#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b6g s GLY 34 N 0.00 1.95 0.00 -0.02 0.00 -1.26 -5.00 107.32 103.00 3b6g s GLY 34 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 44.72 45.14 3b6g s GLY 34 CO 0.00 0.77 0.00 1.55 0.00 0.00 0.00 173.10 175.42 3b6g n VAL 35 N -2.85 0.00 -3.45 1.40 3.14 -1.26 -5.08 118.33 110.24 3b6g n VAL 35 Ca 0.10 -0.03 -0.20 0.00 -2.96 0.00 0.00 64.34 61.24 3b6g n VAL 35 Cb 0.52 1.09 0.06 0.00 -1.06 0.00 0.00 33.84 34.45 3b6g n VAL 35 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 3b6g n LYS 36 N -0.05 -2.95 -3.29 1.45 3.00 -1.26 -4.12 118.16 110.94 3b6g n LYS 36 Ca 0.00 0.72 -0.25 0.00 -0.00 0.00 0.00 58.31 58.78 3b6g n LYS 36 Cb 0.02 -5.30 0.03 0.00 0.00 0.00 0.00 35.03 29.78 3b6g n LYS 36 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 3b6g n LYS 37 N -3.75 -1.84 0.00 1.64 4.76 -1.26 -5.01 118.16 112.69 3b6g n LYS 37 Ca -0.14 1.54 0.00 0.00 -2.87 0.00 0.00 58.31 56.84 3b6g n LYS 37 Cb 0.63 -2.77 0.00 0.00 -1.84 0.00 0.00 35.03 31.05 3b6g n LYS 37 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 3b6g n PRO 38 N 0.08 2.01 -3.64 1.97 -0.04 -1.26 -5.03 135.00 129.09 3b6g n PRO 38 Ca -0.03 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.06 3b6g n PRO 38 Cb 0.57 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.92 3b6g n PRO 38 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3b6g s HIS 39 N 0.32 3.21 -0.39 0.54 2.46 -1.26 -5.03 115.29 115.14 3b6g s HIS 39 Ca 0.00 0.03 0.01 0.00 0.47 0.00 0.00 55.06 55.57 3b6g s HIS 39 Cb 0.00 -2.33 0.13 0.00 -0.13 0.00 0.00 32.58 30.25 3b6g s HIS 39 CO 0.00 -0.16 0.19 1.03 -2.47 0.00 0.00 174.74 173.33 3b6g s ARG 40 N 1.60 1.06 -0.10 2.88 0.52 -1.26 -5.10 118.95 118.55 3b6g s ARG 40 Ca 0.07 -1.68 -0.39 0.00 -0.52 0.00 0.00 55.73 53.21 3b6g s ARG 40 Cb -0.15 -2.16 -0.16 0.00 0.52 0.00 0.00 34.95 32.99 3b6g s ARG 40 CO 0.08 -1.11 1.54 0.66 0.02 0.00 0.00 175.30 176.49 3b6g n TYR 41 N 3.97 1.77 -1.62 -0.53 4.02 -1.26 -4.81 117.16 118.70 3b6g n TYR 41 Ca 0.06 0.60 -0.45 0.00 -0.01 0.00 0.00 57.90 58.10 3b6g n TYR 41 Cb 0.37 -2.39 -0.02 0.00 -0.02 0.00 0.00 39.34 37.28 3b6g n TYR 41 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 3b6g n ARG 42 N 3.94 1.60 -1.44 -0.72 5.12 -1.26 -4.82 116.66 119.09 3b6g n ARG 42 Ca 0.23 0.56 -0.36 0.00 -1.93 0.00 0.00 57.85 56.35 3b6g n ARG 42 Cb 0.16 -2.04 0.08 0.00 -1.16 0.00 0.00 32.46 29.50 3b6g n ARG 42 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 3b6g n PRO 43 N 1.00 0.62 0.00 5.56 -0.02 -1.26 -2.23 135.00 138.67 3b6g n PRO 43 Ca 0.09 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 3b6g n PRO 43 Cb 0.32 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 3b6g n PRO 43 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3b6g n GLY 44 N 1.11 2.91 0.16 -1.23 0.00 -1.26 -4.80 105.19 102.08 3b6g n GLY 44 Ca 0.13 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.95 3b6g n GLY 44 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3b6g h THR 45 N 0.00 1.35 0.00 2.61 2.02 -1.78 0.63 112.91 117.74 3b6g h THR 45 Ca 0.00 -2.32 -0.06 0.00 0.77 0.00 0.00 66.41 64.79 3b6g h THR 45 Cb 0.00 2.66 -0.01 0.00 -1.74 0.00 0.00 68.15 69.07 3b6g h THR 45 CO 0.00 0.70 -0.30 0.58 0.37 0.00 0.00 175.52 176.86 3b6g h VAL 46 N 0.12 1.10 0.20 3.16 2.07 -1.87 -0.65 116.25 120.38 3b6g h VAL 46 Ca -0.14 -1.08 -0.01 0.00 0.82 0.00 0.00 66.70 66.29 3b6g h VAL 46 Cb 1.68 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 33.05 3b6g h VAL 46 CO 0.19 0.30 -0.09 0.00 0.02 0.00 0.00 177.57 177.98 3b6g h ALA 47 N 1.70 -0.27 0.00 1.67 0.00 -1.89 -2.44 119.26 118.03 3b6g h ALA 47 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3b6g h ALA 47 Cb 0.58 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3b6g h ALA 47 CO 0.04 -0.36 0.00 -0.11 0.00 0.00 0.00 179.25 178.82 3b6g n LEU 48 N -4.97 0.39 -0.01 0.00 7.94 0.22 -1.20 117.00 119.38 3b6g n LEU 48 Ca -0.08 0.64 -0.15 0.00 -1.11 0.00 0.00 56.01 55.31 3b6g n LEU 48 Cb 0.26 -0.63 -0.14 0.00 0.53 0.00 0.00 43.42 43.44 3b6g n LEU 48 CO 0.26 -0.62 -0.65 -1.14 -1.11 0.00 0.00 177.39 174.14 3b6g n ARG 49 N -1.98 0.69 0.01 1.96 0.63 -0.26 -4.02 116.66 113.70 3b6g n ARG 49 Ca 0.01 0.28 -0.04 0.00 -0.92 0.00 0.00 57.85 57.18 3b6g n ARG 49 Cb 0.12 -1.76 0.19 0.00 0.45 0.00 0.00 32.46 31.46 3b6g n ARG 49 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 3b6g h GLU 50 N 0.03 0.49 -0.07 -0.14 5.08 -0.64 -2.64 114.58 116.70 3b6g h GLU 50 Ca -0.35 -0.19 0.04 0.00 -1.00 0.00 0.00 59.36 57.86 3b6g h GLU 50 Cb 2.02 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 31.19 3b6g h GLU 50 CO 0.09 0.72 -0.33 0.82 -1.00 0.00 0.00 179.01 179.31 3b6g h ILE 51 N 0.43 0.28 -0.87 3.13 2.04 -1.50 -0.28 117.51 120.74 3b6g h ILE 51 Ca 0.06 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.00 3b6g h ILE 51 Cb 0.70 0.28 -0.07 0.00 -0.74 0.00 0.00 36.82 36.99 3b6g h ILE 51 CO 0.05 0.00 0.53 0.03 0.00 0.00 0.00 178.15 178.76 3b6g h ARG 52 N -0.44 0.89 -0.44 2.37 3.08 -1.68 -1.99 114.38 116.17 3b6g h ARG 52 Ca 0.08 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 3b6g h ARG 52 Cb 0.56 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 3b6g h ARG 52 CO -0.32 0.59 0.17 -0.09 -1.07 0.00 0.00 179.97 179.25 3b6g h ARG 53 N 0.92 0.67 0.00 0.04 2.43 -0.95 -3.00 114.38 114.48 3b6g h ARG 53 Ca 0.40 -0.12 -0.21 0.00 -0.81 0.00 0.00 59.98 59.23 3b6g h ARG 53 Cb 0.28 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 3b6g h ARG 53 CO -0.21 0.62 -1.14 1.88 -1.51 0.00 0.00 179.97 179.60 3b6g h TYR 54 N 0.57 0.00 -0.13 2.20 -1.99 -0.88 -2.86 116.97 113.89 3b6g h TYR 54 Ca 0.15 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.81 3b6g h TYR 54 Cb 0.20 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.92 3b6g h TYR 54 CO 0.00 0.90 -0.22 1.96 -0.00 0.00 0.00 178.16 180.80 3b6g h GLN 55 N 0.00 0.22 0.02 4.88 4.20 -1.41 -3.09 115.11 119.93 3b6g h GLN 55 Ca -0.09 -0.06 -0.23 0.00 0.06 0.00 0.00 58.65 58.33 3b6g h GLN 55 Cb 1.76 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 29.50 3b6g h GLN 55 CO 0.10 0.44 -1.11 -0.22 -0.67 0.00 0.00 178.83 177.37 3b6g h LYS 56 N 0.20 0.05 -6.84 1.46 3.64 -1.54 -3.45 116.57 110.09 3b6g h LYS 56 Ca 0.03 -0.08 -0.45 0.00 -1.27 0.00 0.00 60.65 58.88 3b6g h LYS 56 Cb 0.51 0.03 0.04 0.00 -0.41 0.00 0.00 32.23 32.41 3b6g h LYS 56 CO 0.03 1.00 -0.02 -1.54 -2.27 0.00 0.00 179.45 176.65 3b6g s SER 57 N -6.74 5.50 0.00 4.20 1.04 -1.08 -5.05 113.70 111.57 3b6g s SER 57 Ca -0.00 0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.64 3b6g s SER 57 Cb 0.09 -1.24 0.00 0.00 0.10 0.00 0.00 66.02 64.97 3b6g s SER 57 CO 0.83 -0.99 0.09 0.35 0.98 0.00 0.00 173.24 174.50 3b6g n THR 58 N -2.30 0.00 -2.03 2.02 -2.24 -1.26 -4.86 114.28 103.62 3b6g n THR 58 Ca 0.05 -0.17 -0.39 0.00 -2.27 0.00 0.00 64.05 61.26 3b6g n THR 58 Cb 0.59 1.34 -0.00 0.00 -2.10 0.00 0.00 70.33 70.15 3b6g n THR 58 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3b6g s GLU 59 N -0.17 3.92 0.08 -0.78 1.03 -1.26 -4.91 118.70 116.62 3b6g s GLU 59 Ca 0.00 2.18 -0.33 0.00 0.03 0.00 0.00 54.97 56.85 3b6g s GLU 59 Cb 0.00 -2.73 -0.12 0.00 -0.80 0.00 0.00 34.13 30.48 3b6g s GLU 59 CO 0.00 -0.54 1.78 1.28 -1.33 0.00 0.00 175.26 176.45 3b6g n LEU 60 N 0.07 3.66 -1.78 1.83 4.77 -1.26 -4.89 117.00 119.39 3b6g n LEU 60 Ca 0.04 1.01 -0.05 0.00 -0.03 0.00 0.00 56.01 56.98 3b6g n LEU 60 Cb 0.43 -1.47 0.25 0.00 -2.33 0.00 0.00 43.42 40.30 3b6g n LEU 60 CO 0.56 -0.00 0.92 0.18 -1.33 0.00 0.00 177.39 177.72 3b6g n LEU 61 N 5.28 5.34 -4.16 2.23 4.77 -1.26 -4.80 117.00 124.41 3b6g n LEU 61 Ca 0.19 -2.77 -0.30 0.00 -0.03 0.00 0.00 56.01 53.10 3b6g n LEU 61 Cb 0.33 -0.70 -0.17 0.00 -2.33 0.00 0.00 43.42 40.55 3b6g n LEU 61 CO 0.67 0.72 -0.53 -0.63 -1.33 0.00 0.00 177.39 176.29 3b6g s ILE 62 N -2.52 1.76 0.04 -0.08 1.01 -1.26 -5.10 121.20 115.05 3b6g s ILE 62 Ca 0.45 -0.85 -0.36 0.00 0.00 0.00 0.00 60.65 59.88 3b6g s ILE 62 Cb 0.36 -1.54 -0.16 0.00 0.01 0.00 0.00 42.46 41.13 3b6g s ILE 62 CO 0.11 0.49 1.47 0.54 0.00 0.00 0.00 174.94 177.55 3b6g n ARG 63 N 3.57 1.40 0.16 2.79 1.74 -1.26 -4.87 116.66 120.19 3b6g n ARG 63 Ca -0.20 0.51 0.02 0.00 -0.77 0.00 0.00 57.85 57.40 3b6g n ARG 63 Cb 0.53 -2.19 0.33 0.00 -1.02 0.00 0.00 32.46 30.11 3b6g n ARG 63 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 3b6g h LYS 64 N 5.41 0.07 0.57 5.56 3.64 -1.99 -3.12 116.57 126.70 3b6g h LYS 64 Ca -0.47 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 58.86 3b6g h LYS 64 Cb 1.31 -0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.14 3b6g h LYS 64 CO 0.83 0.42 -0.27 1.25 -2.27 0.00 0.00 179.45 179.41 3b6g h LEU 65 N 0.06 -0.65 -1.91 5.20 5.85 -1.97 -0.10 115.31 121.79 3b6g h LEU 65 Ca 0.00 -0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.72 3b6g h LEU 65 Cb 0.67 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 3b6g h LEU 65 CO 0.05 -0.28 0.13 -0.65 -0.34 0.00 0.00 178.44 177.35 3b6g h PRO 66 N -1.08 0.11 0.63 5.25 0.11 -1.97 0.28 132.00 135.35 3b6g h PRO 66 Ca -0.08 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.99 3b6g h PRO 66 Cb 0.64 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 31.73 3b6g h PRO 66 CO 0.13 0.08 -0.30 0.35 -0.21 0.00 0.00 178.00 178.04 3b6g h PHE 67 N 0.12 -0.79 0.00 0.65 3.57 -1.56 -0.76 116.94 118.18 3b6g h PHE 67 Ca 0.08 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.56 3b6g h PHE 67 Cb 0.17 0.26 0.00 0.00 2.79 0.00 0.00 35.95 39.17 3b6g h PHE 67 CO -0.00 -0.45 0.09 0.94 -2.23 0.00 0.00 178.31 176.66 3b6g n GLN 68 N -5.36 0.07 -0.02 1.11 7.27 -0.05 -0.21 117.38 120.19 3b6g n GLN 68 Ca -0.12 0.54 -0.20 0.00 0.07 0.00 0.00 57.00 57.30 3b6g n GLN 68 Cb 0.35 -1.83 -0.13 0.00 2.41 0.00 0.00 30.24 31.04 3b6g n GLN 68 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3b6g h ARG 69 N 0.00 0.16 -0.09 3.69 3.08 -0.28 -3.23 114.38 117.72 3b6g h ARG 69 Ca 0.00 -0.28 -0.11 0.00 0.07 0.00 0.00 59.98 59.67 3b6g h ARG 69 Cb 0.18 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 3b6g h ARG 69 CO 0.00 1.13 -0.42 1.25 -1.07 0.00 0.00 179.97 180.86 3b6g h LEU 70 N -0.58 0.21 -0.38 3.04 5.85 0.94 0.26 115.31 124.65 3b6g h LEU 70 Ca -0.22 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 3b6g h LEU 70 Cb 1.51 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.46 3b6g h LEU 70 CO 0.02 0.61 0.19 0.58 -0.34 0.00 0.00 178.44 179.50 3b6g h VAL 71 N 0.17 1.16 -0.01 1.05 2.07 -1.07 -2.87 116.25 116.75 3b6g h VAL 71 Ca 0.01 -0.44 -0.13 0.00 0.82 0.00 0.00 66.70 66.96 3b6g h VAL 71 Cb 0.82 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 3b6g h VAL 71 CO 0.06 0.17 -0.62 0.03 0.02 0.00 0.00 177.57 177.23 3b6g h ARG 72 N 0.48 0.05 -0.13 1.57 3.08 -1.45 -3.00 114.38 114.98 3b6g h ARG 72 Ca 0.13 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 59.99 3b6g h ARG 72 Cb 0.09 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3b6g h ARG 72 CO -0.02 0.66 -0.58 1.49 -1.07 0.00 0.00 179.97 180.45 3b6g h GLU 73 N 0.04 0.42 0.03 0.04 4.81 -0.93 -3.19 114.58 115.80 3b6g h GLU 73 Ca -0.01 -0.28 -0.00 0.00 -0.13 0.00 0.00 59.36 58.95 3b6g h GLU 73 Cb 1.11 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.52 3b6g h GLU 73 CO 0.08 0.88 -0.01 0.82 -0.73 0.00 0.00 179.01 180.05 3b6g h ILE 74 N 0.32 1.28 0.00 2.32 2.04 -1.52 -3.36 117.51 118.59 3b6g h ILE 74 Ca 0.00 -1.80 -0.00 0.00 1.00 0.00 0.00 64.86 64.05 3b6g h ILE 74 Cb 1.10 2.35 -0.00 0.00 -0.74 0.00 0.00 36.82 39.53 3b6g h ILE 74 CO 0.10 0.41 -0.01 0.00 0.00 0.00 0.00 178.15 178.65 3b6g h ALA 75 N -0.19 1.36 -0.82 1.87 0.00 -1.65 -1.63 119.26 118.21 3b6g h ALA 75 Ca -0.00 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.96 3b6g h ALA 75 Cb 0.70 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 3b6g h ALA 75 CO 0.01 0.02 0.53 0.37 0.00 0.00 0.00 179.25 180.18 3b6g h GLN 76 N 0.00 0.87 0.00 0.00 5.75 -1.65 -0.11 115.11 119.97 3b6g h GLN 76 Ca -0.00 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 3b6g h GLN 76 Cb 0.04 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 28.40 3b6g h GLN 76 CO 0.00 0.57 0.00 -0.25 -2.65 0.00 0.00 178.83 176.51 3b6g n ASP 77 N -4.48 0.28 -0.12 -0.69 9.92 -0.61 -3.02 116.55 117.82 3b6g n ASP 77 Ca 0.12 0.56 -0.18 0.00 -0.53 0.00 0.00 54.79 54.76 3b6g n ASP 77 Cb 0.21 -0.62 -0.11 0.00 -0.64 0.00 0.00 41.12 39.96 3b6g n ASP 77 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 3b6g n PHE 78 N -1.80 0.00 -3.71 1.24 0.99 -0.60 -4.97 117.46 108.61 3b6g n PHE 78 Ca 0.04 0.00 -0.11 0.00 -0.00 0.00 0.00 57.45 57.37 3b6g n PHE 78 Cb 0.23 -0.96 -0.12 0.00 -1.00 0.00 0.00 39.48 37.63 3b6g n PHE 78 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.76 176.97 3b6g s LYS 79 N -2.50 0.30 0.22 -1.08 2.20 -0.15 -5.15 119.74 113.58 3b6g s LYS 79 Ca -0.34 0.68 -0.24 0.00 -0.36 0.00 0.00 55.97 55.72 3b6g s LYS 79 Cb 0.09 -0.06 -0.09 0.00 -1.51 0.00 0.00 37.83 36.27 3b6g s LYS 79 CO 0.57 -0.17 0.80 0.95 -0.36 0.00 0.00 175.35 177.14 3b6g s THR 80 N 1.42 4.39 -0.44 3.43 -4.23 -1.17 -3.84 115.64 115.20 3b6g s THR 80 Ca -0.09 1.61 -0.14 0.00 -1.18 0.00 0.00 61.69 61.89 3b6g s THR 80 Cb -0.10 -4.03 0.02 0.00 1.34 0.00 0.00 72.50 69.74 3b6g s THR 80 CO -0.11 0.33 0.58 -0.67 -0.54 0.00 0.00 174.62 174.22 3b6g n ASP 81 N 1.07 -7.73 -4.25 3.99 2.03 -1.26 -5.07 116.55 105.33 3b6g n ASP 81 Ca -0.03 0.47 -0.28 0.00 0.52 0.00 0.00 54.79 55.47 3b6g n ASP 81 Cb 0.50 -5.24 -0.06 0.00 -0.72 0.00 0.00 41.12 35.60 3b6g n ASP 81 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3b6g n LEU 82 N -0.42 0.00 -3.97 -2.67 4.77 -1.26 -5.17 117.00 108.28 3b6g n LEU 82 Ca 0.11 -2.92 -0.10 0.00 -0.03 0.00 0.00 56.01 53.07 3b6g n LEU 82 Cb 0.45 0.50 -0.12 0.00 -2.33 0.00 0.00 43.42 41.92 3b6g n LEU 82 CO 0.47 -0.42 -0.36 -0.13 -1.33 0.00 0.00 177.39 175.61 3b6g s ARG 83 N -3.62 0.27 -0.21 3.23 0.52 -1.26 -5.15 118.95 112.74 3b6g s ARG 83 Ca 0.05 -0.51 0.01 0.00 -0.52 0.00 0.00 55.73 54.77 3b6g s ARG 83 Cb 0.00 0.06 0.05 0.00 0.52 0.00 0.00 34.95 35.57 3b6g s ARG 83 CO 0.04 -0.03 -0.11 -0.06 0.02 0.00 0.00 175.30 175.16 3b6g s PHE 84 N -1.18 2.63 0.04 -0.53 0.40 -1.26 -5.09 117.98 113.00 3b6g s PHE 84 Ca -0.13 -1.76 -0.30 0.00 -0.60 0.00 0.00 56.93 54.14 3b6g s PHE 84 Cb -0.08 -1.72 -0.09 0.00 0.51 0.00 0.00 43.02 41.64 3b6g s PHE 84 CO -0.01 -0.78 1.86 -0.65 0.70 0.00 0.00 175.22 176.35 3b6g s GLN 85 N 1.32 4.15 0.49 0.44 -0.21 -1.26 -4.84 119.66 119.75 3b6g s GLN 85 Ca -0.03 2.52 0.38 0.00 0.02 0.00 0.00 55.36 58.26 3b6g s GLN 85 Cb -0.17 -3.97 1.56 0.00 1.00 0.00 0.00 33.01 31.43 3b6g s GLN 85 CO -0.08 -0.90 1.61 0.66 -2.12 0.00 0.00 175.29 174.46 3b6g h SER 86 N 9.81 0.14 0.35 5.90 4.64 -2.01 0.87 113.55 133.25 3b6g h SER 86 Ca -0.47 0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 60.92 3b6g h SER 86 Cb 1.22 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 3b6g h SER 86 CO 0.94 -0.13 -0.17 0.77 -0.87 0.00 0.00 176.83 177.38 3b6g h SER 87 N 0.03 -0.40 -0.71 4.97 4.64 -1.99 -2.92 113.55 117.17 3b6g h SER 87 Ca 0.86 -0.03 0.15 0.00 -0.47 0.00 0.00 61.79 62.30 3b6g h SER 87 Cb 3.03 0.10 -0.10 0.00 -0.31 0.00 0.00 62.40 65.12 3b6g h SER 87 CO -0.26 -0.23 0.18 0.00 -0.87 0.00 0.00 176.83 175.64 3b6g h ALA 88 N 0.08 0.92 -0.85 5.18 0.00 0.41 1.04 119.26 126.05 3b6g h ALA 88 Ca -0.05 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3b6g h ALA 88 Cb 0.41 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 3b6g h ALA 88 CO 0.08 -0.32 0.40 0.28 0.00 0.00 0.00 179.25 179.69 3b6g h VAL 89 N 0.28 1.26 -0.15 0.00 2.07 -1.55 -0.62 116.25 117.55 3b6g h VAL 89 Ca 0.40 -0.75 -0.16 0.00 0.82 0.00 0.00 66.70 67.01 3b6g h VAL 89 Cb 0.66 0.19 0.01 0.00 -1.52 0.00 0.00 31.29 30.62 3b6g h VAL 89 CO -0.48 0.32 -0.52 0.24 0.02 0.00 0.00 177.57 177.14 3b6g h MET 90 N 1.21 0.61 -0.74 1.57 2.86 -0.84 -0.12 114.93 119.48 3b6g h MET 90 Ca 0.29 -0.46 0.16 0.00 -2.06 0.00 0.00 59.70 57.62 3b6g h MET 90 Cb 0.13 0.09 -0.13 0.00 0.06 0.00 0.00 31.60 31.74 3b6g h MET 90 CO -0.03 1.08 -0.08 0.00 1.06 0.00 0.00 176.91 178.94 3b6g h ALA 91 N 0.53 0.63 -0.38 6.32 0.00 0.12 0.78 119.26 127.26 3b6g h ALA 91 Ca -0.02 0.26 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 3b6g h ALA 91 Cb 1.15 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 3b6g h ALA 91 CO 0.11 -0.42 -0.07 -0.07 0.00 0.00 0.00 179.25 178.80 3b6g h LEU 92 N 0.05 0.62 -0.82 0.00 3.38 -0.95 -2.35 115.31 115.24 3b6g h LEU 92 Ca 0.38 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 58.07 3b6g h LEU 92 Cb 0.63 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 3b6g h LEU 92 CO -0.70 0.74 -0.58 -0.61 0.09 0.00 0.00 178.44 177.37 3b6g h GLN 93 N 0.60 0.00 -0.36 1.13 4.15 0.14 0.29 115.11 121.05 3b6g h GLN 93 Ca 0.11 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.39 3b6g h GLN 93 Cb 0.48 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.16 3b6g h GLN 93 CO 0.02 0.58 -0.35 0.93 -1.93 0.00 0.00 178.83 178.08 3b6g h GLU 94 N 0.00 0.83 0.31 1.69 4.39 0.56 -2.70 114.58 119.65 3b6g h GLU 94 Ca -0.01 -0.41 -0.02 0.00 0.34 0.00 0.00 59.36 59.27 3b6g h GLU 94 Cb 1.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 3b6g h GLU 94 CO 0.08 1.05 -0.15 0.00 -1.16 0.00 0.00 179.01 178.82 3b6g h ALA 95 N 0.91 -0.42 -0.34 3.43 0.00 -0.94 -2.13 119.26 119.78 3b6g h ALA 95 Ca 0.07 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.88 3b6g h ALA 95 Cb 0.91 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 3b6g h ALA 95 CO 0.08 -0.43 0.01 0.77 0.00 0.00 0.00 179.25 179.69 3b6g h SER 96 N -1.04 -0.11 0.00 0.00 0.02 -0.58 0.67 113.55 112.52 3b6g h SER 96 Ca -0.04 0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3b6g h SER 96 Cb 0.44 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.11 3b6g h SER 96 CO 0.07 -0.02 -0.00 -0.33 -1.14 0.00 0.00 176.83 175.41 3b6g h GLU 97 N 0.11 -0.00 -0.08 3.45 5.08 -1.60 -2.65 114.58 118.89 3b6g h GLU 97 Ca 0.16 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.45 3b6g h GLU 97 Cb 0.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3b6g h GLU 97 CO -0.26 0.11 -0.27 0.00 -1.00 0.00 0.00 179.01 177.58 3b6g h ALA 98 N 0.89 1.39 -0.04 3.43 0.00 -1.05 -1.66 119.26 122.23 3b6g h ALA 98 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3b6g h ALA 98 Cb 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3b6g h ALA 98 CO 0.00 0.43 0.00 0.98 0.00 0.00 0.00 179.25 180.66 3b6g n TYR 99 N -4.17 0.00 -0.35 0.00 9.36 0.20 -2.73 117.16 119.48 3b6g n TYR 99 Ca -0.01 0.00 -0.05 0.00 3.32 0.00 0.00 57.90 61.16 3b6g n TYR 99 Cb 0.36 -0.49 -0.02 0.00 -0.63 0.00 0.00 39.34 38.55 3b6g n TYR 99 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 3b6g n LEU 100 N -2.18 -0.71 -0.14 2.98 4.77 -1.00 -1.07 117.00 119.64 3b6g n LEU 100 Ca 0.00 1.52 -0.07 0.00 -0.03 0.00 0.00 56.01 57.43 3b6g n LEU 100 Cb 0.00 -0.28 -0.02 0.00 -2.33 0.00 0.00 43.42 40.79 3b6g n LEU 100 CO 0.00 -1.31 0.62 0.58 -1.33 0.00 0.00 177.39 175.95 3b6g h VAL 101 N 0.00 0.18 -0.34 4.08 2.07 -1.32 0.22 116.25 121.15 3b6g h VAL 101 Ca 0.23 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.79 3b6g h VAL 101 Cb 0.45 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 3b6g h VAL 101 CO -0.84 0.00 0.13 0.00 0.02 0.00 0.00 177.57 176.88 3b6g h ALA 102 N 0.74 0.39 -0.09 1.67 0.00 -0.90 -1.97 119.26 119.12 3b6g h ALA 102 Ca 0.18 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.15 3b6g h ALA 102 Cb 0.55 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 3b6g h ALA 102 CO -0.59 -0.26 0.08 1.25 0.00 0.00 0.00 179.25 179.73 3b6g h LEU 103 N 0.28 0.00 -0.28 0.00 5.85 0.40 -1.27 115.31 120.29 3b6g h LEU 103 Ca 0.15 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.67 3b6g h LEU 103 Cb 0.11 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 3b6g h LEU 103 CO -0.14 0.00 -0.88 -0.26 -0.34 0.00 0.00 178.44 176.82 3b6g h PHE 104 N 0.00 0.30 -0.32 1.25 -1.00 0.09 -2.17 116.94 115.09 3b6g h PHE 104 Ca 0.04 -0.16 -0.12 0.00 2.81 0.00 0.00 57.97 60.54 3b6g h PHE 104 Cb 0.19 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 3b6g h PHE 104 CO 0.00 0.98 -0.28 0.93 -1.61 0.00 0.00 178.31 178.33 3b6g h GLU 105 N 0.11 0.67 -0.53 1.51 5.08 -0.99 -1.02 114.58 119.40 3b6g h GLU 105 Ca -0.04 -0.28 -0.12 0.00 -1.00 0.00 0.00 59.36 57.91 3b6g h GLU 105 Cb 1.51 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.72 3b6g h GLU 105 CO 0.13 0.87 -0.13 -0.44 -1.00 0.00 0.00 179.01 178.45 3b6g h ASP 106 N 0.58 1.03 0.77 1.42 3.32 -1.44 -1.59 116.42 120.51 3b6g h ASP 106 Ca 0.07 -0.36 -0.04 0.00 0.02 0.00 0.00 57.03 56.73 3b6g h ASP 106 Cb 0.77 -0.28 0.01 0.00 0.22 0.00 0.00 39.33 40.05 3b6g h ASP 106 CO 0.06 1.15 -0.37 0.74 -1.72 0.00 0.00 179.24 179.11 3b6g h THR 107 N 0.90 0.00 -0.89 0.35 2.02 -1.25 -0.42 112.91 113.63 3b6g h THR 107 Ca 0.13 -0.06 0.24 0.00 0.77 0.00 0.00 66.41 67.50 3b6g h THR 107 Cb 0.70 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 66.97 3b6g h THR 107 CO 0.05 0.00 0.26 -1.13 0.37 0.00 0.00 175.52 175.07 3b6g h ASN 108 N -1.09 0.04 -0.28 4.18 -1.24 -1.19 0.66 115.58 116.66 3b6g h ASN 108 Ca -0.11 0.20 0.00 0.00 0.71 0.00 0.00 56.30 57.10 3b6g h ASN 108 Cb 0.79 0.26 -0.01 0.00 0.73 0.00 0.00 38.32 40.09 3b6g h ASN 108 CO 0.17 -0.15 0.18 -0.07 -1.29 0.00 0.00 177.43 176.28 3b6g h LEU 109 N 0.22 0.32 -0.27 0.34 3.38 -1.23 0.15 115.31 118.21 3b6g h LEU 109 Ca 0.56 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.56 3b6g h LEU 109 Cb 1.15 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 3b6g h LEU 109 CO -0.65 0.23 0.09 0.00 0.09 0.00 0.00 178.44 178.20 3b6g h ALA 111 N 1.18 -1.00 -0.30 0.00 0.00 0.42 -1.57 119.26 117.98 3b6g h ALA 111 Ca 0.12 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 54.94 3b6g h ALA 111 Cb 0.10 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3b6g h ALA 111 CO -0.13 -1.09 0.44 0.82 0.00 0.00 0.00 179.25 179.29 3b6g h ILE 112 N -0.95 0.25 0.00 0.00 2.04 -0.48 0.25 117.51 118.63 3b6g h ILE 112 Ca -0.06 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.71 3b6g h ILE 112 Cb 0.80 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 3b6g h ILE 112 CO 0.01 0.00 -0.43 -0.74 0.00 0.00 0.00 178.15 176.99 3b6g h HIS 113 N 0.00 0.00 -0.10 1.37 2.76 -0.75 -0.32 115.15 118.12 3b6g h HIS 113 Ca 0.14 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.31 3b6g h HIS 113 Cb 1.02 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.98 3b6g h HIS 113 CO 0.00 0.43 0.00 0.00 -1.30 0.00 0.00 177.93 177.06 3b6g n ALA 114 N -2.32 2.54 -2.45 5.26 0.00 0.87 -4.89 120.51 119.53 3b6g n ALA 114 Ca -0.00 -0.29 -0.08 0.00 0.00 0.00 0.00 53.44 53.06 3b6g n ALA 114 Cb 0.54 -1.15 0.01 0.00 0.00 0.00 0.00 19.45 18.86 3b6g n ALA 114 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3b6g n LYS 115 N -0.23 -1.58 -4.58 0.00 5.02 -0.13 -5.05 118.16 111.62 3b6g n LYS 115 Ca 0.12 0.36 -0.26 0.00 -2.02 0.00 0.00 58.31 56.50 3b6g n LYS 115 Cb 0.17 -4.11 -0.11 0.00 -0.02 0.00 0.00 35.03 30.96 3b6g n LYS 115 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3b6g s ARG 116 N -4.83 1.88 0.00 1.97 0.52 -1.09 -4.98 118.95 112.42 3b6g s ARG 116 Ca 0.09 -2.05 0.00 0.00 -0.52 0.00 0.00 55.73 53.24 3b6g s ARG 116 Cb -0.04 -1.46 0.00 0.00 0.52 0.00 0.00 34.95 33.97 3b6g s ARG 116 CO 0.11 -0.07 0.51 1.33 0.02 0.00 0.00 175.30 177.19 3b6g n VAL 117 N -0.89 0.21 -4.07 3.52 0.24 -1.26 -2.68 118.33 113.39 3b6g n VAL 117 Ca -0.04 -0.25 -0.34 0.00 -2.04 0.00 0.00 64.34 61.66 3b6g n VAL 117 Cb 0.67 1.09 -0.14 0.00 -1.47 0.00 0.00 33.84 33.98 3b6g n VAL 117 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3b6g s THR 118 N -0.21 3.03 -0.38 3.34 2.01 -1.26 -5.03 115.64 117.13 3b6g s THR 118 Ca 0.00 -0.62 -0.29 0.00 0.31 0.00 0.00 61.69 61.09 3b6g s THR 118 Cb 0.00 -2.35 0.02 0.00 0.01 0.00 0.00 72.50 70.18 3b6g s THR 118 CO 0.00 0.46 1.18 0.27 -0.69 0.00 0.00 174.62 175.84 3b6g s ILE 119 N 1.28 4.25 0.22 1.82 -4.36 -1.26 -4.96 121.20 118.19 3b6g s ILE 119 Ca 0.03 1.37 0.03 0.00 -0.26 0.00 0.00 60.65 61.82 3b6g s ILE 119 Cb -0.14 -4.41 -0.03 0.00 1.25 0.00 0.00 42.46 39.12 3b6g s ILE 119 CO -0.04 -0.71 0.37 -0.04 0.24 0.00 0.00 174.94 174.76 3b6g s MET 120 N 4.20 3.46 0.61 0.37 -1.94 -1.26 -5.00 119.30 119.73 3b6g s MET 120 Ca 0.50 -0.57 0.31 0.00 -1.71 0.00 0.00 55.69 54.22 3b6g s MET 120 Cb -0.11 -2.87 1.79 0.00 2.01 0.00 0.00 34.83 35.64 3b6g s MET 120 CO 0.25 0.42 2.14 -1.35 -0.01 0.00 0.00 175.02 176.47 3b6g h PRO 121 N 1.58 0.00 0.00 2.03 0.11 -2.00 -0.19 132.00 133.53 3b6g h PRO 121 Ca -0.50 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 3b6g h PRO 121 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 3b6g h PRO 121 CO 0.65 0.00 -0.06 1.57 -0.21 0.00 0.00 178.00 179.95 3b6g h LYS 122 N 0.00 0.00 0.41 1.05 2.10 -2.00 -1.92 116.57 116.21 3b6g h LYS 122 Ca 0.05 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.68 3b6g h LYS 122 Cb 0.37 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.71 3b6g h LYS 122 CO -0.00 0.06 -0.20 -0.44 -2.00 0.00 0.00 179.45 176.87 3b6g h ASP 123 N 0.00 -0.46 -0.90 7.07 3.32 -1.41 -3.30 116.42 120.73 3b6g h ASP 123 Ca -0.00 -0.02 0.25 0.00 0.02 0.00 0.00 57.03 57.28 3b6g h ASP 123 Cb 0.12 0.12 -0.15 0.00 0.22 0.00 0.00 39.33 39.63 3b6g h ASP 123 CO 0.01 -0.03 0.18 0.40 -1.72 0.00 0.00 179.24 178.08 3b6g h ILE 124 N -1.13 0.22 0.00 0.35 2.04 -1.48 0.20 117.51 117.71 3b6g h ILE 124 Ca -0.06 -0.05 -0.00 0.00 1.00 0.00 0.00 64.86 65.75 3b6g h ILE 124 Cb 0.45 0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.61 3b6g h ILE 124 CO 0.09 0.02 -0.02 1.56 0.00 0.00 0.00 178.15 179.81 3b6g h GLN 125 N 0.13 0.00 0.19 2.37 4.20 -1.45 -0.86 115.11 119.70 3b6g h GLN 125 Ca 0.57 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 59.02 3b6g h GLN 125 Cb 1.18 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.98 3b6g h GLN 125 CO -0.73 0.02 -1.15 1.25 -0.67 0.00 0.00 178.83 177.54 3b6g h LEU 126 N 0.00 0.62 -0.43 1.46 5.85 -1.04 -3.08 115.31 118.69 3b6g h LEU 126 Ca -0.00 -0.93 0.00 0.00 0.84 0.00 0.00 57.88 57.79 3b6g h LEU 126 Cb 0.04 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 3b6g h LEU 126 CO 0.00 1.55 0.27 0.00 -0.34 0.00 0.00 178.44 179.92 3b6g h ALA 127 N 0.10 0.54 -0.22 1.25 0.00 -0.96 -0.72 119.26 119.24 3b6g h ALA 127 Ca -0.21 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3b6g h ALA 127 Cb 1.88 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 3b6g h ALA 127 CO 0.20 0.02 0.11 0.00 0.00 0.00 0.00 179.25 179.57 3b6g h ARG 128 N 0.57 0.32 0.34 0.00 3.08 -1.34 -2.40 114.38 114.94 3b6g h ARG 128 Ca 0.15 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 3b6g h ARG 128 Cb -0.03 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 29.93 3b6g h ARG 128 CO -0.03 0.33 -0.44 -0.09 -1.07 0.00 0.00 179.97 178.67 3b6g h ARG 129 N 0.23 -0.79 -0.54 0.04 9.65 -1.41 -0.90 114.38 120.66 3b6g h ARG 129 Ca 0.08 0.05 0.09 0.00 -1.10 0.00 0.00 59.98 59.10 3b6g h ARG 129 Cb 0.11 0.18 -0.07 0.00 -1.39 0.00 0.00 29.97 28.79 3b6g h ARG 129 CO -0.01 -0.53 0.12 0.82 2.80 0.00 0.00 179.97 183.18 3b6g h ILE 130 N -0.82 0.70 0.00 1.20 2.04 -1.16 0.26 117.51 119.74 3b6g h ILE 130 Ca -0.02 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 3b6g h ILE 130 Cb 0.75 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.25 3b6g h ILE 130 CO -0.12 0.05 -0.05 0.03 0.00 0.00 0.00 178.15 178.05 3b6g h ARG 131 N 0.26 0.00 -0.29 2.37 3.08 -1.27 -3.47 114.38 115.06 3b6g h ARG 131 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.33 3b6g h ARG 131 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.43 3b6g h ARG 131 CO -0.35 0.05 0.00 0.41 -1.07 0.00 0.00 179.97 179.01 3b6g n GLY 132 N -1.28 0.85 1.00 0.04 0.00 0.08 -5.06 105.19 100.82 3b6g n GLY 132 Ca -0.03 -0.66 -0.01 0.00 0.00 0.00 0.00 46.02 45.32 3b6g n GLY 132 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3b6g n GLU 133 N -0.15 0.02 0.25 1.61 1.02 -0.45 -4.52 120.64 118.42 3b6g n GLU 133 Ca 0.00 0.01 0.16 0.00 -0.02 0.00 0.00 57.16 57.31 3b6g n GLU 133 Cb 0.05 -0.54 0.69 0.00 -0.02 0.00 0.00 31.44 31.63 3b6g n GLU 133 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3b6g h ARG 134 N -0.04 0.00 -0.02 3.49 3.08 -1.84 -3.49 114.38 115.56 3b6g h ARG 134 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3b6g h ARG 134 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 3b6g h ARG 134 CO -0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90