 CO -0.02 0.21 -0.06 -0.89 -2.57 0.00 0.00 177.10 173.76 2jad s THR 186 N 0.05 0.57 0.50 1.60 2.01 -0.65 -2.56 115.64 117.16 2jad s THR 186 Ca -0.10 -0.25 -0.23 0.00 0.31 0.00 0.00 61.69 61.42 2jad s THR 186 Cb -0.15 -0.52 -0.06 0.00 0.01 0.00 0.00 72.50 71.77 2jad s THR 186 CO 0.06 0.19 1.37 -2.84 -0.69 0.00 0.00 174.62 172.71 2jad s PRO 187 N 0.23 3.38 -0.15 4.92 0.02 -1.26 0.23 135.00 142.37 2jad s PRO 187 Ca -0.03 2.28 -0.23 0.00 0.02 0.00 0.00 61.00 63.04 2jad s PRO 187 Cb -0.07 -2.42 -0.21 0.00 0.02 0.00 0.00 34.50 31.82 2jad s PRO 187 CO 0.00 -1.01 0.53 0.82 -0.33 0.00 0.00 177.00 177.01 2jad h ILE 188 N 1.79 1.34 -1.55 2.83 2.04 -1.32 -3.44 117.51 119.20 2jad h ILE 188 Ca -0.51 -2.10 0.00 0.00 1.00 0.00 0.00 64.86 63.25 2jad h ILE 188 Cb 1.28 2.63 0.00 0.00 -0.74 0.00 0.00 36.82 39.99 2jad h ILE 188 CO 0.59 0.45 0.00 0.61 0.00 0.00 0.00 178.15 179.80 2jad n GLY 189 N 1.59 -0.50 0.30 5.37 0.00 -1.26 -5.02 105.19 105.67 2jad n GLY 189 Ca -0.13 -1.70 0.08 0.00 0.00 0.00 0.00 46.02 44.27 2jad n GLY 189 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jad n ASP 190 N -0.88 1.84 -4.33 1.61 3.85 -1.26 -5.06 116.55 112.32 2jad n ASP 190 Ca 0.00 -3.06 -0.29 0.00 -0.71 0.00 0.00 54.79 50.73 2jad n ASP 190 Cb 0.00 -0.41 0.16 0.00 -1.35 0.00 0.00 41.12 39.52 2jad n ASP 190 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 2jad s GLY 191 N -2.65 1.74 0.52 6.12 0.00 -1.26 -5.01 107.32 106.78 2jad s GLY 191 Ca 0.29 -1.14 -0.22 0.00 0.00 0.00 0.00 44.72 43.65 2jad s GLY 191 CO -0.00 -0.44 1.30 2.56 0.00 0.00 0.00 173.10 176.52 2jad s PRO 192 N -5.76 3.32 0.01 2.90 0.04 -1.26 -5.04 135.00 129.21 2jad s PRO 192 Ca 0.71 2.10 -0.04 0.00 0.04 0.00 0.00 61.00 63.82 2jad s PRO 192 Cb -0.05 -2.30 -0.01 0.00 0.04 0.00 0.00 34.50 32.17 2jad s PRO 192 CO 0.51 -1.00 0.06 0.14 0.04 0.00 0.00 177.00 176.75 2jad s VAL 193 N -1.37 0.09 -0.33 -0.36 -7.23 -1.26 -4.70 120.40 105.24 2jad s VAL 193 Ca 0.69 -0.78 -0.19 0.00 -1.81 0.00 0.00 61.98 59.89 2jad s VAL 193 Cb -0.37 -0.34 -0.01 0.00 0.56 0.00 0.00 36.38 36.22 2jad s VAL 193 CO 0.44 -0.43 0.57 -0.76 -0.31 0.00 0.00 175.10 174.62 2jad s LEU 194 N -1.38 4.24 -0.11 1.32 1.43 -1.26 -5.05 118.68 117.87 2jad s LEU 194 Ca -0.15 0.18 -0.17 0.00 -1.03 0.00 0.00 54.13 52.96 2jad s LEU 194 Cb -0.09 -2.70 -0.04 0.00 0.03 0.00 0.00 46.19 43.39 2jad s LEU 194 CO 0.00 -0.49 0.44 -0.76 0.23 0.00 0.00 176.35 175.77 2jad s LEU 195 N 2.52 4.29 0.51 1.79 1.43 -1.26 -3.52 118.68 124.44 2jad s LEU 195 Ca 0.22 0.78 -0.01 0.00 -1.03 0.00 0.00 54.13 54.09 2jad s LEU 195 Cb -0.15 -2.63 0.01 0.00 0.03 0.00 0.00 46.19 43.46 2jad s LEU 195 CO 0.13 0.06 0.76 -2.16 0.23 0.00 0.00 176.35 175.36 2jad s PRO 196 N 0.39 2.86 0.44 1.29 0.04 -1.26 -4.86 135.00 133.90 2jad s PRO 196 Ca 0.24 -0.47 -0.11 0.00 0.04 0.00 0.00 61.00 60.70 2jad s PRO 196 Cb -0.15 -2.47 -0.06 0.00 0.04 0.00 0.00 34.50 31.86 2jad s PRO 196 CO 0.10 -0.51 0.82 -0.51 0.04 0.00 0.00 177.00 176.93 2jad s ASP 197 N -4.30 6.49 0.23 6.66 1.01 -1.26 -4.13 116.67 121.37 2jad s ASP 197 Ca 0.52 1.20 -0.31 0.00 0.71 0.00 0.00 52.55 54.67 2jad s ASP 197 Cb -0.10 -2.35 -0.14 0.00 1.01 0.00 0.00 42.92 41.33 2jad s ASP 197 CO 0.40 -0.47 1.22 0.59 0.21 0.00 0.00 175.17 177.11 2jad n ASN 198 N -1.52 1.91 -1.61 0.27 3.02 -1.26 -4.88 115.26 111.18 2jad n ASN 198 Ca 0.03 1.16 -0.03 0.00 -0.03 0.00 0.00 54.58 55.71 2jad n ASN 198 Cb 0.54 -1.32 0.01 0.00 -0.61 0.00 0.00 39.78 38.40 2jad n ASN 198 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jad n HIS 199 N 1.24 -1.46 -4.41 3.10 1.44 -0.90 -4.79 115.22 109.44 2jad n HIS 199 Ca 0.12 -0.63 -0.27 0.00 -2.01 0.00 0.00 57.72 54.93 2jad n HIS 199 Cb 0.29 0.32 -0.12 0.00 0.12 0.00 0.00 29.99 30.60 2jad n HIS 199 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 2jad s TYR 200 N -6.61 2.27 -0.17 -1.40 1.51 0.24 -0.40 117.35 112.79 2jad s TYR 200 Ca 0.05 -0.37 0.00 0.00 -1.01 0.00 0.00 57.07 55.75 2jad s TYR 200 Cb -0.02 -1.14 0.04 0.00 -0.11 0.00 0.00 41.96 40.73 2jad s TYR 200 CO 0.04 0.47 -0.09 -0.51 -1.11 0.00 0.00 175.55 174.36 2jad s LEU 201 N -2.60 1.83 -0.23 -1.29 1.43 -0.51 0.24 118.68 117.56 2jad s LEU 201 Ca 0.20 -0.69 -0.10 0.00 -1.03 0.00 0.00 54.13 52.50 2jad s LEU 201 Cb -0.08 -1.06 -0.05 0.00 0.03 0.00 0.00 46.19 45.03 2jad s LEU 201 CO 0.09 -0.15 0.14 0.00 0.23 0.00 0.00 176.35 176.67 2jad s TYR 203 N 0.85 2.94 -0.13 0.00 1.51 0.80 -1.97 117.35 121.35 2jad s TYR 203 Ca 0.07 -0.09 -0.05 0.00 -1.01 0.00 0.00 57.07 55.99 2jad s TYR 203 Cb -0.13 -1.43 0.06 0.00 -0.11 0.00 0.00 41.96 40.35 2jad s TYR 203 CO 0.03 0.52 0.27 -0.65 -1.11 0.00 0.00 175.55 174.60 2jad s GLN 204 N -2.93 0.17 0.18 -0.62 -0.21 -0.65 -2.40 119.66 113.20 2jad s GLN 204 Ca 0.28 0.74 0.09 0.00 0.02 0.00 0.00 55.36 56.49 2jad s GLN 204 Cb -0.10 -0.02 -0.04 0.00 1.00 0.00 0.00 33.01 33.85 2jad s GLN 204 CO 0.20 -0.26 -0.18 -1.12 -2.12 0.00 0.00 175.29 171.81 2jad s SER 205 N 2.25 2.76 -0.05 5.90 0.01 -1.26 -0.34 113.70 122.97 2jad s SER 205 Ca -0.01 -0.90 -0.02 0.00 1.31 0.00 0.00 55.95 56.33 2jad s SER 205 Cb -0.12 -0.17 0.04 0.00 0.21 0.00 0.00 66.02 65.98 2jad s SER 205 CO -0.09 -0.05 0.09 0.00 0.41 0.00 0.00 173.24 173.60 2jad s ALA 206 N -2.23 0.05 -0.10 1.44 0.00 0.12 -4.73 121.76 116.31 2jad s ALA 206 Ca 0.18 0.35 -0.03 0.00 0.00 0.00 0.00 51.96 52.46 2jad s ALA 206 Cb -0.05 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 2jad s ALA 206 CO 0.07 -0.41 0.03 -0.51 0.00 0.00 0.00 175.76 174.95 2jad s LEU 207 N 1.92 3.76 0.00 0.00 1.43 -1.26 -1.18 118.68 123.35 2jad s LEU 207 Ca 0.01 0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.31 2jad s LEU 207 Cb -0.12 -1.88 -0.00 0.00 0.03 0.00 0.00 46.19 44.21 2jad s LEU 207 CO -0.04 0.36 0.29 -1.54 0.23 0.00 0.00 176.35 175.64 2jad n SER 208 N 2.29 -0.78 -4.27 2.29 3.41 0.04 -4.97 113.62 111.63 2jad n SER 208 Ca -0.19 -2.35 -0.22 0.00 -0.26 0.00 0.00 58.87 55.86 2jad n SER 208 Cb 0.54 1.54 -0.12 0.00 -0.26 0.00 0.00 64.21 65.90 2jad n SER 208 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2jad s LYS 209 N -2.66 1.08 -0.46 4.33 -0.14 -1.26 -2.15 119.74 118.47 2jad s LYS 209 Ca 0.22 -1.17 -0.18 0.00 -1.36 0.00 0.00 55.97 53.48 2jad s LYS 209 Cb -0.00 -1.21 0.04 0.00 -1.68 0.00 0.00 37.83 34.98 2jad s LYS 209 CO 0.16 0.27 0.52 0.34 -0.76 0.00 0.00 175.35 175.87 2jad s ASP 210 N -2.06 6.21 0.00 2.83 -1.08 -1.26 -4.92 116.67 116.39 2jad s ASP 210 Ca 0.06 -0.82 0.00 0.00 -0.52 0.00 0.00 52.55 51.27 2jad s ASP 210 Cb -0.09 -2.25 0.00 0.00 -1.46 0.00 0.00 42.92 39.12 2jad s ASP 210 CO 0.04 -0.72 0.95 -0.81 0.52 0.00 0.00 175.17 175.15 2jad n PRO 211 N 5.80 0.00 0.00 4.34 -0.04 -1.26 -0.21 135.00 143.64 2jad n PRO 211 Ca -0.07 0.45 0.10 0.00 -0.04 0.00 0.00 63.50 63.94 2jad n PRO 211 Cb 0.46 -1.54 -0.07 0.00 -0.04 0.00 0.00 33.50 32.31 2jad n PRO 211 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2jad n ASN 212 N -1.45 1.43 -4.72 3.54 5.15 -1.26 -4.91 115.26 113.04 2jad n ASN 212 Ca 0.00 -1.21 -0.38 0.00 -0.60 0.00 0.00 54.58 52.39 2jad n ASN 212 Cb 0.04 0.78 -0.06 0.00 -0.53 0.00 0.00 39.78 40.01 2jad n ASN 212 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2jad s GLU 213 N -2.78 4.35 0.00 1.20 2.56 0.71 -4.97 118.70 119.78 2jad s GLU 213 Ca 0.12 0.52 0.14 0.00 0.00 0.00 0.00 54.97 55.76 2jad s GLU 213 Cb 0.17 -3.44 -0.03 0.00 2.00 0.00 0.00 34.13 32.83 2jad s GLU 213 CO 0.74 0.13 0.75 1.63 -0.56 0.00 0.00 175.26 177.96 2jad n LYS 214 N 3.72 1.93 -3.69 4.30 5.02 -1.26 -4.88 118.16 123.30 2jad n LYS 214 Ca -0.06 -0.61 -0.23 0.00 -2.02 0.00 0.00 58.31 55.40 2jad n LYS 214 Cb 0.52 -1.20 -0.02 0.00 -0.02 0.00 0.00 35.03 34.30 2jad n LYS 214 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2jad s ARG 215 N -1.85 3.46 0.20 1.97 0.52 -1.26 -5.03 118.95 116.97 2jad s ARG 215 Ca 0.11 -0.55 -0.32 0.00 -0.52 0.00 0.00 55.73 54.45 2jad s ARG 215 Cb 0.11 -2.79 -0.12 0.00 0.52 0.00 0.00 34.95 32.68 2jad s ARG 215 CO 0.40 0.30 1.72 0.34 0.02 0.00 0.00 175.30 178.08 2jad s ASP 216 N -3.97 6.40 0.35 0.23 3.68 -1.26 -4.92 116.67 117.18 2jad s ASP 216 Ca 0.37 2.84 -0.14 0.00 2.13 0.00 0.00 52.55 57.75 2jad s ASP 216 Cb -0.09 -2.60 0.04 0.00 -1.45 0.00 0.00 42.92 38.82 2jad s ASP 216 CO 0.32 -0.96 0.70 -1.38 0.13 0.00 0.00 175.17 173.98 2jad s HIS 217 N 1.30 0.26 -0.16 -5.34 -3.43 -1.26 -1.71 115.29 104.95 2jad s HIS 217 Ca 0.75 -0.80 -0.12 0.00 -0.80 0.00 0.00 55.06 54.09 2jad s HIS 217 Cb -0.49 0.61 0.05 0.00 -1.43 0.00 0.00 32.58 31.32 2jad s HIS 217 CO 0.32 -1.41 0.41 1.41 -2.00 0.00 0.00 174.74 173.47 2jad s MET 218 N -2.80 0.43 -0.27 -0.38 0.00 -0.55 -4.98 119.30 110.75 2jad s MET 218 Ca 0.18 0.67 -0.05 0.00 0.00 0.00 0.00 55.69 56.49 2jad s MET 218 Cb -0.04 0.11 0.01 0.00 0.00 0.00 0.00 34.83 34.90 2jad s MET 218 CO 0.12 -0.11 0.04 0.08 0.00 0.00 0.00 175.02 175.15 2jad s VAL 219 N 0.80 3.68 -0.09 10.11 1.01 -0.91 -0.06 120.40 134.94 2jad s VAL 219 Ca -0.05 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 2jad s VAL 219 Cb -0.06 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.43 2jad s VAL 219 CO -0.06 0.16 -0.04 -0.22 0.00 0.00 0.00 175.10 174.94 2jad s LEU 220 N 1.47 3.34 -0.10 3.92 2.96 -0.19 -0.78 118.68 129.28 2jad s LEU 220 Ca 0.03 0.03 -0.00 0.00 -0.22 0.00 0.00 54.13 53.96 2jad s LEU 220 Cb -0.17 -1.75 0.02 0.00 0.50 0.00 0.00 46.19 44.80 2jad s LEU 220 CO 0.00 0.34 -0.07 -0.22 -1.32 0.00 0.00 176.35 175.09 2jad s LEU 221 N -0.68 1.17 -0.03 -0.68 2.96 -0.33 -1.25 118.68 119.83 2jad s LEU 221 Ca 0.11 -0.27 0.04 0.00 -0.22 0.00 0.00 54.13 53.78 2jad s LEU 221 Cb -0.12 -0.78 -0.00 0.00 0.50 0.00 0.00 46.19 45.79 2jad s LEU 221 CO 0.02 -0.11 -0.16 -1.61 -1.32 0.00 0.00 176.35 173.17 2jad s GLU 222 N 1.61 1.56 -0.19 1.98 2.02 -0.74 0.12 118.70 125.06 2jad s GLU 222 Ca 0.03 -0.56 0.01 0.00 0.02 0.00 0.00 54.97 54.47 2jad s GLU 222 Cb -0.13 -1.40 0.03 0.00 0.10 0.00 0.00 34.13 32.73 2jad s GLU 222 CO -0.07 0.25 -0.18 0.12 0.02 0.00 0.00 175.26 175.40 2jad s PHE 223 N -0.03 2.86 -0.06 1.61 5.36 0.54 -1.61 117.98 126.65 2jad s PHE 223 Ca -0.01 -1.75 0.03 0.00 -0.96 0.00 0.00 56.93 54.23 2jad s PHE 223 Cb -0.10 -1.92 0.01 0.00 -0.34 0.00 0.00 43.02 40.67 2jad s PHE 223 CO 0.01 -0.82 -0.14 0.08 -1.46 0.00 0.00 175.22 172.90 2jad s VAL 224 N 1.26 1.23 -0.02 3.12 1.01 -0.63 -1.64 120.40 124.73 2jad s VAL 224 Ca 0.03 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.48 2jad s VAL 224 Cb -0.14 -1.10 -0.00 0.00 0.00 0.00 0.00 36.38 35.14 2jad s VAL 224 CO -0.12 0.37 -0.10 -0.89 0.00 0.00 0.00 175.10 174.36 2jad s THR 225 N 0.45 0.85 0.31 3.92 2.01 -0.83 -0.58 115.64 121.77 2jad s THR 225 Ca -0.11 -0.44 -0.18 0.00 0.31 0.00 0.00 61.69 61.27 2jad s THR 225 Cb -0.14 -0.73 -0.09 0.00 0.01 0.00 0.00 72.50 71.55 2jad s THR 225 CO 0.03 0.25 0.78 0.00 -0.69 0.00 0.00 174.62 175.00 2jad s ALA 226 N -0.10 3.29 0.08 7.40 0.00 0.43 -0.82 121.76 132.04 2jad s ALA 226 Ca 0.02 0.17 -0.26 0.00 0.00 0.00 0.00 51.96 51.88 2jad s ALA 226 Cb -0.06 -2.88 0.08 0.00 0.00 0.00 0.00 23.12 20.27 2jad s ALA 226 CO -0.00 0.29 0.82 0.00 0.00 0.00 0.00 175.76 176.86 2jad s ALA 227 N -1.86 -1.70 0.00 0.00 0.00 0.14 -4.60 121.76 113.73 2jad s ALA 227 Ca 0.52 0.65 0.00 0.00 0.00 0.00 0.00 51.96 53.13 2jad s ALA 227 Cb -0.12 0.60 0.00 0.00 0.00 0.00 0.00 23.12 23.59 2jad s ALA 227 CO 0.18 -0.79 0.00 0.41 0.00 0.00 0.00 175.76 175.56 2jad n GLY 228 N -0.33 2.29 3.85 0.00 0.00 -1.26 0.79 105.19 110.53 2jad n GLY 228 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 2jad n GLY 228 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jad s ILE 229 N -2.24 4.91 0.23 -0.61 -1.09 -1.26 -4.94 121.20 116.19 2jad s ILE 229 Ca 0.00 0.74 -0.21 0.00 -2.23 0.00 0.00 60.65 58.95 2jad s ILE 229 Cb 0.00 -3.71 -0.08 0.00 -1.58 0.00 0.00 42.46 37.08 2jad s ILE 229 CO 0.00 0.24 0.76 0.42 -1.23 0.00 0.00 174.94 175.13 2jad s THR 230 N -1.47 4.50 -0.65 2.92 -4.23 -1.26 -4.97 115.64 110.47 2jad s THR 230 Ca 0.37 1.41 -0.26 0.00 -1.18 0.00 0.00 61.69 62.03 2jad s THR 230 Cb -0.15 -3.91 -0.08 0.00 1.34 0.00 0.00 72.50 69.70 2jad s THR 230 CO 0.19 0.24 2.27 -1.00 -0.54 0.00 0.00 174.62 175.78 2jad s HIS 231 N -1.49 1.27 0.58 3.99 3.76 -1.26 -4.84 115.29 117.30 2jad s HIS 231 Ca 0.43 1.48 0.28 0.00 -0.15 0.00 0.00 55.06 57.10 2jad s HIS 231 Cb -0.18 -3.66 1.58 0.00 1.11 0.00 0.00 32.58 31.43 2jad s HIS 231 CO 0.22 -2.09 2.06 0.78 -0.85 0.00 0.00 174.74 174.85 2jad h GLY 232 N 19.91 0.00 -0.01 -2.22 0.00 -1.93 -3.32 103.07 115.49 2jad h GLY 232 Ca -0.13 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.24 2jad h GLY 232 CO 1.13 0.00 -0.45 -0.33 0.00 0.00 0.00 176.54 176.88 2jad h MET 233 N 0.00 -0.51 0.00 4.80 2.86 -1.99 0.15 114.93 120.24 2jad h MET 233 Ca 0.12 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 2jad h MET 233 Cb 0.64 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.42 2jad h MET 233 CO -0.00 -0.34 0.00 0.45 1.06 0.00 0.00 176.91 178.08 2jad h HIS 234 N -0.53 0.00 0.04 -0.22 3.86 -2.00 -2.63 115.15 113.67 2jad h HIS 234 Ca 0.06 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.27 2jad h HIS 234 Cb 0.65 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.12 2jad h HIS 234 CO -0.50 0.00 -0.02 0.93 0.86 0.00 0.00 177.93 179.20 2jad h GLU 235 N 0.00 -0.06 -0.95 2.45 5.08 -1.43 -3.00 114.58 116.67 2jad h GLU 235 Ca 0.00 0.00 0.19 0.00 -1.00 0.00 0.00 59.36 58.55 2jad h GLU 235 Cb 0.52 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.70 2jad h GLU 235 CO 0.00 0.45 0.61 -0.07 -1.00 0.00 0.00 179.01 179.00 2jad h LEU 236 N -0.60 0.60 -0.94 1.33 3.38 -0.50 0.78 115.31 119.37 2jad h LEU 236 Ca -0.01 0.06 0.24 0.00 0.09 0.00 0.00 57.88 58.27 2jad h LEU 236 Cb 0.54 -0.05 -0.13 0.00 0.09 0.00 0.00 40.66 41.11 2jad h LEU 236 CO 0.01 0.24 0.46 1.88 0.09 0.00 0.00 178.44 181.11 2jad h TYR 237 N 0.60 0.76 0.22 1.13 0.05 -1.33 -1.03 116.97 117.36 2jad h TYR 237 Ca 0.51 0.04 -0.32 0.00 0.05 0.00 0.00 58.73 59.01 2jad h TYR 237 Cb 1.00 -0.19 0.03 0.00 1.01 0.00 0.00 36.73 38.58 2jad h TYR 237 CO -0.00 -0.05 -1.46 1.57 -1.05 0.00 0.00 178.16 177.16 2jad h LYS 238 N 0.42 0.46 -7.08 4.88 -0.00 -0.90 -3.45 116.57 110.89 2jad h LYS 238 Ca 0.61 -0.78 -0.46 0.00 -0.00 0.00 0.00 60.65 60.01 2jad h LYS 238 Cb 1.20 0.29 0.01 0.00 -0.00 0.00 0.00 32.23 33.73 2jad h LYS 238 CO -0.54 1.37 0.37 -1.12 -0.00 0.00 0.00 179.45 179.53 2jad s SER 239 N -7.44 6.51 -0.25 7.07 0.01 -0.39 -4.52 113.70 114.69 2jad s SER 239 Ca -0.08 1.84 -0.27 0.00 1.31 0.00 0.00 55.95 58.75 2jad s SER 239 Cb 0.05 -2.55 0.15 0.00 0.21 0.00 0.00 66.02 63.87 2jad s SER 239 CO 0.92 -0.66 1.14 -0.83 0.41 0.00 0.00 173.24 174.22 2jad s GLY 240 N -2.10 -0.06 0.30 3.44 0.00 -1.26 -4.86 107.32 102.78 2jad s GLY 240 Ca 0.65 2.65 -0.03 0.00 0.00 0.00 0.00 44.72 47.99 2jad s GLY 240 CO 0.19 1.50 0.54 -0.45 0.00 0.00 0.00 173.10 174.88 2jad s SER 241 N -0.40 6.40 0.29 1.64 0.15 -1.26 -4.95 113.70 115.57 2jad s SER 241 Ca 0.03 0.63 -0.18 0.00 0.70 0.00 0.00 55.95 57.13 2jad s SER 241 Cb -0.03 -2.11 -0.13 0.00 -1.71 0.00 0.00 66.02 62.04 2jad s SER 241 CO -0.06 -0.21 0.15 0.61 1.20 0.00 0.00 173.24 174.93 2jad n GLY 246 N -1.10 -2.02 3.61 9.45 0.00 -1.26 -5.11 105.19 108.75 2jad n GLY 246 Ca -0.03 0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 2jad n GLY 246 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2jad n MET 247 N 1.01 0.04 -3.04 1.61 1.56 -1.26 -4.98 117.12 112.06 2jad n MET 247 Ca 0.10 0.08 -0.35 0.00 -0.27 0.00 0.00 57.70 57.27 2jad n MET 247 Cb 0.29 -2.23 -0.06 0.00 2.15 0.00 0.00 33.22 33.37 2jad n MET 247 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 2jad s VAL 248 N -2.20 4.54 0.54 1.12 1.01 -1.26 -5.05 120.40 119.10 2jad s VAL 248 Ca 0.68 1.27 -0.21 0.00 0.00 0.00 0.00 61.98 63.73 2jad s VAL 248 Cb -0.28 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.27 2jad s VAL 248 CO 0.56 0.03 1.23 -0.94 0.00 0.00 0.00 175.10 175.98 2jad s SER 249 N -1.88 5.51 0.45 3.32 1.04 -1.26 -4.88 113.70 116.00 2jad s SER 249 Ca 0.49 2.45 0.11 0.00 0.48 0.00 0.00 55.95 59.48 2jad s SER 249 Cb -0.14 -2.61 1.02 0.00 0.10 0.00 0.00 66.02 64.39 2jad s SER 249 CO 0.19 -1.38 2.08 1.56 0.98 0.00 0.00 173.24 176.68 2jad h GLN 250 N 1.37 0.29 -0.36 4.02 1.08 -1.98 -1.62 115.11 117.91 2jad h GLN 250 Ca -0.50 -0.02 0.06 0.00 -1.45 0.00 0.00 58.65 56.73 2jad h GLN 250 Cb 1.28 -0.06 -0.08 0.00 -0.05 0.00 0.00 27.48 28.57 2jad h GLN 250 CO 0.57 0.21 -0.48 1.49 -0.95 0.00 0.00 178.83 179.67 2jad h GLU 251 N 0.30 -0.38 -0.63 1.46 4.22 -2.00 0.17 114.58 117.71 2jad h GLU 251 Ca 0.08 0.03 -0.03 0.00 0.08 0.00 0.00 59.36 59.51 2jad h GLU 251 Cb 0.00 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 2jad h GLU 251 CO -0.01 -0.25 0.25 1.15 -2.18 0.00 0.00 179.01 177.97 2jad h THR 252 N -0.39 1.22 0.03 0.32 2.02 -1.70 -2.53 112.91 111.88 2jad h THR 252 Ca 0.10 -0.69 -0.00 0.00 0.77 0.00 0.00 66.41 66.59 2jad h THR 252 Cb 0.60 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 2jad h THR 252 CO -0.56 0.27 -0.02 0.40 0.37 0.00 0.00 175.52 175.99 2jad h ILE 253 N 0.90 0.99 -0.29 3.11 1.08 -0.11 -1.31 117.51 121.89 2jad h ILE 253 Ca 0.21 -0.08 0.00 0.00 -0.39 0.00 0.00 64.86 64.61 2jad h ILE 253 Cb 0.17 1.04 -0.01 0.00 -3.07 0.00 0.00 36.82 34.95 2jad h ILE 253 CO -0.02 0.02 0.18 0.50 -0.69 0.00 0.00 178.15 178.14 2jad h LYS 254 N -0.08 0.38 -0.37 2.37 3.64 -0.69 -0.77 116.57 121.06 2jad h LYS 254 Ca -0.00 -0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.42 2jad h LYS 254 Cb 0.07 -0.08 -0.09 0.00 -0.41 0.00 0.00 32.23 31.72 2jad h LYS 254 CO 0.01 0.28 -0.31 1.25 -2.27 0.00 0.00 179.45 178.41 2jad h HIS 255 N 0.38 -0.85 -0.56 1.91 2.76 -1.26 1.09 115.15 118.61 2jad h HIS 255 Ca 0.10 0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.31 2jad h HIS 255 Cb -0.01 0.43 -0.03 0.00 1.55 0.00 0.00 27.41 29.35 2jad h HIS 255 CO -0.05 -0.37 0.29 0.28 -1.30 0.00 0.00 177.93 176.78 2jad h VAL 256 N -0.25 1.18 -0.17 5.26 2.07 -1.00 0.19 116.25 123.52 2jad h VAL 256 Ca 0.17 -0.47 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 2jad h VAL 256 Cb 0.53 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 2jad h VAL 256 CO -0.51 0.20 0.06 0.11 0.02 0.00 0.00 177.57 177.45 2jad h LYS 257 N 0.78 0.27 -0.30 1.57 1.57 0.82 -1.24 116.57 120.05 2jad h LYS 257 Ca 0.20 -0.06 0.06 0.00 -1.87 0.00 0.00 60.65 58.98 2jad h LYS 257 Cb 0.05 -0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.26 2jad h LYS 257 CO -0.03 0.38 -0.08 -0.44 -0.57 0.00 0.00 179.45 178.70 2jad h ASP 258 N 0.10 -0.30 -0.91 0.86 3.32 0.20 0.22 116.42 119.92 2jad h ASP 258 Ca 0.06 0.09 0.18 0.00 0.02 0.00 0.00 57.03 57.38 2jad h ASP 258 Cb 0.22 0.19 -0.07 0.00 0.22 0.00 0.00 39.33 39.89 2jad h ASP 258 CO -0.00 -0.11 0.59 -0.07 -1.72 0.00 0.00 179.24 177.93 2jad h LEU 259 N -0.01 0.55 -0.13 1.55 3.38 -0.36 0.41 115.31 120.70 2jad h LEU 259 Ca 0.14 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 58.06 2jad h LEU 259 Cb 0.23 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2jad h LEU 259 CO -0.31 0.24 -0.34 0.40 0.09 0.00 0.00 178.44 178.51 2jad h ILE 260 N 0.56 1.37 -0.10 1.22 2.04 0.52 -3.23 117.51 119.90 2jad h ILE 260 Ca 0.48 -1.64 -0.20 0.00 1.00 0.00 0.00 64.86 64.49 2jad h ILE 260 Cb 0.96 2.09 0.00 0.00 -0.74 0.00 0.00 36.82 39.13 2jad h ILE 260 CO -0.22 0.49 -0.77 0.00 0.00 0.00 0.00 178.15 177.65 2jad h ALA 261 N 0.52 0.48 -0.05 1.87 0.00 0.22 -3.23 119.26 119.06 2jad h ALA 261 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2jad h ALA 261 Cb 0.96 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2jad h ALA 261 CO 0.07 0.74 0.00 0.39 0.00 0.00 0.00 179.25 180.45 2jad n GLU 262 N -3.86 1.17 -3.89 0.00 1.02 0.13 -4.79 120.64 110.41 2jad n GLU 262 Ca -0.06 -0.21 -0.14 0.00 -0.02 0.00 0.00 57.16 56.73 2jad n GLU 262 Cb 0.73 -1.16 -0.15 0.00 -0.02 0.00 0.00 31.44 30.84 2jad n GLU 262 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2jad s ASN 263 N -0.78 0.16 0.06 1.62 0.01 -1.22 -5.03 114.94 109.76 2jad s ASN 263 Ca 0.04 -0.01 -0.27 0.00 -0.71 0.00 0.00 52.86 51.91 2jad s ASN 263 Cb 0.02 -0.06 -0.17 0.00 0.41 0.00 0.00 41.25 41.45 2jad s ASN 263 CO 0.02 -0.04 1.56 -0.33 -1.51 0.00 0.00 177.10 176.80 2jad h GLU 264 N 6.60 -0.40 -5.76 -0.60 5.08 -1.86 -3.39 114.58 114.25 2jad h GLU 264 Ca -0.33 0.03 -0.65 0.00 -1.00 0.00 0.00 59.36 57.40 2jad h GLU 264 Cb 1.17 0.09 -0.32 0.00 0.50 0.00 0.00 28.75 30.20 2jad h GLU 264 CO 0.50 -0.20 -0.87 0.42 -1.00 0.00 0.00 179.01 177.86 2jad s ILE 265 N -5.68 1.87 -0.07 3.13 1.01 -0.73 0.29 121.20 121.03 2jad s ILE 265 Ca -0.15 -0.96 0.03 0.00 0.00 0.00 0.00 60.65 59.57 2jad s ILE 265 Cb 0.04 -1.59 0.00 0.00 0.01 0.00 0.00 42.46 40.92 2jad s ILE 265 CO 0.62 0.52 -0.16 0.12 0.00 0.00 0.00 174.94 176.04 2jad s PHE 266 N -0.06 1.79 -0.21 3.97 5.36 -0.88 -0.95 117.98 126.99 2jad s PHE 266 Ca -0.05 -0.64 -0.05 0.00 -0.96 0.00 0.00 56.93 55.24 2jad s PHE 266 Cb -0.13 -1.24 0.07 0.00 -0.34 0.00 0.00 43.02 41.38 2jad s PHE 266 CO 0.04 -0.27 0.12 0.08 -1.46 0.00 0.00 175.22 173.72 2jad s VAL 267 N 0.39 -0.11 -0.23 3.12 1.01 -0.36 -1.54 120.40 122.68 2jad s VAL 267 Ca -0.12 -0.31 -0.20 0.00 0.00 0.00 0.00 61.98 61.34 2jad s VAL 267 Cb -0.15 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.52 2jad s VAL 267 CO 0.04 -0.39 0.61 0.00 0.00 0.00 0.00 175.10 175.37 2jad s ALA 268 N 2.15 3.58 0.33 5.51 0.00 -0.93 -1.11 121.76 131.29 2jad s ALA 268 Ca 0.04 -0.38 -0.02 0.00 0.00 0.00 0.00 51.96 51.60 2jad s ALA 268 Cb -0.16 -2.98 -0.00 0.00 0.00 0.00 0.00 23.12 19.98 2jad s ALA 268 CO -0.17 -0.67 0.45 -1.54 0.00 0.00 0.00 175.76 173.83 2jad s SER 269 N 1.34 0.90 -0.01 0.00 1.04 0.13 -1.19 113.70 115.91 2jad s SER 269 Ca 0.27 -1.48 0.05 0.00 0.48 0.00 0.00 55.95 55.27 2jad s SER 269 Cb -0.16 0.64 -0.01 0.00 0.10 0.00 0.00 66.02 66.59 2jad s SER 269 CO 0.09 -1.25 -0.16 -0.54 0.98 0.00 0.00 173.24 172.36 2jad s LYS 270 N -3.18 1.30 0.58 4.02 1.02 -1.26 -0.37 119.74 121.85 2jad s LYS 270 Ca 0.31 -0.60 0.27 0.00 0.02 0.00 0.00 55.97 55.97 2jad s LYS 270 Cb 0.00 -1.27 1.62 0.00 -0.52 0.00 0.00 37.83 37.66 2jad s LYS 270 CO 0.20 0.35 2.11 1.79 -0.92 0.00 0.00 175.35 178.88 2jad h THR 271 N 4.71 0.55 -0.01 2.17 1.35 -1.93 -2.44 112.91 117.31 2jad h THR 271 Ca -0.36 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.50 2jad h THR 271 Cb 1.16 0.86 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 2jad h THR 271 CO 0.48 0.00 -0.80 0.00 -0.25 0.00 0.00 175.52 174.95 2jad n TYR 272 N -3.92 0.00 -2.45 4.73 0.18 -1.26 -4.94 117.16 109.49 2jad n TYR 272 Ca 0.01 0.00 -0.43 0.00 1.88 0.00 0.00 57.90 59.36 2jad n TYR 272 Cb 0.30 -0.00 -0.02 0.00 -0.38 0.00 0.00 39.34 39.23 2jad n TYR 272 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2jad h PRO 274 N 8.68 1.00 -0.17 0.00 0.11 -1.92 -0.82 132.00 138.88 2jad h PRO 274 Ca -0.25 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 65.72 2jad h PRO 274 Cb 1.09 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.97 2jad h PRO 274 CO 1.01 0.66 -0.25 1.88 -0.21 0.00 0.00 178.00 181.09 2jad h TYR 275 N 1.03 0.33 -0.09 0.65 0.05 -1.92 -0.96 116.97 116.07 2jad h TYR 275 Ca 0.41 -0.06 -0.09 0.00 0.05 0.00 0.00 58.73 59.04 2jad h TYR 275 Cb 0.21 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 37.87 2jad h TYR 275 CO -0.02 0.53 -0.28 0.77 -1.05 0.00 0.00 178.16 178.11 2jad h SER 276 N 0.27 0.40 -0.51 3.88 0.02 -1.65 -1.04 113.55 114.93 2jad h SER 276 Ca 0.04 -0.61 0.10 0.00 -0.84 0.00 0.00 61.79 60.48 2jad h SER 276 Cb 0.59 -0.12 -0.10 0.00 0.14 0.00 0.00 62.40 62.91 2jad h SER 276 CO 0.04 0.94 -0.21 0.45 -1.14 0.00 0.00 176.83 176.91 2jad h HIS 277 N -0.13 -0.53 -0.46 3.45 3.86 -0.74 0.55 115.15 121.15 2jad h HIS 277 Ca -0.01 0.05 -0.10 0.00 -1.16 0.00 0.00 60.37 59.15 2jad h HIS 277 Cb 0.91 0.31 -0.01 0.00 1.06 0.00 0.00 27.41 29.68 2jad h HIS 277 CO 0.12 -0.30 -0.11 0.00 0.86 0.00 0.00 177.93 178.50 2jad h ALA 278 N 1.26 0.64 -0.74 2.45 0.00 -1.18 -0.11 119.26 121.58 2jad h ALA 278 Ca 0.24 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2jad h ALA 278 Cb 0.47 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 2jad h ALA 278 CO -0.57 0.53 0.49 0.00 0.00 0.00 0.00 179.25 179.70 2jad h ALA 279 N 0.88 0.95 -0.19 0.00 0.00 -0.29 -0.27 119.26 120.33 2jad h ALA 279 Ca 0.12 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 2jad h ALA 279 Cb 0.65 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2jad h ALA 279 CO 0.05 0.35 -0.14 -0.07 0.00 0.00 0.00 179.25 179.43 2jad h LEU 280 N 1.00 0.46 -1.27 0.00 3.38 -0.79 -2.45 115.31 115.64 2jad h LEU 280 Ca 0.27 -0.45 0.04 0.00 0.09 0.00 0.00 57.88 57.84 2jad h LEU 280 Cb -0.11 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.47 2jad h LEU 280 CO -0.06 0.81 0.51 -1.13 0.09 0.00 0.00 178.44 178.66 2jad h ASN 281 N 0.12 0.80 -0.18 -0.43 -0.73 -0.76 0.90 115.58 115.30 2jad h ASN 281 Ca 0.04 -0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.20 2jad h ASN 281 Cb 0.66 -0.18 -0.01 0.00 0.27 0.00 0.00 38.32 39.07 2jad h ASN 281 CO 0.04 0.54 0.11 0.74 -0.37 0.00 0.00 177.43 178.48 2jad h THR 282 N 0.92 1.09 -0.13 -3.57 2.02 -0.88 0.70 112.91 113.07 2jad h THR 282 Ca 0.32 -0.24 -0.12 0.00 0.77 0.00 0.00 66.41 67.14 2jad h THR 282 Cb 0.11 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 2jad h THR 282 CO -0.10 0.09 -0.37 -0.07 0.37 0.00 0.00 175.52 175.43 2jad h LEU 283 N 0.21 0.55 0.03 2.58 3.38 -0.86 0.72 115.31 121.92 2jad h LEU 283 Ca 0.07 -0.59 -0.26 0.00 0.09 0.00 0.00 57.88 57.18 2jad h LEU 283 Cb 0.05 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2jad h LEU 283 CO -0.01 1.05 -1.40 -0.26 0.09 0.00 0.00 178.44 177.91 2jad h PHE 284 N 0.09 0.11 0.00 1.13 0.04 -0.90 0.16 116.94 117.56 2jad h PHE 284 Ca -0.01 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.68 2jad h PHE 284 Cb 0.99 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.14 2jad h PHE 284 CO 0.11 1.10 -0.12 0.39 -0.60 0.00 0.00 178.31 179.19 2jad n GLU 285 N -3.26 0.06 -0.07 1.51 -0.58 0.19 -3.76 120.64 114.74 2jad n GLU 285 Ca -0.11 0.02 -0.07 0.00 -0.42 0.00 0.00 57.16 56.59 2jad n GLU 285 Cb 1.01 -0.59 -0.01 0.00 -0.57 0.00 0.00 31.44 31.28 2jad n GLU 285 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2jad h LYS 286 N -0.12 -0.13 -0.65 3.49 1.79 -1.37 -2.31 116.57 117.27 2jad h LYS 286 Ca 0.00 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2jad h LYS 286 Cb 0.12 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.80 2jad h LYS 286 CO 0.00 -0.09 0.00 1.28 -1.08 0.00 0.00 179.45 179.56 2jad n LEU 287 N -5.33 4.01 -3.83 2.94 4.77 0.24 -4.98 117.00 114.81 2jad n LEU 287 Ca -0.00 -2.02 -0.24 0.00 -0.03 0.00 0.00 56.01 53.72 2jad n LEU 287 Cb 0.25 -0.51 -0.00 0.00 -2.33 0.00 0.00 43.42 40.83 2jad n LEU 287 CO 0.16 0.78 -0.13 0.29 -1.33 0.00 0.00 177.39 177.16 2jad n LYS 288 N 1.13 -0.67 -3.24 3.23 5.02 -0.87 -4.90 118.16 117.86 2jad n LYS 288 Ca 0.23 -0.16 -0.38 0.00 -2.02 0.00 0.00 58.31 55.98 2jad n LYS 288 Cb 0.72 -1.11 -0.06 0.00 -0.02 0.00 0.00 35.03 34.55 2jad n LYS 288 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2jad s VAL 289 N -4.10 4.70 0.12 -0.18 1.01 0.54 -4.99 120.40 117.50 2jad s VAL 289 Ca 0.21 1.19 -0.31 0.00 0.00 0.00 0.00 61.98 63.08 2jad s VAL 289 Cb -0.12 -3.88 -0.09 0.00 0.00 0.00 0.00 36.38 32.29 2jad s VAL 289 CO 0.53 0.44 1.52 -2.84 0.00 0.00 0.00 175.10 174.75 2jad s PRO 290 N -1.40 4.25 0.65 2.72 0.02 -1.26 -4.59 135.00 135.38 2jad s PRO 290 Ca 0.33 2.24 0.33 0.00 0.02 0.00 0.00 61.00 63.92 2jad s PRO 290 Cb -0.19 -3.29 1.82 0.00 0.02 0.00 0.00 34.50 32.87 2jad s PRO 290 CO 0.20 -0.57 2.06 0.00 -0.33 0.00 0.00 177.00 178.36 2jad h ARG 291 N 7.13 0.00 0.00 5.54 3.08 -1.96 0.10 114.38 128.27 2jad h ARG 291 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.63 2jad h ARG 291 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.25 2jad h ARG 291 CO 0.90 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 178.67 2jad n SER 292 N -3.17 0.00 -0.01 7.04 3.41 -1.26 -3.12 113.62 116.51 2jad n SER 292 Ca -0.01 0.06 0.09 0.00 -0.26 0.00 0.00 58.87 58.75 2jad n SER 292 Cb 0.32 -0.35 -0.13 0.00 -0.26 0.00 0.00 64.21 63.79 2jad n SER 292 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jad n LYS 293 N -1.35 0.66 -3.83 4.33 4.76 0.36 -4.93 118.16 118.16 2jad n LYS 293 Ca 0.11 -0.14 -0.36 0.00 -2.87 0.00 0.00 58.31 55.06 2jad n LYS 293 Cb 0.25 -1.40 -0.13 0.00 -1.84 0.00 0.00 35.03 31.91 2jad n LYS 293 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2jad s VAL 294 N -3.12 3.62 -0.52 -0.18 1.01 -1.18 -1.77 120.40 118.26 2jad s VAL 294 Ca -0.04 -0.70 -0.21 0.00 0.00 0.00 0.00 61.98 61.02 2jad s VAL 294 Cb 0.11 -2.81 0.05 0.00 0.00 0.00 0.00 36.38 33.73 2jad s VAL 294 CO 0.72 0.19 0.74 -0.22 0.00 0.00 0.00 175.10 176.52 2jad s LEU 295 N 1.46 4.62 0.26 3.92 2.96 -0.12 -4.92 118.68 126.86 2jad s LEU 295 Ca 0.03 -0.66 -0.03 0.00 -0.22 0.00 0.00 54.13 53.25 2jad s LEU 295 Cb -0.16 -2.61 -0.05 0.00 0.50 0.00 0.00 46.19 43.87 2jad s LEU 295 CO -0.00 -1.00 0.49 -0.69 -1.32 0.00 0.00 176.35 173.83 2jad s VAL 296 N 3.11 5.10 -0.11 1.68 1.01 -1.26 -1.22 120.40 128.70 2jad s VAL 296 Ca 0.21 -0.16 -0.04 0.00 0.00 0.00 0.00 61.98 62.00 2jad s VAL 296 Cb -0.16 -3.74 0.06 0.00 0.00 0.00 0.00 36.38 32.53 2jad s VAL 296 CO 0.15 -0.28 0.16 -0.76 0.00 0.00 0.00 175.10 174.37 2jad s LEU 297 N -3.52 -0.04 -0.95 3.92 1.43 -0.27 -4.93 118.68 114.33 2jad s LEU 297 Ca 0.41 0.14 -0.16 0.00 -1.03 0.00 0.00 54.13 53.49 2jad s LEU 297 Cb -0.11 0.23 0.17 0.00 0.03 0.00 0.00 46.19 46.52 2jad s LEU 297 CO 0.30 -0.27 1.05 -1.10 0.23 0.00 0.00 176.35 176.56 2jad s GLN 298 N 2.28 3.71 0.47 1.70 -1.52 -1.25 0.20 119.66 125.25 2jad s GLN 298 Ca 0.04 -2.19 0.21 0.00 -1.95 0.00 0.00 55.36 51.46 2jad s GLN 298 Cb -0.13 -4.75 1.21 0.00 -0.22 0.00 0.00 33.01 29.12 2jad s GLN 298 CO -0.07 -1.58 1.92 -0.07 -0.25 0.00 0.00 175.29 175.24 2jad h LEU 299 N 9.21 0.24 0.00 2.90 3.38 -1.08 0.50 115.31 130.46 2jad h LEU 299 Ca 0.16 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2jad h LEU 299 Cb 1.00 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.72 2jad h LEU 299 CO 1.00 0.11 0.00 -0.46 0.09 0.00 0.00 178.44 179.19 2jad n ASN 300 N -4.43 0.00 -2.26 -0.43 6.94 -1.26 -3.04 115.26 110.79 2jad n ASN 300 Ca 0.15 -0.87 -0.17 0.00 -0.02 0.00 0.00 54.58 53.66 2jad n ASN 300 Cb 0.64 0.00 0.03 0.00 -2.36 0.00 0.00 39.78 38.09 2jad n ASN 300 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2jad n ASP 301 N -0.95 3.98 -3.89 0.53 8.00 0.18 -5.04 116.55 119.35 2jad n ASP 301 Ca 0.17 -3.26 -0.09 0.00 0.71 0.00 0.00 54.79 52.31 2jad n ASP 301 Cb 0.08 -0.38 -0.08 0.00 -0.02 0.00 0.00 41.12 40.71 2jad n ASP 301 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2jad s MET 302 N -3.66 0.69 0.08 -1.24 -1.94 -1.17 -4.90 119.30 107.17 2jad s MET 302 Ca 0.44 -0.80 -0.15 0.00 -1.71 0.00 0.00 55.69 53.47 2jad s MET 302 Cb 0.39 0.28 -0.14 0.00 2.01 0.00 0.00 34.83 37.37 2jad s MET 302 CO 0.02 -0.19 1.32 -0.22 -0.01 0.00 0.00 175.02 175.93 2jad h LYS 303 N 3.31 0.68 -0.71 2.03 3.64 -1.96 -3.20 116.57 120.37 2jad h LYS 303 Ca -0.33 -0.48 -0.12 0.00 -1.27 0.00 0.00 60.65 58.45 2jad h LYS 303 Cb 1.19 0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 33.01 2jad h LYS 303 CO 0.52 1.10 0.16 0.39 -2.27 0.00 0.00 179.45 179.35 2jad n GLU 304 N -4.15 4.06 -0.02 1.90 4.71 -1.26 -4.62 120.64 121.26 2jad n GLU 304 Ca -0.06 -2.94 -0.09 0.00 -0.01 0.00 0.00 57.16 54.05 2jad n GLU 304 Cb 0.60 -2.20 -0.03 0.00 -1.01 0.00 0.00 31.44 28.80 2jad n GLU 304 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 2jad h GLY 305 N 3.35 -0.30 0.46 0.62 0.00 -1.71 0.21 103.07 105.70 2jad h GLY 305 Ca 0.15 0.35 0.02 0.00 0.00 0.00 0.00 47.33 47.85 2jad h GLY 305 CO 0.61 -0.21 -0.31 0.00 0.00 0.00 0.00 176.54 176.64 2jad h ALA 306 N 0.61 -0.53 -0.41 3.60 0.00 -1.82 -0.89 119.26 119.82 2jad h ALA 306 Ca 0.11 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.05 2jad h ALA 306 Cb 0.50 0.51 -0.07 0.00 0.00 0.00 0.00 17.79 18.73 2jad h ALA 306 CO -0.37 -0.85 -0.04 -0.44 0.00 0.00 0.00 179.25 177.56 2jad h ASP 307 N -0.53 -0.24 0.32 0.00 3.32 -1.77 0.21 116.42 117.73 2jad h ASP 307 Ca 0.03 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2jad h ASP 307 Cb 0.56 0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.28 2jad h ASP 307 CO -0.18 -0.08 -0.36 0.40 -1.72 0.00 0.00 179.24 177.30 2jad h ILE 308 N 0.07 0.26 -0.88 0.35 2.04 -0.25 0.30 117.51 119.40 2jad h ILE 308 Ca 0.20 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.15 2jad h ILE 308 Cb 0.29 0.26 -0.06 0.00 -0.74 0.00 0.00 36.82 36.58 2jad h ILE 308 CO -0.37 0.00 0.57 -0.61 0.00 0.00 0.00 178.15 177.74 2jad h GLN 309 N -0.72 0.88 0.57 2.37 4.15 -0.79 0.29 115.11 121.86 2jad h GLN 309 Ca -0.02 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.32 2jad h GLN 309 Cb 0.66 -0.20 0.01 0.00 0.21 0.00 0.00 27.48 28.16 2jad h GLN 309 CO -0.08 0.58 -0.27 0.00 -1.93 0.00 0.00 178.83 177.12 2jad h ALA 310 N 1.55 -0.76 -0.97 3.38 0.00 0.11 -2.23 119.26 120.34 2jad h ALA 310 Ca 0.40 -0.18 0.17 0.00 0.00 0.00 0.00 54.91 55.30 2jad h ALA 310 Cb 0.35 0.30 -0.09 0.00 0.00 0.00 0.00 17.79 18.35 2jad h ALA 310 CO -0.16 -0.90 0.61 0.00 0.00 0.00 0.00 179.25 178.79 2jad h ALA 311 N -0.40 1.77 0.09 0.00 0.00 0.74 -1.15 119.26 120.31 2jad h ALA 311 Ca -0.08 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2jad h ALA 311 Cb 0.61 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2jad h ALA 311 CO 0.13 -0.08 -0.10 -0.07 0.00 0.00 0.00 179.25 179.13 2jad h LEU 312 N 0.73 -0.26 -0.65 0.00 3.38 -0.09 -1.38 115.31 117.04 2jad h LEU 312 Ca 0.52 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.61 2jad h LEU 312 Cb 0.84 0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.60 2jad h LEU 312 CO -0.29 -0.15 0.27 0.22 0.09 0.00 0.00 178.44 178.59 2jad h TYR 313 N -0.21 0.48 0.00 1.13 5.03 -0.64 0.24 116.97 122.99 2jad h TYR 313 Ca 0.01 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.35 2jad h TYR 313 Cb 0.21 -0.12 -0.00 0.00 1.55 0.00 0.00 36.73 38.37 2jad h TYR 313 CO -0.12 0.14 -0.00 1.49 -1.32 0.00 0.00 178.16 178.35 2jad h GLU 314 N 0.47 0.00 0.00 1.82 4.57 -1.02 1.54 114.58 121.96 2jad h GLU 314 Ca 0.33 0.00 -0.26 0.00 -1.18 0.00 0.00 59.36 58.25 2jad h GLU 314 Cb 0.40 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.94 2jad h GLU 314 CO -0.30 0.00 -1.59 0.82 -1.18 0.00 0.00 179.01 176.76 2jad h ILE 315 N 0.00 0.83 0.00 2.32 2.04 0.45 -3.42 117.51 119.72 2jad h ILE 315 Ca -0.00 -2.60 0.00 0.00 1.00 0.00 0.00 64.86 63.26 2jad h ILE 315 Cb 0.00 2.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.45 2jad h ILE 315 CO 0.00 0.47 0.00 -0.46 0.00 0.00 0.00 178.15 178.16 2jad n ASN 316 N -3.03 0.02 0.00 1.72 2.04 0.38 -5.03 115.26 111.36 2jad n ASN 316 Ca -0.14 -0.73 0.00 0.00 -0.44 0.00 0.00 54.58 53.27 2jad n ASN 316 Cb 1.00 0.01 0.00 0.00 -2.53 0.00 0.00 39.78 38.26 2jad n ASN 316 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2jad n GLY 317 N 0.01 2.79 3.75 4.83 0.00 0.52 -5.00 105.19 112.10 2jad n GLY 317 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2jad n GLY 317 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jad s GLN 318 N -0.09 4.71 0.00 1.61 0.74 -1.26 -4.90 119.66 120.47 2jad s GLN 318 Ca 0.00 1.66 0.09 0.00 0.05 0.00 0.00 55.36 57.16 2jad s GLN 318 Cb 0.00 -3.25 -0.01 0.00 1.10 0.00 0.00 33.01 30.85 2jad s GLN 318 CO 0.00 0.29 0.60 0.54 -0.55 0.00 0.00 175.29 176.17 2jad n ARG 319 N 1.62 2.21 -4.38 1.67 1.74 -1.26 -3.33 116.66 114.94 2jad n ARG 319 Ca -0.00 -0.55 -0.25 0.00 -0.77 0.00 0.00 57.85 56.27 2jad n ARG 319 Cb 0.46 -1.05 -0.10 0.00 -1.02 0.00 0.00 32.46 30.75 2jad n ARG 319 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2jad s THR 320 N -1.32 2.79 0.07 0.55 -4.23 -1.26 -4.90 115.64 107.34 2jad s THR 320 Ca 0.08 -2.03 0.02 0.00 -1.18 0.00 0.00 61.69 58.58 2jad s THR 320 Cb 0.07 -2.42 -0.04 0.00 1.34 0.00 0.00 72.50 71.46 2jad s THR 320 CO 0.24 -0.24 0.13 0.68 -0.54 0.00 0.00 174.62 174.89 2jad s VAL 321 N -2.04 4.85 0.25 2.29 -7.23 -1.26 -4.02 120.40 113.24 2jad s VAL 321 Ca 0.26 -0.62 -0.30 0.00 -1.81 0.00 0.00 61.98 59.52 2jad s VAL 321 Cb -0.07 -3.35 -0.09 0.00 0.56 0.00 0.00 36.38 33.43 2jad s VAL 321 CO 0.14 0.13 1.14 -2.16 -0.31 0.00 0.00 175.10 174.05 2jad s PRO 322 N -2.43 4.57 -0.37 4.82 0.04 -1.26 -4.74 135.00 135.63 2jad s PRO 322 Ca 0.31 1.85 -0.01 0.00 0.04 0.00 0.00 61.00 63.19 2jad s PRO 322 Cb -0.12 -3.20 0.10 0.00 0.04 0.00 0.00 34.50 31.31 2jad s PRO 322 CO 0.24 0.08 0.14 1.21 0.04 0.00 0.00 177.00 178.71 2jad s ASN 323 N -0.49 5.09 0.04 6.66 3.04 -0.34 -4.06 114.94 124.89 2jad s ASN 323 Ca 0.48 -1.93 -0.01 0.00 0.04 0.00 0.00 52.86 51.43 2jad s ASN 323 Cb -0.33 -1.76 -0.04 0.00 -1.54 0.00 0.00 41.25 37.58 2jad s ASN 323 CO 0.40 -0.46 0.22 -0.63 -3.04 0.00 0.00 177.10 173.59 2jad s ILE 324 N 1.11 5.38 0.04 -5.21 1.01 0.13 -2.18 121.20 121.48 2jad s ILE 324 Ca 0.06 -0.27 -0.03 0.00 0.00 0.00 0.00 60.65 60.42 2jad s ILE 324 Cb -0.21 -3.60 -0.02 0.00 0.01 0.00 0.00 42.46 38.63 2jad s ILE 324 CO -0.05 0.19 0.03 -0.31 0.00 0.00 0.00 174.94 174.81 2jad s TYR 325 N -1.46 0.35 -0.13 3.97 1.51 -0.59 -1.17 117.35 119.82 2jad s TYR 325 Ca 0.33 -0.76 -0.06 0.00 -1.01 0.00 0.00 57.07 55.57 2jad s TYR 325 Cb -0.13 -0.25 0.06 0.00 -0.11 0.00 0.00 41.96 41.53 2jad s TYR 325 CO 0.25 -0.35 0.29 0.42 -1.11 0.00 0.00 175.55 175.04 2jad s ILE 326 N -3.07 -0.29 -1.57 2.71 1.01 0.11 -2.08 121.20 118.02 2jad s ILE 326 Ca -0.01 0.21 -0.14 0.00 0.00 0.00 0.00 60.65 60.71 2jad s ILE 326 Cb 0.02 -0.47 0.10 0.00 0.01 0.00 0.00 42.46 42.12 2jad s ILE 326 CO -0.07 0.09 0.86 -3.20 0.00 0.00 0.00 174.94 172.62 2jad n ASN 327 N 4.91 -3.75 0.00 3.58 4.05 0.15 -0.21 115.26 123.99 2jad n ASN 327 Ca -0.14 -0.88 0.00 0.00 0.45 0.00 0.00 54.58 54.01 2jad n ASN 327 Cb 0.51 -3.45 0.00 0.00 1.23 0.00 0.00 39.78 38.07 2jad n ASN 327 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2jad n GLY 328 N -1.61 2.69 3.73 8.20 0.00 -1.26 -5.00 105.19 111.94 2jad n GLY 328 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2jad n GLY 328 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jad s LYS 329 N -0.12 4.28 0.14 1.61 1.02 0.71 -4.97 119.74 122.40 2jad s LYS 329 Ca 0.00 0.33 -0.30 0.00 0.02 0.00 0.00 55.97 56.02 2jad s LYS 329 Cb 0.00 -3.42 -0.07 0.00 -0.52 0.00 0.00 37.83 33.83 2jad s LYS 329 CO 0.00 0.22 1.11 -1.58 -0.92 0.00 0.00 175.35 174.18 2jad s HIS 330 N 0.45 3.57 -0.20 3.18 5.65 -1.26 0.08 115.29 126.75 2jad s HIS 330 Ca 0.23 1.55 -0.08 0.00 0.25 0.00 0.00 55.06 57.01 2jad s HIS 330 Cb -0.15 -3.29 -0.10 0.00 -1.18 0.00 0.00 32.58 27.87 2jad s HIS 330 CO 0.08 -0.68 -0.25 -0.89 -0.65 0.00 0.00 174.74 172.36 2jad n ILE 331 N 2.84 1.13 0.00 0.89 -0.00 -0.32 -4.91 119.36 118.98 2jad n ILE 331 Ca 0.04 -0.32 0.00 0.00 -0.00 0.00 0.00 62.75 62.47 2jad n ILE 331 Cb 0.47 -1.65 0.00 0.00 -0.00 0.00 0.00 39.64 38.45 2jad n ILE 331 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2jad n GLY 332 N 1.89 0.31 0.00 7.39 0.00 -1.09 -4.81 105.19 108.88 2jad n GLY 332 Ca -0.39 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.41 2jad n GLY 332 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jad n GLY 333 N 0.00 5.00 0.17 -0.02 0.00 -1.26 -0.69 105.19 108.39 2jad n GLY 333 Ca 0.00 -2.01 -0.12 0.00 0.00 0.00 0.00 46.02 43.89 2jad n GLY 333 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2jad h ASN 334 N 0.00 0.51 -0.35 1.61 -1.24 -1.84 -1.81 115.58 112.45 2jad h ASN 334 Ca 0.00 -0.39 -0.00 0.00 0.71 0.00 0.00 56.30 56.62 2jad h ASN 334 Cb 0.00 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 38.89 2jad h ASN 334 CO 0.00 0.79 0.22 -2.24 -1.29 0.00 0.00 177.43 174.91 2jad h ASP 335 N 0.23 0.42 -0.36 1.15 3.04 -1.96 0.33 116.42 119.28 2jad h ASP 335 Ca 0.06 -0.02 -0.16 0.00 -3.24 0.00 0.00 57.03 53.68 2jad h ASP 335 Cb 0.58 -0.11 -0.01 0.00 -1.04 0.00 0.00 39.33 38.76 2jad h ASP 335 CO 0.03 0.32 -0.38 0.44 -2.04 0.00 0.00 179.24 177.62 2jad h ASP 336 N 0.50 0.97 -0.37 4.15 5.19 -1.85 0.14 116.42 125.14 2jad h ASP 336 Ca 0.13 -0.44 -0.09 0.00 -0.62 0.00 0.00 57.03 56.01 2jad h ASP 336 Cb -0.03 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 39.19 2jad h ASP 336 CO -0.03 1.23 -0.09 0.25 -3.12 0.00 0.00 179.24 177.49 2jad h LEU 337 N 0.75 0.79 -0.39 1.55 5.85 -0.21 -1.83 115.31 121.82 2jad h LEU 337 Ca 0.06 -0.23 -0.18 0.00 0.84 0.00 0.00 57.88 58.37 2jad h LEU 337 Cb 0.97 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.78 2jad h LEU 337 CO 0.09 0.91 -0.65 1.56 -0.34 0.00 0.00 178.44 180.01 2jad h GLN 338 N 0.73 0.59 0.03 1.25 1.08 -0.29 -2.14 115.11 116.37 2jad h GLN 338 Ca 0.13 -0.43 0.02 0.00 -1.45 0.00 0.00 58.65 56.92 2jad h GLN 338 Cb 0.57 0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 28.02 2jad h GLN 338 CO 0.04 1.05 -0.53 1.49 -0.95 0.00 0.00 178.83 179.92 2jad h GLU 339 N 0.43 -0.66 0.00 1.46 4.57 -0.29 -0.62 114.58 119.47 2jad h GLU 339 Ca -0.02 0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 2jad h GLU 339 Cb 1.23 0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 29.97 2jad h GLU 339 CO 0.12 -0.44 -0.04 -0.07 -1.18 0.00 0.00 179.01 177.40 2jad h LEU 340 N -0.69 0.00 -0.24 1.64 3.38 -1.32 -2.10 115.31 115.98 2jad h LEU 340 Ca 0.01 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 2jad h LEU 340 Cb 0.73 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 2jad h LEU 340 CO -0.34 0.04 -0.24 0.03 0.09 0.00 0.00 178.44 178.02 2jad h ARG 341 N 0.00 0.58 0.03 1.13 2.47 -0.46 0.25 114.38 118.39 2jad h ARG 341 Ca -0.00 -0.31 -0.00 0.00 -1.26 0.00 0.00 59.98 58.41 2jad h ARG 341 Cb 0.22 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.55 2jad h ARG 341 CO 0.01 0.90 -0.02 0.93 0.56 0.00 0.00 179.97 182.35 2jad h GLU 342 N 0.29 -0.04 0.00 0.04 5.08 -0.73 -2.97 114.58 116.24 2jad h GLU 342 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2jad h GLU 342 Cb 0.80 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.06 2jad h GLU 342 CO 0.06 0.55 0.00 0.25 -1.00 0.00 0.00 179.01 178.87 2jad n THR 343 N -4.81 1.19 -0.69 1.13 -2.24 -0.84 -4.79 114.28 103.23 2jad n THR 343 Ca -0.09 0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.99 2jad n THR 343 Cb 0.31 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 67.31 2jad n THR 343 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jad n GLY 344 N -0.96 1.60 0.30 3.38 0.00 -1.03 -4.90 105.19 103.58 2jad n GLY 344 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 2jad n GLY 344 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2jad h GLU 345 N 2.72 1.01 0.19 1.61 5.08 -1.45 -3.10 114.58 120.64 2jad h GLU 345 Ca 0.00 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2jad h GLU 345 Cb 0.00 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 28.99 2jad h GLU 345 CO 0.00 0.67 -0.28 1.25 -1.00 0.00 0.00 179.01 179.65 2jad h LEU 346 N 1.04 -0.77 -0.90 1.33 5.85 -0.87 -1.94 115.31 119.04 2jad h LEU 346 Ca 0.30 0.08 0.25 0.00 0.84 0.00 0.00 57.88 59.35 2jad h LEU 346 Cb -0.07 0.28 -0.15 0.00 0.37 0.00 0.00 40.66 41.09 2jad h LEU 346 CO -0.08 -0.38 0.25 -0.08 -0.34 0.00 0.00 178.44 177.80 2jad h GLU 347 N -0.54 0.18 0.00 1.25 4.81 -1.76 0.59 114.58 119.11 2jad h GLU 347 Ca 0.01 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.14 2jad h GLU 347 Cb 0.53 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 2jad h GLU 347 CO -0.11 0.12 -0.42 1.05 -0.73 0.00 0.00 179.01 178.91 2jad h GLU 348 N 0.19 0.00 -0.09 1.92 4.11 -1.49 -0.62 114.58 118.60 2jad h GLU 348 Ca 0.58 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.86 2jad h GLU 348 Cb 1.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 2jad h GLU 348 CO -0.68 0.42 -0.60 -0.07 0.07 0.00 0.00 179.01 178.15 2jad h LEU 349 N 0.00 0.34 0.00 3.06 3.38 0.86 -3.16 115.31 119.79 2jad h LEU 349 Ca -0.00 -0.20 -0.19 0.00 0.09 0.00 0.00 57.88 57.58 2jad h LEU 349 Cb 0.98 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 2jad h LEU 349 CO 0.05 0.86 -1.15 -0.07 0.09 0.00 0.00 178.44 178.22 2jad h LEU 350 N 0.23 0.00 -0.61 1.67 3.38 -0.85 -3.39 115.31 115.74 2jad h LEU 350 Ca -0.01 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.02 2jad h LEU 350 Cb 1.12 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.78 2jad h LEU 350 CO 0.10 0.75 -0.45 -0.08 0.09 0.00 0.00 178.44 178.84 2jad h GLU 351 N 0.00 -0.12 -0.23 1.13 4.81 -1.07 0.53 114.58 119.62 2jad h GLU 351 Ca -0.11 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.17 2jad h GLU 351 Cb 1.67 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 31.03 2jad h GLU 351 CO 0.08 -0.08 -0.04 -1.00 -0.73 0.00 0.00 179.01 177.23 2jad h PRO 352 N -0.12 0.02 -0.72 0.92 0.13 -1.75 -1.68 132.00 128.79 2jad h PRO 352 Ca 0.10 -0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.34 2jad h PRO 352 Cb 0.38 -0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.46 2jad h PRO 352 CO -0.63 0.01 0.48 0.82 -0.23 0.00 0.00 178.00 178.44 2jad h ILE 353 N 0.02 0.89 -0.02 -3.56 2.04 -1.38 -3.54 117.51 111.96 2jad h ILE 353 Ca 0.11 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.78 2jad h ILE 353 Cb 0.17 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 2jad h ILE 353 CO -0.23 0.10 0.00 0.18 0.00 0.00 0.00 178.15 178.20