#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mj2 h GLU 2 N 0.00 1.17 -3.28 0.00 4.39 -1.98 -3.41 114.58 111.48 1mj2 h GLU 2 Ca 0.00 -0.10 -0.32 0.00 0.34 0.00 0.00 59.36 59.28 1mj2 h GLU 2 Cb 0.00 -0.25 -0.36 0.00 -0.10 0.00 0.00 28.75 28.04 1mj2 h GLU 2 CO 0.00 0.82 -0.69 -0.46 -1.16 0.00 0.00 179.01 177.52 1mj2 s TRP 3 N -5.88 -0.05 0.46 4.33 -0.00 -1.26 -4.57 118.94 111.97 1mj2 s TRP 3 Ca -0.12 0.37 0.28 0.00 -0.00 0.00 0.00 56.10 56.63 1mj2 s TRP 3 Cb 0.17 -0.31 1.35 0.00 -0.00 0.00 0.00 33.47 34.68 1mj2 s TRP 3 CO 0.81 -0.19 1.74 0.66 -0.00 0.00 0.00 176.95 179.97 1mj2 h SER 4 N 8.04 0.24 0.00 5.86 4.64 -1.82 -3.44 113.55 127.07 1mj2 h SER 4 Ca -0.23 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1mj2 h SER 4 Cb 1.12 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1mj2 h SER 4 CO 0.25 -0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.81 1mj2 n GLY 5 N -1.60 0.68 3.53 -0.77 0.00 -1.26 -4.95 105.19 100.82 1mj2 n GLY 5 Ca 0.29 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.86 4.01 0.19 1.61 2.02 -1.26 -4.76 118.70 119.65 1mj2 s GLU 6 Ca 0.00 -2.22 -0.33 0.00 0.02 0.00 0.00 54.97 52.44 1mj2 s GLU 6 Cb 0.00 -5.31 -0.13 0.00 0.10 0.00 0.00 34.13 28.78 1mj2 s GLU 6 CO 0.00 -2.03 1.58 0.98 0.02 0.00 0.00 175.26 175.81 1mj2 n TYR 7 N 7.18 2.37 -5.13 1.61 9.36 -1.26 -5.00 117.16 126.30 1mj2 n TYR 7 Ca 0.43 0.25 -0.32 0.00 3.32 0.00 0.00 57.90 61.58 1mj2 n TYR 7 Cb 0.45 -2.56 -0.17 0.00 -0.63 0.00 0.00 39.34 36.43 1mj2 n TYR 7 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1mj2 s ILE 8 N 0.77 2.07 -0.02 2.97 1.01 -1.26 -4.78 121.20 121.95 1mj2 s ILE 8 Ca 0.76 -1.01 -0.30 0.00 0.00 0.00 0.00 60.65 60.10 1mj2 s ILE 8 Cb -0.64 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 1mj2 s ILE 8 CO 0.39 0.56 1.19 -0.55 0.00 0.00 0.00 174.94 176.53 1mj2 s SER 9 N 0.42 7.07 0.00 3.58 0.15 -1.26 -4.91 113.70 118.75 1mj2 s SER 9 Ca -0.17 1.86 0.22 0.00 0.70 0.00 0.00 55.95 58.56 1mj2 s SER 9 Cb -0.18 -2.56 1.07 0.00 -1.71 0.00 0.00 66.02 62.64 1mj2 s SER 9 CO 0.07 -0.54 1.72 -2.65 1.20 0.00 0.00 173.24 173.04 1mj2 n PRO 10 N 4.85 0.22 -4.58 5.44 -0.02 -1.26 -4.84 135.00 134.80 1mj2 n PRO 10 Ca 0.10 0.09 -0.27 0.00 -2.02 0.00 0.00 63.50 61.40 1mj2 n PRO 10 Cb 0.46 -1.50 -0.11 0.00 -0.02 0.00 0.00 33.50 32.34 1mj2 n PRO 10 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1mj2 s TYR 11 N -2.71 2.49 0.00 6.00 2.02 -1.26 -4.65 117.35 119.25 1mj2 s TYR 11 Ca 0.18 -0.62 0.02 0.00 -0.37 0.00 0.00 57.07 56.29 1mj2 s TYR 11 Cb 0.15 -1.67 -0.04 0.00 -0.40 0.00 0.00 41.96 40.01 1mj2 s TYR 11 CO 0.36 0.48 -0.03 0.00 -1.57 0.00 0.00 175.55 174.79 1mj2 s ALA 12 N -2.68 3.17 0.08 3.71 0.00 -1.26 -5.06 121.76 119.72 1mj2 s ALA 12 Ca 0.34 -0.98 -0.35 0.00 0.00 0.00 0.00 51.96 50.97 1mj2 s ALA 12 Cb 0.08 -1.25 -0.15 0.00 0.00 0.00 0.00 23.12 21.80 1mj2 s ALA 12 CO 0.18 0.63 1.55 0.39 0.00 0.00 0.00 175.76 178.51 1mj2 n GLU 13 N 1.44 1.76 -1.83 0.00 1.02 -1.26 -4.86 120.64 116.91 1mj2 n GLU 13 Ca -0.15 0.64 -0.38 0.00 -0.02 0.00 0.00 57.16 57.25 1mj2 n GLU 13 Cb 0.53 -2.37 0.04 0.00 -0.02 0.00 0.00 31.44 29.62 1mj2 n GLU 13 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1mj2 s HIS 14 N 1.33 2.31 0.00 -0.32 5.65 -1.26 -2.45 115.29 120.55 1mj2 s HIS 14 Ca 0.84 1.41 0.00 0.00 0.25 0.00 0.00 55.06 57.55 1mj2 s HIS 14 Cb -0.80 -3.74 0.00 0.00 -1.18 0.00 0.00 32.58 26.87 1mj2 s HIS 14 CO 0.44 -2.76 0.00 0.41 -0.65 0.00 0.00 174.74 172.18 1mj2 n GLY 15 N 0.71 1.87 1.28 1.59 0.00 -1.26 -4.52 105.19 104.86 1mj2 n GLY 15 Ca 0.11 -0.20 -0.03 0.00 0.00 0.00 0.00 46.02 45.90 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 1.14 0.03 1.61 5.02 -1.03 -3.87 118.16 121.07 1mj2 n LYS 16 Ca 0.00 -0.31 -0.06 0.00 -2.02 0.00 0.00 58.31 55.91 1mj2 n LYS 16 Cb 0.00 -1.12 -0.11 0.00 -0.02 0.00 0.00 35.03 33.77 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 0.44 0.00 0.00 1.97 1.57 -1.71 -2.85 116.57 115.98 1mj2 h LYS 17 Ca 0.06 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.73 1mj2 h LYS 17 Cb 1.12 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.41 1mj2 h LYS 17 CO 0.13 0.74 -0.53 0.77 -0.57 0.00 0.00 179.45 179.99 1mj2 h SER 18 N 0.00 0.00 0.00 0.86 0.02 -1.90 -2.38 113.55 110.15 1mj2 h SER 18 Ca -0.12 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.82 1mj2 h SER 18 Cb 1.82 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.36 1mj2 h SER 18 CO 0.10 0.53 -0.14 -0.33 -1.14 0.00 0.00 176.83 175.85 1mj2 h GLU 19 N 0.00 0.00 -0.06 3.45 5.08 -1.86 -3.38 114.58 117.81 1mj2 h GLU 19 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1mj2 h GLU 19 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1mj2 h GLU 19 CO 0.07 0.45 0.00 1.04 -1.00 0.00 0.00 179.01 179.57 1mj2 n GLN 20 N -4.68 1.21 -4.93 2.33 6.02 -1.08 -4.86 117.38 111.40 1mj2 n GLN 20 Ca -0.07 -0.32 -0.28 0.00 -0.01 0.00 0.00 57.00 56.32 1mj2 n GLN 20 Cb 0.25 -1.24 -0.17 0.00 1.02 0.00 0.00 30.24 30.11 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 -1.92 1.61 0.26 5.09 1.01 -0.90 -4.96 120.40 120.59 1mj2 s VAL 21 Ca 0.21 -0.78 0.06 0.00 0.00 0.00 0.00 61.98 61.48 1mj2 s VAL 21 Cb 0.10 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 1mj2 s VAL 21 CO 0.17 0.46 0.27 -0.54 0.00 0.00 0.00 175.10 175.46 1mj2 s LYS 22 N 0.33 3.09 -0.19 2.72 3.01 -1.26 -4.86 119.74 122.57 1mj2 s LYS 22 Ca -0.13 -0.97 0.01 0.00 -1.01 0.00 0.00 55.97 53.87 1mj2 s LYS 22 Cb -0.15 -2.68 0.02 0.00 -1.01 0.00 0.00 37.83 34.01 1mj2 s LYS 22 CO 0.05 0.37 -0.18 0.15 0.51 0.00 0.00 175.35 176.25 1mj2 s LYS 23 N -3.92 2.96 0.12 1.68 -0.14 -1.26 -5.12 119.74 114.06 1mj2 s LYS 23 Ca 0.35 -0.86 0.09 0.00 -1.36 0.00 0.00 55.97 54.19 1mj2 s LYS 23 Cb -0.08 -2.63 -0.04 0.00 -1.68 0.00 0.00 37.83 33.39 1mj2 s LYS 23 CO 0.27 -0.24 -0.19 0.96 -0.76 0.00 0.00 175.35 175.38 1mj2 s ILE 24 N 1.29 2.77 -0.33 2.17 -4.36 -1.26 -5.09 121.20 116.38 1mj2 s ILE 24 Ca 0.04 -1.53 -0.18 0.00 -0.26 0.00 0.00 60.65 58.72 1mj2 s ILE 24 Cb -0.14 -2.26 -0.01 0.00 1.25 0.00 0.00 42.46 41.30 1mj2 s ILE 24 CO -0.12 0.10 0.52 -0.89 0.24 0.00 0.00 174.94 174.80 1mj2 s THR 25 N -1.13 5.01 -0.13 8.37 2.01 -1.26 -5.05 115.64 123.47 1mj2 s THR 25 Ca 0.17 0.46 -0.02 0.00 0.31 0.00 0.00 61.69 62.62 1mj2 s THR 25 Cb -0.10 -3.95 -0.02 0.00 0.01 0.00 0.00 72.50 68.43 1mj2 s THR 25 CO 0.09 -0.17 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.10 1mj2 s VAL 26 N 2.41 3.64 -0.09 3.82 1.01 -1.26 -5.10 120.40 124.82 1mj2 s VAL 26 Ca 0.20 -0.46 -0.17 0.00 0.00 0.00 0.00 61.98 61.54 1mj2 s VAL 26 Cb -0.15 -2.55 -0.05 0.00 0.00 0.00 0.00 36.38 33.63 1mj2 s VAL 26 CO 0.13 0.53 0.46 -0.44 0.00 0.00 0.00 175.10 175.77 1mj2 s SER 27 N 0.08 6.71 -0.07 3.32 0.01 -1.26 -5.06 113.70 117.42 1mj2 s SER 27 Ca -0.02 0.84 -0.03 0.00 1.31 0.00 0.00 55.95 58.05 1mj2 s SER 27 Cb -0.14 -2.28 0.04 0.00 0.21 0.00 0.00 66.02 63.86 1mj2 s SER 27 CO 0.03 0.08 0.16 -0.51 0.41 0.00 0.00 173.24 173.42 1mj2 s ILE 28 N 0.21 -0.08 0.59 1.44 2.07 -1.26 -5.14 121.20 119.04 1mj2 s ILE 28 Ca 0.25 0.20 -0.19 0.00 -1.41 0.00 0.00 60.65 59.49 1mj2 s ILE 28 Cb -0.15 -0.27 -0.04 0.00 0.13 0.00 0.00 42.46 42.13 1mj2 s ILE 28 CO 0.11 0.08 1.19 -2.65 -1.91 0.00 0.00 174.94 171.76 1mj2 n PRO 29 N 4.37 1.21 -0.34 3.50 -0.02 -1.26 -4.76 135.00 137.70 1mj2 n PRO 29 Ca -0.24 0.46 0.01 0.00 -2.02 0.00 0.00 63.50 61.72 1mj2 n PRO 29 Cb 0.52 -2.40 0.17 0.00 -0.02 0.00 0.00 33.50 31.76 1mj2 n PRO 29 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1mj2 h LEU 30 N 0.81 1.04 -1.18 2.45 3.38 -2.00 -0.76 115.31 119.05 1mj2 h LEU 30 Ca -0.50 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.45 1mj2 h LEU 30 Cb 1.34 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.82 1mj2 h LEU 30 CO 0.54 0.71 0.34 0.11 0.09 0.00 0.00 178.44 180.23 1mj2 h LYS 31 N 1.20 0.91 -0.10 1.13 1.57 -2.00 -0.96 116.57 118.32 1mj2 h LYS 31 Ca 0.38 -0.10 -0.15 0.00 -1.87 0.00 0.00 60.65 58.90 1mj2 h LYS 31 Cb 0.01 -0.18 0.01 0.00 0.08 0.00 0.00 32.23 32.15 1mj2 h LYS 31 CO -0.12 0.68 -0.54 0.28 -0.57 0.00 0.00 179.45 179.19 1mj2 h VAL 32 N 0.92 1.36 -0.62 0.50 2.07 -1.77 -3.07 116.25 115.64 1mj2 h VAL 32 Ca 0.23 -1.86 0.06 0.00 0.82 0.00 0.00 66.70 65.96 1mj2 h VAL 32 Cb 0.05 2.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 1mj2 h VAL 32 CO -0.03 0.56 0.41 0.25 0.02 0.00 0.00 177.57 178.77 1mj2 h LEU 33 N 0.15 0.53 -0.26 2.57 5.85 -0.73 -0.46 115.31 122.95 1mj2 h LEU 33 Ca -0.04 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.61 1mj2 h LEU 33 Cb 1.19 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 1mj2 h LEU 33 CO 0.11 0.34 -0.13 0.50 -0.34 0.00 0.00 178.44 178.92 1mj2 h LYS 34 N 0.60 0.55 -0.67 1.25 3.64 -1.15 -0.36 116.57 120.44 1mj2 h LYS 34 Ca 0.27 -0.25 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1mj2 h LYS 34 Cb 0.28 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 1mj2 h LYS 34 CO -0.08 0.81 0.37 0.82 -2.27 0.00 0.00 179.45 179.10 1mj2 h ILE 35 N 0.28 1.21 -0.04 2.00 2.04 -1.26 0.61 117.51 122.36 1mj2 h ILE 35 Ca 0.06 -0.52 -0.00 0.00 1.00 0.00 0.00 64.86 65.40 1mj2 h ILE 35 Cb 0.65 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1mj2 h ILE 35 CO 0.04 0.23 0.02 0.25 0.00 0.00 0.00 178.15 178.69 1mj2 h LEU 36 N 0.91 0.06 -0.72 1.44 5.85 -1.00 -2.18 115.31 119.68 1mj2 h LEU 36 Ca 0.24 -0.09 -0.12 0.00 0.84 0.00 0.00 57.88 58.75 1mj2 h LEU 36 Cb 0.04 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1mj2 h LEU 36 CO -0.04 0.13 -0.30 0.74 -0.34 0.00 0.00 178.44 178.63 1mj2 h THR 37 N -0.02 1.28 -0.69 1.05 2.02 -0.90 -2.15 112.91 113.51 1mj2 h THR 37 Ca 0.02 -1.42 -0.05 0.00 0.77 0.00 0.00 66.41 65.73 1mj2 h THR 37 Cb 0.09 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 1mj2 h THR 37 CO -0.00 0.46 0.23 0.44 0.37 0.00 0.00 175.52 177.02 1mj2 h ASP 38 N 0.56 0.97 0.34 4.18 3.32 -0.78 0.38 116.42 125.38 1mj2 h ASP 38 Ca 0.07 -0.16 -0.11 0.00 0.02 0.00 0.00 57.03 56.85 1mj2 h ASP 38 Cb 0.79 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 1mj2 h ASP 38 CO 0.07 0.89 -0.46 -0.08 -1.72 0.00 0.00 179.24 177.94 1mj2 h GLU 39 N 1.01 0.16 -0.27 3.56 4.57 -1.18 -0.41 114.58 122.02 1mj2 h GLU 39 Ca 0.23 -0.08 -0.04 0.00 -1.18 0.00 0.00 59.36 58.28 1mj2 h GLU 39 Cb 0.26 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 1mj2 h GLU 39 CO -0.01 0.59 -0.00 -0.09 -1.18 0.00 0.00 179.01 178.31 1mj2 h ARG 40 N 0.13 0.47 -0.24 1.92 2.43 -0.66 -2.25 114.38 116.18 1mj2 h ARG 40 Ca 0.01 -0.15 0.03 0.00 -0.81 0.00 0.00 59.98 59.05 1mj2 h ARG 40 Cb 0.87 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.35 1mj2 h ARG 40 CO 0.07 0.64 0.06 1.15 -1.51 0.00 0.00 179.97 180.37 1mj2 h THR 41 N 0.25 0.91 -0.64 0.20 2.02 -0.69 -0.63 112.91 114.34 1mj2 h THR 41 Ca 0.07 -0.05 0.12 0.00 0.77 0.00 0.00 66.41 67.32 1mj2 h THR 41 Cb 0.43 0.74 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 1mj2 h THR 41 CO 0.01 0.03 0.43 -0.09 0.37 0.00 0.00 175.52 176.27 1mj2 h ARG 42 N 0.16 0.37 -0.02 6.66 2.43 -0.91 -0.59 114.38 122.47 1mj2 h ARG 42 Ca 0.11 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.15 1mj2 h ARG 42 Cb 0.09 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1mj2 h ARG 42 CO -0.13 0.24 -0.39 0.00 -1.51 0.00 0.00 179.97 178.18 1mj2 h ARG 43 N 0.38 0.30 0.04 0.20 3.08 -0.69 -3.15 114.38 114.54 1mj2 h ARG 43 Ca 0.30 -0.30 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1mj2 h ARG 43 Cb 0.67 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.79 1mj2 h ARG 43 CO -0.08 0.98 -0.04 -0.22 -1.07 0.00 0.00 179.97 179.53 1mj2 h LYS 44 N -0.26 -0.09 0.00 0.04 1.63 -0.37 -0.20 116.57 117.32 1mj2 h LYS 44 Ca -0.04 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1mj2 h LYS 44 Cb 1.10 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.75 1mj2 h LYS 44 CO 0.08 -0.06 0.00 1.33 -3.45 0.00 0.00 179.45 177.35 1mj2 n VAL 45 N -5.15 0.42 -0.57 2.00 0.24 -0.30 -1.85 118.33 113.13 1mj2 n VAL 45 Ca -0.07 0.11 0.07 0.00 -2.04 0.00 0.00 64.34 62.40 1mj2 n VAL 45 Cb 0.08 -0.81 0.17 0.00 -1.47 0.00 0.00 33.84 31.82 1mj2 n VAL 45 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1mj2 n ASN 46 N -1.26 3.10 -3.78 -1.34 4.13 -1.01 -4.98 115.26 110.12 1mj2 n ASN 46 Ca 0.09 -2.52 -0.26 0.00 1.68 0.00 0.00 54.58 53.58 1mj2 n ASN 46 Cb 0.14 -0.34 0.04 0.00 -1.54 0.00 0.00 39.78 38.07 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 -0.24 -3.54 -4.75 6.41 3.02 -0.77 -4.98 115.26 110.42 1mj2 n ASN 47 Ca 0.14 -0.76 -0.31 0.00 -0.03 0.00 0.00 54.58 53.62 1mj2 n ASN 47 Cb 0.61 -4.13 -0.07 0.00 -0.61 0.00 0.00 39.78 35.57 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 -7.03 3.72 0.94 3.41 1.43 -0.12 -4.88 118.68 116.15 1mj2 s LEU 48 Ca 0.39 -0.00 -0.12 0.00 -1.03 0.00 0.00 54.13 53.36 1mj2 s LEU 48 Cb -0.19 -2.32 0.15 0.00 0.03 0.00 0.00 46.19 43.87 1mj2 s LEU 48 CO 0.81 0.21 1.10 -0.13 0.23 0.00 0.00 176.35 178.57 1mj2 s ARG 49 N -2.10 0.91 -1.34 1.70 0.52 -0.60 -4.20 118.95 113.85 1mj2 s ARG 49 Ca 0.26 0.55 -0.03 0.00 -0.52 0.00 0.00 55.73 55.99 1mj2 s ARG 49 Cb -0.12 -1.79 0.02 0.00 0.52 0.00 0.00 34.95 33.58 1mj2 s ARG 49 CO 0.18 -2.41 0.83 0.72 0.02 0.00 0.00 175.30 174.64 1mj2 n HIS 50 N -3.96 -2.09 -2.33 -0.53 8.25 -1.26 -4.90 115.22 108.40 1mj2 n HIS 50 Ca 0.06 0.88 -0.42 0.00 -0.26 0.00 0.00 57.72 57.98 1mj2 n HIS 50 Cb 0.57 -4.46 0.00 0.00 1.12 0.00 0.00 29.99 27.22 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 -4.38 5.83 -3.08 -1.41 0.00 -1.26 -4.63 120.51 111.57 1mj2 n ALA 51 Ca -0.21 -4.32 -0.11 0.00 0.00 0.00 0.00 53.44 48.79 1mj2 n ALA 51 Cb 0.64 -2.80 -0.11 0.00 0.00 0.00 0.00 19.45 17.18 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 -0.71 0.06 0.23 0.00 -4.23 -1.26 -4.84 115.64 104.90 1mj2 s THR 52 Ca 0.43 -0.52 -0.07 0.00 -1.18 0.00 0.00 61.69 60.35 1mj2 s THR 52 Cb 0.12 -0.37 0.20 0.00 1.34 0.00 0.00 72.50 73.79 1mj2 s THR 52 CO -0.02 -0.29 1.87 0.78 -0.54 0.00 0.00 174.62 176.43 1mj2 h ASN 53 N 4.71 0.89 -0.41 3.99 4.21 -1.90 -1.87 115.58 125.20 1mj2 h ASN 53 Ca -0.29 -0.00 0.01 0.00 1.21 0.00 0.00 56.30 57.23 1mj2 h ASN 53 Cb 1.20 -0.19 -0.02 0.00 -1.12 0.00 0.00 38.32 38.18 1mj2 h ASN 53 CO 0.41 0.61 0.26 0.28 -1.29 0.00 0.00 177.43 177.69 1mj2 h SER 54 N 1.04 0.43 -0.40 5.81 0.02 -1.97 -1.67 113.55 116.82 1mj2 h SER 54 Ca 0.35 -0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.23 1mj2 h SER 54 Cb 0.04 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 1mj2 h SER 54 CO -0.13 0.31 0.02 -0.33 -1.14 0.00 0.00 176.83 175.56 1mj2 h GLU 55 N 0.52 0.69 -0.82 3.45 5.08 -1.81 0.08 114.58 121.77 1mj2 h GLU 55 Ca 0.16 -0.21 0.12 0.00 -1.00 0.00 0.00 59.36 58.43 1mj2 h GLU 55 Cb -0.03 -0.07 -0.08 0.00 0.50 0.00 0.00 28.75 29.07 1mj2 h GLU 55 CO -0.06 0.77 0.43 -0.07 -1.00 0.00 0.00 179.01 179.08 1mj2 h LEU 56 N 0.53 0.55 -0.34 1.33 3.38 -1.06 0.20 115.31 119.91 1mj2 h LEU 56 Ca 0.12 0.07 -0.13 0.00 0.09 0.00 0.00 57.88 58.03 1mj2 h LEU 56 Cb 0.44 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1mj2 h LEU 56 CO 0.02 0.27 -0.30 -0.07 0.09 0.00 0.00 178.44 178.45 1mj2 h LEU 57 N 0.66 0.85 -0.61 1.67 3.38 -0.94 -2.26 115.31 118.06 1mj2 h LEU 57 Ca 0.42 -0.46 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1mj2 h LEU 57 Cb 0.52 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1mj2 h LEU 57 CO -0.32 1.13 0.15 0.00 0.09 0.00 0.00 178.44 179.50 1mj2 h GLU 59 N 0.90 -0.85 -1.00 0.00 5.08 -0.62 -2.94 114.58 115.15 1mj2 h GLU 59 Ca 0.19 0.06 0.10 0.00 -1.00 0.00 0.00 59.36 58.71 1mj2 h GLU 59 Cb 0.35 0.19 -0.08 0.00 0.50 0.00 0.00 28.75 29.72 1mj2 h GLU 59 CO 0.00 -0.56 0.64 0.00 -1.00 0.00 0.00 179.01 178.09 1mj2 h ALA 60 N -0.59 1.49 -0.14 3.43 0.00 -1.34 -1.04 119.26 121.07 1mj2 h ALA 60 Ca -0.09 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1mj2 h ALA 60 Cb 0.69 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1mj2 h ALA 60 CO 0.15 0.29 0.07 0.35 0.00 0.00 0.00 179.25 180.12 1mj2 h PHE 61 N 1.05 0.20 -0.55 0.00 3.57 -1.22 0.20 116.94 120.19 1mj2 h PHE 61 Ca 0.47 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.93 1mj2 h PHE 61 Cb 0.38 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 1mj2 h PHE 61 CO -0.00 0.23 0.20 -0.07 -2.23 0.00 0.00 178.31 176.43 1mj2 h LEU 62 N 0.12 0.73 -0.24 0.59 3.38 -1.29 0.36 115.31 118.96 1mj2 h LEU 62 Ca 0.05 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1mj2 h LEU 62 Cb 0.09 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1mj2 h LEU 62 CO -0.01 0.67 0.01 -0.74 0.09 0.00 0.00 178.44 178.46 1mj2 h HIS 63 N 0.79 0.45 -0.33 1.13 2.76 -0.80 -1.27 115.15 117.88 1mj2 h HIS 63 Ca 0.18 -0.08 -0.05 0.00 -2.20 0.00 0.00 60.37 58.23 1mj2 h HIS 63 Cb 0.19 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 1mj2 h HIS 63 CO 0.01 0.58 0.01 0.00 -1.30 0.00 0.00 177.93 177.23 1mj2 h ALA 64 N 0.81 0.44 -0.33 5.26 0.00 0.02 0.24 119.26 125.70 1mj2 h ALA 64 Ca 0.07 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 54.57 1mj2 h ALA 64 Cb 0.40 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1mj2 h ALA 64 CO 0.01 0.18 -0.47 0.35 0.00 0.00 0.00 179.25 179.32 1mj2 h PHE 65 N 0.38 1.10 0.00 0.00 3.57 -0.31 -3.37 116.94 118.30 1mj2 h PHE 65 Ca 0.09 -0.36 0.00 0.00 3.53 0.00 0.00 57.97 61.23 1mj2 h PHE 65 Cb 0.42 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.95 1mj2 h PHE 65 CO 0.03 1.19 -0.61 0.25 -2.23 0.00 0.00 178.31 176.94 1mj2 n THR 66 N -4.03 0.00 -0.78 4.41 -2.24 -0.48 -5.00 114.28 106.16 1mj2 n THR 66 Ca -0.03 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1mj2 n THR 66 Cb 0.59 0.87 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 1mj2 n THR 66 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mj2 n GLY 67 N 1.35 0.81 3.71 3.38 0.00 0.85 -4.40 105.19 110.89 1mj2 n GLY 67 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1mj2 n GLY 67 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1mj2 n GLN 68 N -2.24 2.81 -1.75 1.61 7.27 -1.24 -4.74 117.38 119.10 1mj2 n GLN 68 Ca 0.00 1.01 -0.40 0.00 0.07 0.00 0.00 57.00 57.69 1mj2 n GLN 68 Cb 0.00 -2.87 0.02 0.00 2.41 0.00 0.00 30.24 29.80 1mj2 n GLN 68 CO 0.00 0.00 0.00 -2.30 0.07 0.00 0.00 177.06 174.83 1mj2 n PRO 69 N 4.35 2.08 -2.78 3.69 -0.02 -1.26 -4.16 135.00 136.89 1mj2 n PRO 69 Ca 0.16 0.74 -0.32 0.00 -2.02 0.00 0.00 63.50 62.07 1mj2 n PRO 69 Cb 0.36 -2.58 -0.05 0.00 -0.02 0.00 0.00 33.50 31.20 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 -2.70 3.87 0.31 2.45 1.43 -1.26 -4.83 118.68 117.96 1mj2 s LEU 70 Ca 0.64 1.49 -0.28 0.00 -1.03 0.00 0.00 54.13 54.95 1mj2 s LEU 70 Cb -0.45 -4.36 -0.09 0.00 0.03 0.00 0.00 46.19 41.32 1mj2 s LEU 70 CO 0.56 -0.39 1.05 -2.16 0.23 0.00 0.00 176.35 175.63 1mj2 s PRO 71 N -3.47 4.52 0.58 1.29 0.04 -1.26 -4.93 135.00 131.77 1mj2 s PRO 71 Ca 0.58 1.64 0.05 0.00 0.04 0.00 0.00 61.00 63.31 1mj2 s PRO 71 Cb -0.10 -2.97 0.07 0.00 0.04 0.00 0.00 34.50 31.54 1mj2 s PRO 71 CO 0.21 0.15 0.80 0.16 0.04 0.00 0.00 177.00 178.37 1mj2 s ASP 72 N -1.19 5.04 0.20 6.66 1.47 -1.26 -4.92 116.67 122.68 1mj2 s ASP 72 Ca 0.48 -0.49 -0.10 0.00 1.18 0.00 0.00 52.55 53.63 1mj2 s ASP 72 Cb -0.27 -0.18 0.26 0.00 -0.34 0.00 0.00 42.92 42.39 1mj2 s ASP 72 CO 0.34 -1.33 1.74 0.44 0.68 0.00 0.00 175.17 177.04 1mj2 h ASP 73 N 0.06 0.20 -0.99 2.11 3.32 -1.99 -1.15 116.42 117.99 1mj2 h ASP 73 Ca -0.36 0.08 0.10 0.00 0.02 0.00 0.00 57.03 56.87 1mj2 h ASP 73 Cb 1.28 0.06 -0.08 0.00 0.22 0.00 0.00 39.33 40.82 1mj2 h ASP 73 CO 0.43 0.13 0.63 0.00 -1.72 0.00 0.00 179.24 178.71 1mj2 h ALA 74 N 1.41 1.49 0.00 3.45 0.00 -1.98 0.22 119.26 123.85 1mj2 h ALA 74 Ca 0.30 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 1mj2 h ALA 74 Cb 0.36 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1mj2 h ALA 74 CO -0.30 0.30 -0.20 -0.44 0.00 0.00 0.00 179.25 178.61 1mj2 h ASP 75 N 1.05 0.00 0.91 0.00 3.32 -1.60 -1.80 116.42 118.29 1mj2 h ASP 75 Ca 0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.51 1mj2 h ASP 75 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 1mj2 h ASP 75 CO -0.22 0.20 -0.08 0.18 -1.72 0.00 0.00 179.24 177.60 1mj2 n LEU 76 N -4.09 0.08 -1.71 1.55 4.77 0.73 -2.45 117.00 115.88 1mj2 n LEU 76 Ca -0.02 0.41 0.07 0.00 -0.03 0.00 0.00 56.01 56.44 1mj2 n LEU 76 Cb 0.27 -0.45 0.37 0.00 -2.33 0.00 0.00 43.42 41.27 1mj2 n LEU 76 CO 0.35 0.02 0.82 0.54 -1.33 0.00 0.00 177.39 177.79 1mj2 n ARG 77 N -1.49 4.28 -3.34 3.23 1.74 -0.68 -1.56 116.66 118.85 1mj2 n ARG 77 Ca 0.07 -2.87 -0.38 0.00 -0.77 0.00 0.00 57.85 53.90 1mj2 n ARG 77 Cb 0.34 -2.10 -0.06 0.00 -1.02 0.00 0.00 32.46 29.62 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 -2.36 4.33 0.00 5.56 1.02 -1.02 -4.96 119.74 122.31 1mj2 s LYS 78 Ca 0.50 0.42 0.00 0.00 0.02 0.00 0.00 55.97 56.91 1mj2 s LYS 78 Cb 0.36 -3.43 0.00 0.00 -0.52 0.00 0.00 37.83 34.24 1mj2 s LYS 78 CO 0.18 0.18 0.27 0.39 -0.92 0.00 0.00 175.35 175.45 1mj2 n GLU 79 N 3.62 0.00 -0.66 1.68 4.71 -1.26 -4.84 120.64 123.89 1mj2 n GLU 79 Ca -0.08 0.01 0.08 0.00 -0.01 0.00 0.00 57.16 57.17 1mj2 n GLU 79 Cb 0.52 -1.75 -0.04 0.00 -1.01 0.00 0.00 31.44 29.16 1mj2 n GLU 79 CO 0.00 0.00 0.00 -2.13 0.09 0.00 0.00 177.13 175.09 1mj2 n ARG 80 N -0.77 -1.48 0.00 3.49 0.00 -1.26 -4.69 116.66 111.95 1mj2 n ARG 80 Ca 0.00 1.16 0.00 0.00 -0.00 0.00 0.00 57.85 59.01 1mj2 n ARG 80 Cb 0.25 -1.75 0.00 0.00 0.00 0.00 0.00 32.46 30.95 1mj2 n ARG 80 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1mj2 n SER 81 N -3.22 0.00 -2.48 6.15 7.64 -1.26 -4.24 113.62 116.20 1mj2 n SER 81 Ca -0.03 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.74 1mj2 n SER 81 Cb 0.31 -0.24 0.04 0.00 -1.01 0.00 0.00 64.21 63.30 1mj2 n SER 81 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1mj2 n ASP 82 N 0.00 3.04 -0.01 6.43 2.03 -1.26 -4.89 116.55 121.89 1mj2 n ASP 82 Ca 0.00 -2.80 -0.11 0.00 0.52 0.00 0.00 54.79 52.40 1mj2 n ASP 82 Cb 0.00 -0.42 0.03 0.00 -0.72 0.00 0.00 41.12 40.01 1mj2 n ASP 82 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1mj2 h GLU 83 N 2.44 0.63 -6.16 -0.67 4.11 -1.89 -3.44 114.58 109.61 1mj2 h GLU 83 Ca 0.08 -0.40 -0.74 0.00 0.07 0.00 0.00 59.36 58.38 1mj2 h GLU 83 Cb 1.37 0.05 0.02 0.00 0.50 0.00 0.00 28.75 30.69 1mj2 h GLU 83 CO 0.45 1.01 0.78 -0.89 0.07 0.00 0.00 179.01 180.43 1mj2 n ILE 84 N -3.97 0.22 -1.61 -1.06 5.41 -1.26 -4.85 119.36 112.25 1mj2 n ILE 84 Ca -0.03 -0.04 -0.42 0.00 1.00 0.00 0.00 62.75 63.26 1mj2 n ILE 84 Cb 0.61 -1.07 0.01 0.00 -0.71 0.00 0.00 39.64 38.48 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 4.64 1.34 -0.33 0.38 -0.02 -1.26 -4.69 135.00 135.06 1mj2 n PRO 85 Ca 0.25 0.48 0.04 0.00 -2.02 0.00 0.00 63.50 62.25 1mj2 n PRO 85 Cb 0.13 -2.01 0.19 0.00 -0.02 0.00 0.00 33.50 31.78 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 1.57 0.88 -0.66 -0.52 4.39 -1.93 0.31 114.58 118.61 1mj2 h GLU 86 Ca -0.44 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.20 1mj2 h GLU 86 Cb 1.34 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 29.76 1mj2 h GLU 86 CO 0.57 0.58 0.38 0.00 -1.16 0.00 0.00 179.01 179.39 1mj2 h ALA 87 N 1.48 1.42 -0.01 3.43 0.00 -1.93 0.11 119.26 123.77 1mj2 h ALA 87 Ca 0.43 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 55.13 1mj2 h ALA 87 Cb 0.38 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1mj2 h ALA 87 CO -0.24 0.49 -0.59 0.00 0.00 0.00 0.00 179.25 178.90 1mj2 h ALA 88 N 1.50 1.00 -0.27 0.00 0.00 -1.49 -2.23 119.26 117.77 1mj2 h ALA 88 Ca 0.24 -0.54 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 1mj2 h ALA 88 Cb -0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1mj2 h ALA 88 CO -0.04 0.74 -0.19 0.87 0.00 0.00 0.00 179.25 180.63 1mj2 h LYS 89 N 0.02 0.61 -0.70 0.00 1.57 0.85 -0.01 116.57 118.90 1mj2 h LYS 89 Ca -0.01 -0.29 -0.02 0.00 -1.87 0.00 0.00 60.65 58.47 1mj2 h LYS 89 Cb 1.06 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.33 1mj2 h LYS 89 CO 0.08 0.88 0.37 1.49 -0.57 0.00 0.00 179.45 181.69 1mj2 h GLU 90 N 0.34 0.98 -0.46 3.15 4.81 -0.75 0.41 114.58 123.06 1mj2 h GLU 90 Ca 0.05 -0.13 -0.14 0.00 -0.13 0.00 0.00 59.36 59.02 1mj2 h GLU 90 Cb 0.72 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 1mj2 h GLU 90 CO 0.05 0.75 -0.26 0.82 -0.73 0.00 0.00 179.01 179.64 1mj2 h ILE 91 N 0.96 1.27 -0.74 2.32 2.04 -1.32 0.19 117.51 122.23 1mj2 h ILE 91 Ca 0.24 -1.43 -0.01 0.00 1.00 0.00 0.00 64.86 64.66 1mj2 h ILE 91 Cb 0.07 1.19 -0.04 0.00 -0.74 0.00 0.00 36.82 37.30 1mj2 h ILE 91 CO -0.04 0.49 0.41 0.24 0.00 0.00 0.00 178.15 179.25 1mj2 h MET 92 N 0.84 1.03 0.06 2.37 2.86 -0.61 0.16 114.93 121.64 1mj2 h MET 92 Ca 0.10 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1mj2 h MET 92 Cb 0.85 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.30 1mj2 h MET 92 CO 0.07 0.75 -0.03 0.00 1.06 0.00 0.00 176.91 178.77 1mj2 h ARG 93 N 1.04 -0.07 -0.19 1.72 3.08 -0.54 1.28 114.38 120.69 1mj2 h ARG 93 Ca 0.26 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.37 1mj2 h ARG 93 Cb 0.02 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1mj2 h ARG 93 CO -0.04 0.27 0.19 0.93 -1.07 0.00 0.00 179.97 180.25 1mj2 h GLU 94 N -0.42 0.00 -0.60 0.04 5.08 -0.04 0.78 114.58 119.42 1mj2 h GLU 94 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1mj2 h GLU 94 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1mj2 h GLU 94 CO 0.01 0.00 0.00 -1.33 -1.00 0.00 0.00 179.01 176.69 1mj2 n MET 95 N -3.91 2.80 -1.07 2.33 2.81 0.52 -4.91 117.12 115.69 1mj2 n MET 95 Ca 0.02 -2.14 -0.02 0.00 -1.81 0.00 0.00 57.70 53.74 1mj2 n MET 95 Cb 0.32 -1.63 -0.01 0.00 -0.71 0.00 0.00 33.22 31.19 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 1.13 0.55 3.79 3.03 0.00 0.27 -5.01 105.19 108.94 1mj2 n GLY 96 Ca 0.20 -0.29 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.90 5.36 -0.52 -0.61 1.01 0.44 -4.98 121.20 120.00 1mj2 s ILE 97 Ca 0.00 0.16 -0.24 0.00 0.00 0.00 0.00 60.65 60.57 1mj2 s ILE 97 Cb 0.00 -3.39 0.04 0.00 0.01 0.00 0.00 42.46 39.12 1mj2 s ILE 97 CO 0.00 0.53 0.93 0.21 0.00 0.00 0.00 174.94 176.61 1mj2 s ASN 98 N -0.33 6.39 0.20 3.58 2.47 -1.26 -2.97 114.94 123.01 1mj2 s ASN 98 Ca 0.11 -0.20 -0.11 0.00 0.42 0.00 0.00 52.86 53.08 1mj2 s ASN 98 Cb -0.12 -2.44 0.18 0.00 -1.45 0.00 0.00 41.25 37.42 1mj2 s ASN 98 CO 0.01 -1.15 1.81 -0.65 -3.72 0.00 0.00 177.10 173.40 1mj2 h PRO 99 N 9.22 0.65 -0.02 0.43 0.11 -1.88 -0.07 132.00 140.43 1mj2 h PRO 99 Ca -0.25 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.82 1mj2 h PRO 99 Cb 1.07 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.04 1mj2 h PRO 99 CO 1.06 0.43 0.03 0.93 -0.21 0.00 0.00 178.00 180.24 1mj2 h GLU 100 N 0.67 0.00 -0.00 1.05 4.39 -1.98 -2.80 114.58 115.91 1mj2 h GLU 100 Ca 0.26 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.96 1mj2 h GLU 100 Cb 0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1mj2 h GLU 100 CO -0.14 0.00 -0.08 0.25 -1.16 0.00 0.00 179.01 177.88 1mj2 n THR 101 N -3.74 0.00 -1.88 1.13 -2.24 -0.96 -5.01 114.28 101.58 1mj2 n THR 101 Ca -0.02 -0.46 -0.42 0.00 -2.27 0.00 0.00 64.05 60.88 1mj2 n THR 101 Cb 0.12 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.37 1mj2 n THR 101 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1mj2 s TRP 102 N -0.78 2.98 -0.21 4.78 -0.11 -0.08 -4.98 118.94 120.54 1mj2 s TRP 102 Ca 0.04 0.64 -0.12 0.00 1.22 0.00 0.00 56.10 57.88 1mj2 s TRP 102 Cb 0.03 -3.98 -0.05 0.00 -1.50 0.00 0.00 33.47 27.98 1mj2 s TRP 102 CO 0.10 -3.54 0.22 -1.21 -4.62 0.00 0.00 176.95 167.90 1mj2 s GLU 103 N 0.69 4.16 0.00 5.86 2.02 -1.26 -5.02 118.70 125.14 1mj2 s GLU 103 Ca 0.69 -0.10 0.00 0.00 0.02 0.00 0.00 54.97 55.57 1mj2 s GLU 103 Cb -0.45 -3.49 0.00 0.00 0.10 0.00 0.00 34.13 30.29 1mj2 s GLU 103 CO 0.36 0.14 0.11 2.48 0.02 0.00 0.00 175.26 178.36