#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mj2 n GLU 2 N 0.00 0.00 0.00 0.00 -0.00 -1.26 -5.00 120.64 114.38 1mj2 n GLU 2 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.16 1mj2 n GLU 2 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.44 1mj2 n GLU 2 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.13 179.00 1mj2 n TRP 3 N -0.48 0.00 0.10 -1.84 -0.00 -1.25 -4.95 117.44 109.02 1mj2 n TRP 3 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.50 57.61 1mj2 n TRP 3 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 31.31 31.22 1mj2 n TRP 3 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 177.69 176.56 1mj2 n SER 4 N 0.00 0.40 0.00 5.87 3.41 -1.26 -4.97 113.62 117.06 1mj2 n SER 4 Ca 0.00 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1mj2 n SER 4 Cb 0.00 1.29 0.00 0.00 -0.26 0.00 0.00 64.21 65.24 1mj2 n SER 4 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1mj2 n GLY 5 N 1.24 3.43 3.56 5.00 0.00 -1.26 -5.00 105.19 112.16 1mj2 n GLY 5 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 1mj2 n GLY 5 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mj2 s GLU 6 N -0.97 3.38 0.31 1.61 2.02 -1.26 -4.77 118.70 119.03 1mj2 s GLU 6 Ca 0.00 -0.95 -0.29 0.00 0.02 0.00 0.00 54.97 53.75 1mj2 s GLU 6 Cb 0.00 -5.30 -0.10 0.00 0.10 0.00 0.00 34.13 28.83 1mj2 s GLU 6 CO 0.00 -2.45 1.41 -0.47 0.02 0.00 0.00 175.26 173.77 1mj2 s TYR 7 N 6.02 2.91 -0.17 1.61 5.04 -1.26 -5.02 117.35 126.48 1mj2 s TYR 7 Ca 0.51 1.20 0.01 0.00 -2.44 0.00 0.00 57.07 56.35 1mj2 s TYR 7 Cb -0.01 -3.82 0.02 0.00 0.35 0.00 0.00 41.96 38.49 1mj2 s TYR 7 CO -0.08 -2.47 -0.19 0.42 -1.34 0.00 0.00 175.55 171.89 1mj2 s ILE 8 N -0.72 1.99 0.09 3.14 1.01 -1.26 -4.85 121.20 120.60 1mj2 s ILE 8 Ca 0.54 -0.90 -0.31 0.00 0.00 0.00 0.00 60.65 59.98 1mj2 s ILE 8 Cb -0.42 -1.81 -0.09 0.00 0.01 0.00 0.00 42.46 40.15 1mj2 s ILE 8 CO 0.52 0.53 1.63 -0.55 0.00 0.00 0.00 174.94 177.07 1mj2 s SER 9 N 1.30 6.61 0.00 3.58 0.15 -1.26 -4.87 113.70 119.20 1mj2 s SER 9 Ca 0.05 2.51 0.26 0.00 0.70 0.00 0.00 55.95 59.46 1mj2 s SER 9 Cb -0.13 -2.57 1.40 0.00 -1.71 0.00 0.00 66.02 63.01 1mj2 s SER 9 CO -0.12 -0.87 1.88 -0.81 1.20 0.00 0.00 173.24 174.52 1mj2 n PRO 10 N 5.18 0.57 -4.36 5.44 -0.05 -1.26 -4.84 135.00 135.68 1mj2 n PRO 10 Ca 0.15 0.03 -0.24 0.00 -0.05 0.00 0.00 63.50 63.38 1mj2 n PRO 10 Cb 0.40 -1.50 -0.09 0.00 -0.05 0.00 0.00 33.50 32.26 1mj2 n PRO 10 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 175.50 176.16 1mj2 s TYR 11 N -2.31 2.52 0.00 0.54 2.02 -1.26 -4.70 117.35 114.16 1mj2 s TYR 11 Ca 0.31 -0.27 0.00 0.00 -0.37 0.00 0.00 57.07 56.74 1mj2 s TYR 11 Cb 0.17 -1.15 0.00 0.00 -0.40 0.00 0.00 41.96 40.59 1mj2 s TYR 11 CO 0.35 0.62 0.00 0.00 -1.57 0.00 0.00 175.55 174.94 1mj2 n ALA 12 N -0.49 0.00 -3.65 3.71 0.00 -1.26 -5.09 120.51 113.73 1mj2 n ALA 12 Ca -0.08 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.27 1mj2 n ALA 12 Cb 0.58 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.94 1mj2 n ALA 12 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1mj2 s GLU 13 N 0.04 0.56 0.23 0.00 -1.05 -1.26 -5.06 118.70 112.16 1mj2 s GLU 13 Ca 0.00 0.98 -0.31 0.00 -0.15 0.00 0.00 54.97 55.50 1mj2 s GLU 13 Cb 0.00 0.08 -0.15 0.00 -0.44 0.00 0.00 34.13 33.62 1mj2 s GLU 13 CO 0.00 -0.15 1.13 1.58 0.95 0.00 0.00 175.26 178.78 1mj2 n HIS 14 N 4.15 1.40 0.00 4.83 -0.00 -1.26 -2.13 115.22 122.22 1mj2 n HIS 14 Ca -0.21 0.66 0.00 0.00 0.46 0.00 0.00 57.72 58.63 1mj2 n HIS 14 Cb 0.57 -2.29 0.00 0.00 -0.12 0.00 0.00 29.99 28.15 1mj2 n HIS 14 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1mj2 n GLY 15 N 1.72 2.52 0.30 1.57 0.00 -1.26 -4.65 105.19 105.39 1mj2 n GLY 15 Ca 0.12 -0.55 0.08 0.00 0.00 0.00 0.00 46.02 45.68 1mj2 n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1mj2 n LYS 16 N 0.00 1.39 -0.36 1.61 5.02 -0.91 -4.00 118.16 120.92 1mj2 n LYS 16 Ca 0.00 -0.59 0.03 0.00 -2.02 0.00 0.00 58.31 55.73 1mj2 n LYS 16 Cb 0.00 -1.30 0.18 0.00 -0.02 0.00 0.00 35.03 33.89 1mj2 n LYS 16 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1mj2 h LYS 17 N 1.13 1.07 0.00 1.97 1.57 -1.74 0.21 116.57 120.79 1mj2 h LYS 17 Ca 0.00 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1mj2 h LYS 17 Cb 0.25 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 1mj2 h LYS 17 CO 0.00 0.71 -0.02 1.03 -0.57 0.00 0.00 179.45 180.60 1mj2 h SER 18 N 1.11 0.00 0.00 0.86 0.87 -1.87 0.68 113.55 115.19 1mj2 h SER 18 Ca 0.44 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.98 1mj2 h SER 18 Cb 0.23 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.19 1mj2 h SER 18 CO -0.19 0.02 -0.30 -0.33 -0.53 0.00 0.00 176.83 175.50 1mj2 h GLU 19 N 0.00 0.00 -0.01 2.24 3.07 -0.94 -3.41 114.58 115.54 1mj2 h GLU 19 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1mj2 h GLU 19 Cb 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 1mj2 h GLU 19 CO 0.00 0.14 -0.14 1.04 -1.40 0.00 0.00 179.01 178.65 1mj2 n GLN 20 N -4.68 0.97 -4.54 2.33 6.02 -0.27 -4.91 117.38 112.31 1mj2 n GLN 20 Ca -0.06 -0.48 -0.31 0.00 -0.01 0.00 0.00 57.00 56.14 1mj2 n GLN 20 Cb 0.19 -1.49 -0.11 0.00 1.02 0.00 0.00 30.24 29.85 1mj2 n GLN 20 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1mj2 s VAL 21 N -2.36 3.18 0.05 5.09 1.01 0.22 -4.97 120.40 122.62 1mj2 s VAL 21 Ca 0.30 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 61.31 1mj2 s VAL 21 Cb 0.20 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.18 1mj2 s VAL 21 CO 0.46 0.34 -0.18 -0.75 0.00 0.00 0.00 175.10 174.96 1mj2 s LYS 22 N -1.51 1.18 -0.20 2.72 2.20 -1.26 -4.79 119.74 118.08 1mj2 s LYS 22 Ca 0.16 -0.88 -0.12 0.00 -0.36 0.00 0.00 55.97 54.77 1mj2 s LYS 22 Cb -0.11 -1.26 -0.05 0.00 -1.51 0.00 0.00 37.83 34.90 1mj2 s LYS 22 CO 0.07 0.32 0.21 0.15 -0.36 0.00 0.00 175.35 175.74 1mj2 s LYS 23 N -1.22 4.18 0.05 4.03 1.02 -1.26 -5.08 119.74 121.46 1mj2 s LYS 23 Ca 0.05 -0.09 0.06 0.00 0.02 0.00 0.00 55.97 56.00 1mj2 s LYS 23 Cb -0.09 -3.46 -0.02 0.00 -0.52 0.00 0.00 37.83 33.74 1mj2 s LYS 23 CO 0.02 0.19 -0.16 0.96 -0.92 0.00 0.00 175.35 175.44 1mj2 s ILE 24 N 0.65 1.30 -0.19 2.17 -4.36 -1.26 -5.11 121.20 114.41 1mj2 s ILE 24 Ca 0.12 -1.10 -0.26 0.00 -0.26 0.00 0.00 60.65 59.15 1mj2 s ILE 24 Cb -0.13 -1.17 -0.01 0.00 1.25 0.00 0.00 42.46 42.41 1mj2 s ILE 24 CO 0.02 0.05 0.86 -0.89 0.24 0.00 0.00 174.94 175.23 1mj2 s THR 25 N -0.87 4.84 -0.15 8.37 2.01 -1.26 -5.03 115.64 123.55 1mj2 s THR 25 Ca 0.03 1.69 -0.00 0.00 0.31 0.00 0.00 61.69 63.72 1mj2 s THR 25 Cb -0.08 -4.16 -0.01 0.00 0.01 0.00 0.00 72.50 68.26 1mj2 s THR 25 CO 0.02 -0.02 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.10 1mj2 s VAL 26 N 2.40 2.88 -0.28 3.82 1.01 -1.26 -5.09 120.40 123.88 1mj2 s VAL 26 Ca 0.39 -0.70 -0.23 0.00 0.00 0.00 0.00 61.98 61.44 1mj2 s VAL 26 Cb -0.16 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.99 1mj2 s VAL 26 CO 0.11 0.51 0.74 -0.44 0.00 0.00 0.00 175.10 176.02 1mj2 s SER 27 N 0.68 6.67 -0.07 3.32 0.01 -1.26 -5.04 113.70 118.01 1mj2 s SER 27 Ca -0.07 0.74 0.01 0.00 1.31 0.00 0.00 55.95 57.94 1mj2 s SER 27 Cb -0.15 -2.39 0.02 0.00 0.21 0.00 0.00 66.02 63.71 1mj2 s SER 27 CO 0.02 -0.52 -0.07 -0.51 0.41 0.00 0.00 173.24 172.58 1mj2 s ILE 28 N 2.78 0.80 0.17 1.44 2.07 -1.26 -5.11 121.20 122.09 1mj2 s ILE 28 Ca 0.31 -0.23 -0.32 0.00 -1.41 0.00 0.00 60.65 59.00 1mj2 s ILE 28 Cb -0.15 -0.80 -0.11 0.00 0.13 0.00 0.00 42.46 41.53 1mj2 s ILE 28 CO 0.10 0.30 1.69 -2.84 -1.91 0.00 0.00 174.94 172.27 1mj2 s PRO 29 N 1.13 4.16 0.23 3.50 0.02 -1.26 -4.73 135.00 138.05 1mj2 s PRO 29 Ca -0.07 2.51 0.05 0.00 0.02 0.00 0.00 61.00 63.52 1mj2 s PRO 29 Cb -0.14 -3.21 0.66 0.00 0.02 0.00 0.00 34.50 31.83 1mj2 s PRO 29 CO -0.01 -0.72 1.09 1.28 -0.33 0.00 0.00 177.00 178.31 1mj2 n LEU 30 N 4.34 0.02 -0.18 -5.54 4.77 -1.26 0.76 117.00 119.91 1mj2 n LEU 30 Ca 0.16 1.17 -0.07 0.00 -0.03 0.00 0.00 56.01 57.24 1mj2 n LEU 30 Cb 0.37 -0.47 0.03 0.00 -2.33 0.00 0.00 43.42 41.01 1mj2 n LEU 30 CO 0.63 -1.23 1.09 0.50 -1.33 0.00 0.00 177.39 177.06 1mj2 h LYS 31 N 0.00 0.69 -0.13 3.23 3.64 -2.00 -0.18 116.57 121.82 1mj2 h LYS 31 Ca 0.47 -0.04 -0.17 0.00 -1.27 0.00 0.00 60.65 59.64 1mj2 h LYS 31 Cb 1.08 -0.16 0.01 0.00 -0.41 0.00 0.00 32.23 32.75 1mj2 h LYS 31 CO -0.62 0.46 -0.60 0.28 -2.27 0.00 0.00 179.45 176.70 1mj2 h VAL 32 N 0.71 1.33 -0.72 2.00 2.07 -0.01 -2.98 116.25 118.66 1mj2 h VAL 32 Ca 0.19 -1.87 0.07 0.00 0.82 0.00 0.00 66.70 65.92 1mj2 h VAL 32 Cb -0.08 2.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.73 1mj2 h VAL 32 CO -0.05 0.58 0.47 0.25 0.02 0.00 0.00 177.57 178.84 1mj2 h LEU 33 N 0.30 0.63 0.35 2.57 5.85 -0.88 -1.57 115.31 122.56 1mj2 h LEU 33 Ca -0.04 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1mj2 h LEU 33 Cb 1.24 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.14 1mj2 h LEU 33 CO 0.12 0.40 -0.17 0.50 -0.34 0.00 0.00 178.44 178.96 1mj2 h LYS 34 N 0.71 -0.45 -0.73 1.25 3.11 -0.94 0.15 116.57 119.67 1mj2 h LYS 34 Ca 0.32 0.03 0.10 0.00 -2.81 0.00 0.00 60.65 58.28 1mj2 h LYS 34 Cb 0.32 0.10 -0.07 0.00 -1.00 0.00 0.00 32.23 31.57 1mj2 h LYS 34 CO -0.11 -0.23 0.37 0.82 -2.81 0.00 0.00 179.45 177.49 1mj2 h ILE 35 N -0.58 0.84 -0.27 2.00 2.04 -1.25 -0.57 117.51 119.73 1mj2 h ILE 35 Ca -0.05 -0.21 -0.05 0.00 1.00 0.00 0.00 64.86 65.55 1mj2 h ILE 35 Cb 0.43 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 1mj2 h ILE 35 CO 0.08 0.11 -0.03 0.25 0.00 0.00 0.00 178.15 178.56 1mj2 h LEU 36 N 0.62 0.50 -1.09 1.44 5.85 -1.17 -1.83 115.31 119.62 1mj2 h LEU 36 Ca 0.36 -0.34 -0.09 0.00 0.84 0.00 0.00 57.88 58.65 1mj2 h LEU 36 Cb 0.38 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1mj2 h LEU 36 CO -0.27 0.72 -0.42 0.74 -0.34 0.00 0.00 178.44 178.87 1mj2 h THR 37 N 0.26 1.15 -0.03 1.05 2.02 -0.63 -1.75 112.91 114.99 1mj2 h THR 37 Ca 0.07 -1.51 -0.16 0.00 0.77 0.00 0.00 66.41 65.58 1mj2 h THR 37 Cb 0.49 1.85 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 1mj2 h THR 37 CO 0.02 0.41 -0.70 0.44 0.37 0.00 0.00 175.52 176.06 1mj2 h ASP 38 N 0.00 0.21 0.43 4.18 3.32 -0.99 -0.97 116.42 122.60 1mj2 h ASP 38 Ca -0.00 -0.14 -0.20 0.00 0.02 0.00 0.00 57.03 56.70 1mj2 h ASP 38 Cb 0.81 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.30 1mj2 h ASP 38 CO 0.05 0.84 -0.87 -0.08 -1.72 0.00 0.00 179.24 177.47 1mj2 h GLU 39 N 0.12 0.31 -0.41 3.56 4.57 -0.93 -0.68 114.58 121.12 1mj2 h GLU 39 Ca -0.02 -0.32 -0.11 0.00 -1.18 0.00 0.00 59.36 57.73 1mj2 h GLU 39 Cb 1.25 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.91 1mj2 h GLU 39 CO 0.10 1.01 -0.18 -0.09 -1.18 0.00 0.00 179.01 178.68 1mj2 h ARG 40 N 0.18 0.79 0.08 1.92 2.43 -1.19 -1.41 114.38 117.17 1mj2 h ARG 40 Ca -0.06 -0.30 -0.00 0.00 -0.81 0.00 0.00 59.98 58.81 1mj2 h ARG 40 Cb 1.49 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.99 1mj2 h ARG 40 CO 0.14 0.91 -0.04 1.15 -1.51 0.00 0.00 179.97 180.63 1mj2 h THR 41 N 0.70 0.92 -0.87 0.20 2.02 -1.06 -1.03 112.91 113.79 1mj2 h THR 41 Ca 0.10 -0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.32 1mj2 h THR 41 Cb 0.68 0.93 -0.05 0.00 -1.74 0.00 0.00 68.15 67.96 1mj2 h THR 41 CO 0.05 0.00 0.56 -0.09 0.37 0.00 0.00 175.52 176.41 1mj2 h ARG 42 N -0.10 1.05 -0.73 6.66 2.43 -0.80 0.16 114.38 123.04 1mj2 h ARG 42 Ca -0.01 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.07 1mj2 h ARG 42 Cb 0.08 -0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 29.36 1mj2 h ARG 42 CO 0.02 0.69 0.34 0.00 -1.51 0.00 0.00 179.97 179.51 1mj2 h ARG 43 N 1.08 1.06 -0.13 0.20 3.08 -0.90 -1.25 114.38 117.52 1mj2 h ARG 43 Ca 0.35 -0.16 -0.02 0.00 0.07 0.00 0.00 59.98 60.22 1mj2 h ARG 43 Cb 0.04 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 1mj2 h ARG 43 CO -0.13 0.84 -0.01 0.87 -1.07 0.00 0.00 179.97 180.48 1mj2 h LYS 44 N 1.03 0.23 -0.72 0.04 1.57 -0.62 0.17 116.57 118.27 1mj2 h LYS 44 Ca 0.25 -0.07 0.16 0.00 -1.87 0.00 0.00 60.65 59.11 1mj2 h LYS 44 Cb 0.13 -0.02 -0.11 0.00 0.08 0.00 0.00 32.23 32.31 1mj2 h LYS 44 CO -0.03 0.48 0.14 0.28 -0.57 0.00 0.00 179.45 179.74 1mj2 h VAL 45 N -0.05 0.49 -0.30 0.50 2.07 -0.43 0.15 116.25 118.67 1mj2 h VAL 45 Ca 0.04 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1mj2 h VAL 45 Cb 0.38 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1mj2 h VAL 45 CO 0.01 0.04 0.00 0.59 0.02 0.00 0.00 177.57 178.23 1mj2 n ASN 46 N -5.20 2.53 -3.84 0.57 4.13 -0.49 -4.93 115.26 108.03 1mj2 n ASN 46 Ca 0.13 -2.22 -0.35 0.00 1.68 0.00 0.00 54.58 53.82 1mj2 n ASN 46 Cb 0.45 -0.41 0.03 0.00 -1.54 0.00 0.00 39.78 38.30 1mj2 n ASN 46 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1mj2 n ASN 47 N 0.39 -4.24 -4.79 6.41 3.02 0.52 -4.96 115.26 111.60 1mj2 n ASN 47 Ca 0.12 -1.11 -0.22 0.00 -0.03 0.00 0.00 54.58 53.34 1mj2 n ASN 47 Cb 0.49 -2.80 -0.05 0.00 -0.61 0.00 0.00 39.78 36.81 1mj2 n ASN 47 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1mj2 s LEU 48 N -6.85 3.36 0.69 3.41 1.43 0.55 -4.95 118.68 116.33 1mj2 s LEU 48 Ca 0.42 -0.71 -0.10 0.00 -1.03 0.00 0.00 54.13 52.70 1mj2 s LEU 48 Cb -0.18 -1.89 0.02 0.00 0.03 0.00 0.00 46.19 44.17 1mj2 s LEU 48 CO 0.90 -0.38 1.05 -0.13 0.23 0.00 0.00 176.35 178.03 1mj2 s ARG 49 N -3.93 2.77 -1.45 1.70 0.52 0.33 -4.21 118.95 114.68 1mj2 s ARG 49 Ca 0.40 0.29 -0.08 0.00 -0.52 0.00 0.00 55.73 55.83 1mj2 s ARG 49 Cb -0.03 -2.08 0.05 0.00 0.52 0.00 0.00 34.95 33.41 1mj2 s ARG 49 CO 0.24 -1.01 0.79 0.72 0.02 0.00 0.00 175.30 176.07 1mj2 n HIS 50 N -2.93 -2.04 -1.95 -0.53 8.25 -1.26 -4.85 115.22 109.92 1mj2 n HIS 50 Ca 0.06 0.85 -0.40 0.00 -0.26 0.00 0.00 57.72 57.97 1mj2 n HIS 50 Cb 0.58 -4.00 -0.01 0.00 1.12 0.00 0.00 29.99 27.68 1mj2 n HIS 50 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1mj2 n ALA 51 N -4.48 6.56 -2.83 -1.41 0.00 -1.26 -4.55 120.51 112.53 1mj2 n ALA 51 Ca -0.12 -4.04 -0.09 0.00 0.00 0.00 0.00 53.44 49.19 1mj2 n ALA 51 Cb 0.60 -2.95 -0.11 0.00 0.00 0.00 0.00 19.45 16.99 1mj2 n ALA 51 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1mj2 s THR 52 N -0.10 0.20 0.20 0.00 -4.23 -1.26 -4.82 115.64 105.62 1mj2 s THR 52 Ca 0.53 -1.07 -0.10 0.00 -1.18 0.00 0.00 61.69 59.87 1mj2 s THR 52 Cb 0.16 -0.50 0.14 0.00 1.34 0.00 0.00 72.50 73.64 1mj2 s THR 52 CO -0.07 -0.55 1.81 0.78 -0.54 0.00 0.00 174.62 176.05 1mj2 h ASN 53 N 4.40 0.92 -0.31 3.99 2.35 -1.90 -2.14 115.58 122.90 1mj2 h ASN 53 Ca -0.33 -0.11 0.05 0.00 -0.55 0.00 0.00 56.30 55.36 1mj2 h ASN 53 Cb 1.20 -0.24 -0.05 0.00 0.05 0.00 0.00 38.32 39.29 1mj2 h ASN 53 CO 0.45 0.77 0.03 0.28 -1.65 0.00 0.00 177.43 177.30 1mj2 h SER 54 N 1.01 -0.06 -0.48 5.81 0.02 -1.96 -1.12 113.55 116.77 1mj2 h SER 54 Ca 0.26 0.06 -0.11 0.00 -0.84 0.00 0.00 61.79 61.16 1mj2 h SER 54 Cb 0.06 0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 1mj2 h SER 54 CO -0.04 0.01 -0.11 -0.33 -1.14 0.00 0.00 176.83 175.22 1mj2 h GLU 55 N 0.13 0.96 -0.79 3.45 5.08 -1.82 -1.63 114.58 119.96 1mj2 h GLU 55 Ca 0.15 -0.34 0.02 0.00 -1.00 0.00 0.00 59.36 58.18 1mj2 h GLU 55 Cb 0.18 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 1mj2 h GLU 55 CO -0.22 1.01 0.51 -0.07 -1.00 0.00 0.00 179.01 179.24 1mj2 h LEU 56 N 0.86 0.88 -0.44 1.33 3.38 -1.05 -0.59 115.31 119.68 1mj2 h LEU 56 Ca 0.14 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.98 1mj2 h LEU 56 Cb 0.65 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1mj2 h LEU 56 CO 0.05 0.62 -0.15 -0.07 0.09 0.00 0.00 178.44 178.98 1mj2 h LEU 57 N 1.03 0.88 -0.24 1.67 3.38 -0.87 -1.11 115.31 120.06 1mj2 h LEU 57 Ca 0.30 -0.38 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1mj2 h LEU 57 Cb -0.07 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 1mj2 h LEU 57 CO -0.08 1.06 0.02 0.00 0.09 0.00 0.00 178.44 179.52 1mj2 h GLU 59 N 0.20 -0.21 -0.31 0.00 5.08 -1.08 -1.24 114.58 117.03 1mj2 h GLU 59 Ca 0.07 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.49 1mj2 h GLU 59 Cb 0.38 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 1mj2 h GLU 59 CO 0.01 -0.14 0.04 0.00 -1.00 0.00 0.00 179.01 177.92 1mj2 h ALA 60 N 0.82 0.31 -0.14 3.43 0.00 -1.03 -1.67 119.26 120.99 1mj2 h ALA 60 Ca 0.10 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1mj2 h ALA 60 Cb 0.35 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1mj2 h ALA 60 CO -0.25 -0.37 0.08 0.35 0.00 0.00 0.00 179.25 179.06 1mj2 h PHE 61 N 0.15 0.18 -0.56 0.00 3.57 -0.80 0.23 116.94 119.71 1mj2 h PHE 61 Ca 0.15 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.65 1mj2 h PHE 61 Cb 0.17 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 1mj2 h PHE 61 CO -0.19 0.17 0.37 -0.07 -2.23 0.00 0.00 178.31 176.36 1mj2 h LEU 62 N 0.14 0.63 0.04 0.59 3.38 -1.04 0.56 115.31 119.61 1mj2 h LEU 62 Ca 0.05 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1mj2 h LEU 62 Cb 0.04 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1mj2 h LEU 62 CO -0.01 0.46 -0.09 -0.74 0.09 0.00 0.00 178.44 178.15 1mj2 h HIS 63 N 0.75 -0.23 -0.20 1.13 2.76 -1.09 0.91 115.15 119.18 1mj2 h HIS 63 Ca 0.21 0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.43 1mj2 h HIS 63 Cb -0.08 0.10 -0.05 0.00 1.55 0.00 0.00 27.41 28.93 1mj2 h HIS 63 CO -0.04 -0.14 -0.14 0.00 -1.30 0.00 0.00 177.93 176.31 1mj2 h ALA 64 N 0.77 0.00 0.14 5.26 0.00 0.17 0.49 119.26 126.09 1mj2 h ALA 64 Ca 0.02 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1mj2 h ALA 64 Cb 0.20 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1mj2 h ALA 64 CO -0.07 -0.57 -0.07 0.35 0.00 0.00 0.00 179.25 178.90 1mj2 h PHE 65 N -0.14 -0.17 0.00 0.00 3.57 0.48 -3.37 116.94 117.31 1mj2 h PHE 65 Ca 0.12 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.51 1mj2 h PHE 65 Cb 0.31 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 1mj2 h PHE 65 CO -0.29 0.29 -0.93 1.79 -2.23 0.00 0.00 178.31 176.94 1mj2 h THR 66 N -0.77 0.46 0.00 4.41 1.35 0.80 -3.48 112.91 115.68 1mj2 h THR 66 Ca -0.02 -1.77 0.00 0.00 -0.55 0.00 0.00 66.41 64.07 1mj2 h THR 66 Cb 0.54 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 69.00 1mj2 h THR 66 CO 0.03 0.26 0.00 0.61 -0.25 0.00 0.00 175.52 176.17 1mj2 n GLY 67 N 1.27 1.12 3.77 5.82 0.00 0.17 -3.91 105.19 113.44 1mj2 n GLY 67 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 1mj2 n GLY 67 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1mj2 s GLN 68 N -0.49 4.16 0.35 1.61 -2.07 -1.25 -4.43 119.66 117.54 1mj2 s GLN 68 Ca 0.00 2.50 -0.28 0.00 -1.82 0.00 0.00 55.36 55.76 1mj2 s GLN 68 Cb 0.00 -3.00 -0.12 0.00 -1.09 0.00 0.00 33.01 28.80 1mj2 s GLN 68 CO 0.00 -0.49 1.31 -2.30 -1.32 0.00 0.00 175.29 172.49 1mj2 n PRO 69 N 0.95 2.17 -2.11 9.60 -0.02 -1.26 -4.19 135.00 140.13 1mj2 n PRO 69 Ca 0.02 0.76 -0.29 0.00 -2.02 0.00 0.00 63.50 61.98 1mj2 n PRO 69 Cb 0.39 -2.37 0.03 0.00 -0.02 0.00 0.00 33.50 31.54 1mj2 n PRO 69 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1mj2 s LEU 70 N -1.19 3.11 0.26 2.45 1.43 -1.26 -4.80 118.68 118.68 1mj2 s LEU 70 Ca 0.56 1.01 -0.11 0.00 -1.03 0.00 0.00 54.13 54.56 1mj2 s LEU 70 Cb -0.55 -3.86 -0.07 0.00 0.03 0.00 0.00 46.19 41.74 1mj2 s LEU 70 CO 0.62 -1.13 0.60 -2.16 0.23 0.00 0.00 176.35 174.51 1mj2 s PRO 71 N -5.17 3.84 0.50 1.29 0.04 -1.26 -4.89 135.00 129.35 1mj2 s PRO 71 Ca 0.55 0.36 0.08 0.00 0.04 0.00 0.00 61.00 62.03 1mj2 s PRO 71 Cb -0.11 -2.59 0.03 0.00 0.04 0.00 0.00 34.50 31.88 1mj2 s PRO 71 CO 0.49 0.26 0.54 0.16 0.04 0.00 0.00 177.00 178.50 1mj2 s ASP 72 N -2.41 5.07 0.23 6.66 1.47 -1.26 -4.92 116.67 121.52 1mj2 s ASP 72 Ca 0.49 -0.84 -0.08 0.00 1.18 0.00 0.00 52.55 53.30 1mj2 s ASP 72 Cb -0.11 -0.09 0.38 0.00 -0.34 0.00 0.00 42.92 42.77 1mj2 s ASP 72 CO 0.21 -0.99 1.65 0.44 0.68 0.00 0.00 175.17 177.16 1mj2 h ASP 73 N 0.63 -0.27 -0.64 2.11 3.32 -1.98 0.45 116.42 120.04 1mj2 h ASP 73 Ca -0.36 0.17 0.13 0.00 0.02 0.00 0.00 57.03 56.99 1mj2 h ASP 73 Cb 1.28 0.30 -0.10 0.00 0.22 0.00 0.00 39.33 41.03 1mj2 h ASP 73 CO 0.50 -0.14 0.10 0.00 -1.72 0.00 0.00 179.24 177.98 1mj2 h ALA 74 N 1.64 0.74 0.00 3.45 0.00 -2.02 0.31 119.26 123.39 1mj2 h ALA 74 Ca 0.38 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.41 1mj2 h ALA 74 Cb 0.64 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1mj2 h ALA 74 CO -0.59 -0.35 -0.20 -0.44 0.00 0.00 0.00 179.25 177.67 1mj2 h ASP 75 N 0.21 0.00 0.00 0.00 3.32 -1.32 -2.62 116.42 116.01 1mj2 h ASP 75 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1mj2 h ASP 75 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 1mj2 h ASP 75 CO -0.48 0.20 0.00 0.18 -1.72 0.00 0.00 179.24 177.42 1mj2 n LEU 76 N -4.20 0.19 -0.00 1.55 4.77 0.11 -2.24 117.00 117.17 1mj2 n LEU 76 Ca -0.02 -0.09 0.01 0.00 -0.03 0.00 0.00 56.01 55.87 1mj2 n LEU 76 Cb 0.27 -0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 1mj2 n LEU 76 CO 0.36 0.05 -0.54 0.54 -1.33 0.00 0.00 177.39 176.47 1mj2 n ARG 77 N -0.39 0.65 -1.85 3.23 1.74 -0.99 0.12 116.66 119.17 1mj2 n ARG 77 Ca 0.00 -0.02 -0.35 0.00 -0.77 0.00 0.00 57.85 56.71 1mj2 n ARG 77 Cb 0.05 -1.06 0.05 0.00 -1.02 0.00 0.00 32.46 30.48 1mj2 n ARG 77 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1mj2 s LYS 78 N -2.15 2.76 0.76 5.56 1.02 -0.95 -4.98 119.74 121.76 1mj2 s LYS 78 Ca -0.01 1.78 -0.09 0.00 0.02 0.00 0.00 55.97 57.66 1mj2 s LYS 78 Cb 0.01 -1.91 0.08 0.00 -0.52 0.00 0.00 37.83 35.50 1mj2 s LYS 78 CO 0.10 -1.36 1.10 -1.21 -0.92 0.00 0.00 175.35 173.06 1mj2 s GLU 79 N -3.53 1.99 0.39 1.68 0.41 -1.26 -4.87 118.70 113.51 1mj2 s GLU 79 Ca 0.76 -0.12 0.11 0.00 -0.41 0.00 0.00 54.97 55.30 1mj2 s GLU 79 Cb -0.29 -2.06 0.81 0.00 -1.78 0.00 0.00 34.13 30.80 1mj2 s GLU 79 CO 0.37 -1.47 1.91 -0.09 -0.49 0.00 0.00 175.26 175.50 1mj2 h ARG 80 N -0.86 0.18 0.00 1.61 2.43 -1.98 -1.11 114.38 114.65 1mj2 h ARG 80 Ca -0.45 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1mj2 h ARG 80 Cb 1.32 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 1mj2 h ARG 80 CO 0.61 0.35 0.43 0.77 -1.51 0.00 0.00 179.97 180.62 1mj2 h SER 81 N 0.17 0.00 -0.45 -3.80 0.02 -2.03 -3.01 113.55 104.45 1mj2 h SER 81 Ca 0.03 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.81 1mj2 h SER 81 Cb 0.40 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 62.79 1mj2 h SER 81 CO 0.03 0.00 -0.45 -0.67 -1.14 0.00 0.00 176.83 174.60 1mj2 n ASP 82 N -2.45 -2.99 -0.03 3.07 2.03 -0.46 -5.03 116.55 110.69 1mj2 n ASP 82 Ca -0.01 -2.93 -0.11 0.00 0.52 0.00 0.00 54.79 52.26 1mj2 n ASP 82 Cb 0.46 1.68 -0.14 0.00 -0.72 0.00 0.00 41.12 42.40 1mj2 n ASP 82 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 1mj2 n GLU 83 N 2.26 0.66 -1.72 -0.67 0.28 -0.96 -4.17 120.64 116.32 1mj2 n GLU 83 Ca 0.13 0.23 -0.62 0.00 -0.16 0.00 0.00 57.16 56.74 1mj2 n GLU 83 Cb 0.60 -1.72 -0.08 0.00 1.43 0.00 0.00 31.44 31.67 1mj2 n GLU 83 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 1mj2 n ILE 84 N -3.08 0.17 -1.65 3.84 5.41 -1.26 -4.80 119.36 117.99 1mj2 n ILE 84 Ca -0.23 -0.03 -0.47 0.00 1.00 0.00 0.00 62.75 63.02 1mj2 n ILE 84 Cb 1.07 -0.89 -0.04 0.00 -0.71 0.00 0.00 39.64 39.07 1mj2 n ILE 84 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1mj2 n PRO 85 N 4.68 1.88 -0.30 0.38 -0.02 -1.26 -4.63 135.00 135.72 1mj2 n PRO 85 Ca 0.28 0.67 0.09 0.00 -2.02 0.00 0.00 63.50 62.52 1mj2 n PRO 85 Cb 0.05 -2.36 0.20 0.00 -0.02 0.00 0.00 33.50 31.37 1mj2 n PRO 85 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1mj2 h GLU 86 N 4.94 0.05 -0.83 -0.52 4.39 -1.93 0.81 114.58 121.49 1mj2 h GLU 86 Ca -0.45 -0.00 0.13 0.00 0.34 0.00 0.00 59.36 59.37 1mj2 h GLU 86 Cb 1.28 -0.01 -0.09 0.00 -0.10 0.00 0.00 28.75 29.83 1mj2 h GLU 86 CO 0.81 0.03 0.44 0.00 -1.16 0.00 0.00 179.01 179.13 1mj2 h ALA 87 N 1.85 1.23 -0.36 3.43 0.00 -1.92 -0.18 119.26 123.31 1mj2 h ALA 87 Ca 0.49 0.07 -0.15 0.00 0.00 0.00 0.00 54.91 55.32 1mj2 h ALA 87 Cb 0.90 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1mj2 h ALA 87 CO -0.82 -0.04 -0.36 0.00 0.00 0.00 0.00 179.25 178.03 1mj2 h ALA 88 N 1.52 0.53 -0.92 0.00 0.00 0.17 -2.58 119.26 117.99 1mj2 h ALA 88 Ca 0.44 -0.44 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1mj2 h ALA 88 Cb 0.56 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1mj2 h ALA 88 CO -0.33 0.61 0.59 0.87 0.00 0.00 0.00 179.25 181.00 1mj2 h LYS 89 N 0.68 1.09 0.55 0.00 1.57 0.65 0.68 116.57 121.80 1mj2 h LYS 89 Ca 0.06 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1mj2 h LYS 89 Cb 0.95 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1mj2 h LYS 89 CO 0.09 0.72 -0.28 1.49 -0.57 0.00 0.00 179.45 180.90 1mj2 h GLU 90 N 1.12 -0.74 -0.20 3.15 4.57 -0.97 0.33 114.58 121.85 1mj2 h GLU 90 Ca 0.38 0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.65 1mj2 h GLU 90 Cb 0.06 0.17 -0.04 0.00 -0.16 0.00 0.00 28.75 28.78 1mj2 h GLU 90 CO -0.14 -0.49 -0.05 0.82 -1.18 0.00 0.00 179.01 177.97 1mj2 h ILE 91 N -0.77 0.79 -0.06 2.32 2.04 -1.13 -0.14 117.51 120.57 1mj2 h ILE 91 Ca -0.07 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.82 1mj2 h ILE 91 Cb 0.60 0.79 -0.06 0.00 -0.74 0.00 0.00 36.82 37.41 1mj2 h ILE 91 CO 0.11 0.00 -0.43 0.24 0.00 0.00 0.00 178.15 178.07 1mj2 h MET 92 N -0.01 -0.53 -0.96 2.37 2.86 -0.73 -0.86 114.93 117.08 1mj2 h MET 92 Ca 0.10 0.04 0.19 0.00 -2.06 0.00 0.00 59.70 57.96 1mj2 h MET 92 Cb 0.15 0.12 -0.09 0.00 0.06 0.00 0.00 31.60 31.84 1mj2 h MET 92 CO -0.21 -0.35 0.61 0.00 1.06 0.00 0.00 176.91 178.02 1mj2 h ARG 93 N -0.55 0.62 -0.09 1.72 3.08 0.03 0.27 114.38 119.47 1mj2 h ARG 93 Ca 0.06 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1mj2 h ARG 93 Cb 0.65 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1mj2 h ARG 93 CO -0.36 0.41 0.00 0.39 -1.07 0.00 0.00 179.97 179.34 1mj2 n GLU 94 N -4.64 1.28 -0.01 0.04 1.02 -0.11 -2.57 120.64 115.65 1mj2 n GLU 94 Ca 0.21 -0.43 0.01 0.00 -0.02 0.00 0.00 57.16 56.93 1mj2 n GLU 94 Cb 0.60 -1.24 0.01 0.00 -0.02 0.00 0.00 31.44 30.79 1mj2 n GLU 94 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1mj2 n MET 95 N -0.28 0.26 -0.45 3.49 2.81 0.69 -4.96 117.12 118.68 1mj2 n MET 95 Ca 0.11 -0.88 0.00 0.00 -1.81 0.00 0.00 57.70 55.12 1mj2 n MET 95 Cb 0.14 -1.04 0.00 0.00 -0.71 0.00 0.00 33.22 31.61 1mj2 n MET 95 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1mj2 n GLY 96 N -0.00 0.74 3.31 3.03 0.00 -0.96 -5.05 105.19 106.25 1mj2 n GLY 96 Ca 0.01 -0.36 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 1mj2 n GLY 96 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mj2 s ILE 97 N -2.00 3.73 -0.45 -0.61 1.01 0.36 -4.97 121.20 118.27 1mj2 s ILE 97 Ca 0.00 -0.81 -0.29 0.00 0.00 0.00 0.00 60.65 59.55 1mj2 s ILE 97 Cb 0.00 -2.94 0.03 0.00 0.01 0.00 0.00 42.46 39.55 1mj2 s ILE 97 CO 0.00 0.07 1.14 0.21 0.00 0.00 0.00 174.94 176.36 1mj2 s ASN 98 N 1.45 6.68 0.44 3.58 3.04 -1.26 -1.64 114.94 127.23 1mj2 s ASN 98 Ca 0.02 0.59 0.21 0.00 0.04 0.00 0.00 52.86 53.71 1mj2 s ASN 98 Cb -0.17 -2.55 1.01 0.00 -1.54 0.00 0.00 41.25 38.00 1mj2 s ASN 98 CO 0.01 -1.19 1.90 1.55 -3.04 0.00 0.00 177.10 176.34 1mj2 h PRO 99 N 9.06 0.00 0.00 0.43 0.13 -1.92 -0.07 132.00 139.63 1mj2 h PRO 99 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1mj2 h PRO 99 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1mj2 h PRO 99 CO 1.11 0.26 0.00 0.93 -0.23 0.00 0.00 178.00 180.07 1mj2 h GLU 100 N 0.00 0.00 0.00 0.86 4.39 -1.96 -2.92 114.58 114.95 1mj2 h GLU 100 Ca -0.00 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 1mj2 h GLU 100 Cb 0.58 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.22 1mj2 h GLU 100 CO 0.03 0.00 -1.60 2.41 -1.16 0.00 0.00 179.01 178.69 1mj2 n THR 101 N -2.54 0.26 -1.69 1.13 -1.04 -0.73 -5.02 114.28 104.64 1mj2 n THR 101 Ca 0.01 -0.33 -0.52 0.00 -2.04 0.00 0.00 64.05 61.17 1mj2 n THR 101 Cb 0.25 -0.10 -0.06 0.00 -1.82 0.00 0.00 70.33 68.61 1mj2 n THR 101 CO 0.00 0.00 0.00 1.87 -0.64 0.00 0.00 175.07 176.30 1mj2 n TRP 102 N -2.08 2.21 -2.83 -1.42 -0.00 -0.12 -4.94 117.44 108.26 1mj2 n TRP 102 Ca -0.07 0.23 -0.42 0.00 -0.00 0.00 0.00 57.50 57.23 1mj2 n TRP 102 Cb 0.49 -2.58 -0.04 0.00 -0.00 0.00 0.00 31.31 29.19 1mj2 n TRP 102 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 177.69 176.48 1mj2 s GLU 103 N 3.73 4.10 0.00 5.87 0.41 -1.26 -5.01 118.70 126.55 1mj2 s GLU 103 Ca 0.95 0.91 0.00 0.00 -0.41 0.00 0.00 54.97 56.42 1mj2 s GLU 103 Cb -0.85 -3.69 0.00 0.00 -1.78 0.00 0.00 34.13 27.82 1mj2 s GLU 103 CO 0.57 -0.65 0.10 2.48 -0.49 0.00 0.00 175.26 177.27