#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w4r s GLY 19 N 0.00 1.65 0.13 -0.13 0.00 -1.24 -4.76 107.32 102.97 1w4r s GLY 19 Ca 0.00 -0.78 -0.25 0.00 0.00 0.00 0.00 44.72 43.69 1w4r s GLY 19 CO 0.00 -0.43 0.82 -0.86 0.00 0.00 0.00 173.10 172.62 1w4r s GLN 20 N -5.14 1.20 -0.09 2.90 -2.07 -0.54 -4.92 119.66 111.00 1w4r s GLN 20 Ca 0.57 -0.56 0.04 0.00 -1.82 0.00 0.00 55.36 53.59 1w4r s GLN 20 Cb -0.11 0.47 -0.00 0.00 -1.09 0.00 0.00 33.01 32.29 1w4r s GLN 20 CO 0.45 -0.54 -0.23 0.42 -1.32 0.00 0.00 175.29 174.08 1w4r s ILE 21 N -3.45 1.93 -0.07 3.63 1.01 -1.26 -0.61 121.20 122.38 1w4r s ILE 21 Ca 0.07 -0.95 0.05 0.00 0.00 0.00 0.00 60.65 59.82 1w4r s ILE 21 Cb -0.02 -1.66 -0.01 0.00 0.01 0.00 0.00 42.46 40.78 1w4r s ILE 21 CO -0.04 0.53 -0.22 -1.10 0.00 0.00 0.00 174.94 174.11 1w4r s GLN 22 N 0.27 2.71 -0.11 2.79 -0.21 0.83 -1.34 119.66 124.59 1w4r s GLN 22 Ca -0.15 -0.85 0.03 0.00 0.02 0.00 0.00 55.36 54.41 1w4r s GLN 22 Cb -0.17 -2.26 0.00 0.00 1.00 0.00 0.00 33.01 31.58 1w4r s GLN 22 CO 0.07 0.37 -0.22 0.08 -2.12 0.00 0.00 175.29 173.47 1w4r s VAL 23 N -0.11 2.20 -0.38 1.09 1.01 0.24 -0.89 120.40 123.56 1w4r s VAL 23 Ca -0.05 -0.96 -0.05 0.00 0.00 0.00 0.00 61.98 60.93 1w4r s VAL 23 Cb -0.14 -1.86 0.08 0.00 0.00 0.00 0.00 36.38 34.46 1w4r s VAL 23 CO 0.04 0.55 0.16 -0.63 0.00 0.00 0.00 175.10 175.22 1w4r s ILE 24 N 0.47 3.53 0.48 2.22 1.01 0.67 -1.66 121.20 127.92 1w4r s ILE 24 Ca -0.15 -1.62 0.06 0.00 0.00 0.00 0.00 60.65 58.94 1w4r s ILE 24 Cb -0.17 -3.21 0.03 0.00 0.01 0.00 0.00 42.46 39.11 1w4r s ILE 24 CO 0.06 -0.45 0.66 -0.76 0.00 0.00 0.00 174.94 174.44 1w4r s LEU 25 N 1.27 3.49 0.00 2.97 1.43 0.45 -1.37 118.68 126.92 1w4r s LEU 25 Ca 0.03 -0.34 0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1w4r s LEU 25 Cb -0.22 -2.63 0.00 0.00 0.03 0.00 0.00 46.19 43.38 1w4r s LEU 25 CO -0.01 -0.94 0.00 0.61 0.23 0.00 0.00 176.35 176.24 1w4r n GLY 26 N -2.04 1.89 3.88 -3.19 0.00 -1.19 -0.78 105.19 103.76 1w4r n GLY 26 Ca 0.09 -1.21 -0.30 0.00 0.00 0.00 0.00 46.02 44.59 1w4r n GLY 26 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1w4r s PRO 27 N -1.98 0.29 0.65 1.61 0.04 -1.26 -3.55 135.00 130.80 1w4r s PRO 27 Ca 0.00 -0.38 -0.18 0.00 0.04 0.00 0.00 61.00 60.48 1w4r s PRO 27 Cb 0.00 -1.80 -0.02 0.00 0.04 0.00 0.00 34.50 32.72 1w4r s PRO 27 CO 0.00 -2.65 1.12 -1.33 0.04 0.00 0.00 177.00 174.18 1w4r n MET 28 N -3.94 0.91 -1.28 4.56 2.81 -1.26 -3.32 117.12 115.59 1w4r n MET 28 Ca 0.15 0.36 -0.10 0.00 -1.81 0.00 0.00 57.70 56.31 1w4r n MET 28 Cb 0.59 -2.35 -0.04 0.00 -0.71 0.00 0.00 33.22 30.71 1w4r n MET 28 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1w4r n PHE 29 N -2.00 0.00 1.27 2.03 3.72 -1.26 -4.62 117.46 116.61 1w4r n PHE 29 Ca 0.15 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.68 1w4r n PHE 29 Cb 0.48 -1.98 0.35 0.00 -0.94 0.00 0.00 39.48 37.39 1w4r n PHE 29 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1w4r n SER 30 N 0.07 1.49 -1.00 4.37 3.41 -1.21 -4.55 113.62 116.20 1w4r n SER 30 Ca -0.10 -1.27 -0.07 0.00 -0.26 0.00 0.00 58.87 57.17 1w4r n SER 30 Cb 0.36 0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 1w4r n SER 30 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1w4r n GLY 31 N 1.30 0.18 0.26 5.00 0.00 -1.26 -4.72 105.19 105.95 1w4r n GLY 31 Ca 0.14 -0.53 0.03 0.00 0.00 0.00 0.00 46.02 45.66 1w4r n GLY 31 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1w4r h LYS 32 N -0.25 0.40 -0.31 1.61 1.57 -1.92 -1.33 116.57 116.34 1w4r h LYS 32 Ca -0.17 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.52 1w4r h LYS 32 Cb 1.12 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 1w4r h LYS 32 CO 0.20 0.27 -0.08 0.77 -0.57 0.00 0.00 179.45 180.03 1w4r h SER 33 N 0.42 0.49 -0.32 0.86 0.02 -1.95 -0.23 113.55 112.83 1w4r h SER 33 Ca 0.36 -0.11 -0.11 0.00 -0.84 0.00 0.00 61.79 61.09 1w4r h SER 33 Cb 0.51 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 1w4r h SER 33 CO -0.37 0.62 -0.21 0.74 -1.14 0.00 0.00 176.83 176.47 1w4r h THR 34 N 0.48 1.29 -0.63 -2.27 2.02 -1.82 -1.35 112.91 110.64 1w4r h THR 34 Ca 0.09 -1.35 -0.08 0.00 0.77 0.00 0.00 66.41 65.85 1w4r h THR 34 Cb 0.44 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 68.29 1w4r h THR 34 CO 0.02 0.44 0.09 -0.08 0.37 0.00 0.00 175.52 176.36 1w4r h GLU 35 N 0.48 1.05 -0.16 6.66 4.57 -1.02 0.14 114.58 126.30 1w4r h GLU 35 Ca 0.06 -0.28 0.05 0.00 -1.18 0.00 0.00 59.36 58.01 1w4r h GLU 35 Cb 0.77 -0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 29.18 1w4r h GLU 35 CO 0.06 0.98 -0.19 1.25 -1.18 0.00 0.00 179.01 179.92 1w4r h LEU 36 N 0.96 -0.60 -0.87 1.64 5.85 -0.99 -1.47 115.31 119.83 1w4r h LEU 36 Ca 0.19 0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.93 1w4r h LEU 36 Cb 0.44 0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 1w4r h LEU 36 CO 0.01 -0.24 -0.14 0.24 -0.34 0.00 0.00 178.44 177.98 1w4r h MET 37 N -0.23 0.69 -0.47 1.25 2.86 -0.88 -0.16 114.93 117.99 1w4r h MET 37 Ca 0.11 -0.23 0.05 0.00 -2.06 0.00 0.00 59.70 57.57 1w4r h MET 37 Cb 0.39 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.94 1w4r h MET 37 CO -0.30 0.80 0.19 -0.09 1.06 0.00 0.00 176.91 178.58 1w4r h ARG 38 N 0.63 0.38 -0.40 1.72 2.43 -0.36 0.05 114.38 118.82 1w4r h ARG 38 Ca 0.10 -0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.11 1w4r h ARG 38 Cb 0.59 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 1w4r h ARG 38 CO 0.04 0.25 -0.29 0.00 -1.51 0.00 0.00 179.97 178.46 1w4r h ARG 39 N 0.39 0.91 -0.49 0.20 3.08 -0.69 -2.39 114.38 115.39 1w4r h ARG 39 Ca 0.22 -0.44 -0.06 0.00 0.07 0.00 0.00 59.98 59.77 1w4r h ARG 39 Cb 0.19 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1w4r h ARG 39 CO -0.20 1.09 0.06 0.28 -1.07 0.00 0.00 179.97 180.14 1w4r h VAL 40 N 0.73 1.25 0.00 2.04 2.07 -0.73 -2.89 116.25 118.72 1w4r h VAL 40 Ca 0.08 -0.95 -0.06 0.00 0.82 0.00 0.00 66.70 66.58 1w4r h VAL 40 Cb 0.87 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 1w4r h VAL 40 CO 0.08 0.34 -0.31 0.03 0.02 0.00 0.00 177.57 177.73 1w4r h ARG 41 N 0.69 0.00 -0.95 1.57 3.08 -0.87 -0.71 114.38 117.20 1w4r h ARG 41 Ca 0.15 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.25 1w4r h ARG 41 Cb 0.42 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.41 1w4r h ARG 41 CO 0.01 0.31 0.61 0.00 -1.07 0.00 0.00 179.97 179.83 1w4r h ARG 42 N 0.00 1.12 -0.04 0.04 3.08 -1.21 -1.00 114.38 116.37 1w4r h ARG 42 Ca -0.00 -0.07 -0.25 0.00 0.07 0.00 0.00 59.98 59.73 1w4r h ARG 42 Cb 0.57 -0.25 0.02 0.00 0.08 0.00 0.00 29.97 30.39 1w4r h ARG 42 CO 0.04 0.74 -0.96 0.74 -1.07 0.00 0.00 179.97 179.46 1w4r h PHE 43 N 1.15 1.03 -0.66 3.04 0.04 -1.27 -3.28 116.94 116.99 1w4r h PHE 43 Ca 0.39 -0.53 -0.03 0.00 2.80 0.00 0.00 57.97 60.61 1w4r h PHE 43 Cb 0.08 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 38.07 1w4r h PHE 43 CO -0.01 1.36 0.30 0.37 -0.60 0.00 0.00 178.31 179.73 1w4r h GLN 44 N 0.43 0.96 0.00 1.51 4.15 -0.77 -1.25 115.11 120.14 1w4r h GLN 44 Ca -0.10 -0.15 0.00 0.00 0.77 0.00 0.00 58.65 59.16 1w4r h GLN 44 Cb 1.61 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 29.13 1w4r h GLN 44 CO 0.19 0.78 0.00 0.97 -1.93 0.00 0.00 178.83 178.84 1w4r h ILE 45 N 0.92 0.00 -0.36 2.39 2.10 -1.31 -0.89 117.51 120.36 1w4r h ILE 45 Ca 0.23 -0.41 0.00 0.00 1.08 0.00 0.00 64.86 65.76 1w4r h ILE 45 Cb 0.15 1.38 0.00 0.00 -1.09 0.00 0.00 36.82 37.26 1w4r h ILE 45 CO -0.03 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.04 1w4r n ALA 46 N -2.06 3.18 -1.51 0.18 0.00 -0.53 -4.92 120.51 114.85 1w4r n ALA 46 Ca 0.00 -1.08 -0.09 0.00 0.00 0.00 0.00 53.44 52.27 1w4r n ALA 46 Cb 0.26 -1.06 -0.03 0.00 0.00 0.00 0.00 19.45 18.62 1w4r n ALA 46 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1w4r n GLN 47 N 0.44 -0.65 -2.72 0.00 6.02 -0.34 -5.04 117.38 115.09 1w4r n GLN 47 Ca 0.16 0.71 -0.38 0.00 -0.01 0.00 0.00 57.00 57.49 1w4r n GLN 47 Cb 0.74 -4.63 -0.06 0.00 1.02 0.00 0.00 30.24 27.31 1w4r n GLN 47 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1w4r s TYR 48 N -2.37 3.73 0.18 1.08 2.02 -0.87 -5.02 117.35 116.10 1w4r s TYR 48 Ca 0.00 1.80 -0.29 0.00 -0.37 0.00 0.00 57.07 58.21 1w4r s TYR 48 Cb 0.00 -2.99 -0.08 0.00 -0.40 0.00 0.00 41.96 38.49 1w4r s TYR 48 CO 0.00 0.14 0.91 0.15 -1.57 0.00 0.00 175.55 175.18 1w4r s LYS 49 N -1.79 4.75 0.05 -0.62 1.02 -1.26 -4.35 119.74 117.55 1w4r s LYS 49 Ca 0.48 1.41 0.04 0.00 0.02 0.00 0.00 55.97 57.92 1w4r s LYS 49 Cb -0.22 -3.31 -0.03 0.00 -0.52 0.00 0.00 37.83 33.75 1w4r s LYS 49 CO 0.28 0.42 -0.12 0.00 -0.92 0.00 0.00 175.35 175.00 1w4r s LEU 51 N -1.49 1.86 -0.08 0.00 2.96 -0.24 -4.98 118.68 116.71 1w4r s LEU 51 Ca -0.03 -0.22 0.03 0.00 -0.22 0.00 0.00 54.13 53.69 1w4r s LEU 51 Cb -0.09 -0.63 -0.02 0.00 0.50 0.00 0.00 46.19 45.95 1w4r s LEU 51 CO 0.02 0.10 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.29 1w4r s VAL 52 N 0.06 2.84 -0.11 1.68 1.01 -1.26 -0.64 120.40 123.98 1w4r s VAL 52 Ca -0.01 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.21 1w4r s VAL 52 Cb -0.08 -2.13 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 1w4r s VAL 52 CO 0.00 0.56 -0.16 -0.63 0.00 0.00 0.00 175.10 174.88 1w4r s ILE 53 N -0.21 2.80 0.21 2.22 1.01 0.44 -0.77 121.20 126.90 1w4r s ILE 53 Ca -0.00 -0.77 0.11 0.00 0.00 0.00 0.00 60.65 59.99 1w4r s ILE 53 Cb -0.13 -2.13 -0.05 0.00 0.01 0.00 0.00 42.46 40.16 1w4r s ILE 53 CO 0.03 0.54 -0.23 -1.59 0.00 0.00 0.00 174.94 173.70 1w4r s LYS 54 N 0.14 1.53 -0.22 2.79 -2.85 -0.80 -1.27 119.74 119.06 1w4r s LYS 54 Ca -0.08 -1.57 -0.29 0.00 -1.00 0.00 0.00 55.97 53.02 1w4r s LYS 54 Cb -0.15 -1.79 -0.00 0.00 -2.06 0.00 0.00 37.83 33.83 1w4r s LYS 54 CO 0.05 0.37 1.18 -0.47 0.10 0.00 0.00 175.35 176.59 1w4r s TYR 55 N -1.89 3.00 0.39 1.78 5.04 -1.25 -1.04 117.35 123.38 1w4r s TYR 55 Ca 0.22 1.14 0.07 0.00 -2.44 0.00 0.00 57.07 56.07 1w4r s TYR 55 Cb -0.07 -3.52 0.83 0.00 0.35 0.00 0.00 41.96 39.55 1w4r s TYR 55 CO 0.11 -1.25 2.01 0.00 -1.34 0.00 0.00 175.55 175.08 1w4r h ALA 56 N 8.14 1.75 0.00 3.97 0.00 -0.53 -2.38 119.26 130.22 1w4r h ALA 56 Ca -0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1w4r h ALA 56 Cb 1.08 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1w4r h ALA 56 CO 0.99 0.19 -0.05 1.63 0.00 0.00 0.00 179.25 182.00 1w4r n LYS 57 N -4.47 0.11 -2.47 0.00 5.02 -1.26 -4.55 118.16 110.54 1w4r n LYS 57 Ca 0.07 0.08 -0.42 0.00 -2.02 0.00 0.00 58.31 56.02 1w4r n LYS 57 Cb 0.16 -1.62 -0.02 0.00 -0.02 0.00 0.00 35.03 33.53 1w4r n LYS 57 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1w4r s ASP 58 N -3.61 6.29 -0.52 4.39 -1.08 -0.90 -4.86 116.67 116.38 1w4r s ASP 58 Ca 0.12 0.28 0.02 0.00 -0.52 0.00 0.00 52.55 52.45 1w4r s ASP 58 Cb 0.16 -2.55 0.56 0.00 -1.46 0.00 0.00 42.92 39.63 1w4r s ASP 58 CO 0.57 -1.58 1.89 1.07 0.52 0.00 0.00 175.17 177.65 1w4r n THR 59 N 6.81 3.29 -0.97 1.71 5.66 -1.26 -4.97 114.28 124.56 1w4r n THR 59 Ca 0.11 -2.51 0.00 0.00 -3.05 0.00 0.00 64.05 58.61 1w4r n THR 59 Cb 0.49 -0.76 0.00 0.00 -1.55 0.00 0.00 70.33 68.51 1w4r n THR 59 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 175.07 169.91 1w4r n ARG 60 N -1.04 0.06 -0.00 1.09 1.85 -1.26 -5.13 116.66 112.24 1w4r n ARG 60 Ca 0.58 -0.43 0.00 0.00 -1.00 0.00 0.00 57.85 57.00 1w4r n ARG 60 Cb 1.18 -0.51 0.00 0.00 -1.05 0.00 0.00 32.46 32.08 1w4r n ARG 60 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1w4r n ALA 75 N -0.01 -1.14 -2.39 2.89 0.00 -1.26 -5.18 120.51 113.41 1w4r n ALA 75 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 1w4r n ALA 75 Cb 0.45 -0.19 -0.02 0.00 0.00 0.00 0.00 19.45 19.68 1w4r n ALA 75 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1w4r s LEU 76 N -0.38 3.97 0.50 0.00 2.96 0.05 -4.82 118.68 120.96 1w4r s LEU 76 Ca 0.00 1.38 -0.21 0.00 -0.22 0.00 0.00 54.13 55.08 1w4r s LEU 76 Cb 0.00 -3.54 -0.07 0.00 0.50 0.00 0.00 46.19 43.09 1w4r s LEU 76 CO 0.00 -1.01 1.16 -2.16 -1.32 0.00 0.00 176.35 173.02 1w4r s PRO 77 N 4.03 3.57 0.09 0.98 0.04 -1.26 -1.91 135.00 140.53 1w4r s PRO 77 Ca 0.57 1.73 -0.25 0.00 0.04 0.00 0.00 61.00 63.09 1w4r s PRO 77 Cb -0.19 -2.24 0.07 0.00 0.04 0.00 0.00 34.50 32.18 1w4r s PRO 77 CO 0.21 -0.70 0.61 0.00 0.04 0.00 0.00 177.00 177.17 1w4r s ALA 78 N -1.62 -1.62 -0.10 8.56 0.00 -0.20 -4.86 121.76 121.92 1w4r s ALA 78 Ca 0.68 0.73 0.10 0.00 0.00 0.00 0.00 51.96 53.47 1w4r s ALA 78 Cb -0.27 0.59 -0.15 0.00 0.00 0.00 0.00 23.12 23.29 1w4r s ALA 78 CO 0.32 -0.63 0.27 0.00 0.00 0.00 0.00 175.76 175.71 1w4r s LEU 80 N -3.51 0.93 0.34 0.00 2.96 -1.26 -4.59 118.68 113.55 1w4r s LEU 80 Ca -0.02 0.24 0.04 0.00 -0.22 0.00 0.00 54.13 54.16 1w4r s LEU 80 Cb 0.07 0.28 0.60 0.00 0.50 0.00 0.00 46.19 47.65 1w4r s LEU 80 CO 0.43 -0.13 1.89 -0.07 -1.32 0.00 0.00 176.35 177.16 1w4r h LEU 81 N 7.04 0.53 -1.81 -0.68 3.38 -1.93 -2.08 115.31 119.75 1w4r h LEU 81 Ca -0.40 -0.09 0.18 0.00 0.09 0.00 0.00 57.88 57.66 1w4r h LEU 81 Cb 1.15 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.72 1w4r h LEU 81 CO 0.44 0.56 0.49 -0.09 0.09 0.00 0.00 178.44 179.93 1w4r h ARG 82 N 0.56 0.17 0.00 1.13 1.12 -1.96 -0.58 114.38 114.81 1w4r h ARG 82 Ca 0.12 -0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 58.98 1w4r h ARG 82 Cb 0.27 -0.04 -0.00 0.00 -0.01 0.00 0.00 29.97 30.19 1w4r h ARG 82 CO 0.00 0.11 -0.03 -0.44 -3.11 0.00 0.00 179.97 176.51 1w4r h ASP 83 N 0.17 0.00 -0.15 -3.80 3.32 -1.80 -2.51 116.42 111.66 1w4r h ASP 83 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1w4r h ASP 83 Cb 1.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.66 1w4r h ASP 83 CO -0.06 0.03 0.00 1.33 -1.72 0.00 0.00 179.24 178.82 1w4r n VAL 84 N -3.34 1.34 0.26 -1.35 0.24 -0.26 -4.77 118.33 110.45 1w4r n VAL 84 Ca -0.02 -1.34 0.12 0.00 -2.04 0.00 0.00 64.34 61.06 1w4r n VAL 84 Cb 0.15 0.27 0.71 0.00 -1.47 0.00 0.00 33.84 33.50 1w4r n VAL 84 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1w4r h ALA 85 N 0.89 1.34 0.02 2.33 0.00 -1.11 -2.19 119.26 120.56 1w4r h ALA 85 Ca 0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1w4r h ALA 85 Cb 0.79 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1w4r h ALA 85 CO 0.03 0.15 -0.01 0.37 0.00 0.00 0.00 179.25 179.79 1w4r h GLN 86 N 0.00 -0.03 -0.04 0.00 4.15 -1.86 -2.41 115.11 114.92 1w4r h GLN 86 Ca -0.00 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 1w4r h GLN 86 Cb 0.31 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1w4r h GLN 86 CO 0.02 0.40 -0.31 1.05 -1.93 0.00 0.00 178.83 178.05 1w4r h GLU 87 N -0.47 0.08 -0.29 1.69 9.09 -1.89 -2.25 114.58 120.54 1w4r h GLU 87 Ca -0.00 -0.03 -0.05 0.00 0.05 0.00 0.00 59.36 59.32 1w4r h GLU 87 Cb 0.44 -0.01 -0.02 0.00 -1.65 0.00 0.00 28.75 27.52 1w4r h GLU 87 CO 0.01 0.39 -0.05 0.00 0.05 0.00 0.00 179.01 179.40 1w4r h ALA 88 N 1.61 1.37 0.00 1.06 0.00 -1.33 -2.40 119.26 119.57 1w4r h ALA 88 Ca 0.01 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 1w4r h ALA 88 Cb 0.60 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1w4r h ALA 88 CO 0.04 0.43 -0.24 -0.07 0.00 0.00 0.00 179.25 179.41 1w4r h LEU 89 N 0.43 0.00 -0.44 0.00 3.38 -0.88 -2.59 115.31 115.22 1w4r h LEU 89 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1w4r h LEU 89 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1w4r h LEU 89 CO 0.02 0.24 0.00 0.61 0.09 0.00 0.00 178.44 179.40 1w4r n GLY 90 N -0.12 -0.49 3.52 0.83 0.00 -0.91 -4.91 105.19 103.12 1w4r n GLY 90 Ca -0.01 -0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.54 1w4r n GLY 90 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1w4r s VAL 91 N -1.91 1.72 -0.13 1.61 -7.23 -0.98 -4.99 120.40 108.49 1w4r s VAL 91 Ca 0.28 -2.05 0.18 0.00 -1.81 0.00 0.00 61.98 58.57 1w4r s VAL 91 Cb 0.14 -2.78 -0.24 0.00 0.56 0.00 0.00 36.38 34.06 1w4r s VAL 91 CO 0.22 -0.09 0.39 0.00 -0.31 0.00 0.00 175.10 175.32 1w4r n ALA 92 N -0.78 1.81 -3.63 1.32 0.00 -0.53 -4.90 120.51 113.80 1w4r n ALA 92 Ca -0.04 -0.94 -0.26 0.00 0.00 0.00 0.00 53.44 52.20 1w4r n ALA 92 Cb 0.66 -0.55 -0.17 0.00 0.00 0.00 0.00 19.45 19.39 1w4r n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1w4r s VAL 93 N -2.78 1.13 -0.18 0.00 1.01 -0.96 -1.65 120.40 116.98 1w4r s VAL 93 Ca -0.07 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1w4r s VAL 93 Cb 0.08 -1.07 0.02 0.00 0.00 0.00 0.00 36.38 35.41 1w4r s VAL 93 CO 0.84 0.36 -0.19 -0.63 0.00 0.00 0.00 175.10 175.49 1w4r s ILE 94 N 1.04 2.17 -0.13 2.22 1.01 0.24 -1.08 121.20 126.67 1w4r s ILE 94 Ca -0.07 -0.90 -0.06 0.00 0.00 0.00 0.00 60.65 59.62 1w4r s ILE 94 Cb -0.15 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.37 1w4r s ILE 94 CO -0.01 0.53 0.07 -0.83 0.00 0.00 0.00 174.94 174.70 1w4r s GLY 95 N 1.29 1.99 -0.11 6.18 0.00 0.18 -0.47 107.32 116.39 1w4r s GLY 95 Ca 0.05 -0.72 0.01 0.00 0.00 0.00 0.00 44.72 44.05 1w4r s GLY 95 CO -0.12 -0.31 -0.12 -0.42 0.00 0.00 0.00 173.10 172.13 1w4r s ILE 96 N -0.55 1.31 -0.03 0.90 1.01 0.82 -0.42 121.20 124.23 1w4r s ILE 96 Ca 0.11 -0.50 -0.01 0.00 0.00 0.00 0.00 60.65 60.25 1w4r s ILE 96 Cb -0.12 -1.24 -0.04 0.00 0.01 0.00 0.00 42.46 41.08 1w4r s ILE 96 CO 0.02 0.41 0.07 -0.62 0.00 0.00 0.00 174.94 174.82 1w4r s ASP 97 N 1.29 5.66 -1.27 3.58 2.15 -0.40 -0.46 116.67 127.23 1w4r s ASP 97 Ca -0.01 0.17 -0.02 0.00 0.43 0.00 0.00 52.55 53.12 1w4r s ASP 97 Cb -0.14 -1.64 -0.00 0.00 -0.30 0.00 0.00 42.92 40.84 1w4r s ASP 97 CO -0.05 0.30 0.75 -0.62 -0.17 0.00 0.00 175.17 175.38 1w4r n GLU 98 N 1.42 -4.71 0.21 4.34 1.02 -0.66 -3.87 120.64 118.38 1w4r n GLU 98 Ca -0.15 0.65 0.14 0.00 -0.02 0.00 0.00 57.16 57.78 1w4r n GLU 98 Cb 0.53 -5.23 0.75 0.00 -0.02 0.00 0.00 31.44 27.48 1w4r n GLU 98 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1w4r h GLY 99 N -1.83 0.00 1.76 0.62 0.00 -1.21 -2.17 103.07 100.24 1w4r h GLY 99 Ca -0.61 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.73 1w4r h GLY 99 CO 0.54 0.00 0.11 0.06 0.00 0.00 0.00 176.54 177.25 1w4r h GLN 100 N 0.00 0.00 -0.01 4.80 -0.00 -1.85 -2.66 115.11 115.39 1w4r h GLN 100 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.72 1w4r h GLN 100 Cb 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.79 1w4r h GLN 100 CO -0.00 0.00 -0.11 1.19 -0.00 0.00 0.00 178.83 179.91 1w4r n PHE 101 N -3.45 0.00 -3.44 0.06 3.72 -0.82 -4.61 117.46 108.93 1w4r n PHE 101 Ca -0.02 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.98 1w4r n PHE 101 Cb 0.19 -0.04 -0.10 0.00 -0.94 0.00 0.00 39.48 38.59 1w4r n PHE 101 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1w4r s PHE 102 N -2.19 3.22 0.45 1.38 0.08 -1.00 -4.96 117.98 114.95 1w4r s PHE 102 Ca 0.32 -0.06 0.17 0.00 0.12 0.00 0.00 56.93 57.48 1w4r s PHE 102 Cb 0.20 -2.62 1.12 0.00 -0.57 0.00 0.00 43.02 41.15 1w4r s PHE 102 CO 0.41 -0.41 1.97 -1.35 -0.10 0.00 0.00 175.22 175.74 1w4r h PRO 103 N 8.46 0.31 -0.56 0.24 0.11 -1.87 -2.38 132.00 136.31 1w4r h PRO 103 Ca -0.30 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1w4r h PRO 103 Cb 1.15 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1w4r h PRO 103 CO 0.68 0.20 0.00 -0.40 -0.21 0.00 0.00 178.00 178.27 1w4r n ASP 104 N -4.45 5.48 -0.24 -2.05 5.75 -1.26 -4.65 116.55 115.12 1w4r n ASP 104 Ca 0.11 -2.87 0.03 0.00 -0.01 0.00 0.00 54.79 52.05 1w4r n ASP 104 Cb 0.46 -0.66 0.16 0.00 -1.03 0.00 0.00 41.12 40.05 1w4r n ASP 104 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 1w4r h ILE 105 N 3.85 0.73 -0.03 2.12 6.09 -1.73 -1.16 117.51 127.38 1w4r h ILE 105 Ca 0.00 -0.17 -0.01 0.00 -1.37 0.00 0.00 64.86 63.32 1w4r h ILE 105 Cb 1.87 0.21 -0.00 0.00 0.47 0.00 0.00 36.82 39.37 1w4r h ILE 105 CO 0.44 0.09 -0.01 0.58 -3.07 0.00 0.00 178.15 176.17 1w4r h VAL 106 N 0.48 1.31 -0.02 2.19 2.07 -1.85 -2.00 116.25 118.43 1w4r h VAL 106 Ca 0.38 -0.94 -0.18 0.00 0.82 0.00 0.00 66.70 66.77 1w4r h VAL 106 Cb 0.51 1.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1w4r h VAL 106 CO -0.35 0.25 -0.80 -0.33 0.02 0.00 0.00 177.57 176.37 1w4r h GLU 107 N -0.31 0.20 -0.20 1.57 4.39 -1.84 -2.43 114.58 115.97 1w4r h GLU 107 Ca 0.01 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 1w4r h GLU 107 Cb 0.41 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1w4r h GLU 107 CO 0.00 0.90 0.10 0.35 -1.16 0.00 0.00 179.01 179.20 1w4r h PHE 108 N 0.12 0.28 -0.43 4.33 3.57 -1.25 -1.45 116.94 122.10 1w4r h PHE 108 Ca -0.03 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.38 1w4r h PHE 108 Cb 1.39 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 40.03 1w4r h PHE 108 CO 0.03 0.28 -0.02 0.00 -2.23 0.00 0.00 178.31 176.37 1w4r h GLU 110 N 0.62 0.85 -0.19 0.00 4.57 -1.45 -0.29 114.58 118.70 1w4r h GLU 110 Ca 0.12 -0.34 -0.01 0.00 -1.18 0.00 0.00 59.36 57.95 1w4r h GLU 110 Cb 0.52 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.06 1w4r h GLU 110 CO 0.03 0.98 0.07 0.00 -1.18 0.00 0.00 179.01 178.91 1w4r h ALA 111 N 1.02 0.24 -0.58 2.92 0.00 -1.09 -0.96 119.26 120.82 1w4r h ALA 111 Ca 0.10 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1w4r h ALA 111 Cb 0.73 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1w4r h ALA 111 CO 0.06 -0.16 0.05 0.52 0.00 0.00 0.00 179.25 179.71 1w4r h MET 112 N 0.15 0.99 -0.51 0.00 2.86 -1.10 0.58 114.93 117.89 1w4r h MET 112 Ca 0.06 -0.29 -0.07 0.00 -2.06 0.00 0.00 59.70 57.34 1w4r h MET 112 Cb 0.18 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 1w4r h MET 112 CO -0.00 0.96 0.02 0.00 1.06 0.00 0.00 176.91 178.95 1w4r h ALA 113 N 0.99 1.08 0.00 6.32 0.00 -0.98 -0.96 119.26 125.71 1w4r h ALA 113 Ca 0.17 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1w4r h ALA 113 Cb 0.49 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1w4r h ALA 113 CO 0.02 0.58 -0.14 -0.91 0.00 0.00 0.00 179.25 178.81 1w4r h ASN 114 N 0.79 0.00 -0.19 0.00 2.35 -0.72 -1.91 115.58 115.89 1w4r h ASN 114 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1w4r h ASN 114 Cb 0.44 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.81 1w4r h ASN 114 CO 0.02 0.14 0.00 0.00 -1.65 0.00 0.00 177.43 175.93 1w4r n ALA 115 N -2.18 2.49 -0.34 -0.83 0.00 0.15 -4.90 120.51 114.90 1w4r n ALA 115 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.07 1w4r n ALA 115 Cb 0.36 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1w4r n ALA 115 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w4r n GLY 116 N 0.88 0.69 3.81 0.00 0.00 -0.72 -4.98 105.19 104.87 1w4r n GLY 116 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1w4r n GLY 116 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w4r s LYS 117 N -0.64 4.30 -0.29 1.61 -0.14 -0.46 -3.61 119.74 120.50 1w4r s LYS 117 Ca 0.00 1.18 -0.23 0.00 -1.36 0.00 0.00 55.97 55.56 1w4r s LYS 117 Cb 0.00 -2.32 -0.00 0.00 -1.68 0.00 0.00 37.83 33.83 1w4r s LYS 117 CO 0.00 0.03 0.75 0.99 -0.76 0.00 0.00 175.35 176.35 1w4r s THR 118 N -2.04 4.85 -0.19 2.17 2.01 -0.66 -1.47 115.64 120.31 1w4r s THR 118 Ca 0.59 1.17 -0.02 0.00 0.31 0.00 0.00 61.69 63.74 1w4r s THR 118 Cb -0.11 -4.09 -0.01 0.00 0.01 0.00 0.00 72.50 68.30 1w4r s THR 118 CO 0.16 -0.18 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.13 1w4r s VAL 119 N 2.83 3.05 -0.16 3.82 1.01 0.22 -0.59 120.40 130.58 1w4r s VAL 119 Ca 0.31 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.68 1w4r s VAL 119 Cb -0.15 -2.34 0.02 0.00 0.00 0.00 0.00 36.38 33.91 1w4r s VAL 119 CO 0.11 0.47 -0.21 -0.63 0.00 0.00 0.00 175.10 174.85 1w4r s ILE 120 N 1.10 2.08 -0.17 2.22 1.01 0.38 -0.12 121.20 127.70 1w4r s ILE 120 Ca 0.01 -0.95 0.01 0.00 0.00 0.00 0.00 60.65 59.72 1w4r s ILE 120 Cb -0.15 -1.85 0.02 0.00 0.01 0.00 0.00 42.46 40.49 1w4r s ILE 120 CO -0.02 0.54 -0.20 -0.69 0.00 0.00 0.00 174.94 174.57 1w4r s VAL 121 N 1.09 2.12 -0.16 2.92 1.01 -0.06 -0.13 120.40 127.19 1w4r s VAL 121 Ca -0.00 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 60.94 1w4r s VAL 121 Cb -0.14 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.31 1w4r s VAL 121 CO -0.08 0.54 0.20 0.00 0.00 0.00 0.00 175.10 175.76 1w4r s ALA 122 N 1.13 3.69 -0.09 5.51 0.00 0.39 -0.24 121.76 132.15 1w4r s ALA 122 Ca 0.01 -0.57 -0.25 0.00 0.00 0.00 0.00 51.96 51.14 1w4r s ALA 122 Cb -0.14 -2.22 0.06 0.00 0.00 0.00 0.00 23.12 20.82 1w4r s ALA 122 CO -0.09 0.25 0.59 0.00 0.00 0.00 0.00 175.76 176.52 1w4r s ALA 123 N 0.03 -1.52 0.27 0.00 0.00 -0.47 -0.86 121.76 119.21 1w4r s ALA 123 Ca 0.13 1.24 -0.30 0.00 0.00 0.00 0.00 51.96 53.03 1w4r s ALA 123 Cb -0.12 -0.24 -0.10 0.00 0.00 0.00 0.00 23.12 22.66 1w4r s ALA 123 CO 0.02 -0.33 1.38 -0.51 0.00 0.00 0.00 175.76 176.33 1w4r s LEU 124 N -0.83 4.40 0.03 0.00 1.43 -1.26 -3.20 118.68 119.25 1w4r s LEU 124 Ca -0.09 2.64 0.05 0.00 -1.03 0.00 0.00 54.13 55.70 1w4r s LEU 124 Cb -0.02 -3.63 -0.24 0.00 0.03 0.00 0.00 46.19 42.33 1w4r s LEU 124 CO 0.07 -0.63 0.96 -2.24 0.23 0.00 0.00 176.35 174.73 1w4r h ASP 125 N 4.57 0.15 -4.32 2.29 2.03 -1.93 -3.43 116.42 115.78 1w4r h ASP 125 Ca -0.47 -0.20 -0.49 0.00 -0.73 0.00 0.00 57.03 55.14 1w4r h ASP 125 Cb 1.22 -0.05 -0.23 0.00 -0.83 0.00 0.00 39.33 39.44 1w4r h ASP 125 CO 0.74 1.17 -0.81 -0.83 -1.03 0.00 0.00 179.24 178.48 1w4r s GLY 126 N -4.91 0.99 1.08 7.15 0.00 -1.26 -2.17 107.32 108.21 1w4r s GLY 126 Ca -0.04 -1.03 -0.18 0.00 0.00 0.00 0.00 44.72 43.47 1w4r s GLY 126 CO 0.83 -1.02 1.25 -0.51 0.00 0.00 0.00 173.10 173.66 1w4r s THR 127 N -1.04 1.81 0.44 0.90 -4.23 0.08 -4.80 115.64 108.81 1w4r s THR 127 Ca 0.03 0.00 0.30 0.00 -1.18 0.00 0.00 61.69 60.84 1w4r s THR 127 Cb -0.09 -2.80 0.30 0.00 1.34 0.00 0.00 72.50 71.25 1w4r s THR 127 CO 0.02 0.00 1.90 2.19 -0.54 0.00 0.00 174.62 178.19 1w4r h PHE 128 N -2.11 0.00 -0.48 3.99 -0.00 -1.90 0.23 116.94 116.66 1w4r h PHE 128 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.53 1w4r h PHE 128 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.20 1w4r h PHE 128 CO -1.84 0.00 0.00 1.04 -0.00 0.00 0.00 178.31 177.51 1w4r n GLN 129 N -2.71 2.44 -3.16 6.09 6.02 -1.26 -4.60 117.38 120.20 1w4r n GLN 129 Ca -0.02 -2.20 -0.23 0.00 -0.01 0.00 0.00 57.00 54.54 1w4r n GLN 129 Cb 0.24 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 30.04 1w4r n GLN 129 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1w4r n ARG 130 N 1.36 -5.32 -4.24 -1.09 1.74 0.79 -5.01 116.66 104.88 1w4r n ARG 130 Ca 0.20 0.86 -0.24 0.00 -0.77 0.00 0.00 57.85 57.91 1w4r n ARG 130 Cb 0.56 -5.75 -0.07 0.00 -1.02 0.00 0.00 32.46 26.18 1w4r n ARG 130 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1w4r s LYS 131 N -5.85 2.42 0.19 5.56 -0.14 -1.26 -4.86 119.74 115.80 1w4r s LYS 131 Ca 0.37 -1.27 -0.33 0.00 -1.36 0.00 0.00 55.97 53.37 1w4r s LYS 131 Cb -0.17 -2.28 -0.14 0.00 -1.68 0.00 0.00 37.83 33.57 1w4r s LYS 131 CO 0.45 0.40 1.48 -2.30 -0.76 0.00 0.00 175.35 174.62 1w4r n PRO 132 N -0.71 2.04 -2.76 -1.68 -0.02 -1.26 -0.74 135.00 129.88 1w4r n PRO 132 Ca -0.08 0.73 -0.42 0.00 -2.02 0.00 0.00 63.50 61.71 1w4r n PRO 132 Cb 0.58 -2.44 -0.04 0.00 -0.02 0.00 0.00 33.50 31.58 1w4r n PRO 132 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1w4r s PHE 133 N 0.42 2.59 0.00 6.00 2.19 -0.92 -4.67 117.98 123.60 1w4r s PHE 133 Ca 0.74 -0.24 0.00 0.00 0.33 0.00 0.00 56.93 57.76 1w4r s PHE 133 Cb -0.68 -4.34 0.00 0.00 -1.31 0.00 0.00 43.02 36.69 1w4r s PHE 133 CO 0.44 -1.69 0.00 0.41 1.83 0.00 0.00 175.22 176.21 1w4r n GLY 134 N 5.28 3.02 1.15 13.12 0.00 -1.26 -2.71 105.19 123.79 1w4r n GLY 134 Ca -0.00 -0.30 0.11 0.00 0.00 0.00 0.00 46.02 45.83 1w4r n GLY 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w4r n ALA 135 N 9.29 2.42 -0.10 4.61 0.00 -1.26 -4.65 120.51 130.82 1w4r n ALA 135 Ca 0.00 -1.03 0.05 0.00 0.00 0.00 0.00 53.44 52.46 1w4r n ALA 135 Cb 0.00 -0.92 0.39 0.00 0.00 0.00 0.00 19.45 18.92 1w4r n ALA 135 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1w4r h ILE 136 N 4.13 1.07 0.00 0.00 6.09 -1.84 -0.75 117.51 126.20 1w4r h ILE 136 Ca 0.00 -0.23 0.00 0.00 -1.37 0.00 0.00 64.86 63.26 1w4r h ILE 136 Cb 0.92 0.34 0.00 0.00 0.47 0.00 0.00 36.82 38.56 1w4r h ILE 136 CO 0.00 0.12 0.00 -0.07 -3.07 0.00 0.00 178.15 175.13 1w4r h LEU 137 N 0.66 0.00 -1.81 2.19 3.38 -1.82 -1.16 115.31 116.75 1w4r h LEU 137 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1w4r h LEU 137 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1w4r h LEU 137 CO -0.06 0.00 0.00 0.78 0.09 0.00 0.00 178.44 179.25 1w4r h ASN 138 N 0.00 0.00 0.41 -0.43 2.35 -1.49 -1.09 115.58 115.32 1w4r h ASN 138 Ca 0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1w4r h ASN 138 Cb 0.42 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 1w4r h ASN 138 CO 0.00 0.00 -0.27 -0.07 -1.65 0.00 0.00 177.43 175.44 1w4r h LEU 139 N 0.00 0.00 -0.04 1.61 3.38 -1.36 -3.35 115.31 115.54 1w4r h LEU 139 Ca 0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1w4r h LEU 139 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1w4r h LEU 139 CO 0.00 0.27 -0.03 0.58 0.09 0.00 0.00 178.44 179.35 1w4r h VAL 140 N 0.00 0.91 0.00 1.22 2.07 -1.36 -0.56 116.25 118.53 1w4r h VAL 140 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1w4r h VAL 140 Cb 0.55 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1w4r h VAL 140 CO 0.04 0.00 0.00 -2.65 0.02 0.00 0.00 177.57 174.98 1w4r n PRO 141 N -5.14 0.16 0.00 1.57 -0.02 -1.26 -2.03 135.00 128.28 1w4r n PRO 141 Ca -0.06 0.46 0.12 0.00 -2.02 0.00 0.00 63.50 62.00 1w4r n PRO 141 Cb 0.07 -1.84 0.19 0.00 -0.02 0.00 0.00 33.50 31.90 1w4r n PRO 141 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1w4r n LEU 142 N -2.15 1.11 -4.84 2.45 4.77 -0.30 -4.98 117.00 113.07 1w4r n LEU 142 Ca 0.01 -0.34 -0.35 0.00 -0.03 0.00 0.00 56.01 55.31 1w4r n LEU 142 Cb 0.17 -0.11 -0.06 0.00 -2.33 0.00 0.00 43.42 41.09 1w4r n LEU 142 CO 0.16 0.22 -0.20 0.00 -1.33 0.00 0.00 177.39 176.24 1w4r s ALA 143 N -2.69 3.76 -0.11 -1.18 0.00 -0.71 -4.70 121.76 116.12 1w4r s ALA 143 Ca 0.17 -0.75 0.18 0.00 0.00 0.00 0.00 51.96 51.56 1w4r s ALA 143 Cb 0.18 -1.79 0.30 0.00 0.00 0.00 0.00 23.12 21.80 1w4r s ALA 143 CO 0.63 0.67 1.55 0.93 0.00 0.00 0.00 175.76 179.54 1w4r h GLU 144 N 4.46 0.00 -2.99 0.00 3.07 -1.52 -3.45 114.58 114.15 1w4r h GLU 144 Ca -0.51 0.00 -0.17 0.00 -0.50 0.00 0.00 59.36 58.17 1w4r h GLU 144 Cb 1.20 0.00 -0.28 0.00 -0.84 0.00 0.00 28.75 28.83 1w4r h GLU 144 CO 0.62 0.39 -0.44 0.45 -1.40 0.00 0.00 179.01 178.63 1w4r s SER 145 N -6.38 -0.30 -0.05 1.42 0.15 -1.16 -5.04 113.70 102.34 1w4r s SER 145 Ca 0.03 0.58 -0.02 0.00 0.70 0.00 0.00 55.95 57.25 1w4r s SER 145 Cb 0.08 0.50 0.04 0.00 -1.71 0.00 0.00 66.02 64.92 1w4r s SER 145 CO 0.71 -0.15 0.10 -0.69 1.20 0.00 0.00 173.24 174.41 1w4r s VAL 146 N 0.98 -0.10 0.12 4.45 1.01 -1.26 -0.59 120.40 125.00 1w4r s VAL 146 Ca -0.07 0.26 0.06 0.00 0.00 0.00 0.00 61.98 62.23 1w4r s VAL 146 Cb -0.08 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.08 1w4r s VAL 146 CO -0.07 0.11 -0.14 0.68 0.00 0.00 0.00 175.10 175.68 1w4r s VAL 147 N 1.50 1.29 -0.21 2.92 -7.23 -0.67 -5.00 120.40 113.01 1w4r s VAL 147 Ca -0.05 -1.68 0.02 0.00 -1.81 0.00 0.00 61.98 58.45 1w4r s VAL 147 Cb -0.12 -1.49 0.04 0.00 0.56 0.00 0.00 36.38 35.37 1w4r s VAL 147 CO -0.04 -0.41 -0.15 -0.75 -0.31 0.00 0.00 175.10 173.44 1w4r s LYS 148 N -2.62 2.49 0.75 4.82 2.20 -1.26 -0.42 119.74 125.70 1w4r s LYS 148 Ca 0.08 -0.97 -0.11 0.00 -0.36 0.00 0.00 55.97 54.61 1w4r s LYS 148 Cb -0.05 -2.60 0.04 0.00 -1.51 0.00 0.00 37.83 33.71 1w4r s LYS 148 CO 0.03 -0.37 1.08 -0.51 -0.36 0.00 0.00 175.35 175.22 1w4r s LEU 149 N 1.27 2.84 0.12 5.43 1.43 0.04 -4.93 118.68 124.88 1w4r s LEU 149 Ca -0.01 1.41 0.08 0.00 -1.03 0.00 0.00 54.13 54.59 1w4r s LEU 149 Cb -0.16 -4.15 -0.04 0.00 0.03 0.00 0.00 46.19 41.87 1w4r s LEU 149 CO -0.09 -1.70 -0.14 0.42 0.23 0.00 0.00 176.35 175.07 1w4r s THR 150 N -3.13 3.08 0.48 5.49 -4.23 -1.26 -4.35 115.64 111.71 1w4r s THR 150 Ca 0.59 -1.45 0.06 0.00 -1.18 0.00 0.00 61.69 59.70 1w4r s THR 150 Cb -0.14 -2.44 0.06 0.00 1.34 0.00 0.00 72.50 71.31 1w4r s THR 150 CO 0.54 0.07 0.46 0.00 -0.54 0.00 0.00 174.62 175.15 1w4r n ALA 151 N 0.63 0.83 -2.79 3.99 0.00 -0.49 -4.56 120.51 118.12 1w4r n ALA 151 Ca -0.14 -1.85 -0.35 0.00 0.00 0.00 0.00 53.44 51.09 1w4r n ALA 151 Cb 0.53 0.68 -0.08 0.00 0.00 0.00 0.00 19.45 20.58 1w4r n ALA 151 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1w4r s VAL 152 N -2.25 5.19 0.08 0.00 1.01 -1.26 -0.39 120.40 122.79 1w4r s VAL 152 Ca 0.35 0.10 -0.31 0.00 0.00 0.00 0.00 61.98 62.12 1w4r s VAL 152 Cb -0.03 -3.31 -0.08 0.00 0.00 0.00 0.00 36.38 32.96 1w4r s VAL 152 CO 0.22 0.51 1.57 0.00 0.00 0.00 0.00 175.10 177.40 1w4r n MET 154 N 5.06 0.89 0.00 0.00 2.81 0.08 -1.47 117.12 124.49 1w4r n MET 154 Ca 0.15 -0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 1w4r n MET 154 Cb 0.41 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.42 1w4r n MET 154 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1w4r n GLU 155 N -1.05 3.92 0.00 0.03 1.02 -1.26 -4.82 120.64 118.47 1w4r n GLU 155 Ca 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 1w4r n GLU 155 Cb 0.14 -1.00 0.00 0.00 -0.02 0.00 0.00 31.44 30.56 1w4r n GLU 155 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1w4r n PHE 157 N -0.36 0.00 -1.46 0.00 3.72 -0.54 -5.00 117.46 113.83 1w4r n PHE 157 Ca 0.00 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.16 1w4r n PHE 157 Cb 0.03 -0.64 0.18 0.00 -0.94 0.00 0.00 39.48 38.11 1w4r n PHE 157 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1w4r n ARG 158 N -1.86 -1.71 -2.29 -1.08 1.74 -1.26 -4.59 116.66 105.61 1w4r n ARG 158 Ca -0.00 -1.60 -0.38 0.00 -0.77 0.00 0.00 57.85 55.10 1w4r n ARG 158 Cb 0.15 -1.21 -0.02 0.00 -1.02 0.00 0.00 32.46 30.36 1w4r n ARG 158 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1w4r s GLU 159 N -5.26 4.05 -0.06 5.56 2.02 -1.26 -0.56 118.70 123.19 1w4r s GLU 159 Ca 0.61 1.84 0.05 0.00 0.02 0.00 0.00 54.97 57.49 1w4r s GLU 159 Cb -0.03 -2.67 -0.02 0.00 0.10 0.00 0.00 34.13 31.51 1w4r s GLU 159 CO 0.44 -0.32 -0.21 0.00 0.02 0.00 0.00 175.26 175.19 1w4r s ALA 160 N -1.42 2.35 -0.22 5.21 0.00 0.48 -4.29 121.76 123.88 1w4r s ALA 160 Ca 0.57 -1.02 0.02 0.00 0.00 0.00 0.00 51.96 51.53 1w4r s ALA 160 Cb -0.31 -0.79 0.01 0.00 0.00 0.00 0.00 23.12 22.03 1w4r s ALA 160 CO 0.39 0.46 0.48 0.00 0.00 0.00 0.00 175.76 177.08 1w4r n ALA 161 N 2.75 2.45 -2.30 0.00 0.00 -1.03 -1.39 120.51 120.99 1w4r n ALA 161 Ca -0.17 -0.44 -0.16 0.00 0.00 0.00 0.00 53.44 52.67 1w4r n ALA 161 Cb 0.52 -0.07 -0.10 0.00 0.00 0.00 0.00 19.45 19.80 1w4r n ALA 161 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1w4r s TYR 162 N -0.33 1.43 -0.14 0.00 2.02 -0.81 -4.14 117.35 115.37 1w4r s TYR 162 Ca 0.02 -0.95 0.02 0.00 -0.37 0.00 0.00 57.07 55.79 1w4r s TYR 162 Cb 0.02 -0.82 0.01 0.00 -0.40 0.00 0.00 41.96 40.77 1w4r s TYR 162 CO 0.03 -0.10 -0.20 0.99 -1.57 0.00 0.00 175.55 174.70 1w4r s THR 163 N -3.51 2.22 -0.16 -0.71 2.01 -1.26 -0.94 115.64 113.29 1w4r s THR 163 Ca 0.27 -0.93 -0.08 0.00 0.31 0.00 0.00 61.69 61.26 1w4r s THR 163 Cb 0.06 -1.90 -0.04 0.00 0.01 0.00 0.00 72.50 70.62 1w4r s THR 163 CO 0.07 0.54 0.12 -0.75 -0.69 0.00 0.00 174.62 173.91 1w4r s LYS 164 N 0.77 3.85 -0.01 4.92 2.20 -0.10 -4.30 119.74 127.06 1w4r s LYS 164 Ca -0.08 -0.22 -0.25 0.00 -0.36 0.00 0.00 55.97 55.07 1w4r s LYS 164 Cb -0.16 -3.28 -0.04 0.00 -1.51 0.00 0.00 37.83 32.84 1w4r s LYS 164 CO -0.01 0.48 0.77 0.50 -0.36 0.00 0.00 175.35 176.73 1w4r s ARG 165 N -0.17 4.48 0.15 4.03 3.52 -1.26 -1.29 118.95 128.41 1w4r s ARG 165 Ca 0.10 1.03 0.04 0.00 -0.13 0.00 0.00 55.73 56.78 1w4r s ARG 165 Cb -0.12 -3.41 -0.07 0.00 -1.56 0.00 0.00 34.95 29.79 1w4r s ARG 165 CO 0.01 0.14 1.34 -0.07 -0.81 0.00 0.00 175.30 175.91 1w4r h LEU 166 N 6.30 0.14 0.00 -0.88 3.38 -1.59 -3.47 115.31 119.19 1w4r h LEU 166 Ca -0.42 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1w4r h LEU 166 Cb 1.20 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1w4r h LEU 166 CO 0.73 0.99 0.00 0.61 0.09 0.00 0.00 178.44 180.87 1w4r n GLY 167 N 1.06 0.84 0.20 0.83 0.00 -1.26 -5.06 105.19 101.79 1w4r n GLY 167 Ca -0.02 -1.88 0.05 0.00 0.00 0.00 0.00 46.02 44.16 1w4r n GLY 167 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1w4r n THR 168 N -0.08 0.00 -1.77 2.61 -2.24 -1.26 -5.02 114.28 106.52 1w4r n THR 168 Ca 0.00 -0.40 -0.41 0.00 -2.27 0.00 0.00 64.05 60.97 1w4r n THR 168 Cb 0.00 1.10 -0.00 0.00 -2.10 0.00 0.00 70.33 69.33 1w4r n THR 168 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1w4r n GLU 169 N -0.34 2.68 0.00 -0.78 4.71 -1.26 -4.92 120.64 120.73 1w4r n GLU 169 Ca 0.04 0.94 0.04 0.00 -0.01 0.00 0.00 57.16 58.17 1w4r n GLU 169 Cb 0.19 -2.69 -0.02 0.00 -1.01 0.00 0.00 31.44 27.92 1w4r n GLU 169 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1w4r n LYS 170 N 0.86 2.80 -2.39 3.49 5.02 -1.26 -4.99 118.16 121.69 1w4r n LYS 170 Ca 0.03 -0.38 -0.33 0.00 -2.02 0.00 0.00 58.31 55.61 1w4r n LYS 170 Cb 0.38 -1.01 -0.02 0.00 -0.02 0.00 0.00 35.03 34.36 1w4r n LYS 170 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1w4r s GLU 171 N -1.50 3.70 0.03 1.97 1.03 -1.26 -5.00 118.70 117.66 1w4r s GLU 171 Ca 0.06 1.24 -0.30 0.00 0.03 0.00 0.00 54.97 56.00 1w4r s GLU 171 Cb 0.07 -2.09 -0.16 0.00 -0.80 0.00 0.00 34.13 31.15 1w4r s GLU 171 CO 0.28 -0.50 1.23 0.28 -1.33 0.00 0.00 175.26 175.22 1w4r h VAL 172 N 1.14 0.02 -2.77 1.83 2.07 -2.05 -3.41 116.25 113.08 1w4r h VAL 172 Ca -0.48 -0.22 -0.55 0.00 0.82 0.00 0.00 66.70 66.27 1w4r h VAL 172 Cb 1.21 0.02 -0.08 0.00 -1.52 0.00 0.00 31.29 30.93 1w4r h VAL 172 CO 0.59 0.00 1.03 -0.70 0.02 0.00 0.00 177.57 178.51 1w4r s GLU 173 N -5.03 3.34 -0.22 1.57 2.12 -1.26 -4.93 118.70 114.30 1w4r s GLU 173 Ca -0.16 0.03 -0.02 0.00 0.36 0.00 0.00 54.97 55.18 1w4r s GLU 173 Cb 0.02 -4.10 0.07 0.00 0.26 0.00 0.00 34.13 30.37 1w4r s GLU 173 CO 0.47 -1.92 0.04 0.08 -0.54 0.00 0.00 175.26 173.39 1w4r s VAL 174 N 5.42 0.60 0.35 3.70 1.01 -1.26 -5.13 120.40 125.08 1w4r s VAL 174 Ca 0.40 -0.71 -0.28 0.00 0.00 0.00 0.00 61.98 61.38 1w4r s VAL 174 Cb -0.08 -1.15 -0.10 0.00 0.00 0.00 0.00 36.38 35.05 1w4r s VAL 174 CO 0.20 -0.29 1.32 -0.63 0.00 0.00 0.00 175.10 175.70 1w4r s ILE 175 N 1.81 2.65 0.00 2.22 -1.09 -1.26 -4.98 121.20 120.56 1w4r s ILE 175 Ca 0.01 0.64 0.00 0.00 -2.23 0.00 0.00 60.65 59.07 1w4r s ILE 175 Cb -0.17 -3.40 0.00 0.00 -1.58 0.00 0.00 42.46 37.31 1w4r s ILE 175 CO -0.11 0.14 0.00 0.61 -1.23 0.00 0.00 174.94 174.35 1w4r n GLY 176 N 0.74 2.23 0.00 6.18 0.00 -1.26 -5.04 105.19 108.05 1w4r n GLY 176 Ca 0.01 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1w4r n GLY 176 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w4r n GLY 177 N -0.75 3.12 0.29 -0.02 0.00 -1.26 -4.89 105.19 101.68 1w4r n GLY 177 Ca 0.00 -1.69 0.19 0.00 0.00 0.00 0.00 46.02 44.51 1w4r n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w4r h ALA 178 N -0.26 1.00 -0.17 4.61 0.00 -2.03 -0.82 119.26 121.58 1w4r h ALA 178 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1w4r h ALA 178 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1w4r h ALA 178 CO 0.00 0.00 -0.05 0.38 0.00 0.00 0.00 179.25 179.58 1w4r h ASP 179 N 0.00 0.23 -0.00 0.00 2.03 -2.03 -3.32 116.42 113.34 1w4r h ASP 179 Ca 0.00 -0.04 0.00 0.00 -0.73 0.00 0.00 57.03 56.26 1w4r h ASP 179 Cb 0.29 -0.06 0.00 0.00 -0.83 0.00 0.00 39.33 38.73 1w4r h ASP 179 CO 0.00 0.33 -0.33 0.29 -1.03 0.00 0.00 179.24 178.50 1w4r n LYS 180 N -4.34 4.24 -3.78 4.15 5.02 -0.44 -4.91 118.16 118.11 1w4r n LYS 180 Ca -0.00 -0.06 -0.13 0.00 -2.02 0.00 0.00 58.31 56.10 1w4r n LYS 180 Cb 0.21 -0.87 -0.11 0.00 -0.02 0.00 0.00 35.03 34.24 1w4r n LYS 180 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1w4r s TYR 181 N -1.65 -0.26 -0.05 2.13 2.02 -0.50 -1.42 117.35 117.63 1w4r s TYR 181 Ca 0.03 0.59 0.06 0.00 -0.37 0.00 0.00 57.07 57.37 1w4r s TYR 181 Cb 0.06 0.09 -0.02 0.00 -0.40 0.00 0.00 41.96 41.69 1w4r s TYR 181 CO 0.30 -0.21 -0.22 -1.01 -1.57 0.00 0.00 175.55 172.83 1w4r s HIS 182 N -0.30 2.50 0.19 2.71 3.76 -0.41 -4.12 115.29 119.62 1w4r s HIS 182 Ca -0.04 -0.48 -0.30 0.00 -0.15 0.00 0.00 55.06 54.09 1w4r s HIS 182 Cb -0.03 -1.59 -0.08 0.00 1.11 0.00 0.00 32.58 31.99 1w4r s HIS 182 CO 0.01 -0.06 1.17 -1.54 -0.85 0.00 0.00 174.74 173.48 1w4r s SER 183 N -0.42 7.12 0.04 1.40 1.04 -1.26 -0.93 113.70 120.70 1w4r s SER 183 Ca 0.04 2.22 0.00 0.00 0.48 0.00 0.00 55.95 58.69 1w4r s SER 183 Cb -0.12 -2.61 -0.03 0.00 0.10 0.00 0.00 66.02 63.37 1w4r s SER 183 CO 0.01 -0.33 -0.04 0.68 0.98 0.00 0.00 173.24 174.55 1w4r s VAL 184 N -0.18 0.22 0.98 5.02 -7.23 -0.12 -0.74 120.40 118.35 1w4r s VAL 184 Ca 0.52 -1.25 -0.16 0.00 -1.81 0.00 0.00 61.98 59.28 1w4r s VAL 184 Cb -0.32 -0.74 0.20 0.00 0.56 0.00 0.00 36.38 36.08 1w4r s VAL 184 CO 0.37 -0.65 1.28 0.00 -0.31 0.00 0.00 175.10 175.78 1w4r h ARG 186 N -1.73 0.60 -0.49 0.00 2.43 -1.99 -0.97 114.38 112.25 1w4r h ARG 186 Ca -0.45 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 58.55 1w4r h ARG 186 Cb 1.25 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.68 1w4r h ARG 186 CO 0.40 0.52 -0.02 -0.07 -1.51 0.00 0.00 179.97 179.29 1w4r h LEU 187 N 0.54 0.87 -0.95 3.80 3.38 -1.97 -2.73 115.31 118.24 1w4r h LEU 187 Ca 0.14 -0.32 -0.09 0.00 0.09 0.00 0.00 57.88 57.70 1w4r h LEU 187 Cb 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1w4r h LEU 187 CO -0.02 0.98 -0.44 0.00 0.09 0.00 0.00 178.44 179.04 1w4r h TYR 189 N 0.00 0.77 -0.92 0.00 3.20 -0.87 -2.83 116.97 116.32 1w4r h TYR 189 Ca -0.00 -0.08 -0.45 0.00 3.14 0.00 0.00 58.73 61.34 1w4r h TYR 189 Cb 0.91 -0.22 -0.27 0.00 1.54 0.00 0.00 36.73 38.69 1w4r h TYR 189 CO 0.00 0.68 0.57 1.19 -1.64 0.00 0.00 178.16 178.96 1w4r n PHE 190 N -4.27 2.86 -0.69 -3.82 3.72 -1.11 -5.05 117.46 109.12 1w4r n PHE 190 Ca 0.03 -1.69 0.00 0.00 -0.05 0.00 0.00 57.45 55.74 1w4r n PHE 190 Cb 0.24 -0.88 0.00 0.00 -0.94 0.00 0.00 39.48 37.90 1w4r n PHE 190 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88