#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jwe n LYS 24 N 0.00 -2.25 -0.60 2.12 0.00 -1.26 -5.08 118.16 111.08 1jwe n LYS 24 Ca 0.00 1.50 0.00 0.00 0.00 0.00 0.00 58.31 59.81 1jwe n LYS 24 Cb 0.00 -2.75 0.00 0.00 0.00 0.00 0.00 35.03 32.28 1jwe n LYS 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1jwe n VAL 25 N -3.40 -1.60 -1.54 3.15 0.31 -1.26 -4.83 118.33 109.16 1jwe n VAL 25 Ca 0.00 0.67 -0.47 0.00 -0.01 0.00 0.00 64.34 64.54 1jwe n VAL 25 Cb 0.63 -1.04 -0.05 0.00 -0.91 0.00 0.00 33.84 32.47 1jwe n VAL 25 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1jwe n PRO 26 N -1.62 1.59 -2.11 5.55 -0.04 -1.26 -4.86 135.00 132.25 1jwe n PRO 26 Ca 0.00 0.46 -0.35 0.00 -0.04 0.00 0.00 63.50 63.57 1jwe n PRO 26 Cb 0.13 -2.80 -0.04 0.00 -0.04 0.00 0.00 33.50 30.75 1jwe n PRO 26 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1jwe s PRO 27 N 5.97 2.69 -1.23 0.54 0.04 -1.26 -4.85 135.00 136.91 1jwe s PRO 27 Ca 1.04 0.20 -0.08 0.00 0.04 0.00 0.00 61.00 62.20 1jwe s PRO 27 Cb -0.63 -4.61 -0.07 0.00 0.04 0.00 0.00 34.50 29.24 1jwe s PRO 27 CO 0.44 -2.85 2.50 -2.39 0.04 0.00 0.00 177.00 174.74 1jwe n HIS 28 N 12.65 1.82 -3.83 0.56 1.44 -1.26 -4.36 115.22 122.25 1jwe n HIS 28 Ca 0.25 -2.46 -0.34 0.00 -2.01 0.00 0.00 57.72 53.16 1jwe n HIS 28 Cb 0.50 -2.04 0.02 0.00 0.12 0.00 0.00 29.99 28.60 1jwe n HIS 28 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 1jwe n SER 29 N 3.91 -3.98 -0.22 4.39 7.64 -1.26 -4.55 113.62 119.54 1jwe n SER 29 Ca 0.60 -1.08 0.02 0.00 1.01 0.00 0.00 58.87 59.41 1jwe n SER 29 Cb 0.18 -2.91 0.13 0.00 -1.01 0.00 0.00 64.21 60.60 1jwe n SER 29 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1jwe h ILE 30 N -2.04 0.73 -0.10 0.44 5.03 -1.93 0.57 117.51 120.21 1jwe h ILE 30 Ca -0.67 -0.14 -0.08 0.00 -0.12 0.00 0.00 64.86 63.85 1jwe h ILE 30 Cb 1.37 0.28 -0.01 0.00 -3.03 0.00 0.00 36.82 35.43 1jwe h ILE 30 CO 0.52 0.08 -0.29 -0.33 -0.68 0.00 0.00 178.15 177.45 1jwe h GLU 31 N 0.42 0.18 -0.26 2.37 5.08 -1.96 0.10 114.58 120.51 1jwe h GLU 31 Ca 0.34 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.56 1jwe h GLU 31 Cb 0.46 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1jwe h GLU 31 CO -0.34 0.46 -0.16 0.00 -1.00 0.00 0.00 179.01 177.97 1jwe h ALA 32 N 1.54 0.37 -0.84 3.43 0.00 -1.71 -2.72 119.26 119.34 1jwe h ALA 32 Ca 0.02 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.61 1jwe h ALA 32 Cb 0.60 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1jwe h ALA 32 CO 0.04 0.27 0.55 1.05 0.00 0.00 0.00 179.25 181.16 1jwe h GLU 33 N 0.29 1.10 -0.88 0.00 -0.00 -0.42 -0.22 114.58 114.45 1jwe h GLU 33 Ca 0.05 -0.07 0.05 0.00 -0.00 0.00 0.00 59.36 59.40 1jwe h GLU 33 Cb 0.68 -0.25 -0.05 0.00 -0.00 0.00 0.00 28.75 29.13 1jwe h GLU 33 CO 0.04 0.73 0.57 1.96 -0.00 0.00 0.00 179.01 182.31 1jwe h GLN 34 N 1.13 1.00 -0.14 1.06 4.20 -0.84 -0.92 115.11 120.59 1jwe h GLN 34 Ca 0.31 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.85 1jwe h GLN 34 Cb -0.13 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.41 1jwe h GLN 34 CO -0.07 0.66 -0.39 0.77 -0.67 0.00 0.00 178.83 179.13 1jwe h SER 35 N 1.03 0.33 0.25 1.46 0.02 -0.76 -0.30 113.55 115.58 1jwe h SER 35 Ca 0.37 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 1jwe h SER 35 Cb 0.14 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1jwe h SER 35 CO -0.13 0.69 -0.12 0.58 -1.14 0.00 0.00 176.83 176.71 1jwe h VAL 36 N 0.27 0.74 -0.45 2.27 2.07 0.09 0.14 116.25 121.38 1jwe h VAL 36 Ca 0.03 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.61 1jwe h VAL 36 Cb 0.81 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 1jwe h VAL 36 CO 0.06 0.00 0.15 -0.07 0.02 0.00 0.00 177.57 177.73 1jwe h LEU 37 N -0.34 0.14 -1.21 2.57 3.38 -1.10 -1.13 115.31 117.62 1jwe h LEU 37 Ca -0.03 0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1jwe h LEU 37 Cb 0.27 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1jwe h LEU 37 CO 0.05 0.11 -0.39 1.23 0.09 0.00 0.00 178.44 179.54 1jwe h GLY 38 N 0.31 0.00 1.12 0.83 0.00 -0.95 -2.98 103.07 101.41 1jwe h GLY 38 Ca 0.21 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.44 1jwe h GLY 38 CO -0.23 0.00 -0.05 -1.33 0.00 0.00 0.00 176.54 174.93 1jwe h GLY 39 N 1.24 1.12 2.00 4.60 0.00 0.47 -3.21 103.07 109.31 1jwe h GLY 39 Ca -0.00 -0.86 -0.10 0.00 0.00 0.00 0.00 47.33 46.37 1jwe h GLY 39 CO 0.05 0.79 -0.49 1.41 0.00 0.00 0.00 176.54 178.30 1jwe h LEU 40 N 0.94 0.00 -1.25 3.11 3.38 -1.15 0.11 115.31 120.44 1jwe h LEU 40 Ca 0.16 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 1jwe h LEU 40 Cb 0.61 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1jwe h LEU 40 CO 0.04 0.49 -0.07 0.24 0.09 0.00 0.00 178.44 179.22 1jwe h MET 41 N 0.00 0.42 0.17 1.13 2.86 -1.55 -3.08 114.93 114.88 1jwe h MET 41 Ca -0.00 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 1jwe h MET 41 Cb 0.87 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.48 1jwe h MET 41 CO 0.06 0.51 -0.08 -0.07 1.06 0.00 0.00 176.91 178.39 1jwe h LEU 42 N 0.40 -0.20 -7.40 1.22 3.38 -1.47 -3.39 115.31 107.86 1jwe h LEU 42 Ca 0.08 -0.25 -0.64 0.00 0.09 0.00 0.00 57.88 57.17 1jwe h LEU 42 Cb 0.38 0.05 -0.41 0.00 0.09 0.00 0.00 40.66 40.77 1jwe h LEU 42 CO 0.02 0.36 -0.65 -0.62 0.09 0.00 0.00 178.44 177.63 1jwe s ASP 43 N -5.42 4.34 0.00 -0.43 -1.08 0.31 -4.94 116.67 109.45 1jwe s ASP 43 Ca -0.09 -2.85 0.28 0.00 -0.52 0.00 0.00 52.55 49.37 1jwe s ASP 43 Cb 0.00 -1.59 1.08 0.00 -1.46 0.00 0.00 42.92 40.95 1jwe s ASP 43 CO 0.33 -0.26 1.79 -0.46 0.52 0.00 0.00 175.17 177.09 1jwe n ASN 44 N 3.32 0.36 0.08 -0.34 0.23 -1.17 -3.14 115.26 114.60 1jwe n ASN 44 Ca 0.05 -0.25 -0.14 0.00 -0.53 0.00 0.00 54.58 53.72 1jwe n ASN 44 Cb 0.34 -0.11 -0.06 0.00 -2.08 0.00 0.00 39.78 37.87 1jwe n ASN 44 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1jwe h GLU 45 N 0.32 0.37 0.00 -3.83 4.39 -1.92 -3.02 114.58 110.89 1jwe h GLU 45 Ca 0.00 -0.44 0.00 0.00 0.34 0.00 0.00 59.36 59.26 1jwe h GLU 45 Cb 0.42 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1jwe h GLU 45 CO 0.00 1.12 0.00 0.54 -1.16 0.00 0.00 179.01 179.51 1jwe n ARG 46 N -3.70 0.56 -0.08 2.33 5.12 -1.19 -2.86 116.66 116.84 1jwe n ARG 46 Ca -0.07 0.03 -0.07 0.00 -1.93 0.00 0.00 57.85 55.81 1jwe n ARG 46 Cb 0.87 -1.50 -0.01 0.00 -1.16 0.00 0.00 32.46 30.66 1jwe n ARG 46 CO 0.00 0.00 0.00 2.35 -1.93 0.00 0.00 177.63 178.05 1jwe h TRP 47 N 0.00 -0.62 0.00 -1.55 2.91 -1.61 0.10 115.95 115.18 1jwe h TRP 47 Ca 0.00 0.04 -0.04 0.00 1.13 0.00 0.00 58.89 60.03 1jwe h TRP 47 Cb 0.05 0.32 -0.01 0.00 -0.51 0.00 0.00 29.16 29.02 1jwe h TRP 47 CO 0.00 -0.31 -0.18 -0.44 -1.03 0.00 0.00 178.44 176.48 1jwe h ASP 48 N -0.20 0.00 0.00 2.65 5.19 -1.76 0.33 116.42 122.64 1jwe h ASP 48 Ca 0.16 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.54 1jwe h ASP 48 Cb 0.46 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.97 1jwe h ASP 48 CO -0.44 0.18 -0.13 -0.78 -3.12 0.00 0.00 179.24 174.95 1jwe h ASP 49 N 0.00 0.10 -0.74 6.45 1.82 -1.53 -2.52 116.42 120.00 1jwe h ASP 49 Ca -0.00 -0.81 -0.06 0.00 -0.39 0.00 0.00 57.03 55.77 1jwe h ASP 49 Cb 0.44 -0.03 -0.03 0.00 0.68 0.00 0.00 39.33 40.39 1jwe h ASP 49 CO 0.02 0.90 0.23 0.58 -1.61 0.00 0.00 179.24 179.36 1jwe h VAL 50 N -0.68 1.26 0.00 2.25 2.07 -0.61 -1.64 116.25 118.90 1jwe h VAL 50 Ca -0.02 -0.92 -0.02 0.00 0.82 0.00 0.00 66.70 66.57 1jwe h VAL 50 Cb 0.92 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 31.14 1jwe h VAL 50 CO 0.02 0.36 -0.08 0.00 0.02 0.00 0.00 177.57 177.89 1jwe h ALA 51 N 1.12 1.66 -0.00 1.67 0.00 -0.39 0.37 119.26 123.68 1jwe h ALA 51 Ca 0.24 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1jwe h ALA 51 Cb 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1jwe h ALA 51 CO -0.01 0.10 -0.01 0.39 0.00 0.00 0.00 179.25 179.73 1jwe n GLU 52 N -4.15 1.10 -0.06 0.00 -0.58 -0.68 -3.59 120.64 112.68 1jwe n GLU 52 Ca -0.03 -0.24 -0.08 0.00 -0.42 0.00 0.00 57.16 56.39 1jwe n GLU 52 Cb 0.17 -1.49 -0.08 0.00 -0.57 0.00 0.00 31.44 29.46 1jwe n GLU 52 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1jwe n ARG 53 N -0.74 1.18 -3.96 3.49 5.12 0.47 -5.05 116.66 117.18 1jwe n ARG 53 Ca 0.22 0.04 -0.09 0.00 -1.93 0.00 0.00 57.85 56.09 1jwe n ARG 53 Cb 0.19 -1.29 -0.06 0.00 -1.16 0.00 0.00 32.46 30.14 1jwe n ARG 53 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1jwe s VAL 54 N -2.28 0.02 0.19 1.55 -7.23 0.10 -4.65 120.40 108.09 1jwe s VAL 54 Ca -0.13 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.72 1jwe s VAL 54 Cb 0.04 -2.03 -0.04 0.00 0.56 0.00 0.00 36.38 34.90 1jwe s VAL 54 CO 0.39 -0.09 0.06 0.68 -0.31 0.00 0.00 175.10 175.84 1jwe s VAL 55 N -3.99 0.37 0.61 1.32 -7.23 -1.26 -4.04 120.40 106.18 1jwe s VAL 55 Ca 0.20 -1.97 0.33 0.00 -1.81 0.00 0.00 61.98 58.73 1jwe s VAL 55 Cb 0.00 -2.29 0.38 0.00 0.56 0.00 0.00 36.38 35.03 1jwe s VAL 55 CO 0.05 -0.28 2.27 0.00 -0.31 0.00 0.00 175.10 176.83 1jwe h ALA 56 N 2.66 1.43 0.00 1.32 0.00 -1.93 -0.51 119.26 122.22 1jwe h ALA 56 Ca -0.36 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1jwe h ALA 56 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1jwe h ALA 56 CO 0.59 -0.03 0.00 -0.44 0.00 0.00 0.00 179.25 179.37 1jwe h ASP 57 N 0.00 0.00 0.17 0.00 3.32 -1.97 -2.85 116.42 115.10 1jwe h ASP 57 Ca 0.01 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.82 1jwe h ASP 57 Cb 0.05 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.63 1jwe h ASP 57 CO -0.00 0.00 -1.09 0.44 -1.72 0.00 0.00 179.24 176.87 1jwe h ASP 58 N 0.00 0.57 -1.79 6.45 3.32 -1.49 -3.44 116.42 120.03 1jwe h ASP 58 Ca 0.00 -0.93 -0.50 0.00 0.02 0.00 0.00 57.03 55.62 1jwe h ASP 58 Cb 0.31 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 1jwe h ASP 58 CO 0.00 1.52 1.55 -0.36 -1.72 0.00 0.00 179.24 180.23 1jwe s PHE 59 N -2.48 1.21 0.12 4.55 0.40 -1.08 -4.63 117.98 116.07 1jwe s PHE 59 Ca -0.13 1.22 0.23 0.00 -0.60 0.00 0.00 56.93 57.66 1jwe s PHE 59 Cb 0.02 -3.74 0.88 0.00 0.51 0.00 0.00 43.02 40.69 1jwe s PHE 59 CO 0.86 -2.81 1.81 -0.92 0.70 0.00 0.00 175.22 174.85 1jwe h TYR 60 N 17.78 0.00 -3.39 0.36 3.20 -1.86 -3.43 116.97 129.63 1jwe h TYR 60 Ca -0.28 0.00 -0.57 0.00 3.14 0.00 0.00 58.73 61.02 1jwe h TYR 60 Cb 1.24 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 39.45 1jwe h TYR 60 CO 0.97 0.24 0.97 0.95 -1.64 0.00 0.00 178.16 179.64 1jwe s THR 61 N -3.63 4.14 0.19 1.81 -4.23 -1.26 -4.96 115.64 107.70 1jwe s THR 61 Ca 0.01 1.22 -0.20 0.00 -1.18 0.00 0.00 61.69 61.54 1jwe s THR 61 Cb 0.10 -4.35 0.13 0.00 1.34 0.00 0.00 72.50 69.72 1jwe s THR 61 CO 0.64 -0.73 1.41 0.54 -0.54 0.00 0.00 174.62 175.94 1jwe n ARG 62 N 7.65 -0.28 -0.06 3.99 1.74 -1.26 -0.66 116.66 127.78 1jwe n ARG 62 Ca 0.14 1.40 -0.12 0.00 -0.77 0.00 0.00 57.85 58.49 1jwe n ARG 62 Cb 0.48 -2.07 -0.06 0.00 -1.02 0.00 0.00 32.46 29.79 1jwe n ARG 62 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1jwe h PRO 63 N 0.00 0.35 -0.95 5.56 0.13 -1.93 -3.22 132.00 131.94 1jwe h PRO 63 Ca 0.26 -0.15 0.04 0.00 -0.87 0.00 0.00 66.00 65.28 1jwe h PRO 63 Cb 0.49 -0.01 -0.06 0.00 0.13 0.00 0.00 31.00 31.55 1jwe h PRO 63 CO -0.89 0.65 0.62 0.45 -0.23 0.00 0.00 178.00 178.60 1jwe h HIS 64 N 0.03 1.16 -0.95 1.56 3.86 -1.70 -1.09 115.15 118.02 1jwe h HIS 64 Ca 0.04 0.03 0.17 0.00 -1.16 0.00 0.00 60.37 59.44 1jwe h HIS 64 Cb 0.54 -0.38 -0.10 0.00 1.06 0.00 0.00 27.41 28.53 1jwe h HIS 64 CO 0.06 0.66 0.55 0.00 0.86 0.00 0.00 177.93 180.07 1jwe h ARG 65 N 1.19 0.72 -0.38 2.45 3.08 -0.91 -2.31 114.38 118.22 1jwe h ARG 65 Ca 0.38 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.41 1jwe h ARG 65 Cb 0.01 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 29.86 1jwe h ARG 65 CO -0.12 0.48 0.21 1.25 -1.07 0.00 0.00 179.97 180.72 1jwe h HIS 66 N 0.74 0.39 0.03 3.04 2.76 -1.21 0.75 115.15 121.66 1jwe h HIS 66 Ca 0.53 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.74 1jwe h HIS 66 Cb 0.76 -0.12 -0.03 0.00 1.55 0.00 0.00 27.41 29.56 1jwe h HIS 66 CO -0.04 0.22 -0.20 0.82 -1.30 0.00 0.00 177.93 177.44 1jwe h ILE 67 N 0.43 0.53 -0.31 6.26 5.03 -1.46 0.44 117.51 128.44 1jwe h ILE 67 Ca 0.16 0.00 0.06 0.00 -0.12 0.00 0.00 64.86 64.95 1jwe h ILE 67 Cb 0.03 0.53 -0.05 0.00 -3.03 0.00 0.00 36.82 34.30 1jwe h ILE 67 CO -0.09 0.00 -0.02 0.15 -0.68 0.00 0.00 178.15 177.51 1jwe h PHE 68 N -0.33 -0.06 -0.46 1.37 3.04 -1.22 0.15 116.94 119.43 1jwe h PHE 68 Ca 0.05 0.02 -0.07 0.00 3.98 0.00 0.00 57.97 61.96 1jwe h PHE 68 Cb 0.40 0.07 -0.02 0.00 2.56 0.00 0.00 35.95 38.96 1jwe h PHE 68 CO -0.23 -0.08 0.01 1.15 -2.02 0.00 0.00 178.31 177.15 1jwe h THR 69 N 0.06 1.23 -0.01 4.41 2.02 -0.59 0.87 112.91 120.91 1jwe h THR 69 Ca 0.15 -0.95 -0.16 0.00 0.77 0.00 0.00 66.41 66.22 1jwe h THR 69 Cb 0.21 0.87 0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1jwe h THR 69 CO -0.27 0.34 -0.63 -0.08 0.37 0.00 0.00 175.52 175.25 1jwe h GLU 70 N 0.71 0.44 -0.48 6.66 4.57 -0.30 -1.24 114.58 124.93 1jwe h GLU 70 Ca 0.14 -0.46 0.01 0.00 -1.18 0.00 0.00 59.36 57.87 1jwe h GLU 70 Cb 0.42 0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 29.11 1jwe h GLU 70 CO 0.02 1.12 0.31 0.52 -1.18 0.00 0.00 179.01 179.79 1jwe h MET 71 N -0.05 0.62 -0.25 1.92 2.86 -0.59 0.13 114.93 119.56 1jwe h MET 71 Ca -0.08 -0.04 0.03 0.00 -2.06 0.00 0.00 59.70 57.56 1jwe h MET 71 Cb 1.33 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.82 1jwe h MET 71 CO 0.12 0.41 0.07 0.00 1.06 0.00 0.00 176.91 178.57 1jwe h ALA 72 N 1.19 0.27 -0.77 6.32 0.00 -0.83 -0.09 119.26 125.35 1jwe h ALA 72 Ca 0.18 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1jwe h ALA 72 Cb -0.05 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1jwe h ALA 72 CO -0.05 -0.34 0.36 -0.09 0.00 0.00 0.00 179.25 179.13 1jwe h ARG 73 N 0.18 1.11 0.06 0.00 2.43 -0.78 -0.10 114.38 117.27 1jwe h ARG 73 Ca 0.11 -0.16 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1jwe h ARG 73 Cb 0.09 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.44 1jwe h ARG 73 CO -0.13 0.86 -0.03 -0.07 -1.51 0.00 0.00 179.97 179.09 1jwe h LEU 74 N 1.10 -0.06 -0.99 3.80 3.38 -0.33 -0.28 115.31 121.93 1jwe h LEU 74 Ca 0.26 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1jwe h LEU 74 Cb 0.12 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 1jwe h LEU 74 CO -0.03 0.21 0.38 -0.61 0.09 0.00 0.00 178.44 178.47 1jwe h GLN 75 N -0.34 1.09 -0.77 1.13 5.75 -0.93 0.69 115.11 121.73 1jwe h GLN 75 Ca -0.01 -0.15 0.02 0.00 -0.15 0.00 0.00 58.65 58.36 1jwe h GLN 75 Cb 0.30 -0.20 -0.04 0.00 1.07 0.00 0.00 27.48 28.61 1jwe h GLN 75 CO 0.01 0.84 0.51 1.49 -2.65 0.00 0.00 178.83 179.03 1jwe h GLU 76 N 1.09 0.97 -0.12 1.69 4.81 -0.93 0.16 114.58 122.26 1jwe h GLU 76 Ca 0.27 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 1jwe h GLU 76 Cb 0.10 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.26 1jwe h GLU 76 CO -0.04 0.64 0.00 0.43 -0.73 0.00 0.00 179.01 179.32 1jwe n SER 77 N -4.43 0.73 -1.67 1.04 7.64 -0.12 -4.91 113.62 111.90 1jwe n SER 77 Ca 0.09 -1.90 -0.16 0.00 1.01 0.00 0.00 58.87 57.91 1jwe n SER 77 Cb 0.07 -0.08 -0.03 0.00 -1.01 0.00 0.00 64.21 63.16 1jwe n SER 77 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jwe n GLY 78 N 0.77 0.29 3.52 0.23 0.00 0.05 -4.98 105.19 105.07 1jwe n GLY 78 Ca 0.07 -0.22 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 1jwe n GLY 78 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jwe s SER 79 N -2.44 4.03 0.82 1.61 0.01 0.08 -4.98 113.70 112.83 1jwe s SER 79 Ca 0.00 -0.55 -0.12 0.00 1.31 0.00 0.00 55.95 56.60 1jwe s SER 79 Cb 0.00 -0.62 0.09 0.00 0.21 0.00 0.00 66.02 65.70 1jwe s SER 79 CO 0.00 0.16 1.15 -2.16 0.41 0.00 0.00 173.24 172.81 1jwe s PRO 80 N -2.31 1.70 -0.17 12.44 0.04 -1.26 -3.51 135.00 141.92 1jwe s PRO 80 Ca 0.20 1.54 0.16 0.00 0.04 0.00 0.00 61.00 62.94 1jwe s PRO 80 Cb -0.10 -1.80 0.42 0.00 0.04 0.00 0.00 34.50 33.05 1jwe s PRO 80 CO 0.12 -2.12 1.30 0.44 0.04 0.00 0.00 177.00 176.78 1jwe n ILE 81 N -3.52 2.15 -1.93 0.56 -5.35 -1.26 -4.59 119.36 105.42 1jwe n ILE 81 Ca 0.12 -2.23 -0.38 0.00 -0.27 0.00 0.00 62.75 59.98 1jwe n ILE 81 Cb 0.52 -0.26 0.02 0.00 -1.74 0.00 0.00 39.64 38.18 1jwe n ILE 81 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1jwe s ASP 82 N -2.49 5.61 0.30 7.28 2.15 -1.26 -4.22 116.67 124.05 1jwe s ASP 82 Ca 0.38 2.64 0.05 0.00 0.43 0.00 0.00 52.55 56.05 1jwe s ASP 82 Cb 0.33 -2.63 0.81 0.00 -0.30 0.00 0.00 42.92 41.12 1jwe s ASP 82 CO 0.04 -1.33 1.65 0.25 -0.17 0.00 0.00 175.17 175.62 1jwe h LEU 83 N 1.74 0.15 -0.03 -1.34 5.85 -1.95 -0.67 115.31 119.06 1jwe h LEU 83 Ca -0.50 0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.41 1jwe h LEU 83 Cb 1.28 0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.53 1jwe h LEU 83 CO 0.59 -0.14 0.01 0.40 -0.34 0.00 0.00 178.44 178.95 1jwe h ILE 84 N 0.25 1.18 -0.57 4.05 1.08 -1.98 0.12 117.51 121.63 1jwe h ILE 84 Ca 0.60 -0.54 -0.04 0.00 -0.39 0.00 0.00 64.86 64.49 1jwe h ILE 84 Cb 1.25 1.49 -0.02 0.00 -3.07 0.00 0.00 36.82 36.46 1jwe h ILE 84 CO -0.64 0.15 0.20 0.74 -0.69 0.00 0.00 178.15 177.91 1jwe h THR 85 N -0.17 1.23 0.20 -0.27 2.02 -1.64 -0.99 112.91 113.30 1jwe h THR 85 Ca 0.01 -0.76 0.01 0.00 0.77 0.00 0.00 66.41 66.44 1jwe h THR 85 Cb 0.23 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 1jwe h THR 85 CO -0.00 0.29 -0.27 0.25 0.37 0.00 0.00 175.52 176.16 1jwe h LEU 86 N 0.80 -0.73 -0.55 2.58 5.85 -0.97 0.30 115.31 122.59 1jwe h LEU 86 Ca 0.19 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.99 1jwe h LEU 86 Cb 0.24 0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1jwe h LEU 86 CO -0.01 -0.37 0.36 0.00 -0.34 0.00 0.00 178.44 178.07 1jwe h ALA 87 N 0.14 0.70 0.00 1.25 0.00 -0.66 -1.05 119.26 119.65 1jwe h ALA 87 Ca 0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1jwe h ALA 87 Cb 0.51 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1jwe h ALA 87 CO -0.10 0.12 -0.14 0.93 0.00 0.00 0.00 179.25 180.06 1jwe h GLU 88 N 0.72 0.00 0.04 0.00 5.08 -0.83 0.15 114.58 119.74 1jwe h GLU 88 Ca 0.21 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1jwe h GLU 88 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1jwe h GLU 88 CO -0.06 0.14 -0.02 1.03 -1.00 0.00 0.00 179.01 179.10 1jwe h SER 89 N 0.00 -0.04 -0.87 1.42 0.87 -0.24 -2.35 113.55 112.34 1jwe h SER 89 Ca -0.00 -0.62 0.14 0.00 -1.23 0.00 0.00 61.79 60.09 1jwe h SER 89 Cb 0.28 0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 62.19 1jwe h SER 89 CO 0.02 0.64 0.56 -0.07 -0.53 0.00 0.00 176.83 177.45 1jwe h LEU 90 N -0.77 0.61 -0.42 2.23 3.38 -0.86 -0.11 115.31 119.37 1jwe h LEU 90 Ca -0.01 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1jwe h LEU 90 Cb 0.66 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1jwe h LEU 90 CO 0.01 0.31 -0.01 -0.33 0.09 0.00 0.00 178.44 178.51 1jwe h GLU 91 N 0.64 0.74 -0.62 1.13 4.39 -0.76 0.56 114.58 120.66 1jwe h GLU 91 Ca 0.43 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 59.89 1jwe h GLU 91 Cb 0.74 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.30 1jwe h GLU 91 CO -0.19 0.82 0.38 0.00 -1.16 0.00 0.00 179.01 178.87 1jwe h ARG 92 N 0.57 0.83 0.00 2.33 3.08 -0.50 -0.28 114.38 120.41 1jwe h ARG 92 Ca 0.12 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1jwe h ARG 92 Cb 0.49 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1jwe h ARG 92 CO 0.02 0.57 0.00 1.96 -1.07 0.00 0.00 179.97 181.46 1jwe h GLN 93 N 0.85 0.00 -3.73 0.04 1.08 -0.88 -3.47 115.11 109.01 1jwe h GLN 93 Ca 0.23 0.00 -0.19 0.00 -1.45 0.00 0.00 58.65 57.23 1jwe h GLN 93 Cb -0.05 0.00 0.08 0.00 -0.05 0.00 0.00 27.48 27.46 1jwe h GLN 93 CO -0.04 0.00 -0.38 0.41 -0.95 0.00 0.00 178.83 177.87 1jwe n GLY 94 N 0.44 0.09 0.00 3.46 0.00 -0.12 -4.95 105.19 104.12 1jwe n GLY 94 Ca 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1jwe n GLY 94 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1jwe n GLN 95 N -2.75 -0.12 -0.22 1.61 1.13 0.02 -4.84 117.38 112.20 1jwe n GLN 95 Ca -0.07 -0.07 -0.00 0.00 -1.94 0.00 0.00 57.00 54.91 1jwe n GLN 95 Cb 0.56 -0.56 0.22 0.00 0.11 0.00 0.00 30.24 30.57 1jwe n GLN 95 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1jwe h LEU 96 N 0.00 0.89 -1.02 1.08 5.85 -1.87 -0.63 115.31 119.61 1jwe h LEU 96 Ca 0.00 -0.04 0.10 0.00 0.84 0.00 0.00 57.88 58.78 1jwe h LEU 96 Cb 0.45 -0.22 -0.08 0.00 0.37 0.00 0.00 40.66 41.17 1jwe h LEU 96 CO 0.00 0.67 0.64 -2.24 -0.34 0.00 0.00 178.44 177.17 1jwe h ASP 97 N 1.03 0.96 1.95 1.25 3.04 -1.90 0.29 116.42 123.04 1jwe h ASP 97 Ca 0.27 0.03 0.00 0.00 -3.24 0.00 0.00 57.03 54.10 1jwe h ASP 97 Cb -0.06 -0.16 0.00 0.00 -1.04 0.00 0.00 39.33 38.06 1jwe h ASP 97 CO -0.05 0.55 -0.00 0.28 -2.04 0.00 0.00 179.24 177.98 1jwe h SER 98 N 1.06 0.00 1.41 4.15 0.02 -1.47 -1.54 113.55 117.18 1jwe h SER 98 Ca 0.47 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.42 1jwe h SER 98 Cb 0.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1jwe h SER 98 CO -0.23 0.00 -0.28 -0.37 -1.14 0.00 0.00 176.83 174.81 1jwe h VAL 99 N 0.00 0.00 0.00 2.27 -1.51 -1.30 -3.43 116.25 112.27 1jwe h VAL 99 Ca 0.00 -0.69 0.00 0.00 -1.23 0.00 0.00 66.70 64.78 1jwe h VAL 99 Cb 0.97 1.53 0.00 0.00 -2.13 0.00 0.00 31.29 31.66 1jwe h VAL 99 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 1jwe n GLY 100 N 1.24 0.37 0.00 5.19 0.00 -0.59 -4.84 105.19 106.57 1jwe n GLY 100 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1jwe n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jwe n GLY 101 N 0.00 -0.78 0.19 -0.02 0.00 0.08 -4.11 105.19 100.54 1jwe n GLY 101 Ca 0.00 -1.69 -0.04 0.00 0.00 0.00 0.00 46.02 44.29 1jwe n GLY 101 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1jwe h PHE 102 N 0.00 0.33 0.00 1.61 3.04 -1.96 -1.61 116.94 118.35 1jwe h PHE 102 Ca 0.00 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.97 1jwe h PHE 102 Cb 0.00 -0.08 0.00 0.00 2.56 0.00 0.00 35.95 38.43 1jwe h PHE 102 CO 0.00 0.13 0.00 0.00 -2.02 0.00 0.00 178.31 176.42 1jwe h ALA 103 N 1.30 1.00 -0.29 2.41 0.00 -1.97 -1.10 119.26 120.61 1jwe h ALA 103 Ca 0.22 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.99 1jwe h ALA 103 Cb 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1jwe h ALA 103 CO -0.21 0.00 -0.38 -0.92 0.00 0.00 0.00 179.25 177.74 1jwe h TYR 104 N 0.00 0.93 -0.60 0.00 5.03 -1.44 -0.22 116.97 120.67 1jwe h TYR 104 Ca 0.00 -0.30 -0.06 0.00 2.58 0.00 0.00 58.73 60.95 1jwe h TYR 104 Cb 0.35 -0.19 -0.03 0.00 1.55 0.00 0.00 36.73 38.42 1jwe h TYR 104 CO 0.00 1.09 0.14 -0.07 -1.32 0.00 0.00 178.16 177.99 1jwe h LEU 105 N 0.51 0.89 -1.80 2.82 3.38 -1.22 -1.65 115.31 118.24 1jwe h LEU 105 Ca 0.03 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1jwe h LEU 105 Cb 0.97 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.49 1jwe h LEU 105 CO 0.09 0.87 -0.07 0.00 0.09 0.00 0.00 178.44 179.42 1jwe h ALA 106 N 1.25 1.84 -0.07 1.53 0.00 -1.14 -0.31 119.26 122.35 1jwe h ALA 106 Ca 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1jwe h ALA 106 Cb 0.34 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1jwe h ALA 106 CO 0.00 0.12 0.05 1.49 0.00 0.00 0.00 179.25 180.91 1jwe h GLU 107 N 0.04 0.10 -0.01 0.00 4.57 -0.07 -1.14 114.58 118.06 1jwe h GLU 107 Ca 0.01 -0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.19 1jwe h GLU 107 Cb 0.15 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 1jwe h GLU 107 CO 0.01 0.06 -0.04 -0.07 -1.18 0.00 0.00 179.01 177.80 1jwe h LEU 108 N 0.10 -0.11 -0.79 1.64 3.38 -1.07 -0.14 115.31 118.32 1jwe h LEU 108 Ca 0.03 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1jwe h LEU 108 Cb -0.01 0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1jwe h LEU 108 CO -0.01 -0.06 0.00 -0.24 0.09 0.00 0.00 178.44 178.23 1jwe n SER 109 N -5.15 0.34 -0.00 -0.43 2.88 -0.17 -1.10 113.62 109.98 1jwe n SER 109 Ca -0.06 0.65 0.02 0.00 -1.33 0.00 0.00 58.87 58.15 1jwe n SER 109 Cb 0.08 -0.69 -0.03 0.00 -0.75 0.00 0.00 64.21 62.82 1jwe n SER 109 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1jwe n LYS 110 N -1.94 4.10 -0.51 -1.46 2.85 -0.48 -4.64 118.16 116.08 1jwe n LYS 110 Ca -0.00 -0.01 -0.06 0.00 -1.05 0.00 0.00 58.31 57.19 1jwe n LYS 110 Cb 0.04 -0.82 0.02 0.00 -0.65 0.00 0.00 35.03 33.62 1jwe n LYS 110 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1jwe n ASN 111 N -1.25 4.88 -3.84 -5.58 5.15 -0.09 -4.78 115.26 109.74 1jwe n ASN 111 Ca 0.00 -2.54 -0.27 0.00 -0.60 0.00 0.00 54.58 51.17 1jwe n ASN 111 Cb 0.09 -0.92 -0.17 0.00 -0.53 0.00 0.00 39.78 38.26 1jwe n ASN 111 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1jwe s THR 112 N -0.81 0.91 0.00 -0.44 -1.32 -1.25 -3.87 115.64 108.86 1jwe s THR 112 Ca 0.12 -0.54 0.00 0.00 -1.21 0.00 0.00 61.69 60.05 1jwe s THR 112 Cb 0.09 -1.16 0.00 0.00 -1.51 0.00 0.00 72.50 69.93 1jwe s THR 112 CO 0.01 0.06 1.60 -0.81 -2.21 0.00 0.00 174.62 173.27 1jwe n PRO 113 N 4.94 0.94 -0.70 7.08 -0.04 -1.26 -4.95 135.00 141.00 1jwe n PRO 113 Ca -0.11 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.45 1jwe n PRO 113 Cb 0.48 -1.03 -0.02 0.00 -0.04 0.00 0.00 33.50 32.88 1jwe n PRO 113 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1jwe n SER 114 N 1.24 -4.17 -4.55 3.54 7.64 -1.26 -4.48 113.62 111.57 1jwe n SER 114 Ca 0.00 0.28 -0.37 0.00 1.01 0.00 0.00 58.87 59.79 1jwe n SER 114 Cb 0.47 -2.13 -0.03 0.00 -1.01 0.00 0.00 64.21 61.51 1jwe n SER 114 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jwe s ALA 115 N -1.61 2.08 -0.30 -0.43 0.00 -1.26 -4.87 121.76 115.38 1jwe s ALA 115 Ca 0.00 -0.74 0.03 0.00 0.00 0.00 0.00 51.96 51.25 1jwe s ALA 115 Cb 0.00 -4.34 0.17 0.00 0.00 0.00 0.00 23.12 18.95 1jwe s ALA 115 CO 0.00 -4.05 0.46 0.00 0.00 0.00 0.00 175.76 172.17 1jwe s ALA 116 N 9.36 -1.54 -1.53 0.00 0.00 -1.26 -4.90 121.76 121.89 1jwe s ALA 116 Ca 0.69 0.39 -0.05 0.00 0.00 0.00 0.00 51.96 52.98 1jwe s ALA 116 Cb -0.12 -2.23 0.01 0.00 0.00 0.00 0.00 23.12 20.78 1jwe s ALA 116 CO 0.18 -1.81 0.63 0.09 0.00 0.00 0.00 175.76 174.85 1jwe n ASN 117 N 5.29 -5.93 -0.28 0.00 4.13 -1.26 -4.90 115.26 112.31 1jwe n ASN 117 Ca 0.03 -0.31 -0.02 0.00 1.68 0.00 0.00 54.58 55.96 1jwe n ASN 117 Cb 0.51 -4.79 0.10 0.00 -1.54 0.00 0.00 39.78 34.06 1jwe n ASN 117 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 1jwe h ILE 118 N -1.42 1.08 -0.76 2.41 2.10 -1.90 -0.92 117.51 118.10 1jwe h ILE 118 Ca -0.53 -0.32 0.02 0.00 1.08 0.00 0.00 64.86 65.12 1jwe h ILE 118 Cb 1.36 0.07 -0.04 0.00 -1.09 0.00 0.00 36.82 37.12 1jwe h ILE 118 CO 0.57 0.17 0.49 0.28 -1.08 0.00 0.00 178.15 178.57 1jwe h SER 119 N 0.92 0.82 0.15 2.19 0.02 -1.95 -0.01 113.55 115.69 1jwe h SER 119 Ca 0.32 -0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 61.11 1jwe h SER 119 Cb 0.08 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1jwe h SER 119 CO -0.14 0.58 -0.56 0.00 -1.14 0.00 0.00 176.83 175.57 1jwe h ALA 120 N 1.30 0.77 -0.12 3.77 0.00 -1.78 -0.24 119.26 122.96 1jwe h ALA 120 Ca 0.29 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1jwe h ALA 120 Cb -0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1jwe h ALA 120 CO -0.09 0.70 0.03 1.88 0.00 0.00 0.00 179.25 181.76 1jwe h TYR 121 N 0.33 0.20 -0.45 0.00 0.05 -0.76 -2.89 116.97 113.45 1jwe h TYR 121 Ca 0.00 -0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.74 1jwe h TYR 121 Cb 1.09 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 38.75 1jwe h TYR 121 CO 0.04 0.36 0.19 0.00 -1.05 0.00 0.00 178.16 177.69 1jwe h ALA 122 N 0.82 1.49 -0.33 3.88 0.00 -0.83 -1.95 119.26 122.34 1jwe h ALA 122 Ca 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1jwe h ALA 122 Cb 0.26 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1jwe h ALA 122 CO 0.00 0.40 0.18 -0.44 0.00 0.00 0.00 179.25 179.39 1jwe h ASP 123 N 0.64 0.40 0.16 0.00 3.32 -0.95 -0.12 116.42 119.88 1jwe h ASP 123 Ca 0.16 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1jwe h ASP 123 Cb 0.11 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1jwe h ASP 123 CO -0.02 0.32 -0.08 0.40 -1.72 0.00 0.00 179.24 178.15 1jwe h ILE 124 N 0.46 0.96 -0.29 0.35 2.04 -1.15 -2.58 117.51 117.29 1jwe h ILE 124 Ca 0.12 -0.67 0.06 0.00 1.00 0.00 0.00 64.86 65.37 1jwe h ILE 124 Cb 0.01 1.36 -0.06 0.00 -0.74 0.00 0.00 36.82 37.40 1jwe h ILE 124 CO -0.02 0.15 -0.07 0.58 0.00 0.00 0.00 178.15 178.80 1jwe h VAL 125 N -0.55 0.71 -0.49 1.67 2.07 -1.02 0.15 116.25 118.79 1jwe h VAL 125 Ca -0.02 -0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1jwe h VAL 125 Cb 0.42 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1jwe h VAL 125 CO 0.04 0.00 0.28 -0.09 0.02 0.00 0.00 177.57 177.82 1jwe h ARG 126 N 0.01 0.68 -0.31 1.57 2.43 -1.10 0.89 114.38 118.55 1jwe h ARG 126 Ca 0.14 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 1jwe h ARG 126 Cb 0.21 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1jwe h ARG 126 CO -0.30 0.51 0.11 1.49 -1.51 0.00 0.00 179.97 180.27 1jwe h GLU 127 N 0.65 0.47 0.00 0.20 4.81 -1.02 -2.05 114.58 117.64 1jwe h GLU 127 Ca 0.17 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1jwe h GLU 127 Cb 0.02 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.33 1jwe h GLU 127 CO -0.03 0.50 -0.06 0.00 -0.73 0.00 0.00 179.01 178.69 1jwe h ARG 128 N 0.34 0.00 -0.06 1.92 2.47 -0.36 0.91 114.38 119.60 1jwe h ARG 128 Ca 0.10 0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.67 1jwe h ARG 128 Cb 0.21 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.52 1jwe h ARG 128 CO -0.01 0.06 -0.62 0.00 0.56 0.00 0.00 179.97 179.96 1jwe h ALA 129 N 1.94 0.84 -0.60 0.04 0.00 -0.22 0.65 119.26 121.90 1jwe h ALA 129 Ca -0.00 -0.55 -0.07 0.00 0.00 0.00 0.00 54.91 54.29 1jwe h ALA 129 Cb 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1jwe h ALA 129 CO 0.01 0.74 0.12 0.28 0.00 0.00 0.00 179.25 180.40 1jwe h VAL 130 N 0.16 1.26 0.00 0.00 2.07 -0.25 -2.07 116.25 117.42 1jwe h VAL 130 Ca -0.01 -0.96 -0.01 0.00 0.82 0.00 0.00 66.70 66.54 1jwe h VAL 130 Cb 1.13 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1jwe h VAL 130 CO 0.10 0.36 -0.05 0.58 0.02 0.00 0.00 177.57 178.57 1jwe h VAL 131 N 0.89 0.29 -0.69 2.57 2.07 -0.74 -2.58 116.25 118.06 1jwe h VAL 131 Ca 0.19 -0.33 0.06 0.00 0.82 0.00 0.00 66.70 67.44 1jwe h VAL 131 Cb 0.39 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 1jwe h VAL 131 CO 0.01 0.05 0.46 -0.09 0.02 0.00 0.00 177.57 178.01 1jwe h ARG 132 N 0.00 0.70 0.00 1.57 1.12 -0.12 0.62 114.38 118.26 1jwe h ARG 132 Ca -0.00 -0.04 -0.07 0.00 -1.11 0.00 0.00 59.98 58.76 1jwe h ARG 132 Cb 0.25 -0.16 -0.01 0.00 -0.01 0.00 0.00 29.97 30.04 1jwe h ARG 132 CO 0.01 0.46 -0.32 1.05 -3.11 0.00 0.00 179.97 178.07 1jwe h GLU 133 N 0.72 0.00 0.00 0.20 -0.00 -1.54 -2.82 114.58 111.14 1jwe h GLU 133 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.66 1jwe h GLU 133 Cb 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.99 1jwe h GLU 133 CO -0.09 0.32 0.00 -1.33 -0.00 0.00 0.00 179.01 177.90 1jwe n MET 134 N -3.52 0.04 -3.63 1.06 0.00 0.19 -4.27 117.12 106.98 1jwe n MET 134 Ca -0.00 0.19 -0.37 0.00 0.00 0.00 0.00 57.70 57.52 1jwe n MET 134 Cb 0.46 -1.56 -0.07 0.00 0.00 0.00 0.00 33.22 32.05 1jwe n MET 134 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 1jwe s ILE 135 N -3.04 4.30 0.00 2.02 1.01 -1.06 -5.11 121.20 119.31 1jwe s ILE 135 Ca 0.09 -3.56 0.00 0.00 0.00 0.00 0.00 60.65 57.18 1jwe s ILE 135 Cb 0.12 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.90 1jwe s ILE 135 CO 0.38 -1.03 0.00 -1.20 0.00 0.00 0.00 174.94 173.09