#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxp h GLY 2 N 0.00 0.04 -2.39 3.03 0.00 -2.12 -3.45 103.07 98.17 2jxp h GLY 2 Ca 0.00 -0.02 -0.55 0.00 0.00 0.00 0.00 47.33 46.76 2jxp h GLY 2 CO 0.00 0.02 -0.57 -1.36 0.00 0.00 0.00 176.54 174.63 2jxp s PHE 3 N -5.63 2.72 -0.30 5.60 0.08 -1.26 -5.04 117.98 114.15 2jxp s PHE 3 Ca -0.14 -0.33 0.16 0.00 0.12 0.00 0.00 56.93 56.74 2jxp s PHE 3 Cb 0.05 -1.51 0.65 0.00 -0.57 0.00 0.00 43.02 41.64 2jxp s PHE 3 CO 0.67 0.43 1.56 1.63 -0.10 0.00 0.00 175.22 179.40 2jxp n LYS 4 N -1.08 3.75 -2.50 0.44 5.02 -1.26 -5.00 118.16 117.53 2jxp n LYS 4 Ca -0.04 -2.94 -0.33 0.00 -2.02 0.00 0.00 58.31 52.97 2jxp n LYS 4 Cb 0.60 -1.99 -0.04 0.00 -0.02 0.00 0.00 35.03 33.59 2jxp n LYS 4 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2jxp s LEU 5 N -2.67 3.75 0.19 -0.35 2.01 -1.26 -5.08 118.68 115.27 2jxp s LEU 5 Ca 0.47 1.73 0.04 0.00 0.01 0.00 0.00 54.13 56.37 2jxp s LEU 5 Cb 0.36 -4.53 -0.05 0.00 0.01 0.00 0.00 46.19 41.98 2jxp s LEU 5 CO 0.13 -0.66 -0.04 -0.60 1.01 0.00 0.00 176.35 176.19 2jxp s ARG 6 N -3.62 1.21 0.00 1.70 6.06 -1.26 -5.04 118.95 118.00 2jxp s ARG 6 Ca 0.62 -1.57 0.17 0.00 -2.50 0.00 0.00 55.73 52.45 2jxp s ARG 6 Cb -0.12 -0.59 0.52 0.00 0.06 0.00 0.00 34.95 34.82 2jxp s ARG 6 CO 0.24 -0.03 1.41 0.41 -2.50 0.00 0.00 175.30 174.83 2jxp n GLY 7 N -0.31 0.87 3.89 8.12 0.00 -1.26 -4.94 105.19 111.56 2jxp n GLY 7 Ca -0.07 -0.49 -0.29 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.55 2.59 0.29 1.61 -1.52 -1.26 -4.99 119.66 114.82 2jxp s GLN 8 Ca 0.32 0.29 0.13 0.00 -1.95 0.00 0.00 55.36 54.14 2jxp s GLN 8 Cb 0.17 -2.03 0.39 0.00 -0.22 0.00 0.00 33.01 31.31 2jxp s GLN 8 CO 0.24 -1.17 1.61 -0.24 -0.25 0.00 0.00 175.29 175.48 2jxp h VAL 9 N -0.72 1.27 -1.56 1.09 3.04 -1.92 -3.46 116.25 113.99 2jxp h VAL 9 Ca -0.45 -2.06 0.08 0.00 -1.01 0.00 0.00 66.70 63.25 2jxp h VAL 9 Cb 1.28 2.16 -0.24 0.00 -2.01 0.00 0.00 31.29 32.47 2jxp h VAL 9 CO 0.64 0.56 0.52 -0.55 -1.01 0.00 0.00 177.57 177.74 2jxp s SER 10 N -6.69 -0.39 0.29 3.17 0.15 -1.17 -5.07 113.70 104.00 2jxp s SER 10 Ca -0.00 0.53 0.02 0.00 0.70 0.00 0.00 55.95 57.20 2jxp s SER 10 Cb 0.12 0.47 -0.03 0.00 -1.71 0.00 0.00 66.02 64.87 2jxp s SER 10 CO 0.74 -0.28 0.28 -1.61 1.20 0.00 0.00 173.24 173.58 2jxp s GLU 11 N -0.70 1.62 -0.10 5.44 2.02 -1.26 -3.73 118.70 121.99 2jxp s GLU 11 Ca -0.00 -1.82 -0.24 0.00 0.02 0.00 0.00 54.97 52.93 2jxp s GLU 11 Cb -0.02 0.34 0.06 0.00 0.10 0.00 0.00 34.13 34.61 2jxp s GLU 11 CO -0.01 -0.60 0.57 -0.48 0.02 0.00 0.00 175.26 174.76 2jxp s LEU 12 N -3.27 -0.20 0.55 1.80 0.05 -1.26 -4.93 118.68 111.42 2jxp s LEU 12 Ca 0.37 0.76 0.36 0.00 0.05 0.00 0.00 54.13 55.67 2jxp s LEU 12 Cb 0.03 2.09 1.82 0.00 -2.05 0.00 0.00 46.19 48.08 2jxp s LEU 12 CO 0.21 -0.43 2.10 1.55 -0.55 0.00 0.00 176.35 179.23 2jxp h PRO 13 N 3.97 0.00 -4.17 1.48 0.13 -1.99 -3.36 132.00 128.06 2jxp h PRO 13 Ca -0.28 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 64.13 2jxp h PRO 13 Cb 1.16 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 31.97 2jxp h PRO 13 CO 0.30 0.00 -0.39 -0.59 -0.23 0.00 0.00 178.00 177.09 2jxp s PHE 14 N -3.85 3.49 0.03 1.56 -0.71 -1.26 -4.95 117.98 112.29 2jxp s PHE 14 Ca -0.02 -2.19 -0.17 0.00 -1.04 0.00 0.00 56.93 53.52 2jxp s PHE 14 Cb 0.10 -3.40 -0.34 0.00 -1.21 0.00 0.00 43.02 38.18 2jxp s PHE 14 CO 0.41 -0.96 1.01 1.05 -1.34 0.00 0.00 175.22 175.39 2jxp h GLU 15 N 8.03 0.54 -6.34 1.99 4.11 -1.88 -3.42 114.58 117.60 2jxp h GLU 15 Ca -0.13 -0.87 -0.54 0.00 0.07 0.00 0.00 59.36 57.89 2jxp h GLU 15 Cb 1.04 0.32 -0.08 0.00 0.50 0.00 0.00 28.75 30.52 2jxp h GLU 15 CO 0.78 1.41 1.08 1.03 0.07 0.00 0.00 179.01 183.38 2jxp s ARG 16 N -2.66 3.21 0.13 1.06 3.00 -1.26 -0.04 118.95 122.39 2jxp s ARG 16 Ca -0.10 -0.29 0.11 0.00 0.00 0.00 0.00 55.73 55.45 2jxp s ARG 16 Cb 0.04 -4.24 -0.04 0.00 0.00 0.00 0.00 34.95 30.71 2jxp s ARG 16 CO 0.93 -2.15 -0.27 0.14 0.00 0.00 0.00 175.30 173.95 2jxp s VAL 17 N 5.68 2.26 0.04 3.52 -7.23 -1.21 -0.64 120.40 122.82 2jxp s VAL 17 Ca 0.35 -1.75 0.06 0.00 -1.81 0.00 0.00 61.98 58.83 2jxp s VAL 17 Cb -0.08 -2.00 -0.03 0.00 0.56 0.00 0.00 36.38 34.83 2jxp s VAL 17 CO 0.14 0.10 -0.14 -0.47 -0.31 0.00 0.00 175.10 174.41 2jxp s TYR 18 N -1.05 2.66 0.05 2.82 5.04 -0.64 -1.59 117.35 124.64 2jxp s TYR 18 Ca 0.14 -0.19 0.08 0.00 -2.44 0.00 0.00 57.07 54.66 2jxp s TYR 18 Cb -0.10 -1.50 -0.03 0.00 0.35 0.00 0.00 41.96 40.68 2jxp s TYR 18 CO 0.06 0.30 -0.21 -1.50 -1.34 0.00 0.00 175.55 172.87 2jxp s ILE 19 N -0.98 2.60 -0.06 3.14 2.07 -1.26 -0.86 121.20 125.86 2jxp s ILE 19 Ca 0.16 -1.27 -0.03 0.00 -1.41 0.00 0.00 60.65 58.10 2jxp s ILE 19 Cb -0.11 -2.08 0.04 0.00 0.13 0.00 0.00 42.46 40.44 2jxp s ILE 19 CO 0.07 0.33 0.11 0.28 -1.91 0.00 0.00 174.94 173.82 2jxp s THR 20 N -0.90 -0.18 0.03 4.00 -1.32 -1.04 -4.97 115.64 111.25 2jxp s THR 20 Ca 0.14 0.37 0.05 0.00 -1.21 0.00 0.00 61.69 61.04 2jxp s THR 20 Cb -0.10 -0.22 -0.02 0.00 -1.51 0.00 0.00 72.50 70.64 2jxp s THR 20 CO 0.05 0.15 -0.16 0.00 -2.21 0.00 0.00 174.62 172.45 2jxp s ALA 21 N 2.12 1.32 0.32 11.08 0.00 -1.26 -2.46 121.76 132.87 2jxp s ALA 21 Ca 0.03 -0.83 0.35 0.00 0.00 0.00 0.00 51.96 51.50 2jxp s ALA 21 Cb -0.12 -0.25 1.88 0.00 0.00 0.00 0.00 23.12 24.63 2jxp s ALA 21 CO -0.05 0.28 2.06 -1.00 0.00 0.00 0.00 175.76 177.05 2jxp h PRO 22 N 5.13 0.00 0.00 0.00 0.13 -1.83 -3.26 132.00 132.17 2jxp h PRO 22 Ca -0.38 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.74 2jxp h PRO 22 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2jxp h PRO 22 CO 0.45 0.00 -0.01 0.00 -0.23 0.00 0.00 178.00 178.21 2jxp n ALA 23 N -1.94 1.87 -3.55 -0.56 0.00 -1.26 -5.04 120.51 110.03 2jxp n ALA 23 Ca -0.02 -0.03 -0.23 0.00 0.00 0.00 0.00 53.44 53.15 2jxp n ALA 23 Cb 0.07 -0.02 0.05 0.00 0.00 0.00 0.00 19.45 19.56 2jxp n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jxp n GLY 24 N 0.00 -0.83 3.75 0.00 0.00 -1.23 -4.99 105.19 101.89 2jxp n GLY 24 Ca -0.01 0.40 -0.30 0.00 0.00 0.00 0.00 46.02 46.11 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 -6.20 1.70 0.22 0.99 1.02 -1.26 -4.73 118.68 110.41 2jxp s LEU 25 Ca 0.33 0.61 -0.09 0.00 0.02 0.00 0.00 54.13 55.00 2jxp s LEU 25 Cb -0.09 -2.61 0.33 0.00 0.02 0.00 0.00 46.19 43.85 2jxp s LEU 25 CO 0.81 -3.26 1.70 0.71 0.02 0.00 0.00 176.35 176.33 2jxp h THR 26 N -1.99 0.60 -0.92 5.49 1.35 -1.99 0.74 112.91 116.18 2jxp h THR 26 Ca -0.46 -0.09 0.24 0.00 -0.55 0.00 0.00 66.41 65.55 2jxp h THR 26 Cb 1.29 0.33 -0.06 0.00 -1.73 0.00 0.00 68.15 67.97 2jxp h THR 26 CO 0.43 0.05 0.63 -0.29 -0.25 0.00 0.00 175.52 176.09 2jxp h ILE 27 N 0.25 0.60 0.21 6.82 6.09 -1.95 -0.50 117.51 129.03 2jxp h ILE 27 Ca 0.34 -0.08 -0.29 0.00 -1.37 0.00 0.00 64.86 63.46 2jxp h ILE 27 Cb 0.53 0.35 0.03 0.00 0.47 0.00 0.00 36.82 38.19 2jxp h ILE 27 CO -0.44 0.04 -1.29 1.23 -3.07 0.00 0.00 178.15 174.62 2jxp h GLY 28 N 0.23 0.50 0.79 8.18 0.00 -1.22 -2.66 103.07 108.89 2jxp h GLY 28 Ca 0.47 -1.28 0.00 0.00 0.00 0.00 0.00 47.33 46.52 2jxp h GLY 28 CO -0.12 1.12 -0.21 0.23 0.00 0.00 0.00 176.54 177.56 2jxp h SER 29 N -0.05 -0.55 -0.23 0.19 0.87 -0.38 -1.84 113.55 111.56 2jxp h SER 29 Ca -0.23 0.05 -0.03 0.00 -1.23 0.00 0.00 61.79 60.35 2jxp h SER 29 Cb 1.98 0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 64.10 2jxp h SER 29 CO 0.22 -0.32 0.07 0.44 -0.53 0.00 0.00 176.83 176.71 2jxp h ASP 30 N -0.47 0.40 0.24 6.23 5.19 -1.29 -2.72 116.42 124.00 2jxp h ASP 30 Ca -0.01 -0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 2jxp h ASP 30 Cb 0.42 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 39.82 2jxp h ASP 30 CO -0.03 0.42 -0.22 0.25 -3.12 0.00 0.00 179.24 176.54 2jxp h LEU 31 N 0.44 -0.57 -0.78 1.55 5.85 -1.06 0.15 115.31 120.88 2jxp h LEU 31 Ca 0.11 0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.94 2jxp h LEU 31 Cb 0.18 0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.34 2jxp h LEU 31 CO -0.00 -0.32 0.46 -0.33 -0.34 0.00 0.00 178.44 177.90 2jxp h GLU 32 N -0.48 0.80 -0.01 1.25 5.08 -1.21 -1.49 114.58 118.52 2jxp h GLU 32 Ca -0.01 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2jxp h GLU 32 Cb 0.44 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 2jxp h GLU 32 CO -0.04 0.53 -0.00 0.00 -1.00 0.00 0.00 179.01 178.50 2jxp h ARG 33 N 0.83 0.01 -0.60 2.33 3.08 -1.17 -1.15 114.38 117.71 2jxp h ARG 33 Ca 0.35 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.43 2jxp h ARG 33 Cb 0.22 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 2jxp h ARG 33 CO -0.19 0.47 0.36 0.28 -1.07 0.00 0.00 179.97 179.82 2jxp h VAL 34 N -0.45 1.06 0.56 2.04 2.07 -0.63 -1.46 116.25 119.45 2jxp h VAL 34 Ca 0.00 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 2jxp h VAL 34 Cb 0.47 0.28 0.01 0.00 -1.52 0.00 0.00 31.29 30.53 2jxp h VAL 34 CO 0.00 0.13 -0.27 0.40 0.02 0.00 0.00 177.57 177.85 2jxp h ILE 35 N 0.71 0.42 0.00 4.57 2.04 -1.28 0.82 117.51 124.79 2jxp h ILE 35 Ca 0.25 -0.13 -0.03 0.00 1.00 0.00 0.00 64.86 65.95 2jxp h ILE 35 Cb 0.04 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2jxp h ILE 35 CO -0.11 0.02 -0.12 0.77 0.00 0.00 0.00 178.15 178.71 2jxp h SER 36 N -0.84 0.00 0.07 1.72 4.64 -1.09 -1.63 113.55 116.42 2jxp h SER 36 Ca -0.08 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.87 2jxp h SER 36 Cb 0.62 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.67 2jxp h SER 36 CO 0.13 0.12 -2.14 0.35 -0.87 0.00 0.00 176.83 174.42 2jxp n THR 37 N -4.08 1.67 1.07 2.95 -2.24 -0.56 -4.53 114.28 108.55 2jxp n THR 37 Ca -0.02 -0.59 0.12 0.00 -2.27 0.00 0.00 64.05 61.29 2jxp n THR 37 Cb 0.20 -1.65 0.22 0.00 -2.10 0.00 0.00 70.33 67.00 2jxp n THR 37 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2jxp n HIS 38 N -3.49 0.00 -4.33 4.78 8.25 0.28 -4.98 115.22 115.73 2jxp n HIS 38 Ca -0.37 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 56.90 2jxp n HIS 38 Cb 1.00 -0.17 -0.06 0.00 1.12 0.00 0.00 29.99 31.89 2jxp n HIS 38 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2jxp n THR 39 N -1.18 0.00 1.44 1.59 -2.24 -0.62 -3.03 114.28 110.24 2jxp n THR 39 Ca 0.07 -1.91 0.15 0.00 -2.27 0.00 0.00 64.05 60.09 2jxp n THR 39 Cb 0.35 0.78 0.72 0.00 -2.10 0.00 0.00 70.33 70.08 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 -0.65 0.52 -1.46 -0.78 3.00 -1.24 -4.81 116.66 111.24 2jxp n ARG 40 Ca -0.01 -0.07 -0.29 0.00 -0.00 0.00 0.00 57.85 57.49 2jxp n ARG 40 Cb 0.48 -1.50 0.16 0.00 0.00 0.00 0.00 32.46 31.61 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 -2.53 1.52 -0.23 5.13 0.00 -1.26 -4.83 121.76 119.56 2jxp s ALA 41 Ca 0.29 -0.65 -0.03 0.00 0.00 0.00 0.00 51.96 51.58 2jxp s ALA 41 Cb 0.20 -2.99 0.11 0.00 0.00 0.00 0.00 23.12 20.44 2jxp s ALA 41 CO 0.46 -2.59 0.27 0.21 0.00 0.00 0.00 175.76 174.11 2jxp s LYS 42 N -5.32 0.25 -0.04 0.00 2.47 0.95 -4.68 119.74 113.37 2jxp s LYS 42 Ca 0.66 0.19 -0.30 0.00 -1.56 0.00 0.00 55.97 54.97 2jxp s LYS 42 Cb -0.13 -0.94 -0.06 0.00 -1.46 0.00 0.00 37.83 35.24 2jxp s LYS 42 CO 0.54 -0.73 1.62 0.08 0.16 0.00 0.00 175.35 177.02 2jxp s VAL 43 N 2.38 3.57 0.06 4.02 1.01 -1.26 -3.34 120.40 126.83 2jxp s VAL 43 Ca 0.09 0.74 0.02 0.00 0.00 0.00 0.00 61.98 62.84 2jxp s VAL 43 Cb -0.15 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 2jxp s VAL 43 CO -0.17 -0.06 0.06 0.68 0.00 0.00 0.00 175.10 175.61 2jxp s VAL 44 N 3.76 4.49 -1.08 2.92 -7.23 -0.62 -5.00 120.40 117.64 2jxp s VAL 44 Ca 0.72 -0.70 0.29 0.00 -1.81 0.00 0.00 61.98 60.48 2jxp s VAL 44 Cb -0.33 -3.12 0.27 0.00 0.56 0.00 0.00 36.38 33.75 2jxp s VAL 44 CO 0.29 0.19 1.91 -3.20 -0.31 0.00 0.00 175.10 173.98 2jxp n ASN 45 N 0.70 0.05 -3.92 4.85 2.85 -1.26 -4.37 115.26 114.16 2jxp n ASN 45 Ca -0.10 0.31 -0.19 0.00 -0.11 0.00 0.00 54.58 54.49 2jxp n ASN 45 Cb 0.52 -0.40 -0.16 0.00 1.24 0.00 0.00 39.78 40.98 2jxp n ASN 45 CO 0.00 0.00 0.00 -1.59 -2.11 0.00 0.00 177.26 173.56 2jxp s LYS 46 N -2.92 0.81 0.41 1.20 0.00 -1.26 -5.03 119.74 112.94 2jxp s LYS 46 Ca 0.16 -0.16 0.21 0.00 0.00 0.00 0.00 55.97 56.19 2jxp s LYS 46 Cb 0.19 -0.80 0.76 0.00 0.00 0.00 0.00 37.83 37.98 2jxp s LYS 46 CO 0.53 -0.01 1.76 0.00 0.00 0.00 0.00 175.35 177.63 2jxp h ALA 47 N 6.86 0.98 -0.89 0.59 0.00 -1.89 -3.12 119.26 121.79 2jxp h ALA 47 Ca -0.36 -0.27 0.17 0.00 0.00 0.00 0.00 54.91 54.45 2jxp h ALA 47 Cb 1.16 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.83 2jxp h ALA 47 CO 0.48 0.37 0.58 1.05 0.00 0.00 0.00 179.25 181.73 2jxp h GLU 48 N 0.00 0.55 -0.14 0.00 4.11 -1.96 -0.56 114.58 116.58 2jxp h GLU 48 Ca -0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.39 2jxp h GLU 48 Cb 0.85 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.98 2jxp h GLU 48 CO 0.04 0.36 0.00 1.63 0.07 0.00 0.00 179.01 181.11 2jxp n LYS 49 N -4.55 2.10 -3.06 1.06 4.76 -1.18 -4.96 118.16 112.32 2jxp n LYS 49 Ca 0.18 -1.62 -0.18 0.00 -2.87 0.00 0.00 58.31 53.82 2jxp n LYS 49 Cb 0.57 -1.46 0.03 0.00 -1.84 0.00 0.00 35.03 32.32 2jxp n LYS 49 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2jxp s SER 50 N -1.79 5.41 -0.02 4.39 1.04 -0.22 -4.85 113.70 117.66 2jxp s SER 50 Ca 0.34 -0.61 -0.04 0.00 0.48 0.00 0.00 55.95 56.13 2jxp s SER 50 Cb 0.20 -0.29 -0.02 0.00 0.10 0.00 0.00 66.02 66.01 2jxp s SER 50 CO 0.30 -0.97 -0.08 1.21 0.98 0.00 0.00 173.24 174.68 2jxp n GLU 51 N -1.97 0.13 -4.33 4.02 0.00 0.19 -4.71 120.64 113.97 2jxp n GLU 51 Ca 0.10 0.06 -0.32 0.00 0.00 0.00 0.00 57.16 57.00 2jxp n GLU 51 Cb 0.60 -0.72 -0.09 0.00 0.00 0.00 0.00 31.44 31.23 2jxp n GLU 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2jxp s ALA 52 N -2.16 3.16 -0.18 4.31 0.00 -1.25 -0.86 121.76 124.78 2jxp s ALA 52 Ca -0.08 -1.01 -0.00 0.00 0.00 0.00 0.00 51.96 50.87 2jxp s ALA 52 Cb 0.02 -1.22 0.01 0.00 0.00 0.00 0.00 23.12 21.93 2jxp s ALA 52 CO 0.11 0.64 -0.16 0.42 0.00 0.00 0.00 175.76 176.77 2jxp s ILE 53 N -1.08 2.47 -0.52 0.00 1.01 0.53 -1.62 121.20 122.00 2jxp s ILE 53 Ca 0.19 -0.81 -0.21 0.00 0.00 0.00 0.00 60.65 59.83 2jxp s ILE 53 Cb -0.11 -2.06 0.05 0.00 0.01 0.00 0.00 42.46 40.35 2jxp s ILE 53 CO 0.10 0.51 0.72 -0.63 0.00 0.00 0.00 174.94 175.64 2jxp s ILE 54 N 1.20 4.73 -0.48 2.92 1.09 -0.04 -0.89 121.20 129.74 2jxp s ILE 54 Ca 0.02 -0.28 -0.13 0.00 -1.10 0.00 0.00 60.65 59.17 2jxp s ILE 54 Cb -0.14 -4.37 0.10 0.00 -1.06 0.00 0.00 42.46 36.99 2jxp s ILE 54 CO -0.07 -0.90 0.39 -1.58 -0.10 0.00 0.00 174.94 172.67 2jxp s GLN 55 N 3.01 2.77 -0.36 2.79 0.74 -0.45 -2.51 119.66 125.65 2jxp s GLN 55 Ca 0.19 -1.59 -0.23 0.00 0.05 0.00 0.00 55.36 53.78 2jxp s GLN 55 Cb -0.17 -4.06 0.01 0.00 1.10 0.00 0.00 33.01 29.89 2jxp s GLN 55 CO 0.14 -1.15 0.78 -1.50 -0.55 0.00 0.00 175.29 173.01 2jxp s ILE 56 N 1.51 4.74 -0.13 -2.34 -1.16 -1.03 -0.42 121.20 122.37 2jxp s ILE 56 Ca 0.04 0.87 -0.28 0.00 -0.51 0.00 0.00 60.65 60.77 2jxp s ILE 56 Cb -0.26 -4.21 -0.26 0.00 0.61 0.00 0.00 42.46 38.34 2jxp s ILE 56 CO 0.03 -0.43 0.81 0.58 -2.81 0.00 0.00 174.94 173.11 2jxp h VAL 57 N 5.75 1.76 -1.54 4.00 2.07 -1.18 -3.37 116.25 123.74 2jxp h VAL 57 Ca -0.25 -2.30 0.10 0.00 0.82 0.00 0.00 66.70 65.08 2jxp h VAL 57 Cb 1.09 3.31 -0.23 0.00 -1.52 0.00 0.00 31.29 33.95 2jxp h VAL 57 CO 0.91 0.60 0.58 -1.38 0.02 0.00 0.00 177.57 178.30 2jxp s HIS 58 N -2.35 -0.34 -0.21 1.57 -3.43 -1.03 -4.65 115.29 104.85 2jxp s HIS 58 Ca -0.18 0.56 -0.00 0.00 -0.80 0.00 0.00 55.06 54.63 2jxp s HIS 58 Cb -0.02 0.46 0.06 0.00 -1.43 0.00 0.00 32.58 31.64 2jxp s HIS 58 CO 0.70 -0.32 -0.03 0.00 -2.00 0.00 0.00 174.74 173.09 2jxp s ALA 59 N -1.18 1.60 -0.16 -1.38 0.00 -1.26 -1.04 121.76 118.35 2jxp s ALA 59 Ca -0.00 -1.07 -0.19 0.00 0.00 0.00 0.00 51.96 50.70 2jxp s ALA 59 Cb -0.01 -1.30 -0.03 0.00 0.00 0.00 0.00 23.12 21.78 2jxp s ALA 59 CO 0.00 -1.10 0.54 0.42 0.00 0.00 0.00 175.76 175.62 2jxp s ILE 60 N 1.57 5.12 -0.24 0.00 1.09 0.51 -4.93 121.20 124.32 2jxp s ILE 60 Ca -0.03 1.03 0.02 0.00 -1.10 0.00 0.00 60.65 60.57 2jxp s ILE 60 Cb -0.18 -3.86 0.05 0.00 -1.06 0.00 0.00 42.46 37.41 2jxp s ILE 60 CO -0.07 0.23 -0.12 0.00 -0.10 0.00 0.00 174.94 174.88 2jxp s ARG 61 N 1.25 2.26 -0.07 2.79 1.70 -1.26 -0.34 118.95 125.29 2jxp s ARG 61 Ca 0.27 -1.19 0.04 0.00 -0.47 0.00 0.00 55.73 54.37 2jxp s ARG 61 Cb -0.16 -2.77 -0.00 0.00 -0.57 0.00 0.00 34.95 31.45 2jxp s ARG 61 CO 0.11 -0.51 -0.21 -1.21 -1.08 0.00 0.00 175.30 172.40 2jxp s GLU 62 N 1.18 2.48 -0.38 3.89 2.02 -0.55 -5.05 118.70 122.29 2jxp s GLU 62 Ca -0.06 -0.76 -0.08 0.00 0.02 0.00 0.00 54.97 54.09 2jxp s GLU 62 Cb -0.19 -1.99 0.06 0.00 0.10 0.00 0.00 34.13 32.12 2jxp s GLU 62 CO -0.07 0.22 0.19 0.15 0.02 0.00 0.00 175.26 175.78 2jxp s LYS 63 N 0.21 2.59 0.18 1.61 1.02 -1.26 -2.21 119.74 121.87 2jxp s LYS 63 Ca -0.12 -1.35 0.03 0.00 0.02 0.00 0.00 55.97 54.56 2jxp s LYS 63 Cb -0.15 -3.65 -0.05 0.00 -0.52 0.00 0.00 37.83 33.46 2jxp s LYS 63 CO 0.06 -0.83 -0.04 -0.98 -0.92 0.00 0.00 175.35 172.63 2jxp s ARG 64 N 1.41 1.15 0.24 1.68 1.70 -0.89 -5.03 118.95 119.21 2jxp s ARG 64 Ca 0.02 -1.54 -0.27 0.00 -0.47 0.00 0.00 55.73 53.47 2jxp s ARG 64 Cb -0.21 -0.50 -0.09 0.00 -0.57 0.00 0.00 34.95 33.58 2jxp s ARG 64 CO 0.02 -0.04 0.87 0.42 -1.08 0.00 0.00 175.30 175.49 2jxp s ILE 65 N -3.46 4.24 -0.23 4.99 -1.09 -1.26 0.39 121.20 124.78 2jxp s ILE 65 Ca 0.22 1.83 -0.16 0.00 -2.23 0.00 0.00 60.65 60.31 2jxp s ILE 65 Cb 0.05 -4.14 -0.09 0.00 -1.58 0.00 0.00 42.46 36.69 2jxp s ILE 65 CO 0.04 0.39 -0.35 -0.11 -1.23 0.00 0.00 174.94 173.67 2jxp n LEU 66 N 1.20 1.93 -4.10 2.97 7.94 -0.03 -4.64 117.00 122.27 2jxp n LEU 66 Ca -0.02 0.33 -0.13 0.00 -1.11 0.00 0.00 56.01 55.08 2jxp n LEU 66 Cb 0.49 -0.77 -0.11 0.00 0.53 0.00 0.00 43.42 43.55 2jxp n LEU 66 CO 0.47 0.18 -0.41 -0.44 -1.11 0.00 0.00 177.39 176.08 2jxp s SER 67 N -6.75 1.05 0.21 1.96 0.01 -0.89 -4.98 113.70 104.31 2jxp s SER 67 Ca -0.34 -0.66 0.10 0.00 1.31 0.00 0.00 55.95 56.36 2jxp s SER 67 Cb 0.10 0.03 -0.04 0.00 0.21 0.00 0.00 66.02 66.32 2jxp s SER 67 CO 0.46 -0.24 -0.16 -0.76 0.41 0.00 0.00 173.24 172.94 2jxp s LEU 68 N -1.95 2.72 -0.13 2.44 1.43 -1.26 -2.16 118.68 119.77 2jxp s LEU 68 Ca -0.04 -0.76 -0.03 0.00 -1.03 0.00 0.00 54.13 52.27 2jxp s LEU 68 Cb -0.07 -1.39 -0.03 0.00 0.03 0.00 0.00 46.19 44.74 2jxp s LEU 68 CO -0.00 0.09 -0.02 -0.55 0.23 0.00 0.00 176.35 176.10 2jxp s SER 69 N -2.92 5.00 -1.85 2.29 0.15 0.57 -4.50 113.70 112.44 2jxp s SER 69 Ca 0.24 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.88 2jxp s SER 69 Cb -0.08 -1.65 0.00 0.00 -1.71 0.00 0.00 66.02 62.58 2jxp s SER 69 CO 0.13 0.25 0.00 -0.62 1.20 0.00 0.00 173.24 174.20 2jxp n GLU 70 N 3.01 -1.48 -2.96 5.44 1.02 -1.26 0.27 120.64 124.67 2jxp n GLU 70 Ca -0.18 1.03 -0.22 0.00 -0.02 0.00 0.00 57.16 57.78 2jxp n GLU 70 Cb 0.53 -5.42 0.02 0.00 -0.02 0.00 0.00 31.44 26.55 2jxp n GLU 70 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2jxp n SER 71 N -1.22 -5.74 0.00 1.62 2.88 -1.26 -4.67 113.62 105.23 2jxp n SER 71 Ca -0.19 -0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.11 2jxp n SER 71 Cb 0.61 -4.67 0.00 0.00 -0.75 0.00 0.00 64.21 59.39 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 -1.39 -0.64 3.75 0.46 0.00 -0.45 -5.12 105.19 101.79 2jxp n GLY 72 Ca -0.12 0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 2jxp n GLY 72 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jxp s ARG 73 N -1.97 1.52 0.26 1.61 3.00 0.14 -4.80 118.95 118.70 2jxp s ARG 73 Ca 0.00 0.77 -0.25 0.00 0.00 0.00 0.00 55.73 56.25 2jxp s ARG 73 Cb 0.00 -1.84 -0.09 0.00 0.00 0.00 0.00 34.95 33.02 2jxp s ARG 73 CO 0.00 -2.05 0.87 0.08 0.00 0.00 0.00 175.30 174.20 2jxp s VAL 74 N -3.00 4.30 0.00 3.52 1.01 -1.26 -0.31 120.40 124.65 2jxp s VAL 74 Ca 0.63 1.72 0.00 0.00 0.00 0.00 0.00 61.98 64.33 2jxp s VAL 74 Cb -0.17 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.17 2jxp s VAL 74 CO 0.56 0.28 0.00 -1.14 0.00 0.00 0.00 175.10 174.80 2jxp n ARG 75 N 0.91 0.00 -4.63 2.72 0.63 -0.92 -4.35 116.66 111.02 2jxp n ARG 75 Ca -0.01 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.59 2jxp n ARG 75 Cb 0.50 0.00 -0.15 0.00 0.45 0.00 0.00 32.46 33.25 2jxp n ARG 75 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 2jxp s GLU 76 N -0.64 3.24 -0.24 -0.14 8.01 -1.05 -1.37 118.70 126.50 2jxp s GLU 76 Ca 0.00 -0.75 -0.09 0.00 0.01 0.00 0.00 54.97 54.15 2jxp s GLU 76 Cb 0.00 -2.60 -0.04 0.00 -4.31 0.00 0.00 34.13 27.17 2jxp s GLU 76 CO 0.00 0.07 0.12 0.12 0.01 0.00 0.00 175.26 175.57 2jxp s PHE 77 N 0.69 3.20 -0.42 1.61 5.36 -0.25 -0.85 117.98 127.31 2jxp s PHE 77 Ca -0.07 -0.05 -0.21 0.00 -0.96 0.00 0.00 56.93 55.63 2jxp s PHE 77 Cb -0.16 -2.24 0.02 0.00 -0.34 0.00 0.00 43.02 40.30 2jxp s PHE 77 CO 0.02 -0.12 0.66 -2.00 -1.46 0.00 0.00 175.22 172.32 2jxp s GLU 78 N 1.27 3.39 -0.54 10.12 2.12 0.16 -0.34 118.70 134.89 2jxp s GLU 78 Ca 0.06 -0.24 -0.19 0.00 0.36 0.00 0.00 54.97 54.96 2jxp s GLU 78 Cb -0.14 -3.91 0.08 0.00 0.26 0.00 0.00 34.13 30.41 2jxp s GLU 78 CO 0.05 -0.95 0.64 -0.51 -0.54 0.00 0.00 175.26 173.95 2jxp s LEU 79 N 2.84 5.22 -0.11 2.70 1.43 -0.07 -2.09 118.68 128.61 2jxp s LEU 79 Ca 0.24 -1.19 -0.02 0.00 -1.03 0.00 0.00 54.13 52.13 2jxp s LEU 79 Cb -0.14 -2.36 -0.03 0.00 0.03 0.00 0.00 46.19 43.69 2jxp s LEU 79 CO 0.18 -0.97 -0.05 0.54 0.23 0.00 0.00 176.35 176.28 2jxp s VAL 80 N 2.56 3.84 -0.14 -1.59 0.11 -0.94 -0.57 120.40 123.68 2jxp s VAL 80 Ca 0.12 -0.40 -0.02 0.00 -2.93 0.00 0.00 61.98 58.76 2jxp s VAL 80 Cb -0.22 -2.63 0.04 0.00 -1.53 0.00 0.00 36.38 32.04 2jxp s VAL 80 CO 0.09 0.55 -0.00 -0.47 -3.33 0.00 0.00 175.10 171.93 2jxp s TYR 81 N -0.21 1.05 -0.34 1.54 5.04 0.15 -1.48 117.35 123.11 2jxp s TYR 81 Ca 0.03 -0.64 -0.07 0.00 -2.44 0.00 0.00 57.07 53.95 2jxp s TYR 81 Cb -0.13 -1.01 0.03 0.00 0.35 0.00 0.00 41.96 41.20 2jxp s TYR 81 CO 0.02 -0.50 0.12 1.03 -1.34 0.00 0.00 175.55 174.88 2jxp s ARG 82 N 1.85 2.75 -0.24 4.97 1.81 0.54 -1.34 118.95 129.30 2jxp s ARG 82 Ca 0.02 -1.10 -0.09 0.00 -1.72 0.00 0.00 55.73 52.84 2jxp s ARG 82 Cb -0.15 -3.50 -0.04 0.00 -0.45 0.00 0.00 34.95 30.81 2jxp s ARG 82 CO -0.07 -0.63 0.12 0.08 -0.68 0.00 0.00 175.30 174.12 2jxp s VAL 83 N 1.45 4.96 -0.17 3.52 1.01 0.05 -0.36 120.40 130.87 2jxp s VAL 83 Ca -0.00 0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.01 2jxp s VAL 83 Cb -0.19 -3.31 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 2jxp s VAL 83 CO 0.04 0.35 -0.11 0.00 0.00 0.00 0.00 175.10 175.37 2jxp s ALA 84 N 1.21 2.64 0.32 5.51 0.00 -0.20 -0.37 121.76 130.87 2jxp s ALA 84 Ca 0.06 -1.05 -0.07 0.00 0.00 0.00 0.00 51.96 50.91 2jxp s ALA 84 Cb -0.14 -1.39 0.01 0.00 0.00 0.00 0.00 23.12 21.59 2jxp s ALA 84 CO 0.05 -0.10 0.51 0.00 0.00 0.00 0.00 175.76 176.21 2jxp s ALA 85 N 0.93 0.35 0.06 0.00 0.00 -1.26 -0.64 121.76 121.20 2jxp s ALA 85 Ca -0.02 -1.27 -0.07 0.00 0.00 0.00 0.00 51.96 50.59 2jxp s ALA 85 Cb -0.15 1.08 -0.01 0.00 0.00 0.00 0.00 23.12 24.04 2jxp s ALA 85 CO -0.01 -0.83 0.15 1.03 0.00 0.00 0.00 175.76 176.10 2jxp s ARG 86 N -3.20 0.73 -0.30 0.00 0.52 0.44 -3.97 118.95 113.17 2jxp s ARG 86 Ca 0.27 -0.88 0.00 0.00 -0.52 0.00 0.00 55.73 54.61 2jxp s ARG 86 Cb -0.01 0.29 0.07 0.00 0.52 0.00 0.00 34.95 35.82 2jxp s ARG 86 CO 0.16 -0.21 -0.01 -1.17 0.02 0.00 0.00 175.30 174.09 2jxp s LEU 87 N -2.55 4.01 0.45 2.53 2.96 0.21 -1.35 118.68 124.93 2jxp s LEU 87 Ca 0.01 -1.51 0.07 0.00 -0.22 0.00 0.00 54.13 52.48 2jxp s LEU 87 Cb 0.03 -1.66 -0.01 0.00 0.50 0.00 0.00 46.19 45.05 2jxp s LEU 87 CO -0.08 -0.28 0.38 -0.76 -1.32 0.00 0.00 176.35 174.28 2jxp s LEU 88 N 1.14 3.21 0.54 -0.68 1.02 -0.07 -1.81 118.68 122.03 2jxp s LEU 88 Ca -0.03 -0.89 -0.06 0.00 0.02 0.00 0.00 54.13 53.17 2jxp s LEU 88 Cb -0.20 -1.79 -0.02 0.00 0.02 0.00 0.00 46.19 44.20 2jxp s LEU 88 CO -0.04 -0.76 0.86 -0.62 0.02 0.00 0.00 176.35 175.81 2jxp s ASP 89 N -4.16 5.99 0.62 2.29 2.15 0.74 -0.34 116.67 123.95 2jxp s ASP 89 Ca 0.45 0.89 0.27 0.00 0.43 0.00 0.00 52.55 54.59 2jxp s ASP 89 Cb -0.02 -2.05 1.33 0.00 -0.30 0.00 0.00 42.92 41.88 2jxp s ASP 89 CO 0.26 -0.80 1.75 0.00 -0.17 0.00 0.00 175.17 176.21 2jxp h ALA 90 N 0.01 2.08 -0.80 3.66 0.00 -1.28 0.33 119.26 123.25 2jxp h ALA 90 Ca -0.46 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.14 2jxp h ALA 90 Cb 1.22 0.03 -0.18 0.00 0.00 0.00 0.00 17.79 18.87 2jxp h ALA 90 CO 0.61 -0.79 0.37 0.72 0.00 0.00 0.00 179.25 180.16 2jxp n HIS 91 N -3.36 2.60 -1.56 0.00 8.25 -1.26 -4.71 115.22 115.19 2jxp n HIS 91 Ca 0.07 -1.35 -0.15 0.00 -0.26 0.00 0.00 57.72 56.03 2jxp n HIS 91 Cb 0.75 -0.75 -0.06 0.00 1.12 0.00 0.00 29.99 31.05 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 -0.39 -4.83 -4.56 0.41 5.03 0.12 -4.97 115.26 106.08 2jxp n ASN 92 Ca 0.45 0.33 -0.43 0.00 0.87 0.00 0.00 54.58 55.81 2jxp n ASN 92 Cb 1.45 -3.72 -0.05 0.00 -1.02 0.00 0.00 39.78 36.44 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 -2.60 3.27 -0.90 5.41 0.00 -1.24 -4.80 121.76 120.90 2jxp s ALA 93 Ca 0.00 -0.87 -0.24 0.00 0.00 0.00 0.00 51.96 50.85 2jxp s ALA 93 Cb 0.00 -3.56 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 2jxp s ALA 93 CO 0.00 -1.97 1.84 -1.83 0.00 0.00 0.00 175.76 173.80 2jxp s GLU 94 N 3.53 2.76 -0.13 0.00 -1.05 -1.26 -0.19 118.70 122.36 2jxp s GLU 94 Ca 0.34 -0.39 -0.23 0.00 -0.15 0.00 0.00 54.97 54.54 2jxp s GLU 94 Cb -0.11 -5.07 -0.20 0.00 -0.44 0.00 0.00 34.13 28.31 2jxp s GLU 94 CO 0.24 -3.10 0.61 -0.07 0.95 0.00 0.00 175.26 173.89 2jxp h LEU 95 N 16.76 -0.00 -8.28 1.83 -0.00 -1.87 -3.46 115.31 120.29 2jxp h LEU 95 Ca 0.09 -0.77 -0.66 0.00 -0.00 0.00 0.00 57.88 56.54 2jxp h LEU 95 Cb 1.02 0.00 -0.31 0.00 -0.00 0.00 0.00 40.66 41.37 2jxp h LEU 95 CO 1.25 0.87 -0.79 0.00 -0.00 0.00 0.00 178.44 179.78 2jxp s ALA 96 N -2.34 2.58 -0.72 1.53 0.00 -0.75 -5.05 121.76 117.00 2jxp s ALA 96 Ca -0.15 -1.16 -0.26 0.00 0.00 0.00 0.00 51.96 50.39 2jxp s ALA 96 Cb -0.02 -1.42 -0.00 0.00 0.00 0.00 0.00 23.12 21.67 2jxp s ALA 96 CO 0.54 -0.32 1.66 0.45 0.00 0.00 0.00 175.76 178.09 2jxp s SER 97 N 1.27 5.63 -0.61 0.00 0.15 -1.26 -0.62 113.70 118.25 2jxp s SER 97 Ca 0.03 -0.18 -0.26 0.00 0.70 0.00 0.00 55.95 56.25 2jxp s SER 97 Cb -0.14 -2.55 -0.06 0.00 -1.71 0.00 0.00 66.02 61.56 2jxp s SER 97 CO -0.06 -2.19 2.20 -0.22 1.20 0.00 0.00 173.24 174.17 2jxp s LEU 98 N 7.85 3.27 0.42 3.45 2.96 -1.26 -4.88 118.68 130.50 2jxp s LEU 98 Ca 0.56 0.55 -0.24 0.00 -0.22 0.00 0.00 54.13 54.78 2jxp s LEU 98 Cb -0.09 -2.52 -0.11 0.00 0.50 0.00 0.00 46.19 43.97 2jxp s LEU 98 CO 0.14 -2.86 0.96 0.00 -1.32 0.00 0.00 176.35 173.27 2jxp n GLN 99 N 9.03 1.25 -1.75 1.98 10.64 -1.26 -4.00 117.38 133.27 2jxp n GLN 99 Ca 0.33 0.45 -0.42 0.00 -1.83 0.00 0.00 57.00 55.54 2jxp n GLN 99 Cb 0.52 -1.97 -0.01 0.00 -0.86 0.00 0.00 30.24 27.92 2jxp n GLN 99 CO 0.00 0.00 0.00 -0.85 -1.83 0.00 0.00 177.06 174.38 2jxp n GLU 100 N 0.20 2.64 -3.50 2.61 0.28 -1.26 -4.76 120.64 116.85 2jxp n GLU 100 Ca 0.10 0.93 -0.42 0.00 -0.16 0.00 0.00 57.16 57.61 2jxp n GLU 100 Cb 0.39 -2.68 -0.10 0.00 1.43 0.00 0.00 31.44 30.48 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 -0.50 5.23 -0.43 3.84 1.01 0.50 -4.93 121.20 125.92 2jxp s ILE 101 Ca 0.59 -0.50 -0.11 0.00 0.00 0.00 0.00 60.65 60.64 2jxp s ILE 101 Cb -0.50 -3.82 0.07 0.00 0.01 0.00 0.00 42.46 38.22 2jxp s ILE 101 CO 0.55 -0.19 0.28 0.00 0.00 0.00 0.00 174.94 175.59 2jxp s ARG 102 N 1.69 2.71 -0.09 2.79 1.70 -1.26 -0.77 118.95 125.71 2jxp s ARG 102 Ca 0.05 -1.40 -0.02 0.00 -0.47 0.00 0.00 55.73 53.90 2jxp s ARG 102 Cb -0.18 -3.85 -0.03 0.00 -0.57 0.00 0.00 34.95 30.31 2jxp s ARG 102 CO 0.10 -0.94 -0.01 -0.51 -1.08 0.00 0.00 175.30 172.85 2jxp s LEU 103 N 1.48 3.47 -0.06 -1.89 1.43 -0.45 -4.98 118.68 117.69 2jxp s LEU 103 Ca 0.03 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.21 2jxp s LEU 103 Cb -0.23 -1.79 0.02 0.00 0.03 0.00 0.00 46.19 44.22 2jxp s LEU 103 CO 0.03 0.34 -0.04 0.42 0.23 0.00 0.00 176.35 177.34 2jxp s THR 104 N -0.66 0.55 -0.11 5.49 -4.23 -1.26 -0.67 115.64 114.75 2jxp s THR 104 Ca 0.10 -0.08 0.02 0.00 -1.18 0.00 0.00 61.69 60.55 2jxp s THR 104 Cb -0.12 -0.61 0.01 0.00 1.34 0.00 0.00 72.50 73.13 2jxp s THR 104 CO 0.02 0.25 -0.15 -0.60 -0.54 0.00 0.00 174.62 173.60 2jxp s ARG 105 N 1.28 2.21 -0.38 3.99 6.06 0.27 -4.95 118.95 127.42 2jxp s ARG 105 Ca -0.05 -0.56 -0.24 0.00 -2.50 0.00 0.00 55.73 52.38 2jxp s ARG 105 Cb -0.14 -1.89 0.01 0.00 0.06 0.00 0.00 34.95 33.00 2jxp s ARG 105 CO -0.02 -0.07 0.85 0.42 -2.50 0.00 0.00 175.30 173.98 2jxp s ILE 106 N 1.01 4.65 -0.39 4.11 1.09 -1.26 -0.89 121.20 129.52 2jxp s ILE 106 Ca -0.06 0.94 -0.24 0.00 -1.10 0.00 0.00 60.65 60.18 2jxp s ILE 106 Cb -0.15 -4.28 0.02 0.00 -1.06 0.00 0.00 42.46 36.98 2jxp s ILE 106 CO -0.02 -0.53 0.86 -0.22 -0.10 0.00 0.00 174.94 174.92 2jxp s LEU 107 N 3.31 4.07 -0.20 2.97 1.98 0.54 -4.91 118.68 126.45 2jxp s LEU 107 Ca 0.34 0.33 -0.29 0.00 -2.89 0.00 0.00 54.13 51.62 2jxp s LEU 107 Cb -0.12 -3.13 0.00 0.00 0.66 0.00 0.00 46.19 43.60 2jxp s LEU 107 CO 0.19 -0.85 1.09 -2.16 -1.89 0.00 0.00 176.35 172.73 2jxp s PRO 108 N 3.37 4.27 -0.50 0.98 0.04 -1.26 -1.09 135.00 140.80 2jxp s PRO 108 Ca 0.34 1.44 -0.23 0.00 0.04 0.00 0.00 61.00 62.59 2jxp s PRO 108 Cb -0.12 -3.66 0.04 0.00 0.04 0.00 0.00 34.50 30.80 2jxp s PRO 108 CO 0.20 -0.62 0.84 0.12 0.04 0.00 0.00 177.00 177.59 2jxp s PHE 109 N 3.15 2.91 -0.35 0.56 5.36 -0.47 -4.96 117.98 124.17 2jxp s PHE 109 Ca 0.47 0.02 -0.10 0.00 -0.96 0.00 0.00 56.93 56.36 2jxp s PHE 109 Cb -0.17 -3.85 0.01 0.00 -0.34 0.00 0.00 43.02 38.67 2jxp s PHE 109 CO 0.09 -1.16 0.19 -0.51 -1.46 0.00 0.00 175.22 172.37 2jxp s LEU 110 N 3.53 4.49 0.58 6.12 1.43 -1.26 -4.82 118.68 128.76 2jxp s LEU 110 Ca 0.29 -0.81 0.28 0.00 -1.03 0.00 0.00 54.13 52.86 2jxp s LEU 110 Cb -0.13 -2.02 1.65 0.00 0.03 0.00 0.00 46.19 45.73 2jxp s LEU 110 CO 0.20 -0.31 2.12 0.44 0.23 0.00 0.00 176.35 179.03 2jxp h ASP 111 N 8.41 0.00 -0.04 2.29 5.19 -1.95 -0.65 116.42 129.67 2jxp h ASP 111 Ca -0.28 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.13 2jxp h ASP 111 Cb 1.12 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.63 2jxp h ASP 111 CO 0.65 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.77 2jxp n ALA 112 N -2.35 2.61 -2.47 3.45 0.00 -1.26 -4.88 120.51 115.61 2jxp n ALA 112 Ca 0.01 -0.31 -0.26 0.00 0.00 0.00 0.00 53.44 52.88 2jxp n ALA 112 Cb 0.30 -1.28 -0.13 0.00 0.00 0.00 0.00 19.45 18.33 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 -1.96 1.27 0.08 0.00 -1.52 -0.25 -5.06 119.66 112.22 2jxp s GLN 113 Ca 0.37 -1.24 0.00 0.00 -1.95 0.00 0.00 55.36 52.55 2jxp s GLN 113 Cb 0.19 -1.63 0.00 0.00 -0.22 0.00 0.00 33.01 31.35 2jxp s GLN 113 CO 0.30 0.38 0.00 -0.85 -0.25 0.00 0.00 175.29 174.88 2jxp n GLU 114 N 1.04 0.00 0.13 2.91 0.28 -1.26 -4.84 120.64 118.90 2jxp n GLU 114 Ca -0.19 0.00 0.06 0.00 -0.16 0.00 0.00 57.16 56.87 2jxp n GLU 114 Cb 0.53 -0.36 0.04 0.00 1.43 0.00 0.00 31.44 33.08 2jxp n GLU 114 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2jxp h LEU 115 N 0.00 0.00 -0.96 -1.84 -0.00 -1.99 -3.30 115.31 107.22 2jxp h LEU 115 Ca 0.00 0.00 0.17 0.00 -0.00 0.00 0.00 57.88 58.05 2jxp h LEU 115 Cb 0.34 0.00 -0.10 0.00 -0.00 0.00 0.00 40.66 40.90 2jxp h LEU 115 CO 0.00 0.30 0.56 0.00 -0.00 0.00 0.00 178.44 179.31 2jxp h ALA 116 N 1.70 1.55 -0.69 1.53 0.00 -1.99 0.40 119.26 121.75 2jxp h ALA 116 Ca -0.03 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.04 2jxp h ALA 116 Cb 1.26 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.92 2jxp h ALA 116 CO 0.03 -0.05 0.35 0.87 0.00 0.00 0.00 179.25 180.45 2jxp h LYS 117 N 0.74 0.58 0.15 0.00 1.79 -1.89 0.45 116.57 118.39 2jxp h LYS 117 Ca 0.54 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.97 2jxp h LYS 117 Cb 0.81 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.33 2jxp h LYS 117 CO -0.37 0.38 -0.07 0.00 -1.08 0.00 0.00 179.45 178.31 2jxp h ALA 118 N 1.41 -0.20 0.40 3.86 0.00 -1.12 -2.05 119.26 121.56 2jxp h ALA 118 Ca 0.34 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2jxp h ALA 118 Cb 0.33 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2jxp h ALA 118 CO -0.25 -0.49 -0.19 0.00 0.00 0.00 0.00 179.25 178.31 2jxp h ALA 119 N 0.37 -0.54 0.19 0.00 0.00 -1.20 -1.56 119.26 116.53 2jxp h ALA 119 Ca -0.02 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.74 2jxp h ALA 119 Cb 0.35 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 2jxp h ALA 119 CO 0.03 -0.72 -0.27 1.49 0.00 0.00 0.00 179.25 179.78 2jxp h GLU 120 N -0.69 -0.50 -0.07 0.00 4.57 -0.99 -1.71 114.58 115.18 2jxp h GLU 120 Ca -0.05 0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.09 2jxp h GLU 120 Cb 0.49 0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 2jxp h GLU 120 CO 0.09 -0.34 -0.26 1.49 -1.18 0.00 0.00 179.01 178.81 2jxp h GLU 121 N -0.52 0.11 0.19 1.92 4.81 -1.44 -1.24 114.58 118.42 2jxp h GLU 121 Ca 0.01 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 2jxp h GLU 121 Cb 0.51 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.88 2jxp h GLU 121 CO -0.11 0.37 -0.10 1.49 -0.73 0.00 0.00 179.01 179.94 2jxp h GLU 122 N 0.10 -0.26 -0.62 1.92 4.22 -0.94 -2.66 114.58 116.34 2jxp h GLU 122 Ca 0.02 0.02 0.01 0.00 0.08 0.00 0.00 59.36 59.49 2jxp h GLU 122 Cb 0.53 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 2jxp h GLU 122 CO 0.04 -0.17 0.40 0.52 -2.18 0.00 0.00 179.01 177.62 2jxp h MET 123 N -0.27 0.79 -0.41 1.92 2.86 -0.77 -2.47 114.93 116.58 2jxp h MET 123 Ca -0.03 -0.05 0.07 0.00 -2.06 0.00 0.00 59.70 57.63 2jxp h MET 123 Cb 0.21 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 2jxp h MET 123 CO 0.04 0.52 0.28 -0.07 1.06 0.00 0.00 176.91 178.74 2jxp h LEU 124 N 0.81 0.24 0.68 1.22 3.38 -1.13 0.05 115.31 120.56 2jxp h LEU 124 Ca 0.24 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.18 2jxp h LEU 124 Cb -0.05 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 2jxp h LEU 124 CO -0.07 0.15 -0.42 1.88 0.09 0.00 0.00 178.44 180.07 2jxp h TYR 125 N 0.27 -1.13 -0.64 1.13 0.05 -1.08 -0.33 116.97 115.24 2jxp h TYR 125 Ca 0.18 -0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.91 2jxp h TYR 125 Cb 0.38 0.40 -0.03 0.00 1.01 0.00 0.00 36.73 38.50 2jxp h TYR 125 CO -0.00 -0.63 0.24 1.57 -1.05 0.00 0.00 178.16 178.29 2jxp h LYS 126 N -1.04 0.94 0.32 4.88 2.10 -1.51 -1.64 116.57 120.61 2jxp h LYS 126 Ca -0.09 -0.16 -0.02 0.00 -2.00 0.00 0.00 60.65 58.38 2jxp h LYS 126 Cb 0.83 -0.16 0.00 0.00 -0.90 0.00 0.00 32.23 32.01 2jxp h LYS 126 CO 0.09 0.77 -0.15 -0.44 -2.00 0.00 0.00 179.45 177.72 2jxp h ASP 127 N 0.92 -0.36 -0.53 7.07 3.32 -0.94 0.12 116.42 126.01 2jxp h ASP 127 Ca 0.21 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 2jxp h ASP 127 Cb 0.20 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 2jxp h ASP 127 CO -0.02 -0.10 0.21 0.24 -1.72 0.00 0.00 179.24 177.85 2jxp h MET 128 N -0.63 0.80 -0.83 3.56 2.86 -1.03 0.20 114.93 119.87 2jxp h MET 128 Ca -0.04 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 2jxp h MET 128 Cb 0.45 -0.13 -0.04 0.00 0.06 0.00 0.00 31.60 31.94 2jxp h MET 128 CO 0.07 0.71 0.52 0.37 1.06 0.00 0.00 176.91 179.64 2jxp h GLN 129 N 0.72 1.11 -0.04 1.72 5.75 -1.31 -2.30 115.11 120.77 2jxp h GLN 129 Ca 0.18 -0.09 -0.04 0.00 -0.15 0.00 0.00 58.65 58.55 2jxp h GLN 129 Cb 0.21 -0.24 0.00 0.00 1.07 0.00 0.00 27.48 28.52 2jxp h GLN 129 CO -0.01 0.77 -0.14 -0.22 -2.65 0.00 0.00 178.83 176.57 2jxp h LYS 130 N 1.13 0.16 -0.99 1.69 3.64 -0.66 -3.09 116.57 118.45 2jxp h LYS 130 Ca 0.30 -0.12 0.21 0.00 -1.27 0.00 0.00 60.65 59.77 2jxp h LYS 130 Cb -0.08 0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 31.67 2jxp h LYS 130 CO -0.06 0.76 0.62 -0.44 -2.27 0.00 0.00 179.45 178.06 2jxp h ASP 131 N -0.41 0.64 0.61 4.20 3.32 -0.56 0.57 116.42 124.80 2jxp h ASP 131 Ca -0.01 0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 2jxp h ASP 131 Cb 0.78 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.31 2jxp h ASP 131 CO 0.03 0.21 -0.32 0.00 -1.72 0.00 0.00 179.24 177.44 2jxp h ALA 132 N 1.64 -0.85 -0.35 3.45 0.00 -1.39 -0.63 119.26 121.13 2jxp h ALA 132 Ca 0.57 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 55.24 2jxp h ALA 132 Cb 1.09 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 19.22 2jxp h ALA 132 CO -0.33 -0.98 -0.02 -0.24 0.00 0.00 0.00 179.25 177.67 2jxp h VAL 133 N -0.85 1.21 -0.88 0.00 3.04 -1.29 -0.87 116.25 116.61 2jxp h VAL 133 Ca -0.08 -0.85 -0.02 0.00 -1.01 0.00 0.00 66.70 64.74 2jxp h VAL 133 Cb 0.66 0.97 -0.04 0.00 -2.01 0.00 0.00 31.29 30.88 2jxp h VAL 133 CO 0.12 0.29 0.47 1.56 -1.01 0.00 0.00 177.57 179.00 2jxp h GLN 134 N 0.52 1.23 -0.46 4.17 1.08 -0.82 -0.22 115.11 120.62 2jxp h GLN 134 Ca 0.11 -0.15 -0.04 0.00 -1.45 0.00 0.00 58.65 57.12 2jxp h GLN 134 Cb 0.37 -0.24 -0.02 0.00 -0.05 0.00 0.00 27.48 27.55 2jxp h GLN 134 CO 0.01 0.91 0.13 1.96 -0.95 0.00 0.00 178.83 180.89 2jxp h GLN 135 N 1.23 0.72 0.18 1.46 1.08 -0.40 -1.25 115.11 118.13 2jxp h GLN 135 Ca 0.31 -0.16 0.01 0.00 -1.45 0.00 0.00 58.65 57.36 2jxp h GLN 135 Cb 0.04 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 27.34 2jxp h GLN 135 CO -0.05 0.70 -0.31 0.82 -0.95 0.00 0.00 178.83 179.04 2jxp h ILE 136 N 0.60 0.34 -0.33 2.54 2.04 -0.72 -1.30 117.51 120.68 2jxp h ILE 136 Ca 0.15 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.07 2jxp h ILE 136 Cb 0.29 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 2jxp h ILE 136 CO -0.00 0.00 -0.00 0.25 0.00 0.00 0.00 178.15 178.40 2jxp h LEU 137 N -0.57 -0.14 0.16 1.44 5.85 -1.00 0.06 115.31 121.11 2jxp h LEU 137 Ca 0.02 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.83 2jxp h LEU 137 Cb 0.57 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.71 2jxp h LEU 137 CO -0.14 -0.03 -0.31 -0.09 -0.34 0.00 0.00 178.44 177.53 2jxp h ARG 138 N 0.09 -0.53 -0.54 1.25 2.43 -1.05 -0.51 114.38 115.53 2jxp h ARG 138 Ca 0.16 0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.35 2jxp h ARG 138 Cb 0.22 0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 2jxp h ARG 138 CO -0.27 -0.35 0.26 1.96 -1.51 0.00 0.00 179.97 180.05 2jxp h GLN 139 N -0.55 0.77 0.16 0.20 4.20 -1.00 -1.46 115.11 117.43 2jxp h GLN 139 Ca 0.02 -0.11 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 2jxp h GLN 139 Cb 0.56 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.20 2jxp h GLN 139 CO -0.16 0.64 -0.10 0.28 -0.67 0.00 0.00 178.83 178.83 2jxp h VAL 140 N 0.72 0.80 0.00 -0.54 2.07 -0.84 -2.26 116.25 116.20 2jxp h VAL 140 Ca 0.18 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.70 2jxp h VAL 140 Cb 0.12 0.80 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2jxp h VAL 140 CO -0.02 0.00 -0.04 0.77 0.02 0.00 0.00 177.57 178.30 2jxp h SER 141 N -0.24 0.00 1.61 0.57 4.64 -0.98 -2.13 113.55 117.02 2jxp h SER 141 Ca -0.01 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.25 2jxp h SER 141 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2jxp h SER 141 CO 0.01 0.04 -0.40 0.00 -0.87 0.00 0.00 176.83 175.61 2jxp h ALA 142 N 1.96 0.80 0.00 5.18 0.00 -0.79 -3.35 119.26 123.06 2jxp h ALA 142 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2jxp h ALA 142 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2jxp h ALA 142 CO 0.00 0.30 0.00 1.19 0.00 0.00 0.00 179.25 180.75 2jxp n PHE 143 N -3.09 0.00 0.87 0.00 3.72 -0.80 -2.72 117.46 115.44 2jxp n PHE 143 Ca 0.02 -0.02 0.11 0.00 -0.05 0.00 0.00 57.45 57.51 2jxp n PHE 143 Cb 0.63 -0.06 0.03 0.00 -0.94 0.00 0.00 39.48 39.14 2jxp n PHE 143 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 2jxp n THR 144 N 0.27 0.04 -3.30 4.37 5.66 -1.26 -5.02 114.28 115.04 2jxp n THR 144 Ca 0.00 -0.07 -0.00 0.00 -3.05 0.00 0.00 64.05 60.93 2jxp n THR 144 Cb 0.15 0.54 0.00 0.00 -1.55 0.00 0.00 70.33 69.47 2jxp n THR 144 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2jxp n SER 145 N -1.63 -0.14 -0.33 1.09 2.88 -1.10 -4.99 113.62 109.40 2jxp n SER 145 Ca 0.04 -1.08 -0.04 0.00 -1.33 0.00 0.00 58.87 56.45 2jxp n SER 145 Cb 0.36 0.23 -0.02 0.00 -0.75 0.00 0.00 64.21 64.03 2jxp n SER 145 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jxp n ALA 146 N -2.84 -0.06 -2.07 -1.46 0.00 -1.26 -4.91 120.51 107.91 2jxp n ALA 146 Ca -0.01 0.07 -0.37 0.00 0.00 0.00 0.00 53.44 53.13 2jxp n ALA 146 Cb 0.04 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.31 2jxp n ALA 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jxp n GLY 147 N -0.66 2.19 2.96 0.00 0.00 -1.26 -4.88 105.19 103.54 2jxp n GLY 147 Ca -0.04 -1.15 -0.31 0.00 0.00 0.00 0.00 46.02 44.52 2jxp n GLY 147 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2jxp s LEU 148 N 6.17 3.03 -0.07 0.99 0.20 -1.26 -5.01 118.68 122.73 2jxp s LEU 148 Ca 0.59 -1.39 -0.04 0.00 0.69 0.00 0.00 54.13 53.98 2jxp s LEU 148 Cb 0.05 -1.30 -0.02 0.00 -0.43 0.00 0.00 46.19 44.49 2jxp s LEU 148 CO 0.09 -0.26 0.20 -0.33 -0.29 0.00 0.00 176.35 175.76 2jxp h GLU 149 N 7.88 -0.16 -4.67 1.98 3.07 -1.98 -3.48 114.58 117.22 2jxp h GLU 149 Ca -0.16 0.01 -0.23 0.00 -0.50 0.00 0.00 59.36 58.48 2jxp h GLU 149 Cb 1.05 0.04 -0.15 0.00 -0.84 0.00 0.00 28.75 28.85 2jxp h GLU 149 CO 0.44 -0.10 -0.69 -1.58 -1.40 0.00 0.00 179.01 175.68 2jxp s HIS 150 N -2.04 0.95 -0.44 4.33 2.46 -1.26 -5.04 115.29 114.25 2jxp s HIS 150 Ca -0.02 -0.95 0.00 0.00 0.47 0.00 0.00 55.06 54.56 2jxp s HIS 150 Cb 0.00 -0.55 0.00 0.00 -0.13 0.00 0.00 32.58 31.90 2jxp s HIS 150 CO 0.07 -0.18 0.43 -2.39 -2.47 0.00 0.00 174.74 170.21 2jxp n HIS 151 N -0.08 0.00 -2.53 3.88 1.44 -1.26 -4.52 115.22 112.14 2jxp n HIS 151 Ca -0.11 -0.16 -0.43 0.00 -2.01 0.00 0.00 57.72 55.02 2jxp n HIS 151 Cb 0.61 -0.13 -0.00 0.00 0.12 0.00 0.00 29.99 30.59 2jxp n HIS 151 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2jxp n HIS 152 N 0.50 4.58 -1.68 -1.40 8.25 -1.26 -4.98 115.22 119.23 2jxp n HIS 152 Ca 0.00 -2.81 -0.46 0.00 -0.26 0.00 0.00 57.72 54.19 2jxp n HIS 152 Cb 0.22 -2.64 -0.04 0.00 1.12 0.00 0.00 29.99 28.65 2jxp n HIS 152 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2jxp n HIS 153 N 8.46 2.38 -3.80 4.41 1.44 -1.26 -4.94 115.22 121.90 2jxp n HIS 153 Ca 0.49 0.03 -0.07 0.00 -2.01 0.00 0.00 57.72 56.17 2jxp n HIS 153 Cb 0.46 -2.65 -0.01 0.00 0.12 0.00 0.00 29.99 27.91 2jxp n HIS 153 CO 0.00 0.00 0.00 -2.39 -2.81 0.00 0.00 176.34 171.14 2jxp n HIS 154 N 5.48 -0.86 1.96 -1.40 1.44 -1.26 -5.26 115.22 115.32 2jxp n HIS 154 Ca 0.20 -1.05 0.16 0.00 -2.01 0.00 0.00 57.72 55.02 2jxp n HIS 154 Cb 0.31 0.24 0.92 0.00 0.12 0.00 0.00 29.99 31.58 2jxp n HIS 154 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11