#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jwe s LYS 24 N 0.00 3.92 0.29 0.03 2.36 -1.26 -5.05 119.74 120.03 1jwe s LYS 24 Ca 0.00 0.84 -0.29 0.00 -2.55 0.00 0.00 55.97 53.97 1jwe s LYS 24 Cb 0.00 -3.80 -0.09 0.00 -1.05 0.00 0.00 37.83 32.88 1jwe s LYS 24 CO 0.00 -1.07 1.08 0.08 1.55 0.00 0.00 175.35 176.99 1jwe s VAL 25 N 3.91 3.56 0.14 4.02 1.01 -1.26 -4.99 120.40 126.78 1jwe s VAL 25 Ca 0.45 1.52 -0.32 0.00 0.00 0.00 0.00 61.98 63.64 1jwe s VAL 25 Cb -0.10 -3.95 -0.11 0.00 0.00 0.00 0.00 36.38 32.22 1jwe s VAL 25 CO 0.21 0.32 1.80 -0.81 0.00 0.00 0.00 175.10 176.63 1jwe n PRO 26 N 1.05 2.76 -2.29 2.72 -0.04 -1.26 -4.92 135.00 133.01 1jwe n PRO 26 Ca -0.00 1.00 -0.42 0.00 -0.04 0.00 0.00 63.50 64.03 1jwe n PRO 26 Cb 0.46 -2.88 -0.03 0.00 -0.04 0.00 0.00 33.50 31.01 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 2.31 4.29 0.46 0.54 0.04 -1.26 -5.03 135.00 136.35 1jwe s PRO 27 Ca 0.80 1.87 -0.06 0.00 0.04 0.00 0.00 61.00 63.66 1jwe s PRO 27 Cb -0.50 -3.60 0.10 0.00 0.04 0.00 0.00 34.50 30.55 1jwe s PRO 27 CO 0.36 -0.56 0.62 0.72 0.04 0.00 0.00 177.00 178.18 1jwe n HIS 28 N 5.47 -3.77 -1.64 0.56 8.25 -1.26 -4.91 115.22 117.91 1jwe n HIS 28 Ca 0.13 -0.67 0.05 0.00 -0.26 0.00 0.00 57.72 56.97 1jwe n HIS 28 Cb 0.44 -0.47 0.08 0.00 1.12 0.00 0.00 29.99 31.16 1jwe n HIS 28 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1jwe n SER 29 N -3.30 1.25 -0.08 0.41 3.41 -1.26 -4.99 113.62 109.06 1jwe n SER 29 Ca 0.08 -2.66 -0.02 0.00 -0.26 0.00 0.00 58.87 56.01 1jwe n SER 29 Cb 0.29 -0.34 -0.02 0.00 -0.26 0.00 0.00 64.21 63.88 1jwe n SER 29 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1jwe n ILE 30 N -0.65 -0.12 0.01 -1.33 2.08 -1.26 -0.38 119.36 117.71 1jwe n ILE 30 Ca 0.09 0.75 -0.04 0.00 0.56 0.00 0.00 62.75 64.12 1jwe n ILE 30 Cb 0.73 -0.96 0.19 0.00 -0.75 0.00 0.00 39.64 38.84 1jwe n ILE 30 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 1jwe h GLU 31 N 0.00 0.51 0.03 0.38 5.08 -1.98 0.28 114.58 118.89 1jwe h GLU 31 Ca 0.03 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1jwe h GLU 31 Cb 0.07 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1jwe h GLU 31 CO -0.17 0.72 -0.02 0.00 -1.00 0.00 0.00 179.01 178.54 1jwe h ALA 32 N 1.29 -0.04 -0.86 3.43 0.00 -1.37 -2.26 119.26 119.44 1jwe h ALA 32 Ca 0.07 -0.16 0.15 0.00 0.00 0.00 0.00 54.91 54.97 1jwe h ALA 32 Cb 0.67 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.39 1jwe h ALA 32 CO 0.05 -0.37 0.45 0.93 0.00 0.00 0.00 179.25 180.31 1jwe h GLU 33 N -0.35 0.62 0.17 0.00 5.08 -0.46 0.12 114.58 119.76 1jwe h GLU 33 Ca -0.00 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1jwe h GLU 33 Cb 0.33 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1jwe h GLU 33 CO 0.01 0.41 -0.08 1.96 -1.00 0.00 0.00 179.01 180.31 1jwe h GLN 34 N 0.64 -0.22 0.00 2.33 1.08 -0.41 -1.68 115.11 116.84 1jwe h GLN 34 Ca 0.47 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.68 1jwe h GLN 34 Cb 0.66 0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 28.14 1jwe h GLN 34 CO -0.36 -0.14 -0.01 0.77 -0.95 0.00 0.00 178.83 178.14 1jwe h SER 35 N -0.23 0.00 0.55 1.46 0.02 -0.63 0.16 113.55 114.87 1jwe h SER 35 Ca -0.02 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 1jwe h SER 35 Cb 0.18 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.72 1jwe h SER 35 CO 0.04 0.01 -0.26 0.58 -1.14 0.00 0.00 176.83 176.05 1jwe h VAL 36 N 0.00 0.13 -0.42 2.27 2.07 -0.44 -0.41 116.25 119.45 1jwe h VAL 36 Ca -0.00 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 1jwe h VAL 36 Cb 0.43 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1jwe h VAL 36 CO 0.00 0.02 0.23 -0.07 0.02 0.00 0.00 177.57 177.78 1jwe h LEU 37 N -1.14 0.52 -0.51 2.57 3.38 -1.01 -0.18 115.31 118.94 1jwe h LEU 37 Ca -0.07 -0.08 0.08 0.00 0.09 0.00 0.00 57.88 57.89 1jwe h LEU 37 Cb 0.60 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.15 1jwe h LEU 37 CO 0.12 0.45 0.14 1.23 0.09 0.00 0.00 178.44 180.48 1jwe h GLY 38 N 0.55 0.66 1.70 0.83 0.00 -0.81 -1.48 103.07 104.51 1jwe h GLY 38 Ca 0.15 -0.06 -0.06 0.00 0.00 0.00 0.00 47.33 47.36 1jwe h GLY 38 CO -0.02 -0.04 -0.11 -1.33 0.00 0.00 0.00 176.54 175.04 1jwe h GLY 39 N 0.30 0.40 1.21 4.60 0.00 0.10 0.05 103.07 109.73 1jwe h GLY 39 Ca 0.26 -0.26 -0.16 0.00 0.00 0.00 0.00 47.33 47.16 1jwe h GLY 39 CO -0.30 0.24 -0.44 1.41 0.00 0.00 0.00 176.54 177.45 1jwe h LEU 40 N 0.35 0.93 -0.80 3.11 3.38 -0.60 0.85 115.31 122.53 1jwe h LEU 40 Ca 0.07 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 1jwe h LEU 40 Cb 0.41 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 1jwe h LEU 40 CO 0.02 1.23 0.47 0.24 0.09 0.00 0.00 178.44 180.49 1jwe h MET 41 N 0.69 1.10 -0.24 1.13 2.86 -0.80 -2.83 114.93 116.83 1jwe h MET 41 Ca 0.04 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 1jwe h MET 41 Cb 1.02 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.45 1jwe h MET 41 CO 0.10 0.79 0.07 1.25 1.06 0.00 0.00 176.91 180.18 1jwe h LEU 42 N 1.10 0.35 -6.72 1.22 6.46 -0.68 -3.41 115.31 113.63 1jwe h LEU 42 Ca 0.29 -0.21 -0.41 0.00 -0.12 0.00 0.00 57.88 57.42 1jwe h LEU 42 Cb -0.02 -0.09 -0.37 0.00 -0.73 0.00 0.00 40.66 39.45 1jwe h LEU 42 CO -0.05 0.47 -0.70 -0.62 -0.62 0.00 0.00 178.44 176.92 1jwe s ASP 43 N -5.73 2.38 0.55 1.25 2.15 0.26 -5.03 116.67 112.50 1jwe s ASP 43 Ca -0.14 -0.83 0.29 0.00 0.43 0.00 0.00 52.55 52.31 1jwe s ASP 43 Cb 0.08 0.09 1.62 0.00 -0.30 0.00 0.00 42.92 44.40 1jwe s ASP 43 CO 0.72 -0.39 2.14 0.78 -0.17 0.00 0.00 175.17 178.25 1jwe h ASN 44 N 8.34 0.00 0.38 -0.34 -0.26 -1.75 -2.19 115.58 119.76 1jwe h ASN 44 Ca -0.17 0.00 -0.04 0.00 -0.56 0.00 0.00 56.30 55.54 1jwe h ASN 44 Cb 1.07 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.33 1jwe h ASN 44 CO 0.36 0.07 -0.17 -0.33 -1.06 0.00 0.00 177.43 176.30 1jwe h GLU 45 N 0.00 0.00 0.00 0.81 5.08 -1.94 -1.89 114.58 116.63 1jwe h GLU 45 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1jwe h GLU 45 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1jwe h GLU 45 CO 0.01 0.17 0.00 0.54 -1.00 0.00 0.00 179.01 178.73 1jwe n ARG 46 N -3.79 0.68 -0.18 2.33 5.12 -0.82 -2.50 116.66 117.49 1jwe n ARG 46 Ca -0.02 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 55.90 1jwe n ARG 46 Cb 0.28 -1.39 0.09 0.00 -1.16 0.00 0.00 32.46 30.28 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 0.14 -0.16 -1.55 2.91 -1.52 -0.30 115.95 115.47 1jwe h TRP 47 Ca 0.00 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.04 1jwe h TRP 47 Cb 0.00 0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 28.66 1jwe h TRP 47 CO 0.00 -0.04 0.04 -0.44 -1.03 0.00 0.00 178.44 176.96 1jwe h ASP 48 N 0.22 0.19 0.53 2.65 5.19 -1.74 0.26 116.42 123.72 1jwe h ASP 48 Ca 0.28 -0.01 -0.29 0.00 -0.62 0.00 0.00 57.03 56.39 1jwe h ASP 48 Cb 0.41 -0.05 0.01 0.00 0.18 0.00 0.00 39.33 39.89 1jwe h ASP 48 CO -0.39 0.21 -1.34 -0.78 -3.12 0.00 0.00 179.24 173.82 1jwe h ASP 49 N 0.22 0.51 0.14 6.45 3.58 -1.46 -0.92 116.42 124.94 1jwe h ASP 49 Ca 0.06 -0.57 -0.01 0.00 0.42 0.00 0.00 57.03 56.93 1jwe h ASP 49 Cb 0.09 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 40.98 1jwe h ASP 49 CO -0.00 1.45 -0.07 0.58 -2.88 0.00 0.00 179.24 178.32 1jwe h VAL 50 N 0.09 0.56 0.00 2.25 2.07 -0.92 -3.35 116.25 116.94 1jwe h VAL 50 Ca -0.18 -1.16 0.00 0.00 0.82 0.00 0.00 66.70 66.18 1jwe h VAL 50 Cb 2.02 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.78 1jwe h VAL 50 CO 0.21 0.17 0.00 0.00 0.02 0.00 0.00 177.57 177.97 1jwe n ALA 51 N -2.67 1.32 0.17 1.67 0.00 0.89 -0.60 120.51 121.29 1jwe n ALA 51 Ca -0.05 0.16 0.05 0.00 0.00 0.00 0.00 53.44 53.59 1jwe n ALA 51 Cb 0.20 -1.36 0.22 0.00 0.00 0.00 0.00 19.45 18.52 1jwe n ALA 51 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1jwe h GLU 52 N 0.00 0.00 0.06 0.00 4.11 -1.29 -3.33 114.58 114.12 1jwe h GLU 52 Ca 0.00 0.00 -0.37 0.00 0.07 0.00 0.00 59.36 59.06 1jwe h GLU 52 Cb 0.17 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 1jwe h GLU 52 CO 0.00 0.41 -2.20 0.54 0.07 0.00 0.00 179.01 177.82 1jwe n ARG 53 N -3.37 0.70 -4.43 1.06 1.74 0.23 -5.04 116.66 107.54 1jwe n ARG 53 Ca 0.01 0.23 -0.21 0.00 -0.77 0.00 0.00 57.85 57.10 1jwe n ARG 53 Cb 0.59 -1.62 -0.10 0.00 -1.02 0.00 0.00 32.46 30.31 1jwe n ARG 53 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1jwe s VAL 54 N -2.53 1.80 0.33 1.55 -7.23 -0.05 -4.85 120.40 109.42 1jwe s VAL 54 Ca -0.29 -2.18 0.03 0.00 -1.81 0.00 0.00 61.98 57.74 1jwe s VAL 54 Cb 0.08 -2.37 -0.04 0.00 0.56 0.00 0.00 36.38 34.60 1jwe s VAL 54 CO 0.68 -0.36 0.11 0.68 -0.31 0.00 0.00 175.10 175.90 1jwe s VAL 55 N -2.92 0.71 0.33 1.32 -7.23 -1.26 -4.27 120.40 107.08 1jwe s VAL 55 Ca 0.28 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.50 1jwe s VAL 55 Cb 0.02 -2.58 0.30 0.00 0.56 0.00 0.00 36.38 34.68 1jwe s VAL 55 CO 0.12 0.00 1.90 0.00 -0.31 0.00 0.00 175.10 176.81 1jwe h ALA 56 N 2.10 1.67 -0.01 1.32 0.00 -1.93 -2.21 119.26 120.19 1jwe h ALA 56 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1jwe h ALA 56 Cb 1.25 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1jwe h ALA 56 CO 0.60 0.15 0.06 -0.44 0.00 0.00 0.00 179.25 179.62 1jwe h ASP 57 N 0.85 0.00 1.30 0.00 5.19 -1.97 -1.50 116.42 120.29 1jwe h ASP 57 Ca 0.40 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.73 1jwe h ASP 57 Cb 0.42 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.92 1jwe h ASP 57 CO -0.17 0.00 -0.37 0.44 -3.12 0.00 0.00 179.24 176.03 1jwe h ASP 58 N 0.00 0.00 -3.14 6.45 3.32 -1.77 -3.40 116.42 117.87 1jwe h ASP 58 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 1jwe h ASP 58 Cb 0.12 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 39.57 1jwe h ASP 58 CO -0.00 0.37 0.76 -0.36 -1.72 0.00 0.00 179.24 178.28 1jwe s PHE 59 N -3.25 2.69 0.09 4.55 0.40 -0.57 -4.40 117.98 117.50 1jwe s PHE 59 Ca 0.03 0.15 0.29 0.00 -0.60 0.00 0.00 56.93 56.80 1jwe s PHE 59 Cb 0.08 -4.29 1.15 0.00 0.51 0.00 0.00 43.02 40.47 1jwe s PHE 59 CO 0.70 -1.49 1.91 -0.92 0.70 0.00 0.00 175.22 176.12 1jwe h TYR 60 N 9.45 0.00 -2.25 0.36 3.20 -1.84 -3.43 116.97 122.46 1jwe h TYR 60 Ca -0.26 0.00 -0.52 0.00 3.14 0.00 0.00 58.73 61.09 1jwe h TYR 60 Cb 1.07 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.28 1jwe h TYR 60 CO 0.97 0.09 1.21 0.95 -1.64 0.00 0.00 178.16 179.75 1jwe s THR 61 N -3.65 3.55 0.24 1.81 -4.23 -1.26 -4.93 115.64 107.17 1jwe s THR 61 Ca 0.01 0.35 -0.05 0.00 -1.18 0.00 0.00 61.69 60.82 1jwe s THR 61 Cb 0.09 -4.36 0.23 0.00 1.34 0.00 0.00 72.50 69.81 1jwe s THR 61 CO 0.59 -1.28 1.69 -0.09 -0.54 0.00 0.00 174.62 174.99 1jwe h ARG 62 N 12.60 0.28 -0.51 3.99 2.43 -1.99 0.22 114.38 131.40 1jwe h ARG 62 Ca -0.27 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 58.77 1jwe h ARG 62 Cb 1.11 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.58 1jwe h ARG 62 CO 1.23 0.19 -0.12 -1.00 -1.51 0.00 0.00 179.97 178.76 1jwe h PRO 63 N 0.29 0.97 -0.64 0.20 0.13 -1.91 0.09 132.00 131.13 1jwe h PRO 63 Ca 0.41 -0.35 -0.01 0.00 -0.87 0.00 0.00 66.00 65.18 1jwe h PRO 63 Cb 0.70 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 31.73 1jwe h PRO 63 CO -0.50 1.02 0.34 0.45 -0.23 0.00 0.00 178.00 179.09 1jwe h HIS 64 N 0.86 0.87 0.19 1.56 3.86 -1.54 -2.34 115.15 118.60 1jwe h HIS 64 Ca 0.13 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 1jwe h HIS 64 Cb 0.67 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.86 1jwe h HIS 64 CO 0.04 0.61 -0.09 -0.09 0.86 0.00 0.00 177.93 179.27 1jwe h ARG 65 N 0.89 -0.24 -0.65 2.45 2.43 -0.23 -1.21 114.38 117.83 1jwe h ARG 65 Ca 0.23 0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.53 1jwe h ARG 65 Cb 0.04 0.05 -0.12 0.00 -0.42 0.00 0.00 29.97 29.52 1jwe h ARG 65 CO -0.04 0.04 -0.31 0.45 -1.51 0.00 0.00 179.97 178.61 1jwe h HIS 66 N -0.52 -0.82 -0.17 2.20 3.86 -0.88 0.21 115.15 119.03 1jwe h HIS 66 Ca -0.03 0.07 -0.00 0.00 -1.16 0.00 0.00 60.37 59.25 1jwe h HIS 66 Cb 0.39 0.46 -0.01 0.00 1.06 0.00 0.00 27.41 29.31 1jwe h HIS 66 CO 0.01 -0.37 0.09 0.82 0.86 0.00 0.00 177.93 179.34 1jwe h ILE 67 N -0.12 1.11 -0.55 2.45 2.04 -1.32 -1.02 117.51 120.10 1jwe h ILE 67 Ca 0.27 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 1jwe h ILE 67 Cb 0.55 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.61 1jwe h ILE 67 CO -0.72 0.10 0.28 0.15 0.00 0.00 0.00 178.15 177.96 1jwe h PHE 68 N 0.16 0.78 0.00 1.37 3.57 -0.43 -0.57 116.94 121.83 1jwe h PHE 68 Ca 0.06 -0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 1jwe h PHE 68 Cb 0.08 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 1jwe h PHE 68 CO -0.04 0.59 -0.29 1.15 -2.23 0.00 0.00 178.31 177.49 1jwe h THR 69 N 0.74 1.21 -0.01 4.41 2.02 -0.39 0.66 112.91 121.55 1jwe h THR 69 Ca 0.19 -1.01 -0.23 0.00 0.77 0.00 0.00 66.41 66.13 1jwe h THR 69 Cb 0.09 1.54 0.01 0.00 -1.74 0.00 0.00 68.15 68.05 1jwe h THR 69 CO -0.03 0.29 -0.95 -0.08 0.37 0.00 0.00 175.52 175.12 1jwe h GLU 70 N 0.00 0.47 -0.28 6.66 4.57 -0.71 0.45 114.58 125.74 1jwe h GLU 70 Ca -0.00 -0.50 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 1jwe h GLU 70 Cb 0.52 0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.24 1jwe h GLU 70 CO 0.04 1.15 0.18 0.52 -1.18 0.00 0.00 179.01 179.71 1jwe h MET 71 N 0.27 0.37 -0.93 1.92 2.86 -0.70 -0.41 114.93 118.31 1jwe h MET 71 Ca -0.09 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1jwe h MET 71 Cb 1.59 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 33.12 1jwe h MET 71 CO 0.17 0.27 0.60 0.00 1.06 0.00 0.00 176.91 179.00 1jwe h ALA 72 N 1.08 1.19 0.49 6.32 0.00 -0.76 -0.06 119.26 127.51 1jwe h ALA 72 Ca 0.10 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1jwe h ALA 72 Cb -0.02 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.40 1jwe h ALA 72 CO -0.02 0.61 -0.23 -0.09 0.00 0.00 0.00 179.25 179.52 1jwe h ARG 73 N 1.28 -0.63 -0.47 0.00 9.65 -0.69 -1.35 114.38 122.17 1jwe h ARG 73 Ca 0.34 0.04 0.04 0.00 -1.10 0.00 0.00 59.98 59.31 1jwe h ARG 73 Cb -0.11 0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 28.57 1jwe h ARG 73 CO -0.07 -0.41 0.22 -0.07 2.80 0.00 0.00 179.97 182.44 1jwe h LEU 74 N -0.67 0.30 -0.65 3.80 3.38 -0.62 0.13 115.31 120.98 1jwe h LEU 74 Ca -0.07 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1jwe h LEU 74 Cb 0.51 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 1jwe h LEU 74 CO 0.11 0.21 0.35 -0.61 0.09 0.00 0.00 178.44 178.59 1jwe h GLN 75 N 0.44 0.91 -0.70 1.13 5.75 -1.01 0.23 115.11 121.87 1jwe h GLN 75 Ca 0.21 -0.11 0.02 0.00 -0.15 0.00 0.00 58.65 58.62 1jwe h GLN 75 Cb 0.14 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 28.47 1jwe h GLN 75 CO -0.16 0.69 0.46 1.49 -2.65 0.00 0.00 178.83 178.66 1jwe h GLU 76 N 0.89 0.86 -0.11 1.69 4.22 -0.47 -1.01 114.58 120.64 1jwe h GLU 76 Ca 0.23 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.62 1jwe h GLU 76 Cb 0.05 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.11 1jwe h GLU 76 CO -0.04 0.57 0.00 0.43 -2.18 0.00 0.00 179.01 177.80 1jwe n SER 77 N -4.44 0.67 -1.32 1.04 7.64 0.40 -4.88 113.62 112.73 1jwe n SER 77 Ca 0.08 -1.88 -0.13 0.00 1.01 0.00 0.00 58.87 57.95 1jwe n SER 77 Cb 0.08 -0.07 -0.02 0.00 -1.01 0.00 0.00 64.21 63.19 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 0.76 0.22 3.72 0.23 0.00 -0.35 -4.99 105.19 104.78 1jwe n GLY 78 Ca 0.07 -0.38 -0.23 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.54 4.86 0.98 1.61 0.01 0.68 -4.99 113.70 114.31 1jwe s SER 79 Ca 0.00 -0.58 -0.11 0.00 1.31 0.00 0.00 55.95 56.57 1jwe s SER 79 Cb 0.00 -0.95 0.18 0.00 0.21 0.00 0.00 66.02 65.46 1jwe s SER 79 CO 0.00 -0.11 1.11 -2.84 0.41 0.00 0.00 173.24 171.81 1jwe s PRO 80 N -3.78 0.54 -0.04 12.44 0.02 -1.26 -4.03 135.00 138.89 1jwe s PRO 80 Ca 0.34 1.33 0.06 0.00 0.02 0.00 0.00 61.00 62.75 1jwe s PRO 80 Cb -0.06 -1.69 0.09 0.00 0.02 0.00 0.00 34.50 32.87 1jwe s PRO 80 CO 0.22 -2.88 0.96 0.44 -0.33 0.00 0.00 177.00 175.41 1jwe n ILE 81 N -4.39 0.92 -0.84 2.83 -5.35 -1.26 -4.71 119.36 106.56 1jwe n ILE 81 Ca 0.09 -1.04 -0.30 0.00 -0.27 0.00 0.00 62.75 61.23 1jwe n ILE 81 Cb 0.53 0.35 0.18 0.00 -1.74 0.00 0.00 39.64 38.96 1jwe n ILE 81 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 1jwe s ASP 82 N -1.43 2.53 0.07 7.28 1.47 -1.26 -4.27 116.67 121.06 1jwe s ASP 82 Ca 0.10 1.72 -0.19 0.00 1.18 0.00 0.00 52.55 55.36 1jwe s ASP 82 Cb 0.09 -2.35 -0.07 0.00 -0.34 0.00 0.00 42.92 40.25 1jwe s ASP 82 CO 0.01 -3.27 1.32 0.25 0.68 0.00 0.00 175.17 174.16 1jwe h LEU 83 N -1.98 -0.99 -0.84 2.11 7.12 -1.93 -0.87 115.31 117.93 1jwe h LEU 83 Ca -0.51 0.12 -0.06 0.00 0.13 0.00 0.00 57.88 57.55 1jwe h LEU 83 Cb 1.29 0.39 -0.03 0.00 -0.53 0.00 0.00 40.66 41.78 1jwe h LEU 83 CO 0.49 -0.28 0.16 0.40 -0.13 0.00 0.00 178.44 179.08 1jwe h ILE 84 N -0.34 1.25 -0.33 4.05 5.03 -1.98 0.13 117.51 125.32 1jwe h ILE 84 Ca 0.02 -0.92 0.03 0.00 -0.12 0.00 0.00 64.86 63.86 1jwe h ILE 84 Cb 0.39 0.58 -0.03 0.00 -3.03 0.00 0.00 36.82 34.73 1jwe h ILE 84 CO -0.25 0.35 0.15 0.74 -0.68 0.00 0.00 178.15 178.46 1jwe h THR 85 N 0.98 0.96 -0.36 -0.27 2.02 -1.85 -0.52 112.91 113.86 1jwe h THR 85 Ca 0.21 -0.11 -0.04 0.00 0.77 0.00 0.00 66.41 67.24 1jwe h THR 85 Cb 0.34 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 1jwe h THR 85 CO 0.00 0.06 0.07 0.25 0.37 0.00 0.00 175.52 176.26 1jwe h LEU 86 N 0.31 0.57 0.26 2.58 5.85 -0.47 -1.06 115.31 123.35 1jwe h LEU 86 Ca 0.14 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1jwe h LEU 86 Cb 0.07 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 1jwe h LEU 86 CO -0.11 0.67 -0.26 0.00 -0.34 0.00 0.00 178.44 178.40 1jwe h ALA 87 N 0.91 -0.54 0.00 1.25 0.00 -0.60 -1.20 119.26 119.09 1jwe h ALA 87 Ca 0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1jwe h ALA 87 Cb 0.34 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1jwe h ALA 87 CO 0.01 -0.83 -0.06 0.93 0.00 0.00 0.00 179.25 179.29 1jwe h GLU 88 N -0.55 0.00 0.23 0.00 4.39 -1.00 0.12 114.58 117.76 1jwe h GLU 88 Ca -0.01 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1jwe h GLU 88 Cb 0.51 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 1jwe h GLU 88 CO -0.06 0.06 -0.11 1.03 -1.16 0.00 0.00 179.01 178.77 1jwe h SER 89 N 0.00 -0.26 -0.33 1.42 0.87 -0.49 -0.83 113.55 113.92 1jwe h SER 89 Ca -0.00 -0.21 -0.00 0.00 -1.23 0.00 0.00 61.79 60.35 1jwe h SER 89 Cb 0.13 0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 1jwe h SER 89 CO 0.01 0.08 0.20 -0.07 -0.53 0.00 0.00 176.83 176.52 1jwe h LEU 90 N -0.63 0.41 -0.47 2.23 3.38 -0.64 -1.54 115.31 118.05 1jwe h LEU 90 Ca -0.03 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1jwe h LEU 90 Cb 0.45 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1jwe h LEU 90 CO 0.05 0.33 0.02 -0.33 0.09 0.00 0.00 178.44 178.60 1jwe h GLU 91 N 0.48 0.82 -0.09 1.13 5.08 -0.70 0.79 114.58 122.09 1jwe h GLU 91 Ca 0.13 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 1jwe h GLU 91 Cb -0.00 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1jwe h GLU 91 CO -0.02 0.85 -0.01 0.00 -1.00 0.00 0.00 179.01 178.83 1jwe h ARG 92 N 0.67 0.12 0.00 2.33 3.08 -0.39 0.09 114.38 120.28 1jwe h ARG 92 Ca 0.14 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1jwe h ARG 92 Cb 0.47 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1jwe h ARG 92 CO 0.02 0.14 0.00 1.96 -1.07 0.00 0.00 179.97 181.02 1jwe h GLN 93 N 0.12 0.00 -4.61 0.04 1.08 -0.80 -3.47 115.11 107.46 1jwe h GLN 93 Ca 0.03 0.00 -0.34 0.00 -1.45 0.00 0.00 58.65 56.89 1jwe h GLN 93 Cb 0.10 0.00 0.09 0.00 -0.05 0.00 0.00 27.48 27.63 1jwe h GLN 93 CO 0.00 0.00 -0.55 0.41 -0.95 0.00 0.00 178.83 177.74 1jwe n GLY 94 N 0.46 -0.32 0.00 3.46 0.00 0.02 -4.92 105.19 103.88 1jwe n GLY 94 Ca 0.02 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 -4.01 0.96 -0.01 1.61 6.02 0.12 -4.74 117.38 117.32 1jwe n GLN 95 Ca -0.03 -0.88 -0.10 0.00 -0.01 0.00 0.00 57.00 55.98 1jwe n GLN 95 Cb 0.57 -0.88 -0.04 0.00 1.02 0.00 0.00 30.24 30.90 1jwe n GLN 95 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1jwe h LEU 96 N 0.00 -0.13 -0.84 1.08 5.85 -1.83 -2.20 115.31 117.25 1jwe h LEU 96 Ca 0.00 0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 1jwe h LEU 96 Cb 0.40 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 1jwe h LEU 96 CO 0.00 -0.05 0.21 -0.78 -0.34 0.00 0.00 178.44 177.49 1jwe h ASP 97 N -0.01 1.01 0.03 1.25 1.82 -1.90 0.11 116.42 118.73 1jwe h ASP 97 Ca 0.06 -0.18 0.00 0.00 -0.39 0.00 0.00 57.03 56.52 1jwe h ASP 97 Cb 0.10 -0.26 0.00 0.00 0.68 0.00 0.00 39.33 39.85 1jwe h ASP 97 CO -0.13 0.94 0.00 -0.24 -1.61 0.00 0.00 179.24 178.20 1jwe n SER 98 N -4.26 0.00 -0.05 2.28 2.88 -0.86 -0.76 113.62 112.85 1jwe n SER 98 Ca 0.06 0.16 0.02 0.00 -1.33 0.00 0.00 58.87 57.77 1jwe n SER 98 Cb 0.23 -0.20 -0.01 0.00 -0.75 0.00 0.00 64.21 63.47 1jwe n SER 98 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1jwe n VAL 99 N -1.20 0.00 0.00 2.46 0.24 -0.95 -4.79 118.33 114.09 1jwe n VAL 99 Ca 0.01 -0.44 0.00 0.00 -2.04 0.00 0.00 64.34 61.87 1jwe n VAL 99 Cb 0.02 1.03 0.00 0.00 -1.47 0.00 0.00 33.84 33.41 1jwe n VAL 99 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jwe n GLY 100 N 0.83 1.64 0.47 7.63 0.00 0.06 -4.85 105.19 110.96 1jwe n GLY 100 Ca 0.01 0.00 0.03 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 -0.20 -2.20 0.28 -0.02 0.00 0.34 -3.21 105.19 100.17 1jwe n GLY 101 Ca 0.00 -1.48 0.08 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.20 0.14 -0.44 1.61 3.04 -1.98 -2.40 116.94 116.72 1jwe h PHE 102 Ca 0.00 0.00 0.05 0.00 3.98 0.00 0.00 57.97 62.01 1jwe h PHE 102 Cb 0.20 -0.05 -0.05 0.00 2.56 0.00 0.00 35.95 38.61 1jwe h PHE 102 CO 0.00 0.09 0.17 0.00 -2.02 0.00 0.00 178.31 176.55 1jwe h ALA 103 N 1.92 0.53 -0.52 2.41 0.00 -1.98 0.27 119.26 121.88 1jwe h ALA 103 Ca 0.05 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1jwe h ALA 103 Cb 0.04 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1jwe h ALA 103 CO -0.01 -0.22 -0.00 -0.92 0.00 0.00 0.00 179.25 178.10 1jwe h TYR 104 N 0.35 0.95 -0.24 0.00 3.20 -1.40 0.27 116.97 120.10 1jwe h TYR 104 Ca 0.20 -0.14 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1jwe h TYR 104 Cb 0.18 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 1jwe h TYR 104 CO -0.14 0.86 0.07 -0.07 -1.64 0.00 0.00 178.16 177.24 1jwe h LEU 105 N 0.82 0.35 -1.37 2.82 3.38 -1.37 -2.64 115.31 117.29 1jwe h LEU 105 Ca 0.15 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1jwe h LEU 105 Cb 0.49 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1jwe h LEU 105 CO 0.02 0.47 0.22 0.00 0.09 0.00 0.00 178.44 179.25 1jwe h ALA 106 N 0.89 1.52 0.49 1.53 0.00 0.07 -0.34 119.26 123.42 1jwe h ALA 106 Ca 0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1jwe h ALA 106 Cb 0.25 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1jwe h ALA 106 CO -0.00 0.39 -0.25 1.49 0.00 0.00 0.00 179.25 180.87 1jwe h GLU 107 N 0.65 -0.66 -0.45 0.00 4.81 -0.88 -2.88 114.58 115.16 1jwe h GLU 107 Ca 0.16 0.05 0.09 0.00 -0.13 0.00 0.00 59.36 59.53 1jwe h GLU 107 Cb 0.07 0.15 -0.08 0.00 0.63 0.00 0.00 28.75 29.53 1jwe h GLU 107 CO -0.02 -0.44 -0.03 -0.07 -0.73 0.00 0.00 179.01 177.71 1jwe h LEU 108 N -0.69 -0.26 -1.66 1.64 3.38 -0.99 -1.92 115.31 114.82 1jwe h LEU 108 Ca -0.06 0.12 0.13 0.00 0.09 0.00 0.00 57.88 58.15 1jwe h LEU 108 Cb 0.54 0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 1jwe h LEU 108 CO 0.10 -0.09 0.45 -1.28 0.09 0.00 0.00 178.44 177.70 1jwe h SER 109 N 0.07 0.33 -0.58 -0.43 0.87 -0.98 -0.11 113.55 112.73 1jwe h SER 109 Ca 0.22 0.01 -0.39 0.00 -1.23 0.00 0.00 61.79 60.40 1jwe h SER 109 Cb 0.33 -0.05 -0.26 0.00 -0.44 0.00 0.00 62.40 61.98 1jwe h SER 109 CO -0.40 0.18 -0.30 1.17 -0.53 0.00 0.00 176.83 176.95 1jwe n LYS 110 N -4.46 2.69 -2.72 2.24 4.81 -0.79 -4.65 118.16 115.28 1jwe n LYS 110 Ca 0.12 -3.64 -0.18 0.00 -0.87 0.00 0.00 58.31 53.74 1jwe n LYS 110 Cb 0.47 -2.06 0.00 0.00 0.02 0.00 0.00 35.03 33.46 1jwe n LYS 110 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1jwe n ASN 111 N -0.92 2.74 -3.75 3.14 5.15 -0.05 -4.98 115.26 116.59 1jwe n ASN 111 Ca 0.41 -3.19 -0.13 0.00 -0.60 0.00 0.00 54.58 51.07 1jwe n ASN 111 Cb 0.91 -0.53 -0.11 0.00 -0.53 0.00 0.00 39.78 39.53 1jwe n ASN 111 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1jwe s THR 112 N -3.94 -0.00 -1.23 -0.44 2.01 -1.26 -3.56 115.64 107.21 1jwe s THR 112 Ca 0.38 0.02 -0.20 0.00 0.31 0.00 0.00 61.69 62.20 1jwe s THR 112 Cb 0.40 -0.46 -0.01 0.00 0.01 0.00 0.00 72.50 72.44 1jwe s THR 112 CO -0.07 0.01 1.87 -0.81 -0.69 0.00 0.00 174.62 174.92 1jwe n PRO 113 N 3.09 2.44 -3.75 4.92 -0.04 -1.26 -4.58 135.00 135.82 1jwe n PRO 113 Ca -0.14 -2.81 -0.29 0.00 -0.04 0.00 0.00 63.50 60.21 1jwe n PRO 113 Cb 0.57 -3.53 -0.01 0.00 -0.04 0.00 0.00 33.50 30.49 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 10.45 -3.73 0.00 3.54 7.64 -1.26 -0.75 113.62 129.51 1jwe n SER 114 Ca 0.48 -0.66 0.00 0.00 1.01 0.00 0.00 58.87 59.70 1jwe n SER 114 Cb 0.45 -3.06 0.00 0.00 -1.01 0.00 0.00 64.21 60.60 1jwe n SER 114 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jwe n ALA 115 N -3.99 0.00 0.31 -0.43 0.00 -1.26 -4.84 120.51 110.30 1jwe n ALA 115 Ca 0.03 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.66 1jwe n ALA 115 Cb 0.52 -0.92 1.03 0.00 0.00 0.00 0.00 19.45 20.08 1jwe n ALA 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jwe h ALA 116 N 0.00 1.14 0.00 0.00 0.00 -1.33 -1.47 119.26 117.59 1jwe h ALA 116 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1jwe h ALA 116 Cb 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1jwe h ALA 116 CO 0.00 0.02 -0.02 0.09 0.00 0.00 0.00 179.25 179.34 1jwe n ASN 117 N -3.31 1.98 -0.24 0.00 3.02 -1.26 -4.85 115.26 110.60 1jwe n ASN 117 Ca -0.02 -2.43 -0.00 0.00 -0.03 0.00 0.00 54.58 52.09 1jwe n ASN 117 Cb 0.12 -0.20 0.11 0.00 -0.61 0.00 0.00 39.78 39.21 1jwe n ASN 117 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1jwe h ILE 118 N 0.44 0.93 -0.64 2.41 2.10 -1.59 -0.35 117.51 120.81 1jwe h ILE 118 Ca 0.00 -0.23 0.04 0.00 1.08 0.00 0.00 64.86 65.74 1jwe h ILE 118 Cb 0.78 0.19 -0.04 0.00 -1.09 0.00 0.00 36.82 36.66 1jwe h ILE 118 CO 0.00 0.12 0.39 0.28 -1.08 0.00 0.00 178.15 177.86 1jwe h SER 119 N 0.68 0.62 -0.40 2.19 0.02 -1.88 0.52 113.55 115.30 1jwe h SER 119 Ca 0.32 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.22 1jwe h SER 119 Cb 0.25 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1jwe h SER 119 CO -0.21 0.42 -0.00 0.00 -1.14 0.00 0.00 176.83 175.90 1jwe h ALA 120 N 1.29 0.54 -0.34 3.77 0.00 -1.59 -1.53 119.26 121.40 1jwe h ALA 120 Ca 0.27 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1jwe h ALA 120 Cb 0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1jwe h ALA 120 CO -0.12 0.33 0.11 1.88 0.00 0.00 0.00 179.25 181.44 1jwe h TYR 121 N 0.54 0.54 -0.67 0.00 0.05 -0.63 -2.05 116.97 114.76 1jwe h TYR 121 Ca 0.11 -0.05 0.01 0.00 0.05 0.00 0.00 58.73 58.85 1jwe h TYR 121 Cb 0.49 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 38.04 1jwe h TYR 121 CO 0.04 0.53 0.44 0.00 -1.05 0.00 0.00 178.16 178.12 1jwe h ALA 122 N 0.95 1.53 -0.69 3.88 0.00 -0.78 -0.50 119.26 123.65 1jwe h ALA 122 Ca 0.11 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1jwe h ALA 122 Cb 0.24 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1jwe h ALA 122 CO -0.00 0.43 0.30 0.22 0.00 0.00 0.00 179.25 180.19 1jwe h ASP 123 N 0.90 0.91 -0.12 0.00 3.58 -0.91 -0.77 116.42 120.00 1jwe h ASP 123 Ca 0.25 -0.12 -0.18 0.00 0.42 0.00 0.00 57.03 57.40 1jwe h ASP 123 Cb -0.09 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 40.72 1jwe h ASP 123 CO -0.05 0.80 -0.58 0.40 -2.88 0.00 0.00 179.24 176.93 1jwe h ILE 124 N 0.99 1.30 -0.35 2.25 2.04 -0.55 -0.07 117.51 123.11 1jwe h ILE 124 Ca 0.24 -1.80 -0.03 0.00 1.00 0.00 0.00 64.86 64.27 1jwe h ILE 124 Cb 0.16 1.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 1jwe h ILE 124 CO -0.02 0.57 0.11 0.58 0.00 0.00 0.00 178.15 179.38 1jwe h VAL 125 N 0.54 1.21 -0.99 1.67 2.07 -0.82 -1.31 116.25 118.63 1jwe h VAL 125 Ca 0.00 -0.69 0.07 0.00 0.82 0.00 0.00 66.70 66.90 1jwe h VAL 125 Cb 1.16 1.00 -0.07 0.00 -1.52 0.00 0.00 31.29 31.86 1jwe h VAL 125 CO 0.12 0.24 0.64 -0.09 0.02 0.00 0.00 177.57 178.50 1jwe h ARG 126 N 0.42 1.12 0.38 1.57 9.65 -1.08 -0.31 114.38 126.12 1jwe h ARG 126 Ca 0.11 -0.07 -0.01 0.00 -1.10 0.00 0.00 59.98 58.92 1jwe h ARG 126 Cb 0.26 -0.25 -0.02 0.00 -1.39 0.00 0.00 29.97 28.57 1jwe h ARG 126 CO -0.00 0.74 -0.32 1.49 2.80 0.00 0.00 179.97 184.68 1jwe h GLU 127 N 1.15 -0.68 -0.18 0.20 4.81 -0.51 0.49 114.58 119.86 1jwe h GLU 127 Ca 0.43 0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.71 1jwe h GLU 127 Cb 0.18 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1jwe h GLU 127 CO -0.17 -0.45 0.12 0.00 -0.73 0.00 0.00 179.01 177.78 1jwe h ARG 128 N -0.70 0.22 -0.26 1.92 2.47 -0.78 0.11 114.38 117.35 1jwe h ARG 128 Ca -0.03 -0.01 -0.11 0.00 -1.26 0.00 0.00 59.98 58.57 1jwe h ARG 128 Cb 0.62 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 28.88 1jwe h ARG 128 CO -0.02 0.15 -0.25 0.00 0.56 0.00 0.00 179.97 180.41 1jwe h ALA 129 N 1.89 0.39 -0.50 0.04 0.00 -0.64 -1.27 119.26 119.17 1jwe h ALA 129 Ca 0.07 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.53 1jwe h ALA 129 Cb 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1jwe h ALA 129 CO -0.01 0.37 0.04 0.28 0.00 0.00 0.00 179.25 179.92 1jwe h VAL 130 N 0.36 1.24 -0.62 0.00 2.07 0.15 -0.86 116.25 118.59 1jwe h VAL 130 Ca 0.04 -0.94 -0.05 0.00 0.82 0.00 0.00 66.70 66.57 1jwe h VAL 130 Cb 0.81 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 1jwe h VAL 130 CO 0.06 0.34 0.20 0.58 0.02 0.00 0.00 177.57 178.77 1jwe h VAL 131 N 0.76 1.23 -0.17 2.57 2.07 -0.77 -0.24 116.25 121.71 1jwe h VAL 131 Ca 0.15 -0.80 -0.07 0.00 0.82 0.00 0.00 66.70 66.80 1jwe h VAL 131 Cb 0.40 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1jwe h VAL 131 CO 0.01 0.31 -0.22 -0.09 0.02 0.00 0.00 177.57 177.61 1jwe h ARG 132 N 0.92 0.30 0.08 1.57 1.12 -0.49 -3.30 114.38 114.56 1jwe h ARG 132 Ca 0.21 -0.09 -0.31 0.00 -1.11 0.00 0.00 59.98 58.67 1jwe h ARG 132 Cb 0.26 -0.03 -0.03 0.00 -0.01 0.00 0.00 29.97 30.17 1jwe h ARG 132 CO -0.01 0.51 -1.69 1.05 -3.11 0.00 0.00 179.97 176.72 1jwe h GLU 133 N 0.27 0.16 -0.92 0.20 4.11 -0.51 -3.38 114.58 114.51 1jwe h GLU 133 Ca 0.05 -0.27 -0.24 0.00 0.07 0.00 0.00 59.36 58.96 1jwe h GLU 133 Cb 0.54 0.10 -0.14 0.00 0.50 0.00 0.00 28.75 29.75 1jwe h GLU 133 CO 0.04 0.93 0.31 -1.33 0.07 0.00 0.00 179.01 179.02 1jwe n MET 134 N -3.32 2.32 -0.28 1.06 2.81 -0.16 -4.66 117.12 114.89 1jwe n MET 134 Ca -0.20 -2.00 -0.06 0.00 -1.81 0.00 0.00 57.70 53.63 1jwe n MET 134 Cb 1.04 -1.84 -0.01 0.00 -0.71 0.00 0.00 33.22 31.70 1jwe n MET 134 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1jwe h ILE 135 N 1.22 0.07 0.00 2.02 1.08 -1.75 -3.49 117.51 116.66 1jwe h ILE 135 Ca 0.30 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.77 1jwe h ILE 135 Cb 2.01 0.07 0.00 0.00 -3.07 0.00 0.00 36.82 35.83 1jwe h ILE 135 CO 0.61 0.00 0.00 -1.20 -0.69 0.00 0.00 178.15 176.87