#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxp n GLY 2 N 0.00 2.14 3.98 3.03 0.00 -1.26 -4.81 105.19 108.27 2jxp n GLY 2 Ca 0.00 0.10 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 2jxp n GLY 2 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jxp s PHE 3 N 0.00 1.83 -1.51 1.61 0.08 -1.26 -4.98 117.98 113.75 2jxp s PHE 3 Ca 0.00 -0.10 -0.09 0.00 0.12 0.00 0.00 56.93 56.87 2jxp s PHE 3 Cb 0.00 -3.16 -0.01 0.00 -0.57 0.00 0.00 43.02 39.29 2jxp s PHE 3 CO 0.00 -1.75 2.70 1.17 -0.10 0.00 0.00 175.22 177.24 2jxp n LYS 4 N -2.94 3.92 -3.76 0.44 4.81 -1.26 -4.79 118.16 114.58 2jxp n LYS 4 Ca 0.14 -2.67 -0.29 0.00 -0.87 0.00 0.00 58.31 54.61 2jxp n LYS 4 Cb 0.60 -2.79 -0.16 0.00 0.02 0.00 0.00 35.03 32.71 2jxp n LYS 4 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2jxp s LEU 5 N -0.42 1.94 0.05 3.14 2.01 -1.26 -5.05 118.68 119.09 2jxp s LEU 5 Ca 0.62 -1.30 -0.23 0.00 0.01 0.00 0.00 54.13 53.23 2jxp s LEU 5 Cb 0.18 -0.82 -0.12 0.00 0.01 0.00 0.00 46.19 45.44 2jxp s LEU 5 CO -0.07 -0.35 1.36 -0.09 1.01 0.00 0.00 176.35 178.21 2jxp h ARG 6 N 8.12 -0.66 0.00 1.70 2.43 -1.96 -3.34 114.38 120.66 2jxp h ARG 6 Ca -0.15 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2jxp h ARG 6 Cb 1.06 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 2jxp h ARG 6 CO 0.42 -0.44 0.00 0.41 -1.51 0.00 0.00 179.97 178.85 2jxp n GLY 7 N -1.38 0.77 3.86 2.80 0.00 -1.26 -4.58 105.19 105.41 2jxp n GLY 7 Ca -0.08 -0.70 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 2jxp n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jxp s GLN 8 N -1.35 3.90 0.16 1.61 -0.21 -1.26 -5.01 119.66 117.50 2jxp s GLN 8 Ca 0.00 0.55 -0.15 0.00 0.02 0.00 0.00 55.36 55.77 2jxp s GLN 8 Cb 0.00 -2.45 0.07 0.00 1.00 0.00 0.00 33.01 31.63 2jxp s GLN 8 CO 0.00 0.11 1.78 -0.24 -2.12 0.00 0.00 175.29 174.82 2jxp h VAL 9 N 1.67 0.97 -3.74 1.09 3.04 -1.99 -3.38 116.25 113.91 2jxp h VAL 9 Ca -0.48 -0.14 -0.68 0.00 -1.01 0.00 0.00 66.70 64.39 2jxp h VAL 9 Cb 1.18 0.52 -0.33 0.00 -2.01 0.00 0.00 31.29 30.65 2jxp h VAL 9 CO 0.65 0.08 -0.68 -0.94 -1.01 0.00 0.00 177.57 175.67 2jxp s SER 10 N -5.45 4.95 -0.13 3.17 1.04 -1.25 -5.10 113.70 110.93 2jxp s SER 10 Ca -0.13 -1.36 -0.04 0.00 0.48 0.00 0.00 55.95 54.90 2jxp s SER 10 Cb 0.12 -1.73 -0.03 0.00 0.10 0.00 0.00 66.02 64.48 2jxp s SER 10 CO 0.72 -0.29 0.02 -1.83 0.98 0.00 0.00 173.24 172.84 2jxp s GLU 11 N 1.24 3.47 0.01 4.02 -1.05 -1.26 -4.16 118.70 120.97 2jxp s GLU 11 Ca -0.03 -0.39 -0.07 0.00 -0.15 0.00 0.00 54.97 54.32 2jxp s GLU 11 Cb -0.20 -2.98 -0.00 0.00 -0.44 0.00 0.00 34.13 30.51 2jxp s GLU 11 CO -0.01 0.48 0.14 -0.48 0.95 0.00 0.00 175.26 176.34 2jxp s LEU 12 N -0.26 1.56 0.43 1.83 0.05 -1.26 -4.38 118.68 116.65 2jxp s LEU 12 Ca 0.07 -0.29 0.22 0.00 0.05 0.00 0.00 54.13 54.18 2jxp s LEU 12 Cb -0.12 0.71 0.32 0.00 -2.05 0.00 0.00 46.19 45.05 2jxp s LEU 12 CO 0.02 -0.43 1.60 1.55 -0.55 0.00 0.00 176.35 178.54 2jxp h PRO 13 N 4.02 0.00 -5.73 1.48 0.13 -1.97 -3.46 132.00 126.48 2jxp h PRO 13 Ca -0.31 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.16 2jxp h PRO 13 Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 2jxp h PRO 13 CO 0.44 0.05 -0.49 -0.59 -0.23 0.00 0.00 178.00 177.17 2jxp s PHE 14 N -3.19 3.56 -0.46 1.56 -0.12 -1.26 -5.01 117.98 113.06 2jxp s PHE 14 Ca 0.07 0.44 0.17 0.00 -0.05 0.00 0.00 56.93 57.56 2jxp s PHE 14 Cb 0.05 -1.88 -0.22 0.00 -0.63 0.00 0.00 43.02 40.34 2jxp s PHE 14 CO 0.68 0.69 0.57 0.39 -0.05 0.00 0.00 175.22 177.50 2jxp n GLU 15 N 1.50 1.01 -4.06 1.99 1.02 -1.26 -4.16 120.64 116.67 2jxp n GLU 15 Ca -0.16 -0.07 -0.32 0.00 -0.02 0.00 0.00 57.16 56.60 2jxp n GLU 15 Cb 0.54 -1.35 -0.16 0.00 -0.02 0.00 0.00 31.44 30.45 2jxp n GLU 15 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2jxp s ARG 16 N -2.88 2.53 0.11 3.49 1.81 -1.26 0.02 118.95 122.78 2jxp s ARG 16 Ca 0.01 -0.82 0.06 0.00 -1.72 0.00 0.00 55.73 53.26 2jxp s ARG 16 Cb 0.12 -2.45 -0.04 0.00 -0.45 0.00 0.00 34.95 32.13 2jxp s ARG 16 CO 0.71 -0.30 -0.14 0.14 -0.68 0.00 0.00 175.30 175.03 2jxp s VAL 17 N 1.34 1.33 -0.02 3.52 -7.23 -0.85 -0.43 120.40 118.06 2jxp s VAL 17 Ca 0.02 -1.65 0.07 0.00 -1.81 0.00 0.00 61.98 58.61 2jxp s VAL 17 Cb -0.14 -1.47 -0.02 0.00 0.56 0.00 0.00 36.38 35.31 2jxp s VAL 17 CO -0.11 -0.37 -0.23 -0.47 -0.31 0.00 0.00 175.10 173.62 2jxp s TYR 18 N -1.97 2.05 -0.05 2.82 5.04 -0.41 -0.81 117.35 124.02 2jxp s TYR 18 Ca 0.07 -0.42 0.03 0.00 -2.44 0.00 0.00 57.07 54.31 2jxp s TYR 18 Cb -0.06 -1.32 -0.03 0.00 0.35 0.00 0.00 41.96 40.90 2jxp s TYR 18 CO 0.03 -0.06 -0.11 -1.50 -1.34 0.00 0.00 175.55 172.58 2jxp s ILE 19 N -0.46 3.38 0.01 3.14 2.07 -1.26 -0.51 121.20 127.56 2jxp s ILE 19 Ca 0.07 -0.65 0.00 0.00 -1.41 0.00 0.00 60.65 58.66 2jxp s ILE 19 Cb -0.09 -2.37 -0.01 0.00 0.13 0.00 0.00 42.46 40.12 2jxp s ILE 19 CO -0.00 0.56 -0.02 0.28 -1.91 0.00 0.00 174.94 173.85 2jxp s THR 20 N -0.80 0.07 0.01 4.00 -1.32 -0.29 -4.96 115.64 112.35 2jxp s THR 20 Ca 0.13 -0.46 -0.01 0.00 -1.21 0.00 0.00 61.69 60.13 2jxp s THR 20 Cb -0.11 -0.15 -0.01 0.00 -1.51 0.00 0.00 72.50 70.72 2jxp s THR 20 CO 0.02 -0.25 -0.00 0.00 -2.21 0.00 0.00 174.62 172.18 2jxp s ALA 21 N -0.73 0.05 -1.02 11.08 0.00 -1.26 -2.02 121.76 127.85 2jxp s ALA 21 Ca -0.08 -0.45 0.16 0.00 0.00 0.00 0.00 51.96 51.59 2jxp s ALA 21 Cb -0.05 0.12 0.67 0.00 0.00 0.00 0.00 23.12 23.86 2jxp s ALA 21 CO -0.00 -0.14 1.49 -0.35 0.00 0.00 0.00 175.76 176.75 2jxp n PRO 22 N 1.78 0.01 -3.88 0.00 -0.04 -1.26 -4.88 135.00 126.73 2jxp n PRO 22 Ca -0.22 0.23 -0.02 0.00 -0.04 0.00 0.00 63.50 63.45 2jxp n PRO 22 Cb 0.56 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.53 2jxp n PRO 22 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jxp s ALA 23 N -2.98 -1.77 -1.42 0.55 0.00 -1.26 -5.06 121.76 109.82 2jxp s ALA 23 Ca 0.08 -0.21 -0.10 0.00 0.00 0.00 0.00 51.96 51.74 2jxp s ALA 23 Cb 0.10 0.76 0.06 0.00 0.00 0.00 0.00 23.12 24.05 2jxp s ALA 23 CO 0.28 -1.08 2.35 0.41 0.00 0.00 0.00 175.76 177.72 2jxp n GLY 24 N -0.71 4.67 3.81 0.00 0.00 -1.26 -4.98 105.19 106.72 2jxp n GLY 24 Ca -0.02 -1.82 -0.33 0.00 0.00 0.00 0.00 46.02 43.85 2jxp n GLY 24 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jxp s LEU 25 N 0.04 3.83 -1.06 0.99 1.02 -1.26 -4.95 118.68 117.29 2jxp s LEU 25 Ca 0.52 1.76 -0.23 0.00 0.02 0.00 0.00 54.13 56.20 2jxp s LEU 25 Cb 0.15 -4.54 -0.05 0.00 0.02 0.00 0.00 46.19 41.77 2jxp s LEU 25 CO -0.06 -0.59 1.89 0.42 0.02 0.00 0.00 176.35 178.03 2jxp s THR 26 N -2.20 3.57 0.00 5.49 -4.23 -1.26 -3.47 115.64 113.55 2jxp s THR 26 Ca 0.63 -0.75 0.00 0.00 -1.18 0.00 0.00 61.69 60.39 2jxp s THR 26 Cb -0.12 -4.42 0.00 0.00 1.34 0.00 0.00 72.50 69.30 2jxp s THR 26 CO 0.20 -1.12 0.00 0.00 -0.54 0.00 0.00 174.62 173.16 2jxp n ILE 27 N 7.67 0.00 0.05 2.99 0.13 -1.26 -4.99 119.36 123.94 2jxp n ILE 27 Ca 0.42 0.00 -0.12 0.00 -1.10 0.00 0.00 62.75 61.95 2jxp n ILE 27 Cb 0.47 0.00 -0.07 0.00 -0.84 0.00 0.00 39.64 39.20 2jxp n ILE 27 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 2jxp h GLY 28 N 0.00 -0.04 -0.10 4.50 0.00 -1.96 -1.11 103.07 104.36 2jxp h GLY 28 Ca 0.00 0.01 0.14 0.00 0.00 0.00 0.00 47.33 47.48 2jxp h GLY 28 CO 0.00 -0.01 0.01 0.23 0.00 0.00 0.00 176.54 176.77 2jxp h SER 29 N -0.11 -0.27 0.03 0.19 0.87 -1.94 -0.73 113.55 111.58 2jxp h SER 29 Ca -0.00 0.16 -0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2jxp h SER 29 Cb 0.10 0.28 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 2jxp h SER 29 CO 0.01 -0.12 -0.01 0.44 -0.53 0.00 0.00 176.83 176.61 2jxp h ASP 30 N 0.12 -0.03 -0.10 6.23 5.19 -1.90 -3.04 116.42 122.90 2jxp h ASP 30 Ca 0.34 -0.20 0.02 0.00 -0.62 0.00 0.00 57.03 56.57 2jxp h ASP 30 Cb 0.56 0.01 -0.02 0.00 0.18 0.00 0.00 39.33 40.05 2jxp h ASP 30 CO -0.55 0.19 -0.04 0.25 -3.12 0.00 0.00 179.24 175.97 2jxp h LEU 31 N -0.25 -0.14 -0.72 1.55 5.85 -0.69 -1.89 115.31 119.02 2jxp h LEU 31 Ca -0.00 0.04 0.12 0.00 0.84 0.00 0.00 57.88 58.88 2jxp h LEU 31 Cb 0.23 0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.26 2jxp h LEU 31 CO 0.01 -0.06 0.29 -0.33 -0.34 0.00 0.00 178.44 178.01 2jxp h GLU 32 N -0.03 0.45 -0.21 1.25 5.08 -1.19 -0.90 114.58 119.02 2jxp h GLU 32 Ca 0.05 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2jxp h GLU 32 Cb 0.11 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2jxp h GLU 32 CO -0.12 0.30 0.02 0.00 -1.00 0.00 0.00 179.01 178.21 2jxp h ARG 33 N 0.46 0.36 -0.83 2.33 3.08 -1.37 -3.11 114.38 115.31 2jxp h ARG 33 Ca 0.38 -0.11 0.01 0.00 0.07 0.00 0.00 59.98 60.34 2jxp h ARG 33 Cb 0.54 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.51 2jxp h ARG 33 CO -0.37 0.54 0.55 0.28 -1.07 0.00 0.00 179.97 179.90 2jxp h VAL 34 N 0.14 1.21 0.21 2.04 2.07 -0.64 -2.44 116.25 118.84 2jxp h VAL 34 Ca 0.06 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.19 2jxp h VAL 34 Cb 0.36 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 2jxp h VAL 34 CO 0.01 0.20 -0.19 0.40 0.02 0.00 0.00 177.57 178.01 2jxp h ILE 35 N 1.12 0.00 0.00 4.57 1.08 -1.13 -0.53 117.51 122.62 2jxp h ILE 35 Ca 0.31 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.76 2jxp h ILE 35 Cb -0.12 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 33.63 2jxp h ILE 35 CO -0.07 0.00 -0.10 -1.28 -0.69 0.00 0.00 178.15 176.01 2jxp h SER 36 N -0.40 0.00 0.32 1.72 0.87 -1.51 0.13 113.55 114.68 2jxp h SER 36 Ca -0.03 0.00 -0.33 0.00 -1.23 0.00 0.00 61.79 60.20 2jxp h SER 36 Cb 0.34 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 2jxp h SER 36 CO -0.01 0.10 -1.69 0.71 -0.53 0.00 0.00 176.83 175.41 2jxp h THR 37 N 0.00 0.97 0.00 2.23 1.35 -1.39 -3.39 112.91 112.68 2jxp h THR 37 Ca -0.00 -2.62 -0.20 0.00 -0.55 0.00 0.00 66.41 63.03 2jxp h THR 37 Cb 0.25 2.70 -0.04 0.00 -1.73 0.00 0.00 68.15 69.33 2jxp h THR 37 CO 0.01 0.82 -1.75 1.41 -0.25 0.00 0.00 175.52 175.76 2jxp n HIS 38 N -3.47 0.61 -3.33 4.73 -0.00 -0.21 -5.02 115.22 108.53 2jxp n HIS 38 Ca -0.22 0.21 0.00 0.00 -0.00 0.00 0.00 57.72 57.71 2jxp n HIS 38 Cb 1.06 -0.99 0.00 0.00 -0.00 0.00 0.00 29.99 30.05 2jxp n HIS 38 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 2jxp n THR 39 N -2.78 0.00 0.84 1.59 -2.24 0.02 -3.77 114.28 107.94 2jxp n THR 39 Ca -0.15 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.74 2jxp n THR 39 Cb 0.89 -0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.77 2jxp n THR 39 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2jxp n ARG 40 N -0.21 0.11 -2.36 -0.78 3.00 -1.26 -4.82 116.66 110.34 2jxp n ARG 40 Ca 0.00 -0.02 -0.28 0.00 -0.00 0.00 0.00 57.85 57.55 2jxp n ARG 40 Cb 0.00 -1.52 0.02 0.00 0.00 0.00 0.00 32.46 30.96 2jxp n ARG 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2jxp s ALA 41 N -3.08 3.27 -0.02 5.13 0.00 -1.26 -4.73 121.76 121.07 2jxp s ALA 41 Ca 0.06 -0.49 0.03 0.00 0.00 0.00 0.00 51.96 51.56 2jxp s ALA 41 Cb 0.16 -2.71 -0.00 0.00 0.00 0.00 0.00 23.12 20.56 2jxp s ALA 41 CO 0.83 -0.64 -0.10 0.21 0.00 0.00 0.00 175.76 176.06 2jxp s LYS 42 N -4.96 1.01 -0.23 0.00 2.36 0.10 -3.84 119.74 114.18 2jxp s LYS 42 Ca 0.52 -0.35 -0.28 0.00 -2.55 0.00 0.00 55.97 53.31 2jxp s LYS 42 Cb -0.11 -0.94 0.01 0.00 -1.05 0.00 0.00 37.83 35.74 2jxp s LYS 42 CO 0.47 0.15 0.97 0.08 1.55 0.00 0.00 175.35 178.58 2jxp s VAL 43 N 0.07 4.73 0.13 4.02 1.01 -1.26 -2.00 120.40 127.10 2jxp s VAL 43 Ca -0.01 1.88 -0.07 0.00 0.00 0.00 0.00 61.98 63.79 2jxp s VAL 43 Cb -0.08 -4.25 -0.06 0.00 0.00 0.00 0.00 36.38 32.00 2jxp s VAL 43 CO 0.00 -0.14 0.40 0.68 0.00 0.00 0.00 175.10 176.04 2jxp s VAL 44 N 3.07 5.13 -0.46 2.92 -7.23 0.01 -4.98 120.40 118.86 2jxp s VAL 44 Ca 0.41 0.19 0.25 0.00 -1.81 0.00 0.00 61.98 61.02 2jxp s VAL 44 Cb -0.15 -3.63 0.33 0.00 0.56 0.00 0.00 36.38 33.49 2jxp s VAL 44 CO 0.07 0.09 1.70 -1.13 -0.31 0.00 0.00 175.10 175.52 2jxp h ASN 45 N 3.03 0.00 -3.72 4.85 -0.73 -1.96 -3.40 115.58 113.65 2jxp h ASN 45 Ca -0.47 0.00 -0.38 0.00 1.87 0.00 0.00 56.30 57.32 2jxp h ASN 45 Cb 1.17 0.00 -0.31 0.00 0.27 0.00 0.00 38.32 39.45 2jxp h ASN 45 CO 0.71 0.00 -0.77 -1.59 -0.37 0.00 0.00 177.43 175.41 2jxp s LYS 46 N -3.23 0.66 -1.55 6.67 0.00 -1.26 -5.04 119.74 115.99 2jxp s LYS 46 Ca 0.07 -0.17 -0.11 0.00 0.00 0.00 0.00 55.97 55.76 2jxp s LYS 46 Cb 0.08 -0.66 -0.04 0.00 0.00 0.00 0.00 37.83 37.20 2jxp s LYS 46 CO 0.62 0.03 2.68 0.00 0.00 0.00 0.00 175.35 178.68 2jxp n ALA 47 N 3.47 6.76 -0.04 0.59 0.00 -1.26 -4.11 120.51 125.92 2jxp n ALA 47 Ca -0.19 -3.63 -0.05 0.00 0.00 0.00 0.00 53.44 49.57 2jxp n ALA 47 Cb 0.54 -3.43 -0.05 0.00 0.00 0.00 0.00 19.45 16.51 2jxp n ALA 47 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2jxp n GLU 48 N 4.54 1.46 -0.09 0.00 0.28 -1.26 -4.70 120.64 120.86 2jxp n GLU 48 Ca 0.68 0.02 0.04 0.00 -0.16 0.00 0.00 57.16 57.74 2jxp n GLU 48 Cb 0.29 -1.17 0.09 0.00 1.43 0.00 0.00 31.44 32.07 2jxp n GLU 48 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2jxp n LYS 49 N -2.52 2.39 -2.64 3.44 5.02 -1.26 -5.00 118.16 117.58 2jxp n LYS 49 Ca -0.13 -1.69 -0.43 0.00 -2.02 0.00 0.00 58.31 54.04 2jxp n LYS 49 Cb 0.69 -1.17 -0.02 0.00 -0.02 0.00 0.00 35.03 34.51 2jxp n LYS 49 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2jxp s SER 50 N -0.93 6.81 0.08 4.39 1.04 -1.26 -4.70 113.70 119.14 2jxp s SER 50 Ca 0.14 0.82 -0.15 0.00 0.48 0.00 0.00 55.95 57.24 2jxp s SER 50 Cb 0.08 -2.54 -0.14 0.00 0.10 0.00 0.00 66.02 63.52 2jxp s SER 50 CO 0.10 -1.00 1.32 -0.08 0.98 0.00 0.00 173.24 174.57 2jxp h GLU 51 N 8.48 0.69 -6.55 4.02 4.22 -1.11 -3.38 114.58 120.95 2jxp h GLU 51 Ca -0.21 -0.48 -0.63 0.00 0.08 0.00 0.00 59.36 58.11 2jxp h GLU 51 Cb 1.06 0.08 -0.22 0.00 0.50 0.00 0.00 28.75 30.17 2jxp h GLU 51 CO 1.06 1.11 -0.85 0.00 -2.18 0.00 0.00 179.01 178.14 2jxp s ALA 52 N -3.95 2.10 -0.09 2.92 0.00 -1.21 -1.68 121.76 119.87 2jxp s ALA 52 Ca -0.12 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 50.49 2jxp s ALA 52 Cb 0.08 -0.32 0.02 0.00 0.00 0.00 0.00 23.12 22.90 2jxp s ALA 52 CO 0.86 0.46 -0.08 0.42 0.00 0.00 0.00 175.76 177.41 2jxp s ILE 53 N -1.09 0.96 -0.23 0.00 1.01 -0.01 -1.29 121.20 120.55 2jxp s ILE 53 Ca 0.10 -0.29 -0.08 0.00 0.00 0.00 0.00 60.65 60.38 2jxp s ILE 53 Cb -0.10 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.38 2jxp s ILE 53 CO 0.05 0.34 0.09 -0.63 0.00 0.00 0.00 174.94 174.79 2jxp s ILE 54 N 1.38 4.68 -0.19 2.92 1.09 0.33 -0.46 121.20 130.94 2jxp s ILE 54 Ca -0.02 -0.06 -0.02 0.00 -1.10 0.00 0.00 60.65 59.46 2jxp s ILE 54 Cb -0.14 -3.16 -0.00 0.00 -1.06 0.00 0.00 42.46 38.10 2jxp s ILE 54 CO -0.04 0.37 -0.10 -1.58 -0.10 0.00 0.00 174.94 173.50 2jxp s GLN 55 N 1.12 3.30 -0.22 2.79 -0.44 -0.53 -1.14 119.66 124.53 2jxp s GLN 55 Ca 0.05 -0.68 -0.17 0.00 -2.50 0.00 0.00 55.36 52.05 2jxp s GLN 55 Cb -0.14 -2.83 -0.03 0.00 -1.64 0.00 0.00 33.01 28.37 2jxp s GLN 55 CO 0.04 -0.11 0.47 -1.50 0.50 0.00 0.00 175.29 174.69 2jxp s ILE 56 N 1.18 5.13 -0.10 -2.34 -1.16 -0.86 -0.03 121.20 123.03 2jxp s ILE 56 Ca 0.02 0.82 -0.00 0.00 -0.51 0.00 0.00 60.65 60.98 2jxp s ILE 56 Cb -0.14 -3.79 -0.00 0.00 0.61 0.00 0.00 42.46 39.14 2jxp s ILE 56 CO -0.03 0.18 0.01 0.58 -2.81 0.00 0.00 174.94 172.86 2jxp h VAL 57 N 5.18 0.00 -2.37 4.00 2.07 -0.76 -3.38 116.25 121.00 2jxp h VAL 57 Ca -0.33 -0.96 -0.08 0.00 0.82 0.00 0.00 66.70 66.15 2jxp h VAL 57 Cb 1.15 0.00 -0.22 0.00 -1.52 0.00 0.00 31.29 30.70 2jxp h VAL 57 CO 0.72 0.00 -0.04 -1.38 0.02 0.00 0.00 177.57 176.89 2jxp s HIS 58 N -1.57 -0.60 -0.28 1.57 -3.43 -1.01 -4.85 115.29 105.13 2jxp s HIS 58 Ca -0.00 1.40 0.03 0.00 -0.80 0.00 0.00 55.06 55.68 2jxp s HIS 58 Cb 0.00 0.23 0.07 0.00 -1.43 0.00 0.00 32.58 31.45 2jxp s HIS 58 CO 0.00 -0.34 -0.05 0.00 -2.00 0.00 0.00 174.74 172.35 2jxp s ALA 59 N 0.03 2.49 -0.04 -1.38 0.00 -1.25 -0.83 121.76 120.77 2jxp s ALA 59 Ca -0.02 -1.86 -0.20 0.00 0.00 0.00 0.00 51.96 49.87 2jxp s ALA 59 Cb -0.04 -1.65 -0.05 0.00 0.00 0.00 0.00 23.12 21.39 2jxp s ALA 59 CO 0.02 -1.33 0.58 0.42 0.00 0.00 0.00 175.76 175.45 2jxp s ILE 60 N 1.13 5.01 -0.35 0.00 -1.09 0.16 -4.91 121.20 121.15 2jxp s ILE 60 Ca -0.03 1.19 -0.00 0.00 -2.23 0.00 0.00 60.65 59.58 2jxp s ILE 60 Cb -0.19 -3.91 0.14 0.00 -1.58 0.00 0.00 42.46 36.91 2jxp s ILE 60 CO -0.07 0.37 0.21 0.00 -1.23 0.00 0.00 174.94 174.22 2jxp s ARG 61 N 0.15 0.53 0.14 2.79 1.70 -1.25 -1.92 118.95 121.09 2jxp s ARG 61 Ca 0.31 -1.29 0.03 0.00 -0.47 0.00 0.00 55.73 54.31 2jxp s ARG 61 Cb -0.17 -1.30 -0.04 0.00 -0.57 0.00 0.00 34.95 32.87 2jxp s ARG 61 CO 0.15 -1.20 -0.07 -1.21 -1.08 0.00 0.00 175.30 171.90 2jxp s GLU 62 N 1.13 1.01 0.01 3.89 2.02 -0.88 -5.01 118.70 120.87 2jxp s GLU 62 Ca 0.17 -1.44 0.03 0.00 0.02 0.00 0.00 54.97 53.76 2jxp s GLU 62 Cb -0.23 -0.44 -0.01 0.00 0.10 0.00 0.00 34.13 33.55 2jxp s GLU 62 CO -0.01 0.01 -0.10 -1.59 0.02 0.00 0.00 175.26 173.59 2jxp s LYS 63 N -3.80 0.73 0.37 1.61 -2.85 -1.26 -0.55 119.74 113.99 2jxp s LYS 63 Ca 0.17 -0.46 -0.14 0.00 -1.00 0.00 0.00 55.97 54.55 2jxp s LYS 63 Cb 0.04 -0.69 0.04 0.00 -2.06 0.00 0.00 37.83 35.17 2jxp s LYS 63 CO -0.00 0.18 0.73 -0.98 0.10 0.00 0.00 175.35 175.38 2jxp s ARG 64 N -0.56 2.15 0.23 1.78 3.03 -0.43 -4.99 118.95 120.17 2jxp s ARG 64 Ca 0.01 -1.47 -0.30 0.00 2.03 0.00 0.00 55.73 56.01 2jxp s ARG 64 Cb -0.05 0.59 -0.09 0.00 -1.03 0.00 0.00 34.95 34.37 2jxp s ARG 64 CO 0.00 -0.99 1.26 0.42 -1.13 0.00 0.00 175.30 174.86 2jxp s ILE 65 N -2.54 3.22 -0.27 4.99 -1.09 -1.26 0.30 121.20 124.55 2jxp s ILE 65 Ca 0.18 1.08 -0.07 0.00 -2.23 0.00 0.00 60.65 59.60 2jxp s ILE 65 Cb -0.04 -3.69 -0.14 0.00 -1.58 0.00 0.00 42.46 37.01 2jxp s ILE 65 CO 0.13 0.20 -0.30 -0.11 -1.23 0.00 0.00 174.94 173.62 2jxp n LEU 66 N 2.04 2.37 -3.73 2.97 7.94 0.17 -4.64 117.00 124.12 2jxp n LEU 66 Ca 0.04 0.14 -0.14 0.00 -1.11 0.00 0.00 56.01 54.94 2jxp n LEU 66 Cb 0.43 -0.85 -0.09 0.00 0.53 0.00 0.00 43.42 43.44 2jxp n LEU 66 CO 0.57 0.72 0.07 -0.44 -1.11 0.00 0.00 177.39 177.21 2jxp s SER 67 N -7.08 -0.30 -0.08 1.96 0.01 -1.21 -4.98 113.70 102.02 2jxp s SER 67 Ca -0.37 0.36 0.04 0.00 1.31 0.00 0.00 55.95 57.28 2jxp s SER 67 Cb 0.12 0.48 -0.01 0.00 0.21 0.00 0.00 66.02 66.82 2jxp s SER 67 CO 0.53 -0.37 -0.19 -0.76 0.41 0.00 0.00 173.24 172.86 2jxp s LEU 68 N -0.85 2.38 0.01 2.44 1.43 -1.26 -1.51 118.68 121.32 2jxp s LEU 68 Ca -0.09 -0.40 -0.21 0.00 -1.03 0.00 0.00 54.13 52.40 2jxp s LEU 68 Cb -0.04 -1.48 -0.05 0.00 0.03 0.00 0.00 46.19 44.65 2jxp s LEU 68 CO 0.04 0.23 0.60 -0.94 0.23 0.00 0.00 176.35 176.51 2jxp s SER 69 N -0.08 6.99 -1.73 2.29 1.04 0.89 -4.10 113.70 119.00 2jxp s SER 69 Ca -0.04 1.18 0.00 0.00 0.48 0.00 0.00 55.95 57.57 2jxp s SER 69 Cb -0.14 -2.37 0.00 0.00 0.10 0.00 0.00 66.02 63.61 2jxp s SER 69 CO 0.04 0.12 0.00 -0.62 0.98 0.00 0.00 173.24 173.76 2jxp n GLU 70 N 2.62 -1.39 -2.66 4.02 -0.58 -1.26 -2.35 120.64 119.04 2jxp n GLU 70 Ca -0.07 0.96 -0.04 0.00 -0.42 0.00 0.00 57.16 57.60 2jxp n GLU 70 Cb 0.51 -5.29 -0.03 0.00 -0.57 0.00 0.00 31.44 26.06 2jxp n GLU 70 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2jxp n SER 71 N -0.93 -3.24 0.00 1.62 2.88 -1.26 -4.77 113.62 107.92 2jxp n SER 71 Ca -0.17 1.38 0.00 0.00 -1.33 0.00 0.00 58.87 58.75 2jxp n SER 71 Cb 0.55 -5.26 0.00 0.00 -0.75 0.00 0.00 64.21 58.75 2jxp n SER 71 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jxp n GLY 72 N 1.36 2.61 3.87 0.46 0.00 -1.24 -5.11 105.19 107.13 2jxp n GLY 72 Ca -0.27 -0.59 -0.34 0.00 0.00 0.00 0.00 46.02 44.82 2jxp n GLY 72 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jxp s ARG 73 N 0.00 3.81 0.05 1.61 6.06 -0.99 -4.94 118.95 124.56 2jxp s ARG 73 Ca 0.00 0.25 -0.30 0.00 -2.50 0.00 0.00 55.73 53.18 2jxp s ARG 73 Cb 0.00 -2.87 -0.05 0.00 0.06 0.00 0.00 34.95 32.09 2jxp s ARG 73 CO 0.00 0.47 1.02 0.08 -2.50 0.00 0.00 175.30 174.37 2jxp s VAL 74 N -1.55 4.55 0.00 7.11 1.01 -1.26 -0.08 120.40 130.18 2jxp s VAL 74 Ca 0.39 1.92 0.00 0.00 0.00 0.00 0.00 61.98 64.29 2jxp s VAL 74 Cb -0.13 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.02 2jxp s VAL 74 CO 0.20 0.20 0.00 0.54 0.00 0.00 0.00 175.10 176.04 2jxp n ARG 75 N 3.49 0.00 -4.54 2.72 1.74 -0.57 -4.70 116.66 114.81 2jxp n ARG 75 Ca 0.05 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.89 2jxp n ARG 75 Cb 0.49 -0.28 -0.14 0.00 -1.02 0.00 0.00 32.46 31.52 2jxp n ARG 75 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2jxp s GLU 76 N -0.70 1.29 -0.27 5.56 2.02 -1.21 -0.40 118.70 125.00 2jxp s GLU 76 Ca 0.00 -0.97 -0.03 0.00 0.02 0.00 0.00 54.97 53.99 2jxp s GLU 76 Cb 0.00 -1.43 0.02 0.00 0.10 0.00 0.00 34.13 32.83 2jxp s GLU 76 CO 0.00 0.36 -0.02 0.12 0.02 0.00 0.00 175.26 175.74 2jxp s PHE 77 N -0.88 3.11 -0.12 1.61 5.36 0.83 -0.66 117.98 127.23 2jxp s PHE 77 Ca 0.07 -1.45 -0.28 0.00 -0.96 0.00 0.00 56.93 54.32 2jxp s PHE 77 Cb -0.09 -2.11 -0.02 0.00 -0.34 0.00 0.00 43.02 40.46 2jxp s PHE 77 CO 0.02 -0.70 0.92 -2.00 -1.46 0.00 0.00 175.22 172.00 2jxp s GLU 78 N 1.36 4.39 -0.40 10.12 2.12 0.15 -0.91 118.70 135.53 2jxp s GLU 78 Ca 0.00 1.22 -0.14 0.00 0.36 0.00 0.00 54.97 56.41 2jxp s GLU 78 Cb -0.17 -3.54 0.02 0.00 0.26 0.00 0.00 34.13 30.70 2jxp s GLU 78 CO -0.02 -0.27 0.28 -0.51 -0.54 0.00 0.00 175.26 174.20 2jxp s LEU 79 N 1.88 5.04 -0.12 2.70 1.43 0.51 -1.31 118.68 128.82 2jxp s LEU 79 Ca 0.44 -0.93 -0.16 0.00 -1.03 0.00 0.00 54.13 52.45 2jxp s LEU 79 Cb -0.18 -2.13 -0.05 0.00 0.03 0.00 0.00 46.19 43.87 2jxp s LEU 79 CO 0.17 -0.44 0.38 0.54 0.23 0.00 0.00 176.35 177.23 2jxp s VAL 80 N 1.65 5.22 -0.26 -1.59 0.11 0.29 -0.66 120.40 125.16 2jxp s VAL 80 Ca 0.04 0.75 -0.03 0.00 -2.93 0.00 0.00 61.98 59.82 2jxp s VAL 80 Cb -0.19 -3.71 0.08 0.00 -1.53 0.00 0.00 36.38 31.03 2jxp s VAL 80 CO 0.09 0.40 0.09 -0.47 -3.33 0.00 0.00 175.10 171.88 2jxp s TYR 81 N 0.25 1.04 -0.34 1.54 5.04 0.21 -2.08 117.35 123.00 2jxp s TYR 81 Ca 0.21 -1.14 -0.01 0.00 -2.44 0.00 0.00 57.07 53.69 2jxp s TYR 81 Cb -0.14 -1.22 0.08 0.00 0.35 0.00 0.00 41.96 41.03 2jxp s TYR 81 CO 0.08 -0.76 0.07 1.03 -1.34 0.00 0.00 175.55 174.63 2jxp s ARG 82 N 1.85 2.09 -0.31 4.97 0.52 -0.81 -0.51 118.95 126.75 2jxp s ARG 82 Ca 0.06 -1.58 -0.09 0.00 -0.52 0.00 0.00 55.73 53.60 2jxp s ARG 82 Cb -0.17 -3.30 -0.00 0.00 0.52 0.00 0.00 34.95 32.00 2jxp s ARG 82 CO -0.22 -0.83 0.13 0.08 0.02 0.00 0.00 175.30 174.48 2jxp s VAL 83 N 1.13 4.41 0.05 3.52 1.01 -0.77 -0.66 120.40 129.09 2jxp s VAL 83 Ca 0.02 -0.51 0.07 0.00 0.00 0.00 0.00 61.98 61.57 2jxp s VAL 83 Cb -0.21 -3.26 -0.03 0.00 0.00 0.00 0.00 36.38 32.88 2jxp s VAL 83 CO -0.04 0.07 -0.18 0.00 0.00 0.00 0.00 175.10 174.95 2jxp s ALA 84 N 1.58 2.60 0.17 5.51 0.00 -0.01 0.18 121.76 131.78 2jxp s ALA 84 Ca 0.04 -1.20 -0.19 0.00 0.00 0.00 0.00 51.96 50.60 2jxp s ALA 84 Cb -0.17 -0.73 0.04 0.00 0.00 0.00 0.00 23.12 22.26 2jxp s ALA 84 CO 0.05 0.57 0.53 0.00 0.00 0.00 0.00 175.76 176.91 2jxp s ALA 85 N -0.94 -1.20 -0.05 0.00 0.00 -1.23 -0.00 121.76 118.34 2jxp s ALA 85 Ca 0.15 0.08 0.04 0.00 0.00 0.00 0.00 51.96 52.23 2jxp s ALA 85 Cb -0.10 0.82 -0.03 0.00 0.00 0.00 0.00 23.12 23.81 2jxp s ALA 85 CO 0.06 -0.76 -0.14 1.03 0.00 0.00 0.00 175.76 175.94 2jxp s ARG 86 N -3.81 2.50 -0.39 0.00 0.52 0.96 -3.09 118.95 115.64 2jxp s ARG 86 Ca 0.05 -0.70 -0.10 0.00 -0.52 0.00 0.00 55.73 54.46 2jxp s ARG 86 Cb -0.01 -2.37 0.05 0.00 0.52 0.00 0.00 34.95 33.14 2jxp s ARG 86 CO -0.08 0.62 0.22 -1.17 0.02 0.00 0.00 175.30 174.90 2jxp s LEU 87 N -0.72 4.85 0.37 2.53 0.20 -0.35 -1.45 118.68 124.11 2jxp s LEU 87 Ca 0.11 -1.22 0.08 0.00 0.69 0.00 0.00 54.13 53.79 2jxp s LEU 87 Cb -0.11 -1.99 -0.04 0.00 -0.43 0.00 0.00 46.19 43.63 2jxp s LEU 87 CO 0.00 -0.44 0.22 -0.76 -0.29 0.00 0.00 176.35 175.08 2jxp s LEU 88 N 1.48 3.30 0.00 -0.68 1.02 0.39 -1.85 118.68 122.35 2jxp s LEU 88 Ca 0.02 -0.80 0.00 0.00 0.02 0.00 0.00 54.13 53.37 2jxp s LEU 88 Cb -0.21 -1.80 0.00 0.00 0.02 0.00 0.00 46.19 44.20 2jxp s LEU 88 CO 0.04 -0.43 0.00 -0.90 0.02 0.00 0.00 176.35 175.08 2jxp n ASP 89 N -1.28 0.00 0.23 2.29 5.75 -0.74 -0.83 116.55 121.96 2jxp n ASP 89 Ca -0.01 -0.96 0.06 0.00 -0.01 0.00 0.00 54.79 53.87 2jxp n ASP 89 Cb 0.62 0.00 0.55 0.00 -1.03 0.00 0.00 41.12 41.26 2jxp n ASP 89 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jxp h ALA 90 N 0.35 1.82 -0.30 2.12 0.00 -1.50 -2.10 119.26 119.65 2jxp h ALA 90 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2jxp h ALA 90 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2jxp h ALA 90 CO 0.00 0.13 0.00 0.72 0.00 0.00 0.00 179.25 180.10 2jxp n HIS 91 N -4.42 0.59 -1.64 0.00 8.25 -1.26 -4.89 115.22 111.84 2jxp n HIS 91 Ca -0.02 -0.25 -0.13 0.00 -0.26 0.00 0.00 57.72 57.05 2jxp n HIS 91 Cb 0.17 -0.10 -0.04 0.00 1.12 0.00 0.00 29.99 31.14 2jxp n HIS 91 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2jxp n ASN 92 N 0.38 -4.49 -4.66 0.41 5.03 -0.79 -4.99 115.26 106.14 2jxp n ASN 92 Ca 0.11 0.23 -0.38 0.00 0.87 0.00 0.00 54.58 55.41 2jxp n ASN 92 Cb 0.40 -3.32 -0.07 0.00 -1.02 0.00 0.00 39.78 35.77 2jxp n ASN 92 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2jxp s ALA 93 N -2.55 3.56 -1.21 5.41 0.00 -1.26 -4.86 121.76 120.85 2jxp s ALA 93 Ca 0.00 -0.54 -0.21 0.00 0.00 0.00 0.00 51.96 51.22 2jxp s ALA 93 Cb 0.00 -2.69 -0.00 0.00 0.00 0.00 0.00 23.12 20.43 2jxp s ALA 93 CO 0.00 -0.38 1.81 -1.83 0.00 0.00 0.00 175.76 175.36 2jxp s GLU 94 N 1.49 3.29 0.19 0.00 -1.05 -1.26 -1.80 118.70 119.55 2jxp s GLU 94 Ca 0.20 -1.51 -0.12 0.00 -0.15 0.00 0.00 54.97 53.38 2jxp s GLU 94 Cb -0.15 -5.38 0.13 0.00 -0.44 0.00 0.00 34.13 28.29 2jxp s GLU 94 CO 0.08 -3.01 1.83 -0.07 0.95 0.00 0.00 175.26 175.04 2jxp h LEU 95 N 14.94 0.58 -8.27 1.83 -0.00 -1.71 -3.42 115.31 119.26 2jxp h LEU 95 Ca 0.32 0.00 -0.67 0.00 -0.00 0.00 0.00 57.88 57.53 2jxp h LEU 95 Cb 0.91 -0.12 -0.33 0.00 -0.00 0.00 0.00 40.66 41.13 2jxp h LEU 95 CO 1.35 0.41 -0.85 0.00 -0.00 0.00 0.00 178.44 179.35 2jxp s ALA 96 N -6.13 2.34 -0.90 1.53 0.00 -0.77 -5.05 121.76 112.77 2jxp s ALA 96 Ca -0.13 -1.07 -0.21 0.00 0.00 0.00 0.00 51.96 50.55 2jxp s ALA 96 Cb 0.14 -1.07 0.10 0.00 0.00 0.00 0.00 23.12 22.28 2jxp s ALA 96 CO 0.75 -0.02 1.19 0.45 0.00 0.00 0.00 175.76 178.13 2jxp s SER 97 N 0.80 6.50 -0.58 0.00 0.15 -1.26 -1.21 113.70 118.10 2jxp s SER 97 Ca -0.07 -1.65 -0.27 0.00 0.70 0.00 0.00 55.95 54.66 2jxp s SER 97 Cb -0.15 -2.45 -0.02 0.00 -1.71 0.00 0.00 66.02 61.69 2jxp s SER 97 CO -0.01 -1.27 1.78 -0.22 1.20 0.00 0.00 173.24 174.72 2jxp s LEU 98 N 3.63 3.32 0.49 3.45 2.96 -1.18 -4.95 118.68 126.40 2jxp s LEU 98 Ca 0.34 0.40 -0.23 0.00 -0.22 0.00 0.00 54.13 54.43 2jxp s LEU 98 Cb -0.06 -2.69 -0.07 0.00 0.50 0.00 0.00 46.19 43.87 2jxp s LEU 98 CO -0.05 -2.22 1.26 0.00 -1.32 0.00 0.00 176.35 174.02 2jxp n GLN 99 N 9.06 1.71 -1.67 1.98 6.02 -1.26 -3.55 117.38 129.67 2jxp n GLN 99 Ca 0.19 0.62 -0.47 0.00 -0.01 0.00 0.00 57.00 57.33 2jxp n GLN 99 Cb 0.51 -2.42 -0.04 0.00 1.02 0.00 0.00 30.24 29.31 2jxp n GLN 99 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 2jxp n GLU 100 N -0.45 2.18 -2.62 -1.09 0.28 -1.26 -4.78 120.64 112.90 2jxp n GLU 100 Ca 0.09 0.79 -0.41 0.00 -0.16 0.00 0.00 57.16 57.47 2jxp n GLU 100 Cb 0.42 -2.60 -0.03 0.00 1.43 0.00 0.00 31.44 30.67 2jxp n GLU 100 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2jxp s ILE 101 N 2.20 4.02 -0.74 3.84 1.01 0.13 -4.90 121.20 126.76 2jxp s ILE 101 Ca 0.84 -0.74 -0.19 0.00 0.00 0.00 0.00 60.65 60.56 2jxp s ILE 101 Cb -0.68 -5.00 0.12 0.00 0.01 0.00 0.00 42.46 36.91 2jxp s ILE 101 CO 0.43 -1.86 0.90 -0.60 0.00 0.00 0.00 174.94 173.81 2jxp s ARG 102 N 4.72 3.29 0.05 2.79 3.52 -1.26 -1.84 118.95 130.22 2jxp s ARG 102 Ca 0.42 -1.47 0.02 0.00 -0.13 0.00 0.00 55.73 54.58 2jxp s ARG 102 Cb -0.02 -4.47 -0.04 0.00 -1.56 0.00 0.00 34.95 28.86 2jxp s ARG 102 CO -0.07 -1.65 0.06 -0.51 -0.81 0.00 0.00 175.30 172.33 2jxp s LEU 103 N 2.73 3.76 -0.02 -0.88 1.43 0.33 -4.99 118.68 121.04 2jxp s LEU 103 Ca 0.21 0.01 0.06 0.00 -1.03 0.00 0.00 54.13 53.38 2jxp s LEU 103 Cb -0.15 -2.37 -0.01 0.00 0.03 0.00 0.00 46.19 43.68 2jxp s LEU 103 CO 0.01 0.20 -0.19 0.42 0.23 0.00 0.00 176.35 177.02 2jxp s THR 104 N -1.31 1.47 -0.09 5.49 -4.23 -1.26 -0.62 115.64 115.09 2jxp s THR 104 Ca 0.27 -0.79 0.02 0.00 -1.18 0.00 0.00 61.69 60.01 2jxp s THR 104 Cb -0.12 -1.23 0.01 0.00 1.34 0.00 0.00 72.50 72.50 2jxp s THR 104 CO 0.19 0.42 -0.16 -0.60 -0.54 0.00 0.00 174.62 173.92 2jxp s ARG 105 N -0.39 2.23 -0.26 3.99 6.06 0.17 -4.98 118.95 125.77 2jxp s ARG 105 Ca 0.06 -0.58 -0.15 0.00 -2.50 0.00 0.00 55.73 52.56 2jxp s ARG 105 Cb -0.08 -1.81 -0.04 0.00 0.06 0.00 0.00 34.95 33.08 2jxp s ARG 105 CO -0.00 0.03 0.37 0.42 -2.50 0.00 0.00 175.30 173.62 2jxp s ILE 106 N 0.71 5.18 -0.50 4.11 -1.09 -1.26 -0.36 121.20 127.98 2jxp s ILE 106 Ca -0.13 0.58 -0.10 0.00 -2.23 0.00 0.00 60.65 58.78 2jxp s ILE 106 Cb -0.16 -3.70 0.13 0.00 -1.58 0.00 0.00 42.46 37.15 2jxp s ILE 106 CO 0.03 0.17 0.38 -0.22 -1.23 0.00 0.00 174.94 174.07 2jxp s LEU 107 N 1.95 5.77 0.13 2.97 1.98 -0.08 -4.96 118.68 126.44 2jxp s LEU 107 Ca 0.15 -1.99 -0.31 0.00 -2.89 0.00 0.00 54.13 49.09 2jxp s LEU 107 Cb -0.16 -2.03 -0.09 0.00 0.66 0.00 0.00 46.19 44.58 2jxp s LEU 107 CO 0.09 -0.69 1.50 -2.16 -1.89 0.00 0.00 176.35 173.21 2jxp s PRO 108 N 1.25 4.26 -0.50 0.98 0.04 -1.26 -0.12 135.00 139.65 2jxp s PRO 108 Ca 0.07 2.24 -0.21 0.00 0.04 0.00 0.00 61.00 63.13 2jxp s PRO 108 Cb -0.25 -3.24 0.04 0.00 0.04 0.00 0.00 34.50 31.09 2jxp s PRO 108 CO -0.01 -0.55 0.74 0.12 0.04 0.00 0.00 177.00 177.34 2jxp s PHE 109 N 1.30 2.97 -0.45 0.56 5.36 0.47 -4.91 117.98 123.26 2jxp s PHE 109 Ca 0.68 -0.20 -0.21 0.00 -0.96 0.00 0.00 56.93 56.24 2jxp s PHE 109 Cb -0.40 -3.68 0.03 0.00 -0.34 0.00 0.00 43.02 38.63 2jxp s PHE 109 CO 0.31 -1.09 0.68 -0.51 -1.46 0.00 0.00 175.22 173.14 2jxp s LEU 110 N 3.15 4.49 0.28 6.12 1.02 -1.26 -4.80 118.68 127.68 2jxp s LEU 110 Ca 0.23 -0.36 0.01 0.00 0.02 0.00 0.00 54.13 54.03 2jxp s LEU 110 Cb -0.15 -2.74 0.59 0.00 0.02 0.00 0.00 46.19 43.90 2jxp s LEU 110 CO 0.17 -0.83 1.80 0.44 0.02 0.00 0.00 176.35 177.94 2jxp h ASP 111 N 8.93 0.76 -0.24 2.29 3.32 -1.95 -1.60 116.42 127.92 2jxp h ASP 111 Ca -0.25 0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.87 2jxp h ASP 111 Cb 1.09 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.57 2jxp h ASP 111 CO 0.92 0.35 0.00 0.00 -1.72 0.00 0.00 179.24 178.79 2jxp n ALA 112 N -2.36 2.47 -3.25 3.45 0.00 -1.26 -4.81 120.51 114.75 2jxp n ALA 112 Ca 0.19 -0.73 -0.41 0.00 0.00 0.00 0.00 53.44 52.49 2jxp n ALA 112 Cb 0.43 -0.98 -0.10 0.00 0.00 0.00 0.00 19.45 18.81 2jxp n ALA 112 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2jxp s GLN 113 N -1.69 2.64 -0.02 0.00 -1.52 -0.60 -4.95 119.66 113.51 2jxp s GLN 113 Ca 0.35 -1.47 -0.12 0.00 -1.95 0.00 0.00 55.36 52.17 2jxp s GLN 113 Cb 0.20 -3.83 -0.32 0.00 -0.22 0.00 0.00 33.01 28.84 2jxp s GLN 113 CO 0.29 -0.98 0.78 1.05 -0.25 0.00 0.00 175.29 176.18 2jxp h GLU 114 N 8.45 0.44 -0.17 2.91 9.09 -1.87 -3.33 114.58 130.10 2jxp h GLU 114 Ca -0.23 -0.75 -0.11 0.00 0.05 0.00 0.00 59.36 58.31 2jxp h GLU 114 Cb 1.09 0.28 -0.01 0.00 -1.65 0.00 0.00 28.75 28.45 2jxp h GLU 114 CO 0.78 1.36 -0.39 -0.07 0.05 0.00 0.00 179.01 180.74 2jxp h LEU 115 N 0.12 0.39 -0.91 3.06 -0.00 -1.98 -3.17 115.31 112.82 2jxp h LEU 115 Ca -0.32 -0.16 0.14 0.00 -0.00 0.00 0.00 57.88 57.54 2jxp h LEU 115 Cb 2.12 -0.11 -0.09 0.00 -0.00 0.00 0.00 40.66 42.58 2jxp h LEU 115 CO 0.21 0.75 0.52 0.00 -0.00 0.00 0.00 178.44 179.91 2jxp h ALA 116 N 1.28 1.38 -0.98 1.53 0.00 -1.97 -0.46 119.26 120.05 2jxp h ALA 116 Ca 0.03 0.06 0.20 0.00 0.00 0.00 0.00 54.91 55.20 2jxp h ALA 116 Cb 0.83 -0.09 -0.09 0.00 0.00 0.00 0.00 17.79 18.43 2jxp h ALA 116 CO 0.07 0.03 0.61 0.87 0.00 0.00 0.00 179.25 180.83 2jxp h LYS 117 N 0.77 0.62 0.00 0.00 1.79 -1.67 -0.89 116.57 117.18 2jxp h LYS 117 Ca 0.48 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.91 2jxp h LYS 117 Cb 0.60 -0.14 -0.00 0.00 -1.58 0.00 0.00 32.23 31.11 2jxp h LYS 117 CO -0.32 0.41 -0.24 0.00 -1.08 0.00 0.00 179.45 178.22 2jxp h ALA 118 N 1.63 0.00 0.27 3.86 0.00 -1.32 -3.35 119.26 120.36 2jxp h ALA 118 Ca 0.54 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 2jxp h ALA 118 Cb 1.01 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 2jxp h ALA 118 CO -0.30 0.23 -0.21 0.00 0.00 0.00 0.00 179.25 178.96 2jxp h ALA 119 N -0.97 -0.48 0.23 0.00 0.00 -1.09 -0.96 119.26 115.99 2jxp h ALA 119 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2jxp h ALA 119 Cb 0.26 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2jxp h ALA 119 CO -0.00 -0.79 -0.21 0.93 0.00 0.00 0.00 179.25 179.17 2jxp h GLU 120 N -0.50 -0.45 -0.63 0.00 4.39 -1.39 -1.95 114.58 114.06 2jxp h GLU 120 Ca -0.02 0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.64 2jxp h GLU 120 Cb 0.44 0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.17 2jxp h GLU 120 CO -0.01 -0.30 0.08 1.49 -1.16 0.00 0.00 179.01 179.11 2jxp h GLU 121 N -0.47 1.04 -0.44 2.33 4.81 -1.69 -1.57 114.58 118.60 2jxp h GLU 121 Ca -0.01 -0.28 0.09 0.00 -0.13 0.00 0.00 59.36 59.03 2jxp h GLU 121 Cb 0.43 -0.12 -0.09 0.00 0.63 0.00 0.00 28.75 29.60 2jxp h GLU 121 CO -0.04 0.97 -0.17 1.49 -0.73 0.00 0.00 179.01 180.53 2jxp h GLU 122 N 0.97 -0.08 -0.13 1.92 4.57 -0.98 -0.50 114.58 120.35 2jxp h GLU 122 Ca 0.19 0.01 -0.08 0.00 -1.18 0.00 0.00 59.36 58.30 2jxp h GLU 122 Cb 0.45 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.04 2jxp h GLU 122 CO 0.02 -0.05 -0.27 0.52 -1.18 0.00 0.00 179.01 178.04 2jxp h MET 123 N -0.08 0.24 -0.14 1.92 2.86 -0.95 -2.94 114.93 115.85 2jxp h MET 123 Ca 0.21 -0.08 -0.14 0.00 -2.06 0.00 0.00 59.70 57.63 2jxp h MET 123 Cb 0.40 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 2jxp h MET 123 CO -0.49 0.50 -0.52 -0.07 1.06 0.00 0.00 176.91 177.40 2jxp h LEU 124 N 0.22 0.43 -0.00 1.22 3.38 -0.29 -2.30 115.31 117.97 2jxp h LEU 124 Ca 0.03 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 2jxp h LEU 124 Cb 0.60 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 2jxp h LEU 124 CO 0.04 0.87 0.00 1.88 0.09 0.00 0.00 178.44 181.33 2jxp h TYR 125 N 0.31 0.00 0.00 1.13 0.05 -0.95 0.11 116.97 117.62 2jxp h TYR 125 Ca 0.01 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2jxp h TYR 125 Cb 1.01 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.75 2jxp h TYR 125 CO 0.03 0.06 0.00 0.36 -1.05 0.00 0.00 178.16 177.56 2jxp n LYS 126 N -5.06 0.80 -0.12 4.88 2.85 -1.18 -2.19 118.16 118.14 2jxp n LYS 126 Ca -0.07 0.00 -0.17 0.00 -1.05 0.00 0.00 58.31 57.02 2jxp n LYS 126 Cb 0.06 -1.36 -0.11 0.00 -0.65 0.00 0.00 35.03 32.97 2jxp n LYS 126 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2jxp n ASP 127 N -0.86 2.12 -0.04 -5.58 2.03 -0.78 -3.73 116.55 109.70 2jxp n ASP 127 Ca 0.14 -0.10 -0.14 0.00 0.52 0.00 0.00 54.79 55.21 2jxp n ASP 127 Cb 0.06 -0.40 -0.08 0.00 -0.72 0.00 0.00 41.12 39.98 2jxp n ASP 127 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jxp h MET 128 N -0.06 0.27 -0.64 -0.67 -0.00 -0.69 -2.44 114.93 110.71 2jxp h MET 128 Ca -0.54 -0.17 -0.04 0.00 -0.00 0.00 0.00 59.70 58.95 2jxp h MET 128 Cb 1.81 0.02 -0.03 0.00 -0.00 0.00 0.00 31.60 33.40 2jxp h MET 128 CO -0.10 0.74 0.23 0.37 -0.00 0.00 0.00 176.91 178.15 2jxp h GLN 129 N -0.16 0.97 -0.36 -0.10 -0.00 -1.69 -1.86 115.11 111.91 2jxp h GLN 129 Ca 0.01 -0.19 0.07 0.00 -0.00 0.00 0.00 58.65 58.54 2jxp h GLN 129 Cb 0.71 -0.15 -0.09 0.00 0.00 0.00 0.00 27.48 27.96 2jxp h GLN 129 CO 0.03 0.83 -0.33 -0.22 0.00 0.00 0.00 178.83 179.14 2jxp h LYS 130 N 0.91 -0.27 0.73 1.69 3.64 -1.64 -0.52 116.57 121.11 2jxp h LYS 130 Ca 0.21 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.57 2jxp h LYS 130 Cb 0.24 0.06 0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2jxp h LYS 130 CO -0.01 -0.18 -0.35 0.22 -2.27 0.00 0.00 179.45 176.86 2jxp h ASP 131 N -0.28 -0.83 -0.65 4.20 1.82 -1.28 -3.01 116.42 116.39 2jxp h ASP 131 Ca 0.16 0.01 0.11 0.00 -0.39 0.00 0.00 57.03 56.91 2jxp h ASP 131 Cb 0.54 0.21 -0.08 0.00 0.68 0.00 0.00 39.33 40.69 2jxp h ASP 131 CO -0.51 -0.54 0.24 0.00 -1.61 0.00 0.00 179.24 176.82 2jxp h ALA 132 N -0.87 0.85 -0.46 -0.78 0.00 -1.19 -0.93 119.26 115.88 2jxp h ALA 132 Ca -0.10 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 2jxp h ALA 132 Cb 0.77 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2jxp h ALA 132 CO 0.16 -0.19 -0.10 -0.24 0.00 0.00 0.00 179.25 178.89 2jxp h VAL 133 N 0.42 1.26 -0.07 0.00 3.04 -1.15 -1.55 116.25 118.20 2jxp h VAL 133 Ca 0.33 -1.17 -0.13 0.00 -1.01 0.00 0.00 66.70 64.72 2jxp h VAL 133 Cb 0.44 1.01 -0.01 0.00 -2.01 0.00 0.00 31.29 30.71 2jxp h VAL 133 CO -0.33 0.40 -0.56 1.56 -1.01 0.00 0.00 177.57 177.63 2jxp h GLN 134 N 0.75 0.20 -0.16 4.17 1.08 -1.26 -1.23 115.11 118.67 2jxp h GLN 134 Ca 0.13 -0.13 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2jxp h GLN 134 Cb 0.59 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.03 2jxp h GLN 134 CO 0.04 0.71 0.08 1.96 -0.95 0.00 0.00 178.83 180.66 2jxp h GLN 135 N 0.15 0.22 0.02 1.46 1.08 -0.78 0.94 115.11 118.20 2jxp h GLN 135 Ca -0.00 -0.03 0.02 0.00 -1.45 0.00 0.00 58.65 57.19 2jxp h GLN 135 Cb 1.04 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 28.40 2jxp h GLN 135 CO 0.08 0.26 -0.14 0.82 -0.95 0.00 0.00 178.83 178.91 2jxp h ILE 136 N 0.13 0.67 -0.48 2.54 2.04 -1.20 -2.36 117.51 118.85 2jxp h ILE 136 Ca 0.05 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.01 2jxp h ILE 136 Cb 0.11 0.67 -0.08 0.00 -0.74 0.00 0.00 36.82 36.77 2jxp h ILE 136 CO -0.01 0.00 -0.01 0.25 0.00 0.00 0.00 178.15 178.38 2jxp h LEU 137 N -0.23 -0.23 -0.71 1.44 5.85 -1.06 -0.86 115.31 119.50 2jxp h LEU 137 Ca 0.04 0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.90 2jxp h LEU 137 Cb 0.29 0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 2jxp h LEU 137 CO -0.12 -0.08 0.46 -0.09 -0.34 0.00 0.00 178.44 178.27 2jxp h ARG 138 N 0.10 0.91 -0.24 1.25 2.43 -0.67 -1.03 114.38 117.13 2jxp h ARG 138 Ca 0.24 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.32 2jxp h ARG 138 Cb 0.36 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2jxp h ARG 138 CO -0.41 0.60 0.02 1.96 -1.51 0.00 0.00 179.97 180.63 2jxp h GLN 139 N 0.93 0.40 -0.62 0.20 1.08 -0.85 -1.24 115.11 115.02 2jxp h GLN 139 Ca 0.27 -0.12 -0.03 0.00 -1.45 0.00 0.00 58.65 57.32 2jxp h GLN 139 Cb -0.07 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.29 2jxp h GLN 139 CO -0.07 0.55 0.26 0.28 -0.95 0.00 0.00 178.83 178.90 2jxp h VAL 140 N 0.20 1.23 0.05 -0.54 2.07 -0.96 -2.59 116.25 115.70 2jxp h VAL 140 Ca 0.07 -0.70 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 2jxp h VAL 140 Cb 0.36 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2jxp h VAL 140 CO 0.01 0.28 -0.02 0.77 0.02 0.00 0.00 177.57 178.62 2jxp h SER 141 N 0.86 -0.05 0.19 0.57 4.64 -1.20 -3.27 113.55 115.29 2jxp h SER 141 Ca 0.21 -0.59 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2jxp h SER 141 Cb 0.18 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2jxp h SER 141 CO -0.02 0.61 0.00 0.00 -0.87 0.00 0.00 176.83 176.55 2jxp h ALA 142 N 0.08 1.00 -0.09 5.18 0.00 -1.28 -2.99 119.26 121.16 2jxp h ALA 142 Ca -0.01 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2jxp h ALA 142 Cb 0.64 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2jxp h ALA 142 CO 0.01 0.00 0.43 0.35 0.00 0.00 0.00 179.25 180.04 2jxp h PHE 143 N 0.00 0.00 -0.55 0.00 3.57 -1.51 -1.51 116.94 116.94 2jxp h PHE 143 Ca 0.00 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 2jxp h PHE 143 Cb 0.10 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 2jxp h PHE 143 CO 0.00 0.00 0.00 0.00 -2.23 0.00 0.00 178.31 176.08 2jxp h THR 144 N 0.00 1.26 -2.12 4.41 1.03 -1.77 -3.46 112.91 112.26 2jxp h THR 144 Ca 0.04 -1.09 -0.06 0.00 -0.01 0.00 0.00 66.41 65.29 2jxp h THR 144 Cb 0.90 0.83 -0.20 0.00 -1.07 0.00 0.00 68.15 68.61 2jxp h THR 144 CO -0.00 0.39 0.10 -0.44 -0.01 0.00 0.00 175.52 175.56 2jxp s SER 145 N -6.61 -0.66 -0.07 0.00 0.01 -0.57 -5.07 113.70 100.75 2jxp s SER 145 Ca -0.11 1.04 -0.17 0.00 1.31 0.00 0.00 55.95 58.02 2jxp s SER 145 Cb 0.14 0.99 -0.30 0.00 0.21 0.00 0.00 66.02 67.06 2jxp s SER 145 CO 0.84 -0.39 0.70 0.00 0.41 0.00 0.00 173.24 174.80 2jxp h ALA 146 N 4.20 0.07 0.00 1.44 0.00 -1.89 -3.47 119.26 119.61 2jxp h ALA 146 Ca -0.28 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 53.65 2jxp h ALA 146 Cb 1.15 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2jxp h ALA 146 CO 0.22 0.73 0.00 0.41 0.00 0.00 0.00 179.25 180.61 2jxp n GLY 147 N 1.74 -0.01 0.25 0.00 0.00 -1.26 -4.98 105.19 100.94 2jxp n GLY 147 Ca -0.21 0.22 0.07 0.00 0.00 0.00 0.00 46.02 46.10 2jxp n GLY 147 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jxp h LEU 148 N 0.00 0.03 -0.08 0.99 -0.00 -1.96 -1.62 115.31 112.67 2jxp h LEU 148 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2jxp h LEU 148 Cb 0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 40.66 40.65 2jxp h LEU 148 CO 0.00 0.07 0.05 -0.33 -0.00 0.00 0.00 178.44 178.24 2jxp h GLU 149 N 0.03 0.11 0.00 1.13 3.07 -1.94 -0.31 114.58 116.68 2jxp h GLU 149 Ca 0.01 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2jxp h GLU 149 Cb 0.09 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 27.97 2jxp h GLU 149 CO 0.00 0.08 -0.01 1.25 -1.40 0.00 0.00 179.01 178.94 2jxp h HIS 150 N 0.11 0.00 -0.07 4.33 2.76 -1.82 -3.11 115.15 117.35 2jxp h HIS 150 Ca 0.03 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.12 2jxp h HIS 150 Cb -0.01 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.96 2jxp h HIS 150 CO -0.07 0.01 -0.28 1.25 -1.30 0.00 0.00 177.93 177.54 2jxp h HIS 151 N 0.00 0.42 -0.88 5.26 6.17 -0.77 -3.47 115.15 121.88 2jxp h HIS 151 Ca -0.00 -0.18 0.18 0.00 0.71 0.00 0.00 60.37 61.09 2jxp h HIS 151 Cb 0.73 -0.07 -0.23 0.00 2.52 0.00 0.00 27.41 30.35 2jxp h HIS 151 CO 0.00 0.89 0.20 -1.58 0.71 0.00 0.00 177.93 178.15 2jxp s HIS 152 N -3.70 -0.68 0.17 5.26 5.65 -0.18 -5.09 115.29 116.71 2jxp s HIS 152 Ca -0.14 1.08 -0.05 0.00 0.25 0.00 0.00 55.06 56.19 2jxp s HIS 152 Cb 0.04 0.37 0.02 0.00 -1.18 0.00 0.00 32.58 31.83 2jxp s HIS 152 CO 0.76 -0.35 0.32 -2.39 -0.65 0.00 0.00 174.74 172.44 2jxp n HIS 153 N 5.06 -1.47 -2.15 3.88 -0.00 -1.23 -4.58 115.22 114.73 2jxp n HIS 153 Ca -0.08 -0.86 -0.37 0.00 -0.00 0.00 0.00 57.72 56.41 2jxp n HIS 153 Cb 0.53 0.38 0.01 0.00 -0.00 0.00 0.00 29.99 30.90 2jxp n HIS 153 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2jxp s HIS 154 N -5.65 2.70 -2.00 -1.40 5.65 -1.26 -5.13 115.29 108.20 2jxp s HIS 154 Ca 0.08 1.50 0.03 0.00 0.25 0.00 0.00 55.06 56.92 2jxp s HIS 154 Cb -0.02 -3.46 0.16 0.00 -1.18 0.00 0.00 32.58 28.09 2jxp s HIS 154 CO 0.06 -1.84 0.65 1.58 -0.65 0.00 0.00 174.74 174.54