#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ar4 h VAL 2 N 0.00 1.39 -3.31 0.00 2.07 -1.98 -3.44 116.25 110.98 1ar4 h VAL 2 Ca 0.00 -1.44 -0.67 0.00 0.82 0.00 0.00 66.70 65.41 1ar4 h VAL 2 Cb 0.00 2.10 -0.14 0.00 -1.52 0.00 0.00 31.29 31.74 1ar4 h VAL 2 CO 0.00 0.41 -0.62 -0.31 0.02 0.00 0.00 177.57 177.07 1ar4 s TYR 3 N -4.03 3.14 0.07 1.57 2.02 -1.26 -5.12 117.35 113.75 1ar4 s TYR 3 Ca -0.15 0.16 0.05 0.00 -0.37 0.00 0.00 57.07 56.76 1ar4 s TYR 3 Cb 0.04 -1.74 -0.03 0.00 -0.40 0.00 0.00 41.96 39.83 1ar4 s TYR 3 CO 0.75 0.48 -0.13 0.95 -1.57 0.00 0.00 175.55 176.02 1ar4 s THR 4 N -0.99 1.03 -0.31 -0.71 -4.23 -1.26 -4.94 115.64 104.22 1ar4 s THR 4 Ca 0.17 -1.31 -0.29 0.00 -1.18 0.00 0.00 61.69 59.08 1ar4 s THR 4 Cb -0.11 -1.04 0.01 0.00 1.34 0.00 0.00 72.50 72.70 1ar4 s THR 4 CO 0.06 -0.27 1.17 -0.22 -0.54 0.00 0.00 174.62 174.82 1ar4 s LEU 5 N -1.78 3.91 0.48 4.79 0.20 -1.26 -5.01 118.68 119.99 1ar4 s LEU 5 Ca -0.02 1.10 -0.21 0.00 0.69 0.00 0.00 54.13 55.69 1ar4 s LEU 5 Cb -0.09 -3.54 -0.08 0.00 -0.43 0.00 0.00 46.19 42.04 1ar4 s LEU 5 CO 0.02 -0.97 1.07 -2.16 -0.29 0.00 0.00 176.35 174.01 1ar4 s PRO 6 N 3.89 3.80 0.39 0.98 0.04 -1.26 -5.02 135.00 137.82 1ar4 s PRO 6 Ca 0.50 1.47 -0.17 0.00 0.04 0.00 0.00 61.00 62.85 1ar4 s PRO 6 Cb -0.14 -2.20 -0.09 0.00 0.04 0.00 0.00 34.50 32.11 1ar4 s PRO 6 CO 0.19 -0.45 0.85 -1.21 0.04 0.00 0.00 177.00 176.42 1ar4 s GLU 7 N -3.05 4.04 0.35 4.56 0.41 -1.26 -5.03 118.70 118.73 1ar4 s GLU 7 Ca 0.66 0.83 -0.28 0.00 -0.41 0.00 0.00 54.97 55.77 1ar4 s GLU 7 Cb -0.20 -2.30 -0.10 0.00 -1.78 0.00 0.00 34.13 29.75 1ar4 s GLU 7 CO 0.24 0.01 1.28 -0.51 -0.49 0.00 0.00 175.26 175.79 1ar4 s LEU 8 N -3.31 4.38 0.00 1.80 1.43 -1.26 -4.89 118.68 116.84 1ar4 s LEU 8 Ca 0.57 2.63 0.05 0.00 -1.03 0.00 0.00 54.13 56.35 1ar4 s LEU 8 Cb -0.10 -3.72 0.27 0.00 0.03 0.00 0.00 46.19 42.68 1ar4 s LEU 8 CO 0.20 -0.57 1.06 -0.81 0.23 0.00 0.00 176.35 176.45 1ar4 n PRO 9 N 0.66 0.87 -3.89 1.29 -0.04 -1.26 -4.83 135.00 127.80 1ar4 n PRO 9 Ca 0.01 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.39 1ar4 n PRO 9 Cb 0.43 -1.08 -0.03 0.00 -0.04 0.00 0.00 33.50 32.78 1ar4 n PRO 9 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1ar4 s TYR 10 N -2.00 -0.06 0.66 0.54 -0.85 -1.26 -5.12 117.35 109.26 1ar4 s TYR 10 Ca 0.07 -0.38 -0.16 0.00 -0.52 0.00 0.00 57.07 56.08 1ar4 s TYR 10 Cb 0.03 0.59 -0.00 0.00 0.38 0.00 0.00 41.96 42.96 1ar4 s TYR 10 CO 0.05 -1.18 1.17 0.34 -1.52 0.00 0.00 175.55 174.41 1ar4 s ASP 11 N -2.94 4.86 0.54 -0.18 2.15 -1.26 -4.90 116.67 114.94 1ar4 s ASP 11 Ca 0.14 2.25 0.24 0.00 0.43 0.00 0.00 52.55 55.60 1ar4 s ASP 11 Cb -0.05 -2.58 1.43 0.00 -0.30 0.00 0.00 42.92 41.42 1ar4 s ASP 11 CO 0.08 -1.81 2.06 1.88 -0.17 0.00 0.00 175.17 177.21 1ar4 h TYR 12 N 0.25 0.00 -0.43 -5.34 0.05 -1.97 -1.68 116.97 107.85 1ar4 h TYR 12 Ca -0.48 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.30 1ar4 h TYR 12 Cb 1.28 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.02 1ar4 h TYR 12 CO 0.49 0.00 0.00 -1.13 -1.05 0.00 0.00 178.16 176.47 1ar4 n SER 13 N -4.26 3.55 0.28 3.88 3.41 -1.26 -3.94 113.62 115.27 1ar4 n SER 13 Ca 0.05 -2.00 0.13 0.00 -0.26 0.00 0.00 58.87 56.79 1ar4 n SER 13 Cb 0.41 -0.28 0.81 0.00 -0.26 0.00 0.00 64.21 64.89 1ar4 n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ar4 h ALA 14 N 4.50 1.48 -0.04 7.33 0.00 -1.65 -2.52 119.26 128.36 1ar4 h ALA 14 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ar4 h ALA 14 Cb 1.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1ar4 h ALA 14 CO 0.00 0.07 0.00 1.28 0.00 0.00 0.00 179.25 180.60 1ar4 n LEU 15 N -3.85 1.49 -4.77 0.00 4.77 -1.26 -4.37 117.00 109.02 1ar4 n LEU 15 Ca -0.03 -0.52 -0.33 0.00 -0.03 0.00 0.00 56.01 55.10 1ar4 n LEU 15 Cb 0.15 -0.02 0.05 0.00 -2.33 0.00 0.00 43.42 41.27 1ar4 n LEU 15 CO 0.29 0.26 0.74 -1.61 -1.33 0.00 0.00 177.39 175.75 1ar4 s GLU 16 N -1.96 2.79 0.00 3.23 2.02 -0.95 -2.14 118.70 121.68 1ar4 s GLU 16 Ca 0.37 1.39 0.30 0.00 0.02 0.00 0.00 54.97 57.06 1ar4 s GLU 16 Cb 0.20 -1.95 1.54 0.00 0.10 0.00 0.00 34.13 34.03 1ar4 s GLU 16 CO 0.32 -1.26 2.03 -0.35 0.02 0.00 0.00 175.26 176.03 1ar4 n PRO 17 N -2.43 0.94 -0.22 0.39 -0.04 -1.26 -4.85 135.00 127.53 1ar4 n PRO 17 Ca 0.10 -0.21 -0.08 0.00 -0.04 0.00 0.00 63.50 63.27 1ar4 n PRO 17 Cb 0.52 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.51 1ar4 n PRO 17 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1ar4 h TYR 18 N 0.51 1.08 -3.26 0.54 0.05 -1.82 -3.41 116.97 110.66 1ar4 h TYR 18 Ca 0.00 -0.15 -0.43 0.00 0.05 0.00 0.00 58.73 58.20 1ar4 h TYR 18 Cb 0.21 -0.30 -0.39 0.00 1.01 0.00 0.00 36.73 37.27 1ar4 h TYR 18 CO 0.00 0.92 -0.76 0.42 -1.05 0.00 0.00 178.16 177.70 1ar4 s ILE 19 N -5.21 0.25 0.57 -2.88 1.01 -0.91 -4.78 121.20 109.26 1ar4 s ILE 19 Ca -0.12 0.14 -0.20 0.00 0.00 0.00 0.00 60.65 60.48 1ar4 s ILE 19 Cb 0.13 -0.47 -0.04 0.00 0.01 0.00 0.00 42.46 42.09 1ar4 s ILE 19 CO 0.83 0.19 1.23 -0.94 0.00 0.00 0.00 174.94 176.26 1ar4 s SER 20 N 2.02 5.28 0.45 3.58 1.04 -1.26 -2.90 113.70 121.91 1ar4 s SER 20 Ca 0.05 2.45 0.21 0.00 0.48 0.00 0.00 55.95 59.14 1ar4 s SER 20 Cb -0.13 -2.61 1.06 0.00 0.10 0.00 0.00 66.02 64.45 1ar4 s SER 20 CO -0.05 -1.54 1.92 1.23 0.98 0.00 0.00 173.24 175.79 1ar4 h GLY 21 N 1.09 0.00 1.00 7.32 0.00 -1.88 -2.37 103.07 108.22 1ar4 h GLY 21 Ca -0.50 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.81 1ar4 h GLY 21 CO 0.56 0.00 0.32 -2.09 0.00 0.00 0.00 176.54 175.33 1ar4 h GLU 22 N 0.00 0.88 -0.20 4.80 4.81 -1.91 -1.16 114.58 121.79 1ar4 h GLU 22 Ca -0.00 -0.12 -0.10 0.00 -0.13 0.00 0.00 59.36 59.01 1ar4 h GLU 22 Cb 0.55 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 1ar4 h GLU 22 CO 0.03 0.69 -0.26 0.82 -0.73 0.00 0.00 179.01 179.56 1ar4 h ILE 23 N 0.85 1.33 -0.89 2.32 2.04 -1.85 -2.89 117.51 118.43 1ar4 h ILE 23 Ca 0.22 -1.46 0.08 0.00 1.00 0.00 0.00 64.86 64.70 1ar4 h ILE 23 Cb 0.08 1.80 -0.07 0.00 -0.74 0.00 0.00 36.82 37.88 1ar4 h ILE 23 CO -0.03 0.45 0.54 0.24 0.00 0.00 0.00 178.15 179.35 1ar4 h MET 24 N 0.21 0.92 0.10 2.37 2.86 -1.22 0.28 114.93 120.45 1ar4 h MET 24 Ca 0.03 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1ar4 h MET 24 Cb 0.83 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.28 1ar4 h MET 24 CO 0.06 0.61 -0.05 0.93 1.06 0.00 0.00 176.91 179.53 1ar4 h GLU 25 N 0.95 -0.12 -0.34 1.72 5.08 -1.21 -0.96 114.58 119.70 1ar4 h GLU 25 Ca 0.40 0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.73 1ar4 h GLU 25 Cb 0.26 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1ar4 h GLU 25 CO -0.20 0.20 0.06 -0.07 -1.00 0.00 0.00 179.01 178.00 1ar4 h LEU 26 N -0.46 0.53 -0.53 1.33 3.38 -1.28 -0.56 115.31 117.71 1ar4 h LEU 26 Ca -0.01 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.72 1ar4 h LEU 26 Cb 0.38 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1ar4 h LEU 26 CO 0.02 0.65 0.33 -0.74 0.09 0.00 0.00 178.44 178.79 1ar4 h HIS 27 N 0.39 0.62 0.00 1.13 2.76 -0.44 -1.26 115.15 118.37 1ar4 h HIS 27 Ca 0.10 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.27 1ar4 h HIS 27 Cb 0.34 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 29.09 1ar4 h HIS 27 CO 0.02 0.37 -0.19 1.25 -1.30 0.00 0.00 177.93 178.08 1ar4 h HIS 28 N 0.66 0.00 -0.00 5.26 -0.00 -1.16 -1.91 115.15 118.00 1ar4 h HIS 28 Ca 0.21 0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 60.52 1ar4 h HIS 28 Cb -0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.39 1ar4 h HIS 28 CO -0.05 0.31 -0.29 -0.44 -0.00 0.00 0.00 177.93 177.45 1ar4 h ASP 29 N -1.00 0.00 0.00 3.26 3.32 -1.20 -3.12 116.42 117.68 1ar4 h ASP 29 Ca -0.03 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1ar4 h ASP 29 Cb 0.39 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1ar4 h ASP 29 CO -0.02 0.29 -0.67 0.29 -1.72 0.00 0.00 179.24 177.42 1ar4 n LYS 30 N -4.19 0.36 0.00 3.56 4.76 -0.52 -4.41 118.16 117.72 1ar4 n LYS 30 Ca -0.02 0.14 -0.12 0.00 -2.87 0.00 0.00 58.31 55.44 1ar4 n LYS 30 Cb 0.34 -1.12 -0.08 0.00 -1.84 0.00 0.00 35.03 32.33 1ar4 n LYS 30 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1ar4 h HIS 31 N -0.67 0.05 -0.47 2.13 3.86 -1.43 -2.33 115.15 116.30 1ar4 h HIS 31 Ca 0.00 -0.01 -0.07 0.00 -1.16 0.00 0.00 60.37 59.13 1ar4 h HIS 31 Cb 0.67 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.11 1ar4 h HIS 31 CO -0.29 0.26 0.01 1.25 0.86 0.00 0.00 177.93 180.02 1ar4 h HIS 32 N -0.17 0.89 -0.91 2.45 -0.00 -1.36 -2.63 115.15 113.41 1ar4 h HIS 32 Ca 0.01 -0.15 0.08 0.00 -0.00 0.00 0.00 60.37 60.31 1ar4 h HIS 32 Cb 0.24 -0.23 -0.06 0.00 -0.00 0.00 0.00 27.41 27.35 1ar4 h HIS 32 CO 0.00 0.85 0.59 -0.22 -0.00 0.00 0.00 177.93 179.16 1ar4 h LYS 33 N 0.68 0.95 -0.76 5.26 3.64 -1.56 -1.54 116.57 123.23 1ar4 h LYS 33 Ca 0.13 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1ar4 h LYS 33 Cb 0.49 -0.21 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 1ar4 h LYS 33 CO 0.02 0.63 0.39 0.00 -2.27 0.00 0.00 179.45 178.22 1ar4 h ALA 34 N 1.53 1.24 -0.25 5.00 0.00 -1.05 -1.10 119.26 124.62 1ar4 h ALA 34 Ca 0.41 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 55.01 1ar4 h ALA 34 Cb 0.29 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ar4 h ALA 34 CO -0.17 0.59 -0.53 1.88 0.00 0.00 0.00 179.25 181.02 1ar4 h TYR 35 N 1.08 0.93 -0.10 0.00 0.05 -1.09 -0.94 116.97 116.89 1ar4 h TYR 35 Ca 0.27 -0.32 -0.00 0.00 0.05 0.00 0.00 58.73 58.72 1ar4 h TYR 35 Cb 0.07 -0.18 -0.00 0.00 1.01 0.00 0.00 36.73 37.63 1ar4 h TYR 35 CO 0.01 1.11 0.05 0.28 -1.05 0.00 0.00 178.16 178.56 1ar4 h VAL 36 N 0.57 1.12 -0.72 -2.88 2.07 -1.03 -0.11 116.25 115.27 1ar4 h VAL 36 Ca 0.02 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 1ar4 h VAL 36 Cb 1.11 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 1ar4 h VAL 36 CO 0.11 0.10 0.29 0.44 0.02 0.00 0.00 177.57 178.53 1ar4 h ASP 37 N 0.04 0.98 0.04 0.57 3.32 -1.19 -2.04 116.42 118.13 1ar4 h ASP 37 Ca 0.03 -0.14 -0.12 0.00 0.02 0.00 0.00 57.03 56.82 1ar4 h ASP 37 Cb 0.12 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1ar4 h ASP 37 CO -0.00 0.87 -0.38 1.23 -1.72 0.00 0.00 179.24 179.24 1ar4 h GLY 38 N 1.10 0.49 1.11 2.75 0.00 -0.88 -1.74 103.07 105.89 1ar4 h GLY 38 Ca 0.24 -0.46 -0.17 0.00 0.00 0.00 0.00 47.33 46.94 1ar4 h GLY 38 CO -0.02 0.42 -0.47 0.00 0.00 0.00 0.00 176.54 176.47 1ar4 h ALA 39 N 1.22 0.47 -0.63 3.60 0.00 -0.71 -2.09 119.26 121.12 1ar4 h ALA 39 Ca 0.04 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 1ar4 h ALA 39 Cb 0.84 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1ar4 h ALA 39 CO 0.07 0.63 0.06 -0.91 0.00 0.00 0.00 179.25 179.11 1ar4 h ASN 40 N 0.65 1.03 -0.56 0.00 2.35 -1.30 -2.57 115.58 115.18 1ar4 h ASN 40 Ca 0.03 -0.26 -0.08 0.00 -0.55 0.00 0.00 56.30 55.44 1ar4 h ASN 40 Cb 1.07 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 39.15 1ar4 h ASN 40 CO 0.11 1.04 0.02 0.74 -1.65 0.00 0.00 177.43 177.69 1ar4 h THR 41 N 0.99 1.26 -0.84 2.81 2.02 -1.27 -2.06 112.91 115.81 1ar4 h THR 41 Ca 0.19 -1.09 0.02 0.00 0.77 0.00 0.00 66.41 66.30 1ar4 h THR 41 Cb 0.48 0.85 -0.05 0.00 -1.74 0.00 0.00 68.15 67.69 1ar4 h THR 41 CO 0.02 0.39 0.55 0.00 0.37 0.00 0.00 175.52 176.85 1ar4 h ALA 42 N 0.97 1.09 -0.45 6.16 0.00 -1.19 -0.56 119.26 125.29 1ar4 h ALA 42 Ca 0.16 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1ar4 h ALA 42 Cb 0.51 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1ar4 h ALA 42 CO 0.02 0.43 -0.03 -0.07 0.00 0.00 0.00 179.25 179.60 1ar4 h LEU 43 N 1.10 0.80 -0.91 0.00 3.38 -1.28 -1.28 115.31 117.12 1ar4 h LEU 43 Ca 0.32 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1ar4 h LEU 43 Cb -0.07 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.42 1ar4 h LEU 43 CO -0.09 0.94 0.52 0.44 0.09 0.00 0.00 178.44 180.33 1ar4 h ASP 44 N 0.65 1.12 -0.35 -0.43 3.32 -0.90 -0.69 116.42 119.13 1ar4 h ASP 44 Ca 0.12 -0.09 -0.12 0.00 0.02 0.00 0.00 57.03 56.96 1ar4 h ASP 44 Cb 0.54 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 1ar4 h ASP 44 CO 0.03 0.88 -0.21 0.11 -1.72 0.00 0.00 179.24 178.33 1ar4 h LYS 45 N 1.26 0.84 -0.25 3.56 6.56 -0.96 -1.78 116.57 125.81 1ar4 h LYS 45 Ca 0.32 -0.34 -0.10 0.00 -1.06 0.00 0.00 60.65 59.47 1ar4 h LYS 45 Cb -0.00 -0.04 -0.01 0.00 -0.57 0.00 0.00 32.23 31.61 1ar4 h LYS 45 CO -0.05 0.98 -0.26 -0.07 -2.06 0.00 0.00 179.45 177.98 1ar4 h LEU 46 N 0.73 0.49 -0.28 2.94 3.38 -0.81 -1.10 115.31 120.67 1ar4 h LEU 46 Ca 0.10 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 1ar4 h LEU 46 Cb 0.74 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1ar4 h LEU 46 CO 0.06 0.74 0.00 0.00 0.09 0.00 0.00 178.44 179.34 1ar4 h ALA 47 N 1.30 0.38 -0.38 1.53 0.00 -0.87 -2.35 119.26 118.87 1ar4 h ALA 47 Ca 0.06 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1ar4 h ALA 47 Cb 0.68 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1ar4 h ALA 47 CO 0.05 0.12 -0.06 1.49 0.00 0.00 0.00 179.25 180.85 1ar4 h GLU 48 N 0.28 0.63 -0.84 0.00 4.81 -1.16 -2.01 114.58 116.30 1ar4 h GLU 48 Ca 0.08 -0.17 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 1ar4 h GLU 48 Cb 0.42 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.69 1ar4 h GLU 48 CO 0.01 0.70 0.42 0.00 -0.73 0.00 0.00 179.01 179.41 1ar4 h ALA 49 N 1.35 1.17 -0.21 2.92 0.00 -0.98 -1.92 119.26 121.59 1ar4 h ALA 49 Ca 0.11 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.73 1ar4 h ALA 49 Cb 0.46 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ar4 h ALA 49 CO 0.02 0.64 -0.45 0.00 0.00 0.00 0.00 179.25 179.47 1ar4 h ARG 50 N 1.18 0.68 -0.61 0.00 3.08 -1.07 0.14 114.38 117.78 1ar4 h ARG 50 Ca 0.29 -0.45 0.02 0.00 0.07 0.00 0.00 59.98 59.91 1ar4 h ARG 50 Cb 0.08 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.15 1ar4 h ARG 50 CO -0.04 1.07 0.38 -0.44 -1.07 0.00 0.00 179.97 179.87 1ar4 h ASP 51 N 0.38 0.64 0.05 7.04 3.32 -1.14 -2.66 116.42 124.04 1ar4 h ASP 51 Ca 0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ar4 h ASP 51 Cb 1.06 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.46 1ar4 h ASP 51 CO 0.10 0.45 -0.10 0.29 -1.72 0.00 0.00 179.24 178.26 1ar4 n LYS 52 N -4.71 1.51 -3.71 3.56 5.02 -0.74 -4.95 118.16 114.14 1ar4 n LYS 52 Ca 0.05 -0.98 -0.26 0.00 -2.02 0.00 0.00 58.31 55.11 1ar4 n LYS 52 Cb 0.06 -1.48 0.06 0.00 -0.02 0.00 0.00 35.03 33.65 1ar4 n LYS 52 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ar4 n ALA 53 N 0.11 -1.38 -3.89 7.82 0.00 -0.37 -4.97 120.51 117.83 1ar4 n ALA 53 Ca 0.16 0.28 -0.30 0.00 0.00 0.00 0.00 53.44 53.57 1ar4 n ALA 53 Cb 0.39 -4.80 -0.15 0.00 0.00 0.00 0.00 19.45 14.89 1ar4 n ALA 53 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ar4 s ASP 54 N -3.43 4.40 -0.38 0.00 2.15 -0.11 -4.97 116.67 114.34 1ar4 s ASP 54 Ca 0.55 -2.08 0.06 0.00 0.43 0.00 0.00 52.55 51.52 1ar4 s ASP 54 Cb -0.26 -1.32 0.61 0.00 -0.30 0.00 0.00 42.92 41.65 1ar4 s ASP 54 CO 0.77 -0.37 1.74 0.49 -0.17 0.00 0.00 175.17 177.62 1ar4 n PHE 55 N 4.32 2.26 -0.16 -5.34 3.72 -1.26 -4.55 117.46 116.46 1ar4 n PHE 55 Ca 0.02 -1.72 0.03 0.00 -0.05 0.00 0.00 57.45 55.73 1ar4 n PHE 55 Cb 0.41 -0.76 0.32 0.00 -0.94 0.00 0.00 39.48 38.51 1ar4 n PHE 55 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1ar4 h GLY 56 N 1.08 0.92 -2.95 1.37 0.00 -1.96 -2.36 103.07 99.16 1ar4 h GLY 56 Ca 0.46 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1ar4 h GLY 56 CO 0.81 0.30 0.00 0.00 0.00 0.00 0.00 176.54 177.65 1ar4 n ALA 57 N -2.44 3.44 -0.32 3.60 0.00 -1.26 -4.64 120.51 118.89 1ar4 n ALA 57 Ca 0.08 -1.49 0.09 0.00 0.00 0.00 0.00 53.44 52.12 1ar4 n ALA 57 Cb 0.09 -1.08 0.26 0.00 0.00 0.00 0.00 19.45 18.72 1ar4 n ALA 57 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1ar4 h ILE 58 N 3.33 0.71 -0.56 0.00 6.09 -1.77 -0.37 117.51 124.94 1ar4 h ILE 58 Ca 0.00 -0.23 -0.06 0.00 -1.37 0.00 0.00 64.86 63.20 1ar4 h ILE 58 Cb 1.57 -0.01 -0.02 0.00 0.47 0.00 0.00 36.82 38.82 1ar4 h ILE 58 CO 0.34 0.12 0.11 0.78 -3.07 0.00 0.00 178.15 176.43 1ar4 h ASN 59 N 0.67 0.82 -0.07 2.19 2.35 -1.85 -0.62 115.58 119.06 1ar4 h ASN 59 Ca 0.51 -0.16 -0.04 0.00 -0.55 0.00 0.00 56.30 56.06 1ar4 h ASN 59 Cb 0.75 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.91 1ar4 h ASN 59 CO -0.38 0.82 -0.10 0.50 -1.65 0.00 0.00 177.43 176.62 1ar4 h LYS 60 N 0.83 0.18 -0.65 0.81 3.64 -1.61 -2.90 116.57 116.88 1ar4 h LYS 60 Ca 0.18 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1ar4 h LYS 60 Cb 0.34 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 1ar4 h LYS 60 CO 0.00 0.66 0.27 -0.07 -2.27 0.00 0.00 179.45 178.05 1ar4 h LEU 61 N -0.28 0.86 -0.66 5.20 3.38 -0.94 0.10 115.31 122.96 1ar4 h LEU 61 Ca 0.01 -0.11 -0.14 0.00 0.09 0.00 0.00 57.88 57.73 1ar4 h LEU 61 Cb 0.64 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1ar4 h LEU 61 CO 0.02 0.76 -0.45 -0.33 0.09 0.00 0.00 178.44 178.53 1ar4 h GLU 62 N 0.93 0.51 -0.15 1.13 4.39 -1.18 -0.71 114.58 119.50 1ar4 h GLU 62 Ca 0.22 -0.28 -0.21 0.00 0.34 0.00 0.00 59.36 59.43 1ar4 h GLU 62 Cb 0.16 0.01 0.01 0.00 -0.10 0.00 0.00 28.75 28.83 1ar4 h GLU 62 CO -0.02 0.86 -0.75 -0.22 -1.16 0.00 0.00 179.01 177.73 1ar4 h LYS 63 N 0.41 0.77 -0.59 2.33 3.64 -1.25 -1.60 116.57 120.28 1ar4 h LYS 63 Ca 0.03 -0.63 0.02 0.00 -1.27 0.00 0.00 60.65 58.80 1ar4 h LYS 63 Cb 0.95 0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.87 1ar4 h LYS 63 CO 0.08 1.23 0.37 -0.44 -2.27 0.00 0.00 179.45 178.43 1ar4 h ASP 64 N 0.49 0.62 0.13 4.20 3.32 -0.87 0.13 116.42 124.44 1ar4 h ASP 64 Ca -0.05 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1ar4 h ASP 64 Cb 1.38 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1ar4 h ASP 64 CO 0.15 0.44 -0.06 0.25 -1.72 0.00 0.00 179.24 178.30 1ar4 h LEU 65 N 0.74 -0.15 -0.16 1.55 5.85 -1.11 -1.80 115.31 120.24 1ar4 h LEU 65 Ca 0.23 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1ar4 h LEU 65 Cb -0.02 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 1ar4 h LEU 65 CO -0.08 0.07 0.10 0.00 -0.34 0.00 0.00 178.44 178.20 1ar4 h ALA 66 N 0.47 0.20 0.42 1.25 0.00 -1.04 0.22 119.26 120.79 1ar4 h ALA 66 Ca -0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1ar4 h ALA 66 Cb 0.30 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ar4 h ALA 66 CO 0.03 -0.30 -0.22 0.35 0.00 0.00 0.00 179.25 179.10 1ar4 h PHE 67 N 0.21 -0.58 -0.39 0.00 3.57 -0.77 -0.83 116.94 118.14 1ar4 h PHE 67 Ca 0.06 -0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.42 1ar4 h PHE 67 Cb -0.01 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 1ar4 h PHE 67 CO -0.06 -0.36 -0.26 -0.91 -2.23 0.00 0.00 178.31 174.49 1ar4 h ASN 68 N -0.60 0.91 -0.47 0.41 2.35 -1.32 -1.55 115.58 115.32 1ar4 h ASN 68 Ca -0.05 -0.43 -0.14 0.00 -0.55 0.00 0.00 56.30 55.13 1ar4 h ASN 68 Cb 0.47 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 1ar4 h ASN 68 CO 0.07 1.15 -0.24 0.25 -1.65 0.00 0.00 177.43 177.01 1ar4 h LEU 69 N 0.68 1.02 -0.87 1.61 5.85 -0.98 -0.95 115.31 121.67 1ar4 h LEU 69 Ca 0.08 -0.40 -0.04 0.00 0.84 0.00 0.00 57.88 58.36 1ar4 h LEU 69 Cb 0.84 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 1ar4 h LEU 69 CO 0.07 1.20 0.30 0.00 -0.34 0.00 0.00 178.44 179.68 1ar4 h ALA 70 N 0.87 1.10 -0.67 1.25 0.00 -1.13 0.47 119.26 121.15 1ar4 h ALA 70 Ca 0.10 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1ar4 h ALA 70 Cb 0.82 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1ar4 h ALA 70 CO 0.07 0.64 0.22 0.78 0.00 0.00 0.00 179.25 180.96 1ar4 h GLY 71 N 1.14 1.08 0.80 0.00 0.00 -0.95 0.63 103.07 105.76 1ar4 h GLY 71 Ca 0.25 -0.61 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1ar4 h GLY 71 CO -0.02 0.57 -0.10 0.84 0.00 0.00 0.00 176.54 177.83 1ar4 h HIS 72 N 0.98 0.48 0.04 5.60 6.17 -0.53 -2.16 115.15 125.74 1ar4 h HIS 72 Ca 0.22 -0.12 -0.00 0.00 0.71 0.00 0.00 60.37 61.18 1ar4 h HIS 72 Cb 0.26 -0.11 0.00 0.00 2.52 0.00 0.00 27.41 30.08 1ar4 h HIS 72 CO 0.02 0.71 -0.02 0.28 0.71 0.00 0.00 177.93 179.63 1ar4 h VAL 73 N 0.10 1.02 -0.50 5.26 2.07 -0.69 -0.85 116.25 122.66 1ar4 h VAL 73 Ca 0.04 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.39 1ar4 h VAL 73 Cb 0.59 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 1ar4 h VAL 73 CO 0.03 0.05 0.31 0.78 0.02 0.00 0.00 177.57 178.76 1ar4 h ASN 74 N -0.14 0.53 -0.08 0.57 2.35 -0.92 -1.85 115.58 116.04 1ar4 h ASN 74 Ca -0.01 -0.01 -0.17 0.00 -0.55 0.00 0.00 56.30 55.57 1ar4 h ASN 74 Cb 0.12 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.37 1ar4 h ASN 74 CO 0.01 0.38 -0.54 0.45 -1.65 0.00 0.00 177.43 176.07 1ar4 h HIS 75 N 0.63 0.83 -0.81 1.19 3.86 -1.35 -1.03 115.15 118.47 1ar4 h HIS 75 Ca 0.19 -0.29 -0.00 0.00 -1.16 0.00 0.00 60.37 59.11 1ar4 h HIS 75 Cb -0.03 -0.16 -0.04 0.00 1.06 0.00 0.00 27.41 28.24 1ar4 h HIS 75 CO -0.05 1.06 0.50 0.77 0.86 0.00 0.00 177.93 181.07 1ar4 h SER 76 N 0.51 0.96 -0.28 2.45 0.02 -0.93 -1.71 113.55 114.58 1ar4 h SER 76 Ca 0.01 -0.05 -0.09 0.00 -0.84 0.00 0.00 61.79 60.82 1ar4 h SER 76 Cb 1.11 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.40 1ar4 h SER 76 CO 0.11 0.73 -0.17 0.58 -1.14 0.00 0.00 176.83 176.94 1ar4 h VAL 77 N 1.11 1.30 -0.67 2.27 2.07 -1.28 -3.26 116.25 117.79 1ar4 h VAL 77 Ca 0.29 -1.29 0.11 0.00 0.82 0.00 0.00 66.70 66.63 1ar4 h VAL 77 Cb -0.07 1.54 -0.08 0.00 -1.52 0.00 0.00 31.29 31.16 1ar4 h VAL 77 CO -0.06 0.41 0.27 0.15 0.02 0.00 0.00 177.57 178.37 1ar4 h PHE 78 N 0.34 0.48 -0.30 1.57 3.57 -0.55 -1.36 116.94 120.69 1ar4 h PHE 78 Ca 0.06 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1ar4 h PHE 78 Cb 0.70 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 1ar4 h PHE 78 CO 0.07 0.12 0.14 -1.49 -2.23 0.00 0.00 178.31 174.92 1ar4 h TRP 79 N 0.46 0.43 0.00 0.41 -0.00 -1.38 -2.92 115.95 112.96 1ar4 h TRP 79 Ca 0.34 -0.02 -0.04 0.00 -0.00 0.00 0.00 58.89 59.17 1ar4 h TRP 79 Cb 0.44 -0.13 -0.01 0.00 -0.00 0.00 0.00 29.16 29.46 1ar4 h TRP 79 CO -0.15 0.39 -0.20 0.87 -0.00 0.00 0.00 178.44 179.34 1ar4 h LYS 80 N 0.35 0.00 0.00 0.49 1.57 -1.52 -2.92 116.57 114.54 1ar4 h LYS 80 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1ar4 h LYS 80 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1ar4 h LYS 80 CO -0.01 0.20 0.00 0.09 -0.57 0.00 0.00 179.45 179.16 1ar4 n ASN 81 N -3.35 0.00 -4.44 0.86 3.02 -0.54 -4.74 115.26 106.06 1ar4 n ASN 81 Ca 0.00 0.13 -0.26 0.00 -0.03 0.00 0.00 54.58 54.43 1ar4 n ASN 81 Cb 0.43 -0.34 -0.11 0.00 -0.61 0.00 0.00 39.78 39.15 1ar4 n ASN 81 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1ar4 s MET 82 N -2.68 1.59 -0.04 3.52 -1.94 -1.10 -0.47 119.30 118.18 1ar4 s MET 82 Ca 0.16 -1.63 -0.30 0.00 -1.71 0.00 0.00 55.69 52.22 1ar4 s MET 82 Cb 0.13 -1.82 0.09 0.00 2.01 0.00 0.00 34.83 35.24 1ar4 s MET 82 CO 0.31 0.37 0.75 0.00 -0.01 0.00 0.00 175.02 176.45 1ar4 s ALA 83 N -2.03 -1.79 0.28 3.03 0.00 -0.11 -4.68 121.76 116.46 1ar4 s ALA 83 Ca 0.25 1.24 -0.30 0.00 0.00 0.00 0.00 51.96 53.15 1ar4 s ALA 83 Cb -0.07 -0.01 -0.12 0.00 0.00 0.00 0.00 23.12 22.92 1ar4 s ALA 83 CO 0.12 -0.43 1.45 -0.35 0.00 0.00 0.00 175.76 176.55 1ar4 n PRO 84 N 0.61 2.30 -1.65 0.00 -0.04 -1.26 -4.58 135.00 130.38 1ar4 n PRO 84 Ca -0.16 0.82 -0.46 0.00 -0.04 0.00 0.00 63.50 63.66 1ar4 n PRO 84 Cb 0.59 -2.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.51 1ar4 n PRO 84 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1ar4 n LYS 85 N 1.72 1.88 0.00 0.54 4.81 -1.26 -1.55 118.16 124.30 1ar4 n LYS 85 Ca 0.09 0.67 0.00 0.00 -0.87 0.00 0.00 58.31 58.20 1ar4 n LYS 85 Cb 0.34 -2.32 0.00 0.00 0.02 0.00 0.00 35.03 33.08 1ar4 n LYS 85 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ar4 n GLY 86 N 2.29 2.93 0.16 3.14 0.00 -1.26 -4.87 105.19 107.58 1ar4 n GLY 86 Ca 0.13 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.95 1ar4 n GLY 86 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ar4 h SER 87 N 0.14 0.72 -3.07 1.61 0.02 -1.63 -3.45 113.55 107.89 1ar4 h SER 87 Ca 0.00 -0.79 -0.62 0.00 -0.84 0.00 0.00 61.79 59.54 1ar4 h SER 87 Cb 0.00 -0.22 -0.12 0.00 0.14 0.00 0.00 62.40 62.20 1ar4 h SER 87 CO 0.00 1.43 -0.67 0.00 -1.14 0.00 0.00 176.83 176.44 1ar4 s ALA 88 N -3.11 3.18 0.60 3.77 0.00 -1.25 -5.07 121.76 119.88 1ar4 s ALA 88 Ca -0.11 -1.30 -0.15 0.00 0.00 0.00 0.00 51.96 50.40 1ar4 s ALA 88 Cb 0.05 -1.02 -0.03 0.00 0.00 0.00 0.00 23.12 22.12 1ar4 s ALA 88 CO 0.88 0.55 1.05 -1.25 0.00 0.00 0.00 175.76 176.99 1ar4 s PRO 89 N -2.71 3.32 0.07 0.00 0.04 -1.26 -4.94 135.00 129.52 1ar4 s PRO 89 Ca 0.26 1.12 -0.04 0.00 0.04 0.00 0.00 61.00 62.38 1ar4 s PRO 89 Cb -0.10 -2.04 -0.05 0.00 0.04 0.00 0.00 34.50 32.36 1ar4 s PRO 89 CO 0.18 -0.80 0.28 -1.21 0.04 0.00 0.00 177.00 175.49 1ar4 s GLU 90 N -4.28 3.54 0.17 4.56 0.41 -1.26 -4.08 118.70 117.76 1ar4 s GLU 90 Ca 0.62 -0.21 0.00 0.00 -0.41 0.00 0.00 54.97 54.97 1ar4 s GLU 90 Cb -0.15 -2.99 0.00 0.00 -1.78 0.00 0.00 34.13 29.22 1ar4 s GLU 90 CO 0.40 0.57 0.00 0.54 -0.49 0.00 0.00 175.26 176.28 1ar4 n ARG 91 N 0.49 -2.16 -1.84 1.61 1.74 -1.26 -4.92 116.66 110.32 1ar4 n ARG 91 Ca -0.06 1.57 -0.39 0.00 -0.77 0.00 0.00 57.85 58.19 1ar4 n ARG 91 Cb 0.52 -1.73 0.02 0.00 -1.02 0.00 0.00 32.46 30.25 1ar4 n ARG 91 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 1ar4 s PRO 92 N -3.50 3.63 0.27 5.56 0.02 -1.26 -4.98 135.00 134.74 1ar4 s PRO 92 Ca 0.00 2.34 0.09 0.00 0.02 0.00 0.00 61.00 63.45 1ar4 s PRO 92 Cb 0.00 -2.59 -0.05 0.00 0.02 0.00 0.00 34.50 31.87 1ar4 s PRO 92 CO 0.00 -0.84 -0.12 0.99 -0.33 0.00 0.00 177.00 176.70 1ar4 s THR 93 N -1.23 1.99 0.00 0.99 2.01 -1.26 -4.28 115.64 113.85 1ar4 s THR 93 Ca 0.62 -2.23 0.00 0.00 0.31 0.00 0.00 61.69 60.39 1ar4 s THR 93 Cb -0.42 -2.35 0.00 0.00 0.01 0.00 0.00 72.50 69.74 1ar4 s THR 93 CO 0.53 -0.38 0.00 0.47 -0.69 0.00 0.00 174.62 174.55 1ar4 n ASP 94 N -0.58 0.00 -0.16 3.53 8.00 -1.26 -2.50 116.55 123.58 1ar4 n ASP 94 Ca -0.06 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 55.39 1ar4 n ASP 94 Cb 0.62 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.76 1ar4 n ASP 94 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1ar4 h GLU 95 N 0.00 0.48 -0.44 -1.24 3.07 -1.99 -1.45 114.58 113.00 1ar4 h GLU 95 Ca 0.00 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.82 1ar4 h GLU 95 Cb 0.00 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 1ar4 h GLU 95 CO 0.00 0.32 0.21 1.25 -1.40 0.00 0.00 179.01 179.39 1ar4 h LEU 96 N 0.49 0.57 -0.67 1.33 5.85 -1.90 -0.64 115.31 120.35 1ar4 h LEU 96 Ca 0.21 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.84 1ar4 h LEU 96 Cb 0.11 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 1ar4 h LEU 96 CO -0.14 0.54 0.41 1.23 -0.34 0.00 0.00 178.44 180.14 1ar4 h GLY 97 N 0.57 0.97 1.04 3.75 0.00 -1.16 -0.93 103.07 107.31 1ar4 h GLY 97 Ca 0.15 -0.31 -0.10 0.00 0.00 0.00 0.00 47.33 47.07 1ar4 h GLY 97 CO -0.02 0.26 -0.06 0.00 0.00 0.00 0.00 176.54 176.71 1ar4 h ALA 98 N 1.29 0.69 -0.58 3.60 0.00 -1.03 -2.14 119.26 121.10 1ar4 h ALA 98 Ca 0.27 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1ar4 h ALA 98 Cb 0.03 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1ar4 h ALA 98 CO -0.11 0.56 0.16 0.00 0.00 0.00 0.00 179.25 179.85 1ar4 h ALA 99 N 0.92 1.19 -0.47 0.00 0.00 -0.69 -0.14 119.26 120.06 1ar4 h ALA 99 Ca 0.14 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 1ar4 h ALA 99 Cb 0.61 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1ar4 h ALA 99 CO 0.04 0.56 -0.14 0.82 0.00 0.00 0.00 179.25 180.53 1ar4 h ILE 100 N 0.85 1.27 -0.18 0.00 2.04 -1.01 -1.02 117.51 119.47 1ar4 h ILE 100 Ca 0.19 -1.28 -0.08 0.00 1.00 0.00 0.00 64.86 64.69 1ar4 h ILE 100 Cb 0.28 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 1ar4 h ILE 100 CO -0.00 0.44 -0.24 0.44 0.00 0.00 0.00 178.15 178.79 1ar4 h ASP 101 N 0.77 0.32 -0.12 1.72 3.32 -1.01 -0.29 116.42 121.13 1ar4 h ASP 101 Ca 0.12 -0.10 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 1ar4 h ASP 101 Cb 0.70 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.16 1ar4 h ASP 101 CO 0.05 0.57 -0.12 -0.08 -1.72 0.00 0.00 179.24 177.94 1ar4 h GLU 102 N 0.29 0.28 -0.00 3.56 4.81 -0.66 -0.21 114.58 122.65 1ar4 h GLU 102 Ca 0.05 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1ar4 h GLU 102 Cb 0.58 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1ar4 h GLU 102 CO 0.04 0.69 -0.50 1.19 -0.73 0.00 0.00 179.01 179.71 1ar4 n PHE 103 N -4.61 0.00 0.00 0.92 3.72 -0.42 -4.36 117.46 112.71 1ar4 n PHE 103 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1ar4 n PHE 103 Cb 0.34 -0.16 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 1ar4 n PHE 103 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1ar4 n PHE 104 N -1.17 0.00 0.00 1.38 3.72 -0.13 -5.00 117.46 116.27 1ar4 n PHE 104 Ca 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.47 1ar4 n PHE 104 Cb 0.35 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.89 1ar4 n PHE 104 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ar4 n GLY 105 N 0.59 2.88 3.81 1.37 0.00 -0.09 -4.54 105.19 109.22 1ar4 n GLY 105 Ca 0.00 -0.75 -0.05 0.00 0.00 0.00 0.00 46.02 45.22 1ar4 n GLY 105 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ar4 s SER 106 N 0.00 -0.15 0.17 1.61 1.04 -1.26 -4.70 113.70 110.41 1ar4 s SER 106 Ca 0.00 -0.63 -0.10 0.00 0.48 0.00 0.00 55.95 55.71 1ar4 s SER 106 Cb 0.00 0.63 0.04 0.00 0.10 0.00 0.00 66.02 66.79 1ar4 s SER 106 CO 0.00 -1.19 1.60 0.15 0.98 0.00 0.00 173.24 174.78 1ar4 h PHE 107 N 2.00 1.15 -0.59 5.02 3.57 -1.92 -2.36 116.94 123.81 1ar4 h PHE 107 Ca -0.24 -0.23 -0.05 0.00 3.53 0.00 0.00 57.97 60.98 1ar4 h PHE 107 Cb 1.24 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.66 1ar4 h PHE 107 CO 0.67 1.05 0.17 -0.44 -2.23 0.00 0.00 178.31 177.53 1ar4 h ASP 108 N 0.92 0.84 -0.48 0.41 5.19 -1.96 -0.47 116.42 120.87 1ar4 h ASP 108 Ca 0.15 -0.14 -0.07 0.00 -0.62 0.00 0.00 57.03 56.34 1ar4 h ASP 108 Cb 0.64 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.92 1ar4 h ASP 108 CO 0.04 0.80 0.02 0.78 -3.12 0.00 0.00 179.24 177.77 1ar4 h ASN 109 N 0.88 0.81 -0.29 6.45 4.21 -1.80 -0.97 115.58 124.86 1ar4 h ASN 109 Ca 0.19 -0.29 -0.04 0.00 1.21 0.00 0.00 56.30 57.37 1ar4 h ASN 109 Cb 0.28 -0.22 -0.01 0.00 -1.12 0.00 0.00 38.32 37.25 1ar4 h ASN 109 CO -0.01 0.90 0.04 -0.03 -1.29 0.00 0.00 177.43 177.05 1ar4 h MET 110 N 0.69 0.49 -0.95 0.81 4.05 -1.14 -1.81 114.93 117.06 1ar4 h MET 110 Ca 0.14 -0.14 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1ar4 h MET 110 Cb 0.47 -0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 31.17 1ar4 h MET 110 CO 0.02 0.61 0.60 -0.22 0.23 0.00 0.00 176.91 178.15 1ar4 h LYS 111 N 0.31 1.27 -0.38 0.39 3.64 -0.99 0.12 116.57 120.93 1ar4 h LYS 111 Ca 0.09 -0.09 -0.13 0.00 -1.27 0.00 0.00 60.65 59.24 1ar4 h LYS 111 Cb 0.36 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1ar4 h LYS 111 CO 0.01 0.86 -0.29 0.00 -2.27 0.00 0.00 179.45 177.76 1ar4 h ALA 112 N 1.33 0.55 -0.47 5.00 0.00 -1.04 -0.48 119.26 124.15 1ar4 h ALA 112 Ca 0.34 -0.41 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1ar4 h ALA 112 Cb -0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1ar4 h ALA 112 CO -0.07 0.58 -0.05 0.37 0.00 0.00 0.00 179.25 180.08 1ar4 h GLN 113 N 0.67 0.86 -0.59 0.00 4.15 -1.02 -1.25 115.11 117.93 1ar4 h GLN 113 Ca 0.07 -0.30 -0.06 0.00 0.77 0.00 0.00 58.65 59.13 1ar4 h GLN 113 Cb 0.87 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.47 1ar4 h GLN 113 CO 0.08 0.93 0.15 0.35 -1.93 0.00 0.00 178.83 178.41 1ar4 h PHE 114 N 0.70 0.99 -0.43 3.99 3.04 -0.92 -1.42 116.94 122.89 1ar4 h PHE 114 Ca 0.13 -0.12 -0.05 0.00 3.98 0.00 0.00 57.97 61.91 1ar4 h PHE 114 Cb 0.58 -0.28 -0.02 0.00 2.56 0.00 0.00 35.95 38.79 1ar4 h PHE 114 CO 0.04 0.84 0.07 1.15 -2.02 0.00 0.00 178.31 178.39 1ar4 h THR 115 N 0.85 1.24 -0.84 4.41 2.02 -0.93 -1.10 112.91 118.58 1ar4 h THR 115 Ca 0.19 -0.88 -0.03 0.00 0.77 0.00 0.00 66.41 66.45 1ar4 h THR 115 Cb 0.34 0.99 -0.04 0.00 -1.74 0.00 0.00 68.15 67.71 1ar4 h THR 115 CO 0.00 0.31 0.41 0.00 0.37 0.00 0.00 175.52 176.60 1ar4 h ALA 116 N 0.94 1.14 -0.40 6.16 0.00 -1.05 -1.32 119.26 124.73 1ar4 h ALA 116 Ca 0.13 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1ar4 h ALA 116 Cb 0.38 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1ar4 h ALA 116 CO 0.01 0.65 -0.10 0.00 0.00 0.00 0.00 179.25 179.81 1ar4 h ALA 117 N 1.25 1.07 -0.11 0.00 0.00 -0.97 -2.19 119.26 118.31 1ar4 h ALA 117 Ca 0.29 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1ar4 h ALA 117 Cb 0.11 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ar4 h ALA 117 CO -0.04 0.57 -0.17 0.00 0.00 0.00 0.00 179.25 179.61 1ar4 h ALA 118 N 1.25 0.17 0.00 0.00 0.00 -0.67 -3.33 119.26 116.68 1ar4 h ALA 118 Ca 0.11 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1ar4 h ALA 118 Cb 0.55 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1ar4 h ALA 118 CO 0.03 0.09 -0.07 1.79 0.00 0.00 0.00 179.25 181.09 1ar4 h THR 119 N -0.10 0.00 -0.01 0.00 1.35 -1.25 -3.32 112.91 109.57 1ar4 h THR 119 Ca 0.01 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 1ar4 h THR 119 Cb 0.74 1.64 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 1ar4 h THR 119 CO 0.04 0.00 -0.11 0.61 -0.25 0.00 0.00 175.52 175.81 1ar4 n GLY 120 N 1.23 -0.13 3.70 5.82 0.00 -0.83 -4.95 105.19 110.03 1ar4 n GLY 120 Ca 0.05 -0.46 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 1ar4 n GLY 120 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ar4 n ILE 121 N -0.02 0.03 -3.29 -0.61 5.41 -1.25 -4.92 119.36 114.71 1ar4 n ILE 121 Ca 0.16 -0.01 -0.45 0.00 1.00 0.00 0.00 62.75 63.46 1ar4 n ILE 121 Cb 0.38 -1.87 0.00 0.00 -0.71 0.00 0.00 39.64 37.44 1ar4 n ILE 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ar4 n GLN 122 N 3.96 3.55 0.00 0.38 6.02 -1.26 -4.90 117.38 125.13 1ar4 n GLN 122 Ca 0.16 -4.40 0.00 0.00 -0.01 0.00 0.00 57.00 52.76 1ar4 n GLN 122 Cb 0.33 -2.60 0.00 0.00 1.02 0.00 0.00 30.24 28.99 1ar4 n GLN 122 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ar4 n GLY 123 N 2.78 0.72 3.83 1.08 0.00 -1.26 -5.05 105.19 107.28 1ar4 n GLY 123 Ca 0.25 -2.12 -0.33 0.00 0.00 0.00 0.00 46.02 43.83 1ar4 n GLY 123 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ar4 s SER 124 N -4.00 6.80 0.00 1.61 0.01 -1.26 -4.93 113.70 111.93 1ar4 s SER 124 Ca 0.00 1.62 0.00 0.00 1.31 0.00 0.00 55.95 58.88 1ar4 s SER 124 Cb 0.00 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.71 1ar4 s SER 124 CO 0.00 -0.45 0.00 0.61 0.41 0.00 0.00 173.24 173.81 1ar4 n GLY 125 N -1.03 -1.37 3.07 3.44 0.00 -1.26 -0.45 105.19 107.59 1ar4 n GLY 125 Ca 0.07 -0.97 -0.12 0.00 0.00 0.00 0.00 46.02 45.00 1ar4 n GLY 125 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ar4 s TRP 126 N -2.68 0.65 -0.19 1.61 0.52 -0.67 -0.76 118.94 117.43 1ar4 s TRP 126 Ca 0.00 -0.60 -0.06 0.00 0.02 0.00 0.00 56.10 55.46 1ar4 s TRP 126 Cb 0.00 -0.40 -0.03 0.00 -1.15 0.00 0.00 33.47 31.89 1ar4 s TRP 126 CO 0.00 -0.12 0.03 0.00 0.02 0.00 0.00 176.95 176.88 1ar4 s ALA 127 N -1.87 3.21 -0.02 0.98 0.00 -0.83 -1.08 121.76 122.16 1ar4 s ALA 127 Ca -0.06 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.05 1ar4 s ALA 127 Cb -0.07 -1.83 0.01 0.00 0.00 0.00 0.00 23.12 21.23 1ar4 s ALA 127 CO -0.01 0.04 -0.05 0.45 0.00 0.00 0.00 175.76 176.19 1ar4 s SER 128 N 0.65 0.72 -0.37 0.00 0.15 0.10 -1.20 113.70 113.75 1ar4 s SER 128 Ca 0.01 -0.10 -0.12 0.00 0.70 0.00 0.00 55.95 56.44 1ar4 s SER 128 Cb -0.14 -0.22 0.02 0.00 -1.71 0.00 0.00 66.02 63.97 1ar4 s SER 128 CO 0.02 0.01 0.23 -0.22 1.20 0.00 0.00 173.24 174.47 1ar4 s LEU 129 N 0.37 4.74 0.33 3.45 2.96 0.53 0.01 118.68 131.07 1ar4 s LEU 129 Ca -0.04 -0.89 0.09 0.00 -0.22 0.00 0.00 54.13 53.07 1ar4 s LEU 129 Cb -0.08 -2.06 -0.06 0.00 0.50 0.00 0.00 46.19 44.49 1ar4 s LEU 129 CO -0.00 -0.37 -0.10 0.68 -1.32 0.00 0.00 176.35 175.24 1ar4 s VAL 130 N 1.60 2.15 -0.24 1.68 -7.23 -0.17 -0.49 120.40 117.70 1ar4 s VAL 130 Ca 0.03 -2.21 -0.11 0.00 -1.81 0.00 0.00 61.98 57.88 1ar4 s VAL 130 Cb -0.19 -2.58 -0.05 0.00 0.56 0.00 0.00 36.38 34.12 1ar4 s VAL 130 CO 0.08 -0.24 0.19 0.86 -0.31 0.00 0.00 175.10 175.68 1ar4 s TRP 131 N -2.68 3.32 -0.48 2.82 -0.11 0.43 -1.48 118.94 120.76 1ar4 s TRP 131 Ca 0.32 0.27 -0.19 0.00 1.22 0.00 0.00 56.10 57.72 1ar4 s TRP 131 Cb 0.02 -2.31 0.05 0.00 -1.50 0.00 0.00 33.47 29.73 1ar4 s TRP 131 CO 0.15 0.05 0.59 0.34 -4.62 0.00 0.00 176.95 173.46 1ar4 s ASP 132 N 1.09 6.23 0.39 5.86 2.15 0.63 -2.27 116.67 130.76 1ar4 s ASP 132 Ca 0.09 -0.83 0.10 0.00 0.43 0.00 0.00 52.55 52.34 1ar4 s ASP 132 Cb -0.14 -2.28 0.81 0.00 -0.30 0.00 0.00 42.92 41.01 1ar4 s ASP 132 CO 0.05 -0.82 1.94 -0.65 -0.17 0.00 0.00 175.17 175.52 1ar4 h PRO 133 N 8.93 0.25 0.04 4.34 0.11 -1.85 0.23 132.00 144.04 1ar4 h PRO 133 Ca -0.27 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 65.65 1ar4 h PRO 133 Cb 1.10 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 32.18 1ar4 h PRO 133 CO 0.92 0.36 -0.57 1.25 -0.21 0.00 0.00 178.00 179.75 1ar4 h LEU 134 N 0.24 0.44 -0.25 2.35 5.85 -1.92 -3.33 115.31 118.69 1ar4 h LEU 134 Ca 0.05 -0.82 0.00 0.00 0.84 0.00 0.00 57.88 57.95 1ar4 h LEU 134 Cb 0.32 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1ar4 h LEU 134 CO 0.02 1.21 -0.42 0.61 -0.34 0.00 0.00 178.44 179.53 1ar4 n GLY 135 N 1.25 -0.91 3.58 3.75 0.00 -1.21 -4.97 105.19 106.68 1ar4 n GLY 135 Ca -0.11 -0.40 -0.25 0.00 0.00 0.00 0.00 46.02 45.26 1ar4 n GLY 135 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ar4 n LYS 136 N -1.08 -2.31 -3.95 1.61 4.76 0.78 -4.99 118.16 112.98 1ar4 n LYS 136 Ca 0.09 0.59 -0.09 0.00 -2.87 0.00 0.00 58.31 56.03 1ar4 n LYS 136 Cb 0.34 -4.78 -0.04 0.00 -1.84 0.00 0.00 35.03 28.71 1ar4 n LYS 136 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 1ar4 s ARG 137 N -5.60 1.58 -0.21 1.97 1.70 -1.07 -4.99 118.95 112.33 1ar4 s ARG 137 Ca 0.36 -1.16 -0.08 0.00 -0.47 0.00 0.00 55.73 54.38 1ar4 s ARG 137 Cb -0.10 0.50 -0.04 0.00 -0.57 0.00 0.00 34.95 34.74 1ar4 s ARG 137 CO 0.82 -0.67 0.07 0.42 -1.08 0.00 0.00 175.30 174.86 1ar4 s ILE 138 N -3.98 4.69 0.32 4.99 1.01 -1.26 -0.27 121.20 126.70 1ar4 s ILE 138 Ca 0.19 -0.06 0.06 0.00 0.00 0.00 0.00 60.65 60.84 1ar4 s ILE 138 Cb -0.02 -3.14 -0.06 0.00 0.01 0.00 0.00 42.46 39.25 1ar4 s ILE 138 CO 0.07 0.41 -0.02 0.20 0.00 0.00 0.00 174.94 175.61 1ar4 s ASN 139 N 0.79 2.92 -0.10 3.58 0.02 -0.55 -4.91 114.94 116.69 1ar4 s ASN 139 Ca 0.04 -1.27 -0.01 0.00 -1.02 0.00 0.00 52.86 50.60 1ar4 s ASN 139 Cb -0.13 -0.20 -0.03 0.00 0.02 0.00 0.00 41.25 40.91 1ar4 s ASN 139 CO 0.02 -0.41 -0.06 0.42 0.02 0.00 0.00 177.10 177.08 1ar4 s THR 140 N -3.00 3.71 0.10 1.60 -4.23 -1.26 -1.00 115.64 111.56 1ar4 s THR 140 Ca 0.32 -0.46 0.07 0.00 -1.18 0.00 0.00 61.69 60.45 1ar4 s THR 140 Cb 0.06 -2.55 -0.03 0.00 1.34 0.00 0.00 72.50 71.31 1ar4 s THR 140 CO 0.14 0.56 -0.18 -0.76 -0.54 0.00 0.00 174.62 173.84 1ar4 s LEU 141 N -0.33 2.31 -0.40 4.79 1.43 0.10 -4.98 118.68 121.60 1ar4 s LEU 141 Ca 0.05 -0.68 -0.02 0.00 -1.03 0.00 0.00 54.13 52.45 1ar4 s LEU 141 Cb -0.12 -0.75 0.11 0.00 0.03 0.00 0.00 46.19 45.46 1ar4 s LEU 141 CO 0.02 -0.00 0.18 -1.58 0.23 0.00 0.00 176.35 175.20 1ar4 s GLN 142 N -1.96 1.91 0.36 1.70 0.74 -1.26 -0.72 119.66 120.44 1ar4 s GLN 142 Ca 0.05 -1.84 -0.25 0.00 0.05 0.00 0.00 55.36 53.37 1ar4 s GLN 142 Cb -0.09 -3.52 -0.09 0.00 1.10 0.00 0.00 33.01 30.40 1ar4 s GLN 142 CO 0.04 -1.05 1.01 -0.06 -0.55 0.00 0.00 175.29 174.68 1ar4 s PHE 143 N 1.09 3.45 -0.15 1.67 0.08 -0.24 -4.70 117.98 119.18 1ar4 s PHE 143 Ca 0.09 1.70 -0.05 0.00 0.12 0.00 0.00 56.93 58.78 1ar4 s PHE 143 Cb -0.22 -3.05 -0.04 0.00 -0.57 0.00 0.00 43.02 39.14 1ar4 s PHE 143 CO -0.05 -0.29 0.03 0.71 -0.10 0.00 0.00 175.22 175.53 1ar4 s TYR 144 N -1.63 3.21 0.00 0.36 2.02 -0.12 -1.67 117.35 119.53 1ar4 s TYR 144 Ca 0.54 0.05 0.00 0.00 -0.37 0.00 0.00 57.07 57.29 1ar4 s TYR 144 Cb -0.21 -1.98 0.00 0.00 -0.40 0.00 0.00 41.96 39.37 1ar4 s TYR 144 CO 0.26 0.22 0.00 -0.25 -1.57 0.00 0.00 175.55 174.22 1ar4 n ASP 145 N 3.13 0.00 0.00 2.29 8.00 0.40 -2.08 116.55 128.28 1ar4 n ASP 145 Ca -0.17 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.33 1ar4 n ASP 145 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 1ar4 n ASP 145 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1ar4 n HIS 146 N 5.07 0.00 -0.17 1.24 8.25 -1.26 -4.01 115.22 124.33 1ar4 n HIS 146 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.48 1ar4 n HIS 146 Cb 0.00 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.17 1ar4 n HIS 146 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ar4 n GLN 147 N -1.46 2.81 -4.33 -0.41 0.00 -1.22 -4.74 117.38 108.03 1ar4 n GLN 147 Ca 0.00 -1.77 -0.27 0.00 0.00 0.00 0.00 57.00 54.96 1ar4 n GLN 147 Cb 0.31 -1.13 -0.10 0.00 0.00 0.00 0.00 30.24 29.31 1ar4 n GLN 147 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 1ar4 s ASN 148 N -1.20 3.96 -0.46 2.61 0.01 -0.89 -4.80 114.94 114.18 1ar4 s ASN 148 Ca 0.10 -0.66 -0.01 0.00 -0.71 0.00 0.00 52.86 51.57 1ar4 s ASN 148 Cb 0.06 -0.56 0.00 0.00 0.41 0.00 0.00 41.25 41.17 1ar4 s ASN 148 CO 0.04 0.12 0.39 -3.20 -1.51 0.00 0.00 177.10 172.94 1ar4 n ASN 149 N 0.20 -2.56 -3.69 -1.22 4.05 -1.26 -0.94 115.26 109.84 1ar4 n ASN 149 Ca -0.12 -0.22 -0.14 0.00 0.45 0.00 0.00 54.58 54.55 1ar4 n ASN 149 Cb 0.55 -2.19 -0.09 0.00 1.23 0.00 0.00 39.78 39.29 1ar4 n ASN 149 CO 0.00 0.00 0.00 -1.48 -3.05 0.00 0.00 177.26 172.73 1ar4 s LEU 150 N -3.50 0.23 0.43 1.20 2.34 -1.26 -4.47 118.68 113.65 1ar4 s LEU 150 Ca 0.07 0.66 -0.22 0.00 0.06 0.00 0.00 54.13 54.71 1ar4 s LEU 150 Cb -0.03 1.69 -0.10 0.00 -0.56 0.00 0.00 46.19 47.18 1ar4 s LEU 150 CO 0.27 -0.33 0.98 -2.84 -1.06 0.00 0.00 176.35 173.37 1ar4 s PRO 151 N -0.46 4.14 0.47 1.48 0.02 -1.26 -5.02 135.00 134.37 1ar4 s PRO 151 Ca -0.06 1.24 -0.23 0.00 0.02 0.00 0.00 61.00 61.97 1ar4 s PRO 151 Cb -0.03 -2.25 -0.07 0.00 0.02 0.00 0.00 34.50 32.17 1ar4 s PRO 151 CO 0.03 -0.12 1.22 0.00 -0.33 0.00 0.00 177.00 177.81 1ar4 s ALA 152 N -2.02 2.97 0.00 -1.55 0.00 -1.26 -2.86 121.76 117.04 1ar4 s ALA 152 Ca 0.62 1.06 0.00 0.00 0.00 0.00 0.00 51.96 53.64 1ar4 s ALA 152 Cb -0.13 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.55 1ar4 s ALA 152 CO 0.17 -0.84 0.00 0.41 0.00 0.00 0.00 175.76 175.50 1ar4 n GLY 153 N 0.54 1.26 3.72 0.00 0.00 -1.26 -5.02 105.19 104.43 1ar4 n GLY 153 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1ar4 n GLY 153 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ar4 s SER 154 N -2.93 6.56 -0.32 1.61 0.01 -1.13 -4.58 113.70 112.91 1ar4 s SER 154 Ca 0.00 2.64 -0.08 0.00 1.31 0.00 0.00 55.95 59.82 1ar4 s SER 154 Cb 0.00 -2.59 0.02 0.00 0.21 0.00 0.00 66.02 63.66 1ar4 s SER 154 CO 0.00 -0.85 0.12 -0.63 0.41 0.00 0.00 173.24 172.29 1ar4 s ILE 155 N 1.31 4.11 0.30 1.44 1.01 -0.96 -4.94 121.20 123.46 1ar4 s ILE 155 Ca 0.71 -0.81 -0.29 0.00 0.00 0.00 0.00 60.65 60.26 1ar4 s ILE 155 Cb -0.44 -3.20 -0.10 0.00 0.01 0.00 0.00 42.46 38.72 1ar4 s ILE 155 CO 0.31 -0.05 1.39 -2.16 0.00 0.00 0.00 174.94 174.43 1ar4 s PRO 156 N 1.50 4.29 -0.03 2.79 0.04 -1.26 -0.43 135.00 141.89 1ar4 s PRO 156 Ca 0.02 2.30 -0.01 0.00 0.04 0.00 0.00 61.00 63.35 1ar4 s PRO 156 Cb -0.18 -3.07 -0.02 0.00 0.04 0.00 0.00 34.50 31.26 1ar4 s PRO 156 CO 0.04 -0.33 -0.04 1.28 0.04 0.00 0.00 177.00 177.99 1ar4 n LEU 157 N 1.41 1.89 -3.72 -3.56 4.77 0.35 -4.88 117.00 113.27 1ar4 n LEU 157 Ca 0.03 0.01 -0.14 0.00 -0.03 0.00 0.00 56.01 55.88 1ar4 n LEU 157 Cb 0.41 -0.11 -0.14 0.00 -2.33 0.00 0.00 43.42 41.24 1ar4 n LEU 157 CO 0.60 0.36 -0.21 -0.22 -1.33 0.00 0.00 177.39 176.60 1ar4 s LEU 158 N -5.60 0.41 0.03 2.23 2.96 -0.95 -4.51 118.68 113.25 1ar4 s LEU 158 Ca -0.05 0.36 0.04 0.00 -0.22 0.00 0.00 54.13 54.27 1ar4 s LEU 158 Cb 0.01 0.42 -0.02 0.00 0.50 0.00 0.00 46.19 47.11 1ar4 s LEU 158 CO 0.07 -0.18 -0.13 -1.10 -1.32 0.00 0.00 176.35 173.69 1ar4 s GLN 159 N 1.54 0.91 -0.16 1.98 -0.21 -1.26 -0.34 119.66 122.11 1ar4 s GLN 159 Ca -0.06 -0.70 0.00 0.00 0.02 0.00 0.00 55.36 54.63 1ar4 s GLN 159 Cb -0.12 -0.90 0.03 0.00 1.00 0.00 0.00 33.01 33.03 1ar4 s GLN 159 CO -0.06 0.22 -0.11 -1.17 -2.12 0.00 0.00 175.29 172.05 1ar4 s LEU 160 N -1.02 1.78 -0.21 2.90 2.96 -0.34 -4.77 118.68 119.97 1ar4 s LEU 160 Ca 0.01 -0.60 -0.29 0.00 -0.22 0.00 0.00 54.13 53.04 1ar4 s LEU 160 Cb -0.07 -1.12 -0.01 0.00 0.50 0.00 0.00 46.19 45.48 1ar4 s LEU 160 CO 0.01 -0.10 1.37 -0.62 -1.32 0.00 0.00 176.35 175.68 1ar4 s ASP 161 N 1.51 6.74 -0.09 3.68 -1.08 -1.26 -1.96 116.67 124.21 1ar4 s ASP 161 Ca 0.03 1.57 0.16 0.00 -0.52 0.00 0.00 52.55 53.78 1ar4 s ASP 161 Cb -0.14 -2.54 0.54 0.00 -1.46 0.00 0.00 42.92 39.32 1ar4 s ASP 161 CO -0.09 -0.96 1.45 0.23 0.52 0.00 0.00 175.17 176.32 1ar4 n MET 162 N 7.06 3.22 -2.31 4.34 2.81 0.06 -4.85 117.12 127.45 1ar4 n MET 162 Ca 0.15 -2.59 -0.37 0.00 -1.81 0.00 0.00 57.70 53.08 1ar4 n MET 162 Cb 0.45 -1.66 -0.02 0.00 -0.71 0.00 0.00 33.22 31.29 1ar4 n MET 162 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 1ar4 s TRP 163 N -1.76 2.96 0.51 2.03 0.52 -1.21 -4.33 118.94 117.66 1ar4 s TRP 163 Ca 0.40 1.56 0.18 0.00 0.02 0.00 0.00 56.10 58.26 1ar4 s TRP 163 Cb 0.26 -3.33 1.26 0.00 -1.15 0.00 0.00 33.47 30.51 1ar4 s TRP 163 CO 0.18 -1.32 2.08 0.93 0.02 0.00 0.00 176.95 178.84 1ar4 h GLU 164 N 2.16 0.07 0.00 4.98 5.08 -1.93 -1.27 114.58 123.67 1ar4 h GLU 164 Ca -0.49 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1ar4 h GLU 164 Cb 1.24 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1ar4 h GLU 164 CO 0.61 0.05 0.00 1.12 -1.00 0.00 0.00 179.01 179.78 1ar4 h HIS 165 N 0.07 0.00 0.00 4.33 2.07 -1.98 0.54 115.15 120.19 1ar4 h HIS 165 Ca 0.12 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.64 1ar4 h HIS 165 Cb 0.38 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.36 1ar4 h HIS 165 CO -0.00 0.00 -0.01 0.00 -3.07 0.00 0.00 177.93 174.85 1ar4 h ALA 166 N 2.11 1.00 0.00 6.11 0.00 -1.55 -3.41 119.26 123.51 1ar4 h ALA 166 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ar4 h ALA 166 Cb 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ar4 h ALA 166 CO 0.00 0.01 0.00 1.97 0.00 0.00 0.00 179.25 181.23 1ar4 n PHE 167 N -3.10 0.00 -0.25 0.00 1.16 -0.91 -4.95 117.46 109.40 1ar4 n PHE 167 Ca 0.04 0.00 0.05 0.00 -1.87 0.00 0.00 57.45 55.67 1ar4 n PHE 167 Cb 0.51 0.00 0.18 0.00 -1.61 0.00 0.00 39.48 38.56 1ar4 n PHE 167 CO 0.00 0.00 0.00 -0.92 -1.87 0.00 0.00 176.76 173.97 1ar4 h TYR 168 N 0.00 0.36 -0.03 2.97 3.20 -1.10 0.11 116.97 122.47 1ar4 h TYR 168 Ca 0.00 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.92 1ar4 h TYR 168 Cb 0.00 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.22 1ar4 h TYR 168 CO 0.00 -0.03 0.03 -0.07 -1.64 0.00 0.00 178.16 176.44 1ar4 h LEU 169 N 0.33 0.00 0.00 2.82 3.38 -1.88 -0.81 115.31 119.15 1ar4 h LEU 169 Ca 0.41 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 58.16 1ar4 h LEU 169 Cb 0.68 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 1ar4 h LEU 169 CO -0.47 0.00 -1.80 1.67 0.09 0.00 0.00 178.44 177.93 1ar4 n GLN 170 N -4.09 0.34 0.00 1.13 7.27 -0.85 -4.75 117.38 116.44 1ar4 n GLN 170 Ca -0.02 0.09 0.09 0.00 0.07 0.00 0.00 57.00 57.23 1ar4 n GLN 170 Cb 0.12 -1.21 -0.00 0.00 2.41 0.00 0.00 30.24 31.55 1ar4 n GLN 170 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1ar4 n TYR 171 N -3.10 0.00 -1.06 3.69 4.01 0.31 -5.07 117.16 115.95 1ar4 n TYR 171 Ca -0.26 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.48 1ar4 n TYR 171 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.78 1ar4 n TYR 171 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1ar4 n LYS 172 N -0.06 0.00 0.04 -0.72 4.01 -0.31 -1.76 118.16 119.36 1ar4 n LYS 172 Ca 0.08 0.00 0.14 0.00 -0.51 0.00 0.00 58.31 58.01 1ar4 n LYS 172 Cb 0.39 0.00 0.53 0.00 -0.51 0.00 0.00 35.03 35.44 1ar4 n LYS 172 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1ar4 n ASN 173 N 3.06 0.34 -4.13 4.39 6.94 -1.26 -4.33 115.26 120.27 1ar4 n ASN 173 Ca 0.00 0.53 -0.43 0.00 -0.02 0.00 0.00 54.58 54.67 1ar4 n ASN 173 Cb 0.00 -0.62 0.00 0.00 -2.36 0.00 0.00 39.78 36.80 1ar4 n ASN 173 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1ar4 n VAL 174 N -1.82 3.73 0.29 3.53 0.31 -0.72 -4.74 118.33 118.91 1ar4 n VAL 174 Ca 0.06 -3.60 0.14 0.00 -0.01 0.00 0.00 64.34 60.93 1ar4 n VAL 174 Cb 0.37 -2.48 0.86 0.00 -0.91 0.00 0.00 33.84 31.68 1ar4 n VAL 174 CO 0.00 0.00 0.00 0.07 -1.32 0.00 0.00 176.83 175.58 1ar4 h LYS 175 N 6.70 0.00 -0.63 5.55 2.10 -1.82 -2.55 116.57 125.92 1ar4 h LYS 175 Ca 0.50 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 59.12 1ar4 h LYS 175 Cb 0.75 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.05 1ar4 h LYS 175 CO 1.67 0.01 0.28 0.78 -2.00 0.00 0.00 179.45 180.20 1ar4 h GLY 176 N 0.05 0.98 1.78 0.07 0.00 -1.96 -1.76 103.07 102.22 1ar4 h GLY 176 Ca -0.00 -0.50 -0.10 0.00 0.00 0.00 0.00 47.33 46.73 1ar4 h GLY 176 CO 0.00 0.47 -0.36 -0.55 0.00 0.00 0.00 176.54 176.11 1ar4 h ASP 177 N 0.86 0.26 -0.19 0.19 3.32 -1.85 -2.21 116.42 116.80 1ar4 h ASP 177 Ca 0.21 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 1ar4 h ASP 177 Cb 0.15 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 1ar4 h ASP 177 CO -0.02 0.61 0.05 0.22 -1.72 0.00 0.00 179.24 178.38 1ar4 h TYR 178 N 0.22 0.32 -0.56 4.55 3.20 -1.42 -1.53 116.97 121.75 1ar4 h TYR 178 Ca 0.03 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 1ar4 h TYR 178 Cb 0.74 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.90 1ar4 h TYR 178 CO 0.01 0.41 0.21 0.28 -1.64 0.00 0.00 178.16 177.43 1ar4 h VAL 179 N 0.13 1.23 -0.75 1.81 2.07 -1.21 -0.80 116.25 118.73 1ar4 h VAL 179 Ca 0.06 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1ar4 h VAL 179 Cb 0.25 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 1ar4 h VAL 179 CO -0.00 0.28 0.42 0.50 0.02 0.00 0.00 177.57 178.78 1ar4 h LYS 180 N 0.77 1.04 -0.24 1.57 3.64 -1.32 -2.54 116.57 119.49 1ar4 h LYS 180 Ca 0.19 -0.12 -0.16 0.00 -1.27 0.00 0.00 60.65 59.29 1ar4 h LYS 180 Cb 0.23 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1ar4 h LYS 180 CO -0.01 0.77 -0.50 0.77 -2.27 0.00 0.00 179.45 178.20 1ar4 h SER 181 N 1.03 0.72 -0.63 4.20 0.02 -1.11 -3.21 113.55 114.58 1ar4 h SER 181 Ca 0.26 -0.37 0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1ar4 h SER 181 Cb 0.03 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 1ar4 h SER 181 CO -0.04 1.10 0.41 -0.25 -1.14 0.00 0.00 176.83 176.91 1ar4 h TRP 182 N 0.52 0.74 -0.12 3.45 7.01 -0.75 -1.96 115.95 124.84 1ar4 h TRP 182 Ca 0.02 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.07 1ar4 h TRP 182 Cb 1.06 -0.25 -0.00 0.00 -2.10 0.00 0.00 29.16 27.87 1ar4 h TRP 182 CO 0.05 0.44 0.16 -1.49 -2.79 0.00 0.00 178.44 174.81 1ar4 h TRP 183 N 0.77 0.00 0.00 2.65 4.06 -1.48 -1.53 115.95 120.43 1ar4 h TRP 183 Ca 0.24 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 61.12 1ar4 h TRP 183 Cb 0.02 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.17 1ar4 h TRP 183 CO -0.00 0.00 -0.36 -0.91 -3.56 0.00 0.00 178.44 173.61 1ar4 h ASN 184 N 0.00 0.00 -0.49 -3.49 4.21 -1.52 -3.25 115.58 111.03 1ar4 h ASN 184 Ca 0.06 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.57 1ar4 h ASN 184 Cb 0.38 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.58 1ar4 h ASN 184 CO -0.00 0.36 0.00 1.33 -1.29 0.00 0.00 177.43 177.83 1ar4 n VAL 185 N -3.48 1.45 -2.30 2.81 0.24 -0.58 -4.41 118.33 112.07 1ar4 n VAL 185 Ca 0.00 -1.20 -0.42 0.00 -2.04 0.00 0.00 64.34 60.68 1ar4 n VAL 185 Cb 0.52 0.27 -0.03 0.00 -1.47 0.00 0.00 33.84 33.13 1ar4 n VAL 185 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1ar4 s VAL 186 N -1.54 3.75 -0.88 3.34 1.01 -1.21 -0.94 120.40 123.94 1ar4 s VAL 186 Ca 0.39 1.22 -0.18 0.00 0.00 0.00 0.00 61.98 63.41 1ar4 s VAL 186 Cb 0.24 -3.78 0.14 0.00 0.00 0.00 0.00 36.38 32.98 1ar4 s VAL 186 CO 0.21 0.06 1.03 0.21 0.00 0.00 0.00 175.10 176.61 1ar4 s ASN 187 N 1.30 6.61 0.44 3.32 3.04 0.38 -4.76 114.94 125.27 1ar4 s ASN 187 Ca 0.61 -2.09 0.30 0.00 0.04 0.00 0.00 52.86 51.73 1ar4 s ASN 187 Cb -0.32 -2.36 1.53 0.00 -1.54 0.00 0.00 41.25 38.57 1ar4 s ASN 187 CO 0.28 -0.99 1.92 -0.50 -3.04 0.00 0.00 177.10 174.77 1ar4 h TRP 188 N 8.69 0.00 -0.12 0.43 4.06 -1.86 -1.80 115.95 125.35 1ar4 h TRP 188 Ca 0.10 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 60.84 1ar4 h TRP 188 Cb 1.03 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.20 1ar4 h TRP 188 CO 1.11 0.00 -0.77 -0.44 -3.56 0.00 0.00 178.44 174.79 1ar4 h ASP 189 N 0.00 0.75 -0.37 -3.49 3.32 -1.90 -1.80 116.42 112.93 1ar4 h ASP 189 Ca 0.00 -0.49 -0.08 0.00 0.02 0.00 0.00 57.03 56.47 1ar4 h ASP 189 Cb 0.13 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1ar4 h ASP 189 CO 0.00 1.27 -0.09 -0.78 -1.72 0.00 0.00 179.24 177.92 1ar4 h ASP 190 N 0.42 0.72 -0.14 6.45 3.58 -1.62 -1.82 116.42 124.01 1ar4 h ASP 190 Ca -0.05 -0.36 -0.07 0.00 0.42 0.00 0.00 57.03 56.97 1ar4 h ASP 190 Cb 1.38 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 42.22 1ar4 h ASP 190 CO 0.15 0.91 -0.11 0.58 -2.88 0.00 0.00 179.24 177.90 1ar4 h VAL 191 N 0.51 1.22 -0.45 2.25 2.07 -1.53 -1.65 116.25 118.67 1ar4 h VAL 191 Ca 0.09 -0.96 -0.09 0.00 0.82 0.00 0.00 66.70 66.56 1ar4 h VAL 191 Cb 0.60 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 1ar4 h VAL 191 CO 0.04 0.32 -0.07 0.00 0.02 0.00 0.00 177.57 177.87 1ar4 h ALA 192 N 1.45 0.62 -0.34 1.67 0.00 -1.12 -1.56 119.26 119.98 1ar4 h ALA 192 Ca 0.09 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1ar4 h ALA 192 Cb 0.46 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1ar4 h ALA 192 CO 0.03 0.48 0.08 1.25 0.00 0.00 0.00 179.25 181.08 1ar4 h LEU 193 N 0.68 0.51 -1.06 0.00 5.85 -1.02 -1.54 115.31 118.74 1ar4 h LEU 193 Ca 0.12 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 1ar4 h LEU 193 Cb 0.60 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 1ar4 h LEU 193 CO 0.04 0.61 0.46 0.03 -0.34 0.00 0.00 178.44 179.24 1ar4 h ARG 194 N 0.39 1.11 -0.63 1.25 3.08 -1.24 -2.03 114.38 116.31 1ar4 h ARG 194 Ca 0.11 -0.11 -0.09 0.00 0.07 0.00 0.00 59.98 59.95 1ar4 h ARG 194 Cb 0.30 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 1ar4 h ARG 194 CO 0.00 0.80 0.04 0.35 -1.07 0.00 0.00 179.97 180.09 1ar4 h PHE 195 N 1.12 1.17 -0.65 3.04 3.57 -1.04 0.12 116.94 124.28 1ar4 h PHE 195 Ca 0.29 -0.19 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1ar4 h PHE 195 Cb -0.00 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 38.40 1ar4 h PHE 195 CO 0.01 1.01 0.32 0.77 -2.23 0.00 0.00 178.31 178.19 1ar4 h SER 196 N 1.00 0.84 1.44 0.41 0.02 -0.66 -2.39 113.55 114.21 1ar4 h SER 196 Ca 0.18 -0.12 -0.05 0.00 -0.84 0.00 0.00 61.79 60.97 1ar4 h SER 196 Cb 0.52 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 1ar4 h SER 196 CO 0.03 0.72 -0.57 -0.33 -1.14 0.00 0.00 176.83 175.54 1ar4 h GLU 197 N 0.89 0.00 0.00 3.45 5.08 -1.27 -3.37 114.58 119.37 1ar4 h GLU 197 Ca 0.22 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.54 1ar4 h GLU 197 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1ar4 h GLU 197 CO -0.03 0.15 -0.17 0.00 -1.00 0.00 0.00 179.01 177.96 1ar4 h ALA 198 N 1.81 0.02 0.00 3.43 0.00 -0.58 -3.31 119.26 120.63 1ar4 h ALA 198 Ca -0.02 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1ar4 h ALA 198 Cb 1.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1ar4 h ALA 198 CO 0.02 0.03 0.00 2.89 0.00 0.00 0.00 179.25 182.19 1ar4 n ARG 199 N -4.57 0.31 -2.05 0.00 1.85 -0.92 -2.54 116.66 108.75 1ar4 n ARG 199 Ca -0.10 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.44 1ar4 n ARG 199 Cb 0.47 -1.08 0.03 0.00 -1.05 0.00 0.00 32.46 30.83 1ar4 n ARG 199 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1ar4 n VAL 200 N -0.58 2.96 -0.82 8.89 0.31 -1.25 -5.12 118.33 122.71 1ar4 n VAL 200 Ca 0.01 -4.30 0.00 0.00 -0.01 0.00 0.00 64.34 60.04 1ar4 n VAL 200 Cb 0.01 -1.22 0.00 0.00 -0.91 0.00 0.00 33.84 31.72 1ar4 n VAL 200 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51