#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 0.95 2.88 -5.12 0.00 -1.26 -5.06 105.19 97.58 2jxp n GLY 2 Ca 0.00 -0.02 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 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 0.72 -1.01 1.61 0.08 -1.26 -5.10 117.98 113.02 2jxp s PHE 3 Ca 0.00 -0.19 -0.14 0.00 0.12 0.00 0.00 56.93 56.72 2jxp s PHE 3 Cb 0.00 -0.66 0.20 0.00 -0.57 0.00 0.00 43.02 41.99 2jxp s PHE 3 CO 0.00 -0.20 1.10 0.21 -0.10 0.00 0.00 175.22 176.23 2jxp s LYS 4 N 1.01 3.86 0.00 0.44 2.36 -1.26 -4.76 119.74 121.39 2jxp s LYS 4 Ca -0.10 -2.49 0.13 0.00 -2.55 0.00 0.00 55.97 50.96 2jxp s LYS 4 Cb -0.14 -4.74 0.23 0.00 -1.05 0.00 0.00 37.83 32.13 2jxp s LYS 4 CO -0.00 -1.52 1.11 1.28 1.55 0.00 0.00 175.35 177.76 2jxp n LEU 5 N 4.74 2.59 -3.66 5.43 7.99 -1.26 -5.01 117.00 127.82 2jxp n LEU 5 Ca 0.24 -1.47 -0.14 0.00 -0.01 0.00 0.00 56.01 54.63 2jxp n LEU 5 Cb 0.45 -0.13 -0.07 0.00 -0.11 0.00 0.00 43.42 43.55 2jxp n LEU 5 CO 0.48 0.57 0.18 0.00 -1.51 0.00 0.00 177.39 177.11 2jxp s ARG 6 N -1.06 0.87 -0.44 3.23 1.70 -1.26 -5.11 118.95 116.88 2jxp s ARG 6 Ca 0.21 -0.17 0.07 0.00 -0.47 0.00 0.00 55.73 55.38 2jxp s ARG 6 Cb 0.13 0.39 0.30 0.00 -0.57 0.00 0.00 34.95 35.20 2jxp s ARG 6 CO 0.18 -0.28 0.91 0.41 -1.08 0.00 0.00 175.30 175.44 2jxp n GLY 7 N 0.84 1.34 3.04 3.88 0.00 -1.26 -5.14 105.19 107.89 2jxp n GLY 7 Ca -0.20 -0.49 -0.11 0.00 0.00 0.00 0.00 46.02 45.23 2jxp n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2jxp s GLN 8 N -0.35 0.36 0.06 1.61 0.00 -1.26 -4.89 119.66 115.18 2jxp s GLN 8 Ca 0.30 -0.39 0.03 0.00 -0.00 0.00 0.00 55.36 55.30 2jxp s GLN 8 Cb 0.27 0.14 -0.24 0.00 0.00 0.00 0.00 33.01 33.18 2jxp s GLN 8 CO -0.11 -0.07 1.06 -0.24 0.00 0.00 0.00 175.29 175.92 2jxp h VAL 9 N 4.53 1.41 -3.30 3.63 3.04 -1.90 -3.44 116.25 120.22 2jxp h VAL 9 Ca -0.30 -3.10 -0.66 0.00 -1.01 0.00 0.00 66.70 61.63 2jxp h VAL 9 Cb 1.20 2.78 -0.36 0.00 -2.01 0.00 0.00 31.29 32.91 2jxp h VAL 9 CO 0.41 0.85 -0.84 -0.94 -1.01 0.00 0.00 177.57 176.05 2jxp s SER 10 N -6.77 3.47 0.17 3.17 1.04 -0.92 -5.10 113.70 108.76 2jxp s SER 10 Ca -0.03 -0.85 0.05 0.00 0.48 0.00 0.00 55.95 55.60 2jxp s SER 10 Cb 0.08 -1.46 -0.04 0.00 0.10 0.00 0.00 66.02 64.70 2jxp s SER 10 CO 0.84 -0.06 0.16 -1.83 0.98 0.00 0.00 173.24 173.32 2jxp s GLU 11 N 1.26 2.95 -0.12 4.02 -1.05 -1.26 -3.97 118.70 120.54 2jxp s GLU 11 Ca 0.01 -0.86 -0.18 0.00 -0.15 0.00 0.00 54.97 53.78 2jxp s GLU 11 Cb -0.15 -2.67 0.04 0.00 -0.44 0.00 0.00 34.13 30.92 2jxp s GLU 11 CO -0.10 0.48 0.46 -0.48 0.95 0.00 0.00 175.26 176.56 2jxp s LEU 12 N -3.19 0.25 0.00 1.83 0.05 -1.26 -4.70 118.68 111.65 2jxp s LEU 12 Ca 0.31 0.69 0.00 0.00 0.05 0.00 0.00 54.13 55.18 2jxp s LEU 12 Cb -0.10 1.66 0.00 0.00 -2.05 0.00 0.00 46.19 45.70 2jxp s LEU 12 CO 0.24 -0.30 1.22 -0.81 -0.55 0.00 0.00 176.35 176.14 2jxp n PRO 13 N 2.13 0.90 -3.66 1.48 -0.04 -1.26 -4.79 135.00 129.75 2jxp n PRO 13 Ca -0.16 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.20 2jxp n PRO 13 Cb 0.57 -1.05 -0.03 0.00 -0.04 0.00 0.00 33.50 32.95 2jxp n PRO 13 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2jxp s PHE 14 N 0.14 -0.28 0.00 0.54 -0.12 -1.26 -5.08 117.98 111.92 2jxp s PHE 14 Ca 0.00 -0.05 0.00 0.00 -0.05 0.00 0.00 56.93 56.83 2jxp s PHE 14 Cb 0.00 0.53 0.00 0.00 -0.63 0.00 0.00 43.02 42.92 2jxp s PHE 14 CO 0.00 -0.98 0.00 -0.85 -0.05 0.00 0.00 175.22 173.34 2jxp n GLU 15 N -0.38 3.45 -3.99 1.99 0.28 -1.26 -4.28 120.64 116.44 2jxp n GLU 15 Ca -0.11 0.00 -0.34 0.00 -0.16 0.00 0.00 57.16 56.55 2jxp n GLU 15 Cb 0.62 -0.56 -0.15 0.00 1.43 0.00 0.00 31.44 32.78 2jxp n GLU 15 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2jxp s ARG 16 N -0.98 2.76 -0.05 3.44 1.81 -1.26 -0.16 118.95 124.51 2jxp s ARG 16 Ca 0.00 -1.02 0.03 0.00 -1.72 0.00 0.00 55.73 53.02 2jxp s ARG 16 Cb 0.00 -2.92 0.00 0.00 -0.45 0.00 0.00 34.95 31.58 2jxp s ARG 16 CO 0.00 -0.41 -0.15 0.14 -0.68 0.00 0.00 175.30 174.20 2jxp s VAL 17 N 1.29 1.31 -0.23 3.52 -7.23 -1.03 -0.54 120.40 117.48 2jxp s VAL 17 Ca -0.01 -0.62 -0.09 0.00 -1.81 0.00 0.00 61.98 59.45 2jxp s VAL 17 Cb -0.17 -1.15 -0.04 0.00 0.56 0.00 0.00 36.38 35.58 2jxp s VAL 17 CO -0.06 0.39 0.12 -0.47 -0.31 0.00 0.00 175.10 174.77 2jxp s TYR 18 N 0.27 3.24 0.03 2.82 5.04 -0.07 -0.56 117.35 128.12 2jxp s TYR 18 Ca -0.08 0.05 0.04 0.00 -2.44 0.00 0.00 57.07 54.64 2jxp s TYR 18 Cb -0.13 -2.22 -0.04 0.00 0.35 0.00 0.00 41.96 39.92 2jxp s TYR 18 CO 0.03 -0.01 -0.06 -1.50 -1.34 0.00 0.00 175.55 172.67 2jxp s ILE 19 N 1.05 3.70 0.02 3.14 2.07 -1.26 0.04 121.20 129.95 2jxp s ILE 19 Ca 0.06 -0.85 0.00 0.00 -1.41 0.00 0.00 60.65 58.45 2jxp s ILE 19 Cb -0.14 -2.65 -0.02 0.00 0.13 0.00 0.00 42.46 39.79 2jxp s ILE 19 CO 0.04 0.32 -0.03 0.28 -1.91 0.00 0.00 174.94 173.64 2jxp s THR 20 N -1.07 0.15 -0.00 4.00 -1.32 -0.62 -4.96 115.64 111.83 2jxp s THR 20 Ca 0.19 -0.74 0.01 0.00 -1.21 0.00 0.00 61.69 59.93 2jxp s THR 20 Cb -0.11 -0.26 -0.00 0.00 -1.51 0.00 0.00 72.50 70.62 2jxp s THR 20 CO 0.10 -0.37 -0.02 0.00 -2.21 0.00 0.00 174.62 172.11 2jxp s ALA 21 N -1.14 0.22 0.01 11.08 0.00 -1.26 -2.38 121.76 128.29 2jxp s ALA 21 Ca -0.12 -0.09 -0.05 0.00 0.00 0.00 0.00 51.96 51.70 2jxp s ALA 21 Cb -0.08 -0.07 -0.02 0.00 0.00 0.00 0.00 23.12 22.95 2jxp s ALA 21 CO -0.01 0.05 1.07 -1.00 0.00 0.00 0.00 175.76 175.87 2jxp h PRO 22 N 6.15 -0.14 -0.64 0.00 0.13 -1.85 -3.21 132.00 132.44 2jxp h PRO 22 Ca -0.27 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2jxp h PRO 22 Cb 1.20 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2jxp h PRO 22 CO 0.50 -0.10 0.00 0.00 -0.23 0.00 0.00 178.00 178.18 2jxp n ALA 23 N -2.21 2.70 -3.04 -0.56 0.00 -1.26 -4.95 120.51 111.19 2jxp n ALA 23 Ca -0.02 -1.24 -0.13 0.00 0.00 0.00 0.00 53.44 52.05 2jxp n ALA 23 Cb 0.06 -0.99 0.07 0.00 0.00 0.00 0.00 19.45 18.59 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 1.29 -0.24 3.77 0.00 0.00 -1.21 -4.99 105.19 103.81 2jxp n GLY 24 Ca 0.22 0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 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 -5.22 3.60 0.42 0.99 1.02 -1.26 -4.92 118.68 113.32 2jxp s LEU 25 Ca 0.05 2.09 0.14 0.00 0.02 0.00 0.00 54.13 56.43 2jxp s LEU 25 Cb -0.01 -4.57 1.01 0.00 0.02 0.00 0.00 46.19 42.65 2jxp s LEU 25 CO 0.55 -1.37 1.94 0.71 0.02 0.00 0.00 176.35 178.20 2jxp h THR 26 N 0.73 0.84 -1.18 5.49 1.35 -2.01 -1.76 112.91 116.37 2jxp h THR 26 Ca -0.49 -0.15 0.35 0.00 -0.55 0.00 0.00 66.41 65.56 2jxp h THR 26 Cb 1.25 0.35 -0.10 0.00 -1.73 0.00 0.00 68.15 67.93 2jxp h THR 26 CO 0.56 0.08 0.78 -0.29 -0.25 0.00 0.00 175.52 176.40 2jxp h ILE 27 N 0.45 0.35 -0.17 6.82 6.09 -1.97 0.19 117.51 129.27 2jxp h ILE 27 Ca 0.34 -0.08 -0.16 0.00 -1.37 0.00 0.00 64.86 63.59 2jxp h ILE 27 Cb 0.71 0.11 0.00 0.00 0.47 0.00 0.00 36.82 38.11 2jxp h ILE 27 CO -0.11 0.04 -0.53 1.23 -3.07 0.00 0.00 178.15 175.71 2jxp h GLY 28 N 0.22 0.73 1.58 8.18 0.00 -1.69 -2.68 103.07 109.42 2jxp h GLY 28 Ca 0.68 -0.94 -0.19 0.00 0.00 0.00 0.00 47.33 46.88 2jxp h GLY 28 CO -0.30 0.84 -0.74 0.23 0.00 0.00 0.00 176.54 176.58 2jxp h SER 29 N 0.35 0.48 -0.96 0.19 0.87 -0.86 -2.35 113.55 111.27 2jxp h SER 29 Ca -0.02 -0.32 0.06 0.00 -1.23 0.00 0.00 61.79 60.28 2jxp h SER 29 Cb 1.15 -0.14 -0.06 0.00 -0.44 0.00 0.00 62.40 62.90 2jxp h SER 29 CO 0.11 1.06 0.62 0.44 -0.53 0.00 0.00 176.83 178.53 2jxp h ASP 30 N 0.28 1.00 -0.76 6.23 3.32 -0.99 -2.47 116.42 123.03 2jxp h ASP 30 Ca -0.03 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 2jxp h ASP 30 Cb 1.31 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.62 2jxp h ASP 30 CO 0.13 0.65 0.28 0.25 -1.72 0.00 0.00 179.24 178.83 2jxp h LEU 31 N 1.15 1.08 -0.47 1.55 5.85 -1.10 -1.41 115.31 121.94 2jxp h LEU 31 Ca 0.41 -0.18 0.09 0.00 0.84 0.00 0.00 57.88 59.04 2jxp h LEU 31 Cb 0.12 -0.28 -0.08 0.00 0.37 0.00 0.00 40.66 40.80 2jxp h LEU 31 CO -0.16 0.97 -0.01 -0.33 -0.34 0.00 0.00 178.44 178.57 2jxp h GLU 32 N 1.12 0.10 0.44 1.25 5.08 -0.97 -0.51 114.58 121.10 2jxp h GLU 32 Ca 0.25 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.59 2jxp h GLU 32 Cb 0.25 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.48 2jxp h GLU 32 CO -0.02 0.07 -0.21 0.00 -1.00 0.00 0.00 179.01 177.85 2jxp h ARG 33 N 0.10 -0.57 -0.51 2.33 3.08 -1.22 -2.35 114.38 115.24 2jxp h ARG 33 Ca 0.24 0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.39 2jxp h ARG 33 Cb 0.35 0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.48 2jxp h ARG 33 CO -0.40 -0.33 0.21 0.28 -1.07 0.00 0.00 179.97 178.66 2jxp h VAL 34 N -0.69 0.87 0.70 2.04 2.07 -1.01 -1.31 116.25 118.92 2jxp h VAL 34 Ca -0.06 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 2jxp h VAL 34 Cb 0.50 0.42 0.01 0.00 -1.52 0.00 0.00 31.29 30.70 2jxp h VAL 34 CO 0.10 0.08 -0.34 0.40 0.02 0.00 0.00 177.57 177.83 2jxp h ILE 35 N 0.41 0.25 -0.05 4.57 2.04 -1.12 -0.68 117.51 122.92 2jxp h ILE 35 Ca 0.24 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.97 2jxp h ILE 35 Cb 0.23 0.29 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 2jxp h ILE 35 CO -0.22 0.02 0.04 -1.28 0.00 0.00 0.00 178.15 176.70 2jxp h SER 36 N -1.05 0.02 0.39 1.72 0.87 -1.26 0.16 113.55 114.40 2jxp h SER 36 Ca -0.10 -0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.15 2jxp h SER 36 Cb 0.75 -0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.67 2jxp h SER 36 CO 0.16 0.01 -1.75 0.71 -0.53 0.00 0.00 176.83 175.43 2jxp h THR 37 N 0.02 0.84 -0.01 2.23 1.35 -1.22 -3.39 112.91 112.73 2jxp h THR 37 Ca 0.02 -2.63 0.00 0.00 -0.55 0.00 0.00 66.41 63.26 2jxp h THR 37 Cb 0.07 2.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.99 2jxp h THR 37 CO -0.00 0.66 -0.36 1.41 -0.25 0.00 0.00 175.52 176.98 2jxp n HIS 38 N -3.23 0.00 -4.28 4.73 8.25 -0.27 -4.92 115.22 115.51 2jxp n HIS 38 Ca -0.21 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.11 2jxp n HIS 38 Cb 1.05 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 32.11 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 -0.02 0.00 1.15 1.59 -2.24 0.53 -2.16 114.28 113.12 2jxp n THR 39 Ca 0.08 -1.46 0.12 0.00 -2.27 0.00 0.00 64.05 60.52 2jxp n THR 39 Cb 0.39 0.57 0.22 0.00 -2.10 0.00 0.00 70.33 69.41 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 -0.52 1.98 -2.11 -0.78 3.00 -1.26 -4.71 116.66 112.25 2jxp n ARG 40 Ca -0.02 -1.52 -0.28 0.00 -0.00 0.00 0.00 57.85 56.04 2jxp n ARG 40 Cb 0.37 -1.47 0.06 0.00 0.00 0.00 0.00 32.46 31.42 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 -2.07 3.03 -0.07 5.13 0.00 -1.26 -4.78 121.76 121.74 2jxp s ALA 41 Ca 0.30 -0.65 -0.04 0.00 0.00 0.00 0.00 51.96 51.56 2jxp s ALA 41 Cb 0.20 -2.79 0.03 0.00 0.00 0.00 0.00 23.12 20.56 2jxp s ALA 41 CO 0.35 -1.19 0.16 0.21 0.00 0.00 0.00 175.76 175.28 2jxp s LYS 42 N -5.27 0.15 -0.03 0.00 2.36 0.78 -4.05 119.74 113.67 2jxp s LYS 42 Ca 0.58 0.31 -0.30 0.00 -2.55 0.00 0.00 55.97 54.01 2jxp s LYS 42 Cb -0.11 -0.04 -0.04 0.00 -1.05 0.00 0.00 37.83 36.60 2jxp s LYS 42 CO 0.48 -0.09 1.23 0.08 1.55 0.00 0.00 175.35 178.60 2jxp s VAL 43 N 0.62 4.15 0.18 4.02 1.01 -1.26 -2.47 120.40 126.66 2jxp s VAL 43 Ca -0.04 1.49 0.06 0.00 0.00 0.00 0.00 61.98 63.48 2jxp s VAL 43 Cb -0.06 -3.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 2jxp s VAL 43 CO -0.03 0.01 0.10 0.68 0.00 0.00 0.00 175.10 175.86 2jxp s VAL 44 N 2.12 4.24 -1.55 2.92 -7.23 0.27 -4.94 120.40 116.22 2jxp s VAL 44 Ca 0.57 -1.24 0.27 0.00 -1.81 0.00 0.00 61.98 59.77 2jxp s VAL 44 Cb -0.26 -3.18 0.24 0.00 0.56 0.00 0.00 36.38 33.74 2jxp s VAL 44 CO 0.23 -0.15 1.59 -3.20 -0.31 0.00 0.00 175.10 173.27 2jxp n ASN 45 N -0.40 0.80 -4.12 4.85 5.15 -1.26 -4.12 115.26 116.15 2jxp n ASN 45 Ca -0.09 -0.66 -0.23 0.00 -0.60 0.00 0.00 54.58 53.01 2jxp n ASN 45 Cb 0.55 0.11 -0.15 0.00 -0.53 0.00 0.00 39.78 39.76 2jxp n ASN 45 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 2jxp s LYS 46 N -2.62 1.17 0.00 1.20 0.00 -1.26 -5.03 119.74 113.20 2jxp s LYS 46 Ca 0.22 -0.52 0.27 0.00 0.00 0.00 0.00 55.97 55.94 2jxp s LYS 46 Cb 0.19 -1.14 0.95 0.00 0.00 0.00 0.00 37.83 37.83 2jxp s LYS 46 CO 0.55 0.31 1.69 0.00 0.00 0.00 0.00 175.35 177.90 2jxp n ALA 47 N 2.71 2.96 -0.21 0.59 0.00 -1.26 -4.07 120.51 121.23 2jxp n ALA 47 Ca -0.14 -0.33 0.09 0.00 0.00 0.00 0.00 53.44 53.06 2jxp n ALA 47 Cb 0.55 -1.23 0.38 0.00 0.00 0.00 0.00 19.45 19.15 2jxp n ALA 47 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2jxp h GLU 48 N 0.77 0.67 -2.86 0.00 4.11 -1.96 -3.32 114.58 111.98 2jxp h GLU 48 Ca 0.00 -0.04 -0.59 0.00 0.07 0.00 0.00 59.36 58.80 2jxp h GLU 48 Cb 0.44 -0.15 -0.40 0.00 0.50 0.00 0.00 28.75 29.15 2jxp h GLU 48 CO 0.00 0.44 -0.78 0.21 0.07 0.00 0.00 179.01 178.95 2jxp s LYS 49 N -5.64 0.93 -0.29 1.06 2.20 -1.26 -5.08 119.74 111.66 2jxp s LYS 49 Ca -0.10 -1.63 -0.14 0.00 -0.36 0.00 0.00 55.97 53.74 2jxp s LYS 49 Cb 0.20 -1.87 0.13 0.00 -1.51 0.00 0.00 37.83 34.78 2jxp s LYS 49 CO 0.78 -1.16 0.81 -1.54 -0.36 0.00 0.00 175.35 173.87 2jxp s SER 50 N 0.77 -0.82 0.25 1.43 1.04 -1.25 -4.82 113.70 110.30 2jxp s SER 50 Ca 0.17 1.22 0.04 0.00 0.48 0.00 0.00 55.95 57.86 2jxp s SER 50 Cb -0.23 1.64 0.31 0.00 0.10 0.00 0.00 66.02 67.84 2jxp s SER 50 CO -0.02 -0.18 1.61 -0.33 0.98 0.00 0.00 173.24 175.30 2jxp h GLU 51 N 7.13 0.30 -4.65 4.02 3.07 -1.20 -3.35 114.58 119.90 2jxp h GLU 51 Ca -0.24 -0.17 -0.28 0.00 -0.50 0.00 0.00 59.36 58.17 2jxp h GLU 51 Cb 1.16 0.01 -0.20 0.00 -0.84 0.00 0.00 28.75 28.88 2jxp h GLU 51 CO 0.14 0.74 -0.73 0.00 -1.40 0.00 0.00 179.01 177.75 2jxp s ALA 52 N -3.98 0.69 -0.14 3.43 0.00 -1.19 -3.05 121.76 117.52 2jxp s ALA 52 Ca -0.05 -0.87 -0.00 0.00 0.00 0.00 0.00 51.96 51.05 2jxp s ALA 52 Cb 0.12 0.04 0.03 0.00 0.00 0.00 0.00 23.12 23.32 2jxp s ALA 52 CO 0.79 -0.03 -0.11 0.42 0.00 0.00 0.00 175.76 176.84 2jxp s ILE 53 N -1.66 1.31 -0.41 0.00 1.01 0.35 -0.89 121.20 120.91 2jxp s ILE 53 Ca -0.06 -0.50 -0.16 0.00 0.00 0.00 0.00 60.65 59.92 2jxp s ILE 53 Cb -0.08 -1.29 0.02 0.00 0.01 0.00 0.00 42.46 41.11 2jxp s ILE 53 CO -0.00 0.39 0.38 -0.63 0.00 0.00 0.00 174.94 175.08 2jxp s ILE 54 N 1.59 5.16 -0.42 2.92 1.01 0.11 -0.06 121.20 131.51 2jxp s ILE 54 Ca 0.04 -0.40 -0.09 0.00 0.00 0.00 0.00 60.65 60.20 2jxp s ILE 54 Cb -0.13 -3.97 0.08 0.00 0.01 0.00 0.00 42.46 38.44 2jxp s ILE 54 CO -0.09 -0.34 0.26 -1.58 0.00 0.00 0.00 174.94 173.18 2jxp s GLN 55 N 1.97 2.60 -0.27 2.79 -0.44 -0.70 -1.58 119.66 124.03 2jxp s GLN 55 Ca 0.10 -1.45 -0.27 0.00 -2.50 0.00 0.00 55.36 51.24 2jxp s GLN 55 Cb -0.18 -3.77 0.00 0.00 -1.64 0.00 0.00 33.01 27.43 2jxp s GLN 55 CO 0.12 -0.94 0.93 -1.50 0.50 0.00 0.00 175.29 174.40 2jxp s ILE 56 N 1.42 4.72 -0.06 -2.34 -1.16 -1.00 -0.49 121.20 122.29 2jxp s ILE 56 Ca 0.03 1.66 -0.13 0.00 -0.51 0.00 0.00 60.65 61.70 2jxp s ILE 56 Cb -0.23 -4.24 -0.09 0.00 0.61 0.00 0.00 42.46 38.52 2jxp s ILE 56 CO 0.02 -0.22 0.54 0.58 -2.81 0.00 0.00 174.94 173.05 2jxp h VAL 57 N 5.53 0.25 -1.47 4.00 2.07 -0.67 -3.37 116.25 122.59 2jxp h VAL 57 Ca -0.22 -0.87 0.10 0.00 0.82 0.00 0.00 66.70 66.54 2jxp h VAL 57 Cb 1.08 0.43 -0.28 0.00 -1.52 0.00 0.00 31.29 31.00 2jxp h VAL 57 CO 0.94 0.07 0.51 -2.28 0.02 0.00 0.00 177.57 176.83 2jxp s HIS 58 N -2.90 -0.42 -0.29 1.57 2.46 -0.89 -4.71 115.29 110.12 2jxp s HIS 58 Ca -0.08 0.95 -0.06 0.00 0.47 0.00 0.00 55.06 56.34 2jxp s HIS 58 Cb 0.00 0.36 0.01 0.00 -0.13 0.00 0.00 32.58 32.82 2jxp s HIS 58 CO 0.25 -0.20 0.06 0.00 -2.47 0.00 0.00 174.74 172.38 2jxp s ALA 59 N 0.59 3.03 -0.13 1.58 0.00 -1.26 -1.26 121.76 124.30 2jxp s ALA 59 Ca -0.01 -1.43 -0.01 0.00 0.00 0.00 0.00 51.96 50.52 2jxp s ALA 59 Cb -0.04 -2.09 -0.02 0.00 0.00 0.00 0.00 23.12 20.96 2jxp s ALA 59 CO -0.11 -0.88 -0.10 0.42 0.00 0.00 0.00 175.76 175.09 2jxp s ILE 60 N 1.49 3.29 -0.11 0.00 1.09 -0.19 -4.99 121.20 121.78 2jxp s ILE 60 Ca 0.03 -0.58 -0.05 0.00 -1.10 0.00 0.00 60.65 58.95 2jxp s ILE 60 Cb -0.17 -2.40 0.05 0.00 -1.06 0.00 0.00 42.46 38.88 2jxp s ILE 60 CO 0.02 0.52 0.25 0.00 -0.10 0.00 0.00 174.94 175.62 2jxp s ARG 61 N 0.29 0.19 -0.04 2.79 1.70 -1.26 0.02 118.95 122.63 2jxp s ARG 61 Ca -0.08 0.58 0.03 0.00 -0.47 0.00 0.00 55.73 55.79 2jxp s ARG 61 Cb -0.15 -0.11 0.00 0.00 -0.57 0.00 0.00 34.95 34.12 2jxp s ARG 61 CO 0.05 -0.19 -0.12 -1.21 -1.08 0.00 0.00 175.30 172.74 2jxp s GLU 62 N 1.54 1.36 -0.48 3.89 2.02 -0.57 -5.00 118.70 121.46 2jxp s GLU 62 Ca -0.07 -0.42 -0.21 0.00 0.02 0.00 0.00 54.97 54.29 2jxp s GLU 62 Cb -0.11 -1.21 0.04 0.00 0.10 0.00 0.00 34.13 32.95 2jxp s GLU 62 CO -0.08 0.14 0.70 -1.59 0.02 0.00 0.00 175.26 174.45 2jxp s LYS 63 N 0.24 3.25 0.39 1.61 -2.85 -1.26 -1.85 119.74 119.26 2jxp s LYS 63 Ca -0.05 -0.50 0.04 0.00 -1.00 0.00 0.00 55.97 54.45 2jxp s LYS 63 Cb -0.11 -4.02 -0.03 0.00 -2.06 0.00 0.00 37.83 31.61 2jxp s LYS 63 CO 0.02 -1.17 0.12 -0.98 0.10 0.00 0.00 175.35 173.43 2jxp s ARG 64 N 3.00 1.86 0.18 1.78 1.70 -0.20 -4.98 118.95 122.29 2jxp s ARG 64 Ca 0.22 -2.12 -0.25 0.00 -0.47 0.00 0.00 55.73 53.11 2jxp s ARG 64 Cb -0.15 -0.64 -0.08 0.00 -0.57 0.00 0.00 34.95 33.51 2jxp s ARG 64 CO 0.17 -0.42 0.79 0.42 -1.08 0.00 0.00 175.30 175.17 2jxp s ILE 65 N -3.25 4.36 -0.10 4.99 -1.09 -1.26 0.92 121.20 125.77 2jxp s ILE 65 Ca 0.26 1.71 -0.05 0.00 -2.23 0.00 0.00 60.65 60.34 2jxp s ILE 65 Cb 0.04 -4.13 -0.04 0.00 -1.58 0.00 0.00 42.46 36.74 2jxp s ILE 65 CO 0.15 0.49 -0.13 -0.11 -1.23 0.00 0.00 174.94 174.11 2jxp n LEU 66 N 1.51 0.77 -3.99 2.97 7.94 -0.23 -4.59 117.00 121.37 2jxp n LEU 66 Ca -0.05 0.13 -0.18 0.00 -1.11 0.00 0.00 56.01 54.80 2jxp n LEU 66 Cb 0.49 -0.31 -0.15 0.00 0.53 0.00 0.00 43.42 43.97 2jxp n LEU 66 CO 0.46 0.17 -0.42 -0.44 -1.11 0.00 0.00 177.39 176.04 2jxp s SER 67 N -5.93 0.98 0.41 1.96 0.01 -0.86 -5.00 113.70 105.25 2jxp s SER 67 Ca -0.14 -0.15 0.04 0.00 1.31 0.00 0.00 55.95 57.01 2jxp s SER 67 Cb 0.05 -0.17 -0.05 0.00 0.21 0.00 0.00 66.02 66.06 2jxp s SER 67 CO 0.18 0.08 0.05 -0.76 0.41 0.00 0.00 173.24 173.20 2jxp s LEU 68 N -0.01 2.32 0.30 2.44 1.43 -1.26 -2.28 118.68 121.61 2jxp s LEU 68 Ca 0.01 -1.51 -0.06 0.00 -1.03 0.00 0.00 54.13 51.53 2jxp s LEU 68 Cb -0.05 -0.51 -0.00 0.00 0.03 0.00 0.00 46.19 45.65 2jxp s LEU 68 CO -0.00 -0.71 0.45 -0.55 0.23 0.00 0.00 176.35 175.77 2jxp s SER 69 N -3.66 0.47 -1.21 2.29 0.15 -0.23 -4.91 113.70 106.59 2jxp s SER 69 Ca 0.26 -1.28 0.00 0.00 0.70 0.00 0.00 55.95 55.63 2jxp s SER 69 Cb 0.06 0.61 0.00 0.00 -1.71 0.00 0.00 66.02 64.98 2jxp s SER 69 CO 0.13 -1.21 0.00 -0.62 1.20 0.00 0.00 173.24 172.74 2jxp n GLU 70 N -0.47 -1.57 -2.69 5.44 1.02 -1.26 0.12 120.64 121.23 2jxp n GLU 70 Ca -0.00 0.68 -0.13 0.00 -0.02 0.00 0.00 57.16 57.68 2jxp n GLU 70 Cb 0.62 -5.02 0.02 0.00 -0.02 0.00 0.00 31.44 27.05 2jxp n GLU 70 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2jxp n SER 71 N -0.82 -4.21 0.00 1.62 7.64 -1.26 -4.42 113.62 112.16 2jxp n SER 71 Ca -0.13 -0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.59 2jxp n SER 71 Cb 0.46 -3.10 0.00 0.00 -1.01 0.00 0.00 64.21 60.56 2jxp n SER 71 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jxp n GLY 72 N -1.20 0.50 3.68 0.23 0.00 0.37 -5.13 105.19 103.65 2jxp n GLY 72 Ca -0.07 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.49 2jxp n GLY 72 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2jxp n ARG 73 N 0.00 2.22 -2.04 1.61 3.00 0.33 -4.73 116.66 117.05 2jxp n ARG 73 Ca 0.00 0.81 -0.42 0.00 -0.00 0.00 0.00 57.85 58.24 2jxp n ARG 73 Cb 0.00 -2.62 -0.03 0.00 0.00 0.00 0.00 32.46 29.81 2jxp n ARG 73 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2jxp s VAL 74 N 2.30 2.83 0.00 5.15 1.01 -1.26 -1.07 120.40 129.36 2jxp s VAL 74 Ca 0.84 0.64 0.00 0.00 0.00 0.00 0.00 61.98 63.47 2jxp s VAL 74 Cb -0.66 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.30 2jxp s VAL 74 CO 0.43 0.08 0.00 0.54 0.00 0.00 0.00 175.10 176.15 2jxp n ARG 75 N 3.18 0.00 -3.75 2.72 1.74 -1.12 -4.80 116.66 114.63 2jxp n ARG 75 Ca 0.10 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.80 2jxp n ARG 75 Cb 0.40 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.72 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 -0.42 3.12 -0.24 5.56 2.02 -0.97 -1.65 118.70 126.12 2jxp s GLU 76 Ca 0.00 -0.84 -0.16 0.00 0.02 0.00 0.00 54.97 53.99 2jxp s GLU 76 Cb 0.00 -3.39 -0.04 0.00 0.10 0.00 0.00 34.13 30.81 2jxp s GLU 76 CO 0.00 -0.44 0.40 0.12 0.02 0.00 0.00 175.26 175.36 2jxp s PHE 77 N 1.51 3.30 -0.49 1.61 5.36 -0.11 -1.06 117.98 128.10 2jxp s PHE 77 Ca 0.03 0.53 -0.23 0.00 -0.96 0.00 0.00 56.93 56.29 2jxp s PHE 77 Cb -0.17 -2.57 0.03 0.00 -0.34 0.00 0.00 43.02 39.97 2jxp s PHE 77 CO 0.03 -0.14 0.83 -2.00 -1.46 0.00 0.00 175.22 172.47 2jxp s GLU 78 N 1.77 3.37 -0.84 10.12 2.12 0.26 -0.89 118.70 134.61 2jxp s GLU 78 Ca 0.17 -0.20 -0.20 0.00 0.36 0.00 0.00 54.97 55.10 2jxp s GLU 78 Cb -0.15 -3.99 0.11 0.00 0.26 0.00 0.00 34.13 30.36 2jxp s GLU 78 CO 0.09 -1.24 1.08 -0.51 -0.54 0.00 0.00 175.26 174.14 2jxp s LEU 79 N 3.46 4.75 0.08 2.70 1.43 0.05 -1.03 118.68 130.12 2jxp s LEU 79 Ca 0.29 -1.65 -0.20 0.00 -1.03 0.00 0.00 54.13 51.54 2jxp s LEU 79 Cb -0.13 -2.41 -0.07 0.00 0.03 0.00 0.00 46.19 43.61 2jxp s LEU 79 CO 0.21 -1.21 0.58 0.54 0.23 0.00 0.00 176.35 176.70 2jxp s VAL 80 N 3.27 4.71 -0.04 -1.59 0.11 -0.77 -0.89 120.40 125.20 2jxp s VAL 80 Ca 0.29 1.25 -0.01 0.00 -2.93 0.00 0.00 61.98 60.58 2jxp s VAL 80 Cb -0.09 -3.92 0.03 0.00 -1.53 0.00 0.00 36.38 30.88 2jxp s VAL 80 CO -0.03 0.55 0.06 -0.47 -3.33 0.00 0.00 175.10 171.89 2jxp s TYR 81 N -1.11 0.00 -0.20 1.54 5.04 0.78 -1.51 117.35 121.88 2jxp s TYR 81 Ca 0.29 0.25 -0.00 0.00 -2.44 0.00 0.00 57.07 55.17 2jxp s TYR 81 Cb -0.20 -0.30 0.05 0.00 0.35 0.00 0.00 41.96 41.86 2jxp s TYR 81 CO 0.20 -0.14 -0.05 1.03 -1.34 0.00 0.00 175.55 175.24 2jxp s ARG 82 N 1.52 1.53 -0.34 4.97 0.52 0.10 -0.03 118.95 127.22 2jxp s ARG 82 Ca -0.04 -0.76 -0.12 0.00 -0.52 0.00 0.00 55.73 54.30 2jxp s ARG 82 Cb -0.12 -2.33 -0.00 0.00 0.52 0.00 0.00 34.95 33.02 2jxp s ARG 82 CO -0.04 -0.52 0.21 0.08 0.02 0.00 0.00 175.30 175.05 2jxp s VAL 83 N 1.52 4.91 -0.20 3.52 1.01 -0.60 -1.03 120.40 129.53 2jxp s VAL 83 Ca -0.02 -0.44 -0.09 0.00 0.00 0.00 0.00 61.98 61.42 2jxp s VAL 83 Cb -0.17 -3.57 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 2jxp s VAL 83 CO -0.07 -0.05 0.11 0.00 0.00 0.00 0.00 175.10 175.09 2jxp s ALA 84 N 1.65 3.54 0.21 5.51 0.00 -0.39 -1.26 121.76 131.03 2jxp s ALA 84 Ca 0.05 -0.77 -0.18 0.00 0.00 0.00 0.00 51.96 51.05 2jxp s ALA 84 Cb -0.18 -2.10 0.03 0.00 0.00 0.00 0.00 23.12 20.87 2jxp s ALA 84 CO 0.08 0.07 0.57 0.00 0.00 0.00 0.00 175.76 176.48 2jxp s ALA 85 N 0.56 -1.00 0.08 0.00 0.00 -1.26 0.10 121.76 120.24 2jxp s ALA 85 Ca 0.06 -0.22 0.06 0.00 0.00 0.00 0.00 51.96 51.85 2jxp s ALA 85 Cb -0.12 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.84 2jxp s ALA 85 CO 0.00 -0.85 -0.15 1.03 0.00 0.00 0.00 175.76 175.79 2jxp s ARG 86 N -3.88 0.89 -0.54 0.00 0.52 0.35 -4.32 118.95 111.96 2jxp s ARG 86 Ca 0.10 -1.03 -0.09 0.00 -0.52 0.00 0.00 55.73 54.18 2jxp s ARG 86 Cb -0.02 -0.90 0.14 0.00 0.52 0.00 0.00 34.95 34.69 2jxp s ARG 86 CO -0.01 0.20 0.42 -1.17 0.02 0.00 0.00 175.30 174.76 2jxp s LEU 87 N -1.90 5.81 0.51 2.53 2.96 -1.26 -1.73 118.68 125.61 2jxp s LEU 87 Ca 0.01 -2.12 0.05 0.00 -0.22 0.00 0.00 54.13 51.85 2jxp s LEU 87 Cb -0.09 -2.03 0.04 0.00 0.50 0.00 0.00 46.19 44.61 2jxp s LEU 87 CO 0.03 -0.65 0.70 -0.76 -1.32 0.00 0.00 176.35 174.35 2jxp s LEU 88 N 1.05 3.39 0.00 -0.68 1.02 0.92 -0.85 118.68 123.54 2jxp s LEU 88 Ca 0.08 -0.35 0.02 0.00 0.02 0.00 0.00 54.13 53.90 2jxp s LEU 88 Cb -0.24 -2.51 0.02 0.00 0.02 0.00 0.00 46.19 43.49 2jxp s LEU 88 CO -0.02 -1.07 0.18 -0.90 0.02 0.00 0.00 176.35 174.57 2jxp n ASP 89 N -2.15 1.22 0.17 2.29 5.75 -1.26 -0.50 116.55 122.08 2jxp n ASP 89 Ca 0.10 -1.57 0.18 0.00 -0.01 0.00 0.00 54.79 53.48 2jxp n ASP 89 Cb 0.60 -0.06 0.80 0.00 -1.03 0.00 0.00 41.12 41.42 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 0.59 1.92 -0.71 2.12 0.00 -1.68 -1.08 119.26 120.41 2jxp h ALA 90 Ca -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2jxp h ALA 90 Cb 0.41 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2jxp h ALA 90 CO 0.16 -0.38 0.00 0.72 0.00 0.00 0.00 179.25 179.75 2jxp n HIS 91 N -3.85 1.09 -1.40 0.00 8.25 -1.26 -4.93 115.22 113.12 2jxp n HIS 91 Ca 0.03 -0.53 -0.14 0.00 -0.26 0.00 0.00 57.72 56.82 2jxp n HIS 91 Cb 0.39 -0.06 -0.06 0.00 1.12 0.00 0.00 29.99 31.38 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 1.50 -5.45 -1.40 0.41 4.13 -0.41 -4.83 115.26 109.21 2jxp n ASN 92 Ca 0.25 0.35 0.05 0.00 1.68 0.00 0.00 54.58 56.91 2jxp n ASN 92 Cb 0.68 -4.31 0.28 0.00 -1.54 0.00 0.00 39.78 34.89 2jxp n ASN 92 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2jxp n ALA 93 N 1.20 3.31 -1.74 5.41 0.00 -1.26 -4.84 120.51 122.58 2jxp n ALA 93 Ca -0.14 -1.28 0.00 0.00 0.00 0.00 0.00 53.44 52.02 2jxp n ALA 93 Cb 0.61 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.99 2jxp n ALA 93 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2jxp n GLU 94 N 0.54 -3.99 -0.00 0.00 1.02 -1.26 -4.89 120.64 112.05 2jxp n GLU 94 Ca 0.19 2.98 -0.00 0.00 -0.02 0.00 0.00 57.16 60.31 2jxp n GLU 94 Cb 0.84 -3.25 -0.00 0.00 -0.02 0.00 0.00 31.44 29.01 2jxp n GLU 94 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2jxp n LEU 95 N 1.37 0.05 -4.56 -4.62 -0.00 -0.03 -4.69 117.00 104.52 2jxp n LEU 95 Ca 0.00 0.12 -0.26 0.00 -0.00 0.00 0.00 56.01 55.87 2jxp n LEU 95 Cb 0.00 -0.51 -0.11 0.00 -0.00 0.00 0.00 43.42 42.80 2jxp n LEU 95 CO 0.00 -0.50 -0.29 0.00 -0.00 0.00 0.00 177.39 176.61 2jxp s ALA 96 N -3.00 2.91 -1.05 1.96 0.00 -0.78 -5.02 121.76 116.78 2jxp s ALA 96 Ca -0.01 -2.22 -0.21 0.00 0.00 0.00 0.00 51.96 49.52 2jxp s ALA 96 Cb 0.00 0.31 0.07 0.00 0.00 0.00 0.00 23.12 23.50 2jxp s ALA 96 CO 0.01 -0.17 1.43 0.45 0.00 0.00 0.00 175.76 177.48 2jxp s SER 97 N -3.64 6.59 -0.38 0.00 0.15 -1.26 -3.99 113.70 111.17 2jxp s SER 97 Ca 0.35 -1.76 -0.22 0.00 0.70 0.00 0.00 55.95 55.02 2jxp s SER 97 Cb 0.09 -2.53 0.01 0.00 -1.71 0.00 0.00 66.02 61.88 2jxp s SER 97 CO 0.17 -1.35 0.73 -0.22 1.20 0.00 0.00 173.24 173.77 2jxp s LEU 98 N 4.33 4.21 0.28 3.45 2.96 -1.26 -4.98 118.68 127.67 2jxp s LEU 98 Ca 0.45 0.16 0.07 0.00 -0.22 0.00 0.00 54.13 54.59 2jxp s LEU 98 Cb -0.00 -2.93 -0.03 0.00 0.50 0.00 0.00 46.19 43.73 2jxp s LEU 98 CO -0.07 -0.73 0.28 -1.10 -1.32 0.00 0.00 176.35 173.41 2jxp s GLN 99 N 3.01 3.01 0.46 1.98 -0.21 -1.26 -4.40 119.66 122.25 2jxp s GLN 99 Ca 0.29 -1.04 -0.24 0.00 0.02 0.00 0.00 55.36 54.38 2jxp s GLN 99 Cb -0.13 -2.64 -0.07 0.00 1.00 0.00 0.00 33.01 31.17 2jxp s GLN 99 CO 0.18 0.31 1.31 -1.83 -2.12 0.00 0.00 175.29 173.13 2jxp s GLU 100 N -3.94 3.67 -0.27 2.91 -1.05 -1.26 -4.68 118.70 114.08 2jxp s GLU 100 Ca 0.36 2.13 -0.04 0.00 -0.15 0.00 0.00 54.97 57.28 2jxp s GLU 100 Cb -0.08 -2.54 0.02 0.00 -0.44 0.00 0.00 34.13 31.09 2jxp s GLU 100 CO 0.27 -0.73 0.00 0.42 0.95 0.00 0.00 175.26 176.16 2jxp s ILE 101 N -1.32 3.34 -0.22 1.83 1.01 -0.39 -4.93 121.20 120.52 2jxp s ILE 101 Ca 0.63 -0.90 -0.11 0.00 0.00 0.00 0.00 60.65 60.26 2jxp s ILE 101 Cb -0.37 -2.72 -0.05 0.00 0.01 0.00 0.00 42.46 39.33 2jxp s ILE 101 CO 0.47 0.13 0.18 0.00 0.00 0.00 0.00 174.94 175.72 2jxp s ARG 102 N 1.39 4.12 0.07 2.79 3.03 -1.26 -1.56 118.95 127.53 2jxp s ARG 102 Ca 0.01 -0.20 0.05 0.00 2.03 0.00 0.00 55.73 57.62 2jxp s ARG 102 Cb -0.17 -3.50 -0.03 0.00 -1.03 0.00 0.00 34.95 30.22 2jxp s ARG 102 CO -0.01 0.13 -0.13 -0.51 -1.13 0.00 0.00 175.30 173.64 2jxp s LEU 103 N 0.86 2.27 -0.02 -1.89 1.43 0.95 -4.98 118.68 117.30 2jxp s LEU 103 Ca 0.09 -0.60 0.02 0.00 -1.03 0.00 0.00 54.13 52.61 2jxp s LEU 103 Cb -0.13 -0.46 0.00 0.00 0.03 0.00 0.00 46.19 45.64 2jxp s LEU 103 CO 0.03 -0.10 -0.07 0.42 0.23 0.00 0.00 176.35 176.86 2jxp s THR 104 N -1.28 0.64 -0.07 5.49 -4.23 -1.26 -0.16 115.64 114.77 2jxp s THR 104 Ca -0.03 -0.29 0.05 0.00 -1.18 0.00 0.00 61.69 60.23 2jxp s THR 104 Cb -0.10 -0.58 -0.00 0.00 1.34 0.00 0.00 72.50 73.16 2jxp s THR 104 CO 0.02 0.20 -0.22 -0.60 -0.54 0.00 0.00 174.62 173.48 2jxp s ARG 105 N 0.17 2.52 -0.33 3.99 6.06 -0.07 -4.92 118.95 126.36 2jxp s ARG 105 Ca -0.02 -0.80 -0.26 0.00 -2.50 0.00 0.00 55.73 52.15 2jxp s ARG 105 Cb -0.07 -2.04 0.01 0.00 0.06 0.00 0.00 34.95 32.91 2jxp s ARG 105 CO 0.00 0.26 0.90 0.42 -2.50 0.00 0.00 175.30 174.38 2jxp s ILE 106 N 0.12 4.66 -0.36 4.11 -1.09 -1.26 -0.77 121.20 126.61 2jxp s ILE 106 Ca -0.10 1.31 -0.11 0.00 -2.23 0.00 0.00 60.65 59.51 2jxp s ILE 106 Cb -0.15 -4.27 0.01 0.00 -1.58 0.00 0.00 42.46 36.47 2jxp s ILE 106 CO 0.05 -0.41 0.20 -0.22 -1.23 0.00 0.00 174.94 173.34 2jxp s LEU 107 N 3.29 4.55 0.20 2.97 1.98 -0.07 -4.95 118.68 126.66 2jxp s LEU 107 Ca 0.37 -0.79 -0.30 0.00 -2.89 0.00 0.00 54.13 50.52 2jxp s LEU 107 Cb -0.13 -2.04 -0.08 0.00 0.66 0.00 0.00 46.19 44.60 2jxp s LEU 107 CO 0.15 -0.32 0.97 -2.16 -1.89 0.00 0.00 176.35 173.10 2jxp s PRO 108 N 1.60 4.78 -0.94 0.98 0.04 -1.26 -0.93 135.00 139.26 2jxp s PRO 108 Ca 0.03 1.52 -0.22 0.00 0.04 0.00 0.00 61.00 62.37 2jxp s PRO 108 Cb -0.18 -3.30 0.07 0.00 0.04 0.00 0.00 34.50 31.13 2jxp s PRO 108 CO 0.07 0.38 1.32 0.12 0.04 0.00 0.00 177.00 178.93 2jxp s PHE 109 N -0.79 2.66 -0.83 0.56 5.36 -0.66 -4.93 117.98 119.35 2jxp s PHE 109 Ca 0.43 -0.87 -0.06 0.00 -0.96 0.00 0.00 56.93 55.47 2jxp s PHE 109 Cb -0.26 -4.56 0.21 0.00 -0.34 0.00 0.00 43.02 38.07 2jxp s PHE 109 CO 0.32 -1.82 0.72 -0.51 -1.46 0.00 0.00 175.22 172.47 2jxp s LEU 110 N 4.42 5.87 0.20 6.12 1.02 -1.26 -4.93 118.68 130.11 2jxp s LEU 110 Ca 0.40 -3.19 -0.10 0.00 0.02 0.00 0.00 54.13 51.25 2jxp s LEU 110 Cb -0.03 -2.01 0.13 0.00 0.02 0.00 0.00 46.19 44.29 2jxp s LEU 110 CO -0.06 -0.35 1.78 -0.78 0.02 0.00 0.00 176.35 176.96 2jxp h ASP 111 N 6.84 0.95 -0.01 2.29 3.58 -1.99 -2.35 116.42 125.73 2jxp h ASP 111 Ca 0.10 -0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.40 2jxp h ASP 111 Cb 0.92 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.72 2jxp h ASP 111 CO 0.81 0.83 0.00 0.00 -2.88 0.00 0.00 179.24 178.00 2jxp n ALA 112 N -2.38 2.60 -3.28 -0.78 0.00 -1.26 -3.97 120.51 111.43 2jxp n ALA 112 Ca 0.06 -0.12 -0.25 0.00 0.00 0.00 0.00 53.44 53.12 2jxp n ALA 112 Cb 0.14 -1.27 -0.07 0.00 0.00 0.00 0.00 19.45 18.26 2jxp n ALA 112 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2jxp n GLN 113 N -0.72 1.89 -0.34 0.00 1.13 -0.88 -4.94 117.38 113.52 2jxp n GLN 113 Ca 0.13 -4.12 -0.02 0.00 -1.94 0.00 0.00 57.00 51.05 2jxp n GLN 113 Cb 0.07 -1.87 0.11 0.00 0.11 0.00 0.00 30.24 28.66 2jxp n GLN 113 CO 0.00 0.00 0.00 1.05 -1.44 0.00 0.00 177.06 176.67 2jxp h GLU 114 N 3.92 1.15 -0.86 -1.09 9.09 -1.72 -0.53 114.58 124.53 2jxp h GLU 114 Ca 0.14 -0.07 -0.02 0.00 0.05 0.00 0.00 59.36 59.46 2jxp h GLU 114 Cb 0.74 -0.26 -0.04 0.00 -1.65 0.00 0.00 28.75 27.54 2jxp h GLU 114 CO 0.69 0.76 0.46 -0.07 0.05 0.00 0.00 179.01 180.90 2jxp h LEU 115 N 1.18 1.08 -0.13 3.06 -0.00 -1.93 0.58 115.31 119.14 2jxp h LEU 115 Ca 0.35 -0.10 -0.03 0.00 -0.00 0.00 0.00 57.88 58.11 2jxp h LEU 115 Cb -0.05 -0.27 -0.00 0.00 -0.00 0.00 0.00 40.66 40.33 2jxp h LEU 115 CO -0.10 0.87 -0.02 0.00 -0.00 0.00 0.00 178.44 179.19 2jxp h ALA 116 N 1.30 0.18 -0.83 1.53 0.00 -1.77 -2.32 119.26 117.35 2jxp h ALA 116 Ca 0.30 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2jxp h ALA 116 Cb 0.04 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2jxp h ALA 116 CO -0.05 -0.08 0.50 0.87 0.00 0.00 0.00 179.25 180.49 2jxp h LYS 117 N -0.05 1.14 0.10 0.00 1.57 -0.98 0.16 116.57 118.51 2jxp h LYS 117 Ca 0.03 -0.11 0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2jxp h LYS 117 Cb 0.43 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 2jxp h LYS 117 CO 0.01 0.80 -0.23 0.00 -0.57 0.00 0.00 179.45 179.47 2jxp h ALA 118 N 1.27 -0.38 -0.67 3.86 0.00 -0.83 0.56 119.26 123.07 2jxp h ALA 118 Ca 0.30 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 2jxp h ALA 118 Cb -0.04 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2jxp h ALA 118 CO -0.06 -0.76 0.22 0.00 0.00 0.00 0.00 179.25 178.66 2jxp h ALA 119 N 0.37 0.87 0.63 0.00 0.00 -1.22 -2.39 119.26 117.52 2jxp h ALA 119 Ca 0.03 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 2jxp h ALA 119 Cb 0.45 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.98 2jxp h ALA 119 CO -0.14 0.54 -0.30 1.49 0.00 0.00 0.00 179.25 180.84 2jxp h GLU 120 N 0.97 -0.82 -0.29 0.00 4.57 -0.41 0.11 114.58 118.71 2jxp h GLU 120 Ca 0.22 0.06 -0.03 0.00 -1.18 0.00 0.00 59.36 58.42 2jxp h GLU 120 Cb 0.28 0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 29.04 2jxp h GLU 120 CO -0.01 -0.51 0.03 0.93 -1.18 0.00 0.00 179.01 178.27 2jxp h GLU 121 N -0.98 0.43 -0.22 1.92 5.08 -0.94 0.15 114.58 120.02 2jxp h GLU 121 Ca -0.09 -0.07 -0.17 0.00 -1.00 0.00 0.00 59.36 58.03 2jxp h GLU 121 Cb 0.69 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2jxp h GLU 121 CO 0.14 0.43 -0.56 0.93 -1.00 0.00 0.00 179.01 178.95 2jxp h GLU 122 N 0.42 0.69 0.05 2.33 4.39 -1.39 0.83 114.58 121.90 2jxp h GLU 122 Ca 0.10 -0.44 -0.00 0.00 0.34 0.00 0.00 59.36 59.35 2jxp h GLU 122 Cb 0.23 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 2jxp h GLU 122 CO 0.00 1.06 -0.03 0.52 -1.16 0.00 0.00 179.01 179.41 2jxp h MET 123 N 0.53 -0.07 -0.07 2.33 2.86 -0.25 -3.05 114.93 117.20 2jxp h MET 123 Ca 0.01 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.61 2jxp h MET 123 Cb 1.14 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.80 2jxp h MET 123 CO 0.11 0.09 -0.16 -0.07 1.06 0.00 0.00 176.91 177.95 2jxp h LEU 124 N -0.21 0.11 -0.50 1.22 3.38 -0.71 0.48 115.31 119.07 2jxp h LEU 124 Ca -0.01 -0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.04 2jxp h LEU 124 Cb 0.19 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.83 2jxp h LEU 124 CO 0.01 0.28 0.01 0.22 0.09 0.00 0.00 178.44 179.05 2jxp h TYR 125 N 0.11 -0.02 0.00 1.13 5.03 -0.72 -0.18 116.97 122.31 2jxp h TYR 125 Ca 0.02 0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.37 2jxp h TYR 125 Cb 0.35 0.09 0.00 0.00 1.55 0.00 0.00 36.73 38.72 2jxp h TYR 125 CO 0.00 -0.11 -1.15 0.36 -1.32 0.00 0.00 178.16 175.94 2jxp n LYS 126 N -5.23 0.61 -0.05 1.82 2.85 -0.91 -3.68 118.16 113.57 2jxp n LYS 126 Ca 0.06 0.07 -0.14 0.00 -1.05 0.00 0.00 58.31 57.25 2jxp n LYS 126 Cb 0.27 -1.78 -0.07 0.00 -0.65 0.00 0.00 35.03 32.80 2jxp n LYS 126 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 2jxp h ASP 127 N 0.00 0.47 -0.77 -5.58 3.58 0.34 0.21 116.42 114.68 2jxp h ASP 127 Ca 0.00 -0.55 -0.01 0.00 0.42 0.00 0.00 57.03 56.90 2jxp h ASP 127 Cb 0.99 -0.14 -0.04 0.00 1.72 0.00 0.00 39.33 41.87 2jxp h ASP 127 CO 0.00 0.93 0.46 0.24 -2.88 0.00 0.00 179.24 177.99 2jxp h MET 128 N 0.03 1.05 -0.95 0.28 2.86 -1.21 0.64 114.93 117.63 2jxp h MET 128 Ca 0.01 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 2jxp h MET 128 Cb 0.85 -0.22 -0.05 0.00 0.06 0.00 0.00 31.60 32.24 2jxp h MET 128 CO 0.06 0.75 0.61 0.37 1.06 0.00 0.00 176.91 179.75 2jxp h GLN 129 N 1.05 1.27 0.57 1.72 5.75 -1.61 -2.16 115.11 121.70 2jxp h GLN 129 Ca 0.28 -0.09 -0.03 0.00 -0.15 0.00 0.00 58.65 58.66 2jxp h GLN 129 Cb -0.03 -0.28 0.01 0.00 1.07 0.00 0.00 27.48 28.25 2jxp h GLN 129 CO -0.05 0.86 -0.27 -0.22 -2.65 0.00 0.00 178.83 176.49 2jxp h LYS 130 N 1.30 -0.73 -0.84 1.69 3.64 0.12 -3.05 116.57 118.70 2jxp h LYS 130 Ca 0.35 0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.85 2jxp h LYS 130 Cb -0.11 0.17 -0.06 0.00 -0.41 0.00 0.00 32.23 31.81 2jxp h LYS 130 CO -0.07 -0.49 0.51 0.22 -2.27 0.00 0.00 179.45 177.35 2jxp h ASP 131 N -0.85 0.78 0.12 4.20 3.58 -0.91 -1.73 116.42 121.61 2jxp h ASP 131 Ca -0.08 0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.42 2jxp h ASP 131 Cb 0.58 -0.13 -0.04 0.00 1.72 0.00 0.00 39.33 41.47 2jxp h ASP 131 CO 0.13 0.48 -0.28 0.00 -2.88 0.00 0.00 179.24 176.69 2jxp h ALA 132 N 1.41 -0.48 0.00 -0.78 0.00 -1.48 -1.11 119.26 116.82 2jxp h ALA 132 Ca 0.38 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.17 2jxp h ALA 132 Cb 0.22 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2jxp h ALA 132 CO -0.19 -0.82 -0.35 -0.24 0.00 0.00 0.00 179.25 177.65 2jxp h VAL 133 N -0.50 1.24 -0.50 0.00 3.04 -1.34 -1.89 116.25 116.30 2jxp h VAL 133 Ca 0.03 -1.20 -0.04 0.00 -1.01 0.00 0.00 66.70 64.48 2jxp h VAL 133 Cb 0.53 1.65 -0.02 0.00 -2.01 0.00 0.00 31.29 31.43 2jxp h VAL 133 CO -0.16 0.34 0.17 1.56 -1.01 0.00 0.00 177.57 178.46 2jxp h GLN 134 N 0.00 0.77 -0.18 4.17 1.08 -0.94 -2.38 115.11 117.63 2jxp h GLN 134 Ca -0.00 -0.16 -0.08 0.00 -1.45 0.00 0.00 58.65 56.96 2jxp h GLN 134 Cb 0.62 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.92 2jxp h GLN 134 CO 0.05 0.71 -0.23 1.96 -0.95 0.00 0.00 178.83 180.37 2jxp h GLN 135 N 0.68 0.33 0.16 1.46 1.08 -0.71 -2.17 115.11 115.94 2jxp h GLN 135 Ca 0.16 -0.11 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 2jxp h GLN 135 Cb 0.26 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 2jxp h GLN 135 CO -0.01 0.55 -0.08 0.82 -0.95 0.00 0.00 178.83 179.16 2jxp h ILE 136 N 0.30 0.84 -0.85 2.54 2.04 -1.14 -2.80 117.51 118.43 2jxp h ILE 136 Ca 0.05 -0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.04 2jxp h ILE 136 Cb 0.57 0.84 -0.09 0.00 -0.74 0.00 0.00 36.82 37.41 2jxp h ILE 136 CO 0.04 0.00 0.46 0.25 0.00 0.00 0.00 178.15 178.90 2jxp h LEU 137 N -0.22 0.59 -0.47 1.44 5.85 -1.19 -2.02 115.31 119.29 2jxp h LEU 137 Ca -0.02 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.87 2jxp h LEU 137 Cb 0.17 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.10 2jxp h LEU 137 CO 0.04 0.27 -0.02 -0.09 -0.34 0.00 0.00 178.44 178.30 2jxp h ARG 138 N 0.68 0.09 -0.16 1.25 9.65 -1.14 -0.59 114.38 124.16 2jxp h ARG 138 Ca 0.45 -0.01 -0.05 0.00 -1.10 0.00 0.00 59.98 59.28 2jxp h ARG 138 Cb 0.59 -0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 29.14 2jxp h ARG 138 CO -0.33 0.06 -0.08 1.96 2.80 0.00 0.00 179.97 184.38 2jxp h GLN 139 N 0.09 0.33 -0.02 0.20 4.20 -1.28 -2.69 115.11 115.94 2jxp h GLN 139 Ca 0.23 -0.15 0.01 0.00 0.06 0.00 0.00 58.65 58.80 2jxp h GLN 139 Cb 0.35 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.12 2jxp h GLN 139 CO -0.41 0.65 0.01 0.28 -0.67 0.00 0.00 178.83 178.69 2jxp h VAL 140 N 0.01 0.91 -0.55 -0.54 2.07 -0.97 -0.66 116.25 116.52 2jxp h VAL 140 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2jxp h VAL 140 Cb 0.55 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 2jxp h VAL 140 CO 0.02 0.00 0.00 -1.54 0.02 0.00 0.00 177.57 176.07 2jxp n SER 141 N -4.42 3.67 0.00 0.57 3.41 -0.27 -4.41 113.62 112.17 2jxp n SER 141 Ca -0.03 -1.99 0.00 0.00 -0.26 0.00 0.00 58.87 56.60 2jxp n SER 141 Cb 0.11 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 2jxp n SER 141 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jxp n ALA 142 N 1.51 1.20 -0.13 7.33 0.00 -0.53 -4.76 120.51 125.14 2jxp n ALA 142 Ca 0.21 -0.08 0.22 0.00 0.00 0.00 0.00 53.44 53.79 2jxp n ALA 142 Cb 0.60 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.70 2jxp n ALA 142 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2jxp h PHE 143 N 0.00 0.16 0.08 0.00 -5.15 -1.38 -0.81 116.94 109.85 2jxp h PHE 143 Ca 0.00 0.00 -0.28 0.00 -0.20 0.00 0.00 57.97 57.49 2jxp h PHE 143 Cb 0.07 -0.05 -0.02 0.00 0.22 0.00 0.00 35.95 36.17 2jxp h PHE 143 CO 0.00 0.05 -1.44 0.00 -2.00 0.00 0.00 178.31 174.93 2jxp h THR 144 N 0.13 1.24 -3.17 0.88 1.03 -1.88 -3.38 112.91 107.77 2jxp h THR 144 Ca 0.36 -2.92 -0.58 0.00 -0.01 0.00 0.00 66.41 63.27 2jxp h THR 144 Cb 1.25 2.75 -0.07 0.00 -1.07 0.00 0.00 68.15 71.01 2jxp h THR 144 CO -0.05 0.81 0.66 -0.94 -0.01 0.00 0.00 175.52 175.99 2jxp s SER 145 N -6.84 7.02 -1.09 0.00 1.04 -0.31 -3.35 113.70 110.16 2jxp s SER 145 Ca -0.06 1.27 0.00 0.00 0.48 0.00 0.00 55.95 57.64 2jxp s SER 145 Cb 0.08 -2.50 0.00 0.00 0.10 0.00 0.00 66.02 63.69 2jxp s SER 145 CO 0.85 -0.59 0.00 0.00 0.98 0.00 0.00 173.24 174.47 2jxp n ALA 146 N 6.08 -0.16 -3.94 5.32 0.00 -1.26 -4.95 120.51 121.60 2jxp n ALA 146 Ca 0.09 0.17 -0.31 0.00 0.00 0.00 0.00 53.44 53.39 2jxp n ALA 146 Cb 0.47 -1.36 -0.15 0.00 0.00 0.00 0.00 19.45 18.41 2jxp n ALA 146 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2jxp s GLY 147 N -2.69 1.56 -1.66 0.00 0.00 -1.21 -4.83 107.32 98.49 2jxp s GLY 147 Ca 0.00 -1.99 -0.17 0.00 0.00 0.00 0.00 44.72 42.56 2jxp s GLY 147 CO 0.00 1.06 0.84 1.04 0.00 0.00 0.00 173.10 176.04 2jxp n LEU 148 N 4.50 -1.90 -0.12 0.66 7.99 -1.26 -4.76 117.00 122.12 2jxp n LEU 148 Ca -0.03 -0.94 -0.09 0.00 -0.01 0.00 0.00 56.01 54.94 2jxp n LEU 148 Cb 0.42 -2.20 -0.02 0.00 -0.11 0.00 0.00 43.42 41.52 2jxp n LEU 148 CO 0.18 0.33 0.91 -0.33 -1.51 0.00 0.00 177.39 176.97 2jxp h GLU 149 N -1.63 0.53 -6.67 3.23 5.08 -1.88 -3.39 114.58 109.85 2jxp h GLU 149 Ca -0.58 -0.09 -0.56 0.00 -1.00 0.00 0.00 59.36 57.13 2jxp h GLU 149 Cb 1.38 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 30.47 2jxp h GLU 149 CO 0.75 0.51 0.95 -1.58 -1.00 0.00 0.00 179.01 178.65 2jxp s HIS 150 N -5.56 2.73 -0.12 4.33 2.46 -1.26 -4.99 115.29 112.88 2jxp s HIS 150 Ca -0.13 0.62 -0.07 0.00 0.47 0.00 0.00 55.06 55.95 2jxp s HIS 150 Cb 0.09 -4.46 0.05 0.00 -0.13 0.00 0.00 32.58 28.13 2jxp s HIS 150 CO 0.74 -1.41 0.28 -3.38 -2.47 0.00 0.00 174.74 168.50 2jxp s HIS 151 N 4.68 -0.38 -0.04 3.88 -3.43 -1.26 -5.12 115.29 113.61 2jxp s HIS 151 Ca 0.47 0.88 -0.34 0.00 -0.80 0.00 0.00 55.06 55.27 2jxp s HIS 151 Cb -0.07 0.10 -0.12 0.00 -1.43 0.00 0.00 32.58 31.06 2jxp s HIS 151 CO 0.30 -0.24 1.85 -2.39 -2.00 0.00 0.00 174.74 172.25 2jxp n HIS 152 N 4.04 2.34 0.01 0.38 1.44 -1.26 -4.92 115.22 117.25 2jxp n HIS 152 Ca -0.23 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.46 2jxp n HIS 152 Cb 0.54 -2.66 -0.01 0.00 0.12 0.00 0.00 29.99 27.98 2jxp n HIS 152 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 2jxp h HIS 153 N 8.84 -0.11 0.00 -1.40 3.86 -2.01 -3.43 115.15 120.90 2jxp h HIS 153 Ca -0.48 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 2jxp h HIS 153 Cb 1.27 0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.77 2jxp h HIS 153 CO 0.85 -0.07 -0.70 -2.39 0.86 0.00 0.00 177.93 176.48 2jxp n HIS 154 N -4.37 0.00 -1.88 2.45 1.44 -1.26 -5.36 115.22 106.24 2jxp n HIS 154 Ca -0.01 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.70 2jxp n HIS 154 Cb 0.05 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.16 2jxp n HIS 154 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11