#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jb3 h LEU 5 N 0.00 -0.80 -7.94 0.64 5.85 -2.02 -3.46 115.31 107.59 2jb3 h LEU 5 Ca 0.00 0.08 -0.10 0.00 0.84 0.00 0.00 57.88 58.70 2jb3 h LEU 5 Cb 0.00 0.28 -0.15 0.00 0.37 0.00 0.00 40.66 41.16 2jb3 h LEU 5 CO 0.00 -0.40 -0.48 0.27 -0.34 0.00 0.00 178.44 177.48 2jb3 s ILE 6 N -6.04 0.16 1.04 4.05 -4.36 -1.26 -4.99 121.20 109.79 2jb3 s ILE 6 Ca -0.16 -1.32 -0.14 0.00 -0.26 0.00 0.00 60.65 58.77 2jb3 s ILE 6 Cb 0.07 -1.29 0.21 0.00 1.25 0.00 0.00 42.46 42.70 2jb3 s ILE 6 CO 0.64 -0.73 1.10 -0.83 0.24 0.00 0.00 174.94 175.37 2jb3 s GLY 7 N -2.71 1.57 0.47 6.27 0.00 -1.26 -4.84 107.32 106.82 2jb3 s GLY 7 Ca 0.03 -0.53 -0.24 0.00 0.00 0.00 0.00 44.72 43.98 2jb3 s GLY 7 CO -0.09 0.14 1.33 0.54 0.00 0.00 0.00 173.10 175.02 2jb3 s LYS 8 N -5.10 3.59 0.01 2.90 -0.14 -1.26 -4.66 119.74 115.08 2jb3 s LYS 8 Ca 0.67 2.19 -0.16 0.00 -1.36 0.00 0.00 55.97 57.30 2jb3 s LYS 8 Cb -0.16 -2.51 -0.06 0.00 -1.68 0.00 0.00 37.83 33.42 2jb3 s LYS 8 CO 0.57 -0.81 0.46 0.54 -0.76 0.00 0.00 175.35 175.34 2jb3 s VAL 9 N -1.30 4.96 -0.05 3.17 0.11 0.19 -5.03 120.40 122.45 2jb3 s VAL 9 Ca 0.64 0.95 -0.24 0.00 -2.93 0.00 0.00 61.98 60.40 2jb3 s VAL 9 Cb -0.39 -3.77 -0.04 0.00 -1.53 0.00 0.00 36.38 30.65 2jb3 s VAL 9 CO 0.48 0.55 0.72 -0.54 -3.33 0.00 0.00 175.10 172.99 2jb3 s LYS 10 N -0.94 4.45 1.91 1.54 3.01 -1.26 -4.87 119.74 123.57 2jb3 s LYS 10 Ca 0.25 0.93 0.00 0.00 -1.01 0.00 0.00 55.97 56.15 2jb3 s LYS 10 Cb -0.17 -3.43 0.00 0.00 -1.01 0.00 0.00 37.83 33.21 2jb3 s LYS 10 CO 0.15 0.09 0.00 0.41 0.51 0.00 0.00 175.35 176.51 2jb3 n GLY 11 N 2.99 -1.28 3.69 -3.33 0.00 -1.26 -4.84 105.19 101.16 2jb3 n GLY 11 Ca -0.01 -1.26 -0.36 0.00 0.00 0.00 0.00 46.02 44.39 2jb3 n GLY 11 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jb3 s SER 12 N -4.00 6.21 -0.16 1.61 0.01 -1.26 -4.96 113.70 111.15 2jb3 s SER 12 Ca 0.00 0.23 -0.11 0.00 1.31 0.00 0.00 55.95 57.39 2jb3 s SER 12 Cb 0.00 -2.12 0.05 0.00 0.21 0.00 0.00 66.02 64.16 2jb3 s SER 12 CO 0.00 0.08 0.41 -1.00 0.41 0.00 0.00 173.24 173.14 2jb3 s HIS 13 N 0.83 -0.56 0.11 2.43 4.02 -1.26 -5.08 115.29 115.78 2jb3 s HIS 13 Ca 0.10 1.23 0.10 0.00 1.02 0.00 0.00 55.06 57.50 2jb3 s HIS 13 Cb -0.13 0.23 -0.04 0.00 -1.02 0.00 0.00 32.58 31.62 2jb3 s HIS 13 CO 0.03 -0.31 -0.23 -1.54 1.02 0.00 0.00 174.74 173.72 2jb3 s SER 14 N 1.07 3.57 -0.01 1.40 1.04 -1.26 -1.25 113.70 118.27 2jb3 s SER 14 Ca -0.07 -0.63 0.01 0.00 0.48 0.00 0.00 55.95 55.73 2jb3 s SER 14 Cb -0.07 -0.39 0.01 0.00 0.10 0.00 0.00 66.02 65.67 2jb3 s SER 14 CO -0.09 0.19 -0.02 -0.69 0.98 0.00 0.00 173.24 173.61 2jb3 s VAL 15 N -1.06 0.21 -0.16 5.02 1.01 0.05 -2.29 120.40 123.17 2jb3 s VAL 15 Ca 0.15 -0.06 -0.05 0.00 0.00 0.00 0.00 61.98 62.03 2jb3 s VAL 15 Cb -0.10 -0.22 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 2jb3 s VAL 15 CO 0.07 0.09 -0.01 0.54 0.00 0.00 0.00 175.10 175.79 2jb3 s VAL 16 N 0.27 4.17 -0.21 2.92 0.11 -0.61 -1.71 120.40 125.34 2jb3 s VAL 16 Ca -0.02 -0.26 -0.05 0.00 -2.93 0.00 0.00 61.98 58.72 2jb3 s VAL 16 Cb -0.05 -2.84 -0.02 0.00 -1.53 0.00 0.00 36.38 31.93 2jb3 s VAL 16 CO -0.01 0.48 0.00 -0.69 -3.33 0.00 0.00 175.10 171.56 2jb3 s VAL 17 N 0.36 3.88 -0.36 2.04 1.01 0.23 -1.36 120.40 126.20 2jb3 s VAL 17 Ca -0.02 -0.33 -0.16 0.00 0.00 0.00 0.00 61.98 61.47 2jb3 s VAL 17 Cb -0.14 -2.77 -0.00 0.00 0.00 0.00 0.00 36.38 33.47 2jb3 s VAL 17 CO 0.02 0.41 0.42 -0.76 0.00 0.00 0.00 175.10 175.19 2jb3 s LEU 18 N 1.21 4.50 0.00 3.92 1.02 -0.40 -0.82 118.68 128.12 2jb3 s LEU 18 Ca 0.03 -0.27 0.00 0.00 0.02 0.00 0.00 54.13 53.91 2jb3 s LEU 18 Cb -0.15 -2.42 0.00 0.00 0.02 0.00 0.00 46.19 43.65 2jb3 s LEU 18 CO 0.01 -0.43 0.00 0.61 0.02 0.00 0.00 176.35 176.56 2jb3 n GLY 19 N 4.95 1.56 2.26 -3.19 0.00 0.48 -1.14 105.19 110.11 2jb3 n GLY 19 Ca -0.08 -1.27 -0.31 0.00 0.00 0.00 0.00 46.02 44.37 2jb3 n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jb3 n GLY 20 N 2.89 6.05 0.00 -0.02 0.00 -1.26 -4.03 105.19 108.83 2jb3 n GLY 20 Ca 0.00 -2.46 0.00 0.00 0.00 0.00 0.00 46.02 43.56 2jb3 n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jb3 n GLY 21 N -0.81 -1.01 0.21 -0.02 0.00 -1.26 -1.18 105.19 101.11 2jb3 n GLY 21 Ca 0.55 -1.68 -0.02 0.00 0.00 0.00 0.00 46.02 44.87 2jb3 n GLY 21 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2jb3 h PRO 22 N 0.00 0.25 -0.71 1.61 0.11 -1.94 -0.46 132.00 130.86 2jb3 h PRO 22 Ca 0.00 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.08 2jb3 h PRO 22 Cb 0.00 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.02 2jb3 h PRO 22 CO 0.00 0.17 0.37 0.00 -0.21 0.00 0.00 178.00 178.33 2jb3 h ALA 23 N 1.40 0.91 -0.10 -0.75 0.00 -1.93 -1.22 119.26 117.56 2jb3 h ALA 23 Ca 0.26 -0.12 -0.22 0.00 0.00 0.00 0.00 54.91 54.82 2jb3 h ALA 23 Cb 0.35 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.87 2jb3 h ALA 23 CO -0.33 0.44 -0.83 0.78 0.00 0.00 0.00 179.25 179.31 2jb3 h GLY 24 N 0.98 0.75 0.97 0.00 0.00 -1.61 -0.95 103.07 103.21 2jb3 h GLY 24 Ca 0.25 -1.12 -0.16 0.00 0.00 0.00 0.00 47.33 46.29 2jb3 h GLY 24 CO -0.04 1.00 -0.54 1.41 0.00 0.00 0.00 176.54 178.37 2jb3 h LEU 25 N 0.45 0.73 -0.57 3.11 3.38 -1.07 -0.92 115.31 120.43 2jb3 h LEU 25 Ca -0.06 -0.61 0.04 0.00 0.09 0.00 0.00 57.88 57.34 2jb3 h LEU 25 Cb 1.45 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.94 2jb3 h LEU 25 CO 0.16 1.22 0.32 0.00 0.09 0.00 0.00 178.44 180.23 2jb3 h SER 27 N 0.62 -1.03 -0.40 0.00 0.02 -0.98 -1.20 113.55 110.57 2jb3 h SER 27 Ca 0.24 0.07 0.08 0.00 -0.84 0.00 0.00 61.79 61.35 2jb3 h SER 27 Cb 0.09 0.32 -0.09 0.00 0.14 0.00 0.00 62.40 62.87 2jb3 h SER 27 CO -0.14 -0.58 -0.28 0.00 -1.14 0.00 0.00 176.83 174.70 2jb3 h ALA 28 N -0.56 -0.07 -0.41 3.77 0.00 -0.97 -1.22 119.26 119.79 2jb3 h ALA 28 Ca -0.06 0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.06 2jb3 h ALA 28 Cb 0.75 0.62 -0.09 0.00 0.00 0.00 0.00 17.79 19.08 2jb3 h ALA 28 CO 0.01 -0.66 -0.31 0.35 0.00 0.00 0.00 179.25 178.64 2jb3 h PHE 29 N -0.21 -0.84 -0.30 0.00 3.57 -0.82 -0.66 116.94 117.69 2jb3 h PHE 29 Ca 0.18 0.06 -0.14 0.00 3.53 0.00 0.00 57.97 61.60 2jb3 h PHE 29 Cb 0.51 0.43 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 2jb3 h PHE 29 CO -0.50 -0.37 -0.38 0.93 -2.23 0.00 0.00 178.31 175.76 2jb3 h GLU 30 N -0.23 0.70 -0.47 1.11 4.39 -1.11 -2.54 114.58 116.42 2jb3 h GLU 30 Ca 0.18 -0.35 -0.05 0.00 0.34 0.00 0.00 59.36 59.48 2jb3 h GLU 30 Cb 0.53 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.16 2jb3 h GLU 30 CO -0.54 0.96 0.09 -0.07 -1.16 0.00 0.00 179.01 178.29 2jb3 h LEU 31 N 0.57 0.74 -0.09 1.33 3.38 -1.12 -2.67 115.31 117.45 2jb3 h LEU 31 Ca 0.05 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.79 2jb3 h LEU 31 Cb 0.92 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 2jb3 h LEU 31 CO 0.08 0.81 -0.05 1.56 0.09 0.00 0.00 178.44 180.93 2jb3 h GLN 32 N 0.65 -0.04 -0.98 1.13 4.20 -1.08 -1.73 115.11 117.27 2jb3 h GLN 32 Ca 0.15 0.00 0.22 0.00 0.06 0.00 0.00 58.65 59.08 2jb3 h GLN 32 Cb 0.37 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.08 2jb3 h GLN 32 CO 0.01 -0.03 0.63 0.87 -0.67 0.00 0.00 178.83 179.64 2jb3 h LYS 33 N -0.04 0.45 -0.00 1.46 1.57 -1.30 -1.79 116.57 116.91 2jb3 h LYS 33 Ca 0.06 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2jb3 h LYS 33 Cb 0.13 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.33 2jb3 h LYS 33 CO -0.12 0.30 -0.06 0.00 -0.57 0.00 0.00 179.45 178.99 2jb3 n ALA 34 N -2.47 2.64 0.00 3.86 0.00 -0.88 -4.88 120.51 118.78 2jb3 n ALA 34 Ca 0.22 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2jb3 n ALA 34 Cb 0.75 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.79 2jb3 n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jb3 n GLY 35 N 1.29 0.83 3.80 0.00 0.00 -0.67 0.55 105.19 110.99 2jb3 n GLY 35 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 2jb3 n GLY 35 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jb3 s TYR 36 N -2.00 3.03 -0.09 1.61 2.02 -0.70 -4.77 117.35 116.45 2jb3 s TYR 36 Ca 0.00 1.57 -0.27 0.00 -0.37 0.00 0.00 57.07 58.00 2jb3 s TYR 36 Cb 0.00 -3.04 -0.02 0.00 -0.40 0.00 0.00 41.96 38.50 2jb3 s TYR 36 CO 0.00 -0.78 0.90 0.21 -1.57 0.00 0.00 175.55 174.31 2jb3 s LYS 37 N -3.30 4.43 0.02 -0.62 2.47 -0.38 -4.27 119.74 118.09 2jb3 s LYS 37 Ca 0.66 1.21 0.03 0.00 -1.56 0.00 0.00 55.97 56.31 2jb3 s LYS 37 Cb -0.15 -3.51 -0.02 0.00 -1.46 0.00 0.00 37.83 32.69 2jb3 s LYS 37 CO 0.21 -0.18 -0.10 0.08 0.16 0.00 0.00 175.35 175.51 2jb3 s VAL 38 N 1.56 0.81 -0.05 4.02 1.01 -1.26 -0.77 120.40 125.72 2jb3 s VAL 38 Ca 0.45 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.64 2jb3 s VAL 38 Cb -0.18 -0.75 0.02 0.00 0.00 0.00 0.00 36.38 35.47 2jb3 s VAL 38 CO 0.19 -0.03 -0.04 -0.89 0.00 0.00 0.00 175.10 174.34 2jb3 s THR 39 N -0.74 0.52 -0.17 3.92 2.01 -0.69 -4.82 115.64 115.66 2jb3 s THR 39 Ca -0.01 -0.08 -0.08 0.00 0.31 0.00 0.00 61.69 61.83 2jb3 s THR 39 Cb -0.07 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.83 2jb3 s THR 39 CO 0.01 0.23 0.09 -0.69 -0.69 0.00 0.00 174.62 173.57 2jb3 s VAL 40 N 1.11 5.05 -0.33 3.82 1.01 0.63 -0.60 120.40 131.10 2jb3 s VAL 40 Ca -0.08 0.05 -0.03 0.00 0.00 0.00 0.00 61.98 61.93 2jb3 s VAL 40 Cb -0.14 -3.27 0.06 0.00 0.00 0.00 0.00 36.38 33.04 2jb3 s VAL 40 CO -0.01 0.49 0.07 -0.76 0.00 0.00 0.00 175.10 174.88 2jb3 s LEU 41 N 0.10 4.28 -0.10 3.92 1.43 0.00 0.24 118.68 128.54 2jb3 s LEU 41 Ca 0.07 -1.40 0.01 0.00 -1.03 0.00 0.00 54.13 51.78 2jb3 s LEU 41 Cb -0.12 -1.77 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 2jb3 s LEU 41 CO 0.00 -0.33 -0.14 -0.70 0.23 0.00 0.00 176.35 175.40 2jb3 s GLU 42 N 1.26 3.09 0.19 1.70 2.56 0.14 -0.39 118.70 127.26 2jb3 s GLU 42 Ca -0.02 -0.70 0.00 0.00 0.00 0.00 0.00 54.97 54.25 2jb3 s GLU 42 Cb -0.20 -2.53 0.11 0.00 2.00 0.00 0.00 34.13 33.51 2jb3 s GLU 42 CO -0.01 0.34 1.47 0.00 -0.56 0.00 0.00 175.26 176.50 2jb3 h ALA 43 N 6.29 0.67 -1.73 6.30 0.00 -1.77 0.67 119.26 129.70 2jb3 h ALA 43 Ca -0.32 -0.58 -0.45 0.00 0.00 0.00 0.00 54.91 53.56 2jb3 h ALA 43 Cb 1.20 -0.07 0.15 0.00 0.00 0.00 0.00 17.79 19.06 2jb3 h ALA 43 CO 0.54 0.75 0.34 1.03 0.00 0.00 0.00 179.25 181.90 2jb3 s ARG 44 N -3.69 0.75 0.00 0.00 0.52 -1.26 -3.60 118.95 111.68 2jb3 s ARG 44 Ca -0.05 -0.70 0.21 0.00 -0.52 0.00 0.00 55.73 54.67 2jb3 s ARG 44 Cb 0.11 -1.97 0.22 0.00 0.52 0.00 0.00 34.95 33.83 2jb3 s ARG 44 CO 0.83 -2.26 1.21 0.25 0.02 0.00 0.00 175.30 175.35 2jb3 n THR 45 N -3.57 0.13 -4.44 0.02 -2.24 -1.26 -0.96 114.28 101.97 2jb3 n THR 45 Ca 0.16 -0.56 -0.22 0.00 -2.27 0.00 0.00 64.05 61.16 2jb3 n THR 45 Cb 0.60 1.32 -0.10 0.00 -2.10 0.00 0.00 70.33 70.05 2jb3 n THR 45 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jb3 s ARG 46 N -1.67 1.58 0.05 -0.78 1.70 -1.26 -4.95 118.95 113.62 2jb3 s ARG 46 Ca 0.27 -1.72 -0.19 0.00 -0.47 0.00 0.00 55.73 53.62 2jb3 s ARG 46 Cb 0.18 -1.56 -0.06 0.00 -0.57 0.00 0.00 34.95 32.94 2jb3 s ARG 46 CO 0.27 0.27 0.54 -1.25 -1.08 0.00 0.00 175.30 174.05 2jb3 s PRO 47 N -3.56 4.16 0.00 3.89 0.04 -1.26 -4.68 135.00 133.59 2jb3 s PRO 47 Ca 0.28 0.67 0.00 0.00 0.04 0.00 0.00 61.00 61.99 2jb3 s PRO 47 Cb -0.03 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.26 2jb3 s PRO 47 CO 0.13 0.62 0.00 0.41 0.04 0.00 0.00 177.00 178.20 2jb3 n GLY 48 N 1.82 1.25 7.00 0.56 0.00 -0.33 -4.77 105.19 110.72 2jb3 n GLY 48 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2jb3 n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jb3 n GLY 49 N 0.00 3.68 0.00 -0.02 0.00 -1.26 -0.61 105.19 106.98 2jb3 n GLY 49 Ca 0.00 0.10 0.06 0.00 0.00 0.00 0.00 46.02 46.18 2jb3 n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jb3 n ARG 50 N 14.00 0.26 -3.18 1.61 1.74 -1.26 -4.07 116.66 125.77 2jb3 n ARG 50 Ca 0.00 0.11 -0.45 0.00 -0.77 0.00 0.00 57.85 56.73 2jb3 n ARG 50 Cb 0.00 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 29.90 2jb3 n ARG 50 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2jb3 s VAL 51 N -2.35 4.99 -0.05 1.55 1.01 0.22 -3.30 120.40 122.46 2jb3 s VAL 51 Ca 0.14 -1.29 -0.01 0.00 0.00 0.00 0.00 61.98 60.83 2jb3 s VAL 51 Cb 0.08 -4.46 0.03 0.00 0.00 0.00 0.00 36.38 32.03 2jb3 s VAL 51 CO 0.17 -1.07 0.01 0.86 0.00 0.00 0.00 175.10 175.07 2jb3 s TRP 52 N 2.17 0.49 -0.19 5.22 -0.00 -1.26 -4.52 118.94 120.85 2jb3 s TRP 52 Ca 0.11 -0.06 -0.04 0.00 -0.00 0.00 0.00 56.10 56.10 2jb3 s TRP 52 Cb -0.24 -0.65 -0.02 0.00 -0.00 0.00 0.00 33.47 32.56 2jb3 s TRP 52 CO 0.03 -0.25 -0.02 0.99 -0.00 0.00 0.00 176.95 177.71 2jb3 s THR 53 N 1.70 3.89 -0.28 5.86 2.01 -1.26 -0.52 115.64 127.04 2jb3 s THR 53 Ca 0.00 -0.34 -0.20 0.00 0.31 0.00 0.00 61.69 61.46 2jb3 s THR 53 Cb -0.13 -2.74 -0.02 0.00 0.01 0.00 0.00 72.50 69.63 2jb3 s THR 53 CO -0.04 0.45 0.59 0.00 -0.69 0.00 0.00 174.62 174.94 2jb3 s ALA 54 N 0.82 3.57 0.28 7.40 0.00 0.09 -4.95 121.76 128.97 2jb3 s ALA 54 Ca -0.00 -0.57 0.02 0.00 0.00 0.00 0.00 51.96 51.41 2jb3 s ALA 54 Cb -0.14 -3.01 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 2jb3 s ALA 54 CO 0.02 -0.89 0.16 -0.98 0.00 0.00 0.00 175.76 174.07 2jb3 s ARG 55 N 2.48 1.51 -0.31 0.00 1.70 -1.26 -2.46 118.95 120.61 2jb3 s ARG 55 Ca 0.24 -1.85 -0.41 0.00 -0.47 0.00 0.00 55.73 53.24 2jb3 s ARG 55 Cb -0.15 -0.00 -0.17 0.00 -0.57 0.00 0.00 34.95 34.06 2jb3 s ARG 55 CO 0.10 -0.44 1.70 0.41 -1.08 0.00 0.00 175.30 175.99 2jb3 n GLY 56 N -0.51 0.70 0.00 3.88 0.00 -1.23 -0.33 105.19 107.70 2jb3 n GLY 56 Ca 0.02 0.94 0.00 0.00 0.00 0.00 0.00 46.02 46.98 2jb3 n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jb3 n GLY 57 N 4.08 1.97 3.68 -0.02 0.00 -0.38 -4.95 105.19 109.57 2jb3 n GLY 57 Ca 0.27 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.84 2jb3 n GLY 57 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jb3 n SER 58 N 0.00 3.28 -4.10 1.61 7.64 0.55 -4.79 113.62 117.81 2jb3 n SER 58 Ca 0.00 1.07 -0.26 0.00 1.01 0.00 0.00 58.87 60.69 2jb3 n SER 58 Cb 0.00 -1.45 -0.16 0.00 -1.01 0.00 0.00 64.21 61.59 2jb3 n SER 58 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2jb3 s GLU 59 N 1.18 1.79 -0.01 1.43 2.12 -1.26 0.27 118.70 124.21 2jb3 s GLU 59 Ca 0.79 -0.56 -0.00 0.00 0.36 0.00 0.00 54.97 55.56 2jb3 s GLU 59 Cb -0.65 -1.52 0.02 0.00 0.26 0.00 0.00 34.13 32.24 2jb3 s GLU 59 CO 0.38 0.18 0.02 -2.00 -0.54 0.00 0.00 175.26 173.30 2jb3 s GLU 60 N 0.22 -0.01 -0.26 4.30 2.56 -0.53 -5.00 118.70 119.98 2jb3 s GLU 60 Ca -0.07 0.12 -0.07 0.00 0.00 0.00 0.00 54.97 54.95 2jb3 s GLU 60 Cb -0.13 -0.14 -0.01 0.00 2.00 0.00 0.00 34.13 35.85 2jb3 s GLU 60 CO 0.03 -0.10 0.05 0.99 -0.56 0.00 0.00 175.26 175.68 2jb3 s THR 61 N 0.62 4.06 0.82 -1.70 2.01 -1.26 -0.43 115.64 119.75 2jb3 s THR 61 Ca -0.05 -0.37 -0.07 0.00 0.31 0.00 0.00 61.69 61.51 2jb3 s THR 61 Cb -0.07 -2.94 0.16 0.00 0.01 0.00 0.00 72.50 69.65 2jb3 s THR 61 CO -0.02 0.28 1.13 1.51 -0.69 0.00 0.00 174.62 176.83 2jb3 s ASP 62 N 1.56 3.85 0.00 3.53 1.47 0.11 -4.71 116.67 122.48 2jb3 s ASP 62 Ca 0.05 -0.10 0.15 0.00 1.18 0.00 0.00 52.55 53.84 2jb3 s ASP 62 Cb -0.16 -0.15 0.67 0.00 -0.34 0.00 0.00 42.92 42.95 2jb3 s ASP 62 CO 0.02 -2.22 1.49 0.18 0.68 0.00 0.00 175.17 175.32 2jb3 n LEU 63 N -3.22 0.00 -0.34 2.11 4.77 -0.31 -0.33 117.00 119.68 2jb3 n LEU 63 Ca 0.15 0.48 0.14 0.00 -0.03 0.00 0.00 56.01 56.75 2jb3 n LEU 63 Cb 0.60 -0.48 0.51 0.00 -2.33 0.00 0.00 43.42 41.72 2jb3 n LEU 63 CO 0.44 -0.23 0.82 -1.20 -1.33 0.00 0.00 177.39 175.89 2jb3 n SER 64 N -1.48 1.15 0.00 -1.43 7.64 -1.26 -4.96 113.62 113.27 2jb3 n SER 64 Ca 0.04 -1.17 0.00 0.00 1.01 0.00 0.00 58.87 58.75 2jb3 n SER 64 Cb 0.18 0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 2jb3 n SER 64 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jb3 n GLY 65 N 1.23 0.61 3.73 0.23 0.00 0.55 -5.03 105.19 106.51 2jb3 n GLY 65 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 2jb3 n GLY 65 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jb3 s GLU 66 N -0.12 4.53 -0.23 1.61 2.12 -1.26 -4.79 118.70 120.56 2jb3 s GLU 66 Ca 0.00 1.16 -0.06 0.00 0.36 0.00 0.00 54.97 56.43 2jb3 s GLU 66 Cb 0.00 -3.41 -0.02 0.00 0.26 0.00 0.00 34.13 30.96 2jb3 s GLU 66 CO 0.00 0.15 0.03 0.99 -0.54 0.00 0.00 175.26 175.89 2jb3 s THR 67 N 0.38 4.06 -0.09 -1.70 2.01 -1.26 -0.72 115.64 118.32 2jb3 s THR 67 Ca 0.43 -0.26 -0.02 0.00 0.31 0.00 0.00 61.69 62.15 2jb3 s THR 67 Cb -0.20 -2.88 -0.03 0.00 0.01 0.00 0.00 72.50 69.40 2jb3 s THR 67 CO 0.24 0.38 -0.00 -1.10 -0.69 0.00 0.00 174.62 173.44 2jb3 s GLN 68 N 1.44 2.98 -0.24 4.92 -0.21 0.43 -4.98 119.66 124.00 2jb3 s GLN 68 Ca 0.05 -0.42 0.01 0.00 0.02 0.00 0.00 55.36 55.03 2jb3 s GLN 68 Cb -0.15 -2.79 0.04 0.00 1.00 0.00 0.00 33.01 31.12 2jb3 s GLN 68 CO 0.02 0.69 -0.11 0.15 -2.12 0.00 0.00 175.29 173.92 2jb3 s LYS 69 N -0.85 2.55 0.05 2.91 1.02 -1.26 -1.46 119.74 122.70 2jb3 s LYS 69 Ca 0.13 -1.15 -0.30 0.00 0.02 0.00 0.00 55.97 54.67 2jb3 s LYS 69 Cb -0.11 -2.86 -0.05 0.00 -0.52 0.00 0.00 37.83 34.28 2jb3 s LYS 69 CO 0.02 -0.46 1.13 0.00 -0.92 0.00 0.00 175.35 175.13 2jb3 n THR 71 N 3.79 1.69 -1.62 0.00 -2.24 -1.26 -1.25 114.28 113.39 2jb3 n THR 71 Ca 0.08 -2.36 -0.39 0.00 -2.27 0.00 0.00 64.05 59.10 2jb3 n THR 71 Cb 0.48 -0.07 0.03 0.00 -2.10 0.00 0.00 70.33 68.67 2jb3 n THR 71 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2jb3 n PHE 72 N -1.02 1.06 -1.50 4.78 3.72 -1.26 -4.85 117.46 118.40 2jb3 n PHE 72 Ca 0.15 0.48 -0.36 0.00 -0.05 0.00 0.00 57.45 57.67 2jb3 n PHE 72 Cb 0.71 -2.19 0.08 0.00 -0.94 0.00 0.00 39.48 37.14 2jb3 n PHE 72 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2jb3 n SER 73 N -0.16 1.34 -4.70 4.37 7.64 -1.26 -3.50 113.62 117.35 2jb3 n SER 73 Ca 0.11 0.74 -0.44 0.00 1.01 0.00 0.00 58.87 60.29 2jb3 n SER 73 Cb 0.44 -1.49 -0.02 0.00 -1.01 0.00 0.00 64.21 62.12 2jb3 n SER 73 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2jb3 n GLU 74 N -2.10 2.25 0.00 1.43 2.13 -1.26 -0.69 120.64 122.40 2jb3 n GLU 74 Ca 0.15 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.77 2jb3 n GLU 74 Cb 0.49 -2.48 0.00 0.00 0.27 0.00 0.00 31.44 29.71 2jb3 n GLU 74 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jb3 n GLY 75 N 1.96 3.06 3.87 8.31 0.00 -1.26 -5.03 105.19 116.10 2jb3 n GLY 75 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 2jb3 n GLY 75 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jb3 s HIS 76 N -2.02 3.63 0.16 1.61 3.76 0.13 -5.03 115.29 117.54 2jb3 s HIS 76 Ca 0.00 0.63 -0.24 0.00 -0.15 0.00 0.00 55.06 55.30 2jb3 s HIS 76 Cb 0.00 -2.02 0.06 0.00 1.11 0.00 0.00 32.58 31.73 2jb3 s HIS 76 CO 0.00 0.71 0.82 -0.59 -0.85 0.00 0.00 174.74 174.83 2jb3 s PHE 77 N -1.05 -0.25 0.05 1.40 -0.12 -1.26 -4.37 117.98 112.37 2jb3 s PHE 77 Ca 0.18 -0.05 -0.03 0.00 -0.05 0.00 0.00 56.93 56.98 2jb3 s PHE 77 Cb -0.13 0.63 -0.03 0.00 -0.63 0.00 0.00 43.02 42.86 2jb3 s PHE 77 CO 0.07 -0.90 0.02 1.52 -0.05 0.00 0.00 175.22 175.87 2jb3 s TYR 78 N -3.52 0.41 -0.42 3.49 -0.85 -1.03 -4.82 117.35 110.62 2jb3 s TYR 78 Ca 0.09 -0.91 -0.24 0.00 -0.52 0.00 0.00 57.07 55.49 2jb3 s TYR 78 Cb -0.03 -0.30 0.02 0.00 0.38 0.00 0.00 41.96 42.03 2jb3 s TYR 78 CO -0.01 -0.40 0.84 -0.80 -1.52 0.00 0.00 175.55 173.66 2jb3 s ASN 79 N -2.76 6.50 0.30 -0.18 0.02 -1.26 -0.73 114.94 116.82 2jb3 s ASN 79 Ca 0.04 0.15 0.15 0.00 -1.02 0.00 0.00 52.86 52.18 2jb3 s ASN 79 Cb 0.06 -2.41 0.30 0.00 0.02 0.00 0.00 41.25 39.21 2jb3 s ASN 79 CO -0.09 -0.90 1.55 0.58 0.02 0.00 0.00 177.10 178.26 2jb3 h VAL 80 N 5.93 1.01 0.00 1.60 2.07 -1.17 -3.45 116.25 122.25 2jb3 h VAL 80 Ca -0.24 -2.08 0.00 0.00 0.82 0.00 0.00 66.70 65.19 2jb3 h VAL 80 Cb 1.08 2.26 0.00 0.00 -1.52 0.00 0.00 31.29 33.12 2jb3 h VAL 80 CO 0.97 0.51 0.00 0.61 0.02 0.00 0.00 177.57 179.68 2jb3 n GLY 81 N 0.78 1.17 3.69 2.17 0.00 -1.17 -4.66 105.19 107.17 2jb3 n GLY 81 Ca 0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 2jb3 n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jb3 n ALA 82 N -3.00 1.70 0.00 4.61 0.00 -1.21 -4.89 120.51 117.72 2jb3 n ALA 82 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.86 2jb3 n ALA 82 Cb 0.00 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.08 2jb3 n ALA 82 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2jb3 n THR 83 N 2.94 0.00 -3.82 0.00 5.66 -1.26 -4.68 114.28 113.12 2jb3 n THR 83 Ca 0.14 -0.02 -0.12 0.00 -3.05 0.00 0.00 64.05 61.00 2jb3 n THR 83 Cb 0.31 0.27 -0.10 0.00 -1.55 0.00 0.00 70.33 69.26 2jb3 n THR 83 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2jb3 s ARG 84 N -0.60 0.46 -0.05 1.09 1.70 -1.26 -4.66 118.95 115.62 2jb3 s ARG 84 Ca 0.00 -0.14 0.00 0.00 -0.47 0.00 0.00 55.73 55.12 2jb3 s ARG 84 Cb 0.00 0.20 0.02 0.00 -0.57 0.00 0.00 34.95 34.60 2jb3 s ARG 84 CO 0.00 -0.11 -0.02 0.42 -1.08 0.00 0.00 175.30 174.51 2jb3 s ILE 85 N -0.92 0.44 0.79 4.99 1.01 0.80 -4.95 121.20 123.36 2jb3 s ILE 85 Ca -0.10 -0.01 -0.12 0.00 0.00 0.00 0.00 60.65 60.42 2jb3 s ILE 85 Cb -0.05 -0.53 0.07 0.00 0.01 0.00 0.00 42.46 41.96 2jb3 s ILE 85 CO 0.02 0.23 1.11 -2.16 0.00 0.00 0.00 174.94 174.14 2jb3 s PRO 86 N 1.33 2.15 0.34 2.79 0.04 -1.26 -0.83 135.00 139.56 2jb3 s PRO 86 Ca -0.05 0.49 0.13 0.00 0.04 0.00 0.00 61.00 61.61 2jb3 s PRO 86 Cb -0.13 -1.94 0.61 0.00 0.04 0.00 0.00 34.50 33.08 2jb3 s PRO 86 CO -0.02 -1.54 1.75 1.96 0.04 0.00 0.00 177.00 179.19 2jb3 h GLN 87 N -1.03 0.00 0.00 4.56 4.20 -1.91 -2.55 115.11 118.39 2jb3 h GLN 87 Ca -0.47 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.24 2jb3 h GLN 87 Cb 1.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.06 2jb3 h GLN 87 CO 0.62 0.45 0.00 0.66 -0.67 0.00 0.00 178.83 179.89 2jb3 h SER 88 N 0.00 0.00 -3.66 1.46 4.64 -1.94 -3.47 113.55 110.59 2jb3 h SER 88 Ca -0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 2jb3 h SER 88 Cb 0.83 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.89 2jb3 h SER 88 CO 0.06 0.00 0.27 -1.00 -0.87 0.00 0.00 176.83 175.29 2jb3 s HIS 89 N -3.31 3.93 0.08 4.77 3.76 -0.96 -4.95 115.29 118.60 2jb3 s HIS 89 Ca 0.06 1.78 0.32 0.00 -0.15 0.00 0.00 55.06 57.06 2jb3 s HIS 89 Cb 0.10 -2.88 1.56 0.00 1.11 0.00 0.00 32.58 32.47 2jb3 s HIS 89 CO 0.48 0.47 1.97 0.97 -0.85 0.00 0.00 174.74 177.78 2jb3 h ILE 90 N 3.18 0.00 -1.00 0.60 2.10 -1.90 -2.57 117.51 117.93 2jb3 h ILE 90 Ca -0.46 -0.18 0.23 0.00 1.08 0.00 0.00 64.86 65.53 2jb3 h ILE 90 Cb 1.20 1.01 -0.10 0.00 -1.09 0.00 0.00 36.82 37.84 2jb3 h ILE 90 CO 0.67 0.00 0.63 0.74 -1.08 0.00 0.00 178.15 179.11 2jb3 h THR 91 N 0.00 0.61 -0.40 2.19 2.02 -1.92 0.29 112.91 115.69 2jb3 h THR 91 Ca 0.00 -0.18 -0.11 0.00 0.77 0.00 0.00 66.41 66.88 2jb3 h THR 91 Cb 0.21 0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.64 2jb3 h THR 91 CO 0.00 0.10 -0.21 -0.07 0.37 0.00 0.00 175.52 175.70 2jb3 h LEU 92 N 0.53 0.81 -0.76 2.58 3.38 -1.79 -0.30 115.31 119.75 2jb3 h LEU 92 Ca 0.57 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 58.17 2jb3 h LEU 92 Cb 1.23 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 2jb3 h LEU 92 CO -0.32 1.00 -0.06 0.44 0.09 0.00 0.00 178.44 179.59 2jb3 h ASP 93 N 0.70 0.86 -0.33 -0.43 3.32 -1.15 -1.48 116.42 117.91 2jb3 h ASP 93 Ca 0.10 -0.25 -0.14 0.00 0.02 0.00 0.00 57.03 56.76 2jb3 h ASP 93 Cb 0.73 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 2jb3 h ASP 93 CO 0.06 0.96 -0.31 1.88 -1.72 0.00 0.00 179.24 180.11 2jb3 h TYR 94 N 0.80 1.00 -0.97 4.55 0.05 -0.85 -0.62 116.97 120.93 2jb3 h TYR 94 Ca 0.14 -0.27 0.10 0.00 0.05 0.00 0.00 58.73 58.75 2jb3 h TYR 94 Cb 0.56 -0.22 -0.07 0.00 1.01 0.00 0.00 36.73 38.00 2jb3 h TYR 94 CO 0.03 1.05 0.62 0.00 -1.05 0.00 0.00 178.16 178.81 2jb3 h ARG 96 N 1.01 -0.20 -0.24 0.00 2.43 -0.90 -0.14 114.38 116.33 2jb3 h ARG 96 Ca 0.45 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.66 2jb3 h ARG 96 Cb 0.37 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 2jb3 h ARG 96 CO -0.21 0.05 0.16 1.49 -1.51 0.00 0.00 179.97 179.95 2jb3 h GLU 97 N -0.44 0.19 -0.00 0.20 4.81 -0.75 -2.56 114.58 116.02 2jb3 h GLU 97 Ca -0.02 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2jb3 h GLU 97 Cb 0.35 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.68 2jb3 h GLU 97 CO 0.04 0.13 -0.73 1.28 -0.73 0.00 0.00 179.01 178.99 2jb3 n LEU 98 N -4.50 0.85 -0.60 1.64 4.77 -0.21 -4.95 117.00 114.00 2jb3 n LEU 98 Ca 0.02 -0.29 -0.06 0.00 -0.03 0.00 0.00 56.01 55.65 2jb3 n LEU 98 Cb 0.17 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 2jb3 n LEU 98 CO 0.35 0.20 -0.07 0.61 -1.33 0.00 0.00 177.39 177.15 2jb3 n GLY 99 N 1.49 0.27 3.48 -0.72 0.00 -0.44 -4.98 105.19 104.28 2jb3 n GLY 99 Ca 0.05 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 2jb3 n GLY 99 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jb3 s VAL 100 N -2.27 4.84 0.36 1.61 1.01 -0.19 -5.03 120.40 120.72 2jb3 s VAL 100 Ca 0.00 -0.20 -0.28 0.00 0.00 0.00 0.00 61.98 61.50 2jb3 s VAL 100 Cb 0.00 -4.26 -0.11 0.00 0.00 0.00 0.00 36.38 32.02 2jb3 s VAL 100 CO 0.00 -0.72 1.41 -1.61 0.00 0.00 0.00 175.10 174.18 2jb3 s GLU 101 N 2.75 4.22 0.33 2.72 0.41 -1.26 -4.61 118.70 123.26 2jb3 s GLU 101 Ca 0.19 2.42 0.09 0.00 -0.41 0.00 0.00 54.97 57.25 2jb3 s GLU 101 Cb -0.17 -3.01 -0.05 0.00 -1.78 0.00 0.00 34.13 29.12 2jb3 s GLU 101 CO 0.15 -0.39 0.08 0.96 -0.49 0.00 0.00 175.26 175.57 2jb3 s ILE 102 N -1.10 2.92 0.11 -1.63 -4.36 -1.26 -0.99 121.20 114.89 2jb3 s ILE 102 Ca 0.51 -1.82 -0.07 0.00 -0.26 0.00 0.00 60.65 59.01 2jb3 s ILE 102 Cb -0.44 -2.90 -0.01 0.00 1.25 0.00 0.00 42.46 40.37 2jb3 s ILE 102 CO 0.58 -0.21 0.18 0.00 0.24 0.00 0.00 174.94 175.74 2jb3 s GLN 103 N -3.78 0.90 0.30 0.37 -2.07 0.19 -4.74 119.66 110.84 2jb3 s GLN 103 Ca 0.36 -1.07 -0.29 0.00 -1.82 0.00 0.00 55.36 52.53 2jb3 s GLN 103 Cb -0.02 0.33 -0.11 0.00 -1.09 0.00 0.00 33.01 32.13 2jb3 s GLN 103 CO 0.21 -0.29 1.45 0.20 -1.32 0.00 0.00 175.29 175.54 2jb3 s GLY 104 N -2.91 2.57 -0.22 2.60 0.00 -1.26 -1.19 107.32 106.91 2jb3 s GLY 104 Ca 0.10 1.41 -0.08 0.00 0.00 0.00 0.00 44.72 46.15 2jb3 s GLY 104 CO -0.07 2.24 0.08 -0.12 0.00 0.00 0.00 173.10 175.23 2jb3 s PHE 105 N -0.50 3.17 -0.85 1.90 5.36 0.34 -4.73 117.98 122.67 2jb3 s PHE 105 Ca 0.56 -0.12 -0.25 0.00 -0.96 0.00 0.00 56.93 56.16 2jb3 s PHE 105 Cb -0.43 -2.18 -0.01 0.00 -0.34 0.00 0.00 43.02 40.06 2jb3 s PHE 105 CO 0.51 -0.09 1.71 0.20 -1.46 0.00 0.00 175.22 176.08 2jb3 s GLY 106 N 1.04 0.56 0.00 13.12 0.00 -1.26 -4.34 107.32 116.44 2jb3 s GLY 106 Ca 0.04 -1.50 0.17 0.00 0.00 0.00 0.00 44.72 43.43 2jb3 s GLY 106 CO 0.03 3.15 1.30 -2.01 0.00 0.00 0.00 173.10 175.58 2jb3 n ASN 107 N 11.78 3.17 -3.66 1.64 5.15 -1.26 -2.55 115.26 129.53 2jb3 n ASN 107 Ca 0.29 -1.92 -0.09 0.00 -0.60 0.00 0.00 54.58 52.26 2jb3 n ASN 107 Cb 0.49 -0.26 -0.08 0.00 -0.53 0.00 0.00 39.78 39.40 2jb3 n ASN 107 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 2jb3 s GLN 108 N -1.13 0.60 -0.15 1.20 0.74 -1.26 -4.86 119.66 114.79 2jb3 s GLN 108 Ca 0.32 1.04 -0.08 0.00 0.05 0.00 0.00 55.36 56.69 2jb3 s GLN 108 Cb 0.18 0.10 0.06 0.00 1.10 0.00 0.00 33.01 34.44 2jb3 s GLN 108 CO 0.24 -0.15 0.37 1.21 -0.55 0.00 0.00 175.29 176.41 2jb3 s ASN 109 N 1.44 -0.41 0.46 6.67 3.84 -1.26 -4.80 114.94 120.88 2jb3 s ASN 109 Ca -0.09 0.80 0.18 0.00 0.21 0.00 0.00 52.86 53.96 2jb3 s ASN 109 Cb -0.06 0.72 1.10 0.00 -0.55 0.00 0.00 41.25 42.45 2jb3 s ASN 109 CO -0.16 -0.19 2.00 0.00 -2.79 0.00 0.00 177.10 175.96 2jb3 h ALA 110 N 7.26 1.55 0.00 1.71 0.00 -1.97 -3.21 119.26 124.60 2jb3 h ALA 110 Ca -0.35 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2jb3 h ALA 110 Cb 1.17 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2jb3 h ALA 110 CO 0.30 0.23 -0.78 0.09 0.00 0.00 0.00 179.25 179.09 2jb3 n ASN 111 N -4.11 0.71 -4.85 0.00 5.03 -1.26 -1.64 115.26 109.15 2jb3 n ASN 111 Ca -0.02 -0.55 -0.29 0.00 0.87 0.00 0.00 54.58 54.59 2jb3 n ASN 111 Cb 0.26 0.64 0.11 0.00 -1.02 0.00 0.00 39.78 39.76 2jb3 n ASN 111 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2jb3 s THR 112 N -3.03 2.16 0.13 3.41 -4.23 -1.21 -4.77 115.64 108.09 2jb3 s THR 112 Ca 0.09 0.05 0.04 0.00 -1.18 0.00 0.00 61.69 60.69 2jb3 s THR 112 Cb 0.16 -2.93 -0.04 0.00 1.34 0.00 0.00 72.50 71.04 2jb3 s THR 112 CO 0.78 -0.07 0.13 -0.36 -0.54 0.00 0.00 174.62 174.57 2jb3 s PHE 113 N -3.41 3.20 -0.00 3.99 0.08 -1.26 -1.49 117.98 119.09 2jb3 s PHE 113 Ca 0.62 0.04 0.05 0.00 0.12 0.00 0.00 56.93 57.76 2jb3 s PHE 113 Cb -0.13 -1.57 -0.03 0.00 -0.57 0.00 0.00 43.02 40.72 2jb3 s PHE 113 CO 0.51 0.52 -0.13 0.14 -0.10 0.00 0.00 175.22 176.17 2jb3 s VAL 114 N -1.61 3.17 -0.23 -0.44 -7.23 0.13 -0.76 120.40 113.43 2jb3 s VAL 114 Ca 0.31 -0.90 -0.04 0.00 -1.81 0.00 0.00 61.98 59.54 2jb3 s VAL 114 Cb -0.11 -2.32 0.12 0.00 0.56 0.00 0.00 36.38 34.63 2jb3 s VAL 114 CO 0.23 0.44 0.39 0.21 -0.31 0.00 0.00 175.10 176.06 2jb3 s ASN 115 N -1.20 0.09 0.06 4.85 3.84 -0.73 -1.41 114.94 120.44 2jb3 s ASN 115 Ca 0.14 0.42 0.00 0.00 0.21 0.00 0.00 52.86 53.64 2jb3 s ASN 115 Cb -0.11 1.18 -0.03 0.00 -0.55 0.00 0.00 41.25 41.74 2jb3 s ASN 115 CO 0.04 -0.28 -0.05 -0.31 -2.79 0.00 0.00 177.10 173.72 2jb3 s TYR 116 N 2.57 0.60 0.24 0.43 2.02 -1.26 -3.20 117.35 118.74 2jb3 s TYR 116 Ca 0.09 -0.83 -0.22 0.00 -0.37 0.00 0.00 57.07 55.74 2jb3 s TYR 116 Cb -0.15 -0.39 -0.09 0.00 -0.40 0.00 0.00 41.96 40.94 2jb3 s TYR 116 CO -0.15 -0.23 0.79 -0.65 -1.57 0.00 0.00 175.55 173.73 2jb3 s GLN 117 N -3.06 4.38 0.22 -0.62 -1.52 -1.26 -1.12 119.66 116.68 2jb3 s GLN 117 Ca 0.01 1.03 -0.23 0.00 -1.95 0.00 0.00 55.36 54.22 2jb3 s GLN 117 Cb 0.01 -2.92 0.05 0.00 -0.22 0.00 0.00 33.01 29.94 2jb3 s GLN 117 CO -0.05 0.39 0.89 -1.54 -0.25 0.00 0.00 175.29 174.73 2jb3 s SER 118 N -1.57 -0.15 -0.49 5.90 1.04 -1.26 -4.89 113.70 112.27 2jb3 s SER 118 Ca 0.44 -0.57 -0.03 0.00 0.48 0.00 0.00 55.95 56.26 2jb3 s SER 118 Cb -0.18 0.59 0.14 0.00 0.10 0.00 0.00 66.02 66.67 2jb3 s SER 118 CO 0.22 -1.12 2.55 0.47 0.98 0.00 0.00 173.24 176.34 2jb3 n ASP 119 N -0.67 6.66 -4.28 7.02 8.00 -1.26 -4.46 116.55 127.56 2jb3 n ASP 119 Ca -0.05 -3.29 -0.15 0.00 0.71 0.00 0.00 54.79 52.01 2jb3 n ASP 119 Cb 0.60 -1.18 -0.10 0.00 -0.02 0.00 0.00 41.12 40.42 2jb3 n ASP 119 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2jb3 s THR 120 N -2.72 0.37 -1.30 -3.53 -4.23 -1.26 -4.98 115.64 97.99 2jb3 s THR 120 Ca 0.55 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 59.21 2jb3 s THR 120 Cb 0.38 -2.59 0.22 0.00 1.34 0.00 0.00 72.50 71.85 2jb3 s THR 120 CO -0.21 -0.01 1.44 -1.20 -0.54 0.00 0.00 174.62 174.10 2jb3 n SER 121 N -0.40 0.00 -0.27 3.99 7.64 -1.26 -1.91 113.62 121.42 2jb3 n SER 121 Ca 0.01 0.20 0.13 0.00 1.01 0.00 0.00 58.87 60.22 2jb3 n SER 121 Cb 0.66 -0.35 0.45 0.00 -1.01 0.00 0.00 64.21 63.96 2jb3 n SER 121 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2jb3 n LEU 122 N -1.35 1.02 -4.67 -3.43 4.77 -1.26 -4.80 117.00 107.28 2jb3 n LEU 122 Ca 0.06 -0.26 -0.47 0.00 -0.03 0.00 0.00 56.01 55.31 2jb3 n LEU 122 Cb 0.14 -0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 41.07 2jb3 n LEU 122 CO 0.12 0.18 1.53 -0.24 -1.33 0.00 0.00 177.39 177.66 2jb3 n SER 123 N -0.55 3.55 0.00 -1.43 2.88 -0.80 -1.49 113.62 115.78 2jb3 n SER 123 Ca 0.14 0.92 0.00 0.00 -1.33 0.00 0.00 58.87 58.60 2jb3 n SER 123 Cb 0.34 -1.40 0.00 0.00 -0.75 0.00 0.00 64.21 62.39 2jb3 n SER 123 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jb3 n GLY 124 N 4.53 0.74 3.75 0.46 0.00 -0.28 -4.90 105.19 109.50 2jb3 n GLY 124 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 2jb3 n GLY 124 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jb3 s GLN 125 N -0.26 4.42 -0.04 1.61 0.74 -0.55 -4.87 119.66 120.70 2jb3 s GLN 125 Ca 0.00 0.92 -0.25 0.00 0.05 0.00 0.00 55.36 56.08 2jb3 s GLN 125 Cb 0.00 -3.36 -0.04 0.00 1.10 0.00 0.00 33.01 30.71 2jb3 s GLN 125 CO 0.00 0.31 0.78 -1.12 -0.55 0.00 0.00 175.29 174.70 2jb3 s SER 126 N -0.07 7.10 -0.03 6.67 0.01 -1.26 -4.41 113.70 121.72 2jb3 s SER 126 Ca 0.35 1.33 0.02 0.00 1.31 0.00 0.00 55.95 58.97 2jb3 s SER 126 Cb -0.19 -2.46 0.00 0.00 0.21 0.00 0.00 66.02 63.58 2jb3 s SER 126 CO 0.20 -0.14 -0.09 -0.69 0.41 0.00 0.00 173.24 172.93 2jb3 s VAL 127 N 0.80 0.78 0.59 3.43 1.01 -0.50 -4.96 120.40 121.54 2jb3 s VAL 127 Ca 0.41 -0.36 -0.18 0.00 0.00 0.00 0.00 61.98 61.85 2jb3 s VAL 127 Cb -0.19 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 2jb3 s VAL 127 CO 0.21 0.25 1.16 0.42 0.00 0.00 0.00 175.10 177.14 2jb3 s THR 128 N 0.21 2.91 0.24 3.92 -4.23 -1.26 -0.69 115.64 116.74 2jb3 s THR 128 Ca -0.03 0.54 -0.05 0.00 -1.18 0.00 0.00 61.69 60.97 2jb3 s THR 128 Cb -0.09 -3.18 0.20 0.00 1.34 0.00 0.00 72.50 70.78 2jb3 s THR 128 CO 0.00 -0.15 1.75 1.88 -0.54 0.00 0.00 174.62 177.57 2jb3 h TYR 129 N 0.84 0.60 -0.06 3.99 -1.99 -1.07 -0.98 116.97 118.30 2jb3 h TYR 129 Ca -0.50 0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.20 2jb3 h TYR 129 Cb 1.28 -0.15 -0.01 0.00 2.00 0.00 0.00 36.73 39.84 2jb3 h TYR 129 CO 0.50 0.15 -0.26 0.07 -0.00 0.00 0.00 178.16 178.61 2jb3 h ARG 130 N 0.53 0.11 0.07 4.88 0.11 -1.61 0.20 114.38 118.67 2jb3 h ARG 130 Ca 0.40 -0.03 -0.00 0.00 0.10 0.00 0.00 59.98 60.44 2jb3 h ARG 130 Cb 0.53 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.60 2jb3 h ARG 130 CO -0.34 0.37 -0.03 0.00 0.10 0.00 0.00 179.97 180.07 2jb3 h ALA 131 N 1.63 -0.09 -0.72 0.08 0.00 -1.59 -0.75 119.26 117.81 2jb3 h ALA 131 Ca 0.02 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.73 2jb3 h ALA 131 Cb 0.53 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 2jb3 h ALA 131 CO 0.04 -0.26 0.41 0.00 0.00 0.00 0.00 179.25 179.44 2jb3 h ALA 132 N 0.16 0.99 -0.24 0.00 0.00 -0.90 -1.76 119.26 117.50 2jb3 h ALA 132 Ca -0.01 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2jb3 h ALA 132 Cb 0.56 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2jb3 h ALA 132 CO 0.02 0.08 0.09 0.87 0.00 0.00 0.00 179.25 180.31 2jb3 h LYS 133 N 0.74 0.37 -0.75 0.00 1.57 -0.62 -0.68 116.57 117.20 2jb3 h LYS 133 Ca 0.33 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.99 2jb3 h LYS 133 Cb 0.23 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 2jb3 h LYS 133 CO -0.20 0.42 0.26 0.00 -0.57 0.00 0.00 179.45 179.36 2jb3 h ALA 134 N 0.93 0.97 0.18 3.86 0.00 -0.97 0.18 119.26 124.42 2jb3 h ALA 134 Ca 0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2jb3 h ALA 134 Cb 0.20 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2jb3 h ALA 134 CO -0.01 0.63 -0.09 -0.44 0.00 0.00 0.00 179.25 179.35 2jb3 h ASP 135 N 1.09 -0.21 -0.12 0.00 5.19 -1.30 0.70 116.42 121.78 2jb3 h ASP 135 Ca 0.24 -0.31 0.03 0.00 -0.62 0.00 0.00 57.03 56.38 2jb3 h ASP 135 Cb 0.27 0.05 -0.03 0.00 0.18 0.00 0.00 39.33 39.80 2jb3 h ASP 135 CO -0.01 0.24 -0.06 0.74 -3.12 0.00 0.00 179.24 177.03 2jb3 h THR 136 N -0.72 0.80 0.00 0.35 2.02 -1.06 -1.15 112.91 113.15 2jb3 h THR 136 Ca -0.03 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.10 2jb3 h THR 136 Cb 0.50 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.70 2jb3 h THR 136 CO 0.04 0.00 -0.28 -0.26 0.37 0.00 0.00 175.52 175.39 2jb3 h PHE 137 N -0.05 0.00 0.04 3.16 0.04 -1.05 -0.90 116.94 118.18 2jb3 h PHE 137 Ca 0.07 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.84 2jb3 h PHE 137 Cb 0.16 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.31 2jb3 h PHE 137 CO -0.19 0.28 -0.02 0.78 -0.60 0.00 0.00 178.31 178.56 2jb3 h GLY 138 N 2.49 -0.05 1.05 -1.45 0.00 -0.69 -0.89 103.07 103.51 2jb3 h GLY 138 Ca -0.00 0.02 -0.15 0.00 0.00 0.00 0.00 47.33 47.20 2jb3 h GLY 138 CO 0.04 -0.02 -0.40 -0.97 0.00 0.00 0.00 176.54 175.19 2jb3 h TYR 139 N -0.52 0.97 -0.36 5.60 0.05 -1.18 -0.51 116.97 121.01 2jb3 h TYR 139 Ca -0.01 -0.32 0.06 0.00 0.05 0.00 0.00 58.73 58.52 2jb3 h TYR 139 Cb 0.48 -0.19 -0.06 0.00 1.01 0.00 0.00 36.73 37.97 2jb3 h TYR 139 CO 0.08 1.11 0.00 1.98 -1.05 0.00 0.00 178.16 180.28 2jb3 h MET 140 N 0.55 0.10 -0.37 4.88 4.05 -1.24 0.09 114.93 122.98 2jb3 h MET 140 Ca 0.03 -0.01 -0.06 0.00 -0.28 0.00 0.00 59.70 59.39 2jb3 h MET 140 Cb 1.00 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.76 2jb3 h MET 140 CO 0.09 0.07 -0.02 0.77 0.23 0.00 0.00 176.91 178.05 2jb3 h SER 141 N 0.10 0.57 -0.16 1.39 0.02 -0.92 -1.78 113.55 112.76 2jb3 h SER 141 Ca 0.17 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.97 2jb3 h SER 141 Cb 0.24 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 2jb3 h SER 141 CO -0.29 0.65 -0.02 -0.08 -1.14 0.00 0.00 176.83 175.96 2jb3 h GLU 142 N 0.57 0.30 -0.09 3.45 4.81 -0.86 -1.13 114.58 121.62 2jb3 h GLU 142 Ca 0.12 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2jb3 h GLU 142 Cb 0.39 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.75 2jb3 h GLU 142 CO 0.02 0.54 0.05 -0.07 -0.73 0.00 0.00 179.01 178.82 2jb3 h LEU 143 N 0.02 0.10 -1.02 1.64 3.38 -0.85 0.16 115.31 118.74 2jb3 h LEU 143 Ca 0.04 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2jb3 h LEU 143 Cb 0.42 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 2jb3 h LEU 143 CO 0.01 0.13 0.32 0.25 0.09 0.00 0.00 178.44 179.24 2jb3 h LEU 144 N 0.07 0.93 -0.45 1.67 5.85 -1.29 -0.99 115.31 121.10 2jb3 h LEU 144 Ca 0.03 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 2jb3 h LEU 144 Cb 0.04 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 2jb3 h LEU 144 CO -0.01 0.80 0.16 0.50 -0.34 0.00 0.00 178.44 179.55 2jb3 h LYS 145 N 1.01 0.69 -0.46 1.25 3.64 -1.00 -0.90 116.57 120.82 2jb3 h LYS 145 Ca 0.24 -0.14 0.08 0.00 -1.27 0.00 0.00 60.65 59.56 2jb3 h LYS 145 Cb 0.13 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 31.78 2jb3 h LYS 145 CO -0.03 0.65 0.09 -0.22 -2.27 0.00 0.00 179.45 177.67 2jb3 h LYS 146 N 0.59 0.21 -0.68 1.90 3.64 -0.33 -0.56 116.57 121.34 2jb3 h LYS 146 Ca 0.15 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.45 2jb3 h LYS 146 Cb 0.24 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.98 2jb3 h LYS 146 CO -0.01 0.14 0.19 0.00 -2.27 0.00 0.00 179.45 177.50 2jb3 h ALA 147 N 1.35 1.05 0.09 5.00 0.00 -1.05 -0.28 119.26 125.42 2jb3 h ALA 147 Ca 0.23 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2jb3 h ALA 147 Cb 0.29 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2jb3 h ALA 147 CO -0.30 0.63 -0.04 1.15 0.00 0.00 0.00 179.25 180.69 2jb3 h THR 148 N 1.01 1.05 -0.52 0.00 2.02 -0.74 -1.66 112.91 114.07 2jb3 h THR 148 Ca 0.22 -0.53 0.03 0.00 0.77 0.00 0.00 66.41 66.90 2jb3 h THR 148 Cb 0.32 1.39 -0.03 0.00 -1.74 0.00 0.00 68.15 68.10 2jb3 h THR 148 CO -0.00 0.13 0.35 0.44 0.37 0.00 0.00 175.52 176.80 2jb3 h ASP 149 N -0.37 0.52 0.67 4.18 3.45 -0.83 -1.47 116.42 122.57 2jb3 h ASP 149 Ca -0.01 -0.01 -0.03 0.00 0.43 0.00 0.00 57.03 57.41 2jb3 h ASP 149 Cb 0.31 -0.12 -0.00 0.00 -0.56 0.00 0.00 39.33 38.95 2jb3 h ASP 149 CO 0.02 0.36 -0.14 -0.61 -1.57 0.00 0.00 179.24 177.30 2jb3 h GLN 150 N 0.60 0.00 0.00 3.56 4.15 -0.95 -3.46 115.11 119.01 2jb3 h GLN 150 Ca 0.21 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.63 2jb3 h GLN 150 Cb 0.09 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.78 2jb3 h GLN 150 CO -0.05 0.14 0.00 0.41 -1.93 0.00 0.00 178.83 177.40 2jb3 n GLY 151 N -0.26 0.61 0.34 2.39 0.00 -0.55 -4.97 105.19 102.75 2jb3 n GLY 151 Ca -0.01 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 2jb3 n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jb3 h ALA 152 N 0.00 1.90 -0.12 4.61 0.00 -1.50 -2.19 119.26 121.97 2jb3 h ALA 152 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2jb3 h ALA 152 Cb 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2jb3 h ALA 152 CO 0.00 -0.35 -0.15 1.28 0.00 0.00 0.00 179.25 180.03 2jb3 n LEU 153 N -3.87 3.08 0.25 0.00 4.77 -1.26 -4.69 117.00 115.28 2jb3 n LEU 153 Ca 0.03 -3.43 0.13 0.00 -0.03 0.00 0.00 56.01 52.71 2jb3 n LEU 153 Cb 0.37 -0.52 0.57 0.00 -2.33 0.00 0.00 43.42 41.51 2jb3 n LEU 153 CO 0.29 1.00 0.90 0.44 -1.33 0.00 0.00 177.39 178.68 2jb3 h ASP 154 N 0.79 0.00 0.78 -1.43 3.32 -1.65 -0.69 116.42 117.54 2jb3 h ASP 154 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2jb3 h ASP 154 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 2jb3 h ASP 154 CO 0.12 0.12 -0.23 0.00 -1.72 0.00 0.00 179.24 177.53 2jb3 n GLN 155 N -3.26 0.00 0.00 3.56 1.13 -1.26 -3.95 117.38 113.60 2jb3 n GLN 155 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 2jb3 n GLN 155 Cb 0.37 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.21 2jb3 n GLN 155 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 2jb3 n VAL 156 N -1.51 0.00 -4.86 5.09 0.24 -0.74 -5.02 118.33 111.54 2jb3 n VAL 156 Ca 0.06 -0.39 -0.26 0.00 -2.04 0.00 0.00 64.34 61.72 2jb3 n VAL 156 Cb 0.34 1.04 -0.16 0.00 -1.47 0.00 0.00 33.84 33.59 2jb3 n VAL 156 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2jb3 s LEU 157 N -1.25 1.95 1.17 1.34 1.43 -0.34 -5.10 118.68 117.87 2jb3 s LEU 157 Ca 0.00 -0.35 -0.19 0.00 -1.03 0.00 0.00 54.13 52.55 2jb3 s LEU 157 Cb 0.00 -0.98 0.28 0.00 0.03 0.00 0.00 46.19 45.52 2jb3 s LEU 157 CO 0.00 0.17 1.17 -0.94 0.23 0.00 0.00 176.35 176.99 2jb3 s SER 158 N -0.07 1.26 0.22 2.29 1.04 -1.26 -4.61 113.70 112.57 2jb3 s SER 158 Ca -0.01 0.45 -0.01 0.00 0.48 0.00 0.00 55.95 56.85 2jb3 s SER 158 Cb -0.11 -0.57 0.22 0.00 0.10 0.00 0.00 66.02 65.66 2jb3 s SER 158 CO 0.02 -3.90 1.59 -0.09 0.98 0.00 0.00 173.24 171.84 2jb3 h ARG 159 N -2.43 0.54 -0.33 4.02 9.65 -1.99 -0.61 114.38 123.23 2jb3 h ARG 159 Ca -0.43 -0.28 -0.10 0.00 -1.10 0.00 0.00 59.98 58.06 2jb3 h ARG 159 Cb 1.27 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.85 2jb3 h ARG 159 CO 0.31 0.86 -0.20 0.93 2.80 0.00 0.00 179.97 184.68 2jb3 h GLU 160 N 0.45 0.72 0.06 0.20 3.07 -2.00 -2.03 114.58 115.04 2jb3 h GLU 160 Ca 0.04 -0.33 0.02 0.00 -0.50 0.00 0.00 59.36 58.58 2jb3 h GLU 160 Cb 0.92 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.79 2jb3 h GLU 160 CO 0.08 0.94 -0.17 -0.44 -1.40 0.00 0.00 179.01 178.02 2jb3 h ASP 161 N 0.49 -0.49 -1.00 1.42 3.32 -1.83 -1.46 116.42 116.87 2jb3 h ASP 161 Ca 0.07 0.06 0.14 0.00 0.02 0.00 0.00 57.03 57.32 2jb3 h ASP 161 Cb 0.75 0.19 -0.09 0.00 0.22 0.00 0.00 39.33 40.40 2jb3 h ASP 161 CO 0.06 -0.24 0.62 0.11 -1.72 0.00 0.00 179.24 178.06 2jb3 h LYS 162 N -0.31 0.91 -0.13 3.56 1.57 -0.94 0.12 116.57 121.35 2jb3 h LYS 162 Ca 0.04 -0.05 -0.23 0.00 -1.87 0.00 0.00 60.65 58.54 2jb3 h LYS 162 Cb 0.35 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 32.47 2jb3 h LYS 162 CO -0.13 0.60 -0.81 -0.44 -0.57 0.00 0.00 179.45 178.11 2jb3 h ASP 163 N 0.93 0.90 0.04 0.86 3.32 -1.19 -0.42 116.42 120.86 2jb3 h ASP 163 Ca 0.51 -0.60 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 2jb3 h ASP 163 Cb 0.58 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2jb3 h ASP 163 CO -0.29 1.40 -0.02 0.00 -1.72 0.00 0.00 179.24 178.60 2jb3 h ALA 164 N 0.58 -0.06 -0.97 3.45 0.00 -1.13 -1.63 119.26 119.50 2jb3 h ALA 164 Ca -0.06 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.86 2jb3 h ALA 164 Cb 1.44 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.20 2jb3 h ALA 164 CO 0.16 -0.52 0.63 1.25 0.00 0.00 0.00 179.25 180.77 2jb3 h LEU 165 N -0.08 1.07 -0.03 0.00 5.85 -0.60 -2.37 115.31 119.15 2jb3 h LEU 165 Ca -0.01 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 2jb3 h LEU 165 Cb 0.06 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.84 2jb3 h LEU 165 CO 0.01 0.75 0.01 -1.28 -0.34 0.00 0.00 178.44 177.59 2jb3 h SER 166 N 1.25 0.04 -0.50 1.25 0.87 -0.89 -0.48 113.55 115.09 2jb3 h SER 166 Ca 0.38 -0.13 0.10 0.00 -1.23 0.00 0.00 61.79 60.91 2jb3 h SER 166 Cb -0.05 -0.01 -0.09 0.00 -0.44 0.00 0.00 62.40 61.81 2jb3 h SER 166 CO -0.11 0.15 -0.06 -0.08 -0.53 0.00 0.00 176.83 176.20 2jb3 h GLU 167 N -0.09 0.05 -0.74 2.24 4.81 -1.15 -0.63 114.58 119.08 2jb3 h GLU 167 Ca 0.01 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.27 2jb3 h GLU 167 Cb 0.13 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 2jb3 h GLU 167 CO -0.00 0.03 0.46 0.35 -0.73 0.00 0.00 179.01 179.13 2jb3 h PHE 168 N 0.05 0.87 -0.06 0.92 3.57 -0.98 -2.73 116.94 118.58 2jb3 h PHE 168 Ca 0.25 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.64 2jb3 h PHE 168 Cb 0.38 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 2jb3 h PHE 168 CO -0.37 0.49 -0.57 -0.07 -2.23 0.00 0.00 178.31 175.56 2jb3 h LEU 169 N 0.90 0.22 -0.63 0.59 3.38 -0.55 0.41 115.31 119.63 2jb3 h LEU 169 Ca 0.30 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 2jb3 h LEU 169 Cb 0.02 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2jb3 h LEU 169 CO -0.11 0.74 -0.07 0.28 0.09 0.00 0.00 178.44 179.36 2jb3 h SER 170 N 0.15 0.99 0.19 -0.43 0.02 -1.00 -0.30 113.55 113.17 2jb3 h SER 170 Ca -0.00 -0.31 -0.27 0.00 -0.84 0.00 0.00 61.79 60.37 2jb3 h SER 170 Cb 1.05 -0.27 0.03 0.00 0.14 0.00 0.00 62.40 63.35 2jb3 h SER 170 CO 0.09 1.08 -1.19 -0.78 -1.14 0.00 0.00 176.83 174.89 2jb3 h ASP 171 N 0.90 0.64 -0.91 3.07 3.58 -1.12 0.15 116.42 122.73 2jb3 h ASP 171 Ca 0.15 -0.93 0.01 0.00 0.42 0.00 0.00 57.03 56.68 2jb3 h ASP 171 Cb 0.62 -0.21 -0.05 0.00 1.72 0.00 0.00 39.33 41.42 2jb3 h ASP 171 CO 0.04 1.57 0.60 0.15 -2.88 0.00 0.00 179.24 178.72 2jb3 h PHE 172 N -0.12 1.14 -0.02 0.28 3.57 -0.13 -1.96 116.94 119.70 2jb3 h PHE 172 Ca -0.21 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.31 2jb3 h PHE 172 Cb 1.91 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 40.26 2jb3 h PHE 172 CO 0.16 0.71 -0.10 0.41 -2.23 0.00 0.00 178.31 177.26 2jb3 n GLY 173 N -1.35 0.27 3.86 2.40 0.00 -0.13 -4.77 105.19 105.47 2jb3 n GLY 173 Ca 0.10 -0.55 -0.35 0.00 0.00 0.00 0.00 46.02 45.22 2jb3 n GLY 173 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jb3 n ASP 174 N 0.45 -3.98 -4.84 1.61 2.03 -0.67 -4.27 116.55 106.88 2jb3 n ASP 174 Ca 0.15 -1.10 -0.33 0.00 0.52 0.00 0.00 54.79 54.02 2jb3 n ASP 174 Cb 0.46 -2.79 -0.06 0.00 -0.72 0.00 0.00 41.12 38.00 2jb3 n ASP 174 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2jb3 s LEU 175 N -6.86 4.09 1.09 -2.67 1.43 -0.05 -4.69 118.68 111.03 2jb3 s LEU 175 Ca 0.39 1.39 -0.19 0.00 -1.03 0.00 0.00 54.13 54.69 2jb3 s LEU 175 Cb -0.17 -4.08 0.06 0.00 0.03 0.00 0.00 46.19 42.04 2jb3 s LEU 175 CO 0.90 -0.19 -0.14 -1.54 0.23 0.00 0.00 176.35 175.62 2jb3 n SER 176 N -0.21 -2.48 0.24 2.29 3.41 0.74 -4.87 113.62 112.75 2jb3 n SER 176 Ca 0.03 -0.06 0.11 0.00 -0.26 0.00 0.00 58.87 58.69 2jb3 n SER 176 Cb 0.53 -0.93 0.62 0.00 -0.26 0.00 0.00 64.21 64.17 2jb3 n SER 176 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2jb3 h ASP 177 N -1.89 0.00 -0.76 4.04 3.32 -1.97 -1.84 116.42 117.31 2jb3 h ASP 177 Ca -0.51 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.26 2jb3 h ASP 177 Cb 1.36 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.74 2jb3 h ASP 177 CO 0.36 0.17 0.36 -0.90 -1.72 0.00 0.00 179.24 177.51 2jb3 n ASP 178 N -3.61 4.42 -0.04 6.45 5.75 -1.26 -4.92 116.55 123.34 2jb3 n ASP 178 Ca -0.01 -3.23 -0.00 0.00 -0.01 0.00 0.00 54.79 51.53 2jb3 n ASP 178 Cb 0.31 -0.76 -0.00 0.00 -1.03 0.00 0.00 41.12 39.64 2jb3 n ASP 178 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jb3 n GLY 179 N -0.36 0.44 3.64 6.12 0.00 -0.69 -5.06 105.19 109.28 2jb3 n GLY 179 Ca 0.43 -0.83 -0.33 0.00 0.00 0.00 0.00 46.02 45.30 2jb3 n GLY 179 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jb3 s ARG 180 N -1.60 2.73 -0.33 1.61 0.52 -1.26 -4.66 118.95 115.96 2jb3 s ARG 180 Ca 0.00 -0.61 -0.24 0.00 -0.52 0.00 0.00 55.73 54.36 2jb3 s ARG 180 Cb 0.00 -2.62 0.00 0.00 0.52 0.00 0.00 34.95 32.86 2jb3 s ARG 180 CO 0.00 0.63 0.80 -0.47 0.02 0.00 0.00 175.30 176.29 2jb3 s TYR 181 N -0.98 3.16 -0.10 -0.53 5.04 -1.26 -0.19 117.35 122.49 2jb3 s TYR 181 Ca 0.17 0.74 0.15 0.00 -2.44 0.00 0.00 57.07 55.68 2jb3 s TYR 181 Cb -0.11 -3.32 0.23 0.00 0.35 0.00 0.00 41.96 39.11 2jb3 s TYR 181 CO 0.07 -0.64 1.12 1.28 -1.34 0.00 0.00 175.55 176.03 2jb3 n LEU 182 N 6.33 1.86 0.00 6.97 4.77 -1.26 -4.97 117.00 130.71 2jb3 n LEU 182 Ca 0.04 -2.66 0.00 0.00 -0.03 0.00 0.00 56.01 53.36 2jb3 n LEU 182 Cb 0.48 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2jb3 n LEU 182 CO 0.52 0.62 0.00 0.61 -1.33 0.00 0.00 177.39 177.81 2jb3 n GLY 183 N -1.13 0.73 3.59 -0.72 0.00 -1.26 -4.81 105.19 101.59 2jb3 n GLY 183 Ca 0.13 -2.23 -0.10 0.00 0.00 0.00 0.00 46.02 43.82 2jb3 n GLY 183 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jb3 s SER 184 N 0.00 -0.35 0.29 1.61 0.15 -1.26 -4.93 113.70 109.21 2jb3 s SER 184 Ca 0.00 0.44 0.21 0.00 0.70 0.00 0.00 55.95 57.30 2jb3 s SER 184 Cb 0.00 0.36 1.08 0.00 -1.71 0.00 0.00 66.02 65.75 2jb3 s SER 184 CO 0.00 -0.29 1.65 -1.54 1.20 0.00 0.00 173.24 174.26 2jb3 n SER 185 N 0.93 0.57 0.25 5.45 3.41 -1.26 -1.59 113.62 121.37 2jb3 n SER 185 Ca -0.10 0.73 0.16 0.00 -0.26 0.00 0.00 58.87 59.40 2jb3 n SER 185 Cb 0.58 -0.82 0.61 0.00 -0.26 0.00 0.00 64.21 64.32 2jb3 n SER 185 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2jb3 h ARG 186 N 0.00 0.00 0.00 4.33 3.08 -1.93 -1.08 114.38 118.78 2jb3 h ARG 186 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2jb3 h ARG 186 Cb 0.10 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 2jb3 h ARG 186 CO 0.00 0.00 -0.12 0.00 -1.07 0.00 0.00 179.97 178.78 2jb3 h ARG 187 N 0.00 0.00 0.00 0.04 3.08 -1.49 -3.40 114.38 112.61 2jb3 h ARG 187 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2jb3 h ARG 187 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 2jb3 h ARG 187 CO 0.00 0.12 0.00 0.41 -1.07 0.00 0.00 179.97 179.43 2jb3 n GLY 188 N 0.10 -1.73 2.94 0.04 0.00 -0.41 -3.99 105.19 102.13 2jb3 n GLY 188 Ca 0.00 -2.04 -0.12 0.00 0.00 0.00 0.00 46.02 43.86 2jb3 n GLY 188 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jb3 s TYR 189 N 0.00 -0.06 -0.15 1.61 2.02 -1.26 -0.91 117.35 118.60 2jb3 s TYR 189 Ca 0.00 0.15 0.15 0.00 -0.37 0.00 0.00 57.07 57.00 2jb3 s TYR 189 Cb 0.00 0.02 0.05 0.00 -0.40 0.00 0.00 41.96 41.62 2jb3 s TYR 189 CO 0.00 -0.04 1.41 -0.44 -1.57 0.00 0.00 175.55 174.91 2jb3 h ASP 190 N 5.99 0.00 -3.46 2.29 3.32 -0.93 -3.44 116.42 120.19 2jb3 h ASP 190 Ca -0.25 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.47 2jb3 h ASP 190 Cb 1.21 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 40.40 2jb3 h ASP 190 CO 0.47 0.52 -0.74 -0.55 -1.72 0.00 0.00 179.24 177.22 2jb3 s SER 191 N -6.43 0.44 0.19 6.45 0.15 -1.15 -4.94 113.70 108.40 2jb3 s SER 191 Ca 0.04 0.04 -0.30 0.00 0.70 0.00 0.00 55.95 56.42 2jb3 s SER 191 Cb 0.08 -0.12 -0.08 0.00 -1.71 0.00 0.00 66.02 64.18 2jb3 s SER 191 CO 0.75 -0.16 1.19 -0.70 1.20 0.00 0.00 173.24 175.52 2jb3 s GLU 192 N 1.37 4.50 0.14 5.44 2.56 -1.26 -1.61 118.70 129.84 2jb3 s GLU 192 Ca -0.05 1.86 -0.31 0.00 0.00 0.00 0.00 54.97 56.47 2jb3 s GLU 192 Cb -0.13 -3.24 -0.10 0.00 2.00 0.00 0.00 34.13 32.66 2jb3 s GLU 192 CO -0.03 -0.06 1.71 -2.14 -0.56 0.00 0.00 175.26 174.17 2jb3 s PRO 193 N -0.31 4.17 0.00 4.30 0.02 -1.26 -4.39 135.00 137.53 2jb3 s PRO 193 Ca 0.52 2.48 0.00 0.00 0.02 0.00 0.00 61.00 64.02 2jb3 s PRO 193 Cb -0.32 -3.38 0.00 0.00 0.02 0.00 0.00 34.50 30.82 2jb3 s PRO 193 CO 0.37 -0.74 0.00 0.41 -0.33 0.00 0.00 177.00 176.70 2jb3 n GLY 194 N 4.01 5.06 3.92 0.52 0.00 0.27 -4.93 105.19 114.04 2jb3 n GLY 194 Ca 0.16 -1.61 -0.20 0.00 0.00 0.00 0.00 46.02 44.36 2jb3 n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jb3 s ALA 195 N -2.04 4.04 0.00 4.61 0.00 -1.26 -4.74 121.76 122.36 2jb3 s ALA 195 Ca 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 51.96 50.39 2jb3 s ALA 195 Cb 0.00 -1.41 0.00 0.00 0.00 0.00 0.00 23.12 21.71 2jb3 s ALA 195 CO 0.00 -0.02 0.00 0.41 0.00 0.00 0.00 175.76 176.15 2jb3 n GLY 196 N -1.50 3.66 1.77 0.00 0.00 -1.26 -1.80 105.19 106.06 2jb3 n GLY 196 Ca -0.01 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.03 2jb3 n GLY 196 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jb3 n LEU 197 N 0.00 5.31 -4.26 0.99 4.77 -1.26 -4.72 117.00 117.83 2jb3 n LEU 197 Ca 0.00 -2.70 -0.44 0.00 -0.03 0.00 0.00 56.01 52.84 2jb3 n LEU 197 Cb 0.00 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.42 2jb3 n LEU 197 CO 0.00 0.59 1.25 -3.20 -1.33 0.00 0.00 177.39 174.70 2jb3 n ASN 198 N 0.56 5.49 0.20 -1.43 5.15 -0.75 -4.78 115.26 119.71 2jb3 n ASN 198 Ca 0.25 -3.09 0.15 0.00 -0.60 0.00 0.00 54.58 51.29 2jb3 n ASN 198 Cb 1.11 -1.45 0.56 0.00 -0.53 0.00 0.00 39.78 39.48 2jb3 n ASN 198 CO 0.00 0.00 0.00 -0.26 1.40 0.00 0.00 177.26 178.40 2jb3 h PHE 199 N 6.49 0.00 -0.68 1.20 0.04 -1.85 0.78 116.94 122.92 2jb3 h PHE 199 Ca 0.27 0.00 0.08 0.00 2.80 0.00 0.00 57.97 61.12 2jb3 h PHE 199 Cb 0.79 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.92 2jb3 h PHE 199 CO 1.00 0.00 -0.14 0.41 -0.60 0.00 0.00 178.31 178.98 2jb3 n GLY 200 N 0.15 -1.65 2.74 -1.45 0.00 -1.26 -4.26 105.19 99.47 2jb3 n GLY 200 Ca 0.02 -1.44 -0.23 0.00 0.00 0.00 0.00 46.02 44.36 2jb3 n GLY 200 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jb3 s THR 201 N -1.62 0.28 0.66 2.61 -4.23 -0.63 -4.92 115.64 107.80 2jb3 s THR 201 Ca 0.00 0.08 -0.17 0.00 -1.18 0.00 0.00 61.69 60.42 2jb3 s THR 201 Cb 0.00 -0.53 0.00 0.00 1.34 0.00 0.00 72.50 73.31 2jb3 s THR 201 CO 0.00 0.16 1.27 -1.61 -0.54 0.00 0.00 174.62 173.90 2jb3 s GLU 202 N 2.00 2.47 0.13 3.99 2.02 -1.26 -0.33 118.70 127.71 2jb3 s GLU 202 Ca 0.04 1.98 -0.30 0.00 0.02 0.00 0.00 54.97 56.71 2jb3 s GLU 202 Cb -0.13 -1.85 -0.07 0.00 0.10 0.00 0.00 34.13 32.19 2jb3 s GLU 202 CO -0.05 -1.64 1.11 0.15 0.02 0.00 0.00 175.26 174.85 2jb3 s LYS 203 N -3.50 4.55 0.32 1.61 1.02 -0.09 -4.60 119.74 119.05 2jb3 s LYS 203 Ca 0.80 1.69 -0.22 0.00 0.02 0.00 0.00 55.97 58.27 2jb3 s LYS 203 Cb -0.35 -3.32 -0.10 0.00 -0.52 0.00 0.00 37.83 33.54 2jb3 s LYS 203 CO 0.41 -0.02 0.86 0.15 -0.92 0.00 0.00 175.35 175.82 2jb3 s LYS 204 N 0.17 4.35 0.60 1.68 1.02 -1.26 -4.74 119.74 121.57 2jb3 s LYS 204 Ca 0.52 1.08 -0.17 0.00 0.02 0.00 0.00 55.97 57.43 2jb3 s LYS 204 Cb -0.28 -2.63 -0.03 0.00 -0.52 0.00 0.00 37.83 34.36 2jb3 s LYS 204 CO 0.32 0.22 1.10 -1.25 -0.92 0.00 0.00 175.35 174.83 2jb3 s PRO 205 N -2.40 3.13 0.65 -1.68 0.04 -1.26 -5.06 135.00 128.41 2jb3 s PRO 205 Ca 0.52 1.42 -0.11 0.00 0.04 0.00 0.00 61.00 62.86 2jb3 s PRO 205 Cb -0.15 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 2jb3 s PRO 205 CO 0.20 -0.99 1.05 -0.06 0.04 0.00 0.00 177.00 177.24 2jb3 s PHE 206 N -2.17 3.50 0.60 0.56 0.08 -1.26 -5.07 117.98 114.23 2jb3 s PHE 206 Ca 0.68 1.22 -0.15 0.00 0.12 0.00 0.00 56.93 58.80 2jb3 s PHE 206 Cb -0.20 -2.84 -0.03 0.00 -0.57 0.00 0.00 43.02 39.38 2jb3 s PHE 206 CO 0.35 -0.88 1.05 0.00 -0.10 0.00 0.00 175.22 175.64 2jb3 s ALA 207 N -3.23 2.77 0.08 5.36 0.00 -1.26 -4.91 121.76 120.58 2jb3 s ALA 207 Ca 0.56 0.31 -0.31 0.00 0.00 0.00 0.00 51.96 52.52 2jb3 s ALA 207 Cb -0.11 -3.21 -0.16 0.00 0.00 0.00 0.00 23.12 19.64 2jb3 s ALA 207 CO 0.53 -0.82 1.63 1.98 0.00 0.00 0.00 175.76 179.08 2jb3 h MET 208 N 0.27 -0.74 -0.90 0.00 4.05 -1.97 -1.37 114.93 114.29 2jb3 h MET 208 Ca -0.46 0.05 0.02 0.00 -0.28 0.00 0.00 59.70 59.03 2jb3 h MET 208 Cb 1.21 0.17 -0.05 0.00 -0.80 0.00 0.00 31.60 32.13 2jb3 h MET 208 CO 0.58 -0.49 0.59 0.37 0.23 0.00 0.00 176.91 178.19 2jb3 h GLN 209 N -0.76 1.14 -0.04 0.39 4.15 -1.99 -1.32 115.11 116.68 2jb3 h GLN 209 Ca -0.05 -0.07 -0.11 0.00 0.77 0.00 0.00 58.65 59.19 2jb3 h GLN 209 Cb 0.64 -0.26 -0.01 0.00 0.21 0.00 0.00 27.48 28.05 2jb3 h GLN 209 CO 0.03 0.75 -0.51 1.05 -1.93 0.00 0.00 178.83 178.23 2jb3 h GLU 210 N 1.17 0.09 -0.33 1.69 4.11 -1.89 -0.51 114.58 118.92 2jb3 h GLU 210 Ca 0.34 -0.05 -0.07 0.00 0.07 0.00 0.00 59.36 59.64 2jb3 h GLU 210 Cb -0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 2jb3 h GLU 210 CO -0.09 0.58 -0.09 0.28 0.07 0.00 0.00 179.01 179.77 2jb3 h VAL 211 N 0.08 1.28 -0.18 -1.06 2.07 -0.60 0.56 116.25 118.39 2jb3 h VAL 211 Ca 0.00 -1.14 -0.04 0.00 0.82 0.00 0.00 66.70 66.33 2jb3 h VAL 211 Cb 0.92 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 2jb3 h VAL 211 CO 0.07 0.37 -0.06 0.40 0.02 0.00 0.00 177.57 178.37 2jb3 h ILE 212 N 0.42 1.30 0.00 4.57 2.04 -1.08 -3.05 117.51 121.71 2jb3 h ILE 212 Ca 0.08 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 64.88 2jb3 h ILE 212 Cb 0.59 1.63 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 2jb3 h ILE 212 CO 0.03 0.32 0.00 0.03 0.00 0.00 0.00 178.15 178.53 2jb3 h ARG 213 N 0.05 0.00 0.00 2.37 2.47 -0.89 -3.10 114.38 115.28 2jb3 h ARG 213 Ca 0.04 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.65 2jb3 h ARG 213 Cb 0.51 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.82 2jb3 h ARG 213 CO 0.02 0.00 -0.52 0.66 0.56 0.00 0.00 179.97 180.69 2jb3 h SER 214 N 0.00 0.00 -1.46 7.04 4.64 -0.77 -3.42 113.55 119.57 2jb3 h SER 214 Ca 0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 2jb3 h SER 214 Cb 0.63 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.68 2jb3 h SER 214 CO 0.00 0.52 -0.31 0.61 -0.87 0.00 0.00 176.83 176.78 2jb3 n GLY 215 N 0.83 0.33 0.10 -0.77 0.00 -1.17 -4.76 105.19 99.75 2jb3 n GLY 215 Ca 0.01 -0.36 0.10 0.00 0.00 0.00 0.00 46.02 45.76 2jb3 n GLY 215 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2jb3 n ILE 216 N -3.57 1.00 0.65 -0.61 -5.35 -1.26 -1.52 119.36 108.71 2jb3 n ILE 216 Ca -0.15 0.37 0.10 0.00 -0.27 0.00 0.00 62.75 62.80 2jb3 n ILE 216 Cb 0.56 -1.28 0.27 0.00 -1.74 0.00 0.00 39.64 37.44 2jb3 n ILE 216 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jb3 n GLY 217 N -0.40 1.10 0.28 3.28 0.00 -1.26 -4.61 105.19 103.58 2jb3 n GLY 217 Ca 0.01 -0.56 0.15 0.00 0.00 0.00 0.00 46.02 45.62 2jb3 n GLY 217 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2jb3 h ARG 218 N 3.13 0.00 -0.04 1.61 0.11 -1.67 -2.13 114.38 115.40 2jb3 h ARG 218 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2jb3 h ARG 218 Cb 0.70 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.78 2jb3 h ARG 218 CO 0.00 0.06 0.00 -1.71 0.10 0.00 0.00 179.97 178.42 2jb3 n ASN 219 N -3.65 2.53 0.01 0.08 4.05 -1.26 -4.63 115.26 112.38 2jb3 n ASN 219 Ca -0.02 -1.76 0.03 0.00 0.45 0.00 0.00 54.58 53.29 2jb3 n ASN 219 Cb 0.17 -0.01 0.41 0.00 1.23 0.00 0.00 39.78 41.58 2jb3 n ASN 219 CO 0.00 0.00 0.00 -0.26 -3.05 0.00 0.00 177.26 173.95 2jb3 h PHE 220 N 3.52 0.50 0.00 1.20 0.04 -1.70 -2.03 116.94 118.47 2jb3 h PHE 220 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2jb3 h PHE 220 Cb 0.75 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.74 2jb3 h PHE 220 CO 0.01 0.35 0.00 0.66 -0.60 0.00 0.00 178.31 178.73 2jb3 h SER 221 N 0.53 0.00 -1.02 2.17 4.64 -1.82 -1.87 113.55 116.18 2jb3 h SER 221 Ca 0.14 0.00 0.25 0.00 -0.47 0.00 0.00 61.79 61.71 2jb3 h SER 221 Cb -0.01 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 61.99 2jb3 h SER 221 CO -0.03 0.00 0.64 0.15 -0.87 0.00 0.00 176.83 176.73 2jb3 h PHE 222 N 0.00 0.76 -0.10 4.77 3.57 -1.70 -0.55 116.94 123.68 2jb3 h PHE 222 Ca 0.00 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.56 2jb3 h PHE 222 Cb 0.32 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 38.83 2jb3 h PHE 222 CO 0.00 0.09 0.16 -0.44 -2.23 0.00 0.00 178.31 175.89 2jb3 h ASP 223 N 0.47 0.00 0.27 0.41 3.32 -1.53 -2.43 116.42 116.95 2jb3 h ASP 223 Ca 0.59 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.64 2jb3 h ASP 223 Cb 1.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.91 2jb3 h ASP 223 CO -0.33 0.00 -1.11 0.49 -1.72 0.00 0.00 179.24 176.57 2jb3 n PHE 224 N -3.54 0.15 -1.61 4.55 3.72 -0.22 -3.96 117.46 116.56 2jb3 n PHE 224 Ca -0.00 0.04 -0.48 0.00 -0.05 0.00 0.00 57.45 56.96 2jb3 n PHE 224 Cb 0.26 -0.32 -0.04 0.00 -0.94 0.00 0.00 39.48 38.43 2jb3 n PHE 224 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jb3 n GLY 225 N 1.40 0.41 0.37 1.37 0.00 -0.91 -4.76 105.19 103.06 2jb3 n GLY 225 Ca 0.02 0.58 0.09 0.00 0.00 0.00 0.00 46.02 46.71 2jb3 n GLY 225 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2jb3 h TYR 226 N 4.11 0.89 -0.05 1.61 3.20 -1.93 0.02 116.97 124.82 2jb3 h TYR 226 Ca -0.45 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.45 2jb3 h TYR 226 Cb 1.32 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 39.30 2jb3 h TYR 226 CO 0.57 0.38 0.00 -0.25 -1.64 0.00 0.00 178.16 177.22 2jb3 n ASP 227 N -4.54 1.87 -0.00 -2.11 8.00 -1.26 -4.36 116.55 114.14 2jb3 n ASP 227 Ca 0.16 -1.64 0.00 0.00 0.71 0.00 0.00 54.79 54.02 2jb3 n ASP 227 Cb 0.37 -0.02 -0.00 0.00 -0.02 0.00 0.00 41.12 41.44 2jb3 n ASP 227 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jb3 n GLN 228 N 0.46 0.13 -2.06 -1.24 1.13 -0.43 -4.27 117.38 111.11 2jb3 n GLN 228 Ca 0.18 -0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.83 2jb3 n GLN 228 Cb 0.41 -1.01 -0.01 0.00 0.11 0.00 0.00 30.24 29.73 2jb3 n GLN 228 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jb3 s ALA 229 N -2.03 3.43 0.51 -1.58 0.00 -0.14 -4.86 121.76 117.08 2jb3 s ALA 229 Ca -0.00 1.29 -0.22 0.00 0.00 0.00 0.00 51.96 53.02 2jb3 s ALA 229 Cb 0.00 -3.50 -0.06 0.00 0.00 0.00 0.00 23.12 19.57 2jb3 s ALA 229 CO 0.02 -0.75 1.30 -1.64 0.00 0.00 0.00 175.76 174.70 2jb3 s MET 230 N -1.97 3.39 0.32 0.00 -1.94 -1.26 -4.24 119.30 113.60 2jb3 s MET 230 Ca 0.52 2.11 -0.26 0.00 -1.71 0.00 0.00 55.69 56.34 2jb3 s MET 230 Cb -0.40 -2.35 -0.10 0.00 2.01 0.00 0.00 34.83 33.99 2jb3 s MET 230 CO 0.53 -0.95 0.95 -1.64 -0.01 0.00 0.00 175.02 173.90 2jb3 s MET 231 N -2.79 4.58 0.20 2.03 1.00 -1.26 -5.12 119.30 117.95 2jb3 s MET 231 Ca 0.68 1.35 0.10 0.00 0.00 0.00 0.00 55.69 57.82 2jb3 s MET 231 Cb -0.37 -2.82 -0.04 0.00 0.00 0.00 0.00 34.83 31.60 2jb3 s MET 231 CO 0.44 0.27 -0.19 -1.64 0.00 0.00 0.00 175.02 173.91 2jb3 s MET 232 N -2.02 1.41 0.13 2.03 1.00 -1.26 -4.15 119.30 116.44 2jb3 s MET 232 Ca 0.50 -1.55 -0.01 0.00 0.00 0.00 0.00 55.69 54.64 2jb3 s MET 232 Cb -0.19 -1.45 -0.04 0.00 0.00 0.00 0.00 34.83 33.14 2jb3 s MET 232 CO 0.25 0.28 0.05 -0.06 0.00 0.00 0.00 175.02 175.54 2jb3 s PHE 233 N -2.30 0.89 -0.19 -0.03 0.08 -0.01 -0.50 117.98 115.90 2jb3 s PHE 233 Ca 0.21 -1.23 -0.27 0.00 0.12 0.00 0.00 56.93 55.76 2jb3 s PHE 233 Cb -0.05 -0.49 0.08 0.00 -0.57 0.00 0.00 43.02 41.99 2jb3 s PHE 233 CO 0.09 -0.50 0.78 -0.08 -0.10 0.00 0.00 175.22 175.40 2jb3 s THR 234 N -4.03 0.00 0.27 0.64 -1.32 -0.34 -0.14 115.64 110.72 2jb3 s THR 234 Ca 0.24 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.42 2jb3 s THR 234 Cb 0.07 -1.00 -0.11 0.00 -1.51 0.00 0.00 72.50 69.95 2jb3 s THR 234 CO 0.02 0.00 1.58 -2.84 -2.21 0.00 0.00 174.62 171.17 2jb3 s PRO 235 N -0.26 4.15 0.06 7.08 0.02 -1.26 -0.64 135.00 144.16 2jb3 s PRO 235 Ca -0.03 2.52 -0.33 0.00 0.02 0.00 0.00 61.00 63.18 2jb3 s PRO 235 Cb -0.03 -3.05 -0.12 0.00 0.02 0.00 0.00 34.50 31.32 2jb3 s PRO 235 CO 0.03 -0.61 1.77 0.28 -0.33 0.00 0.00 177.00 178.14 2jb3 n VAL 236 N 2.56 0.33 -0.52 3.83 0.31 -0.16 -2.72 118.33 121.96 2jb3 n VAL 236 Ca 0.09 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 2jb3 n VAL 236 Cb 0.38 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 31.46 2jb3 n VAL 236 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jb3 n GLY 237 N 4.02 0.75 0.00 2.92 0.00 -1.26 -4.92 105.19 106.71 2jb3 n GLY 237 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2jb3 n GLY 237 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jb3 n GLY 238 N -2.20 4.02 0.26 -0.02 0.00 -1.10 -4.87 105.19 101.29 2jb3 n GLY 238 Ca 0.00 -1.43 0.13 0.00 0.00 0.00 0.00 46.02 44.72 2jb3 n GLY 238 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2jb3 h MET 239 N 0.00 0.00 0.00 1.61 4.05 -1.83 -2.01 114.93 116.74 2jb3 h MET 239 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2jb3 h MET 239 Cb 0.00 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.80 2jb3 h MET 239 CO 0.00 0.12 0.00 -0.40 0.23 0.00 0.00 176.91 176.86 2jb3 n ASP 240 N -3.55 0.48 0.27 1.39 5.75 -1.26 -2.47 116.55 117.16 2jb3 n ASP 240 Ca -0.01 0.60 0.12 0.00 -0.01 0.00 0.00 54.79 55.49 2jb3 n ASP 240 Cb 0.25 -0.71 0.77 0.00 -1.03 0.00 0.00 41.12 40.40 2jb3 n ASP 240 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 2jb3 h ARG 241 N 0.00 0.00 -0.54 0.11 3.08 -1.70 0.53 114.38 115.86 2jb3 h ARG 241 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2jb3 h ARG 241 Cb 0.39 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 2jb3 h ARG 241 CO 0.00 0.06 0.31 0.82 -1.07 0.00 0.00 179.97 180.09 2jb3 h ILE 242 N 0.00 1.17 0.00 2.04 2.04 -1.71 -1.44 117.51 119.61 2jb3 h ILE 242 Ca -0.00 -0.41 -0.08 0.00 1.00 0.00 0.00 64.86 65.37 2jb3 h ILE 242 Cb 0.13 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 2jb3 h ILE 242 CO 0.01 0.18 -0.81 1.88 0.00 0.00 0.00 178.15 179.41 2jb3 h TYR 243 N 0.73 0.00 -0.00 1.37 0.05 -1.13 -0.68 116.97 117.29 2jb3 h TYR 243 Ca 0.19 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.85 2jb3 h TYR 243 Cb 0.02 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.74 2jb3 h TYR 243 CO -0.02 0.30 -0.58 1.88 -1.05 0.00 0.00 178.16 178.69 2jb3 h TYR 244 N 0.00 0.02 -0.23 4.88 0.05 -1.24 0.73 116.97 121.18 2jb3 h TYR 244 Ca -0.05 -0.01 -0.13 0.00 0.05 0.00 0.00 58.73 58.59 2jb3 h TYR 244 Cb 1.27 -0.00 -0.00 0.00 1.01 0.00 0.00 36.73 39.01 2jb3 h TYR 244 CO 0.00 0.59 -0.37 0.00 -1.05 0.00 0.00 178.16 177.33 2jb3 h ALA 245 N 1.41 0.36 -0.31 3.88 0.00 -0.99 -0.50 119.26 123.11 2jb3 h ALA 245 Ca -0.01 -0.44 0.04 0.00 0.00 0.00 0.00 54.91 54.51 2jb3 h ALA 245 Cb 1.03 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 2jb3 h ALA 245 CO 0.08 0.43 0.08 0.74 0.00 0.00 0.00 179.25 180.58 2jb3 h PHE 246 N 0.37 0.15 -0.62 0.00 0.04 -0.99 -1.88 116.94 114.00 2jb3 h PHE 246 Ca 0.02 0.02 0.05 0.00 2.80 0.00 0.00 57.97 60.86 2jb3 h PHE 246 Cb 0.96 -0.02 -0.05 0.00 2.20 0.00 0.00 35.95 39.03 2jb3 h PHE 246 CO 0.08 0.05 0.34 0.37 -0.60 0.00 0.00 178.31 178.55 2jb3 h GLN 247 N 0.21 0.61 -0.60 1.51 4.15 -0.70 -0.14 115.11 120.15 2jb3 h GLN 247 Ca 0.14 -0.04 -0.08 0.00 0.77 0.00 0.00 58.65 59.45 2jb3 h GLN 247 Cb 0.13 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 2jb3 h GLN 247 CO -0.17 0.40 0.06 -0.44 -1.93 0.00 0.00 178.83 176.76 2jb3 h ASP 248 N 0.63 0.95 -0.23 -0.69 3.32 -0.69 0.86 116.42 120.57 2jb3 h ASP 248 Ca 0.27 -0.23 -0.10 0.00 0.02 0.00 0.00 57.03 57.00 2jb3 h ASP 248 Cb 0.17 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.46 2jb3 h ASP 248 CO -0.17 0.97 -0.23 0.03 -1.72 0.00 0.00 179.24 178.12 2jb3 h ARG 249 N 0.92 0.56 -0.54 3.56 2.47 -0.56 -3.23 114.38 117.55 2jb3 h ARG 249 Ca 0.18 -0.30 -0.02 0.00 -1.26 0.00 0.00 59.98 58.58 2jb3 h ARG 249 Cb 0.46 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.76 2jb3 h ARG 249 CO 0.02 0.89 0.24 0.82 0.56 0.00 0.00 179.97 182.50 2jb3 h ILE 250 N 0.25 1.21 -0.00 2.04 2.04 -0.88 -3.50 117.51 118.67 2jb3 h ILE 250 Ca 0.03 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2jb3 h ILE 250 Cb 0.79 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2jb3 h ILE 250 CO 0.06 0.24 0.00 0.61 0.00 0.00 0.00 178.15 179.06 2jb3 n GLY 251 N -0.87 1.64 0.30 5.37 0.00 0.28 -4.62 105.19 107.29 2jb3 n GLY 251 Ca 0.03 -1.36 0.20 0.00 0.00 0.00 0.00 46.02 44.89 2jb3 n GLY 251 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2jb3 h THR 252 N 0.00 0.00 -0.15 2.61 1.35 -1.87 0.15 112.91 115.00 2jb3 h THR 252 Ca 0.00 -0.08 0.04 0.00 -0.55 0.00 0.00 66.41 65.82 2jb3 h THR 252 Cb 0.00 1.01 -0.01 0.00 -1.73 0.00 0.00 68.15 67.43 2jb3 h THR 252 CO 0.00 0.00 0.11 -0.78 -0.25 0.00 0.00 175.52 174.60 2jb3 h ASP 253 N 0.00 0.00 -0.42 5.36 3.58 -1.95 -2.47 116.42 120.52 2jb3 h ASP 253 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2jb3 h ASP 253 Cb 0.08 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.13 2jb3 h ASP 253 CO 0.00 0.00 0.00 0.59 -2.88 0.00 0.00 179.24 176.95 2jb3 n ASN 254 N -4.41 3.48 -3.91 2.28 3.02 0.04 -4.85 115.26 110.90 2jb3 n ASN 254 Ca 0.01 -1.99 -0.28 0.00 -0.03 0.00 0.00 54.58 52.29 2jb3 n ASN 254 Cb 0.24 -0.27 -0.17 0.00 -0.61 0.00 0.00 39.78 38.97 2jb3 n ASN 254 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2jb3 s ILE 255 N -1.45 1.12 -0.44 2.41 1.01 -0.93 -0.26 121.20 122.66 2jb3 s ILE 255 Ca 0.40 -0.47 -0.18 0.00 0.00 0.00 0.00 60.65 60.40 2jb3 s ILE 255 Cb 0.23 -1.19 0.03 0.00 0.01 0.00 0.00 42.46 41.54 2jb3 s ILE 255 CO 0.32 0.28 0.48 -0.69 0.00 0.00 0.00 174.94 175.33 2jb3 s VAL 256 N 1.65 5.04 0.63 2.92 1.01 0.14 -4.89 120.40 126.89 2jb3 s VAL 256 Ca 0.03 -0.35 -0.08 0.00 0.00 0.00 0.00 61.98 61.59 2jb3 s VAL 256 Cb -0.14 -4.10 0.01 0.00 0.00 0.00 0.00 36.38 32.16 2jb3 s VAL 256 CO -0.08 -0.50 0.96 -0.36 0.00 0.00 0.00 175.10 175.12 2jb3 s PHE 257 N 2.26 3.26 -1.37 5.22 0.08 -1.26 -0.68 117.98 125.48 2jb3 s PHE 257 Ca 0.13 0.75 -0.03 0.00 0.12 0.00 0.00 56.93 57.90 2jb3 s PHE 257 Cb -0.17 -2.85 0.02 0.00 -0.57 0.00 0.00 43.02 39.44 2jb3 s PHE 257 CO 0.14 -0.95 0.26 0.41 -0.10 0.00 0.00 175.22 174.98 2jb3 n GLY 258 N -2.72 -0.50 3.33 4.36 0.00 -0.13 -4.89 105.19 104.64 2jb3 n GLY 258 Ca 0.05 0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 2jb3 n GLY 258 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jb3 s ALA 259 N -2.91 3.20 -0.50 4.61 0.00 0.12 -4.25 121.76 122.04 2jb3 s ALA 259 Ca 0.16 -1.76 -0.15 0.00 0.00 0.00 0.00 51.96 50.21 2jb3 s ALA 259 Cb -0.08 -2.50 0.11 0.00 0.00 0.00 0.00 23.12 20.65 2jb3 s ALA 259 CO 0.20 -1.40 0.43 -2.00 0.00 0.00 0.00 175.76 173.00 2jb3 s GLU 260 N 1.49 2.92 0.22 0.00 2.12 -0.01 -2.49 118.70 122.95 2jb3 s GLU 260 Ca 0.01 -1.57 -0.31 0.00 0.36 0.00 0.00 54.97 53.45 2jb3 s GLU 260 Cb -0.20 -4.17 -0.11 0.00 0.26 0.00 0.00 34.13 29.91 2jb3 s GLU 260 CO 0.05 -1.19 1.62 0.08 -0.54 0.00 0.00 175.26 175.29 2jb3 s VAL 261 N 1.58 2.27 0.00 3.70 1.01 -1.26 -1.09 120.40 126.61 2jb3 s VAL 261 Ca 0.04 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.22 2jb3 s VAL 261 Cb -0.27 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 32.98 2jb3 s VAL 261 CO 0.04 0.02 0.00 0.35 0.00 0.00 0.00 175.10 175.51 2jb3 n THR 262 N 3.44 0.00 -3.70 3.92 -2.24 -0.22 -4.95 114.28 110.54 2jb3 n THR 262 Ca 0.13 -0.36 -0.14 0.00 -2.27 0.00 0.00 64.05 61.41 2jb3 n THR 262 Cb 0.37 0.91 -0.09 0.00 -2.10 0.00 0.00 70.33 69.42 2jb3 n THR 262 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2jb3 s SER 263 N -0.99 -0.51 -0.17 3.42 0.15 -0.95 -1.08 113.70 113.57 2jb3 s SER 263 Ca 0.00 0.93 -0.04 0.00 0.70 0.00 0.00 55.95 57.54 2jb3 s SER 263 Cb 0.00 0.95 0.08 0.00 -1.71 0.00 0.00 66.02 65.34 2jb3 s SER 263 CO 0.00 -0.21 0.22 -0.32 1.20 0.00 0.00 173.24 174.12 2jb3 s MET 264 N 0.09 0.16 -0.02 5.44 0.00 -0.04 -1.38 119.30 123.56 2jb3 s MET 264 Ca -0.01 0.34 0.01 0.00 0.00 0.00 0.00 55.69 56.03 2jb3 s MET 264 Cb -0.03 -0.88 0.01 0.00 0.00 0.00 0.00 34.83 33.93 2jb3 s MET 264 CO 0.01 -0.54 -0.01 0.15 0.00 0.00 0.00 175.02 174.63 2jb3 s LYS 265 N 2.33 0.26 0.12 4.11 1.02 -0.45 -3.73 119.74 123.41 2jb3 s LYS 265 Ca 0.05 -0.02 -0.31 0.00 0.02 0.00 0.00 55.97 55.72 2jb3 s LYS 265 Cb -0.15 -0.34 -0.09 0.00 -0.52 0.00 0.00 37.83 36.73 2jb3 s LYS 265 CO -0.10 -0.03 1.64 -0.80 -0.92 0.00 0.00 175.35 175.13 2jb3 s ASN 266 N 0.45 6.56 0.37 2.83 -0.87 -1.26 -1.23 114.94 121.80 2jb3 s ASN 266 Ca -0.04 2.59 0.04 0.00 -1.57 0.00 0.00 52.86 53.88 2jb3 s ASN 266 Cb -0.07 -2.58 -0.05 0.00 -0.02 0.00 0.00 41.25 38.53 2jb3 s ASN 266 CO -0.01 -0.88 0.06 0.68 -2.57 0.00 0.00 177.10 174.39 2jb3 s VAL 267 N 1.94 1.15 0.28 1.60 -7.23 -0.30 -4.89 120.40 112.96 2jb3 s VAL 267 Ca 0.73 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.91 2jb3 s VAL 267 Cb -0.43 -2.66 0.28 0.00 0.56 0.00 0.00 36.38 34.13 2jb3 s VAL 267 CO 0.32 0.00 1.83 0.28 -0.31 0.00 0.00 175.10 177.22 2jb3 h SER 268 N 1.93 0.89 -0.12 4.85 0.02 -2.01 -1.14 113.55 117.96 2jb3 h SER 268 Ca -0.40 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2jb3 h SER 268 Cb 1.26 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.68 2jb3 h SER 268 CO 0.69 0.46 0.00 -1.84 -1.14 0.00 0.00 176.83 174.99 2jb3 n GLU 269 N -4.65 1.85 0.00 3.45 0.00 -1.26 -5.00 120.64 115.03 2jb3 n GLU 269 Ca 0.19 -1.26 0.00 0.00 0.00 0.00 0.00 57.16 56.09 2jb3 n GLU 269 Cb 0.37 -1.44 0.00 0.00 0.00 0.00 0.00 31.44 30.37 2jb3 n GLU 269 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2jb3 n GLY 270 N 1.21 0.54 2.82 -1.84 0.00 -0.43 -4.39 105.19 103.10 2jb3 n GLY 270 Ca 0.17 -0.45 -0.17 0.00 0.00 0.00 0.00 46.02 45.57 2jb3 n GLY 270 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jb3 s VAL 271 N 0.00 0.20 -0.15 1.61 1.01 0.69 -1.15 120.40 122.61 2jb3 s VAL 271 Ca 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.01 2jb3 s VAL 271 Cb 0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 36.38 36.05 2jb3 s VAL 271 CO 0.00 0.15 -0.00 -0.89 0.00 0.00 0.00 175.10 174.36 2jb3 s THR 272 N 1.05 4.21 -0.13 3.92 2.01 -0.36 -1.08 115.64 125.25 2jb3 s THR 272 Ca -0.09 -0.25 -0.00 0.00 0.31 0.00 0.00 61.69 61.66 2jb3 s THR 272 Cb -0.14 -2.85 0.03 0.00 0.01 0.00 0.00 72.50 69.55 2jb3 s THR 272 CO -0.02 0.50 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.63 2jb3 s VAL 273 N 0.15 1.21 -0.06 3.82 1.01 0.10 -1.34 120.40 125.29 2jb3 s VAL 273 Ca 0.01 -0.44 -0.06 0.00 0.00 0.00 0.00 61.98 61.49 2jb3 s VAL 273 Cb -0.13 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 2jb3 s VAL 273 CO 0.02 0.37 0.19 -1.61 0.00 0.00 0.00 175.10 174.07 2jb3 s GLU 274 N 1.63 3.49 -0.00 2.72 2.02 -0.48 -1.26 118.70 126.83 2jb3 s GLU 274 Ca 0.04 -0.14 -0.19 0.00 0.02 0.00 0.00 54.97 54.70 2jb3 s GLU 274 Cb -0.13 -3.15 0.04 0.00 0.10 0.00 0.00 34.13 30.99 2jb3 s GLU 274 CO -0.09 0.73 0.43 1.52 0.02 0.00 0.00 175.26 177.86 2jb3 s TYR 275 N -1.15 -0.31 -0.22 1.61 -0.85 -0.81 -1.05 117.35 114.56 2jb3 s TYR 275 Ca 0.21 0.44 -0.09 0.00 -0.52 0.00 0.00 57.07 57.10 2jb3 s TYR 275 Cb -0.13 0.21 -0.05 0.00 0.38 0.00 0.00 41.96 42.38 2jb3 s TYR 275 CO 0.10 -0.50 0.13 0.99 -1.52 0.00 0.00 175.55 174.74 2jb3 s THR 276 N -1.72 5.16 -0.16 -3.49 2.01 -0.25 -0.18 115.64 117.02 2jb3 s THR 276 Ca -0.10 0.11 -0.07 0.00 0.31 0.00 0.00 61.69 61.94 2jb3 s THR 276 Cb -0.02 -3.38 0.06 0.00 0.01 0.00 0.00 72.50 69.17 2jb3 s THR 276 CO 0.03 0.39 0.35 0.00 -0.69 0.00 0.00 174.62 174.70 2jb3 s ALA 277 N 0.83 -0.88 -1.21 7.40 0.00 -0.82 -0.83 121.76 126.25 2jb3 s ALA 277 Ca 0.06 1.31 -0.01 0.00 0.00 0.00 0.00 51.96 53.33 2jb3 s ALA 277 Cb -0.13 -0.98 0.00 0.00 0.00 0.00 0.00 23.12 22.01 2jb3 s ALA 277 CO 0.02 -0.43 0.10 0.41 0.00 0.00 0.00 175.76 175.86 2jb3 n GLY 278 N 4.72 -0.21 2.46 0.00 0.00 -1.26 -1.83 105.19 109.06 2jb3 n GLY 278 Ca -0.17 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.60 2jb3 n GLY 278 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jb3 n GLY 279 N -1.08 2.47 3.86 -0.02 0.00 -1.26 -5.00 105.19 104.16 2jb3 n GLY 279 Ca -0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 2jb3 n GLY 279 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jb3 s SER 280 N -2.96 6.03 -0.22 1.61 0.01 -0.76 -5.06 113.70 112.35 2jb3 s SER 280 Ca 0.00 0.19 -0.29 0.00 1.31 0.00 0.00 55.95 57.16 2jb3 s SER 280 Cb 0.00 -1.79 0.00 0.00 0.21 0.00 0.00 66.02 64.45 2jb3 s SER 280 CO 0.00 0.20 1.12 -0.54 0.41 0.00 0.00 173.24 174.43 2jb3 s LYS 281 N -2.25 4.22 0.24 12.44 -0.14 -1.26 -1.95 119.74 131.04 2jb3 s LYS 281 Ca 0.30 1.42 0.11 0.00 -1.36 0.00 0.00 55.97 56.44 2jb3 s LYS 281 Cb -0.13 -3.69 -0.05 0.00 -1.68 0.00 0.00 37.83 32.28 2jb3 s LYS 281 CO 0.22 -0.70 -0.20 0.15 -0.76 0.00 0.00 175.35 174.06 2jb3 s LYS 282 N 3.37 1.56 0.01 1.68 1.02 0.75 -5.00 119.74 123.13 2jb3 s LYS 282 Ca 0.48 -1.65 0.02 0.00 0.02 0.00 0.00 55.97 54.84 2jb3 s LYS 282 Cb -0.17 -1.69 -0.01 0.00 -0.52 0.00 0.00 37.83 35.44 2jb3 s LYS 282 CO 0.10 0.33 -0.06 0.45 -0.92 0.00 0.00 175.35 175.25 2jb3 s SER 283 N -3.17 0.73 -0.01 2.83 0.15 -1.26 -1.92 113.70 111.05 2jb3 s SER 283 Ca 0.25 -0.22 0.01 0.00 0.70 0.00 0.00 55.95 56.69 2jb3 s SER 283 Cb -0.06 -0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.21 2jb3 s SER 283 CO 0.12 0.00 -0.03 -0.51 1.20 0.00 0.00 173.24 174.03 2jb3 s ILE 284 N -0.45 0.25 -0.06 6.45 2.07 -0.39 -5.00 121.20 124.08 2jb3 s ILE 284 Ca -0.01 -0.10 0.06 0.00 -1.41 0.00 0.00 60.65 59.20 2jb3 s ILE 284 Cb -0.04 -0.24 -0.01 0.00 0.13 0.00 0.00 42.46 42.30 2jb3 s ILE 284 CO -0.00 0.09 -0.25 -0.89 -1.91 0.00 0.00 174.94 171.98 2jb3 s THR 285 N 0.16 2.09 0.09 4.00 2.01 -1.26 -0.72 115.64 122.01 2jb3 s THR 285 Ca -0.01 -1.05 -0.03 0.00 0.31 0.00 0.00 61.69 60.90 2jb3 s THR 285 Cb -0.04 -1.76 -0.03 0.00 0.01 0.00 0.00 72.50 70.68 2jb3 s THR 285 CO -0.00 0.57 0.06 0.00 -0.69 0.00 0.00 174.62 174.55 2jb3 s ALA 286 N -0.18 0.45 0.33 7.40 0.00 -0.25 -4.97 121.76 124.55 2jb3 s ALA 286 Ca -0.03 -1.17 0.04 0.00 0.00 0.00 0.00 51.96 50.81 2jb3 s ALA 286 Cb -0.14 0.53 0.67 0.00 0.00 0.00 0.00 23.12 24.18 2jb3 s ALA 286 CO 0.04 -0.45 1.92 -0.44 0.00 0.00 0.00 175.76 176.82 2jb3 h ASP 287 N 2.95 0.76 -5.10 0.00 3.32 -1.66 0.20 116.42 116.89 2jb3 h ASP 287 Ca -0.34 0.01 -0.14 0.00 0.02 0.00 0.00 57.03 56.58 2jb3 h ASP 287 Cb 1.17 -0.15 -0.18 0.00 0.22 0.00 0.00 39.33 40.40 2jb3 h ASP 287 CO 0.61 0.47 -0.63 -0.31 -1.72 0.00 0.00 179.24 177.66 2jb3 s TYR 288 N -5.77 0.33 -0.01 4.55 2.02 -1.05 -4.31 117.35 113.10 2jb3 s TYR 288 Ca -0.10 -0.71 0.04 0.00 -0.37 0.00 0.00 57.07 55.93 2jb3 s TYR 288 Cb 0.20 -0.24 -0.01 0.00 -0.40 0.00 0.00 41.96 41.51 2jb3 s TYR 288 CO 0.79 -0.31 -0.14 0.00 -1.57 0.00 0.00 175.55 174.31 2jb3 s ALA 289 N -2.68 1.18 -0.37 3.71 0.00 -0.47 -1.57 121.76 121.56 2jb3 s ALA 289 Ca -0.04 -0.59 -0.06 0.00 0.00 0.00 0.00 51.96 51.27 2jb3 s ALA 289 Cb -0.01 -0.32 0.07 0.00 0.00 0.00 0.00 23.12 22.86 2jb3 s ALA 289 CO -0.05 0.27 0.15 0.42 0.00 0.00 0.00 175.76 176.56 2jb3 s ILE 290 N -0.26 3.67 -0.43 0.00 1.01 -0.47 -1.06 121.20 123.67 2jb3 s ILE 290 Ca 0.04 -1.46 -0.21 0.00 0.00 0.00 0.00 60.65 59.03 2jb3 s ILE 290 Cb -0.06 -3.23 0.02 0.00 0.01 0.00 0.00 42.46 39.20 2jb3 s ILE 290 CO -0.00 -0.38 0.64 0.00 0.00 0.00 0.00 174.94 175.21 2jb3 n THR 292 N 5.82 0.59 -1.78 0.00 -2.24 -0.29 -1.71 114.28 114.67 2jb3 n THR 292 Ca -0.02 -0.79 -0.42 0.00 -2.27 0.00 0.00 64.05 60.55 2jb3 n THR 292 Cb 0.48 0.83 -0.02 0.00 -2.10 0.00 0.00 70.33 69.52 2jb3 n THR 292 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2jb3 s ILE 293 N -1.08 2.12 0.19 2.28 1.01 -1.23 -4.87 121.20 119.63 2jb3 s ILE 293 Ca 0.25 0.10 -0.32 0.00 0.00 0.00 0.00 60.65 60.67 2jb3 s ILE 293 Cb 0.14 -3.06 -0.15 0.00 0.01 0.00 0.00 42.46 39.40 2jb3 s ILE 293 CO 0.19 0.01 1.14 -2.65 0.00 0.00 0.00 174.94 173.64 2jb3 n PRO 294 N 3.02 1.20 -0.11 2.79 -0.02 -1.26 -4.71 135.00 135.91 2jb3 n PRO 294 Ca 0.11 0.43 0.14 0.00 -2.02 0.00 0.00 63.50 62.16 2jb3 n PRO 294 Cb 0.37 -1.91 0.51 0.00 -0.02 0.00 0.00 33.50 32.45 2jb3 n PRO 294 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2jb3 h PRO 295 N 3.17 0.38 0.00 0.52 0.13 -1.90 0.11 132.00 134.41 2jb3 h PRO 295 Ca -0.42 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2jb3 h PRO 295 Cb 1.34 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2jb3 h PRO 295 CO 0.69 0.25 0.00 1.12 -0.23 0.00 0.00 178.00 179.83 2jb3 h HIS 296 N 0.39 0.00 0.00 1.56 2.07 -1.81 -2.81 115.15 114.55 2jb3 h HIS 296 Ca 0.31 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.83 2jb3 h HIS 296 Cb 0.69 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.67 2jb3 h HIS 296 CO -0.00 0.00 -1.42 1.28 -3.07 0.00 0.00 177.93 174.72 2jb3 n LEU 297 N -2.37 0.45 -0.22 6.12 4.77 0.35 -4.44 117.00 121.66 2jb3 n LEU 297 Ca 0.03 0.08 -0.07 0.00 -0.03 0.00 0.00 56.01 56.01 2jb3 n LEU 297 Cb 0.28 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.40 2jb3 n LEU 297 CO 0.23 -0.04 0.91 0.58 -1.33 0.00 0.00 177.39 177.74 2jb3 h VAL 298 N 0.00 1.26 -0.31 4.08 2.07 -1.20 -2.49 116.25 119.65 2jb3 h VAL 298 Ca 0.00 -1.03 0.09 0.00 0.82 0.00 0.00 66.70 66.59 2jb3 h VAL 298 Cb 0.92 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 2jb3 h VAL 298 CO 0.00 0.38 0.23 1.23 0.02 0.00 0.00 177.57 179.44 2jb3 h GLY 299 N 1.05 0.00 2.00 2.17 0.00 -1.78 -2.02 103.07 104.49 2jb3 h GLY 299 Ca 0.20 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.50 2jb3 h GLY 299 CO 0.01 0.00 -0.16 3.21 0.00 0.00 0.00 176.54 179.60 2jb3 h ARG 300 N 0.00 0.00 -7.21 4.80 3.08 -1.70 -3.44 114.38 109.90 2jb3 h ARG 300 Ca 0.15 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.68 2jb3 h ARG 300 Cb 0.61 0.00 0.12 0.00 0.08 0.00 0.00 29.97 30.78 2jb3 h ARG 300 CO -0.00 0.16 0.36 -0.51 -1.07 0.00 0.00 179.97 178.91 2jb3 s LEU 301 N -6.91 3.31 0.11 3.04 1.43 -0.76 -5.01 118.68 113.88 2jb3 s LEU 301 Ca -0.01 2.04 -0.30 0.00 -1.03 0.00 0.00 54.13 54.83 2jb3 s LEU 301 Cb 0.11 -4.55 -0.06 0.00 0.03 0.00 0.00 46.19 41.72 2jb3 s LEU 301 CO 0.60 -1.85 1.11 -1.10 0.23 0.00 0.00 176.35 175.34 2jb3 s GLN 302 N -4.19 4.54 0.27 1.70 -0.21 -0.24 -4.94 119.66 116.58 2jb3 s GLN 302 Ca 0.67 1.69 -0.16 0.00 0.02 0.00 0.00 55.36 57.58 2jb3 s GLN 302 Cb -0.22 -3.33 0.01 0.00 1.00 0.00 0.00 33.01 30.47 2jb3 s GLN 302 CO 0.45 -0.05 0.60 0.54 -2.12 0.00 0.00 175.29 174.70 2jb3 s ASN 303 N 0.44 -0.15 -0.31 5.90 4.22 -1.26 -0.86 114.94 122.93 2jb3 s ASN 303 Ca 0.53 -0.80 0.11 0.00 -2.14 0.00 0.00 52.86 50.56 2jb3 s ASN 303 Cb -0.28 0.66 0.47 0.00 1.28 0.00 0.00 41.25 43.38 2jb3 s ASN 303 CO 0.32 -1.25 1.15 -0.46 -2.04 0.00 0.00 177.10 174.81 2jb3 n ASN 304 N -0.46 3.95 -4.77 3.54 0.23 -1.24 -5.01 115.26 111.50 2jb3 n ASN 304 Ca -0.03 -3.30 -0.38 0.00 -0.53 0.00 0.00 54.58 50.34 2jb3 n ASN 304 Cb 0.60 -0.40 -0.05 0.00 -2.08 0.00 0.00 39.78 37.85 2jb3 n ASN 304 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2jb3 s LEU 305 N -3.61 4.44 0.56 -4.53 1.43 -1.26 -4.88 118.68 110.82 2jb3 s LEU 305 Ca 0.44 2.00 -0.20 0.00 -1.03 0.00 0.00 54.13 55.34 2jb3 s LEU 305 Cb 0.39 -3.85 -0.05 0.00 0.03 0.00 0.00 46.19 42.72 2jb3 s LEU 305 CO -0.01 -0.10 1.21 -2.84 0.23 0.00 0.00 176.35 174.85 2jb3 s PRO 306 N -1.75 3.17 0.28 1.29 0.02 -1.26 -4.76 135.00 131.98 2jb3 s PRO 306 Ca 0.48 1.85 0.02 0.00 0.02 0.00 0.00 61.00 63.37 2jb3 s PRO 306 Cb -0.24 -2.06 0.68 0.00 0.02 0.00 0.00 34.50 32.90 2jb3 s PRO 306 CO 0.31 -1.06 1.69 0.78 -0.33 0.00 0.00 177.00 178.39 2jb3 h GLY 307 N 1.19 1.42 2.00 0.52 0.00 -1.99 -1.50 103.07 104.71 2jb3 h GLY 307 Ca -0.50 -0.12 -0.03 0.00 0.00 0.00 0.00 47.33 46.67 2jb3 h GLY 307 CO 0.56 -0.27 -0.15 1.29 0.00 0.00 0.00 176.54 177.98 2jb3 h ASP 308 N 0.35 0.00 0.01 0.19 2.03 -1.99 -0.78 116.42 116.23 2jb3 h ASP 308 Ca 0.53 0.00 -0.21 0.00 -0.73 0.00 0.00 57.03 56.62 2jb3 h ASP 308 Cb 1.01 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.53 2jb3 h ASP 308 CO -0.54 0.15 -0.83 0.58 -1.03 0.00 0.00 179.24 177.56 2jb3 h VAL 309 N 0.00 1.36 -0.41 4.15 2.07 -1.64 -1.02 116.25 120.75 2jb3 h VAL 309 Ca -0.00 -2.19 -0.06 0.00 0.82 0.00 0.00 66.70 65.28 2jb3 h VAL 309 Cb 0.68 2.53 -0.02 0.00 -1.52 0.00 0.00 31.29 32.96 2jb3 h VAL 309 CO 0.02 0.66 0.01 -0.07 0.02 0.00 0.00 177.57 178.21 2jb3 h LEU 310 N 0.12 0.61 -0.31 2.57 3.38 -1.23 -1.12 115.31 119.32 2jb3 h LEU 310 Ca -0.11 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.63 2jb3 h LEU 310 Cb 1.52 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.11 2jb3 h LEU 310 CO 0.16 0.67 -0.23 0.74 0.09 0.00 0.00 178.44 179.87 2jb3 h THR 311 N 0.61 1.30 -0.55 0.22 2.02 -1.06 -3.02 112.91 112.42 2jb3 h THR 311 Ca 0.13 -1.37 0.04 0.00 0.77 0.00 0.00 66.41 65.98 2jb3 h THR 311 Cb 0.37 1.49 -0.04 0.00 -1.74 0.00 0.00 68.15 68.22 2jb3 h THR 311 CO 0.01 0.44 0.30 0.00 0.37 0.00 0.00 175.52 176.65 2jb3 h ALA 312 N 0.74 0.72 -0.54 6.16 0.00 -0.59 -2.48 119.26 123.27 2jb3 h ALA 312 Ca 0.06 0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.09 2jb3 h ALA 312 Cb 0.78 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 2jb3 h ALA 312 CO 0.06 -0.02 0.37 -0.07 0.00 0.00 0.00 179.25 179.59 2jb3 h LEU 313 N 0.59 0.25 -0.55 0.00 3.38 -1.10 -2.53 115.31 115.34 2jb3 h LEU 313 Ca 0.24 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2jb3 h LEU 313 Cb 0.11 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2jb3 h LEU 313 CO -0.14 0.15 0.00 0.11 0.09 0.00 0.00 178.44 178.64 2jb3 h LYS 314 N 0.28 0.00 0.00 1.13 1.57 -1.38 -3.14 116.57 115.02 2jb3 h LYS 314 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 2jb3 h LYS 314 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 2jb3 h LYS 314 CO -0.05 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.83 2jb3 n ALA 315 N -1.92 2.21 -2.92 3.86 0.00 -0.95 -4.36 120.51 116.43 2jb3 n ALA 315 Ca 0.03 -0.06 -0.44 0.00 0.00 0.00 0.00 53.44 52.97 2jb3 n ALA 315 Cb 0.36 -1.44 -0.01 0.00 0.00 0.00 0.00 19.45 18.37 2jb3 n ALA 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jb3 s ALA 316 N -3.05 3.84 0.32 0.00 0.00 -1.19 -1.28 121.76 120.41 2jb3 s ALA 316 Ca 0.12 -3.22 -0.29 0.00 0.00 0.00 0.00 51.96 48.57 2jb3 s ALA 316 Cb 0.16 -4.15 -0.10 0.00 0.00 0.00 0.00 23.12 19.03 2jb3 s ALA 316 CO 0.51 -2.85 1.24 0.15 0.00 0.00 0.00 175.76 174.82 2jb3 s LYS 317 N 1.96 4.42 0.68 0.00 -0.14 -0.43 -4.59 119.74 121.65 2jb3 s LYS 317 Ca 0.42 2.09 -0.11 0.00 -1.36 0.00 0.00 55.97 57.00 2jb3 s LYS 317 Cb -0.03 -3.09 0.00 0.00 -1.68 0.00 0.00 37.83 33.03 2jb3 s LYS 317 CO -0.01 -0.08 1.06 -1.25 -0.76 0.00 0.00 175.35 174.31 2jb3 s PRO 318 N -1.72 3.04 0.04 -1.68 0.04 -1.26 -1.38 135.00 132.08 2jb3 s PRO 318 Ca 0.48 0.78 -0.01 0.00 0.04 0.00 0.00 61.00 62.29 2jb3 s PRO 318 Cb -0.37 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.12 2jb3 s PRO 318 CO 0.49 -0.98 -0.03 -1.54 0.04 0.00 0.00 177.00 174.98 2jb3 s SER 319 N -4.02 0.40 -0.07 6.66 1.04 -1.16 -4.80 113.70 111.76 2jb3 s SER 319 Ca 0.57 -0.83 -0.14 0.00 0.48 0.00 0.00 55.95 56.03 2jb3 s SER 319 Cb -0.13 0.17 -0.05 0.00 0.10 0.00 0.00 66.02 66.11 2jb3 s SER 319 CO 0.54 -0.51 0.35 -0.44 0.98 0.00 0.00 173.24 174.17 2jb3 s SER 320 N -2.46 6.65 0.08 7.02 0.01 -1.26 -1.55 113.70 122.19 2jb3 s SER 320 Ca -0.00 0.77 -0.25 0.00 1.31 0.00 0.00 55.95 57.78 2jb3 s SER 320 Cb 0.02 -2.21 0.06 0.00 0.21 0.00 0.00 66.02 64.10 2jb3 s SER 320 CO -0.07 0.25 0.59 -0.55 0.41 0.00 0.00 173.24 173.87 2jb3 s SER 321 N -0.51 -0.55 0.12 2.44 0.15 -1.26 -1.25 113.70 112.84 2jb3 s SER 321 Ca 0.21 0.22 -0.26 0.00 0.70 0.00 0.00 55.95 56.82 2jb3 s SER 321 Cb -0.15 0.55 0.07 0.00 -1.71 0.00 0.00 66.02 64.79 2jb3 s SER 321 CO 0.09 -0.81 0.97 -0.83 1.20 0.00 0.00 173.24 173.87 2jb3 s GLY 322 N -2.16 -0.28 0.11 9.45 0.00 -0.53 -0.75 107.32 113.18 2jb3 s GLY 322 Ca -0.04 0.29 -0.04 0.00 0.00 0.00 0.00 44.72 44.93 2jb3 s GLY 322 CO -0.04 0.06 0.11 0.54 0.00 0.00 0.00 173.10 173.76 2jb3 s LYS 323 N -3.20 0.89 -0.09 2.90 1.02 -0.62 -2.06 119.74 118.59 2jb3 s LYS 323 Ca 0.11 -1.25 -0.05 0.00 0.02 0.00 0.00 55.97 54.81 2jb3 s LYS 323 Cb -0.01 0.28 0.04 0.00 -0.52 0.00 0.00 37.83 37.62 2jb3 s LYS 323 CO 0.00 -0.26 0.20 -1.17 -0.92 0.00 0.00 175.35 173.20 2jb3 s LEU 324 N -2.97 0.62 -0.04 3.17 0.20 -0.95 -1.26 118.68 117.46 2jb3 s LEU 324 Ca 0.15 0.43 0.04 0.00 0.69 0.00 0.00 54.13 55.45 2jb3 s LEU 324 Cb 0.06 0.60 -0.03 0.00 -0.43 0.00 0.00 46.19 46.39 2jb3 s LEU 324 CO -0.03 -0.15 -0.16 -0.83 -0.29 0.00 0.00 176.35 174.89 2jb3 s GLY 325 N 1.10 1.51 -0.18 7.98 0.00 -0.47 -0.11 107.32 117.15 2jb3 s GLY 325 Ca -0.08 -1.02 0.01 0.00 0.00 0.00 0.00 44.72 43.63 2jb3 s GLY 325 CO -0.07 -0.82 -0.19 -0.42 0.00 0.00 0.00 173.10 171.60 2jb3 s ILE 326 N -0.75 2.05 -0.18 0.90 1.01 0.29 -1.84 121.20 122.68 2jb3 s ILE 326 Ca 0.12 -0.97 -0.29 0.00 0.00 0.00 0.00 60.65 59.50 2jb3 s ILE 326 Cb -0.11 -1.87 -0.01 0.00 0.01 0.00 0.00 42.46 40.49 2jb3 s ILE 326 CO 0.01 0.50 1.13 -0.70 0.00 0.00 0.00 174.94 175.88 2jb3 s GLU 327 N 1.29 4.28 -0.06 2.79 2.12 -0.24 -0.42 118.70 128.45 2jb3 s GLU 327 Ca 0.04 1.50 -0.03 0.00 0.36 0.00 0.00 54.97 56.84 2jb3 s GLU 327 Cb -0.13 -3.67 -0.04 0.00 0.26 0.00 0.00 34.13 30.55 2jb3 s GLU 327 CO -0.12 -0.61 0.09 0.71 -0.54 0.00 0.00 175.26 174.79 2jb3 s TYR 328 N 3.09 3.38 -1.99 5.30 2.02 -0.09 0.04 117.35 129.10 2jb3 s TYR 328 Ca 0.49 0.32 0.12 0.00 -0.37 0.00 0.00 57.07 57.64 2jb3 s TYR 328 Cb -0.19 -1.82 0.36 0.00 -0.40 0.00 0.00 41.96 39.91 2jb3 s TYR 328 CO 0.12 0.60 1.30 -1.13 -1.57 0.00 0.00 175.55 174.86 2jb3 n SER 329 N 1.65 2.16 -3.71 2.29 3.41 0.10 -1.74 113.62 117.78 2jb3 n SER 329 Ca -0.16 -2.00 -0.12 0.00 -0.26 0.00 0.00 58.87 56.33 2jb3 n SER 329 Cb 0.54 -0.27 -0.12 0.00 -0.26 0.00 0.00 64.21 64.09 2jb3 n SER 329 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2jb3 s ARG 330 N -1.46 0.28 -1.34 4.33 3.52 -1.24 -4.57 118.95 118.47 2jb3 s ARG 330 Ca 0.27 0.65 -0.07 0.00 -0.13 0.00 0.00 55.73 56.45 2jb3 s ARG 330 Cb 0.14 -0.07 0.12 0.00 -1.56 0.00 0.00 34.95 33.57 2jb3 s ARG 330 CO 0.18 -0.17 2.26 0.54 -0.81 0.00 0.00 175.30 177.30 2jb3 n ARG 331 N 4.31 4.14 0.19 5.12 1.74 -1.26 -4.73 116.66 126.17 2jb3 n ARG 331 Ca -0.24 -3.35 0.15 0.00 -0.77 0.00 0.00 57.85 53.64 2jb3 n ARG 331 Cb 0.54 -2.76 0.75 0.00 -1.02 0.00 0.00 32.46 29.96 2jb3 n ARG 331 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 2jb3 h TRP 332 N 5.06 0.00 -0.25 -1.55 5.08 -1.97 -1.55 115.95 120.77 2jb3 h TRP 332 Ca 0.61 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 60.46 2jb3 h TRP 332 Cb 0.42 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.57 2jb3 h TRP 332 CO 1.51 0.00 -0.36 0.11 -1.28 0.00 0.00 178.44 178.42 2jb3 h TRP 333 N 0.00 0.65 0.16 0.12 0.09 -1.86 -0.75 115.95 114.36 2jb3 h TRP 333 Ca 0.08 -0.17 -0.22 0.00 0.09 0.00 0.00 58.89 58.67 2jb3 h TRP 333 Cb 0.38 -0.14 0.03 0.00 0.08 0.00 0.00 29.16 29.50 2jb3 h TRP 333 CO 0.00 0.84 -0.97 0.93 0.09 0.00 0.00 178.44 179.32 2jb3 h GLU 334 N 0.47 0.37 0.03 0.12 5.08 -1.23 0.19 114.58 119.60 2jb3 h GLU 334 Ca 0.05 -0.62 -0.24 0.00 -1.00 0.00 0.00 59.36 57.55 2jb3 h GLU 334 Cb 0.84 0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.32 2jb3 h GLU 334 CO 0.07 1.29 -1.00 1.79 -1.00 0.00 0.00 179.01 180.16 2jb3 h THR 335 N -0.23 1.41 0.00 1.13 1.35 -1.26 -2.55 112.91 112.77 2jb3 h THR 335 Ca -0.17 -2.55 -0.36 0.00 -0.55 0.00 0.00 66.41 62.78 2jb3 h THR 335 Cb 1.76 2.52 -0.06 0.00 -1.73 0.00 0.00 68.15 70.64 2jb3 h THR 335 CO 0.18 0.76 -2.25 -0.62 -0.25 0.00 0.00 175.52 173.34 2jb3 n GLU 336 N -3.71 0.50 0.00 4.72 1.02 -0.30 -4.70 120.64 118.17 2jb3 n GLU 336 Ca -0.07 0.18 0.13 0.00 -0.02 0.00 0.00 57.16 57.38 2jb3 n GLU 336 Cb 0.87 -1.34 0.29 0.00 -0.02 0.00 0.00 31.44 31.24 2jb3 n GLU 336 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2jb3 n ASP 337 N -3.72 1.41 -3.48 1.62 8.00 -0.91 -4.95 116.55 114.52 2jb3 n ASP 337 Ca -0.42 -1.16 -0.25 0.00 0.71 0.00 0.00 54.79 53.66 2jb3 n ASP 337 Cb 0.84 0.20 0.01 0.00 -0.02 0.00 0.00 41.12 42.15 2jb3 n ASP 337 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2jb3 n ARG 338 N -0.31 -4.34 -3.65 -1.24 5.12 -0.66 -4.94 116.66 106.64 2jb3 n ARG 338 Ca 0.12 0.60 -0.37 0.00 -1.93 0.00 0.00 57.85 56.27 2jb3 n ARG 338 Cb 0.39 -5.39 -0.10 0.00 -1.16 0.00 0.00 32.46 26.20 2jb3 n ARG 338 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2jb3 s ILE 339 N -3.10 5.35 -0.33 0.55 1.01 -0.03 -4.89 121.20 119.76 2jb3 s ILE 339 Ca 0.47 0.18 0.02 0.00 0.00 0.00 0.00 60.65 61.32 2jb3 s ILE 339 Cb -0.24 -3.50 0.10 0.00 0.01 0.00 0.00 42.46 38.83 2jb3 s ILE 339 CO 0.58 0.34 0.07 -0.31 0.00 0.00 0.00 174.94 175.61 2jb3 s TYR 340 N 1.13 2.88 0.11 3.97 2.02 -1.26 -2.99 117.35 123.21 2jb3 s TYR 340 Ca 0.07 -2.46 0.00 0.00 -0.37 0.00 0.00 57.07 54.32 2jb3 s TYR 340 Cb -0.14 -2.40 0.00 0.00 -0.40 0.00 0.00 41.96 39.02 2jb3 s TYR 340 CO 0.05 -0.92 0.00 0.41 -1.57 0.00 0.00 175.55 173.52 2jb3 n GLY 341 N 4.51 -1.85 0.42 0.71 0.00 -1.18 -5.02 105.19 102.78 2jb3 n GLY 341 Ca 0.01 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.75 2jb3 n GLY 341 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jb3 n GLY 342 N -1.74 -2.62 2.91 -0.02 0.00 -1.06 -4.68 105.19 97.98 2jb3 n GLY 342 Ca 0.00 -1.64 -0.16 0.00 0.00 0.00 0.00 46.02 44.22 2jb3 n GLY 342 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jb3 s ALA 343 N -1.01 0.39 0.43 4.61 0.00 -1.26 -0.91 121.76 124.01 2jb3 s ALA 343 Ca 0.00 -0.09 -0.20 0.00 0.00 0.00 0.00 51.96 51.67 2jb3 s ALA 343 Cb 0.00 -0.19 -0.10 0.00 0.00 0.00 0.00 23.12 22.83 2jb3 s ALA 343 CO 0.00 0.04 0.94 -1.12 0.00 0.00 0.00 175.76 175.62 2jb3 s SER 344 N 0.29 6.89 -0.00 0.00 0.01 0.51 -4.54 113.70 116.86 2jb3 s SER 344 Ca -0.03 1.64 0.04 0.00 1.31 0.00 0.00 55.95 58.92 2jb3 s SER 344 Cb -0.06 -2.52 -0.01 0.00 0.21 0.00 0.00 66.02 63.63 2jb3 s SER 344 CO -0.00 -0.37 -0.14 0.21 0.41 0.00 0.00 173.24 173.35 2jb3 s ASN 345 N -2.28 1.61 0.16 2.44 2.47 0.06 -1.33 114.94 118.07 2jb3 s ASN 345 Ca 0.61 -0.29 -0.15 0.00 0.42 0.00 0.00 52.86 53.45 2jb3 s ASN 345 Cb -0.09 -0.17 0.02 0.00 -1.45 0.00 0.00 41.25 39.57 2jb3 s ASN 345 CO 0.15 0.14 0.42 0.28 -3.72 0.00 0.00 177.10 174.38 2jb3 s THR 346 N -0.42 0.06 -1.08 -5.21 -1.32 -0.57 -1.77 115.64 105.33 2jb3 s THR 346 Ca 0.05 -0.82 0.27 0.00 -1.21 0.00 0.00 61.69 59.98 2jb3 s THR 346 Cb -0.06 -1.45 0.17 0.00 -1.51 0.00 0.00 72.50 69.65 2jb3 s THR 346 CO -0.00 -0.25 1.71 -0.90 -2.21 0.00 0.00 174.62 172.96 2jb3 n ASP 347 N -0.26 0.27 -4.61 8.08 5.75 -1.19 -4.39 116.55 120.19 2jb3 n ASP 347 Ca -0.12 0.05 -0.30 0.00 -0.01 0.00 0.00 54.79 54.41 2jb3 n ASP 347 Cb 0.63 -0.13 0.20 0.00 -1.03 0.00 0.00 41.12 40.78 2jb3 n ASP 347 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2jb3 s LYS 348 N -2.93 0.32 0.38 0.11 1.02 -1.26 -4.85 119.74 112.52 2jb3 s LYS 348 Ca 0.15 1.33 0.10 0.00 0.02 0.00 0.00 55.97 57.56 2jb3 s LYS 348 Cb 0.19 -1.66 0.86 0.00 -0.52 0.00 0.00 37.83 36.69 2jb3 s LYS 348 CO 0.59 -3.03 1.93 -0.44 -0.92 0.00 0.00 175.35 173.47 2jb3 h ASP 349 N -2.15 0.57 -0.54 2.83 3.32 -1.91 0.66 116.42 119.20 2jb3 h ASP 349 Ca -0.49 0.02 0.08 0.00 0.02 0.00 0.00 57.03 56.66 2jb3 h ASP 349 Cb 1.29 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.71 2jb3 h ASP 349 CO 0.44 0.33 0.36 0.16 -1.72 0.00 0.00 179.24 178.81 2jb3 h ILE 350 N 0.63 0.93 0.00 0.35 3.07 -1.90 -3.44 117.51 117.15 2jb3 h ILE 350 Ca 0.36 -0.13 0.00 0.00 1.55 0.00 0.00 64.86 66.64 2jb3 h ILE 350 Cb 0.55 0.50 0.00 0.00 -0.27 0.00 0.00 36.82 37.60 2jb3 h ILE 350 CO -0.13 0.07 0.00 -1.20 -1.05 0.00 0.00 178.15 175.84 2jb3 n SER 351 N -4.47 0.00 -3.56 2.16 7.64 0.22 -2.97 113.62 112.64 2jb3 n SER 351 Ca 0.08 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.86 2jb3 n SER 351 Cb 0.32 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.47 2jb3 n SER 351 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jb3 s GLN 352 N 0.00 0.63 -0.19 1.43 -2.07 -1.26 -1.51 119.66 116.69 2jb3 s GLN 352 Ca 0.00 0.07 0.01 0.00 -1.82 0.00 0.00 55.36 53.62 2jb3 s GLN 352 Cb 0.00 0.30 0.03 0.00 -1.09 0.00 0.00 33.01 32.24 2jb3 s GLN 352 CO 0.00 -0.21 -0.17 0.42 -1.32 0.00 0.00 175.29 174.01 2jb3 s ILE 353 N -1.48 1.94 -0.20 3.63 1.01 -0.44 -3.18 121.20 122.48 2jb3 s ILE 353 Ca -0.01 -0.97 -0.04 0.00 0.00 0.00 0.00 60.65 59.64 2jb3 s ILE 353 Cb -0.01 -1.82 -0.02 0.00 0.01 0.00 0.00 42.46 40.63 2jb3 s ILE 353 CO -0.00 0.42 -0.04 -0.04 0.00 0.00 0.00 174.94 175.27 2jb3 s MET 354 N 1.32 3.47 0.14 2.79 -1.94 -0.15 -0.36 119.30 124.56 2jb3 s MET 354 Ca 0.03 -0.60 -0.08 0.00 -1.71 0.00 0.00 55.69 53.33 2jb3 s MET 354 Cb -0.14 -2.97 -0.06 0.00 2.01 0.00 0.00 34.83 33.67 2jb3 s MET 354 CO -0.11 -0.05 0.43 -0.06 -0.01 0.00 0.00 175.02 175.22 2jb3 s PHE 355 N 1.10 3.51 0.62 -0.03 0.08 -0.09 -0.81 117.98 122.36 2jb3 s PHE 355 Ca 0.01 0.72 -0.17 0.00 0.12 0.00 0.00 56.93 57.61 2jb3 s PHE 355 Cb -0.15 -2.12 -0.02 0.00 -0.57 0.00 0.00 43.02 40.16 2jb3 s PHE 355 CO -0.00 0.43 1.18 -1.25 -0.10 0.00 0.00 175.22 175.48 2jb3 s PRO 356 N -2.40 2.84 0.00 0.24 0.04 -1.26 -3.88 135.00 130.58 2jb3 s PRO 356 Ca 0.39 1.70 0.17 0.00 0.04 0.00 0.00 61.00 63.30 2jb3 s PRO 356 Cb -0.13 -1.93 0.48 0.00 0.04 0.00 0.00 34.50 32.96 2jb3 s PRO 356 CO 0.21 -1.28 1.40 2.48 0.04 0.00 0.00 177.00 179.85 2jb3 n TYR 357 N -1.91 0.72 -4.43 0.56 0.18 -1.26 -3.13 117.16 107.90 2jb3 n TYR 357 Ca 0.13 -0.49 -0.21 0.00 1.88 0.00 0.00 57.90 59.20 2jb3 n TYR 357 Cb 0.50 -0.01 -0.10 0.00 -0.38 0.00 0.00 39.34 39.35 2jb3 n TYR 357 CO 0.00 0.00 0.00 0.16 -2.08 0.00 0.00 176.86 174.94 2jb3 s ASP 358 N -1.01 2.13 -1.48 9.48 -4.77 -1.26 -4.87 116.67 114.89 2jb3 s ASP 358 Ca 0.36 -1.44 -0.12 0.00 -3.30 0.00 0.00 52.55 48.05 2jb3 s ASP 358 Cb 0.19 0.11 0.07 0.00 -1.09 0.00 0.00 42.92 42.20 2jb3 s ASP 358 CO 0.25 -0.71 0.83 1.41 0.70 0.00 0.00 175.17 177.65 2jb3 n HIS 359 N -0.67 -2.16 -1.72 2.11 8.25 -1.26 -4.90 115.22 114.87 2jb3 n HIS 359 Ca -0.02 0.76 -0.42 0.00 -0.26 0.00 0.00 57.72 57.79 2jb3 n HIS 359 Cb 0.66 -3.81 0.00 0.00 1.12 0.00 0.00 29.99 27.96 2jb3 n HIS 359 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2jb3 n TYR 360 N -4.51 2.43 -1.09 4.41 4.01 -1.26 -1.82 117.16 119.33 2jb3 n TYR 360 Ca 0.01 0.51 -0.03 0.00 -0.16 0.00 0.00 57.90 58.23 2jb3 n TYR 360 Cb 0.54 -2.43 -0.01 0.00 -0.31 0.00 0.00 39.34 37.12 2jb3 n TYR 360 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2jb3 n ASN 361 N 0.48 -5.44 -2.26 7.72 3.02 -1.26 -4.99 115.26 112.52 2jb3 n ASN 361 Ca 0.04 0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.67 2jb3 n ASN 361 Cb 0.38 -3.22 0.00 0.00 -0.61 0.00 0.00 39.78 36.33 2jb3 n ASN 361 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2jb3 n SER 362 N -0.84 0.00 0.02 6.41 3.41 -0.75 -5.00 113.62 116.86 2jb3 n SER 362 Ca -0.03 -0.39 0.11 0.00 -0.26 0.00 0.00 58.87 58.30 2jb3 n SER 362 Cb 0.45 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.35 2jb3 n SER 362 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2jb3 n ASP 363 N -1.16 0.57 -3.87 4.04 5.75 -1.26 -4.69 116.55 115.92 2jb3 n ASP 363 Ca 0.00 -0.30 -0.08 0.00 -0.01 0.00 0.00 54.79 54.40 2jb3 n ASP 363 Cb 0.00 1.07 -0.03 0.00 -1.03 0.00 0.00 41.12 41.13 2jb3 n ASP 363 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jb3 s ARG 364 N -3.23 1.66 -0.25 0.11 1.70 -1.26 -3.58 118.95 114.09 2jb3 s ARG 364 Ca 0.02 -1.03 -0.35 0.00 -0.47 0.00 0.00 55.73 53.90 2jb3 s ARG 364 Cb 0.14 0.56 0.16 0.00 -0.57 0.00 0.00 34.95 35.24 2jb3 s ARG 364 CO 0.84 -0.73 1.31 0.20 -1.08 0.00 0.00 175.30 175.83 2jb3 s GLY 365 N -2.94 -0.16 -0.18 3.88 0.00 -0.71 -4.88 107.32 102.33 2jb3 s GLY 365 Ca 0.14 2.04 -0.12 0.00 0.00 0.00 0.00 44.72 46.77 2jb3 s GLY 365 CO 0.06 0.73 0.23 0.14 0.00 0.00 0.00 173.10 174.26 2jb3 s VAL 366 N -1.89 5.34 -0.09 1.40 1.01 -1.26 -0.91 120.40 124.00 2jb3 s VAL 366 Ca 0.10 0.41 -0.01 0.00 0.00 0.00 0.00 61.98 62.47 2jb3 s VAL 366 Cb -0.01 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 2jb3 s VAL 366 CO -0.04 0.39 -0.02 -0.69 0.00 0.00 0.00 175.10 174.74 2jb3 s VAL 367 N 0.55 4.12 -0.87 2.92 1.01 0.44 -4.03 120.40 124.54 2jb3 s VAL 367 Ca 0.13 -0.32 -0.23 0.00 0.00 0.00 0.00 61.98 61.57 2jb3 s VAL 367 Cb -0.12 -2.73 0.07 0.00 0.00 0.00 0.00 36.38 33.60 2jb3 s VAL 367 CO 0.02 0.59 1.25 -0.69 0.00 0.00 0.00 175.10 176.27 2jb3 s VAL 368 N -0.73 4.14 0.36 2.92 1.01 0.01 -0.55 120.40 127.57 2jb3 s VAL 368 Ca 0.11 -0.63 0.27 0.00 0.00 0.00 0.00 61.98 61.74 2jb3 s VAL 368 Cb -0.11 -4.89 0.28 0.00 0.00 0.00 0.00 36.38 31.66 2jb3 s VAL 368 CO 0.02 -1.73 2.02 0.00 0.00 0.00 0.00 175.10 175.41 2jb3 h ALA 369 N 9.58 1.22 -2.40 5.51 0.00 -0.80 -0.38 119.26 131.98 2jb3 h ALA 369 Ca -0.01 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 2jb3 h ALA 369 Cb 1.03 -0.02 -0.21 0.00 0.00 0.00 0.00 17.79 18.59 2jb3 h ALA 369 CO 1.27 0.17 -0.10 1.52 0.00 0.00 0.00 179.25 182.11 2jb3 s TYR 370 N -4.07 -0.46 -0.29 0.00 -0.85 -1.15 -4.60 117.35 105.94 2jb3 s TYR 370 Ca -0.02 0.96 -0.03 0.00 -0.52 0.00 0.00 57.07 57.45 2jb3 s TYR 370 Cb 0.12 0.21 0.10 0.00 0.38 0.00 0.00 41.96 42.77 2jb3 s TYR 370 CO 0.59 -0.38 0.12 -0.47 -1.52 0.00 0.00 175.55 173.89 2jb3 s TYR 371 N -0.56 0.72 0.31 -3.49 5.04 -1.16 -2.23 117.35 115.98 2jb3 s TYR 371 Ca -0.07 -1.10 0.06 0.00 -2.44 0.00 0.00 57.07 53.53 2jb3 s TYR 371 Cb -0.03 -1.12 -0.06 0.00 0.35 0.00 0.00 41.96 41.09 2jb3 s TYR 371 CO 0.04 -0.83 -0.02 -1.54 -1.34 0.00 0.00 175.55 171.86 2jb3 s SER 372 N 1.96 2.89 0.23 4.32 1.04 -0.87 -4.35 113.70 118.91 2jb3 s SER 372 Ca 0.09 -1.26 -0.11 0.00 0.48 0.00 0.00 55.95 55.14 2jb3 s SER 372 Cb -0.16 -0.19 -0.01 0.00 0.10 0.00 0.00 66.02 65.76 2jb3 s SER 372 CO -0.32 -0.41 0.42 -0.44 0.98 0.00 0.00 173.24 173.47 2jb3 s SER 373 N -3.50 -0.06 0.76 7.02 0.01 -1.26 -1.45 113.70 115.22 2jb3 s SER 373 Ca 0.32 -0.94 0.00 0.00 1.31 0.00 0.00 55.95 56.65 2jb3 s SER 373 Cb 0.06 0.54 0.00 0.00 0.21 0.00 0.00 66.02 66.83 2jb3 s SER 373 CO 0.14 -1.07 0.00 0.61 0.41 0.00 0.00 173.24 173.33 2jb3 n GLY 374 N -0.34 2.58 0.32 3.44 0.00 -0.38 -2.65 105.19 108.15 2jb3 n GLY 374 Ca -0.03 -0.34 0.06 0.00 0.00 0.00 0.00 46.02 45.72 2jb3 n GLY 374 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2jb3 h LYS 375 N 0.00 0.73 0.00 1.61 3.64 -1.99 -1.43 116.57 119.13 2jb3 h LYS 375 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2jb3 h LYS 375 Cb 0.00 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.66 2jb3 h LYS 375 CO 0.00 0.48 0.00 0.54 -2.27 0.00 0.00 179.45 178.20 2jb3 n ARG 376 N -4.78 0.04 -0.03 1.90 1.74 -1.09 -1.66 116.66 112.78 2jb3 n ARG 376 Ca 0.17 0.23 -0.11 0.00 -0.77 0.00 0.00 57.85 57.37 2jb3 n ARG 376 Cb 0.39 -1.57 -0.14 0.00 -1.02 0.00 0.00 32.46 30.11 2jb3 n ARG 376 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 2jb3 n GLN 377 N -1.64 0.66 0.00 5.56 -0.06 -0.62 -4.05 117.38 117.23 2jb3 n GLN 377 Ca 0.04 0.24 0.17 0.00 -2.00 0.00 0.00 57.00 55.45 2jb3 n GLN 377 Cb 0.22 -1.73 0.64 0.00 -4.06 0.00 0.00 30.24 25.31 2jb3 n GLN 377 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 2jb3 h GLU 378 N 0.01 0.09 0.00 3.69 5.08 -0.49 0.50 114.58 123.46 2jb3 h GLU 378 Ca -0.35 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 2jb3 h GLU 378 Cb 2.05 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.28 2jb3 h GLU 378 CO 0.07 0.06 0.00 0.00 -1.00 0.00 0.00 179.01 178.14 2jb3 h ALA 379 N 1.75 1.00 0.00 3.43 0.00 -1.62 -3.15 119.26 120.67 2jb3 h ALA 379 Ca 0.24 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 2jb3 h ALA 379 Cb 0.83 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2jb3 h ALA 379 CO -0.02 0.00 -1.35 1.19 0.00 0.00 0.00 179.25 179.06 2jb3 n PHE 380 N -2.48 0.00 -0.21 0.00 3.72 0.16 -4.75 117.46 113.90 2jb3 n PHE 380 Ca -0.01 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.35 2jb3 n PHE 380 Cb 0.09 -0.24 0.03 0.00 -0.94 0.00 0.00 39.48 38.42 2jb3 n PHE 380 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2jb3 h GLU 381 N 0.00 -0.11 0.00 -1.08 5.08 -1.11 -1.42 114.58 115.93 2jb3 h GLU 381 Ca -0.11 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2jb3 h GLU 381 Cb 1.08 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.35 2jb3 h GLU 381 CO 0.01 -0.08 0.00 0.77 -1.00 0.00 0.00 179.01 178.71 2jb3 h SER 382 N -0.12 0.00 -3.91 1.42 0.02 -1.88 -3.45 113.55 105.63 2jb3 h SER 382 Ca 0.26 0.00 -0.50 0.00 -0.84 0.00 0.00 61.79 60.71 2jb3 h SER 382 Cb 0.54 0.00 0.04 0.00 0.14 0.00 0.00 62.40 63.12 2jb3 h SER 382 CO -0.68 0.00 0.49 -0.76 -1.14 0.00 0.00 176.83 174.74 2jb3 s LEU 383 N -5.26 4.29 1.12 5.07 1.43 -0.54 -5.04 118.68 119.75 2jb3 s LEU 383 Ca 0.08 2.31 -0.12 0.00 -1.03 0.00 0.00 54.13 55.37 2jb3 s LEU 383 Cb 0.09 -3.93 0.26 0.00 0.03 0.00 0.00 46.19 42.64 2jb3 s LEU 383 CO 0.59 -0.52 1.05 0.42 0.23 0.00 0.00 176.35 178.13 2jb3 s THR 384 N -1.37 2.01 0.14 5.49 -4.23 -1.26 -4.79 115.64 111.63 2jb3 s THR 384 Ca 0.54 0.00 -0.16 0.00 -1.18 0.00 0.00 61.69 60.89 2jb3 s THR 384 Cb -0.30 -2.01 -0.00 0.00 1.34 0.00 0.00 72.50 71.52 2jb3 s THR 384 CO 0.39 -0.00 1.72 -0.74 -0.54 0.00 0.00 174.62 175.44 2jb3 h HIS 385 N -2.52 0.57 -0.70 3.99 2.76 -1.96 0.11 115.15 117.41 2jb3 h HIS 385 Ca -0.58 -0.03 0.04 0.00 -2.20 0.00 0.00 60.37 57.61 2jb3 h HIS 385 Cb 1.32 -0.18 -0.05 0.00 1.55 0.00 0.00 27.41 30.05 2jb3 h HIS 385 CO 0.32 0.47 0.42 -0.09 -1.30 0.00 0.00 177.93 177.75 2jb3 h ARG 386 N 0.50 0.78 -0.43 5.26 2.43 -1.99 -0.54 114.38 120.39 2jb3 h ARG 386 Ca 0.14 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 2jb3 h ARG 386 Cb 0.11 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 2jb3 h ARG 386 CO -0.02 0.52 0.18 1.96 -1.51 0.00 0.00 179.97 181.10 2jb3 h GLN 387 N 0.80 0.65 -0.27 0.20 4.20 -1.78 -1.90 115.11 117.02 2jb3 h GLN 387 Ca 0.29 -0.11 0.06 0.00 0.06 0.00 0.00 58.65 58.94 2jb3 h GLN 387 Cb 0.08 -0.11 -0.05 0.00 0.30 0.00 0.00 27.48 27.70 2jb3 h GLN 387 CO -0.14 0.59 -0.08 0.00 -0.67 0.00 0.00 178.83 178.53 2jb3 h ARG 388 N 0.56 -0.02 -0.35 1.46 3.08 -0.18 -1.55 114.38 117.38 2jb3 h ARG 388 Ca 0.15 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.22 2jb3 h ARG 388 Cb 0.18 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 2jb3 h ARG 388 CO -0.01 -0.02 0.17 1.25 -1.07 0.00 0.00 179.97 180.29 2jb3 h LEU 389 N -0.02 0.25 -0.86 3.04 5.85 -1.00 -0.66 115.31 121.90 2jb3 h LEU 389 Ca 0.13 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.90 2jb3 h LEU 389 Cb 0.23 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.18 2jb3 h LEU 389 CO -0.29 0.18 0.56 0.00 -0.34 0.00 0.00 178.44 178.55 2jb3 h ALA 390 N 1.18 1.13 -0.35 1.25 0.00 -1.07 0.24 119.26 121.64 2jb3 h ALA 390 Ca 0.15 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 2jb3 h ALA 390 Cb 0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2jb3 h ALA 390 CO -0.10 0.41 -0.35 -0.22 0.00 0.00 0.00 179.25 178.99 2jb3 h LYS 391 N 1.09 0.81 -0.28 0.00 3.64 -1.12 -1.15 116.57 119.56 2jb3 h LYS 391 Ca 0.34 -0.40 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 2jb3 h LYS 391 Cb -0.02 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2jb3 h LYS 391 CO -0.11 1.03 0.03 0.00 -2.27 0.00 0.00 179.45 178.13 2jb3 h ALA 392 N 0.93 0.38 -0.42 5.00 0.00 -0.85 -0.85 119.26 123.44 2jb3 h ALA 392 Ca 0.06 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 2jb3 h ALA 392 Cb 0.90 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2jb3 h ALA 392 CO 0.08 0.09 -0.18 0.82 0.00 0.00 0.00 179.25 180.06 2jb3 h ILE 393 N 0.29 1.27 -0.03 0.00 2.04 -0.86 -0.62 117.51 119.60 2jb3 h ILE 393 Ca 0.08 -1.29 -0.00 0.00 1.00 0.00 0.00 64.86 64.66 2jb3 h ILE 393 Cb 0.37 1.14 -0.00 0.00 -0.74 0.00 0.00 36.82 37.59 2jb3 h ILE 393 CO 0.01 0.43 0.01 0.00 0.00 0.00 0.00 178.15 178.61 2jb3 h ALA 394 N 1.08 0.04 -0.06 1.87 0.00 -0.75 0.95 119.26 122.39 2jb3 h ALA 394 Ca 0.10 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 2jb3 h ALA 394 Cb 0.69 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2jb3 h ALA 394 CO 0.05 -0.40 -0.71 0.93 0.00 0.00 0.00 179.25 179.12 2jb3 h GLU 395 N -0.08 0.32 -0.20 0.00 5.08 -1.15 -2.96 114.58 115.60 2jb3 h GLU 395 Ca 0.01 -0.26 -0.15 0.00 -1.00 0.00 0.00 59.36 57.96 2jb3 h GLU 395 Cb 0.12 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2jb3 h GLU 395 CO -0.00 0.91 -0.50 0.78 -1.00 0.00 0.00 179.01 179.20 2jb3 h GLY 396 N 1.43 0.59 2.00 -3.84 0.00 -0.97 -2.56 103.07 99.71 2jb3 h GLY 396 Ca -0.02 -0.65 -0.04 0.00 0.00 0.00 0.00 47.33 46.61 2jb3 h GLY 396 CO 0.12 0.59 -0.20 1.48 0.00 0.00 0.00 176.54 178.52 2jb3 h SER 397 N 0.43 0.00 0.70 0.19 4.64 -0.72 -0.61 113.55 118.18 2jb3 h SER 397 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2jb3 h SER 397 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 2jb3 h SER 397 CO 0.09 0.20 0.00 -0.33 -0.87 0.00 0.00 176.83 175.93 2jb3 h GLU 398 N 0.00 0.00 0.00 4.77 5.08 -1.29 -0.96 114.58 122.18 2jb3 h GLU 398 Ca -0.00 0.00 -0.44 0.00 -1.00 0.00 0.00 59.36 57.92 2jb3 h GLU 398 Cb 0.36 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.55 2jb3 h GLU 398 CO 0.03 0.00 -2.48 -0.89 -1.00 0.00 0.00 179.01 174.66 2jb3 n ILE 399 N -3.01 1.52 0.15 3.13 5.41 -0.57 -4.73 119.36 121.28 2jb3 n ILE 399 Ca -0.00 -0.42 0.05 0.00 1.00 0.00 0.00 62.75 63.38 2jb3 n ILE 399 Cb 0.23 -1.79 0.09 0.00 -0.71 0.00 0.00 39.64 37.47 2jb3 n ILE 399 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 2jb3 n HIS 400 N -4.04 0.22 -1.06 1.39 8.25 -0.34 -4.74 115.22 114.89 2jb3 n HIS 400 Ca -0.52 -0.24 0.00 0.00 -0.26 0.00 0.00 57.72 56.70 2jb3 n HIS 400 Cb 0.90 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 32.00 2jb3 n HIS 400 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jb3 n GLY 401 N 0.55 -2.60 0.36 -1.41 0.00 -0.37 -4.46 105.19 97.26 2jb3 n GLY 401 Ca 0.09 -1.74 0.12 0.00 0.00 0.00 0.00 46.02 44.49 2jb3 n GLY 401 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2jb3 h GLU 402 N 0.00 0.46 -0.50 1.61 5.08 -1.96 -1.51 114.58 117.77 2jb3 h GLU 402 Ca 0.00 -0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.48 2jb3 h GLU 402 Cb 0.00 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 2jb3 h GLU 402 CO 0.00 0.31 0.53 1.57 -1.00 0.00 0.00 179.01 180.42 2jb3 h LYS 403 N 0.48 0.00 0.00 2.33 2.10 -1.95 -0.48 116.57 119.05 2jb3 h LYS 403 Ca 0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.97 2jb3 h LYS 403 Cb 0.60 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.93 2jb3 h LYS 403 CO -0.10 0.00 0.00 -0.92 -2.00 0.00 0.00 179.45 176.43 2jb3 h TYR 404 N 0.00 0.00 -0.01 0.07 3.20 -1.49 -2.44 116.97 116.30 2jb3 h TYR 404 Ca 0.24 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.11 2jb3 h TYR 404 Cb 1.30 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.57 2jb3 h TYR 404 CO 0.00 0.00 -0.30 0.25 -1.64 0.00 0.00 178.16 176.47 2jb3 n THR 405 N -2.89 0.00 -4.18 1.81 -2.24 -0.19 -4.90 114.28 101.69 2jb3 n THR 405 Ca -0.00 -0.25 -0.22 0.00 -2.27 0.00 0.00 64.05 61.31 2jb3 n THR 405 Cb 0.21 0.95 -0.05 0.00 -2.10 0.00 0.00 70.33 69.33 2jb3 n THR 405 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2jb3 s ARG 406 N -2.38 2.70 -1.61 -0.78 0.52 -0.92 -4.66 118.95 111.82 2jb3 s ARG 406 Ca 0.23 -1.19 -0.03 0.00 -0.52 0.00 0.00 55.73 54.22 2jb3 s ARG 406 Cb 0.19 -2.42 0.00 0.00 0.52 0.00 0.00 34.95 33.25 2jb3 s ARG 406 CO 0.50 0.39 0.43 -0.25 0.02 0.00 0.00 175.30 176.39 2jb3 n ASP 407 N -1.08 -6.05 -4.67 0.23 8.00 -1.26 -4.88 116.55 106.84 2jb3 n ASP 407 Ca -0.07 -0.21 -0.40 0.00 0.71 0.00 0.00 54.79 54.81 2jb3 n ASP 407 Cb 0.58 -4.91 -0.05 0.00 -0.02 0.00 0.00 41.12 36.72 2jb3 n ASP 407 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2jb3 s ILE 408 N -3.14 4.97 -0.22 0.53 1.01 -1.26 0.02 121.20 123.11 2jb3 s ILE 408 Ca 0.21 1.38 -0.17 0.00 0.00 0.00 0.00 60.65 62.08 2jb3 s ILE 408 Cb -0.09 -4.03 -0.18 0.00 0.01 0.00 0.00 42.46 38.17 2jb3 s ILE 408 CO 0.27 0.10 0.06 -1.20 0.00 0.00 0.00 174.94 174.16 2jb3 n SER 409 N 4.96 1.92 -2.81 3.58 7.64 0.11 -4.92 113.62 124.11 2jb3 n SER 409 Ca 0.01 0.35 -0.05 0.00 1.01 0.00 0.00 58.87 60.19 2jb3 n SER 409 Cb 0.50 -0.89 0.02 0.00 -1.01 0.00 0.00 64.21 62.82 2jb3 n SER 409 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2jb3 n SER 410 N -4.23 -1.71 -3.67 6.43 3.41 -1.19 -5.01 113.62 107.64 2jb3 n SER 410 Ca -0.39 -2.03 -0.07 0.00 -0.26 0.00 0.00 58.87 56.12 2jb3 n SER 410 Cb 0.79 2.81 -0.02 0.00 -0.26 0.00 0.00 64.21 67.53 2jb3 n SER 410 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2jb3 s SER 411 N -2.98 -0.32 -0.28 4.04 1.04 -1.26 -1.08 113.70 112.86 2jb3 s SER 411 Ca 0.17 -0.32 -0.16 0.00 0.48 0.00 0.00 55.95 56.12 2jb3 s SER 411 Cb -0.03 0.57 0.11 0.00 0.10 0.00 0.00 66.02 66.77 2jb3 s SER 411 CO 0.07 -1.01 0.82 0.12 0.98 0.00 0.00 173.24 174.22 2jb3 s PHE 412 N -3.56 -0.83 0.22 5.02 5.36 -0.77 -4.78 117.98 118.65 2jb3 s PHE 412 Ca 0.08 1.67 0.10 0.00 -0.96 0.00 0.00 56.93 57.83 2jb3 s PHE 412 Cb -0.03 0.49 -0.05 0.00 -0.34 0.00 0.00 43.02 43.10 2jb3 s PHE 412 CO -0.01 -0.41 -0.19 -1.54 -1.46 0.00 0.00 175.22 171.61 2jb3 s SER 413 N 1.45 3.13 -0.00 6.13 1.04 -1.26 -1.36 113.70 122.82 2jb3 s SER 413 Ca -0.09 -0.96 0.02 0.00 0.48 0.00 0.00 55.95 55.39 2jb3 s SER 413 Cb -0.04 -0.22 -0.01 0.00 0.10 0.00 0.00 66.02 65.85 2jb3 s SER 413 CO -0.17 -0.01 -0.06 -0.83 0.98 0.00 0.00 173.24 173.15 2jb3 s GLY 414 N -3.14 0.32 -0.21 7.32 0.00 -0.39 -5.00 107.32 106.21 2jb3 s GLY 414 Ca 0.24 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.66 2jb3 s GLY 414 CO 0.10 -0.26 -0.07 -0.45 0.00 0.00 0.00 173.10 172.43 2jb3 s SER 415 N -0.23 3.47 0.35 1.64 0.15 -1.26 -1.58 113.70 116.24 2jb3 s SER 415 Ca 0.02 -0.97 0.06 0.00 0.70 0.00 0.00 55.95 55.76 2jb3 s SER 415 Cb -0.03 -1.13 0.65 0.00 -1.71 0.00 0.00 66.02 63.80 2jb3 s SER 415 CO -0.00 -0.20 1.87 -0.50 1.20 0.00 0.00 173.24 175.62 2jb3 h TRP 416 N 8.00 0.43 0.00 3.44 4.06 -1.28 -0.23 115.95 130.37 2jb3 h TRP 416 Ca -0.22 -0.05 -0.01 0.00 2.06 0.00 0.00 58.89 60.66 2jb3 h TRP 416 Cb 1.09 -0.12 -0.00 0.00 -1.00 0.00 0.00 29.16 29.13 2jb3 h TRP 416 CO 0.49 0.49 -0.06 0.00 -3.56 0.00 0.00 178.44 175.80 2jb3 h ARG 417 N 0.39 0.00 -0.54 0.49 3.08 -1.77 -2.33 114.38 113.70 2jb3 h ARG 417 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 2jb3 h ARG 417 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.43 2jb3 h ARG 417 CO 0.02 0.06 0.00 0.54 -1.07 0.00 0.00 179.97 179.52 2jb3 n ARG 418 N -3.34 3.80 -4.67 0.04 5.12 -0.12 -4.31 116.66 113.18 2jb3 n ARG 418 Ca -0.01 -2.88 -0.33 0.00 -1.93 0.00 0.00 57.85 52.70 2jb3 n ARG 418 Cb 0.21 -1.92 -0.16 0.00 -1.16 0.00 0.00 32.46 29.43 2jb3 n ARG 418 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 2jb3 s THR 419 N -2.15 2.09 0.29 0.55 -1.32 -0.91 -1.17 115.64 113.02 2jb3 s THR 419 Ca 0.48 -0.97 -0.30 0.00 -1.21 0.00 0.00 61.69 59.69 2jb3 s THR 419 Cb 0.33 -1.84 -0.13 0.00 -1.51 0.00 0.00 72.50 69.36 2jb3 s THR 419 CO 0.19 0.55 1.40 1.17 -2.21 0.00 0.00 174.62 175.72 2jb3 n LYS 420 N 4.06 2.20 -0.95 7.08 4.81 -1.26 -0.73 118.16 133.36 2jb3 n LYS 420 Ca -0.20 0.78 0.00 0.00 -0.87 0.00 0.00 58.31 58.02 2jb3 n LYS 420 Cb 0.52 -2.43 0.00 0.00 0.02 0.00 0.00 35.03 33.13 2jb3 n LYS 420 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2jb3 n TYR 421 N 1.39 0.00 0.00 5.64 4.01 -1.26 -4.72 117.16 122.22 2jb3 n TYR 421 Ca 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 2jb3 n TYR 421 Cb 0.34 -0.34 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 2jb3 n TYR 421 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2jb3 n SER 422 N -0.10 0.00 -1.80 7.72 7.64 -0.82 -4.79 113.62 121.46 2jb3 n SER 422 Ca 0.00 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.70 2jb3 n SER 422 Cb 0.05 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.20 2jb3 n SER 422 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2jb3 n GLU 423 N -2.42 -1.54 -3.61 1.43 1.02 0.09 -4.85 120.64 110.75 2jb3 n GLU 423 Ca 0.00 1.01 -0.05 0.00 -0.02 0.00 0.00 57.16 58.10 2jb3 n GLU 423 Cb 0.00 -5.45 -0.04 0.00 -0.02 0.00 0.00 31.44 25.93 2jb3 n GLU 423 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2jb3 s SER 424 N -2.38 -0.17 0.04 1.62 0.15 -1.04 -4.55 113.70 107.37 2jb3 s SER 424 Ca 0.00 0.18 -0.02 0.00 0.70 0.00 0.00 55.95 56.82 2jb3 s SER 424 Cb 0.00 0.14 -0.27 0.00 -1.71 0.00 0.00 66.02 64.18 2jb3 s SER 424 CO 0.00 -0.16 1.00 0.00 1.20 0.00 0.00 173.24 175.28 2jb3 h ALA 425 N 2.25 0.24 -1.02 5.45 0.00 -1.54 -3.42 119.26 121.22 2jb3 h ALA 425 Ca -0.12 -1.02 0.36 0.00 0.00 0.00 0.00 54.91 54.13 2jb3 h ALA 425 Cb 1.18 0.14 -0.18 0.00 0.00 0.00 0.00 17.79 18.93 2jb3 h ALA 425 CO 0.26 1.11 0.99 1.67 0.00 0.00 0.00 179.25 183.28 2jb3 s TRP 426 N -2.64 -0.00 0.05 0.00 -2.14 -1.26 -4.90 118.94 108.05 2jb3 s TRP 426 Ca -0.06 0.00 -0.13 0.00 2.66 0.00 0.00 56.10 58.58 2jb3 s TRP 426 Cb 0.07 0.50 -0.06 0.00 -3.10 0.00 0.00 33.47 30.89 2jb3 s TRP 426 CO 0.86 -0.01 0.42 0.00 -2.66 0.00 0.00 176.95 175.56 2jb3 s ALA 427 N -2.02 3.69 -0.19 2.67 0.00 -1.26 -3.00 121.76 121.65 2jb3 s ALA 427 Ca 0.13 -0.27 0.01 0.00 0.00 0.00 0.00 51.96 51.83 2jb3 s ALA 427 Cb 0.03 -2.36 0.02 0.00 0.00 0.00 0.00 23.12 20.82 2jb3 s ALA 427 CO -0.04 0.51 -0.18 -0.80 0.00 0.00 0.00 175.76 175.25 2jb3 s ASN 428 N -1.44 3.37 -0.10 0.00 -0.87 -0.48 -4.92 114.94 110.51 2jb3 s ASN 428 Ca 0.29 -0.74 -0.30 0.00 -1.57 0.00 0.00 52.86 50.55 2jb3 s ASN 428 Cb -0.15 -1.50 -0.02 0.00 -0.02 0.00 0.00 41.25 39.56 2jb3 s ASN 428 CO 0.16 -0.03 1.08 0.26 -2.57 0.00 0.00 177.10 176.00 2jb3 s TRP 429 N 1.27 3.38 0.11 2.20 0.52 -1.26 -1.31 118.94 123.85 2jb3 s TRP 429 Ca 0.03 1.44 -0.31 0.00 0.02 0.00 0.00 56.10 57.28 2jb3 s TRP 429 Cb -0.14 -3.28 -0.10 0.00 -1.15 0.00 0.00 33.47 28.80 2jb3 s TRP 429 CO -0.11 -0.65 1.86 0.00 0.02 0.00 0.00 176.95 178.07 2jb3 s ALA 430 N 2.19 3.74 0.00 0.98 0.00 -0.40 -2.25 121.76 126.02 2jb3 s ALA 430 Ca 0.51 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.91 2jb3 s ALA 430 Cb -0.20 -3.78 0.00 0.00 0.00 0.00 0.00 23.12 19.13 2jb3 s ALA 430 CO 0.19 -1.29 0.00 0.41 0.00 0.00 0.00 175.76 175.06 2jb3 n GLY 431 N 4.30 0.75 3.90 0.00 0.00 -1.26 -4.95 105.19 107.93 2jb3 n GLY 431 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 2jb3 n GLY 431 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jb3 s SER 432 N -2.51 6.51 0.48 1.61 1.04 -0.95 -4.88 113.70 115.01 2jb3 s SER 432 Ca 0.00 0.70 -0.22 0.00 0.48 0.00 0.00 55.95 56.90 2jb3 s SER 432 Cb 0.00 -2.13 -0.07 0.00 0.10 0.00 0.00 66.02 63.92 2jb3 s SER 432 CO 0.00 -0.05 1.17 0.00 0.98 0.00 0.00 173.24 175.34 2jb3 s ALA 440 N -1.82 2.90 0.72 5.32 0.00 -1.26 -5.15 121.76 122.48 2jb3 s ALA 440 Ca 0.43 0.94 -0.11 0.00 0.00 0.00 0.00 51.96 53.22 2jb3 s ALA 440 Cb -0.11 -3.39 0.02 0.00 0.00 0.00 0.00 23.12 19.64 2jb3 s ALA 440 CO 0.25 -0.73 1.10 0.95 0.00 0.00 0.00 175.76 177.32 2jb3 s THR 441 N -1.57 3.45 0.24 0.00 -4.23 -1.26 -4.89 115.64 107.38 2jb3 s THR 441 Ca 0.66 0.47 0.18 0.00 -1.18 0.00 0.00 61.69 61.82 2jb3 s THR 441 Cb -0.29 -3.42 0.12 0.00 1.34 0.00 0.00 72.50 70.25 2jb3 s THR 441 CO 0.34 -0.62 1.76 1.55 -0.54 0.00 0.00 174.62 177.12 2jb3 h PRO 442 N -0.72 0.00 -0.43 3.99 0.13 -1.97 -1.76 132.00 131.25 2jb3 h PRO 442 Ca -0.45 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.56 2jb3 h PRO 442 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2jb3 h PRO 442 CO 0.63 0.38 -0.21 0.93 -0.23 0.00 0.00 178.00 179.50 2jb3 h GLU 443 N 0.00 0.90 -0.37 0.86 3.07 -1.92 0.20 114.58 117.31 2jb3 h GLU 443 Ca -0.00 -0.39 -0.02 0.00 -0.50 0.00 0.00 59.36 58.44 2jb3 h GLU 443 Cb 0.83 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.70 2jb3 h GLU 443 CO 0.05 1.04 0.14 -0.92 -1.40 0.00 0.00 179.01 177.92 2jb3 h TYR 444 N 0.72 0.57 -0.47 4.33 3.20 -1.81 -2.13 116.97 121.39 2jb3 h TYR 444 Ca 0.10 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2jb3 h TYR 444 Cb 0.78 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.85 2jb3 h TYR 444 CO 0.06 0.53 0.30 0.93 -1.64 0.00 0.00 178.16 178.34 2jb3 h GLU 445 N 0.45 0.62 -0.91 1.82 5.08 -1.10 -2.40 114.58 118.14 2jb3 h GLU 445 Ca 0.12 -0.05 0.09 0.00 -1.00 0.00 0.00 59.36 58.53 2jb3 h GLU 445 Cb 0.21 -0.14 -0.07 0.00 0.50 0.00 0.00 28.75 29.25 2jb3 h GLU 445 CO -0.01 0.43 0.56 -0.22 -1.00 0.00 0.00 179.01 178.77 2jb3 h LYS 446 N 0.63 0.92 0.00 2.33 1.63 -0.69 -1.92 116.57 119.47 2jb3 h LYS 446 Ca 0.17 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.91 2jb3 h LYS 446 Cb -0.05 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 31.38 2jb3 h LYS 446 CO -0.03 0.61 0.00 1.28 -3.45 0.00 0.00 179.45 177.86 2jb3 n LEU 447 N -4.64 0.00 0.18 5.20 4.77 -0.82 -2.34 117.00 119.35 2jb3 n LEU 447 Ca 0.15 0.16 0.07 0.00 -0.03 0.00 0.00 56.01 56.36 2jb3 n LEU 447 Cb 0.26 -0.16 0.20 0.00 -2.33 0.00 0.00 43.42 41.38 2jb3 n LEU 447 CO 0.29 -0.01 0.65 -0.07 -1.33 0.00 0.00 177.39 176.92 2jb3 h LEU 448 N 0.00 0.00 -9.76 2.23 3.38 -1.22 -3.41 115.31 106.53 2jb3 h LEU 448 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 2jb3 h LEU 448 Cb 0.15 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.91 2jb3 h LEU 448 CO 0.00 0.31 0.46 -1.61 0.09 0.00 0.00 178.44 177.69 2jb3 s GLU 449 N -3.23 4.66 0.67 1.13 0.41 -0.99 -4.94 118.70 116.42 2jb3 s GLU 449 Ca 0.03 1.74 -0.16 0.00 -0.41 0.00 0.00 54.97 56.18 2jb3 s GLU 449 Cb 0.08 -3.22 0.01 0.00 -1.78 0.00 0.00 34.13 29.21 2jb3 s GLU 449 CO 0.69 0.23 1.16 -1.25 -0.49 0.00 0.00 175.26 175.59 2jb3 s PRO 450 N -1.14 2.59 -0.79 0.39 0.04 -1.26 -4.75 135.00 130.08 2jb3 s PRO 450 Ca 0.45 1.58 -0.04 0.00 0.04 0.00 0.00 61.00 63.03 2jb3 s PRO 450 Cb -0.30 -1.91 0.20 0.00 0.04 0.00 0.00 34.50 32.53 2jb3 s PRO 450 CO 0.38 -1.45 0.66 0.08 0.04 0.00 0.00 177.00 176.71 2jb3 s VAL 451 N -2.10 4.38 0.00 -0.36 1.01 0.12 -4.95 120.40 118.50 2jb3 s VAL 451 Ca 0.71 -3.27 0.00 0.00 0.00 0.00 0.00 61.98 59.42 2jb3 s VAL 451 Cb -0.25 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.38 2jb3 s VAL 451 CO 0.41 -1.00 0.00 0.47 0.00 0.00 0.00 175.10 174.98 2jb3 n ASP 452 N 3.06 0.00 -1.16 3.32 10.43 -1.26 -1.07 116.55 129.88 2jb3 n ASP 452 Ca 0.15 0.00 0.11 0.00 2.57 0.00 0.00 54.79 57.62 2jb3 n ASP 452 Cb 0.39 0.00 0.23 0.00 1.84 0.00 0.00 41.12 43.58 2jb3 n ASP 452 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 2jb3 n LYS 453 N 0.00 2.52 -3.70 -1.24 4.76 -1.26 -4.90 118.16 114.33 2jb3 n LYS 453 Ca 0.00 -2.33 -0.36 0.00 -2.87 0.00 0.00 58.31 52.75 2jb3 n LYS 453 Cb 0.00 -1.51 -0.10 0.00 -1.84 0.00 0.00 35.03 31.59 2jb3 n LYS 453 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2jb3 s ILE 454 N -1.35 5.27 -0.06 -0.18 1.01 -0.23 -1.37 121.20 124.29 2jb3 s ILE 454 Ca 0.39 0.15 0.04 0.00 0.00 0.00 0.00 60.65 61.23 2jb3 s ILE 454 Cb 0.22 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 39.23 2jb3 s ILE 454 CO 0.31 0.36 -0.18 -0.31 0.00 0.00 0.00 174.94 175.12 2jb3 s TYR 455 N 0.96 2.61 0.11 3.97 2.02 -0.23 0.15 117.35 126.95 2jb3 s TYR 455 Ca 0.07 -0.44 -0.11 0.00 -0.37 0.00 0.00 57.07 56.23 2jb3 s TYR 455 Cb -0.13 -1.65 -0.06 0.00 -0.40 0.00 0.00 41.96 39.72 2jb3 s TYR 455 CO 0.04 -0.02 0.45 -0.06 -1.57 0.00 0.00 175.55 174.38 2jb3 s PHE 456 N -0.36 3.57 0.09 2.71 0.08 -1.26 -0.17 117.98 122.64 2jb3 s PHE 456 Ca 0.03 0.85 -0.13 0.00 0.12 0.00 0.00 56.93 57.80 2jb3 s PHE 456 Cb -0.12 -2.21 0.02 0.00 -0.57 0.00 0.00 43.02 40.13 2jb3 s PHE 456 CO 0.02 0.47 0.31 0.00 -0.10 0.00 0.00 175.22 175.92 2jb3 s ALA 457 N -1.47 -0.65 0.00 5.36 0.00 -0.69 -4.88 121.76 119.43 2jb3 s ALA 457 Ca 0.36 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.12 2jb3 s ALA 457 Cb -0.14 0.52 0.00 0.00 0.00 0.00 0.00 23.12 23.51 2jb3 s ALA 457 CO 0.19 -0.54 0.00 0.41 0.00 0.00 0.00 175.76 175.82 2jb3 n GLY 458 N 0.05 3.35 0.30 0.00 0.00 -1.26 -4.01 105.19 103.62 2jb3 n GLY 458 Ca -0.16 -1.57 0.17 0.00 0.00 0.00 0.00 46.02 44.45 2jb3 n GLY 458 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2jb3 h ASP 459 N 0.00 0.00 0.72 1.61 2.03 -1.84 -1.56 116.42 117.38 2jb3 h ASP 459 Ca 0.00 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.28 2jb3 h ASP 459 Cb 0.00 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.50 2jb3 h ASP 459 CO 0.00 0.03 -0.08 1.12 -1.03 0.00 0.00 179.24 179.28 2jb3 h HIS 460 N 0.00 0.00 -1.38 4.15 2.07 -1.92 -2.42 115.15 115.65 2jb3 h HIS 460 Ca -0.00 0.00 -0.71 0.00 -2.85 0.00 0.00 60.37 56.81 2jb3 h HIS 460 Cb 0.11 0.00 -0.29 0.00 2.57 0.00 0.00 27.41 29.80 2jb3 h HIS 460 CO 0.00 0.08 0.85 1.28 -3.07 0.00 0.00 177.93 177.07 2jb3 n LEU 461 N -3.28 7.47 -4.08 6.12 4.77 -0.59 -4.93 117.00 122.49 2jb3 n LEU 461 Ca -0.01 -4.54 -0.10 0.00 -0.03 0.00 0.00 56.01 51.33 2jb3 n LEU 461 Cb 0.29 -0.98 -0.08 0.00 -2.33 0.00 0.00 43.42 40.32 2jb3 n LEU 461 CO 0.28 1.62 -0.08 -0.94 -1.33 0.00 0.00 177.39 176.94 2jb3 s SER 462 N -1.65 0.08 -0.26 -1.43 1.04 -0.91 -4.81 113.70 105.75 2jb3 s SER 462 Ca 0.59 -1.12 0.07 0.00 0.48 0.00 0.00 55.95 55.97 2jb3 s SER 462 Cb 0.48 0.44 0.57 0.00 0.10 0.00 0.00 66.02 67.61 2jb3 s SER 462 CO -0.17 -0.92 1.58 0.59 0.98 0.00 0.00 173.24 175.30 2jb3 n ASN 463 N -0.27 4.11 -2.78 7.02 3.02 -1.26 -4.16 115.26 120.95 2jb3 n ASN 463 Ca -0.02 -2.97 -0.11 0.00 -0.03 0.00 0.00 54.58 51.45 2jb3 n ASN 463 Cb 0.64 -0.70 0.03 0.00 -0.61 0.00 0.00 39.78 39.14 2jb3 n ASN 463 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jb3 n ALA 464 N -0.14 2.62 -1.75 5.41 0.00 -1.26 -5.05 120.51 120.34 2jb3 n ALA 464 Ca 0.34 -2.86 -0.42 0.00 0.00 0.00 0.00 53.44 50.50 2jb3 n ALA 464 Cb 1.19 -0.96 -0.01 0.00 0.00 0.00 0.00 19.45 19.68 2jb3 n ALA 464 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2jb3 n ILE 465 N -0.04 1.53 -1.69 0.00 5.41 -1.26 -2.00 119.36 121.31 2jb3 n ILE 465 Ca 0.11 -0.38 -0.07 0.00 1.00 0.00 0.00 62.75 63.41 2jb3 n ILE 465 Cb 0.78 -1.92 -0.02 0.00 -0.71 0.00 0.00 39.64 37.78 2jb3 n ILE 465 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2jb3 n ALA 466 N 1.24 -0.16 -2.84 -1.39 0.00 -1.26 -5.02 120.51 111.07 2jb3 n ALA 466 Ca 0.05 0.08 -0.17 0.00 0.00 0.00 0.00 53.44 53.41 2jb3 n ALA 466 Cb 0.37 -1.04 -0.15 0.00 0.00 0.00 0.00 19.45 18.64 2jb3 n ALA 466 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2jb3 s TRP 467 N -2.30 0.55 0.45 0.00 0.52 -0.85 -5.03 118.94 112.28 2jb3 s TRP 467 Ca 0.00 -0.11 0.11 0.00 0.02 0.00 0.00 56.10 56.13 2jb3 s TRP 467 Cb 0.00 -0.37 1.01 0.00 -1.15 0.00 0.00 33.47 32.96 2jb3 s TRP 467 CO 0.00 -0.03 2.06 1.96 0.02 0.00 0.00 176.95 180.96 2jb3 h GLN 468 N 6.13 0.36 -0.84 4.98 4.20 -1.95 -0.96 115.11 127.04 2jb3 h GLN 468 Ca -0.30 -0.02 0.10 0.00 0.06 0.00 0.00 58.65 58.49 2jb3 h GLN 468 Cb 1.18 -0.08 -0.07 0.00 0.30 0.00 0.00 27.48 28.81 2jb3 h GLN 468 CO 0.50 0.24 0.48 1.25 -0.67 0.00 0.00 178.83 180.63 2jb3 h HIS 469 N 0.37 0.87 -0.23 2.96 2.76 -1.96 -0.31 115.15 119.62 2jb3 h HIS 469 Ca 0.15 0.03 0.06 0.00 -2.20 0.00 0.00 60.37 58.41 2jb3 h HIS 469 Cb 0.13 -0.27 -0.07 0.00 1.55 0.00 0.00 27.41 28.76 2jb3 h HIS 469 CO -0.00 0.36 -0.21 0.78 -1.30 0.00 0.00 177.93 177.56 2jb3 h GLY 470 N 0.81 -0.09 1.50 5.26 0.00 -1.24 0.31 103.07 109.61 2jb3 h GLY 470 Ca 0.40 0.25 -0.10 0.00 0.00 0.00 0.00 47.33 47.89 2jb3 h GLY 470 CO -0.25 -0.19 -0.24 0.00 0.00 0.00 0.00 176.54 175.87 2jb3 h ALA 471 N 0.88 1.03 0.15 3.60 0.00 -1.23 -1.38 119.26 122.31 2jb3 h ALA 471 Ca 0.13 -0.35 -0.28 0.00 0.00 0.00 0.00 54.91 54.41 2jb3 h ALA 471 Cb 0.41 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 18.10 2jb3 h ALA 471 CO -0.36 0.58 -1.19 -0.07 0.00 0.00 0.00 179.25 178.22 2jb3 h LEU 472 N 0.51 0.78 -0.93 0.00 3.38 -1.00 -1.54 115.31 116.51 2jb3 h LEU 472 Ca 0.07 -0.86 -0.11 0.00 0.09 0.00 0.00 57.88 57.07 2jb3 h LEU 472 Cb 0.68 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2jb3 h LEU 472 CO 0.05 1.58 -0.50 0.71 0.09 0.00 0.00 178.44 180.37 2jb3 h THR 473 N 0.11 1.36 -0.29 0.22 1.35 -0.88 -1.82 112.91 112.96 2jb3 h THR 473 Ca -0.19 -1.73 -0.01 0.00 -0.55 0.00 0.00 66.41 63.93 2jb3 h THR 473 Cb 1.89 1.90 -0.01 0.00 -1.73 0.00 0.00 68.15 70.20 2jb3 h THR 473 CO 0.23 0.50 0.14 -1.28 -0.25 0.00 0.00 175.52 174.86 2jb3 h SER 474 N 0.06 0.38 -0.07 5.36 0.87 -1.18 -0.57 113.55 118.39 2jb3 h SER 474 Ca -0.00 -0.12 0.01 0.00 -1.23 0.00 0.00 61.79 60.45 2jb3 h SER 474 Cb 0.91 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.76 2jb3 h SER 474 CO 0.07 0.39 -0.02 0.00 -0.53 0.00 0.00 176.83 176.75 2jb3 h ALA 475 N 1.00 0.04 -0.84 6.23 0.00 -1.15 -1.14 119.26 123.39 2jb3 h ALA 475 Ca 0.10 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.05 2jb3 h ALA 475 Cb 0.12 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2jb3 h ALA 475 CO -0.01 -0.49 0.56 0.00 0.00 0.00 0.00 179.25 179.30 2jb3 h ARG 476 N -0.00 1.08 -0.34 0.00 3.08 -1.13 0.03 114.38 117.11 2jb3 h ARG 476 Ca 0.03 -0.07 -0.14 0.00 0.07 0.00 0.00 59.98 59.88 2jb3 h ARG 476 Cb 0.05 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 29.85 2jb3 h ARG 476 CO -0.07 0.72 -0.34 -0.44 -1.07 0.00 0.00 179.97 178.76 2jb3 h ASP 477 N 1.12 0.89 -0.30 7.04 3.45 -0.66 -1.51 116.42 126.45 2jb3 h ASP 477 Ca 0.32 -0.47 -0.09 0.00 0.43 0.00 0.00 57.03 57.22 2jb3 h ASP 477 Cb -0.08 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.43 2jb3 h ASP 477 CO -0.08 1.18 -0.17 0.58 -1.57 0.00 0.00 179.24 179.18 2jb3 h VAL 478 N 0.61 1.30 -0.46 -1.35 2.07 -0.79 -1.56 116.25 116.07 2jb3 h VAL 478 Ca 0.05 -1.28 -0.03 0.00 0.82 0.00 0.00 66.70 66.26 2jb3 h VAL 478 Cb 0.93 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.16 2jb3 h VAL 478 CO 0.09 0.41 0.17 0.58 0.02 0.00 0.00 177.57 178.84 2jb3 h VAL 479 N 0.39 1.18 -0.54 2.57 2.07 -0.95 -1.52 116.25 119.44 2jb3 h VAL 479 Ca 0.06 -0.56 -0.10 0.00 0.82 0.00 0.00 66.70 66.92 2jb3 h VAL 479 Cb 0.70 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 2jb3 h VAL 479 CO 0.05 0.22 -0.06 0.74 0.02 0.00 0.00 177.57 178.53 2jb3 h THR 480 N 0.65 1.26 0.12 2.57 2.02 -1.02 -0.61 112.91 117.90 2jb3 h THR 480 Ca 0.16 -1.20 -0.01 0.00 0.77 0.00 0.00 66.41 66.14 2jb3 h THR 480 Cb 0.15 0.91 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 2jb3 h THR 480 CO -0.01 0.42 -0.06 0.45 0.37 0.00 0.00 175.52 176.69 2jb3 h HIS 481 N 0.89 -0.15 -0.43 3.16 3.86 -0.86 0.47 115.15 122.10 2jb3 h HIS 481 Ca 0.15 -0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.42 2jb3 h HIS 481 Cb 0.61 0.05 -0.06 0.00 1.06 0.00 0.00 27.41 29.07 2jb3 h HIS 481 CO 0.04 0.10 0.10 0.82 0.86 0.00 0.00 177.93 179.85 2jb3 h ILE 482 N -0.39 0.79 -0.41 2.45 2.04 -1.14 -1.55 117.51 119.31 2jb3 h ILE 482 Ca -0.02 -0.08 0.01 0.00 1.00 0.00 0.00 64.86 65.77 2jb3 h ILE 482 Cb 0.32 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 2jb3 h ILE 482 CO 0.03 0.04 0.26 -0.74 0.00 0.00 0.00 178.15 177.74 2jb3 h HIS 483 N 0.24 0.49 0.00 1.37 2.76 -0.62 0.25 115.15 119.63 2jb3 h HIS 483 Ca 0.21 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.33 2jb3 h HIS 483 Cb 0.24 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.03 2jb3 h HIS 483 CO -0.20 0.30 -0.26 0.93 -1.30 0.00 0.00 177.93 177.40 2jb3 h GLU 484 N 0.53 0.00 -0.00 5.26 5.08 -0.79 0.19 114.58 124.84 2jb3 h GLU 484 Ca 0.15 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2jb3 h GLU 484 Cb -0.04 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 2jb3 h GLU 484 CO -0.05 0.26 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.13 2jb3 h ARG 485 N 0.00 0.01 -0.65 2.33 2.43 -0.61 -1.35 114.38 116.54 2jb3 h ARG 485 Ca -0.00 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2jb3 h ARG 485 Cb 0.49 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.99 2jb3 h ARG 485 CO 0.03 0.56 0.37 0.28 -1.51 0.00 0.00 179.97 179.71 2jb3 h VAL 486 N -0.54 1.00 -0.47 0.20 2.07 -0.41 -1.58 116.25 116.52 2jb3 h VAL 486 Ca 0.00 -0.24 0.04 0.00 0.82 0.00 0.00 66.70 67.32 2jb3 h VAL 486 Cb 0.56 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 2jb3 h VAL 486 CO 0.00 0.13 0.31 0.00 0.02 0.00 0.00 177.57 178.03 2jb3 h ALA 487 N 1.32 1.84 0.00 1.67 0.00 -0.60 -3.47 119.26 120.02 2jb3 h ALA 487 Ca 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2jb3 h ALA 487 Cb 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2jb3 h ALA 487 CO -0.16 0.09 0.00 0.94 0.00 0.00 0.00 179.25 180.13 2jb3 n GLN 488 N -4.48 0.00 0.00 0.00 -0.06 -0.51 -5.10 117.38 107.23 2jb3 n GLN 488 Ca 0.06 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.06 2jb3 n GLN 488 Cb 0.18 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.36 2jb3 n GLN 488 CO 0.00 0.00 0.00 -1.91 -0.20 0.00 0.00 177.06 174.95