#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xb4 n ALA 3 N 0.00 2.53 -2.51 7.33 0.00 -1.26 -4.88 120.51 121.73 1xb4 n ALA 3 Ca 0.00 -0.50 -0.24 0.00 0.00 0.00 0.00 53.44 52.70 1xb4 n ALA 3 Cb 0.00 -1.11 -0.10 0.00 0.00 0.00 0.00 19.45 18.25 1xb4 n ALA 3 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xb4 s LEU 4 N -1.66 2.71 0.37 0.00 1.43 -1.26 -4.35 118.68 115.93 1xb4 s LEU 4 Ca 0.34 -0.98 -0.12 0.00 -1.03 0.00 0.00 54.13 52.34 1xb4 s LEU 4 Cb 0.18 -1.20 -0.07 0.00 0.03 0.00 0.00 46.19 45.13 1xb4 s LEU 4 CO 0.28 0.00 0.75 -2.84 0.23 0.00 0.00 176.35 174.77 1xb4 s PRO 5 N -3.55 3.84 0.06 1.29 0.02 -1.26 -4.97 135.00 130.43 1xb4 s PRO 5 Ca 0.31 0.51 0.10 0.00 0.02 0.00 0.00 61.00 61.94 1xb4 s PRO 5 Cb -0.04 -2.41 0.46 0.00 0.02 0.00 0.00 34.50 32.53 1xb4 s PRO 5 CO 0.16 0.03 1.32 -0.35 -0.33 0.00 0.00 177.00 177.83 1xb4 n PRO 6 N -0.99 0.04 0.09 5.54 -0.04 -1.26 -1.23 135.00 137.15 1xb4 n PRO 6 Ca 0.03 0.42 0.12 0.00 -0.04 0.00 0.00 63.50 64.03 1xb4 n PRO 6 Cb 0.54 -1.59 0.22 0.00 -0.04 0.00 0.00 33.50 32.63 1xb4 n PRO 6 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 1xb4 h VAL 7 N 0.00 0.00 0.00 0.52 3.04 -1.99 -3.31 116.25 114.51 1xb4 h VAL 7 Ca 0.00 -0.59 0.00 0.00 -1.01 0.00 0.00 66.70 65.10 1xb4 h VAL 7 Cb 0.13 1.33 0.00 0.00 -2.01 0.00 0.00 31.29 30.74 1xb4 h VAL 7 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.56 1xb4 n TYR 8 N -2.31 0.00 -1.04 3.17 9.36 -0.36 -1.17 117.16 124.80 1xb4 n TYR 8 Ca 0.04 0.00 0.02 0.00 3.32 0.00 0.00 57.90 61.27 1xb4 n TYR 8 Cb 0.46 -0.00 0.02 0.00 -0.63 0.00 0.00 39.34 39.19 1xb4 n TYR 8 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1xb4 n SER 9 N -0.49 0.85 -4.41 2.98 7.64 -1.25 -4.98 113.62 113.96 1xb4 n SER 9 Ca 0.00 -1.83 -0.44 0.00 1.01 0.00 0.00 58.87 57.61 1xb4 n SER 9 Cb 0.00 -0.12 -0.04 0.00 -1.01 0.00 0.00 64.21 63.04 1xb4 n SER 9 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1xb4 s PHE 10 N -0.71 2.84 0.27 1.43 5.36 -0.31 -4.95 117.98 121.91 1xb4 s PHE 10 Ca 0.05 -0.78 -0.09 0.00 -0.96 0.00 0.00 56.93 55.15 1xb4 s PHE 10 Cb 0.05 -4.16 0.42 0.00 -0.34 0.00 0.00 43.02 38.99 1xb4 s PHE 10 CO 0.00 -1.47 1.57 -1.35 -1.46 0.00 0.00 175.22 172.51 1xb4 h PRO 11 N 9.36 -0.00 -1.59 10.12 0.11 -1.94 -0.76 132.00 147.30 1xb4 h PRO 11 Ca -0.28 0.00 0.46 0.00 0.11 0.00 0.00 66.00 66.29 1xb4 h PRO 11 Cb 1.08 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.12 1xb4 h PRO 11 CO 1.14 -0.00 1.18 -1.35 -0.21 0.00 0.00 178.00 178.76 1xb4 h PRO 12 N -0.00 0.00 -0.09 1.05 0.11 -1.93 0.57 132.00 131.71 1xb4 h PRO 12 Ca 0.45 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.42 1xb4 h PRO 12 Cb 0.69 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.81 1xb4 h PRO 12 CO -0.98 0.00 -0.48 1.25 -0.21 0.00 0.00 178.00 177.58 1xb4 h LEU 13 N 0.00 0.58 -2.01 2.35 5.85 -1.51 -3.11 115.31 117.46 1xb4 h LEU 13 Ca 0.75 -0.65 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1xb4 h LEU 13 Cb 3.10 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 43.96 1xb4 h LEU 13 CO -0.01 1.14 0.00 -1.22 -0.34 0.00 0.00 178.44 178.01 1xb4 n TYR 14 N -4.26 0.00 -3.64 1.25 4.01 0.20 -4.55 117.16 110.16 1xb4 n TYR 14 Ca -0.08 -0.36 -0.15 0.00 -0.16 0.00 0.00 57.90 57.15 1xb4 n TYR 14 Cb 0.59 -0.21 -0.14 0.00 -0.31 0.00 0.00 39.34 39.27 1xb4 n TYR 14 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1xb4 s THR 15 N 0.29 -0.36 1.07 -0.72 2.01 -1.18 -4.49 115.64 112.26 1xb4 s THR 15 Ca 0.00 0.26 -0.19 0.00 0.31 0.00 0.00 61.69 62.07 1xb4 s THR 15 Cb 0.00 -0.42 0.05 0.00 0.01 0.00 0.00 72.50 72.13 1xb4 s THR 15 CO 0.00 0.09 -0.14 -1.14 -0.69 0.00 0.00 174.62 172.75 1xb4 n ARG 16 N 5.34 -1.11 -3.60 4.92 0.63 -1.26 -4.96 116.66 116.62 1xb4 n ARG 16 Ca -0.06 -0.30 -0.12 0.00 -0.92 0.00 0.00 57.85 56.45 1xb4 n ARG 16 Cb 0.50 -1.62 -0.06 0.00 0.45 0.00 0.00 32.46 31.73 1xb4 n ARG 16 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 1xb4 s GLN 17 N -3.25 0.66 0.42 -0.14 0.74 -1.26 -5.06 119.66 111.77 1xb4 s GLN 17 Ca 0.53 0.45 0.10 0.00 0.05 0.00 0.00 55.36 56.49 1xb4 s GLN 17 Cb -0.11 0.32 0.94 0.00 1.10 0.00 0.00 33.01 35.25 1xb4 s GLN 17 CO 0.67 -0.15 2.01 -1.35 -0.55 0.00 0.00 175.29 175.93 1xb4 h PRO 18 N 3.57 0.48 0.00 1.67 0.11 -2.03 -3.42 132.00 132.38 1xb4 h PRO 18 Ca -0.25 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1xb4 h PRO 18 Cb 1.16 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1xb4 h PRO 18 CO 0.21 0.32 0.00 0.25 -0.21 0.00 0.00 178.00 178.57 1xb4 n THR 22 N -4.47 0.00 0.11 -1.15 -2.24 -1.26 -4.89 114.28 100.38 1xb4 n THR 22 Ca 0.07 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.94 1xb4 n THR 22 Cb 0.23 0.00 0.13 0.00 -2.10 0.00 0.00 70.33 68.59 1xb4 n THR 22 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1xb4 n ARG 23 N 0.00 0.02 0.29 -0.78 0.63 -1.26 0.72 116.66 116.28 1xb4 n ARG 23 Ca 0.00 0.82 0.10 0.00 -0.92 0.00 0.00 57.85 57.85 1xb4 n ARG 23 Cb 0.00 -2.15 0.56 0.00 0.45 0.00 0.00 32.46 31.32 1xb4 n ARG 23 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 1xb4 h ARG 24 N 0.00 0.00 0.00 -0.14 2.43 -1.90 0.78 114.38 115.55 1xb4 h ARG 24 Ca 0.15 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1xb4 h ARG 24 Cb 1.97 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.52 1xb4 h ARG 24 CO -0.00 0.00 -0.72 0.00 -1.51 0.00 0.00 179.97 177.74 1xb4 n GLN 25 N -2.59 2.70 -0.05 0.20 -0.00 0.22 -4.43 117.38 113.44 1xb4 n GLN 25 Ca -0.01 -0.02 0.05 0.00 -0.00 0.00 0.00 57.00 57.02 1xb4 n GLN 25 Cb 0.47 -0.90 0.41 0.00 -0.00 0.00 0.00 30.24 30.23 1xb4 n GLN 25 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.06 177.43 1xb4 h GLN 26 N 0.00 0.58 -0.15 2.61 4.15 0.49 0.25 115.11 123.04 1xb4 h GLN 26 Ca 0.00 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.38 1xb4 h GLN 26 Cb 0.13 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 1xb4 h GLN 26 CO 0.00 0.39 0.08 0.82 -1.93 0.00 0.00 178.83 178.18 1xb4 h ILE 27 N 0.60 1.12 -1.02 2.39 2.04 -1.59 -1.60 117.51 119.45 1xb4 h ILE 27 Ca 0.19 -0.35 0.25 0.00 1.00 0.00 0.00 64.86 65.96 1xb4 h ILE 27 Cb 0.04 1.07 -0.11 0.00 -0.74 0.00 0.00 36.82 37.07 1xb4 h ILE 27 CO -0.05 0.11 0.62 0.28 0.00 0.00 0.00 178.15 179.11 1xb4 h SER 28 N 0.13 0.62 0.15 1.72 0.02 -0.77 0.23 113.55 115.64 1xb4 h SER 28 Ca 0.05 0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 1xb4 h SER 28 Cb 0.11 0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.67 1xb4 h SER 28 CO -0.01 0.11 -0.07 0.74 -1.14 0.00 0.00 176.83 176.46 1xb4 h THR 29 N 0.54 0.92 -0.70 -2.27 2.02 -0.25 -1.37 112.91 111.80 1xb4 h THR 29 Ca 0.63 -0.29 -0.01 0.00 0.77 0.00 0.00 66.41 67.51 1xb4 h THR 29 Cb 1.29 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 68.77 1xb4 h THR 29 CO -0.42 0.07 0.39 -0.50 0.37 0.00 0.00 175.52 175.43 1xb4 h TRP 30 N -0.34 0.95 -0.33 3.16 4.06 -0.33 0.17 115.95 123.29 1xb4 h TRP 30 Ca -0.02 -0.02 0.07 0.00 2.06 0.00 0.00 58.89 60.98 1xb4 h TRP 30 Cb 0.27 -0.30 -0.06 0.00 -1.00 0.00 0.00 29.16 28.06 1xb4 h TRP 30 CO -0.03 0.66 -0.09 0.82 -3.56 0.00 0.00 178.44 176.25 1xb4 h ILE 31 N 0.95 0.66 0.02 1.49 2.04 -0.56 0.63 117.51 122.74 1xb4 h ILE 31 Ca 0.25 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.11 1xb4 h ILE 31 Cb 0.02 0.66 -0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1xb4 h ILE 31 CO -0.04 0.00 -0.02 -0.78 0.00 0.00 0.00 178.15 177.31 1xb4 h ASP 32 N -0.01 -0.05 -0.63 1.72 3.58 -0.72 0.33 116.42 120.65 1xb4 h ASP 32 Ca 0.16 0.01 0.13 0.00 0.42 0.00 0.00 57.03 57.74 1xb4 h ASP 32 Cb 0.25 0.02 -0.12 0.00 1.72 0.00 0.00 39.33 41.20 1xb4 h ASP 32 CO -0.34 -0.03 -0.13 0.40 -2.88 0.00 0.00 179.24 176.26 1xb4 h ILE 33 N -0.04 0.39 0.00 2.25 2.04 0.73 0.19 117.51 123.07 1xb4 h ILE 33 Ca 0.00 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1xb4 h ILE 33 Cb 0.04 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1xb4 h ILE 33 CO -0.01 0.00 0.00 -0.38 0.00 0.00 0.00 178.15 177.77 1xb4 n ILE 34 N -5.41 0.00 -0.31 -0.67 2.08 0.21 -1.91 119.36 113.35 1xb4 n ILE 34 Ca 0.08 1.21 0.04 0.00 0.56 0.00 0.00 62.75 64.64 1xb4 n ILE 34 Cb 0.33 -2.20 0.11 0.00 -0.75 0.00 0.00 39.64 37.14 1xb4 n ILE 34 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 1xb4 n SER 35 N -1.21 -0.34 0.19 4.38 2.88 0.11 0.70 113.62 120.34 1xb4 n SER 35 Ca 0.00 1.49 0.04 0.00 -1.33 0.00 0.00 58.87 59.07 1xb4 n SER 35 Cb 0.00 -0.44 0.39 0.00 -0.75 0.00 0.00 64.21 63.41 1xb4 n SER 35 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1xb4 h GLN 36 N 0.00 0.00 0.00 -1.46 1.08 -0.69 -2.18 115.11 111.87 1xb4 h GLN 36 Ca 0.40 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.60 1xb4 h GLN 36 Cb 0.62 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.05 1xb4 h GLN 36 CO -0.89 0.36 0.00 0.98 -0.95 0.00 0.00 178.83 178.33 1xb4 n TYR 37 N -3.88 0.00 -0.26 2.96 9.36 0.22 -3.02 117.16 122.54 1xb4 n TYR 37 Ca -0.01 0.00 -0.05 0.00 3.32 0.00 0.00 57.90 61.15 1xb4 n TYR 37 Cb 0.42 -0.31 -0.00 0.00 -0.63 0.00 0.00 39.34 38.82 1xb4 n TYR 37 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1xb4 n LYS 39 N -5.43 -0.17 0.05 0.00 4.81 -0.82 0.11 118.16 116.72 1xb4 n LYS 39 Ca 0.05 1.38 -0.12 0.00 -0.87 0.00 0.00 58.31 58.74 1xb4 n LYS 39 Cb 0.36 -2.05 -0.09 0.00 0.02 0.00 0.00 35.03 33.27 1xb4 n LYS 39 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 1xb4 h THR 40 N 0.00 1.02 0.00 3.15 1.35 -1.21 -3.06 112.91 114.15 1xb4 h THR 40 Ca 0.34 -1.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 1xb4 h THR 40 Cb 0.57 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 68.59 1xb4 h THR 40 CO -0.90 0.22 0.00 0.29 -0.25 0.00 0.00 175.52 174.89 1xb4 n LYS 41 N -4.95 0.97 -1.30 4.72 5.02 0.15 -4.83 118.16 117.95 1xb4 n LYS 41 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 1xb4 n LYS 41 Cb 0.26 -1.09 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 1xb4 n LYS 41 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1xb4 n LYS 42 N 0.43 -1.49 -2.19 1.97 4.76 0.31 -4.86 118.16 117.09 1xb4 n LYS 42 Ca 0.00 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.06 1xb4 n LYS 42 Cb 0.45 -3.32 -0.01 0.00 -1.84 0.00 0.00 35.03 30.31 1xb4 n LYS 42 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1xb4 s ILE 43 N -1.10 2.95 0.00 -0.18 -1.09 -0.39 -4.94 121.20 116.45 1xb4 s ILE 43 Ca 0.00 0.76 0.00 0.00 -2.23 0.00 0.00 60.65 59.18 1xb4 s ILE 43 Cb 0.00 -3.41 0.00 0.00 -1.58 0.00 0.00 42.46 37.47 1xb4 s ILE 43 CO 0.00 0.04 0.00 0.79 -1.23 0.00 0.00 174.94 174.54 1xb4 n TRP 44 N -0.26 0.00 -1.86 3.97 7.02 -1.26 -4.44 117.44 120.62 1xb4 n TRP 44 Ca 0.06 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.24 1xb4 n TRP 44 Cb 0.47 0.05 0.17 0.00 -2.42 0.00 0.00 31.31 29.58 1xb4 n TRP 44 CO 0.00 0.00 0.00 0.71 -2.02 0.00 0.00 177.69 176.38 1xb4 s TYR 45 N -2.00 1.74 0.00 -5.99 2.02 -1.26 0.17 117.35 112.04 1xb4 s TYR 45 Ca 0.00 0.41 0.00 0.00 -0.37 0.00 0.00 57.07 57.11 1xb4 s TYR 45 Cb 0.00 -3.97 0.00 0.00 -0.40 0.00 0.00 41.96 37.59 1xb4 s TYR 45 CO 0.00 -2.60 0.00 -1.33 -1.57 0.00 0.00 175.55 170.05 1xb4 n MET 46 N -3.77 0.00 0.00 -0.62 2.81 0.20 -4.63 117.12 111.11 1xb4 n MET 46 Ca 0.14 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 1xb4 n MET 46 Cb 0.60 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.11 1xb4 n MET 46 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1xb4 n SER 47 N 0.00 0.00 -0.00 7.83 3.41 -1.25 -3.49 113.62 120.12 1xb4 n SER 47 Ca 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1xb4 n SER 47 Cb 0.02 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 63.97 1xb4 n SER 47 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1xb4 n VAL 48 N 0.00 0.15 0.49 -3.33 0.31 -1.26 0.26 118.33 114.95 1xb4 n VAL 48 Ca 0.00 0.25 0.04 0.00 -0.01 0.00 0.00 64.34 64.63 1xb4 n VAL 48 Cb 0.00 -1.33 0.24 0.00 -0.91 0.00 0.00 33.84 31.85 1xb4 n VAL 48 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1xb4 n ASP 49 N -2.66 0.00 0.00 4.52 5.75 -1.26 -4.90 116.55 118.00 1xb4 n ASP 49 Ca -0.01 -0.11 0.00 0.00 -0.01 0.00 0.00 54.79 54.66 1xb4 n ASP 49 Cb 0.03 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 1xb4 n ASP 49 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xb4 n GLY 50 N -0.50 0.77 2.69 6.12 0.00 -1.23 -2.14 105.19 110.91 1xb4 n GLY 50 Ca 0.06 -0.70 -0.04 0.00 0.00 0.00 0.00 46.02 45.34 1xb4 n GLY 50 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xb4 n THR 51 N 0.00-11.57 -1.45 2.61 -1.04 -1.26 -4.11 114.28 97.46 1xb4 n THR 51 Ca 0.00 2.28 -0.50 0.00 -2.04 0.00 0.00 64.05 63.79 1xb4 n THR 51 Cb 0.00 -6.29 -0.04 0.00 -1.82 0.00 0.00 70.33 62.18 1xb4 n THR 51 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1xb4 n VAL 52 N 1.48 1.45 -2.60 12.58 0.24 -1.26 -4.84 118.33 125.39 1xb4 n VAL 52 Ca -0.27 -0.36 -0.23 0.00 -2.04 0.00 0.00 64.34 61.44 1xb4 n VAL 52 Cb 0.43 -0.13 -0.00 0.00 -1.47 0.00 0.00 33.84 32.66 1xb4 n VAL 52 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1xb4 n ILE 53 N 0.47 2.09 0.29 1.34 5.41 -1.26 -5.06 119.36 122.64 1xb4 n ILE 53 Ca 0.18 -4.63 0.14 0.00 1.00 0.00 0.00 62.75 59.44 1xb4 n ILE 53 Cb 0.22 -0.86 0.45 0.00 -0.71 0.00 0.00 39.64 38.73 1xb4 n ILE 53 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 176.55 175.42 1xb4 h ASN 54 N 2.73 0.00 0.00 4.38 -1.24 -1.95 -3.46 115.58 116.04 1xb4 h ASN 54 Ca 0.19 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.20 1xb4 h ASN 54 Cb 0.92 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.97 1xb4 h ASN 54 CO 0.76 0.00 0.00 -3.20 -1.29 0.00 0.00 177.43 173.70 1xb4 n ASN 74 N -2.97 0.00 -0.01 1.15 5.15 -0.91 -5.10 115.26 112.58 1xb4 n ASN 74 Ca 0.02 0.00 0.15 0.00 -0.60 0.00 0.00 54.58 54.15 1xb4 n ASN 74 Cb 0.40 0.00 0.78 0.00 -0.53 0.00 0.00 39.78 40.43 1xb4 n ASN 74 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1xb4 n LEU 75 N 0.00 0.04 -0.24 1.20 7.94 -1.26 -2.83 117.00 121.85 1xb4 n LEU 75 Ca 0.00 0.22 0.04 0.00 -1.11 0.00 0.00 56.01 55.16 1xb4 n LEU 75 Cb 0.00 -0.23 0.01 0.00 0.53 0.00 0.00 43.42 43.73 1xb4 n LEU 75 CO 0.00 0.01 0.26 0.49 -1.11 0.00 0.00 177.39 177.04 1xb4 n PHE 76 N -1.21 0.00 -3.93 1.96 0.99 -1.26 -4.84 117.46 109.16 1xb4 n PHE 76 Ca 0.16 0.00 -0.33 0.00 -0.00 0.00 0.00 57.45 57.28 1xb4 n PHE 76 Cb 0.22 0.00 -0.14 0.00 -1.00 0.00 0.00 39.48 38.57 1xb4 n PHE 76 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.76 177.97 1xb4 s ASN 77 N -1.03 4.93 -0.55 4.37 3.84 -1.13 -1.94 114.94 123.43 1xb4 s ASN 77 Ca 0.08 -2.05 -0.23 0.00 0.21 0.00 0.00 52.86 50.87 1xb4 s ASN 77 Cb 0.07 -1.70 0.05 0.00 -0.55 0.00 0.00 41.25 39.12 1xb4 s ASN 77 CO 0.17 -0.43 0.87 0.21 -2.79 0.00 0.00 177.10 175.13 1xb4 s ASN 78 N 1.24 6.30 0.03 -4.21 3.84 0.02 -4.74 114.94 117.42 1xb4 s ASN 78 Ca 0.09 -0.54 -0.27 0.00 0.21 0.00 0.00 52.86 52.35 1xb4 s ASN 78 Cb -0.20 -2.40 -0.17 0.00 -0.55 0.00 0.00 41.25 37.93 1xb4 s ASN 78 CO -0.06 -1.17 1.34 -0.33 -2.79 0.00 0.00 177.10 174.09 1xb4 h GLU 79 N 9.26 -0.51 -0.89 0.43 4.39 -1.91 0.82 114.58 126.18 1xb4 h GLU 79 Ca -0.27 0.03 0.16 0.00 0.34 0.00 0.00 59.36 59.63 1xb4 h GLU 79 Cb 1.08 0.12 -0.10 0.00 -0.10 0.00 0.00 28.75 29.74 1xb4 h GLU 79 CO 1.07 -0.22 0.47 -0.44 -1.16 0.00 0.00 179.01 178.72 1xb4 h ASP 80 N -0.78 0.56 0.67 1.42 3.45 -1.96 -0.50 116.42 119.27 1xb4 h ASP 80 Ca -0.05 0.10 0.00 0.00 0.43 0.00 0.00 57.03 57.51 1xb4 h ASP 80 Cb 0.53 0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.31 1xb4 h ASP 80 CO 0.09 0.21 -0.47 -0.38 -1.57 0.00 0.00 179.24 177.12 1xb4 n ILE 81 N -4.87 0.10 -3.57 0.35 2.08 -1.22 -4.97 119.36 107.27 1xb4 n ILE 81 Ca 0.19 -0.08 -0.20 0.00 0.56 0.00 0.00 62.75 63.22 1xb4 n ILE 81 Cb 0.49 0.05 0.05 0.00 -0.75 0.00 0.00 39.64 39.48 1xb4 n ILE 81 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1xb4 n GLN 82 N -1.67 -4.65 -3.81 0.38 6.02 0.22 -5.01 117.38 108.86 1xb4 n GLN 82 Ca 0.05 0.70 -0.12 0.00 -0.01 0.00 0.00 57.00 57.62 1xb4 n GLN 82 Cb 0.36 -5.35 -0.10 0.00 1.02 0.00 0.00 30.24 26.18 1xb4 n GLN 82 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1xb4 s ARG 83 N -5.60 0.54 -0.07 -1.09 1.81 -0.79 -5.04 118.95 108.71 1xb4 s ARG 83 Ca 0.11 -0.23 -0.07 0.00 -1.72 0.00 0.00 55.73 53.82 1xb4 s ARG 83 Cb -0.02 0.23 0.02 0.00 -0.45 0.00 0.00 34.95 34.73 1xb4 s ARG 83 CO 0.79 -0.14 0.19 -1.12 -0.68 0.00 0.00 175.30 174.34 1xb4 s SER 84 N -1.19 -0.19 0.11 0.23 0.01 -1.26 -0.80 113.70 110.61 1xb4 s SER 84 Ca -0.13 0.37 -0.30 0.00 1.31 0.00 0.00 55.95 57.20 1xb4 s SER 84 Cb -0.06 0.39 -0.06 0.00 0.21 0.00 0.00 66.02 66.50 1xb4 s SER 84 CO 0.03 -0.07 1.08 -0.69 0.41 0.00 0.00 173.24 173.99 1xb4 s VAL 85 N 0.06 4.17 0.38 3.43 1.01 -0.82 -4.89 120.40 123.75 1xb4 s VAL 85 Ca -0.00 1.72 -0.27 0.00 0.00 0.00 0.00 61.98 63.43 1xb4 s VAL 85 Cb -0.01 -4.10 -0.10 0.00 0.00 0.00 0.00 36.38 32.17 1xb4 s VAL 85 CO 0.00 0.23 1.38 -0.94 0.00 0.00 0.00 175.10 175.77 1xb4 s SER 86 N 0.37 6.39 0.26 3.32 1.04 -1.26 -4.79 113.70 119.03 1xb4 s SER 86 Ca 0.52 2.83 -0.02 0.00 0.48 0.00 0.00 55.95 59.76 1xb4 s SER 86 Cb -0.27 -2.65 0.50 0.00 0.10 0.00 0.00 66.02 63.69 1xb4 s SER 86 CO 0.32 -0.82 1.77 -0.61 0.98 0.00 0.00 173.24 174.88 1xb4 h GLN 87 N 2.93 0.61 -0.58 4.02 5.75 -1.98 0.64 115.11 126.50 1xb4 h GLN 87 Ca -0.50 -0.04 0.11 0.00 -0.15 0.00 0.00 58.65 58.08 1xb4 h GLN 87 Cb 1.24 -0.14 -0.11 0.00 1.07 0.00 0.00 27.48 29.54 1xb4 h GLN 87 CO 0.64 0.41 -0.23 0.28 -2.65 0.00 0.00 178.83 177.27 1xb4 h VAL 88 N 0.63 0.30 0.65 2.39 2.07 -2.00 0.12 116.25 120.41 1xb4 h VAL 88 Ca 0.44 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.93 1xb4 h VAL 88 Cb 0.60 0.30 0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1xb4 h VAL 88 CO -0.34 0.00 -0.31 0.15 0.02 0.00 0.00 177.57 177.08 1xb4 h PHE 89 N -0.09 -0.81 -0.99 1.57 -0.00 -1.32 -2.80 116.94 112.49 1xb4 h PHE 89 Ca 0.26 -0.02 0.33 0.00 -0.00 0.00 0.00 57.97 58.54 1xb4 h PHE 89 Cb 0.50 0.27 -0.18 0.00 -0.00 0.00 0.00 35.95 36.53 1xb4 h PHE 89 CO -0.55 -0.47 0.20 -0.89 -0.00 0.00 0.00 178.31 176.61 1xb4 n ILE 90 N -5.41 -0.42 -0.16 1.41 5.41 -0.11 0.19 119.36 120.27 1xb4 n ILE 90 Ca -0.13 2.13 -0.08 0.00 1.00 0.00 0.00 62.75 65.67 1xb4 n ILE 90 Cb 0.37 -3.23 0.01 0.00 -0.71 0.00 0.00 39.64 36.08 1xb4 n ILE 90 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 1xb4 h ASP 91 N 0.00 0.62 -0.80 4.38 3.32 -0.65 0.88 116.42 124.17 1xb4 h ASP 91 Ca 0.69 -0.12 0.06 0.00 0.02 0.00 0.00 57.03 57.67 1xb4 h ASP 91 Cb 1.60 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 40.93 1xb4 h ASP 91 CO -0.88 0.57 0.49 -0.33 -1.72 0.00 0.00 179.24 177.38 1xb4 h GLU 92 N 0.63 0.88 0.15 3.56 5.08 0.24 -1.38 114.58 123.73 1xb4 h GLU 92 Ca 0.16 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1xb4 h GLU 92 Cb 0.11 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 1xb4 h GLU 92 CO -0.02 0.58 -0.26 0.82 -1.00 0.00 0.00 179.01 179.13 1xb4 h ILE 93 N 0.91 0.44 0.62 3.13 1.08 0.48 -1.56 117.51 122.60 1xb4 h ILE 93 Ca 0.35 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.80 1xb4 h ILE 93 Cb 0.15 0.44 -0.01 0.00 -3.07 0.00 0.00 36.82 34.33 1xb4 h ILE 93 CO -0.17 0.00 -0.43 -0.50 -0.69 0.00 0.00 178.15 176.36 1xb4 h TRP 94 N -0.48 -1.15 -0.42 1.37 -0.00 -0.22 0.13 115.95 115.18 1xb4 h TRP 94 Ca 0.02 -0.01 0.09 0.00 -0.00 0.00 0.00 58.89 58.99 1xb4 h TRP 94 Cb 0.49 0.42 -0.09 0.00 -0.00 0.00 0.00 29.16 29.98 1xb4 h TRP 94 CO -0.22 -0.63 -0.21 0.66 -0.00 0.00 0.00 178.44 178.04 1xb4 h SER 95 N -1.00 -0.72 -0.35 -3.49 4.64 -1.28 1.11 113.55 112.46 1xb4 h SER 95 Ca -0.08 0.16 0.08 0.00 -0.47 0.00 0.00 61.79 61.48 1xb4 h SER 95 Cb 0.83 0.38 -0.08 0.00 -0.31 0.00 0.00 62.40 63.22 1xb4 h SER 95 CO 0.04 -0.24 -0.22 -0.61 -0.87 0.00 0.00 176.83 174.93 1xb4 h GLN 96 N -0.13 -0.17 0.00 4.77 5.75 -1.03 0.96 115.11 125.26 1xb4 h GLN 96 Ca 0.20 0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.69 1xb4 h GLN 96 Cb 0.45 0.04 -0.00 0.00 1.07 0.00 0.00 27.48 29.03 1xb4 h GLN 96 CO -0.50 -0.11 -0.08 1.98 -2.65 0.00 0.00 178.83 177.47 1xb4 h MET 97 N -0.17 0.00 0.03 1.69 4.05 0.19 -0.60 114.93 120.12 1xb4 h MET 97 Ca 0.17 0.00 -0.12 0.00 -0.28 0.00 0.00 59.70 59.47 1xb4 h MET 97 Cb 0.44 0.00 0.01 0.00 -0.80 0.00 0.00 31.60 31.25 1xb4 h MET 97 CO -0.45 0.08 -0.50 1.15 0.23 0.00 0.00 176.91 177.42 1xb4 h THR 98 N 0.00 1.50 -0.87 -0.77 2.02 0.48 0.13 112.91 115.41 1xb4 h THR 98 Ca -0.00 -2.15 0.11 0.00 0.77 0.00 0.00 66.41 65.15 1xb4 h THR 98 Cb 0.16 2.82 -0.08 0.00 -1.74 0.00 0.00 68.15 69.31 1xb4 h THR 98 CO 0.01 0.61 0.50 0.50 0.37 0.00 0.00 175.52 177.50 1xb4 h LYS 99 N -0.33 0.77 0.00 6.66 3.64 0.15 0.90 116.57 128.36 1xb4 h LYS 99 Ca -0.07 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1xb4 h LYS 99 Cb 1.27 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 1xb4 h LYS 99 CO 0.10 0.51 0.00 0.39 -2.27 0.00 0.00 179.45 178.18 1xb4 n GLU 100 N -4.75 0.17 -1.24 1.90 1.02 -0.30 -4.89 120.64 112.55 1xb4 n GLU 100 Ca 0.16 0.27 -0.03 0.00 -0.02 0.00 0.00 57.16 57.54 1xb4 n GLU 100 Cb 0.33 -1.76 -0.01 0.00 -0.02 0.00 0.00 31.44 29.99 1xb4 n GLU 100 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xb4 n GLY 101 N 0.69 0.52 0.12 0.62 0.00 0.31 -4.91 105.19 102.54 1xb4 n GLY 101 Ca 0.04 -0.93 0.12 0.00 0.00 0.00 0.00 46.02 45.25 1xb4 n GLY 101 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xb4 h LYS 102 N 0.00 0.00 -4.55 1.61 1.79 -0.98 -3.45 116.57 110.98 1xb4 h LYS 102 Ca -0.05 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.19 1xb4 h LYS 102 Cb 0.32 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 30.82 1xb4 h LYS 102 CO 0.08 0.00 -0.62 0.00 -1.08 0.00 0.00 179.45 177.83 1xb4 s LEU 104 N -3.14 1.04 -0.30 0.00 2.96 0.10 -4.67 118.68 114.67 1xb4 s LEU 104 Ca 0.37 -0.25 -0.29 0.00 -0.22 0.00 0.00 54.13 53.74 1xb4 s LEU 104 Cb 0.07 -0.74 -0.01 0.00 0.50 0.00 0.00 46.19 46.01 1xb4 s LEU 104 CO 0.11 -0.14 1.56 -2.84 -1.32 0.00 0.00 176.35 173.72 1xb4 s PRO 105 N 1.76 3.66 0.00 0.98 0.02 -1.26 -0.82 135.00 139.35 1xb4 s PRO 105 Ca 0.05 1.39 0.00 0.00 0.02 0.00 0.00 61.00 62.46 1xb4 s PRO 105 Cb -0.12 -4.05 0.00 0.00 0.02 0.00 0.00 34.50 30.35 1xb4 s PRO 105 CO -0.07 -1.45 0.00 0.44 -0.33 0.00 0.00 177.00 175.59 1xb4 n ILE 106 N 6.75 0.00 -4.15 2.83 -5.35 -1.26 -4.98 119.36 113.20 1xb4 n ILE 106 Ca 0.19 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.38 1xb4 n ILE 106 Cb 0.46 0.00 -0.03 0.00 -1.74 0.00 0.00 39.64 38.34 1xb4 n ILE 106 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1xb4 s TYR 121 N -1.00 1.65 -0.07 4.28 1.51 0.14 -5.11 117.35 118.75 1xb4 s TYR 121 Ca 0.00 -0.89 -0.13 0.00 -1.01 0.00 0.00 57.07 55.04 1xb4 s TYR 121 Cb 0.00 -1.82 -0.05 0.00 -0.11 0.00 0.00 41.96 39.98 1xb4 s TYR 121 CO 0.00 -0.28 0.33 0.12 -1.11 0.00 0.00 175.55 174.60 1xb4 s PHE 122 N -2.81 3.63 -0.51 2.71 5.99 0.00 0.61 117.98 127.60 1xb4 s PHE 122 Ca 0.25 0.79 -0.20 0.00 0.00 0.00 0.00 56.93 57.77 1xb4 s PHE 122 Cb -0.01 -2.24 0.06 0.00 0.00 0.00 0.00 43.02 40.83 1xb4 s PHE 122 CO 0.15 0.55 0.66 0.42 -0.00 0.00 0.00 175.22 176.99 1xb4 s ILE 123 N -0.62 4.83 -0.84 3.12 -1.09 0.46 -0.72 121.20 126.33 1xb4 s ILE 123 Ca 0.20 -0.41 -0.08 0.00 -2.23 0.00 0.00 60.65 58.14 1xb4 s ILE 123 Cb -0.15 -4.32 -0.15 0.00 -1.58 0.00 0.00 42.46 36.26 1xb4 s ILE 123 CO 0.09 -0.83 3.23 -0.11 -1.23 0.00 0.00 174.94 176.09 1xb4 n LEU 124 N 6.29 7.08 -1.82 2.97 7.94 0.13 -4.72 117.00 134.87 1xb4 n LEU 124 Ca -0.06 -3.85 -0.01 0.00 -1.11 0.00 0.00 56.01 50.98 1xb4 n LEU 124 Cb 0.46 -1.47 -0.02 0.00 0.53 0.00 0.00 43.42 42.92 1xb4 n LEU 124 CO 0.55 1.90 0.63 -2.67 -1.11 0.00 0.00 177.39 176.68 1xb4 n TRP 125 N 2.89 0.00 0.00 1.96 4.27 -1.22 -4.34 117.44 121.00 1xb4 n TRP 125 Ca 0.61 -0.58 0.00 0.00 -3.89 0.00 0.00 57.50 53.64 1xb4 n TRP 125 Cb 0.55 -0.49 0.00 0.00 -1.36 0.00 0.00 31.31 30.01 1xb4 n TRP 125 CO 0.00 0.00 0.00 1.17 -2.29 0.00 0.00 177.69 176.57 1xb4 n LYS 126 N 1.90 0.00 -1.49 -2.67 4.81 -1.26 -5.01 118.16 114.43 1xb4 n LYS 126 Ca 0.04 0.00 -0.46 0.00 -0.87 0.00 0.00 58.31 57.02 1xb4 n LYS 126 Cb 0.30 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.33 1xb4 n LYS 126 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1xb4 n SER 127 N 0.00 0.00 0.09 3.14 3.41 -1.26 -4.69 113.62 114.31 1xb4 n SER 127 Ca 0.00 1.14 0.00 0.00 -0.26 0.00 0.00 58.87 59.75 1xb4 n SER 127 Cb 0.00 -1.12 0.31 0.00 -0.26 0.00 0.00 64.21 63.14 1xb4 n SER 127 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1xb4 h LEU 128 N 1.46 0.27 -1.66 1.04 4.07 -1.92 0.17 115.31 118.74 1xb4 h LEU 128 Ca -0.34 -0.08 -0.03 0.00 0.08 0.00 0.00 57.88 57.51 1xb4 h LEU 128 Cb 1.39 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 43.05 1xb4 h LEU 128 CO 0.58 0.51 -0.14 -0.78 -1.08 0.00 0.00 178.44 177.54 1xb4 h ASP 129 N 0.25 0.00 0.07 -0.43 1.82 -1.90 0.50 116.42 116.74 1xb4 h ASP 129 Ca 0.04 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.68 1xb4 h ASP 129 Cb 0.55 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.56 1xb4 h ASP 129 CO 0.04 0.14 -0.03 -1.28 -1.61 0.00 0.00 179.24 176.49 1xb4 h SER 130 N 0.00 -0.08 -0.62 2.28 0.87 -1.31 -3.00 113.55 111.69 1xb4 h SER 130 Ca -0.00 0.00 0.16 0.00 -1.23 0.00 0.00 61.79 60.72 1xb4 h SER 130 Cb 0.47 0.02 -0.12 0.00 -0.44 0.00 0.00 62.40 62.34 1xb4 h SER 130 CO 0.02 0.12 -0.04 0.79 -0.53 0.00 0.00 176.83 177.19 1xb4 n TRP 131 N -3.23 0.34 0.14 2.24 5.03 0.40 0.18 117.44 122.55 1xb4 n TRP 131 Ca -0.01 0.75 -0.09 0.00 3.03 0.00 0.00 57.50 61.18 1xb4 n TRP 131 Cb 0.04 -0.93 -0.05 0.00 -1.03 0.00 0.00 31.31 29.33 1xb4 n TRP 131 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 1xb4 h ALA 132 N 1.24 -0.95 -1.24 6.99 0.00 -0.08 0.31 119.26 125.54 1xb4 h ALA 132 Ca 0.35 -0.09 0.37 0.00 0.00 0.00 0.00 54.91 55.53 1xb4 h ALA 132 Cb 0.68 0.50 -0.10 0.00 0.00 0.00 0.00 17.79 18.87 1xb4 h ALA 132 CO -0.60 -0.96 0.83 0.77 0.00 0.00 0.00 179.25 179.28 1xb4 h SER 133 N -0.50 0.25 0.18 0.00 0.02 0.21 0.31 113.55 114.02 1xb4 h SER 133 Ca -0.03 0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1xb4 h SER 133 Cb 0.44 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.03 1xb4 h SER 133 CO -0.04 -0.03 -0.09 0.25 -1.14 0.00 0.00 176.83 175.78 1xb4 h LEU 134 N 0.17 -0.21 -0.46 5.07 5.85 -0.55 0.41 115.31 125.60 1xb4 h LEU 134 Ca 0.69 0.01 0.04 0.00 0.84 0.00 0.00 57.88 59.46 1xb4 h LEU 134 Cb 2.21 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 43.24 1xb4 h LEU 134 CO -0.26 -0.10 -0.27 -0.38 -0.34 0.00 0.00 178.44 177.09 1xb4 n ILE 135 N -2.92 -0.31 -0.35 4.05 2.08 0.22 0.77 119.36 122.89 1xb4 n ILE 135 Ca -0.03 1.42 0.10 0.00 0.56 0.00 0.00 62.75 64.80 1xb4 n ILE 135 Cb 0.10 -1.78 0.28 0.00 -0.75 0.00 0.00 39.64 37.48 1xb4 n ILE 135 CO 0.00 0.00 0.00 0.25 0.56 0.00 0.00 176.55 177.36 1xb4 h LEU 136 N 0.00 0.84 -2.21 1.39 5.85 -0.50 0.41 115.31 121.10 1xb4 h LEU 136 Ca 0.07 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 1xb4 h LEU 136 Cb 0.19 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 1xb4 h LEU 136 CO -0.43 0.38 -0.06 -0.61 -0.34 0.00 0.00 178.44 177.38 1xb4 h GLN 137 N 0.87 0.00 0.68 1.25 4.15 0.26 -2.57 115.11 119.75 1xb4 h GLN 137 Ca 0.53 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.92 1xb4 h GLN 137 Cb 0.69 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.38 1xb4 h GLN 137 CO -0.32 0.06 -0.33 2.35 -1.93 0.00 0.00 178.83 178.65 1xb4 h TRP 138 N 0.00 -0.85 -0.52 3.99 7.01 0.75 -3.48 115.95 122.85 1xb4 h TRP 138 Ca -0.00 -0.02 -0.28 0.00 2.11 0.00 0.00 58.89 60.70 1xb4 h TRP 138 Cb 0.15 0.28 -0.04 0.00 -2.10 0.00 0.00 29.16 27.45 1xb4 h TRP 138 CO 0.00 -0.49 1.18 1.19 -2.79 0.00 0.00 178.44 177.52 1xb4 n PHE 139 N -5.43 0.86 0.92 2.65 3.72 -0.97 -4.56 117.46 114.65 1xb4 n PHE 139 Ca -0.13 0.09 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 1xb4 n PHE 139 Cb 0.38 -2.09 0.00 0.00 -0.94 0.00 0.00 39.48 36.83 1xb4 n PHE 139 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xb4 n GLY 143 N 6.26 1.42 3.16 1.37 0.00 -1.26 -4.81 105.19 111.33 1xb4 n GLY 143 Ca 0.53 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 46.11 1xb4 n GLY 143 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xb4 n LYS 144 N 0.09 3.85 0.00 1.61 4.76 -1.26 -4.94 118.16 122.27 1xb4 n LYS 144 Ca 0.00 -4.22 0.00 0.00 -2.87 0.00 0.00 58.31 51.22 1xb4 n LYS 144 Cb 0.25 -2.69 0.00 0.00 -1.84 0.00 0.00 35.03 30.75 1xb4 n LYS 144 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1xb4 n LEU 145 N 2.95 0.00 -3.59 -0.35 7.94 -1.26 -4.72 117.00 117.96 1xb4 n LEU 145 Ca 0.30 0.00 -0.27 0.00 -1.11 0.00 0.00 56.01 54.93 1xb4 n LEU 145 Cb 0.37 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.25 1xb4 n LEU 145 CO 0.65 0.00 1.11 -3.20 -1.11 0.00 0.00 177.39 174.84 1xb4 n ASN 146 N 0.00 0.33 -3.61 1.96 5.15 -0.16 -3.77 115.26 115.16 1xb4 n ASN 146 Ca 0.00 -1.83 -0.02 0.00 -0.60 0.00 0.00 54.58 52.13 1xb4 n ASN 146 Cb 0.00 -0.34 -0.01 0.00 -0.53 0.00 0.00 39.78 38.89 1xb4 n ASN 146 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1xb4 s GLN 147 N 5.49 0.34 -0.31 1.20 1.03 -1.21 -4.97 119.66 121.23 1xb4 s GLN 147 Ca 0.41 -0.16 -0.27 0.00 0.04 0.00 0.00 55.36 55.39 1xb4 s GLN 147 Cb 0.09 0.13 0.01 0.00 0.03 0.00 0.00 33.01 33.28 1xb4 s GLN 147 CO 0.21 -0.15 0.97 0.08 -2.54 0.00 0.00 175.29 173.86 1xb4 s VAL 148 N -2.41 4.62 -0.02 3.63 1.01 -1.26 -3.99 120.40 121.98 1xb4 s VAL 148 Ca 0.12 1.56 0.07 0.00 0.00 0.00 0.00 61.98 63.72 1xb4 s VAL 148 Cb 0.02 -4.32 -0.02 0.00 0.00 0.00 0.00 36.38 32.06 1xb4 s VAL 148 CO -0.04 -0.39 -0.23 -0.51 0.00 0.00 0.00 175.10 173.93 1xb4 s ILE 149 N 3.39 1.82 0.35 2.22 2.07 -0.64 -4.96 121.20 125.45 1xb4 s ILE 149 Ca 0.41 -0.98 -0.27 0.00 -1.41 0.00 0.00 60.65 58.40 1xb4 s ILE 149 Cb -0.13 -1.51 -0.09 0.00 0.13 0.00 0.00 42.46 40.86 1xb4 s ILE 149 CO 0.14 0.51 1.13 0.42 -1.91 0.00 0.00 174.94 175.23 1xb4 s THR 150 N -0.50 3.37 0.48 4.00 -4.23 -1.26 -1.84 115.64 115.65 1xb4 s THR 150 Ca 0.08 1.22 0.18 0.00 -1.18 0.00 0.00 61.69 61.99 1xb4 s THR 150 Cb -0.09 -3.71 0.34 0.00 1.34 0.00 0.00 72.50 70.38 1xb4 s THR 150 CO -0.01 0.17 2.01 -0.07 -0.54 0.00 0.00 174.62 176.19 1xb4 h LEU 151 N 3.07 0.18 -0.01 4.79 3.38 -0.52 -0.20 115.31 126.00 1xb4 h LEU 151 Ca -0.48 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.49 1xb4 h LEU 151 Cb 1.22 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 1xb4 h LEU 151 CO 0.64 0.11 -0.01 0.22 0.09 0.00 0.00 178.44 179.49 1xb4 h TYR 152 N 0.20 0.03 0.00 1.13 5.03 -1.86 -2.58 116.97 118.92 1xb4 h TYR 152 Ca 0.23 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.52 1xb4 h TYR 152 Cb 0.62 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 38.90 1xb4 h TYR 152 CO -0.00 0.55 0.16 -1.91 -1.32 0.00 0.00 178.16 175.64 1xb4 n GLU 153 N -4.81 0.05 0.08 1.82 2.13 -0.14 0.63 120.64 120.40 1xb4 n GLU 153 Ca -0.08 0.48 -0.09 0.00 0.66 0.00 0.00 57.16 58.13 1xb4 n GLU 153 Cb 0.28 -1.83 -0.09 0.00 0.27 0.00 0.00 31.44 30.06 1xb4 n GLU 153 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1xb4 h LEU 154 N 0.00 0.12 -6.18 4.31 3.38 -0.98 -3.47 115.31 112.48 1xb4 h LEU 154 Ca 0.00 -0.12 -0.46 0.00 0.09 0.00 0.00 57.88 57.40 1xb4 h LEU 154 Cb 0.32 -0.04 -0.33 0.00 0.09 0.00 0.00 40.66 40.70 1xb4 h LEU 154 CO 0.00 1.04 -0.80 -0.94 0.09 0.00 0.00 178.44 177.83 1xb4 s SER 155 N -6.83 1.10 0.00 -0.43 1.04 0.21 -4.68 113.70 104.10 1xb4 s SER 155 Ca -0.01 -2.33 0.00 0.00 0.48 0.00 0.00 55.95 54.09 1xb4 s SER 155 Cb 0.10 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.43 1xb4 s SER 155 CO 0.83 -0.19 0.00 0.52 0.98 0.00 0.00 173.24 175.37 1xb4 n VAL 161 N 3.41 0.00 -1.67 5.02 0.31 -1.26 -4.78 118.33 119.37 1xb4 n VAL 161 Ca 0.20 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.22 1xb4 n VAL 161 Cb 0.47 -1.19 -0.02 0.00 -0.91 0.00 0.00 33.84 32.19 1xb4 n VAL 161 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1xb4 n ASN 162 N 1.59 6.87 0.00 4.52 3.02 -1.26 -4.69 115.26 125.32 1xb4 n ASN 162 Ca 0.00 -3.40 0.00 0.00 -0.03 0.00 0.00 54.58 51.15 1xb4 n ASN 162 Cb 0.49 -1.19 0.00 0.00 -0.61 0.00 0.00 39.78 38.47 1xb4 n ASN 162 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1xb4 n TRP 163 N 0.47 0.00 -0.04 3.10 7.02 -1.26 -5.00 117.44 121.73 1xb4 n TRP 163 Ca 0.51 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.97 1xb4 n TRP 163 Cb 0.44 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 29.24 1xb4 n TRP 163 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 1xb4 n GLU 164 N 0.00 1.77 -0.03 -0.99 2.13 -1.26 -4.33 120.64 117.93 1xb4 n GLU 164 Ca 0.00 -0.03 0.01 0.00 0.66 0.00 0.00 57.16 57.80 1xb4 n GLU 164 Cb 0.00 -1.26 0.02 0.00 0.27 0.00 0.00 31.44 30.47 1xb4 n GLU 164 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 1xb4 n PHE 165 N -2.25 0.08 -2.02 4.31 1.16 -1.26 -4.88 117.46 112.61 1xb4 n PHE 165 Ca -0.13 -0.04 -0.40 0.00 -1.87 0.00 0.00 57.45 55.02 1xb4 n PHE 165 Cb 0.69 -0.01 -0.01 0.00 -1.61 0.00 0.00 39.48 38.54 1xb4 n PHE 165 CO 0.00 0.00 0.00 -1.58 -1.87 0.00 0.00 176.76 173.31 1xb4 s HIS 166 N -1.88 2.80 0.00 2.97 2.46 -1.26 -2.25 115.29 118.13 1xb4 s HIS 166 Ca 0.04 1.37 0.00 0.00 0.47 0.00 0.00 55.06 56.94 1xb4 s HIS 166 Cb 0.02 -3.73 0.00 0.00 -0.13 0.00 0.00 32.58 28.74 1xb4 s HIS 166 CO 0.02 -2.21 0.00 -2.13 -2.47 0.00 0.00 174.74 167.95 1xb4 n ARG 167 N 0.25 -1.27 -1.97 2.88 0.00 -1.26 -4.91 116.66 110.37 1xb4 n ARG 167 Ca 0.03 0.32 -0.42 0.00 -0.00 0.00 0.00 57.85 57.78 1xb4 n ARG 167 Cb 0.43 -4.33 -0.03 0.00 0.00 0.00 0.00 32.46 28.53 1xb4 n ARG 167 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.63 179.04 1xb4 s MET 168 N -1.31 3.12 -0.54 -0.14 1.75 -0.96 -4.85 119.30 116.38 1xb4 s MET 168 Ca 0.00 1.29 -0.41 0.00 -1.25 0.00 0.00 55.69 55.32 1xb4 s MET 168 Cb 0.00 -4.26 -0.18 0.00 2.84 0.00 0.00 34.83 33.23 1xb4 s MET 168 CO 0.00 -2.11 2.22 -2.30 -0.65 0.00 0.00 175.02 172.18 1xb4 n PRO 169 N 8.62 0.17 -0.18 4.11 -0.02 -1.26 -4.47 135.00 141.97 1xb4 n PRO 169 Ca 0.23 0.04 0.18 0.00 -2.02 0.00 0.00 63.50 61.93 1xb4 n PRO 169 Cb 0.48 -1.66 0.33 0.00 -0.02 0.00 0.00 33.50 32.63 1xb4 n PRO 169 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1xb4 n GLU 170 N 7.74 -0.03 0.00 -0.52 1.02 -1.26 0.13 120.64 127.72 1xb4 n GLU 170 Ca 0.54 0.77 0.02 0.00 -0.02 0.00 0.00 57.16 58.47 1xb4 n GLU 170 Cb 0.02 -1.39 0.12 0.00 -0.02 0.00 0.00 31.44 30.17 1xb4 n GLU 170 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1xb4 n SER 171 N -4.26 0.00 0.00 1.62 3.41 -1.26 -2.22 113.62 110.91 1xb4 n SER 171 Ca 0.21 0.17 0.00 0.00 -0.26 0.00 0.00 58.87 58.99 1xb4 n SER 171 Cb 0.72 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 1xb4 n SER 171 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xb4 n LEU 172 N -1.25 0.03 0.00 1.04 4.77 0.35 -4.60 117.00 117.33 1xb4 n LEU 172 Ca 0.02 -0.04 0.02 0.00 -0.03 0.00 0.00 56.01 55.98 1xb4 n LEU 172 Cb 0.03 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.25 1xb4 n LEU 172 CO 0.03 0.01 0.57 -0.11 -1.33 0.00 0.00 177.39 176.56 1xb4 n LEU 173 N -0.03 0.00 -0.04 2.23 7.94 -0.87 -3.45 117.00 122.78 1xb4 n LEU 173 Ca 0.00 0.00 -0.01 0.00 -1.11 0.00 0.00 56.01 54.89 1xb4 n LEU 173 Cb 0.10 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.05 1xb4 n LEU 173 CO 0.00 0.00 -0.08 0.22 -1.11 0.00 0.00 177.39 176.42 1xb4 h TYR 174 N 0.00 0.00 -0.88 1.96 3.20 -1.80 -3.21 116.97 116.24 1xb4 h TYR 174 Ca 0.00 0.00 0.12 0.00 3.14 0.00 0.00 58.73 61.99 1xb4 h TYR 174 Cb 0.00 0.00 -0.08 0.00 1.54 0.00 0.00 36.73 38.19 1xb4 h TYR 174 CO 0.00 0.00 0.50 1.88 -1.64 0.00 0.00 178.16 178.90 1xb4 h TYR 175 N -0.70 0.89 -0.91 -3.82 0.99 -1.89 0.11 116.97 111.64 1xb4 h TYR 175 Ca 0.00 0.03 0.01 0.00 2.00 0.00 0.00 58.73 60.78 1xb4 h TYR 175 Cb 0.12 -0.27 -0.05 0.00 1.00 0.00 0.00 36.73 37.54 1xb4 h TYR 175 CO -0.05 0.31 0.60 0.00 -0.00 0.00 0.00 178.16 179.01 1xb4 h LEU 177 N 1.21 0.04 -0.08 0.00 3.38 -0.86 -3.29 115.31 115.70 1xb4 h LEU 177 Ca 0.34 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.31 1xb4 h LEU 177 Cb -0.11 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1xb4 h LEU 177 CO -0.08 0.37 -0.18 0.11 0.09 0.00 0.00 178.44 178.75 1xb4 h LYS 178 N 0.03 -0.16 -1.17 1.13 1.57 0.59 -1.36 116.57 117.20 1xb4 h LYS 178 Ca 0.00 0.01 0.37 0.00 -1.87 0.00 0.00 60.65 59.16 1xb4 h LYS 178 Cb 0.61 0.04 -0.12 0.00 0.08 0.00 0.00 32.23 32.83 1xb4 h LYS 178 CO 0.04 -0.10 0.74 -1.00 -0.57 0.00 0.00 179.45 178.56 1xb4 h PRO 179 N -0.16 0.21 0.00 3.15 0.13 -1.62 2.73 132.00 136.43 1xb4 h PRO 179 Ca 0.02 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1xb4 h PRO 179 Cb 0.21 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.29 1xb4 h PRO 179 CO -0.16 0.14 0.12 -0.07 -0.23 0.00 0.00 178.00 177.79 1xb4 h LEU 180 N 0.21 0.00 0.00 1.56 3.38 -1.38 -2.32 115.31 116.75 1xb4 h LEU 180 Ca 0.74 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.71 1xb4 h LEU 180 Cb 2.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.85 1xb4 h LEU 180 CO -0.42 0.00 -0.00 0.00 0.09 0.00 0.00 178.44 178.11 1xb4 n ASP 182 N -2.45 -0.01 -3.76 0.00 9.92 -0.90 0.99 116.55 120.35 1xb4 n ASP 182 Ca -0.00 0.25 -0.41 0.00 -0.53 0.00 0.00 54.79 54.10 1xb4 n ASP 182 Cb 0.00 -0.10 0.02 0.00 -0.64 0.00 0.00 41.12 40.40 1xb4 n ASP 182 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 1xb4 n ARG 183 N -3.86 5.09 0.00 -1.24 3.00 -1.06 -5.13 116.66 113.48 1xb4 n ARG 183 Ca 0.04 -4.63 0.00 0.00 -0.00 0.00 0.00 57.85 53.25 1xb4 n ARG 183 Cb 0.12 -2.48 0.00 0.00 0.00 0.00 0.00 32.46 30.10 1xb4 n ARG 183 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1xb4 n ASN 184 N 0.41 0.00 0.00 6.15 4.13 0.28 -4.97 115.26 121.26 1xb4 n ASN 184 Ca 0.40 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.66 1xb4 n ASN 184 Cb 0.29 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.53 1xb4 n ASN 184 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1xb4 n THR 187 N 0.07 0.00 -3.72 3.41 -2.24 -1.26 -4.79 114.28 105.75 1xb4 n THR 187 Ca 0.00 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.40 1xb4 n THR 187 Cb 0.00 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.11 1xb4 n THR 187 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1xb4 s MET 188 N 0.03 2.57 0.02 -0.78 -1.94 -1.26 -1.84 119.30 116.10 1xb4 s MET 188 Ca 0.00 -1.29 -0.30 0.00 -1.71 0.00 0.00 55.69 52.39 1xb4 s MET 188 Cb 0.00 -3.54 -0.05 0.00 2.01 0.00 0.00 34.83 33.25 1xb4 s MET 188 CO 0.00 -0.76 1.20 -0.51 -0.01 0.00 0.00 175.02 174.95 1xb4 s LEU 189 N 1.39 4.34 0.00 -0.03 1.43 -0.99 -4.99 118.68 119.82 1xb4 s LEU 189 Ca 0.00 1.95 0.04 0.00 -1.03 0.00 0.00 54.13 55.09 1xb4 s LEU 189 Cb -0.20 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.49 1xb4 s LEU 189 CO 0.02 -0.51 0.36 2.29 0.23 0.00 0.00 176.35 178.74 1xb4 n LYS 190 N 4.41 0.77 -1.36 1.70 2.85 -1.26 -2.35 118.16 122.93 1xb4 n LYS 190 Ca 0.10 -3.05 0.00 0.00 -1.05 0.00 0.00 58.31 54.30 1xb4 n LYS 190 Cb 0.46 0.33 0.00 0.00 -0.65 0.00 0.00 35.03 35.17 1xb4 n LYS 190 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1xb4 n ASP 191 N -1.85 1.89 0.00 -5.58 5.68 -0.18 -4.86 116.55 111.65 1xb4 n ASP 191 Ca -0.02 -0.70 0.03 0.00 -0.50 0.00 0.00 54.79 53.61 1xb4 n ASP 191 Cb 0.56 0.00 0.19 0.00 -1.14 0.00 0.00 41.12 40.72 1xb4 n ASP 191 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1xb4 n GLU 192 N -0.04 0.31 -0.08 0.11 4.07 -1.26 -1.26 120.64 122.49 1xb4 n GLU 192 Ca 0.00 0.00 0.02 0.00 -0.06 0.00 0.00 57.16 57.12 1xb4 n GLU 192 Cb 0.00 -1.32 0.03 0.00 -0.06 0.00 0.00 31.44 30.09 1xb4 n GLU 192 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1xb4 n ASN 193 N -0.82 1.35 0.00 4.31 3.02 -1.26 -4.98 115.26 116.88 1xb4 n ASN 193 Ca 0.05 -2.01 0.00 0.00 -0.03 0.00 0.00 54.58 52.59 1xb4 n ASN 193 Cb 0.02 -0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.07 1xb4 n ASN 193 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1xb4 n ASP 194 N -0.53 -2.20 -4.78 6.41 9.92 -0.39 -4.98 116.55 120.01 1xb4 n ASP 194 Ca 0.04 0.00 -0.37 0.00 -0.53 0.00 0.00 54.79 53.92 1xb4 n ASP 194 Cb 0.45 -1.88 -0.03 0.00 -0.64 0.00 0.00 41.12 39.03 1xb4 n ASP 194 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1xb4 s LYS 195 N -0.88 4.08 -0.30 -1.24 2.20 -1.26 -4.67 119.74 117.66 1xb4 s LYS 195 Ca 0.00 1.66 -0.15 0.00 -0.36 0.00 0.00 55.97 57.12 1xb4 s LYS 195 Cb 0.00 -2.58 -0.03 0.00 -1.51 0.00 0.00 37.83 33.71 1xb4 s LYS 195 CO 0.00 -0.25 0.37 0.08 -0.36 0.00 0.00 175.35 175.19 1xb4 s VAL 196 N -1.55 5.17 -0.15 4.02 1.01 -1.26 -1.01 120.40 126.63 1xb4 s VAL 196 Ca 0.58 0.37 0.22 0.00 0.00 0.00 0.00 61.98 63.15 1xb4 s VAL 196 Cb -0.26 -3.75 -0.26 0.00 0.00 0.00 0.00 36.38 32.11 1xb4 s VAL 196 CO 0.32 0.06 0.63 -0.38 0.00 0.00 0.00 175.10 175.73 1xb4 n ILE 197 N 5.18 0.12 -3.77 2.22 2.08 -0.99 -4.79 119.36 119.40 1xb4 n ILE 197 Ca -0.09 -0.47 -0.02 0.00 0.56 0.00 0.00 62.75 62.73 1xb4 n ILE 197 Cb 0.50 0.00 0.02 0.00 -0.75 0.00 0.00 39.64 39.41 1xb4 n ILE 197 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1xb4 n ALA 198 N -2.18 -1.94 -3.16 -1.39 0.00 -1.23 0.24 120.51 110.84 1xb4 n ALA 198 Ca -0.03 -0.74 -0.09 0.00 0.00 0.00 0.00 53.44 52.58 1xb4 n ALA 198 Cb 0.55 0.41 -0.05 0.00 0.00 0.00 0.00 19.45 20.36 1xb4 n ALA 198 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1xb4 s ILE 199 N -2.20 0.02 0.02 0.00 2.07 -0.77 -2.35 121.20 117.98 1xb4 s ILE 199 Ca 0.17 -1.23 0.02 0.00 -1.41 0.00 0.00 60.65 58.19 1xb4 s ILE 199 Cb -0.02 -1.97 -0.01 0.00 0.13 0.00 0.00 42.46 40.58 1xb4 s ILE 199 CO 0.04 -0.08 -0.06 -0.75 -1.91 0.00 0.00 174.94 172.18 1xb4 s LYS 200 N -3.97 0.41 0.00 3.50 2.20 -0.77 -1.62 119.74 119.50 1xb4 s LYS 200 Ca 0.18 -0.41 0.00 0.00 -0.36 0.00 0.00 55.97 55.38 1xb4 s LYS 200 Cb -0.00 -0.29 0.00 0.00 -1.51 0.00 0.00 37.83 36.03 1xb4 s LYS 200 CO 0.04 0.07 0.00 0.28 -0.36 0.00 0.00 175.35 175.38