#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iqw s MET 14 N 0.00 0.75 0.14 -1.46 1.00 -1.16 -4.98 119.30 113.60 3iqw s MET 14 Ca 0.00 -0.46 -0.34 0.00 0.00 0.00 0.00 55.69 54.89 3iqw s MET 14 Cb 0.00 -0.72 -0.14 0.00 0.00 0.00 0.00 34.83 33.98 3iqw s MET 14 CO 0.00 0.19 1.59 0.39 0.00 0.00 0.00 175.02 177.18 3iqw n GLU 15 N 2.50 2.10 -0.99 2.03 4.71 -1.26 -4.64 120.64 125.09 3iqw n GLU 15 Ca -0.15 0.76 -0.20 0.00 -0.01 0.00 0.00 57.16 57.55 3iqw n GLU 15 Cb 0.56 -2.53 -0.10 0.00 -1.01 0.00 0.00 31.44 28.37 3iqw n GLU 15 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 3iqw n PRO 16 N 3.60 2.38 -3.94 3.49 -0.04 -1.26 -4.34 135.00 134.88 3iqw n PRO 16 Ca 0.17 -1.34 -0.09 0.00 -0.04 0.00 0.00 63.50 62.20 3iqw n PRO 16 Cb 0.28 -2.26 -0.05 0.00 -0.04 0.00 0.00 33.50 31.44 3iqw n PRO 16 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3iqw s THR 17 N 1.78 0.01 -0.31 0.52 -4.23 -1.26 -4.12 115.64 108.03 3iqw s THR 17 Ca 0.60 -1.27 0.10 0.00 -1.18 0.00 0.00 61.69 59.94 3iqw s THR 17 Cb 0.23 -2.08 0.63 0.00 1.34 0.00 0.00 72.50 72.62 3iqw s THR 17 CO -0.02 -0.03 1.67 0.18 -0.54 0.00 0.00 174.62 175.88 3iqw n LEU 18 N -0.38 5.32 -0.27 4.79 4.77 -0.15 -4.53 117.00 126.54 3iqw n LEU 18 Ca -0.03 -3.40 0.05 0.00 -0.03 0.00 0.00 56.01 52.60 3iqw n LEU 18 Cb 0.61 -0.70 0.19 0.00 -2.33 0.00 0.00 43.42 41.19 3iqw n LEU 18 CO 0.21 0.94 1.07 -0.61 -1.33 0.00 0.00 177.39 177.67 3iqw h GLN 19 N 1.80 0.57 -0.81 3.23 5.75 -1.84 -1.71 115.11 122.08 3iqw h GLN 19 Ca 0.27 -0.03 0.04 0.00 -0.15 0.00 0.00 58.65 58.78 3iqw h GLN 19 Cb 2.10 -0.13 -0.05 0.00 1.07 0.00 0.00 27.48 30.47 3iqw h GLN 19 CO 0.62 0.38 0.51 0.66 -2.65 0.00 0.00 178.83 178.35 3iqw h SER 20 N 0.58 0.82 -0.23 -0.69 4.64 -1.98 0.68 113.55 117.38 3iqw h SER 20 Ca 0.42 0.01 0.04 0.00 -0.47 0.00 0.00 61.79 61.78 3iqw h SER 20 Cb 0.55 -0.17 -0.04 0.00 -0.31 0.00 0.00 62.40 62.43 3iqw h SER 20 CO -0.34 0.55 -0.02 0.40 -0.87 0.00 0.00 176.83 176.55 3iqw h ILE 21 N 0.97 0.81 -0.15 0.95 1.08 -1.66 0.16 117.51 119.66 3iqw h ILE 21 Ca 0.34 -0.01 0.03 0.00 -0.39 0.00 0.00 64.86 64.83 3iqw h ILE 21 Cb 0.08 0.76 -0.01 0.00 -3.07 0.00 0.00 36.82 34.59 3iqw h ILE 21 CO -0.14 0.01 0.10 -0.07 -0.69 0.00 0.00 178.15 177.36 3iqw h LEU 22 N 0.04 0.04 0.00 1.44 3.38 -0.71 -2.46 115.31 117.04 3iqw h LEU 22 Ca 0.11 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3iqw h LEU 22 Cb 0.15 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3iqw h LEU 22 CO -0.21 0.03 -0.41 0.44 0.09 0.00 0.00 178.44 178.38 3iqw h ASP 23 N 0.05 0.00 -2.74 -0.43 3.32 0.13 -3.41 116.42 113.34 3iqw h ASP 23 Ca 0.07 -0.12 -0.74 0.00 0.02 0.00 0.00 57.03 56.25 3iqw h ASP 23 Cb 0.21 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 39.55 3iqw h ASP 23 CO -0.00 0.06 0.87 -1.58 -1.72 0.00 0.00 179.24 176.86 3iqw s GLN 24 N -3.16 3.92 0.47 3.56 0.74 0.03 -4.88 119.66 120.34 3iqw s GLN 24 Ca 0.07 -2.48 0.29 0.00 0.05 0.00 0.00 55.36 53.30 3iqw s GLN 24 Cb 0.12 -4.84 1.03 0.00 1.10 0.00 0.00 33.01 30.43 3iqw s GLN 24 CO 0.68 -1.60 1.85 0.00 -0.55 0.00 0.00 175.29 175.67 3iqw h ARG 25 N 7.59 0.00 0.00 1.67 3.08 -1.82 -2.45 114.38 122.44 3iqw h ARG 25 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.27 3iqw h ARG 25 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.99 3iqw h ARG 25 CO 1.09 0.00 0.00 0.77 -1.07 0.00 0.00 179.97 180.76 3iqw h SER 26 N 0.00 0.00 -2.14 7.04 0.02 -1.90 -3.46 113.55 113.11 3iqw h SER 26 Ca 0.00 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.35 3iqw h SER 26 Cb 0.63 0.00 0.05 0.00 0.14 0.00 0.00 62.40 63.22 3iqw h SER 26 CO 0.00 0.00 0.78 0.18 -1.14 0.00 0.00 176.83 176.65 3iqw n LEU 27 N -2.80 2.89 -0.03 5.07 4.77 -0.92 -4.47 117.00 121.50 3iqw n LEU 27 Ca 0.02 1.08 -0.04 0.00 -0.03 0.00 0.00 56.01 57.04 3iqw n LEU 27 Cb 0.36 -1.38 -0.03 0.00 -2.33 0.00 0.00 43.42 40.04 3iqw n LEU 27 CO 0.28 -0.38 -0.70 -1.14 -1.33 0.00 0.00 177.39 174.11 3iqw n ARG 28 N 3.66 1.17 -3.96 3.23 3.00 0.52 -4.65 116.66 119.64 3iqw n ARG 28 Ca 0.18 0.02 -0.30 0.00 -0.00 0.00 0.00 57.85 57.75 3iqw n ARG 28 Cb 0.27 -1.13 -0.16 0.00 0.00 0.00 0.00 32.46 31.44 3iqw n ARG 28 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 3iqw s TRP 29 N -2.13 2.41 -0.31 -0.14 0.51 -0.10 -0.39 118.94 118.79 3iqw s TRP 29 Ca -0.07 -1.71 -0.02 0.00 -2.12 0.00 0.00 56.10 52.18 3iqw s TRP 29 Cb 0.02 -1.60 0.05 0.00 -0.81 0.00 0.00 33.47 31.13 3iqw s TRP 29 CO 0.17 -0.76 0.02 0.42 -0.51 0.00 0.00 176.95 176.29 3iqw s ILE 30 N 1.39 3.06 -0.10 2.03 1.01 0.34 -2.22 121.20 126.71 3iqw s ILE 30 Ca -0.05 -1.40 -0.20 0.00 0.00 0.00 0.00 60.65 59.01 3iqw s ILE 30 Cb -0.18 -2.77 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 3iqw s ILE 30 CO -0.07 -0.14 0.56 -0.36 0.00 0.00 0.00 174.94 174.93 3iqw s PHE 31 N 1.26 3.54 -0.26 3.97 0.08 -0.76 -0.89 117.98 124.92 3iqw s PHE 31 Ca -0.04 1.02 -0.07 0.00 0.12 0.00 0.00 56.93 57.96 3iqw s PHE 31 Cb -0.20 -2.64 -0.02 0.00 -0.57 0.00 0.00 43.02 39.59 3iqw s PHE 31 CO -0.01 0.14 0.06 0.08 -0.10 0.00 0.00 175.22 175.39 3iqw s VAL 32 N 0.68 4.16 0.25 -0.44 1.01 -0.39 -0.51 120.40 125.17 3iqw s VAL 32 Ca 0.30 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 62.00 3iqw s VAL 32 Cb -0.16 -2.98 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 3iqw s VAL 32 CO 0.13 0.29 0.06 -0.83 0.00 0.00 0.00 175.10 174.75 3iqw s GLY 33 N 1.58 1.68 0.00 4.51 0.00 -0.62 -3.52 107.32 110.95 3iqw s GLY 33 Ca 0.06 -1.84 0.00 0.00 0.00 0.00 0.00 44.72 42.94 3iqw s GLY 33 CO 0.03 -1.63 0.00 0.61 0.00 0.00 0.00 173.10 172.11 3iqw n GLY 34 N -0.46 3.58 3.63 0.20 0.00 -1.26 -0.53 105.19 110.35 3iqw n GLY 34 Ca -0.02 -1.38 -0.32 0.00 0.00 0.00 0.00 46.02 44.29 3iqw n GLY 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3iqw n LYS 35 N -1.67 -0.21 -1.70 1.61 5.02 -1.26 -4.25 118.16 115.70 3iqw n LYS 35 Ca 0.00 0.01 -0.44 0.00 -2.02 0.00 0.00 58.31 55.86 3iqw n LYS 35 Cb 0.00 -2.30 -0.03 0.00 -0.02 0.00 0.00 35.03 32.68 3iqw n LYS 35 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3iqw n GLY 36 N 0.59 1.18 1.00 0.72 0.00 -1.26 -2.54 105.19 104.88 3iqw n GLY 36 Ca 0.12 0.57 0.00 0.00 0.00 0.00 0.00 46.02 46.71 3iqw n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iqw n GLY 37 N 2.98 1.04 0.28 -0.02 0.00 -1.26 -4.91 105.19 103.31 3iqw n GLY 37 Ca 0.14 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.33 3iqw n GLY 37 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3iqw h VAL 38 N 0.00 0.00 0.00 1.61 -1.51 -1.85 -3.45 116.25 111.05 3iqw h VAL 38 Ca 0.00 -0.48 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 3iqw h VAL 38 Cb 0.00 1.47 0.00 0.00 -2.13 0.00 0.00 31.29 30.63 3iqw h VAL 38 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 3iqw n GLY 39 N -0.02 1.09 0.30 5.19 0.00 -1.26 -4.74 105.19 105.75 3iqw n GLY 39 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 3iqw n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3iqw h LYS 40 N 0.00 -0.68 0.02 1.61 1.57 -1.88 -2.08 116.57 115.12 3iqw h LYS 40 Ca 0.00 0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.86 3iqw h LYS 40 Cb 0.00 0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.41 3iqw h LYS 40 CO 0.00 -0.37 -0.39 1.15 -0.57 0.00 0.00 179.45 179.27 3iqw h THR 41 N -1.00 0.20 -1.13 -0.16 2.02 -1.94 -0.52 112.91 110.38 3iqw h THR 41 Ca -0.07 0.00 0.33 0.00 0.77 0.00 0.00 66.41 67.44 3iqw h THR 41 Cb 0.62 0.20 -0.11 0.00 -1.74 0.00 0.00 68.15 67.12 3iqw h THR 41 CO 0.12 0.00 0.73 0.74 0.37 0.00 0.00 175.52 177.48 3iqw h THR 42 N -0.55 0.37 0.10 3.16 2.02 -1.94 0.14 112.91 116.21 3iqw h THR 42 Ca 0.05 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 3iqw h THR 42 Cb 0.63 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.11 3iqw h THR 42 CO -0.29 0.05 -0.05 0.74 0.37 0.00 0.00 175.52 176.34 3iqw h THR 43 N 0.28 0.64 -0.61 3.16 2.02 -0.62 -2.38 112.91 115.39 3iqw h THR 43 Ca 0.68 -1.27 0.06 0.00 0.77 0.00 0.00 66.41 66.65 3iqw h THR 43 Cb 1.89 1.15 -0.07 0.00 -1.74 0.00 0.00 68.15 69.38 3iqw h THR 43 CO -0.35 0.20 -0.36 -1.20 0.37 0.00 0.00 175.52 174.17 3iqw n SER 44 N -4.84 -0.65 -0.19 4.18 7.64 -0.27 0.76 113.62 120.25 3iqw n SER 44 Ca -0.05 1.37 -0.11 0.00 1.01 0.00 0.00 58.87 61.08 3iqw n SER 44 Cb 0.21 -0.28 -0.08 0.00 -1.01 0.00 0.00 64.21 63.05 3iqw n SER 44 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3iqw h SER 46 N -0.23 -0.77 -0.78 0.00 0.02 -0.38 -0.79 113.55 110.61 3iqw h SER 46 Ca 0.08 0.17 0.07 0.00 -0.84 0.00 0.00 61.79 61.28 3iqw h SER 46 Cb 0.45 0.41 -0.06 0.00 0.14 0.00 0.00 62.40 63.34 3iqw h SER 46 CO -0.59 -0.25 0.45 0.25 -1.14 0.00 0.00 176.83 175.55 3iqw h LEU 47 N -0.13 0.68 -0.28 5.07 5.85 0.98 -1.63 115.31 125.85 3iqw h LEU 47 Ca 0.22 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.91 3iqw h LEU 47 Cb 0.47 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 3iqw h LEU 47 CO -0.54 0.42 -0.06 0.00 -0.34 0.00 0.00 178.44 177.92 3iqw h ALA 48 N 1.40 0.38 -0.73 1.25 0.00 0.07 -1.11 119.26 120.53 3iqw h ALA 48 Ca 0.36 -0.27 0.14 0.00 0.00 0.00 0.00 54.91 55.13 3iqw h ALA 48 Cb 0.25 -0.10 -0.09 0.00 0.00 0.00 0.00 17.79 17.84 3iqw h ALA 48 CO -0.20 0.19 0.27 0.82 0.00 0.00 0.00 179.25 180.32 3iqw h ILE 49 N 0.29 0.64 -0.24 0.00 2.04 -0.51 0.25 117.51 119.98 3iqw h ILE 49 Ca 0.07 -0.14 -0.04 0.00 1.00 0.00 0.00 64.86 65.76 3iqw h ILE 49 Cb 0.53 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 3iqw h ILE 49 CO 0.03 0.07 0.01 -0.61 0.00 0.00 0.00 178.15 177.65 3iqw h GLN 50 N 0.40 0.42 -0.71 2.37 5.75 -0.91 -3.08 115.11 119.36 3iqw h GLN 50 Ca 0.40 -0.13 -0.03 0.00 -0.15 0.00 0.00 58.65 58.74 3iqw h GLN 50 Cb 0.61 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 29.09 3iqw h GLN 50 CO -0.41 0.58 0.33 -0.07 -2.65 0.00 0.00 178.83 176.61 3iqw h LEU 51 N 0.20 0.94 -1.17 -2.39 3.38 -0.10 -0.91 115.31 115.27 3iqw h LEU 51 Ca 0.07 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3iqw h LEU 51 Cb 0.38 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3iqw h LEU 51 CO 0.01 0.82 0.00 0.00 0.09 0.00 0.00 178.44 179.36 3iqw n ALA 52 N -2.38 1.17 0.86 1.53 0.00 0.78 0.84 120.51 123.31 3iqw n ALA 52 Ca 0.06 0.16 0.13 0.00 0.00 0.00 0.00 53.44 53.78 3iqw n ALA 52 Cb 0.14 -1.31 0.36 0.00 0.00 0.00 0.00 19.45 18.64 3iqw n ALA 52 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3iqw n LYS 53 N -2.19 0.10 -1.58 0.00 4.81 -0.34 -3.88 118.16 115.08 3iqw n LYS 53 Ca -0.01 0.05 0.01 0.00 -0.87 0.00 0.00 58.31 57.49 3iqw n LYS 53 Cb 0.07 -1.58 0.01 0.00 0.02 0.00 0.00 35.03 33.55 3iqw n LYS 53 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 3iqw n VAL 54 N -1.73 0.14 -4.13 3.15 0.24 0.25 -5.07 118.33 111.17 3iqw n VAL 54 Ca 0.05 -0.99 -0.09 0.00 -2.04 0.00 0.00 64.34 61.27 3iqw n VAL 54 Cb 0.37 0.92 -0.10 0.00 -1.47 0.00 0.00 33.84 33.57 3iqw n VAL 54 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 3iqw s ARG 55 N -0.41 0.91 0.29 7.34 1.81 -0.29 -5.02 118.95 123.59 3iqw s ARG 55 Ca 0.25 -1.41 0.01 0.00 -1.72 0.00 0.00 55.73 52.86 3iqw s ARG 55 Cb 0.30 0.25 0.45 0.00 -0.45 0.00 0.00 34.95 35.49 3iqw s ARG 55 CO -0.12 -0.26 1.81 -0.09 -0.68 0.00 0.00 175.30 175.97 3iqw h ARG 56 N 2.87 0.68 -1.67 3.54 2.43 -1.90 -3.46 114.38 116.87 3iqw h ARG 56 Ca -0.35 -0.16 0.23 0.00 -0.81 0.00 0.00 59.98 58.88 3iqw h ARG 56 Cb 1.20 -0.09 -0.17 0.00 -0.42 0.00 0.00 29.97 30.48 3iqw h ARG 56 CO 0.59 0.69 0.73 -1.54 -1.51 0.00 0.00 179.97 178.94 3iqw s SER 57 N -6.68 -0.18 -0.11 -3.80 1.04 -1.26 -4.89 113.70 97.82 3iqw s SER 57 Ca -0.09 -0.02 -0.08 0.00 0.48 0.00 0.00 55.95 56.24 3iqw s SER 57 Cb 0.15 0.21 0.04 0.00 0.10 0.00 0.00 66.02 66.51 3iqw s SER 57 CO 0.79 -0.34 0.27 -0.69 0.98 0.00 0.00 173.24 174.25 3iqw s VAL 58 N -2.60 -0.02 -0.06 5.02 1.01 -0.98 -2.49 120.40 120.29 3iqw s VAL 58 Ca 0.09 0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.16 3iqw s VAL 58 Cb -0.01 -0.40 -0.02 0.00 0.00 0.00 0.00 36.38 35.95 3iqw s VAL 58 CO -0.05 0.02 -0.15 -0.22 0.00 0.00 0.00 175.10 174.70 3iqw s LEU 59 N 0.62 2.68 -0.29 3.92 2.96 0.23 -1.02 118.68 127.78 3iqw s LEU 59 Ca -0.04 -0.24 -0.03 0.00 -0.22 0.00 0.00 54.13 53.61 3iqw s LEU 59 Cb -0.05 -1.55 0.04 0.00 0.50 0.00 0.00 46.19 45.13 3iqw s LEU 59 CO -0.04 0.31 0.01 -0.22 -1.32 0.00 0.00 176.35 175.10 3iqw s LEU 60 N -0.54 3.81 -0.21 -0.68 2.96 0.37 -1.15 118.68 123.23 3iqw s LEU 60 Ca 0.07 -1.12 0.01 0.00 -0.22 0.00 0.00 54.13 52.86 3iqw s LEU 60 Cb -0.11 -1.74 0.03 0.00 0.50 0.00 0.00 46.19 44.86 3iqw s LEU 60 CO 0.01 -0.24 -0.15 -0.22 -1.32 0.00 0.00 176.35 174.44 3iqw s LEU 61 N 1.31 2.63 -0.12 -0.68 0.20 -0.49 -0.70 118.68 120.83 3iqw s LEU 61 Ca -0.03 -0.81 -0.01 0.00 0.69 0.00 0.00 54.13 53.97 3iqw s LEU 61 Cb -0.19 -1.55 -0.02 0.00 -0.43 0.00 0.00 46.19 44.00 3iqw s LEU 61 CO -0.01 -0.06 -0.10 -0.55 -0.29 0.00 0.00 176.35 175.34 3iqw s SER 62 N 1.27 4.31 -0.00 3.68 0.15 -0.14 -1.02 113.70 121.95 3iqw s SER 62 Ca 0.02 -0.22 0.19 0.00 0.70 0.00 0.00 55.95 56.64 3iqw s SER 62 Cb -0.15 -1.53 -0.22 0.00 -1.71 0.00 0.00 66.02 62.41 3iqw s SER 62 CO -0.09 0.21 0.78 0.41 1.20 0.00 0.00 173.24 175.75 3iqw n THR 63 N 3.25 0.00 -1.65 6.45 -1.04 -1.05 -2.16 114.28 118.09 3iqw n THR 63 Ca -0.18 -0.08 -0.50 0.00 -2.04 0.00 0.00 64.05 61.25 3iqw n THR 63 Cb 0.53 0.91 -0.05 0.00 -1.82 0.00 0.00 70.33 69.89 3iqw n THR 63 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 3iqw n ASP 64 N -1.53 2.58 0.10 8.00 -0.08 -1.26 -4.65 116.55 119.71 3iqw n ASP 64 Ca 0.03 1.07 0.06 0.00 -1.51 0.00 0.00 54.79 54.44 3iqw n ASP 64 Cb 0.32 -1.30 0.30 0.00 2.34 0.00 0.00 41.12 42.79 3iqw n ASP 64 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 3iqw n PRO 65 N 4.03 0.07 -2.32 -0.67 -0.02 -1.26 -4.35 135.00 130.47 3iqw n PRO 65 Ca 0.20 0.53 -0.40 0.00 -2.02 0.00 0.00 63.50 61.81 3iqw n PRO 65 Cb 0.23 -1.85 -0.03 0.00 -0.02 0.00 0.00 33.50 31.83 3iqw n PRO 65 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3iqw s ALA 66 N -3.21 3.38 -0.79 3.55 0.00 -1.26 -4.96 121.76 118.47 3iqw s ALA 66 Ca -0.01 1.03 -0.05 0.00 0.00 0.00 0.00 51.96 52.93 3iqw s ALA 66 Cb 0.03 -3.39 0.06 0.00 0.00 0.00 0.00 23.12 19.83 3iqw s ALA 66 CO 0.10 -0.39 2.68 0.72 0.00 0.00 0.00 175.76 178.88 3iqw n HIS 67 N 0.82 1.90 0.18 0.00 8.25 -1.26 -4.69 115.22 120.42 3iqw n HIS 67 Ca 0.00 -2.28 0.07 0.00 -0.26 0.00 0.00 57.72 55.25 3iqw n HIS 67 Cb 0.44 -1.60 0.16 0.00 1.12 0.00 0.00 29.99 30.11 3iqw n HIS 67 CO 0.00 0.00 0.00 -0.91 0.64 0.00 0.00 176.34 176.07 3iqw h ASN 68 N 3.67 0.00 -0.33 0.41 -0.26 -1.93 -2.81 115.58 114.33 3iqw h ASN 68 Ca 0.51 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 56.25 3iqw h ASN 68 Cb 0.60 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.84 3iqw h ASN 68 CO 1.09 0.30 0.20 -0.07 -1.06 0.00 0.00 177.43 177.89 3iqw h LEU 69 N 0.00 0.39 -0.57 1.61 3.38 -1.96 0.30 115.31 118.47 3iqw h LEU 69 Ca -0.00 -0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 3iqw h LEU 69 Cb 1.14 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 3iqw h LEU 69 CO 0.04 0.33 -0.21 0.28 0.09 0.00 0.00 178.44 178.97 3iqw h SER 70 N 0.43 0.95 -0.74 -0.43 0.02 -1.70 -2.40 113.55 109.68 3iqw h SER 70 Ca 0.12 -0.35 -0.04 0.00 -0.84 0.00 0.00 61.79 60.68 3iqw h SER 70 Cb 0.01 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.25 3iqw h SER 70 CO -0.02 1.12 0.33 0.44 -1.14 0.00 0.00 176.83 177.56 3iqw h ASP 71 N 0.80 1.00 -0.94 3.07 3.32 -1.20 0.28 116.42 122.75 3iqw h ASP 71 Ca 0.11 -0.13 0.01 0.00 0.02 0.00 0.00 57.03 57.04 3iqw h ASP 71 Cb 0.77 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 40.01 3iqw h ASP 71 CO 0.06 0.87 0.62 0.00 -1.72 0.00 0.00 179.24 179.07 3iqw h ALA 72 N 1.28 1.34 -0.35 3.45 0.00 0.01 -2.98 119.26 122.02 3iqw h ALA 72 Ca 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3iqw h ALA 72 Cb 0.16 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3iqw h ALA 72 CO -0.03 0.60 0.00 1.19 0.00 0.00 0.00 179.25 181.02 3iqw n PHE 73 N -4.40 0.47 -4.14 0.00 3.72 -0.85 -1.21 117.46 111.05 3iqw n PHE 73 Ca 0.11 -0.47 -0.38 0.00 -0.05 0.00 0.00 57.45 56.66 3iqw n PHE 73 Cb 0.03 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 38.52 3iqw n PHE 73 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3iqw n SER 74 N 0.59 -1.92 -3.67 4.37 7.64 0.91 -4.77 113.62 116.78 3iqw n SER 74 Ca 0.12 -1.25 -0.13 0.00 1.01 0.00 0.00 58.87 58.62 3iqw n SER 74 Cb 0.43 -1.86 -0.08 0.00 -1.01 0.00 0.00 64.21 61.69 3iqw n SER 74 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 3iqw s GLN 75 N -7.26 0.70 -0.32 1.43 0.74 -0.99 -5.05 119.66 108.90 3iqw s GLN 75 Ca 0.26 0.86 -0.29 0.00 0.05 0.00 0.00 55.36 56.24 3iqw s GLN 75 Cb -0.14 0.32 0.00 0.00 1.10 0.00 0.00 33.01 34.29 3iqw s GLN 75 CO 0.97 -0.09 1.32 0.21 -0.55 0.00 0.00 175.29 177.15 3iqw s LYS 76 N 0.43 3.86 0.52 1.67 2.36 -1.26 -4.10 119.74 123.21 3iqw s LYS 76 Ca -0.01 1.20 0.06 0.00 -2.55 0.00 0.00 55.97 54.67 3iqw s LYS 76 Cb -0.04 -3.91 0.02 0.00 -1.05 0.00 0.00 37.83 32.85 3iqw s LYS 76 CO -0.01 -1.20 0.38 -0.06 1.55 0.00 0.00 175.35 176.02 3iqw s PHE 77 N 4.56 1.84 0.00 4.03 0.08 -1.26 -5.05 117.98 122.18 3iqw s PHE 77 Ca 0.57 -0.78 0.00 0.00 0.12 0.00 0.00 56.93 56.85 3iqw s PHE 77 Cb -0.16 -1.95 0.00 0.00 -0.57 0.00 0.00 43.02 40.34 3iqw s PHE 77 CO 0.25 -0.38 0.00 0.41 -0.10 0.00 0.00 175.22 175.40 3iqw n GLY 78 N -1.70 1.10 0.00 4.36 0.00 -1.26 -4.80 105.19 102.89 3iqw n GLY 78 Ca -0.01 -0.89 0.09 0.00 0.00 0.00 0.00 46.02 45.22 3iqw n GLY 78 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3iqw n LYS 79 N 0.00 0.67 -3.98 1.61 -0.00 -1.03 -0.76 118.16 114.68 3iqw n LYS 79 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 58.31 57.97 3iqw n LYS 79 Cb 0.00 -1.44 -0.15 0.00 -0.00 0.00 0.00 35.03 33.45 3iqw n LYS 79 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 3iqw s GLU 80 N -2.00 3.13 0.50 -1.58 2.56 -1.26 -4.89 118.70 115.16 3iqw s GLU 80 Ca 0.28 -0.77 -0.23 0.00 0.00 0.00 0.00 54.97 54.25 3iqw s GLU 80 Cb 0.13 -2.88 -0.07 0.00 2.00 0.00 0.00 34.13 33.32 3iqw s GLU 80 CO 0.22 -0.25 1.35 0.00 -0.56 0.00 0.00 175.26 176.02 3iqw n ALA 81 N 4.71 1.61 -2.60 6.30 0.00 -1.26 -4.80 120.51 124.47 3iqw n ALA 81 Ca -0.19 0.18 -0.09 0.00 0.00 0.00 0.00 53.44 53.34 3iqw n ALA 81 Cb 0.50 -2.34 -0.07 0.00 0.00 0.00 0.00 19.45 17.53 3iqw n ALA 81 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3iqw s ARG 82 N -2.65 1.06 0.12 0.00 1.70 -0.93 -4.94 118.95 113.31 3iqw s ARG 82 Ca 0.67 -1.17 -0.31 0.00 -0.47 0.00 0.00 55.73 54.45 3iqw s ARG 82 Cb -0.44 0.35 -0.08 0.00 -0.57 0.00 0.00 34.95 34.21 3iqw s ARG 82 CO 0.53 -0.37 1.37 -1.17 -1.08 0.00 0.00 175.30 174.58 3iqw s LEU 83 N -2.96 4.37 -0.00 -1.89 2.96 -1.26 -1.26 118.68 118.65 3iqw s LEU 83 Ca 0.16 2.31 -0.30 0.00 -0.22 0.00 0.00 54.13 56.07 3iqw s LEU 83 Cb 0.04 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.10 3iqw s LEU 83 CO -0.02 -0.63 1.27 -0.69 -1.32 0.00 0.00 176.35 174.96 3iqw s VAL 84 N 1.04 3.98 0.07 1.68 1.01 0.46 -4.91 120.40 123.74 3iqw s VAL 84 Ca 0.64 1.37 -0.34 0.00 0.00 0.00 0.00 61.98 63.64 3iqw s VAL 84 Cb -0.36 -3.88 -0.14 0.00 0.00 0.00 0.00 36.38 32.01 3iqw s VAL 84 CO 0.31 0.03 1.65 -0.62 0.00 0.00 0.00 175.10 176.46 3iqw n GLU 85 N 4.87 2.04 0.00 2.72 -0.58 -1.26 -1.75 120.64 126.69 3iqw n GLU 85 Ca 0.11 0.74 0.00 0.00 -0.42 0.00 0.00 57.16 57.59 3iqw n GLU 85 Cb 0.45 -2.52 0.00 0.00 -0.57 0.00 0.00 31.44 28.80 3iqw n GLU 85 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3iqw n GLY 86 N 3.64 0.33 3.36 0.62 0.00 -1.26 -4.97 105.19 106.92 3iqw n GLY 86 Ca 0.19 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.02 3iqw n GLY 86 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3iqw s PHE 87 N -2.00 1.74 -0.01 1.61 0.08 -0.71 -5.05 117.98 113.64 3iqw s PHE 87 Ca 0.00 -0.64 0.01 0.00 0.12 0.00 0.00 56.93 56.42 3iqw s PHE 87 Cb 0.00 -0.88 0.02 0.00 -0.57 0.00 0.00 43.02 41.59 3iqw s PHE 87 CO 0.00 0.30 0.87 -0.40 -0.10 0.00 0.00 175.22 175.89 3iqw n ASP 88 N -0.43 1.43 0.00 1.36 3.85 -1.26 -4.68 116.55 116.82 3iqw n ASP 88 Ca -0.07 -1.80 0.00 0.00 -0.71 0.00 0.00 54.79 52.21 3iqw n ASP 88 Cb 0.61 -0.03 0.00 0.00 -1.35 0.00 0.00 41.12 40.35 3iqw n ASP 88 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 3iqw n ASN 89 N -0.41 2.45 -4.50 -1.12 4.05 -1.26 -5.07 115.26 109.39 3iqw n ASN 89 Ca 0.01 0.00 -0.34 0.00 0.45 0.00 0.00 54.58 54.70 3iqw n ASN 89 Cb 0.35 0.45 -0.12 0.00 1.23 0.00 0.00 39.78 41.70 3iqw n ASN 89 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 177.26 173.99 3iqw s LEU 90 N -1.62 3.23 0.23 1.20 2.96 -1.26 -2.33 118.68 121.10 3iqw s LEU 90 Ca 0.00 -0.13 0.09 0.00 -0.22 0.00 0.00 54.13 53.88 3iqw s LEU 90 Cb 0.00 -1.77 -0.05 0.00 0.50 0.00 0.00 46.19 44.87 3iqw s LEU 90 CO 0.00 0.18 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.74 3iqw s TYR 91 N 0.29 1.93 0.01 5.38 2.02 -0.19 -0.40 117.35 126.39 3iqw s TYR 91 Ca -0.04 -0.48 -0.06 0.00 -0.37 0.00 0.00 57.07 56.12 3iqw s TYR 91 Cb -0.14 -0.87 -0.00 0.00 -0.40 0.00 0.00 41.96 40.55 3iqw s TYR 91 CO 0.03 0.49 0.11 0.00 -1.57 0.00 0.00 175.55 174.61 3iqw s ALA 92 N -2.80 -0.21 0.05 3.71 0.00 -0.39 -0.48 121.76 121.65 3iqw s ALA 92 Ca 0.25 -0.29 -0.03 0.00 0.00 0.00 0.00 51.96 51.89 3iqw s ALA 92 Cb -0.02 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.22 3iqw s ALA 92 CO 0.10 -0.23 0.03 0.00 0.00 0.00 0.00 175.76 175.66 3iqw s MET 93 N -1.68 0.58 -0.17 0.00 0.23 0.13 -2.19 119.30 116.20 3iqw s MET 93 Ca -0.13 -0.95 -0.01 0.00 -1.03 0.00 0.00 55.69 53.57 3iqw s MET 93 Cb -0.06 0.21 0.04 0.00 -1.53 0.00 0.00 34.83 33.49 3iqw s MET 93 CO -0.00 -0.13 -0.05 -1.21 -2.03 0.00 0.00 175.02 171.60 3iqw s GLU 94 N -3.12 1.40 0.38 3.16 2.02 0.07 -0.97 118.70 121.64 3iqw s GLU 94 Ca -0.00 -0.51 0.01 0.00 0.02 0.00 0.00 54.97 54.48 3iqw s GLU 94 Cb 0.02 -2.00 -0.00 0.00 0.10 0.00 0.00 34.13 32.25 3iqw s GLU 94 CO -0.07 -0.44 0.02 0.44 0.02 0.00 0.00 175.26 175.23 3iqw n ILE 95 N 4.88 0.00 -3.55 -1.63 -5.35 -0.92 -2.46 119.36 110.33 3iqw n ILE 95 Ca -0.12 -1.87 -0.29 0.00 -0.27 0.00 0.00 62.75 60.20 3iqw n ILE 95 Cb 0.48 0.42 -0.13 0.00 -1.74 0.00 0.00 39.64 38.67 3iqw n ILE 95 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 3iqw s ASP 96 N -3.15 3.35 0.00 7.28 1.01 -1.26 -4.57 116.67 119.33 3iqw s ASP 96 Ca 0.03 -1.94 0.00 0.00 0.71 0.00 0.00 52.55 51.35 3iqw s ASP 96 Cb 0.00 -0.53 0.00 0.00 1.01 0.00 0.00 42.92 43.40 3iqw s ASP 96 CO 0.02 -0.35 0.00 -2.65 0.21 0.00 0.00 175.17 172.40 3iqw n PRO 97 N 4.40 0.00 0.00 8.23 -0.01 -1.26 -5.11 135.00 141.25 3iqw n PRO 97 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.54 3iqw n PRO 97 Cb 0.39 0.00 0.00 0.00 -0.01 0.00 0.00 33.50 33.88 3iqw n PRO 97 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 175.50 175.14 3iqw n PRO 130 N 0.00 0.00 -0.25 0.52 -0.04 -1.26 -4.81 135.00 129.16 3iqw n PRO 130 Ca 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.42 3iqw n PRO 130 Cb 0.00 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.48 3iqw n PRO 130 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3iqw n GLY 131 N 0.00 2.46 0.00 0.55 0.00 -1.26 -4.68 105.19 102.25 3iqw n GLY 131 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3iqw n GLY 131 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3iqw n ILE 132 N 0.40 0.00 -0.35 -0.61 -0.00 -1.26 -2.40 119.36 115.14 3iqw n ILE 132 Ca 0.09 0.74 0.05 0.00 -0.00 0.00 0.00 62.75 63.63 3iqw n ILE 132 Cb 0.65 -1.56 0.13 0.00 -0.00 0.00 0.00 39.64 38.85 3iqw n ILE 132 CO 0.00 0.00 0.00 -0.90 -0.00 0.00 0.00 176.55 175.65 3iqw n ASP 133 N -0.39 -0.38 -0.25 4.38 5.68 -1.26 0.96 116.55 125.30 3iqw n ASP 133 Ca 0.00 1.67 0.05 0.00 -0.50 0.00 0.00 54.79 56.01 3iqw n ASP 133 Cb 0.00 -0.50 0.18 0.00 -1.14 0.00 0.00 41.12 39.67 3iqw n ASP 133 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3iqw h GLU 134 N 0.00 0.40 -0.47 0.11 5.08 -1.91 10.96 114.58 128.75 3iqw h GLU 134 Ca 0.46 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.75 3iqw h GLU 134 Cb 0.70 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 3iqw h GLU 134 CO -1.00 0.27 0.13 0.00 -1.00 0.00 0.00 179.01 177.41 3iqw h ALA 135 N 1.55 1.35 0.27 3.43 0.00 0.16 0.66 119.26 126.68 3iqw h ALA 135 Ca 0.41 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 3iqw h ALA 135 Cb 0.63 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3iqw h ALA 135 CO -0.41 0.47 -0.22 1.98 0.00 0.00 0.00 179.25 181.06 3iqw h MET 136 N 0.69 -0.49 -0.48 0.00 -1.53 2.73 -1.87 114.93 113.97 3iqw h MET 136 Ca 0.16 0.03 0.08 0.00 -3.44 0.00 0.00 59.70 56.53 3iqw h MET 136 Cb 0.23 0.11 -0.06 0.00 -0.55 0.00 0.00 31.60 31.32 3iqw h MET 136 CO -0.01 -0.33 0.13 0.77 0.14 0.00 0.00 176.91 177.61 3iqw h SER 137 N -0.51 0.07 -1.02 1.39 0.02 1.49 -0.99 113.55 114.00 3iqw h SER 137 Ca -0.01 0.08 0.25 0.00 -0.84 0.00 0.00 61.79 61.26 3iqw h SER 137 Cb 0.45 0.09 -0.10 0.00 0.14 0.00 0.00 62.40 62.99 3iqw h SER 137 CO -0.02 0.07 0.65 0.15 -1.14 0.00 0.00 176.83 176.53 3iqw h PHE 138 N 0.27 0.73 -0.37 3.45 3.57 0.78 0.23 116.94 125.59 3iqw h PHE 138 Ca 0.24 0.02 -0.15 0.00 3.53 0.00 0.00 57.97 61.62 3iqw h PHE 138 Cb 0.29 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 3iqw h PHE 138 CO -0.20 0.09 -0.35 0.00 -2.23 0.00 0.00 178.31 175.62 3iqw h ALA 139 N 1.63 0.68 -0.60 2.41 0.00 -0.38 -2.29 119.26 120.71 3iqw h ALA 139 Ca 0.58 -0.43 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3iqw h ALA 139 Cb 1.37 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.00 3iqw h ALA 139 CO -0.31 0.67 0.36 0.93 0.00 0.00 0.00 179.25 180.90 3iqw h GLU 140 N 0.72 0.70 0.04 0.00 4.39 -0.33 0.31 114.58 120.40 3iqw h GLU 140 Ca 0.07 -0.04 0.02 0.00 0.34 0.00 0.00 59.36 59.74 3iqw h GLU 140 Cb 0.91 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 29.38 3iqw h GLU 140 CO 0.08 0.46 -0.15 0.28 -1.16 0.00 0.00 179.01 178.52 3iqw h VAL 141 N 0.72 0.64 -0.38 3.13 2.07 -1.18 0.68 116.25 121.92 3iqw h VAL 141 Ca 0.24 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.84 3iqw h VAL 141 Cb 0.03 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.38 3iqw h VAL 141 CO -0.11 0.00 -0.06 -0.07 0.02 0.00 0.00 177.57 177.35 3iqw h LEU 142 N -0.27 -0.29 0.02 2.57 3.38 -0.82 -0.60 115.31 119.29 3iqw h LEU 142 Ca 0.04 0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3iqw h LEU 142 Cb 0.31 0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3iqw h LEU 142 CO -0.11 -0.10 -0.01 0.50 0.09 0.00 0.00 178.44 178.81 3iqw h LYS 143 N 0.03 -0.02 0.08 1.13 1.63 -0.63 -0.62 116.57 118.17 3iqw h LYS 143 Ca 0.18 0.00 0.02 0.00 -0.85 0.00 0.00 60.65 60.01 3iqw h LYS 143 Cb 0.28 0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 31.87 3iqw h LYS 143 CO -0.37 0.09 -0.39 0.37 -3.45 0.00 0.00 179.45 175.71 3iqw h GLN 144 N -0.14 -0.58 -0.18 1.90 5.75 -0.47 -2.24 115.11 119.15 3iqw h GLN 144 Ca -0.00 0.04 0.05 0.00 -0.15 0.00 0.00 58.65 58.58 3iqw h GLN 144 Cb 0.13 0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.76 3iqw h GLN 144 CO 0.00 -0.38 -0.11 0.28 -2.65 0.00 0.00 178.83 175.97 3iqw h VAL 145 N -0.60 0.66 -0.19 2.39 2.07 -1.06 -2.73 116.25 116.78 3iqw h VAL 145 Ca 0.03 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.61 3iqw h VAL 145 Cb 0.64 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 3iqw h VAL 145 CO -0.25 0.00 0.40 -1.13 0.02 0.00 0.00 177.57 176.61 3iqw h ASN 146 N -0.11 0.00 -0.16 0.57 -1.24 -0.49 0.47 115.58 114.62 3iqw h ASN 146 Ca 0.11 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.12 3iqw h ASN 146 Cb 0.27 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.32 3iqw h ASN 146 CO -0.25 0.00 0.00 -1.54 -1.29 0.00 0.00 177.43 174.35 3iqw n SER 147 N -3.26 1.54 -4.79 1.15 3.41 -1.03 -4.86 113.62 105.78 3iqw n SER 147 Ca 0.02 -1.70 -0.23 0.00 -0.26 0.00 0.00 58.87 56.70 3iqw n SER 147 Cb 0.51 -0.10 0.08 0.00 -0.26 0.00 0.00 64.21 64.44 3iqw n SER 147 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3iqw s LEU 148 N -1.54 3.06 0.00 1.04 1.02 0.15 -4.99 118.68 117.42 3iqw s LEU 148 Ca 0.31 -0.18 0.25 0.00 0.02 0.00 0.00 54.13 54.54 3iqw s LEU 148 Cb 0.17 -2.37 0.83 0.00 0.02 0.00 0.00 46.19 44.84 3iqw s LEU 148 CO 0.25 -1.61 1.62 -1.54 0.02 0.00 0.00 176.35 175.09 3iqw n SER 149 N -2.69 1.83 -4.69 2.29 3.41 -1.26 -4.88 113.62 107.63 3iqw n SER 149 Ca 0.12 -1.64 -0.42 0.00 -0.26 0.00 0.00 58.87 56.67 3iqw n SER 149 Cb 0.60 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.48 3iqw n SER 149 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3iqw s TYR 150 N -1.92 2.37 0.17 7.33 1.51 -1.26 -4.88 117.35 120.67 3iqw s TYR 150 Ca 0.35 0.19 -0.08 0.00 -1.01 0.00 0.00 57.07 56.52 3iqw s TYR 150 Cb 0.20 -4.07 0.04 0.00 -0.11 0.00 0.00 41.96 38.02 3iqw s TYR 150 CO 0.31 -4.32 1.51 1.49 -1.11 0.00 0.00 175.55 173.43 3iqw h GLU 151 N 8.24 0.81 -4.34 -0.62 4.81 -1.82 -3.44 114.58 118.22 3iqw h GLU 151 Ca -0.44 -0.43 -0.33 0.00 -0.13 0.00 0.00 59.36 58.03 3iqw h GLU 151 Cb 1.21 0.01 -0.28 0.00 0.63 0.00 0.00 28.75 30.32 3iqw h GLU 151 CO 0.94 1.06 -0.76 0.99 -0.73 0.00 0.00 179.01 180.51 3iqw s THR 152 N -4.34 0.44 -0.14 0.32 2.01 -1.20 -4.64 115.64 108.09 3iqw s THR 152 Ca -0.10 -0.25 0.02 0.00 0.31 0.00 0.00 61.69 61.67 3iqw s THR 152 Cb 0.12 -0.37 0.00 0.00 0.01 0.00 0.00 72.50 72.26 3iqw s THR 152 CO 0.86 0.11 -0.20 -0.63 -0.69 0.00 0.00 174.62 174.07 3iqw s ILE 153 N -0.16 2.27 -0.37 1.82 1.01 0.47 -0.60 121.20 125.65 3iqw s ILE 153 Ca 0.02 -0.92 -0.09 0.00 0.00 0.00 0.00 60.65 59.66 3iqw s ILE 153 Cb -0.02 -1.92 0.04 0.00 0.01 0.00 0.00 42.46 40.57 3iqw s ILE 153 CO -0.00 0.54 0.18 -0.69 0.00 0.00 0.00 174.94 174.97 3iqw s VAL 154 N 0.70 4.23 -0.20 2.92 1.01 -0.30 -0.51 120.40 128.25 3iqw s VAL 154 Ca -0.09 -1.04 -0.22 0.00 0.00 0.00 0.00 61.98 60.62 3iqw s VAL 154 Cb -0.16 -3.41 -0.02 0.00 0.00 0.00 0.00 36.38 32.79 3iqw s VAL 154 CO 0.01 -0.26 0.70 -0.36 0.00 0.00 0.00 175.10 175.20 3iqw s PHE 155 N 1.48 3.36 -0.42 5.22 0.08 -0.07 -1.40 117.98 126.24 3iqw s PHE 155 Ca 0.01 1.02 -0.20 0.00 0.12 0.00 0.00 56.93 57.88 3iqw s PHE 155 Cb -0.20 -2.89 0.02 0.00 -0.57 0.00 0.00 43.02 39.38 3iqw s PHE 155 CO 0.05 -0.24 0.58 0.34 -0.10 0.00 0.00 175.22 175.85 3iqw s ASP 156 N 1.25 6.30 0.28 1.36 3.68 -0.19 -1.26 116.67 128.09 3iqw s ASP 156 Ca 0.31 -0.35 0.03 0.00 2.13 0.00 0.00 52.55 54.67 3iqw s ASP 156 Cb -0.16 -2.29 -0.06 0.00 -1.45 0.00 0.00 42.92 38.96 3iqw s ASP 156 CO 0.10 -0.69 0.06 0.42 0.13 0.00 0.00 175.17 175.19 3iqw s THR 157 N 2.62 0.91 1.02 1.71 -4.23 -1.23 -2.52 115.64 113.92 3iqw s THR 157 Ca 0.20 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.53 3iqw s THR 157 Cb -0.15 -2.67 0.25 0.00 1.34 0.00 0.00 72.50 71.28 3iqw s THR 157 CO 0.17 -0.05 0.88 0.00 -0.54 0.00 0.00 174.62 175.08 3iqw n ALA 158 N -0.56 -2.91 -1.39 3.99 0.00 -1.26 -4.73 120.51 113.65 3iqw n ALA 158 Ca -0.02 -1.32 -0.35 0.00 0.00 0.00 0.00 53.44 51.75 3iqw n ALA 158 Cb 0.66 -0.09 0.10 0.00 0.00 0.00 0.00 19.45 20.12 3iqw n ALA 158 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3iqw s PRO 159 N -4.99 2.04 0.11 0.00 0.02 -1.26 -4.62 135.00 126.29 3iqw s PRO 159 Ca 0.58 1.91 -0.11 0.00 0.02 0.00 0.00 61.00 63.39 3iqw s PRO 159 Cb -0.06 -1.80 0.07 0.00 0.02 0.00 0.00 34.50 32.73 3iqw s PRO 159 CO 0.44 -1.95 0.80 2.41 -0.33 0.00 0.00 177.00 178.38 3iqw n THR 160 N -2.66 -0.30 -0.23 0.99 -1.04 -1.26 -0.12 114.28 109.66 3iqw n THR 160 Ca 0.15 1.23 -0.01 0.00 -2.04 0.00 0.00 64.05 63.38 3iqw n THR 160 Cb 0.49 -1.59 0.02 0.00 -1.82 0.00 0.00 70.33 67.43 3iqw n THR 160 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3iqw n GLY 161 N -1.21 -1.23 0.18 3.41 0.00 -1.26 -2.28 105.19 102.80 3iqw n GLY 161 Ca 0.04 0.65 -0.14 0.00 0.00 0.00 0.00 46.02 46.57 3iqw n GLY 161 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3iqw h HIS 162 N 0.00 0.72 0.10 1.61 -0.00 -0.82 -2.70 115.15 114.06 3iqw h HIS 162 Ca 0.19 -0.36 -0.01 0.00 -0.00 0.00 0.00 60.37 60.19 3iqw h HIS 162 Cb 0.34 -0.09 0.00 0.00 -0.00 0.00 0.00 27.41 27.65 3iqw h HIS 162 CO -0.52 1.17 -0.05 1.15 -0.00 0.00 0.00 177.93 179.68 3iqw h THR 163 N 0.31 1.09 -0.01 2.45 2.02 -1.70 -3.38 112.91 113.69 3iqw h THR 163 Ca -0.07 -1.26 0.00 0.00 0.77 0.00 0.00 66.41 65.85 3iqw h THR 163 Cb 1.50 1.82 -0.00 0.00 -1.74 0.00 0.00 68.15 69.73 3iqw h THR 163 CO 0.16 0.28 -0.01 -0.11 0.37 0.00 0.00 175.52 176.21 3iqw n LEU 164 N -4.87 -0.01 -0.17 2.58 7.94 -0.97 0.15 117.00 121.65 3iqw n LEU 164 Ca -0.08 0.87 -0.02 0.00 -1.11 0.00 0.00 56.01 55.66 3iqw n LEU 164 Cb 0.28 -0.43 -0.01 0.00 0.53 0.00 0.00 43.42 43.80 3iqw n LEU 164 CO 0.28 -0.44 0.24 -1.14 -1.11 0.00 0.00 177.39 175.22 3iqw n ARG 165 N -2.88 -0.14 0.10 1.96 0.63 -1.02 0.17 116.66 115.48 3iqw n ARG 165 Ca 0.00 0.67 -0.12 0.00 -0.92 0.00 0.00 57.85 57.47 3iqw n ARG 165 Cb 0.00 -0.99 -0.05 0.00 0.45 0.00 0.00 32.46 31.87 3iqw n ARG 165 CO 0.00 0.00 0.00 0.35 -2.51 0.00 0.00 177.63 175.47 3iqw h PHE 166 N 0.00 -0.57 -0.74 -0.14 -0.00 -0.46 -1.84 116.94 113.19 3iqw h PHE 166 Ca 0.12 0.01 0.17 0.00 -0.00 0.00 0.00 57.97 58.27 3iqw h PHE 166 Cb 0.23 0.24 -0.12 0.00 -0.00 0.00 0.00 35.95 36.29 3iqw h PHE 166 CO -0.41 -0.31 0.07 -0.07 -0.00 0.00 0.00 178.31 177.60 3iqw h LEU 167 N -0.39 -0.21 -1.24 0.59 -0.00 0.22 1.40 115.31 115.68 3iqw h LEU 167 Ca 0.03 0.18 0.00 0.00 -0.00 0.00 0.00 57.88 58.09 3iqw h LEU 167 Cb 0.42 0.29 0.00 0.00 -0.00 0.00 0.00 40.66 41.37 3iqw h LEU 167 CO -0.13 -0.13 0.23 1.56 -0.00 0.00 0.00 178.44 179.96 3iqw h GLN 168 N 0.16 0.00 0.14 1.13 4.20 0.31 -3.21 115.11 117.83 3iqw h GLN 168 Ca 0.41 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.12 3iqw h GLN 168 Cb 0.73 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.51 3iqw h GLN 168 CO -0.60 0.00 -0.07 0.35 -0.67 0.00 0.00 178.83 177.84 3iqw h PHE 169 N 0.00 -0.17 0.00 2.96 3.57 0.21 -3.32 116.94 120.19 3iqw h PHE 169 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3iqw h PHE 169 Cb 0.45 0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.25 3iqw h PHE 169 CO 0.00 0.29 0.00 -2.30 -2.23 0.00 0.00 178.31 174.07 3iqw n PRO 170 N -4.90 0.00 -0.15 6.41 -0.02 -1.21 0.27 135.00 135.40 3iqw n PRO 170 Ca -0.08 0.41 0.03 0.00 -2.02 0.00 0.00 63.50 61.85 3iqw n PRO 170 Cb 0.27 -1.10 0.07 0.00 -0.02 0.00 0.00 33.50 32.72 3iqw n PRO 170 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3iqw n THR 171 N -1.17 -0.18 0.13 3.45 -2.24 -1.26 -0.70 114.28 112.32 3iqw n THR 171 Ca 0.00 0.97 -0.24 0.00 -2.27 0.00 0.00 64.05 62.51 3iqw n THR 171 Cb 0.00 -1.36 -0.16 0.00 -2.10 0.00 0.00 70.33 66.71 3iqw n THR 171 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 3iqw h VAL 172 N 0.00 1.21 0.00 2.28 2.07 -1.42 -3.54 116.25 116.85 3iqw h VAL 172 Ca 0.22 -2.65 0.00 0.00 0.82 0.00 0.00 66.70 65.09 3iqw h VAL 172 Cb 0.36 2.99 0.00 0.00 -1.52 0.00 0.00 31.29 33.12 3iqw h VAL 172 CO -0.43 0.82 0.00 -0.11 0.02 0.00 0.00 177.57 177.86 3iqw n LEU 173 N -3.71 0.00 0.00 2.57 0.00 0.14 -5.11 117.00 110.89 3iqw n LEU 173 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.82 3iqw n LEU 173 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 43.42 44.51 3iqw n LEU 173 CO 0.58 0.00 0.00 -0.90 0.00 0.00 0.00 177.39 177.07 3iqw n ASP 209 N 0.00 0.00 -0.04 1.96 5.68 -1.26 -5.12 116.55 117.77 3iqw n ASP 209 Ca 0.00 0.00 -0.06 0.00 -0.50 0.00 0.00 54.79 54.23 3iqw n ASP 209 Cb 0.00 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 39.95 3iqw n ASP 209 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 3iqw n VAL 210 N -0.26 0.42 -0.45 2.12 0.24 -1.26 -4.58 118.33 114.56 3iqw n VAL 210 Ca 0.00 -0.14 0.38 0.00 -2.04 0.00 0.00 64.34 62.54 3iqw n VAL 210 Cb 0.00 -1.09 0.69 0.00 -1.47 0.00 0.00 33.84 31.96 3iqw n VAL 210 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3iqw h MET 211 N -0.11 0.10 0.00 7.34 -0.00 -2.06 1.49 114.93 121.69 3iqw h MET 211 Ca -0.17 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.52 3iqw h MET 211 Cb 1.22 -0.02 0.00 0.00 -0.00 0.00 0.00 31.60 32.80 3iqw h MET 211 CO -0.06 0.06 0.45 -1.91 -0.00 0.00 0.00 176.91 175.45 3iqw n GLU 212 N -4.42 0.02 -0.12 -0.10 2.13 -1.26 0.50 120.64 117.40 3iqw n GLU 212 Ca 0.34 0.31 -0.21 0.00 0.66 0.00 0.00 57.16 58.26 3iqw n GLU 212 Cb 1.43 -2.02 -0.12 0.00 0.27 0.00 0.00 31.44 31.00 3iqw n GLU 212 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 3iqw n LYS 213 N -1.48 0.64 -0.29 5.31 4.81 0.51 -2.39 118.16 125.28 3iqw n LYS 213 Ca -0.00 0.20 -0.08 0.00 -0.87 0.00 0.00 58.31 57.56 3iqw n LYS 213 Cb 0.45 -1.54 -0.07 0.00 0.02 0.00 0.00 35.03 33.89 3iqw n LYS 213 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 3iqw n LEU 214 N -3.55 -0.73 0.25 3.14 7.94 0.18 -0.77 117.00 123.46 3iqw n LEU 214 Ca -0.46 1.40 -0.15 0.00 -1.11 0.00 0.00 56.01 55.69 3iqw n LEU 214 Cb 0.96 -0.24 -0.08 0.00 0.53 0.00 0.00 43.42 44.59 3iqw n LEU 214 CO 0.22 -1.09 0.52 -0.78 -1.11 0.00 0.00 177.39 175.15 3iqw h ASP 215 N 0.00 -1.11 0.00 1.96 1.82 -1.53 -1.84 116.42 115.71 3iqw h ASP 215 Ca 0.11 0.09 0.00 0.00 -0.39 0.00 0.00 57.03 56.84 3iqw h ASP 215 Cb 0.28 0.36 0.00 0.00 0.68 0.00 0.00 39.33 40.65 3iqw h ASP 215 CO -0.65 -0.55 0.26 -1.54 -1.61 0.00 0.00 179.24 175.15 3iqw n SER 216 N -4.89 0.00 -0.03 2.28 3.41 -0.51 -0.41 113.62 113.46 3iqw n SER 216 Ca -0.10 0.15 -0.02 0.00 -0.26 0.00 0.00 58.87 58.64 3iqw n SER 216 Cb 0.38 -0.15 -0.01 0.00 -0.26 0.00 0.00 64.21 64.17 3iqw n SER 216 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3iqw h LEU 217 N 0.00 0.00 -1.13 1.04 5.85 -0.08 -3.22 115.31 117.77 3iqw h LEU 217 Ca 0.00 0.00 0.36 0.00 0.84 0.00 0.00 57.88 59.08 3iqw h LEU 217 Cb 0.52 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.40 3iqw h LEU 217 CO 0.00 0.33 0.64 -0.09 -0.34 0.00 0.00 178.44 178.98 3iqw h ARG 218 N -0.45 0.21 0.03 1.25 9.65 -0.57 0.95 114.38 125.46 3iqw h ARG 218 Ca 0.00 -0.01 0.01 0.00 -1.10 0.00 0.00 59.98 58.88 3iqw h ARG 218 Cb 0.20 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.72 3iqw h ARG 218 CO 0.00 0.14 -0.11 0.28 2.80 0.00 0.00 179.97 183.09 3iqw h VAL 219 N 0.22 0.74 0.00 0.20 2.07 -1.56 0.83 116.25 118.76 3iqw h VAL 219 Ca 0.76 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.28 3iqw h VAL 219 Cb 1.97 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 3iqw h VAL 219 CO -0.56 0.00 0.00 0.71 0.02 0.00 0.00 177.57 177.74 3iqw h THR 220 N -0.20 0.00 0.07 2.57 1.35 0.85 -2.18 112.91 115.38 3iqw h THR 220 Ca 0.03 -0.40 -0.26 0.00 -0.55 0.00 0.00 66.41 65.23 3iqw h THR 220 Cb 0.23 1.30 0.01 0.00 -1.73 0.00 0.00 68.15 67.96 3iqw h THR 220 CO -0.08 0.00 -1.12 0.40 -0.25 0.00 0.00 175.52 174.47 3iqw h ILE 221 N 0.00 1.39 -0.21 6.82 2.04 -0.37 -2.57 117.51 124.61 3iqw h ILE 221 Ca 0.00 -2.62 0.06 0.00 1.00 0.00 0.00 64.86 63.30 3iqw h ILE 221 Cb 0.59 2.65 -0.07 0.00 -0.74 0.00 0.00 36.82 39.25 3iqw h ILE 221 CO 0.00 0.78 -0.26 0.28 0.00 0.00 0.00 178.15 178.95 3iqw h SER 222 N 0.20 -0.82 -0.85 1.72 0.02 -0.25 -0.20 113.55 113.38 3iqw h SER 222 Ca -0.13 0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 60.93 3iqw h SER 222 Cb 1.79 0.37 -0.04 0.00 0.14 0.00 0.00 62.40 64.66 3iqw h SER 222 CO 0.20 -0.30 0.41 -0.33 -1.14 0.00 0.00 176.83 175.67 3iqw h GLU 223 N -0.28 1.23 0.65 3.45 5.08 -1.49 0.95 114.58 124.17 3iqw h GLU 223 Ca 0.12 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 3iqw h GLU 223 Cb 0.48 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.51 3iqw h GLU 223 CO -0.37 0.94 -0.31 0.28 -1.00 0.00 0.00 179.01 178.55 3iqw h VAL 224 N 1.22 0.26 -0.50 3.13 2.07 -1.09 -2.20 116.25 119.14 3iqw h VAL 224 Ca 0.29 -0.22 0.08 0.00 0.82 0.00 0.00 66.70 67.68 3iqw h VAL 224 Cb 0.12 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.19 3iqw h VAL 224 CO -0.04 0.02 0.34 -1.13 0.02 0.00 0.00 177.57 176.79 3iqw h ASN 225 N -1.04 0.30 -0.33 0.57 -1.24 -0.81 0.31 115.58 113.33 3iqw h ASN 225 Ca -0.09 0.00 0.03 0.00 0.71 0.00 0.00 56.30 56.95 3iqw h ASN 225 Cb 0.71 -0.06 -0.03 0.00 0.73 0.00 0.00 38.32 39.67 3iqw h ASN 225 CO 0.15 0.19 0.16 0.00 -1.29 0.00 0.00 177.43 176.63 3iqw h ALA 226 N 1.74 0.40 -0.04 1.57 0.00 -0.65 -2.83 119.26 119.45 3iqw h ALA 226 Ca 0.23 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 55.01 3iqw h ALA 226 Cb 0.46 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3iqw h ALA 226 CO -0.05 -0.22 -0.63 1.96 0.00 0.00 0.00 179.25 180.31 3iqw h GLN 227 N 0.33 0.16 0.00 0.00 4.20 0.21 -2.08 115.11 117.93 3iqw h GLN 227 Ca 0.14 -0.12 -0.06 0.00 0.06 0.00 0.00 58.65 58.67 3iqw h GLN 227 Cb 0.06 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 3iqw h GLN 227 CO -0.11 0.74 -0.28 0.74 -0.67 0.00 0.00 178.83 179.25 3iqw h PHE 228 N 0.12 0.00 -0.01 2.96 0.04 -1.18 -2.97 116.94 115.89 3iqw h PHE 228 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 3iqw h PHE 228 Cb 1.13 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.28 3iqw h PHE 228 CO 0.02 0.28 -0.16 1.63 -0.60 0.00 0.00 178.31 179.48 3iqw n LYS 229 N -4.07 1.37 -3.36 1.51 5.02 -0.81 -4.45 118.16 113.36 3iqw n LYS 229 Ca -0.02 -0.91 -0.42 0.00 -2.02 0.00 0.00 58.31 54.94 3iqw n LYS 229 Cb 0.34 -1.48 -0.09 0.00 -0.02 0.00 0.00 35.03 33.78 3iqw n LYS 229 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3iqw s ASP 230 N -2.26 6.19 0.00 4.39 -1.08 -1.02 -4.90 116.67 118.00 3iqw s ASP 230 Ca 0.29 -0.37 0.22 0.00 -0.52 0.00 0.00 52.55 52.17 3iqw s ASP 230 Cb 0.20 -2.21 1.10 0.00 -1.46 0.00 0.00 42.92 40.54 3iqw s ASP 230 CO 0.43 -0.43 1.73 -1.84 0.52 0.00 0.00 175.17 175.58 3iqw n GLU 231 N 5.48 0.25 0.15 4.34 0.28 -1.26 -1.21 120.64 128.67 3iqw n GLU 231 Ca -0.08 0.08 0.12 0.00 -0.16 0.00 0.00 57.16 57.12 3iqw n GLU 231 Cb 0.49 -1.50 0.20 0.00 1.43 0.00 0.00 31.44 32.06 3iqw n GLU 231 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3iqw h ARG 232 N 0.00 0.00 0.00 3.44 3.08 -1.93 -3.37 114.38 115.60 3iqw h ARG 232 Ca 0.00 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.80 3iqw h ARG 232 Cb 0.25 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.25 3iqw h ARG 232 CO 0.00 0.00 -1.94 1.28 -1.07 0.00 0.00 179.97 178.24 3iqw n LEU 233 N -2.66 0.00 -3.96 3.04 4.77 -0.35 -2.49 117.00 115.34 3iqw n LEU 233 Ca 0.04 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.84 3iqw n LEU 233 Cb 0.49 0.34 -0.15 0.00 -2.33 0.00 0.00 43.42 41.77 3iqw n LEU 233 CO 0.34 0.34 -0.42 -0.89 -1.33 0.00 0.00 177.39 175.43 3iqw s THR 234 N -2.34 0.57 0.13 -5.08 2.01 -0.83 -0.35 115.64 109.75 3iqw s THR 234 Ca -0.07 -0.26 -0.02 0.00 0.31 0.00 0.00 61.69 61.65 3iqw s THR 234 Cb 0.04 -0.51 -0.03 0.00 0.01 0.00 0.00 72.50 72.01 3iqw s THR 234 CO 0.56 0.18 0.09 -0.89 -0.69 0.00 0.00 174.62 173.87 3iqw s THR 235 N 0.15 0.10 0.01 -0.82 2.01 -0.94 -4.35 115.64 111.80 3iqw s THR 235 Ca -0.02 -1.82 0.04 0.00 0.31 0.00 0.00 61.69 60.20 3iqw s THR 235 Cb -0.06 -1.98 -0.03 0.00 0.01 0.00 0.00 72.50 70.43 3iqw s THR 235 CO -0.00 -0.47 -0.07 -0.36 -0.69 0.00 0.00 174.62 173.03 3iqw s PHE 236 N -4.03 2.86 -0.19 4.92 2.99 -0.63 -1.82 117.98 122.08 3iqw s PHE 236 Ca 0.22 -0.06 -0.06 0.00 0.00 0.00 0.00 56.93 57.03 3iqw s PHE 236 Cb 0.07 -1.59 -0.03 0.00 0.00 0.00 0.00 43.02 41.47 3iqw s PHE 236 CO 0.01 0.37 0.03 0.08 -0.00 0.00 0.00 175.22 175.71 3iqw s VAL 237 N -1.01 4.32 -0.22 -0.44 1.01 0.34 -3.92 120.40 120.48 3iqw s VAL 237 Ca 0.17 -0.19 -0.12 0.00 0.00 0.00 0.00 61.98 61.84 3iqw s VAL 237 Cb -0.11 -2.95 -0.05 0.00 0.00 0.00 0.00 36.38 33.27 3iqw s VAL 237 CO 0.08 0.44 0.25 0.00 0.00 0.00 0.00 175.10 175.86 3iqw s VAL 239 N 1.08 4.75 0.23 0.00 1.01 0.30 0.04 120.40 127.82 3iqw s VAL 239 Ca 0.12 -0.08 -0.18 0.00 0.00 0.00 0.00 61.98 61.84 3iqw s VAL 239 Cb -0.14 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.23 3iqw s VAL 239 CO 0.05 0.61 0.58 0.00 0.00 0.00 0.00 175.10 176.34 3iqw s ILE 241 N -3.92 1.91 -1.17 0.00 -4.36 -1.26 -0.08 121.20 112.32 3iqw s ILE 241 Ca 0.13 -1.78 -0.05 0.00 -0.26 0.00 0.00 60.65 58.69 3iqw s ILE 241 Cb -0.02 -2.69 0.13 0.00 1.25 0.00 0.00 42.46 41.13 3iqw s ILE 241 CO 0.03 0.00 2.39 -0.81 0.24 0.00 0.00 174.94 176.79 3iqw n PRO 242 N -1.28 4.34 -4.55 0.37 -0.04 -1.26 -4.29 135.00 128.29 3iqw n PRO 242 Ca -0.06 -3.40 -0.25 0.00 -0.04 0.00 0.00 63.50 59.74 3iqw n PRO 242 Cb 0.65 -2.54 -0.11 0.00 -0.04 0.00 0.00 33.50 31.46 3iqw n PRO 242 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 3iqw s GLU 243 N -1.54 1.82 0.07 0.54 4.04 -1.26 -4.65 118.70 117.72 3iqw s GLU 243 Ca 0.54 -1.99 -0.34 0.00 0.04 0.00 0.00 54.97 53.21 3iqw s GLU 243 Cb 0.22 -1.45 -0.17 0.00 0.02 0.00 0.00 34.13 32.75 3iqw s GLU 243 CO -0.12 -0.02 1.52 0.35 -1.84 0.00 0.00 175.26 175.15 3iqw h PHE 244 N 1.96 -1.29 -0.20 4.83 3.57 -2.01 -2.55 116.94 121.26 3iqw h PHE 244 Ca -0.42 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.11 3iqw h PHE 244 Cb 1.24 0.48 -0.01 0.00 2.79 0.00 0.00 35.95 40.46 3iqw h PHE 244 CO 0.70 -0.65 0.14 -0.07 -2.23 0.00 0.00 178.31 176.20 3iqw h LEU 245 N -1.02 0.12 -0.01 0.59 3.38 -1.98 -2.10 115.31 114.29 3iqw h LEU 245 Ca -0.08 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 3iqw h LEU 245 Cb 0.86 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.58 3iqw h LEU 245 CO 0.00 0.08 -0.05 -1.28 0.09 0.00 0.00 178.44 177.28 3iqw h SER 246 N 0.13 0.07 -0.36 -0.43 0.87 -1.78 -2.24 113.55 109.81 3iqw h SER 246 Ca 0.09 -0.65 0.00 0.00 -1.23 0.00 0.00 61.79 60.00 3iqw h SER 246 Cb 0.18 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.10 3iqw h SER 246 CO -0.01 0.70 0.23 -0.07 -0.53 0.00 0.00 176.83 177.16 3iqw h LEU 247 N -0.56 0.42 -0.55 2.23 3.38 -1.09 -1.43 115.31 117.70 3iqw h LEU 247 Ca -0.00 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 3iqw h LEU 247 Cb 0.70 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 3iqw h LEU 247 CO 0.01 0.31 -0.52 0.22 0.09 0.00 0.00 178.44 178.55 3iqw h TYR 248 N 0.49 0.70 -0.27 1.13 -0.00 -1.26 -0.21 116.97 117.54 3iqw h TYR 248 Ca 0.13 -0.24 -0.18 0.00 -0.00 0.00 0.00 58.73 58.44 3iqw h TYR 248 Cb -0.05 -0.14 0.00 0.00 -0.00 0.00 0.00 36.73 36.55 3iqw h TYR 248 CO 0.00 0.96 -0.54 1.49 -0.00 0.00 0.00 178.16 180.07 3iqw h GLU 249 N 0.44 0.84 -1.00 1.82 4.81 -0.82 -2.46 114.58 118.22 3iqw h GLU 249 Ca 0.02 -0.55 0.09 0.00 -0.13 0.00 0.00 59.36 58.79 3iqw h GLU 249 Cb 1.05 0.07 -0.08 0.00 0.63 0.00 0.00 28.75 30.43 3iqw h GLU 249 CO 0.10 1.18 0.64 1.15 -0.73 0.00 0.00 179.01 181.34 3iqw h THR 250 N 0.62 1.00 -0.14 0.32 2.02 -1.01 0.18 112.91 115.89 3iqw h THR 250 Ca 0.01 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 66.82 3iqw h THR 250 Cb 1.15 -0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 3iqw h THR 250 CO 0.12 0.20 0.09 -0.33 0.37 0.00 0.00 175.52 175.97 3iqw h GLU 251 N 1.08 0.19 -0.65 6.66 5.08 -0.87 -1.58 114.58 124.48 3iqw h GLU 251 Ca 0.47 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.78 3iqw h GLU 251 Cb 0.34 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 3iqw h GLU 251 CO -0.22 0.12 0.28 -0.09 -1.00 0.00 0.00 179.01 178.11 3iqw h ARG 252 N 0.19 0.94 0.18 2.33 2.43 -0.56 -2.05 114.38 117.84 3iqw h ARG 252 Ca 0.05 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 3iqw h ARG 252 Cb -0.02 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.36 3iqw h ARG 252 CO -0.01 0.75 -0.08 1.98 -1.51 0.00 0.00 179.97 181.10 3iqw h MET 253 N 0.93 -0.23 -0.89 0.20 4.05 -0.50 0.18 114.93 118.67 3iqw h MET 253 Ca 0.22 0.02 0.22 0.00 -0.28 0.00 0.00 59.70 59.88 3iqw h MET 253 Cb 0.14 0.05 -0.12 0.00 -0.80 0.00 0.00 31.60 30.87 3iqw h MET 253 CO -0.02 0.13 0.39 0.82 0.23 0.00 0.00 176.91 178.45 3iqw h ILE 254 N -0.64 0.47 -0.32 1.77 2.04 -1.01 0.28 117.51 120.12 3iqw h ILE 254 Ca -0.02 -0.14 -0.12 0.00 1.00 0.00 0.00 64.86 65.58 3iqw h ILE 254 Cb 0.47 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 3iqw h ILE 254 CO 0.04 0.07 -0.31 -0.61 0.00 0.00 0.00 178.15 177.34 3iqw h GLN 255 N 0.40 0.68 0.20 2.37 5.75 -1.16 -2.14 115.11 121.20 3iqw h GLN 255 Ca 0.56 -0.31 -0.01 0.00 -0.15 0.00 0.00 58.65 58.74 3iqw h GLN 255 Cb 1.05 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.59 3iqw h GLN 255 CO -0.53 0.90 -0.09 0.93 -2.65 0.00 0.00 178.83 177.39 3iqw h GLU 256 N 0.58 -0.26 -0.80 1.69 4.39 0.12 -1.98 114.58 118.33 3iqw h GLU 256 Ca 0.07 0.02 0.10 0.00 0.34 0.00 0.00 59.36 59.88 3iqw h GLU 256 Cb 0.82 0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 29.47 3iqw h GLU 256 CO 0.07 0.05 0.52 -0.07 -1.16 0.00 0.00 179.01 178.42 3iqw h LEU 257 N -0.57 0.66 -0.03 1.33 3.38 -0.50 0.90 115.31 120.48 3iqw h LEU 257 Ca -0.03 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3iqw h LEU 257 Cb 0.42 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 3iqw h LEU 257 CO 0.04 0.39 0.01 0.00 0.09 0.00 0.00 178.44 178.98 3iqw h ALA 258 N 1.60 0.04 -0.77 1.53 0.00 -1.30 0.43 119.26 120.78 3iqw h ALA 258 Ca 0.37 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.24 3iqw h ALA 258 Cb 0.45 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 3iqw h ALA 258 CO -0.14 -0.41 0.51 -0.91 0.00 0.00 0.00 179.25 178.30 3iqw h ASN 259 N -0.07 0.85 0.37 0.00 2.35 -0.11 0.21 115.58 119.19 3iqw h ASN 259 Ca 0.01 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3iqw h ASN 259 Cb 0.11 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.27 3iqw h ASN 259 CO -0.00 0.61 -0.04 -1.22 -1.65 0.00 0.00 177.43 175.12 3iqw n TYR 260 N -4.43 0.00 -2.50 1.19 4.01 -0.14 -4.92 117.16 110.37 3iqw n TYR 260 Ca 0.09 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.68 3iqw n TYR 260 Cb 0.07 -0.19 0.01 0.00 -0.31 0.00 0.00 39.34 38.92 3iqw n TYR 260 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3iqw n GLY 261 N 1.23 -0.22 3.80 2.72 0.00 0.75 -4.92 105.19 108.56 3iqw n GLY 261 Ca 0.16 -0.20 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 3iqw n GLY 261 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3iqw s ILE 262 N -2.85 5.34 0.27 -0.61 1.01 0.13 -4.55 121.20 119.94 3iqw s ILE 262 Ca 0.09 0.43 -0.30 0.00 0.00 0.00 0.00 60.65 60.87 3iqw s ILE 262 Cb -0.04 -3.54 -0.09 0.00 0.01 0.00 0.00 42.46 38.80 3iqw s ILE 262 CO 0.11 0.52 1.06 -0.62 0.00 0.00 0.00 174.94 176.01 3iqw s ASP 263 N -0.40 7.36 -0.18 3.58 -1.08 -1.26 -4.21 116.67 120.48 3iqw s ASP 263 Ca 0.16 2.19 -0.15 0.00 -0.52 0.00 0.00 52.55 54.24 3iqw s ASP 263 Cb -0.13 -2.62 0.05 0.00 -1.46 0.00 0.00 42.92 38.76 3iqw s ASP 263 CO 0.05 -0.07 0.46 0.28 0.52 0.00 0.00 175.17 176.41 3iqw s THR 264 N -1.15 -0.00 0.00 1.71 -1.32 -1.26 -1.61 115.64 112.00 3iqw s THR 264 Ca 0.44 0.02 0.01 0.00 -1.21 0.00 0.00 61.69 60.95 3iqw s THR 264 Cb -0.31 -0.66 0.02 0.00 -1.51 0.00 0.00 72.50 70.05 3iqw s THR 264 CO 0.39 0.01 0.75 0.00 -2.21 0.00 0.00 174.62 173.56 3iqw n HIS 265 N 3.13 0.00 -3.90 9.09 1.44 -1.25 -4.97 115.22 118.75 3iqw n HIS 265 Ca -0.15 -0.21 -0.19 0.00 -2.01 0.00 0.00 57.72 55.16 3iqw n HIS 265 Cb 0.57 0.30 -0.17 0.00 0.12 0.00 0.00 29.99 30.81 3iqw n HIS 265 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3iqw s ILE 267 N 1.30 3.24 -0.32 0.00 1.01 0.10 -1.56 121.20 124.98 3iqw s ILE 267 Ca -0.06 -0.60 -0.09 0.00 0.00 0.00 0.00 60.65 59.89 3iqw s ILE 267 Cb -0.13 -2.36 0.00 0.00 0.01 0.00 0.00 42.46 39.98 3iqw s ILE 267 CO -0.02 0.53 0.15 -0.69 0.00 0.00 0.00 174.94 174.91 3iqw s VAL 268 N 0.16 4.49 -0.41 2.92 1.01 0.11 -0.46 120.40 128.21 3iqw s VAL 268 Ca -0.06 -0.57 -0.16 0.00 0.00 0.00 0.00 61.98 61.19 3iqw s VAL 268 Cb -0.15 -3.35 0.02 0.00 0.00 0.00 0.00 36.38 32.91 3iqw s VAL 268 CO 0.04 -0.00 0.39 -0.69 0.00 0.00 0.00 175.10 174.84 3iqw s VAL 269 N 1.58 5.15 0.35 2.92 1.01 -0.38 -1.51 120.40 129.51 3iqw s VAL 269 Ca 0.04 -0.43 0.07 0.00 0.00 0.00 0.00 61.98 61.66 3iqw s VAL 269 Cb -0.18 -3.99 -0.01 0.00 0.00 0.00 0.00 36.38 32.20 3iqw s VAL 269 CO 0.06 -0.37 0.44 0.21 0.00 0.00 0.00 175.10 175.43 3iqw s ASN 270 N 1.77 5.70 -1.45 3.32 2.47 0.89 -1.12 114.94 126.51 3iqw s ASN 270 Ca 0.10 -0.33 -0.09 0.00 0.42 0.00 0.00 52.86 52.95 3iqw s ASN 270 Cb -0.18 -1.04 0.03 0.00 -1.45 0.00 0.00 41.25 38.62 3iqw s ASN 270 CO 0.12 -0.48 0.94 0.00 -3.72 0.00 0.00 177.10 173.96 3iqw n GLN 271 N -1.60 -6.25 -2.50 0.43 6.02 -1.11 -4.33 117.38 108.03 3iqw n GLN 271 Ca 0.01 0.77 -0.42 0.00 -0.01 0.00 0.00 57.00 57.34 3iqw n GLN 271 Cb 0.59 -5.71 -0.03 0.00 1.02 0.00 0.00 30.24 26.11 3iqw n GLN 271 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3iqw s LEU 272 N -7.09 4.27 -0.39 1.08 1.43 -0.82 -4.40 118.68 112.76 3iqw s LEU 272 Ca 0.52 1.76 -0.27 0.00 -1.03 0.00 0.00 54.13 55.11 3iqw s LEU 272 Cb -0.24 -3.56 0.02 0.00 0.03 0.00 0.00 46.19 42.44 3iqw s LEU 272 CO 0.64 -0.56 0.97 -0.22 0.23 0.00 0.00 176.35 177.42 3iqw s LEU 273 N 2.20 3.94 -0.44 1.79 1.98 -1.26 -0.76 118.68 126.13 3iqw s LEU 273 Ca 0.54 0.58 -0.12 0.00 -2.89 0.00 0.00 54.13 52.25 3iqw s LEU 273 Cb -0.23 -3.33 0.08 0.00 0.66 0.00 0.00 46.19 43.37 3iqw s LEU 273 CO 0.21 -0.93 0.31 -0.36 -1.89 0.00 0.00 176.35 173.69 3iqw s PHE 274 N 3.66 3.31 0.70 5.38 0.08 -1.26 -4.63 117.98 125.21 3iqw s PHE 274 Ca 0.40 -1.32 -0.16 0.00 0.12 0.00 0.00 56.93 55.97 3iqw s PHE 274 Cb -0.11 -3.07 -0.01 0.00 -0.57 0.00 0.00 43.02 39.26 3iqw s PHE 274 CO 0.21 -0.84 0.90 -2.30 -0.10 0.00 0.00 175.22 173.09 3iqw n PRO 275 N 5.02 0.53 -2.48 0.24 -0.02 -1.26 -4.92 135.00 132.11 3iqw n PRO 275 Ca -0.11 0.23 -0.41 0.00 -2.02 0.00 0.00 63.50 61.20 3iqw n PRO 275 Cb 0.43 -2.15 -0.04 0.00 -0.02 0.00 0.00 33.50 31.72 3iqw n PRO 275 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3iqw s LYS 276 N -3.16 4.62 0.18 -0.52 1.02 -1.26 -4.96 119.74 115.65 3iqw s LYS 276 Ca 0.73 1.78 -0.31 0.00 0.02 0.00 0.00 55.97 58.18 3iqw s LYS 276 Cb -0.36 -3.22 -0.10 0.00 -0.52 0.00 0.00 37.83 33.63 3iqw s LYS 276 CO 0.51 0.15 1.51 -1.25 -0.92 0.00 0.00 175.35 175.34 3iqw s PRO 277 N -0.97 4.24 0.00 -1.68 0.04 -1.26 -1.04 135.00 134.33 3iqw s PRO 277 Ca 0.47 2.31 0.00 0.00 0.04 0.00 0.00 61.00 63.82 3iqw s PRO 277 Cb -0.31 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.08 3iqw s PRO 277 CO 0.38 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 177.30 3iqw n GLY 278 N 3.24 2.86 3.63 0.56 0.00 -1.26 -4.99 105.19 109.24 3iqw n GLY 278 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 3iqw n GLY 278 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3iqw s SER 279 N -1.70 6.87 -0.24 1.61 0.01 -0.21 -5.01 113.70 115.03 3iqw s SER 279 Ca 0.00 0.94 -0.10 0.00 1.31 0.00 0.00 55.95 58.10 3iqw s SER 279 Cb 0.00 -2.52 -0.05 0.00 0.21 0.00 0.00 66.02 63.66 3iqw s SER 279 CO 0.00 -0.87 0.15 1.51 0.41 0.00 0.00 173.24 174.44 3iqw s ASP 280 N 1.71 6.02 -0.04 2.44 1.47 -1.26 -4.74 116.67 122.27 3iqw s ASP 280 Ca 0.43 0.08 -0.00 0.00 1.18 0.00 0.00 52.55 54.24 3iqw s ASP 280 Cb -0.12 -2.09 0.03 0.00 -0.34 0.00 0.00 42.92 40.40 3iqw s ASP 280 CO 0.16 0.06 0.02 0.00 0.68 0.00 0.00 175.17 176.08 3iqw n GLU 282 N 4.51 0.00 0.22 0.00 -0.58 -1.26 -0.39 120.64 123.14 3iqw n GLU 282 Ca -0.19 0.82 -0.10 0.00 -0.42 0.00 0.00 57.16 57.26 3iqw n GLU 282 Cb 0.50 -1.37 -0.05 0.00 -0.57 0.00 0.00 31.44 29.95 3iqw n GLU 282 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 3iqw h GLN 283 N 0.00 -0.59 -0.96 3.49 4.20 -1.98 0.15 115.11 119.43 3iqw h GLN 283 Ca 0.00 0.04 0.16 0.00 0.06 0.00 0.00 58.65 58.91 3iqw h GLN 283 Cb 0.00 0.13 -0.16 0.00 0.30 0.00 0.00 27.48 27.75 3iqw h GLN 283 CO 0.00 -0.39 -0.32 0.00 -0.67 0.00 0.00 178.83 177.44 3iqw h THR 285 N 0.00 0.00 -0.97 0.00 2.02 0.19 -2.17 112.91 111.97 3iqw h THR 285 Ca 0.38 -0.04 0.24 0.00 0.77 0.00 0.00 66.41 67.76 3iqw h THR 285 Cb 0.62 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.96 3iqw h THR 285 CO -0.96 0.00 0.65 0.00 0.37 0.00 0.00 175.52 175.57 3iqw h ALA 286 N -1.37 2.32 -0.00 6.16 0.00 0.13 0.35 119.26 126.86 3iqw h ALA 286 Ca -0.13 0.03 -0.25 0.00 0.00 0.00 0.00 54.91 54.56 3iqw h ALA 286 Cb 0.99 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.80 3iqw h ALA 286 CO 0.22 -0.65 -1.00 -0.09 0.00 0.00 0.00 179.25 177.73 3iqw h ARG 287 N 0.35 0.57 0.00 0.00 2.43 0.00 -1.65 114.38 116.08 3iqw h ARG 287 Ca 0.52 -0.62 -0.05 0.00 -0.81 0.00 0.00 59.98 59.02 3iqw h ARG 287 Cb 1.41 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 31.12 3iqw h ARG 287 CO -0.20 1.23 -0.26 -0.09 -1.51 0.00 0.00 179.97 179.14 3iqw h ARG 288 N 0.32 0.00 0.09 0.20 1.12 -0.56 -2.43 114.38 113.12 3iqw h ARG 288 Ca -0.11 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.76 3iqw h ARG 288 Cb 1.64 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.60 3iqw h ARG 288 CO 0.19 0.26 -0.04 -0.09 -3.11 0.00 0.00 179.97 177.18 3iqw h ARG 289 N 0.00 -0.11 -0.16 0.20 2.43 -0.11 -1.54 114.38 115.10 3iqw h ARG 289 Ca -0.00 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.13 3iqw h ARG 289 Cb 0.56 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.13 3iqw h ARG 289 CO 0.03 0.08 -0.08 0.00 -1.51 0.00 0.00 179.97 178.50 3iqw h MET 290 N -0.29 0.33 -0.94 0.20 -0.00 -1.13 -2.61 114.93 110.49 3iqw h MET 290 Ca -0.01 -0.15 0.13 0.00 -0.00 0.00 0.00 59.70 59.67 3iqw h MET 290 Cb 0.25 -0.01 -0.08 0.00 -0.00 0.00 0.00 31.60 31.76 3iqw h MET 290 CO 0.02 0.65 0.60 1.96 -0.00 0.00 0.00 176.91 180.14 3iqw h GLN 291 N -0.00 0.82 -0.26 -0.10 4.20 -1.51 -2.70 115.11 115.57 3iqw h GLN 291 Ca 0.03 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.58 3iqw h GLN 291 Cb 0.56 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 3iqw h GLN 291 CO 0.02 0.54 -0.32 -0.22 -0.67 0.00 0.00 178.83 178.19 3iqw h LYS 292 N 0.85 0.54 0.00 1.46 3.11 -0.91 0.83 116.57 122.44 3iqw h LYS 292 Ca 0.46 -0.23 -0.01 0.00 -2.81 0.00 0.00 60.65 58.06 3iqw h LYS 292 Cb 0.57 -0.02 -0.00 0.00 -1.00 0.00 0.00 32.23 31.79 3iqw h LYS 292 CO -0.23 0.79 -0.04 -0.22 -2.81 0.00 0.00 179.45 176.94 3iqw h LYS 293 N 0.46 0.00 0.13 1.90 3.64 -1.18 -0.98 116.57 120.53 3iqw h LYS 293 Ca 0.05 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 3iqw h LYS 293 Cb 0.78 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 3iqw h LYS 293 CO 0.06 0.04 -0.06 1.88 -2.27 0.00 0.00 179.45 179.10 3iqw h TYR 294 N 0.00 -0.16 -0.71 1.91 0.05 -0.77 -3.30 116.97 113.99 3iqw h TYR 294 Ca -0.00 -0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.84 3iqw h TYR 294 Cb 0.09 0.05 -0.09 0.00 1.01 0.00 0.00 36.73 37.79 3iqw h TYR 294 CO 0.00 -0.10 -0.42 1.28 -1.05 0.00 0.00 178.16 177.87 3iqw n LEU 295 N -4.74 -0.76 -0.34 3.88 4.77 -0.24 -0.23 117.00 119.35 3iqw n LEU 295 Ca -0.02 1.33 0.03 0.00 -0.03 0.00 0.00 56.01 57.32 3iqw n LEU 295 Cb 0.07 -0.19 0.09 0.00 -2.33 0.00 0.00 43.42 41.06 3iqw n LEU 295 CO 0.05 -1.07 0.58 0.47 -1.33 0.00 0.00 177.39 176.09 3iqw n ASP 296 N -4.80 -0.43 -0.08 -1.43 9.92 -0.38 -0.50 116.55 118.85 3iqw n ASP 296 Ca 0.01 1.59 -0.10 0.00 -0.53 0.00 0.00 54.79 55.76 3iqw n ASP 296 Cb 0.19 -0.43 -0.04 0.00 -0.64 0.00 0.00 41.12 40.19 3iqw n ASP 296 CO 0.00 0.00 0.00 1.56 0.13 0.00 0.00 177.20 178.89 3iqw h GLN 297 N 0.00 0.38 -0.61 -1.24 4.20 -0.68 -0.54 115.11 116.62 3iqw h GLN 297 Ca 0.39 -0.08 0.10 0.00 0.06 0.00 0.00 58.65 59.12 3iqw h GLN 297 Cb 0.62 -0.06 -0.08 0.00 0.30 0.00 0.00 27.48 28.27 3iqw h GLN 297 CO -0.93 0.46 0.20 0.82 -0.67 0.00 0.00 178.83 178.71 3iqw h ILE 298 N 0.23 0.73 -0.03 2.54 2.04 0.16 -1.70 117.51 121.47 3iqw h ILE 298 Ca 0.08 -0.13 -0.16 0.00 1.00 0.00 0.00 64.86 65.65 3iqw h ILE 298 Cb 0.23 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 3iqw h ILE 298 CO -0.00 0.07 -0.70 -0.33 0.00 0.00 0.00 178.15 177.18 3iqw h GLU 299 N 0.37 0.18 0.00 2.37 5.08 -0.66 -1.77 114.58 120.15 3iqw h GLU 299 Ca 0.31 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 3iqw h GLU 299 Cb 0.42 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.70 3iqw h GLU 299 CO -0.34 0.81 0.00 1.49 -1.00 0.00 0.00 179.01 179.97 3iqw h GLU 300 N 0.12 0.00 0.00 2.33 4.22 -0.24 0.18 114.58 121.19 3iqw h GLU 300 Ca -0.02 0.00 -0.29 0.00 0.08 0.00 0.00 59.36 59.14 3iqw h GLU 300 Cb 1.25 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.44 3iqw h GLU 300 CO 0.11 0.00 -2.11 1.28 -2.18 0.00 0.00 179.01 176.10 3iqw n LEU 301 N -2.95 0.00 0.00 1.64 4.77 -0.74 -4.65 117.00 115.06 3iqw n LEU 301 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 3iqw n LEU 301 Cb 0.19 0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 3iqw n LEU 301 CO 0.23 0.39 0.00 -1.22 -1.33 0.00 0.00 177.39 175.45 3iqw n TYR 302 N -2.59 0.00 -0.09 -1.77 4.01 -0.70 -4.79 117.16 111.23 3iqw n TYR 302 Ca -0.26 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.49 3iqw n TYR 302 Cb 1.01 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 40.06 3iqw n TYR 302 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3iqw n ASP 303 N -0.66 -0.11 0.02 7.72 2.03 0.05 0.16 116.55 125.76 3iqw n ASP 303 Ca 0.00 0.42 0.11 0.00 0.52 0.00 0.00 54.79 55.84 3iqw n ASP 303 Cb 0.00 -0.12 -0.03 0.00 -0.72 0.00 0.00 41.12 40.26 3iqw n ASP 303 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3iqw n GLU 304 N -4.38 0.35 -0.19 -0.67 1.02 -1.26 -2.99 120.64 112.51 3iqw n GLU 304 Ca 0.03 -0.03 0.04 0.00 -0.02 0.00 0.00 57.16 57.19 3iqw n GLU 304 Cb 0.11 -1.59 0.06 0.00 -0.02 0.00 0.00 31.44 30.01 3iqw n GLU 304 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 3iqw n GLU 305 N -2.02 0.98 -4.17 3.49 0.28 -0.35 -4.77 120.64 114.07 3iqw n GLU 305 Ca 0.01 -1.73 -0.16 0.00 -0.16 0.00 0.00 57.16 55.13 3iqw n GLU 305 Cb 0.46 -1.01 -0.13 0.00 1.43 0.00 0.00 31.44 32.18 3iqw n GLU 305 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 3iqw s PHE 306 N -1.42 0.63 -0.19 -1.84 0.08 0.12 -4.67 117.98 110.70 3iqw s PHE 306 Ca 0.14 -0.24 -0.29 0.00 0.12 0.00 0.00 56.93 56.66 3iqw s PHE 306 Cb 0.13 -0.39 -0.01 0.00 -0.57 0.00 0.00 43.02 42.17 3iqw s PHE 306 CO 0.01 -0.03 1.31 -0.80 -0.10 0.00 0.00 175.22 175.62 3iqw s ASN 307 N -0.67 6.85 -0.69 1.36 0.01 -0.29 -4.57 114.94 116.94 3iqw s ASN 307 Ca -0.02 1.64 -0.09 0.00 -0.71 0.00 0.00 52.86 53.68 3iqw s ASN 307 Cb -0.05 -2.54 0.18 0.00 0.41 0.00 0.00 41.25 39.25 3iqw s ASN 307 CO 0.00 -0.86 0.57 -0.69 -1.51 0.00 0.00 177.10 174.61 3iqw s VAL 308 N 3.78 4.61 0.69 1.60 1.01 -1.26 0.03 120.40 130.87 3iqw s VAL 308 Ca 0.57 -2.57 -0.11 0.00 0.00 0.00 0.00 61.98 59.87 3iqw s VAL 308 Cb -0.22 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.24 3iqw s VAL 308 CO 0.18 -0.93 1.06 -0.69 0.00 0.00 0.00 175.10 174.72 3iqw s VAL 309 N 0.26 3.99 -0.35 2.92 1.01 0.39 -4.55 120.40 124.06 3iqw s VAL 309 Ca 0.16 0.68 -0.00 0.00 0.00 0.00 0.00 61.98 62.81 3iqw s VAL 309 Cb -0.17 -3.39 0.13 0.00 0.00 0.00 0.00 36.38 32.95 3iqw s VAL 309 CO -0.05 -0.81 0.19 -0.54 0.00 0.00 0.00 175.10 173.89 3iqw s LYS 310 N -4.93 0.65 0.12 2.72 1.02 -1.26 -1.25 119.74 116.80 3iqw s LYS 310 Ca 0.59 -1.30 -0.23 0.00 0.02 0.00 0.00 55.97 55.05 3iqw s LYS 310 Cb -0.14 -1.54 -0.07 0.00 -0.52 0.00 0.00 37.83 35.55 3iqw s LYS 310 CO 0.53 -1.15 0.68 -1.64 -0.92 0.00 0.00 175.35 172.86 3iqw s MET 311 N 1.15 4.41 0.43 1.68 -1.94 -0.28 -4.69 119.30 120.07 3iqw s MET 311 Ca 0.16 0.97 -0.19 0.00 -1.71 0.00 0.00 55.69 54.92 3iqw s MET 311 Cb -0.22 -3.26 -0.10 0.00 2.01 0.00 0.00 34.83 33.27 3iqw s MET 311 CO -0.08 0.59 0.91 -1.25 -0.01 0.00 0.00 175.02 175.19 3iqw s PRO 312 N -1.08 4.11 -0.08 2.03 0.04 -1.26 -1.95 135.00 136.81 3iqw s PRO 312 Ca 0.33 0.98 -0.30 0.00 0.04 0.00 0.00 61.00 62.05 3iqw s PRO 312 Cb -0.21 -2.22 -0.03 0.00 0.04 0.00 0.00 34.50 32.07 3iqw s PRO 312 CO 0.23 -0.05 1.30 -1.17 0.04 0.00 0.00 177.00 177.34 3iqw s LEU 313 N -3.37 4.26 0.29 -3.56 2.96 0.06 -4.49 118.68 114.82 3iqw s LEU 313 Ca 0.60 1.87 0.01 0.00 -0.22 0.00 0.00 54.13 56.39 3iqw s LEU 313 Cb -0.09 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.01 3iqw s LEU 313 CO 0.18 -0.69 0.46 -0.76 -1.32 0.00 0.00 176.35 174.22 3iqw s LEU 314 N 2.80 4.14 0.20 -0.68 1.02 -1.26 -4.92 118.68 119.99 3iqw s LEU 314 Ca 0.58 0.34 -0.01 0.00 0.02 0.00 0.00 54.13 55.06 3iqw s LEU 314 Cb -0.26 -3.16 0.15 0.00 0.02 0.00 0.00 46.19 42.95 3iqw s LEU 314 CO 0.21 -0.18 1.52 -0.37 0.02 0.00 0.00 176.35 177.55 3iqw h VAL 315 N 1.04 1.33 -1.94 -1.59 -1.51 -2.04 -3.44 116.25 108.10 3iqw h VAL 315 Ca -0.50 -1.83 -0.49 0.00 -1.23 0.00 0.00 66.70 62.65 3iqw h VAL 315 Cb 1.22 1.82 -0.04 0.00 -2.13 0.00 0.00 31.29 32.16 3iqw h VAL 315 CO 0.63 0.56 -0.46 -1.61 -1.23 0.00 0.00 177.57 175.45 3iqw s GLU 316 N -3.94 2.80 0.60 5.19 2.02 -1.26 -5.07 118.70 119.04 3iqw s GLU 316 Ca -0.06 -1.21 -0.19 0.00 0.02 0.00 0.00 54.97 53.52 3iqw s GLU 316 Cb 0.11 -2.52 -0.03 0.00 0.10 0.00 0.00 34.13 31.80 3iqw s GLU 316 CO 0.83 0.17 1.25 -1.21 0.02 0.00 0.00 175.26 176.32 3iqw s GLU 317 N -3.96 2.87 -0.76 1.61 8.01 -1.26 -4.91 118.70 120.30 3iqw s GLU 317 Ca 0.39 1.94 -0.24 0.00 0.01 0.00 0.00 54.97 57.07 3iqw s GLU 317 Cb -0.07 -1.94 0.06 0.00 -4.31 0.00 0.00 34.13 27.87 3iqw s GLU 317 CO 0.26 -1.32 1.17 0.08 0.01 0.00 0.00 175.26 175.46 3iqw s VAL 318 N -1.50 4.07 0.09 2.63 1.01 -1.26 -5.00 120.40 120.44 3iqw s VAL 318 Ca 0.78 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 62.57 3iqw s VAL 318 Cb -0.34 -4.83 -0.04 0.00 0.00 0.00 0.00 36.38 31.17 3iqw s VAL 318 CO 0.36 -1.68 -0.08 -0.13 0.00 0.00 0.00 175.10 173.58 3iqw s ARG 319 N 4.72 0.82 0.00 2.72 0.52 -1.26 -4.81 118.95 121.65 3iqw s ARG 319 Ca 0.31 -1.24 0.00 0.00 -0.52 0.00 0.00 55.73 54.28 3iqw s ARG 319 Cb -0.10 -0.30 0.00 0.00 0.52 0.00 0.00 34.95 35.06 3iqw s ARG 319 CO 0.08 0.01 0.00 0.41 0.02 0.00 0.00 175.30 175.82 3iqw n GLY 320 N 0.24 -2.18 0.15 -3.53 0.00 -0.35 -3.95 105.19 95.57 3iqw n GLY 320 Ca -0.14 -1.46 -0.06 0.00 0.00 0.00 0.00 46.02 44.36 3iqw n GLY 320 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3iqw h LYS 321 N 0.00 0.04 0.39 1.61 3.64 -1.86 -1.16 116.57 119.23 3iqw h LYS 321 Ca 0.00 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 3iqw h LYS 321 Cb 0.00 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 3iqw h LYS 321 CO 0.00 0.03 -0.19 1.49 -2.27 0.00 0.00 179.45 178.51 3iqw h GLU 322 N 0.04 -0.50 -0.94 1.90 4.81 -1.99 0.13 114.58 118.04 3iqw h GLU 322 Ca 0.16 0.03 0.17 0.00 -0.13 0.00 0.00 59.36 59.59 3iqw h GLU 322 Cb 0.23 0.11 -0.08 0.00 0.63 0.00 0.00 28.75 29.65 3iqw h GLU 322 CO -0.31 -0.33 0.60 0.00 -0.73 0.00 0.00 179.01 178.24 3iqw h ARG 323 N -0.56 0.65 -0.43 1.92 3.08 -1.68 -0.43 114.38 116.93 3iqw h ARG 323 Ca -0.05 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 59.81 3iqw h ARG 323 Cb 0.40 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 3iqw h ARG 323 CO 0.09 0.43 -0.31 -0.07 -1.07 0.00 0.00 179.97 179.04 3iqw h LEU 324 N 0.67 0.99 -0.21 3.04 3.38 -0.72 -1.91 115.31 120.55 3iqw h LEU 324 Ca 0.49 -0.42 0.05 0.00 0.09 0.00 0.00 57.88 58.10 3iqw h LEU 324 Cb 0.86 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.28 3iqw h LEU 324 CO -0.25 1.21 -0.16 -0.33 0.09 0.00 0.00 178.44 179.00 3iqw h GLU 325 N 0.80 -0.15 -0.52 1.13 5.08 0.87 -0.21 114.58 121.58 3iqw h GLU 325 Ca 0.08 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.51 3iqw h GLU 325 Cb 0.89 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.13 3iqw h GLU 325 CO 0.08 -0.10 0.25 0.87 -1.00 0.00 0.00 179.01 179.11 3iqw h LYS 326 N -0.16 0.47 -0.21 2.33 1.57 -1.14 -1.78 116.57 117.65 3iqw h LYS 326 Ca 0.12 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.91 3iqw h LYS 326 Cb 0.35 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 3iqw h LYS 326 CO -0.31 0.31 0.01 0.35 -0.57 0.00 0.00 179.45 179.23 3iqw h PHE 327 N 0.48 0.00 -0.32 -1.35 3.57 -0.90 -2.67 116.94 115.76 3iqw h PHE 327 Ca 0.23 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.79 3iqw h PHE 327 Cb 0.17 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 3iqw h PHE 327 CO -0.11 -0.02 0.21 0.66 -2.23 0.00 0.00 178.31 176.82 3iqw h SER 328 N 0.07 0.23 -0.98 0.41 4.64 -0.19 -0.42 113.55 117.31 3iqw h SER 328 Ca 0.10 -0.00 0.21 0.00 -0.47 0.00 0.00 61.79 61.62 3iqw h SER 328 Cb 0.12 -0.05 -0.09 0.00 -0.31 0.00 0.00 62.40 62.06 3iqw h SER 328 CO -0.16 0.16 0.62 -0.33 -0.87 0.00 0.00 176.83 176.25 3iqw h GLU 329 N 0.27 0.57 0.00 4.77 4.39 -1.06 0.30 114.58 123.81 3iqw h GLU 329 Ca 0.13 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.80 3iqw h GLU 329 Cb 0.20 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.73 3iqw h GLU 329 CO -0.03 0.37 -0.00 0.52 -1.16 0.00 0.00 179.01 178.72 3iqw h MET 330 N 0.58 0.00 -0.17 2.33 2.86 -1.17 0.13 114.93 119.49 3iqw h MET 330 Ca 0.55 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 58.15 3iqw h MET 330 Cb 1.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.74 3iqw h MET 330 CO -0.30 0.00 -0.07 1.25 1.06 0.00 0.00 176.91 178.86 3iqw h LEU 331 N 0.00 0.24 0.00 1.22 5.85 -1.03 -3.33 115.31 118.26 3iqw h LEU 331 Ca -0.00 -0.04 -0.17 0.00 0.84 0.00 0.00 57.88 58.51 3iqw h LEU 331 Cb 0.51 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 3iqw h LEU 331 CO 0.00 0.35 -1.68 -0.38 -0.34 0.00 0.00 178.44 176.39 3iqw n ILE 332 N -4.32 0.62 -4.09 4.05 2.08 -0.57 -0.98 119.36 116.16 3iqw n ILE 332 Ca -0.00 -0.41 -0.34 0.00 0.56 0.00 0.00 62.75 62.55 3iqw n ILE 332 Cb 0.23 -0.62 -0.15 0.00 -0.75 0.00 0.00 39.64 38.35 3iqw n ILE 332 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 3iqw s LYS 333 N -2.30 3.25 0.22 0.38 3.01 0.35 -4.71 119.74 119.93 3iqw s LYS 333 Ca -0.05 -0.70 -0.32 0.00 -1.01 0.00 0.00 55.97 53.89 3iqw s LYS 333 Cb 0.03 -2.82 -0.13 0.00 -1.01 0.00 0.00 37.83 33.90 3iqw s LYS 333 CO 0.42 -0.15 1.48 -2.30 0.51 0.00 0.00 175.35 175.31 3iqw n PRO 334 N 4.59 2.13 -2.56 -1.68 -0.02 -1.26 -4.18 135.00 132.01 3iqw n PRO 334 Ca -0.19 0.76 -0.42 0.00 -2.02 0.00 0.00 63.50 61.63 3iqw n PRO 334 Cb 0.51 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.50 3iqw n PRO 334 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3iqw s PHE 335 N 0.25 3.47 -0.31 6.00 5.36 -1.26 -5.01 117.98 126.49 3iqw s PHE 335 Ca 0.71 1.46 0.02 0.00 -0.96 0.00 0.00 56.93 58.16 3iqw s PHE 335 Cb -0.65 -3.29 0.16 0.00 -0.34 0.00 0.00 43.02 38.91 3iqw s PHE 335 CO 0.46 -0.71 0.42 0.14 -1.46 0.00 0.00 175.22 174.06 3iqw s VAL 336 N 1.42 -0.62 -0.13 3.12 -7.23 -1.26 -4.99 120.40 110.71 3iqw s VAL 336 Ca 0.54 -0.36 -0.07 0.00 -1.81 0.00 0.00 61.98 60.29 3iqw s VAL 336 Cb -0.24 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.75 3iqw s VAL 336 CO 0.26 -0.30 0.11 -2.16 -0.31 0.00 0.00 175.10 172.69 3iqw s PRO 337 N 2.38 3.55 0.09 4.82 0.04 -1.26 -5.03 135.00 139.60 3iqw s PRO 337 Ca 0.11 -0.21 -0.33 0.00 0.04 0.00 0.00 61.00 60.60 3iqw s PRO 337 Cb -0.12 -3.17 -0.18 0.00 0.04 0.00 0.00 34.50 31.07 3iqw s PRO 337 CO -0.26 0.63 0.78 -2.30 0.04 0.00 0.00 177.00 175.89 3iqw n PRO 338 N 2.43 0.00 0.00 0.56 -0.02 -1.26 -5.08 135.00 131.63 3iqw n PRO 338 Ca -0.19 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.44 3iqw n PRO 338 Cb 0.54 -1.22 0.69 0.00 -0.02 0.00 0.00 33.50 33.49 3iqw n PRO 338 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63