#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 1.24 -0.13 2.12 2.20 -1.26 -5.07 119.74 118.85 1jwe s LYS 24 Ca 0.00 0.82 -0.08 0.00 -0.36 0.00 0.00 55.97 56.35 1jwe s LYS 24 Cb 0.00 -1.81 -0.04 0.00 -1.51 0.00 0.00 37.83 34.47 1jwe s LYS 24 CO 0.00 -2.25 0.16 0.08 -0.36 0.00 0.00 175.35 172.98 1jwe s VAL 25 N -2.93 5.45 0.92 4.02 1.01 -1.26 -5.11 120.40 122.50 1jwe s VAL 25 Ca 0.63 0.26 -0.11 0.00 0.00 0.00 0.00 61.98 62.76 1jwe s VAL 25 Cb -0.18 -3.44 0.14 0.00 0.00 0.00 0.00 36.38 32.90 1jwe s VAL 25 CO 0.57 0.57 1.09 -2.16 0.00 0.00 0.00 175.10 175.18 1jwe s PRO 26 N -0.72 1.08 0.30 2.72 0.04 -1.26 -4.99 135.00 132.18 1jwe s PRO 26 Ca 0.14 0.97 -0.29 0.00 0.04 0.00 0.00 61.00 61.86 1jwe s PRO 26 Cb -0.12 -1.78 -0.10 0.00 0.04 0.00 0.00 34.50 32.54 1jwe s PRO 26 CO 0.04 -2.41 1.24 -1.25 0.04 0.00 0.00 177.00 174.66 1jwe s PRO 27 N -4.83 4.45 -0.22 0.56 0.04 -1.26 -5.02 135.00 128.72 1jwe s PRO 27 Ca 0.64 2.07 -0.02 0.00 0.04 0.00 0.00 61.00 63.73 1jwe s PRO 27 Cb -0.19 -3.12 0.07 0.00 0.04 0.00 0.00 34.50 31.29 1jwe s PRO 27 CO 0.58 -0.06 0.03 -1.01 0.04 0.00 0.00 177.00 176.58 1jwe s HIS 28 N -1.04 1.35 -0.05 0.56 3.76 -1.26 -4.75 115.29 113.85 1jwe s HIS 28 Ca 0.48 -1.14 -0.05 0.00 -0.15 0.00 0.00 55.06 54.20 1jwe s HIS 28 Cb -0.37 -1.22 -0.21 0.00 1.11 0.00 0.00 32.58 31.90 1jwe s HIS 28 CO 0.48 -0.68 3.40 0.43 -0.85 0.00 0.00 174.74 177.52 1jwe n SER 29 N 4.96 5.40 -0.28 1.40 7.64 -1.26 -4.63 113.62 126.84 1jwe n SER 29 Ca -0.08 -2.56 0.01 0.00 1.01 0.00 0.00 58.87 57.24 1jwe n SER 29 Cb 0.46 -1.37 0.14 0.00 -1.01 0.00 0.00 64.21 62.42 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 1.92 0.97 0.00 0.44 5.03 -1.98 -1.37 117.51 122.51 1jwe h ILE 30 Ca 0.20 -0.28 -0.06 0.00 -0.12 0.00 0.00 64.86 64.59 1jwe h ILE 30 Cb 1.39 0.07 -0.01 0.00 -3.03 0.00 0.00 36.82 35.24 1jwe h ILE 30 CO 0.29 0.15 -0.30 -0.33 -0.68 0.00 0.00 178.15 177.28 1jwe h GLU 31 N 0.82 0.00 -0.34 2.37 5.08 -2.00 0.78 114.58 121.29 1jwe h GLU 31 Ca 0.36 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.63 1jwe h GLU 31 Cb 0.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1jwe h GLU 31 CO -0.20 0.30 -0.14 0.00 -1.00 0.00 0.00 179.01 177.97 1jwe h ALA 32 N 1.70 0.48 -0.81 3.43 0.00 -1.67 -3.01 119.26 119.37 1jwe h ALA 32 Ca -0.00 -0.33 0.11 0.00 0.00 0.00 0.00 54.91 54.68 1jwe h ALA 32 Cb 0.57 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 1jwe h ALA 32 CO 0.04 0.37 0.53 1.05 0.00 0.00 0.00 179.25 181.24 1jwe h GLU 33 N 0.48 0.69 -0.02 0.00 4.11 -0.40 -1.95 114.58 117.49 1jwe h GLU 33 Ca 0.08 -0.04 -0.03 0.00 0.07 0.00 0.00 59.36 59.44 1jwe h GLU 33 Cb 0.66 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 1jwe h GLU 33 CO 0.04 0.46 -0.11 1.96 0.07 0.00 0.00 179.01 181.44 1jwe h GLN 34 N 0.71 0.03 0.00 1.06 4.20 -0.75 0.88 115.11 121.24 1jwe h GLN 34 Ca 0.38 -0.00 -0.08 0.00 0.06 0.00 0.00 58.65 59.01 1jwe h GLN 34 Cb 0.51 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 1jwe h GLN 34 CO -0.15 0.14 -0.38 0.77 -0.67 0.00 0.00 178.83 178.54 1jwe h SER 35 N 0.03 0.00 0.46 1.46 0.02 -1.36 0.54 113.55 114.70 1jwe h SER 35 Ca 0.01 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1jwe h SER 35 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1jwe h SER 35 CO 0.01 0.38 -0.22 0.58 -1.14 0.00 0.00 176.83 176.44 1jwe h VAL 36 N 0.00 0.36 -0.34 2.27 2.07 -0.83 -1.03 116.25 118.75 1jwe h VAL 36 Ca -0.00 -0.52 0.06 0.00 0.82 0.00 0.00 66.70 67.05 1jwe h VAL 36 Cb 0.93 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.18 1jwe h VAL 36 CO 0.05 0.06 0.01 -0.07 0.02 0.00 0.00 177.57 177.65 1jwe h LEU 37 N -0.99 -0.11 -0.22 2.57 3.38 -1.12 -1.21 115.31 117.60 1jwe h LEU 37 Ca -0.06 0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.00 1jwe h LEU 37 Cb 0.58 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 1jwe h LEU 37 CO 0.10 -0.02 0.08 1.23 0.09 0.00 0.00 178.44 179.93 1jwe h GLY 38 N 0.11 0.28 2.00 0.83 0.00 -0.99 -2.84 103.07 102.46 1jwe h GLY 38 Ca 0.16 -0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 1jwe h GLY 38 CO -0.26 0.04 -0.05 -1.33 0.00 0.00 0.00 176.54 174.93 1jwe h GLY 39 N 0.19 0.00 0.78 4.60 0.00 -0.08 -2.33 103.07 106.24 1jwe h GLY 39 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.35 1jwe h GLY 39 CO -0.09 0.00 -0.21 1.41 0.00 0.00 0.00 176.54 177.65 1jwe h LEU 40 N 0.00 0.46 -1.43 3.11 3.38 -1.01 0.15 115.31 119.96 1jwe h LEU 40 Ca -0.00 -0.51 -0.06 0.00 0.09 0.00 0.00 57.88 57.40 1jwe h LEU 40 Cb 0.21 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1jwe h LEU 40 CO 0.01 0.88 -0.29 0.24 0.09 0.00 0.00 178.44 179.36 1jwe h MET 41 N 0.05 0.00 0.07 1.13 2.86 -1.53 -3.11 114.93 114.39 1jwe h MET 41 Ca 0.02 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.40 1jwe h MET 41 Cb 0.77 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.43 1jwe h MET 41 CO 0.05 0.29 -1.10 1.25 1.06 0.00 0.00 176.91 178.46 1jwe h LEU 42 N 0.00 0.54 -6.56 1.22 6.46 -1.02 -3.41 115.31 112.54 1jwe h LEU 42 Ca -0.00 -0.49 -0.53 0.00 -0.12 0.00 0.00 57.88 56.73 1jwe h LEU 42 Cb 0.53 -0.17 -0.38 0.00 -0.73 0.00 0.00 40.66 39.91 1jwe h LEU 42 CO 0.04 1.33 -0.81 -0.62 -0.62 0.00 0.00 178.44 177.75 1jwe s ASP 43 N -7.16 2.67 0.54 1.25 2.15 0.48 -4.95 116.67 111.65 1jwe s ASP 43 Ca -0.06 -1.97 0.21 0.00 0.43 0.00 0.00 52.55 51.16 1jwe s ASP 43 Cb 0.08 -0.20 1.39 0.00 -0.30 0.00 0.00 42.92 43.89 1jwe s ASP 43 CO 0.88 -0.31 2.12 0.78 -0.17 0.00 0.00 175.17 178.47 1jwe h ASN 44 N 7.17 0.00 1.22 -0.34 4.21 -1.77 -0.21 115.58 125.87 1jwe h ASN 44 Ca 0.03 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.54 1jwe h ASN 44 Cb 0.99 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.19 1jwe h ASN 44 CO 0.27 0.00 0.00 -0.62 -1.29 0.00 0.00 177.43 175.79 1jwe n GLU 45 N -4.36 0.13 0.00 0.81 1.02 -1.26 -2.53 120.64 114.45 1jwe n GLU 45 Ca 0.00 0.11 0.10 0.00 -0.02 0.00 0.00 57.16 57.36 1jwe n GLU 45 Cb 0.23 -1.65 0.56 0.00 -0.02 0.00 0.00 31.44 30.56 1jwe n GLU 45 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1jwe n ARG 46 N -1.88 0.39 -0.26 3.49 5.12 -0.09 -3.48 116.66 119.94 1jwe n ARG 46 Ca 0.06 0.07 -0.01 0.00 -1.93 0.00 0.00 57.85 56.04 1jwe n ARG 46 Cb 0.38 -1.50 0.05 0.00 -1.16 0.00 0.00 32.46 30.23 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 -0.72 -0.59 -1.55 2.91 -1.63 -0.45 115.95 113.92 1jwe h TRP 47 Ca 0.00 0.08 -0.06 0.00 1.13 0.00 0.00 58.89 60.04 1jwe h TRP 47 Cb 0.15 0.43 -0.03 0.00 -0.51 0.00 0.00 29.16 29.20 1jwe h TRP 47 CO 0.00 -0.36 0.13 0.22 -1.03 0.00 0.00 178.44 177.40 1jwe h ASP 48 N -0.07 0.87 -0.21 2.65 3.58 -1.83 0.28 116.42 121.69 1jwe h ASP 48 Ca 0.31 -0.17 -0.03 0.00 0.42 0.00 0.00 57.03 57.56 1jwe h ASP 48 Cb 0.57 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.38 1jwe h ASP 48 CO -0.78 0.85 0.02 -0.78 -2.88 0.00 0.00 179.24 175.68 1jwe h ASP 49 N 0.88 0.34 0.12 2.28 1.82 -1.63 0.18 116.42 120.42 1jwe h ASP 49 Ca 0.19 -0.28 -0.01 0.00 -0.39 0.00 0.00 57.03 56.54 1jwe h ASP 49 Cb 0.34 -0.09 0.00 0.00 0.68 0.00 0.00 39.33 40.26 1jwe h ASP 49 CO 0.00 0.54 -0.06 0.58 -1.61 0.00 0.00 179.24 178.69 1jwe h VAL 50 N 0.13 0.99 0.00 2.25 2.07 -0.94 -2.87 116.25 117.88 1jwe h VAL 50 Ca 0.06 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.14 1jwe h VAL 50 Cb 0.35 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1jwe h VAL 50 CO 0.01 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.70 1jwe h ALA 51 N 0.48 1.00 -0.07 1.67 0.00 -0.20 0.25 119.26 122.39 1jwe h ALA 51 Ca -0.02 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.71 1jwe h ALA 51 Cb 0.30 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1jwe h ALA 51 CO 0.03 0.00 -0.73 0.93 0.00 0.00 0.00 179.25 179.47 1jwe h GLU 52 N 0.00 0.36 0.00 0.00 4.39 -0.51 -3.36 114.58 115.46 1jwe h GLU 52 Ca 0.00 -0.30 -0.13 0.00 0.34 0.00 0.00 59.36 59.27 1jwe h GLU 52 Cb 0.24 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 1jwe h GLU 52 CO 0.00 0.94 -1.95 0.54 -1.16 0.00 0.00 179.01 177.38 1jwe n ARG 53 N -3.82 0.66 -3.98 2.33 5.12 0.57 -4.99 116.66 112.56 1jwe n ARG 53 Ca -0.04 -0.06 -0.10 0.00 -1.93 0.00 0.00 57.85 55.73 1jwe n ARG 53 Cb 0.71 -1.59 -0.07 0.00 -1.16 0.00 0.00 32.46 30.35 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 -3.12 0.06 0.31 1.55 -7.23 0.49 -4.59 120.40 107.87 1jwe s VAL 54 Ca -0.07 -1.43 0.03 0.00 -1.81 0.00 0.00 61.98 58.70 1jwe s VAL 54 Cb 0.11 -1.89 -0.05 0.00 0.56 0.00 0.00 36.38 35.10 1jwe s VAL 54 CO 0.86 -0.28 0.09 0.68 -0.31 0.00 0.00 175.10 176.14 1jwe s VAL 55 N -3.98 0.85 0.56 1.32 -7.23 -1.26 -4.19 120.40 106.47 1jwe s VAL 55 Ca 0.18 -2.00 0.26 0.00 -1.81 0.00 0.00 61.98 58.61 1jwe s VAL 55 Cb 0.03 -2.67 0.36 0.00 0.56 0.00 0.00 36.38 34.66 1jwe s VAL 55 CO 0.01 0.00 2.05 0.00 -0.31 0.00 0.00 175.10 176.85 1jwe h ALA 56 N 2.18 2.09 0.00 1.32 0.00 -1.95 -1.98 119.26 120.92 1jwe h ALA 56 Ca -0.39 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1jwe h ALA 56 Cb 1.25 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 1jwe h ALA 56 CO 0.64 -0.41 -0.05 0.22 0.00 0.00 0.00 179.25 179.65 1jwe h ASP 57 N 0.00 0.00 0.00 0.00 3.58 -1.97 -3.26 116.42 114.76 1jwe h ASP 57 Ca 0.14 0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.38 1jwe h ASP 57 Cb 0.66 0.00 0.02 0.00 1.72 0.00 0.00 39.33 41.73 1jwe h ASP 57 CO -0.00 0.05 -0.83 0.44 -2.88 0.00 0.00 179.24 176.02 1jwe h ASP 58 N 0.00 0.73 -4.26 2.28 3.32 -1.75 -3.44 116.42 113.30 1jwe h ASP 58 Ca -0.00 -0.75 -0.52 0.00 0.02 0.00 0.00 57.03 55.78 1jwe h ASP 58 Cb 0.96 -0.22 0.20 0.00 0.22 0.00 0.00 39.33 40.48 1jwe h ASP 58 CO 0.01 1.38 0.25 -0.36 -1.72 0.00 0.00 179.24 178.80 1jwe s PHE 59 N -3.26 1.63 0.00 4.55 0.08 -1.23 -4.52 117.98 115.23 1jwe s PHE 59 Ca -0.11 1.78 0.00 0.00 0.12 0.00 0.00 56.93 58.71 1jwe s PHE 59 Cb 0.05 -3.38 0.00 0.00 -0.57 0.00 0.00 43.02 39.12 1jwe s PHE 59 CO 0.87 -2.85 0.00 0.98 -0.10 0.00 0.00 175.22 174.12 1jwe n TYR 60 N -4.06 0.00 -2.97 0.36 9.36 -1.26 -4.93 117.16 113.66 1jwe n TYR 60 Ca 0.12 0.00 -0.28 0.00 3.32 0.00 0.00 57.90 61.07 1jwe n TYR 60 Cb 0.52 0.00 -0.02 0.00 -0.63 0.00 0.00 39.34 39.21 1jwe n TYR 60 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 1jwe s THR 61 N -1.78 4.94 0.15 2.97 -4.23 -1.26 -4.90 115.64 111.53 1jwe s THR 61 Ca 0.00 0.16 -0.23 0.00 -1.18 0.00 0.00 61.69 60.43 1jwe s THR 61 Cb 0.00 -3.80 0.02 0.00 1.34 0.00 0.00 72.50 70.06 1jwe s THR 61 CO 0.00 -0.60 1.62 -0.09 -0.54 0.00 0.00 174.62 175.01 1jwe h ARG 62 N 0.90 -0.27 -0.08 3.99 2.43 -1.98 -0.01 114.38 119.35 1jwe h ARG 62 Ca -0.48 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 58.71 1jwe h ARG 62 Cb 1.20 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.81 1jwe h ARG 62 CO 0.63 -0.18 0.04 -1.00 -1.51 0.00 0.00 179.97 177.94 1jwe h PRO 63 N -0.28 0.12 -0.20 0.20 0.13 -1.89 -1.76 132.00 128.32 1jwe h PRO 63 Ca 0.13 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 65.25 1jwe h PRO 63 Cb 0.49 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.59 1jwe h PRO 63 CO -0.40 0.22 0.12 0.45 -0.23 0.00 0.00 178.00 178.16 1jwe h HIS 64 N -0.01 0.22 -0.54 1.56 3.86 -1.89 -1.90 115.15 116.44 1jwe h HIS 64 Ca 0.03 0.01 -0.11 0.00 -1.16 0.00 0.00 60.37 59.14 1jwe h HIS 64 Cb 0.14 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.52 1jwe h HIS 64 CO -0.02 0.13 -0.08 0.00 0.86 0.00 0.00 177.93 178.82 1jwe h ARG 65 N 0.24 1.01 -0.56 2.45 3.08 -0.96 -2.07 114.38 117.58 1jwe h ARG 65 Ca 0.08 -0.36 0.10 0.00 0.07 0.00 0.00 59.98 59.86 1jwe h ARG 65 Cb -0.01 -0.07 -0.08 0.00 0.08 0.00 0.00 29.97 29.89 1jwe h ARG 65 CO -0.03 1.05 0.13 1.25 -1.07 0.00 0.00 179.97 181.29 1jwe h HIS 66 N 0.89 0.21 0.35 3.04 2.76 -1.08 0.16 115.15 121.49 1jwe h HIS 66 Ca 0.14 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.34 1jwe h HIS 66 Cb 0.64 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.57 1jwe h HIS 66 CO 0.05 -0.00 -0.30 0.82 -1.30 0.00 0.00 177.93 177.19 1jwe h ILE 67 N 0.27 0.37 -0.41 6.26 2.04 -0.73 0.10 117.51 125.41 1jwe h ILE 67 Ca 0.28 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 66.07 1jwe h ILE 67 Cb 0.39 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 1jwe h ILE 67 CO -0.35 0.00 -0.06 0.15 0.00 0.00 0.00 178.15 177.88 1jwe h PHE 68 N -0.67 0.75 -0.73 1.37 3.57 -1.14 0.20 116.94 120.30 1jwe h PHE 68 Ca -0.03 -0.12 -0.01 0.00 3.53 0.00 0.00 57.97 61.35 1jwe h PHE 68 Cb 0.59 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 1jwe h PHE 68 CO -0.16 0.74 0.40 1.15 -2.23 0.00 0.00 178.31 178.22 1jwe h THR 69 N 0.65 1.22 -0.26 4.41 2.02 -0.77 0.29 112.91 120.47 1jwe h THR 69 Ca 0.12 -0.55 -0.10 0.00 0.77 0.00 0.00 66.41 66.65 1jwe h THR 69 Cb 0.50 0.25 -0.00 0.00 -1.74 0.00 0.00 68.15 67.16 1jwe h THR 69 CO 0.03 0.24 -0.23 -0.08 0.37 0.00 0.00 175.52 175.85 1jwe h GLU 70 N 1.00 0.61 0.01 6.66 4.57 -0.06 -0.16 114.58 127.22 1jwe h GLU 70 Ca 0.26 -0.31 0.03 0.00 -1.18 0.00 0.00 59.36 58.15 1jwe h GLU 70 Cb 0.03 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.59 1jwe h GLU 70 CO -0.04 0.91 -0.18 0.52 -1.18 0.00 0.00 179.01 179.03 1jwe h MET 71 N 0.33 -0.29 -0.41 1.92 2.86 -0.90 0.16 114.93 118.60 1jwe h MET 71 Ca 0.04 0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.74 1jwe h MET 71 Cb 0.78 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.47 1jwe h MET 71 CO 0.06 -0.19 0.18 0.00 1.06 0.00 0.00 176.91 178.02 1jwe h ALA 72 N 0.60 0.50 -0.07 6.32 0.00 -0.77 -0.55 119.26 125.29 1jwe h ALA 72 Ca 0.05 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.80 1jwe h ALA 72 Cb 0.37 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1jwe h ALA 72 CO -0.17 -0.19 -0.75 0.07 0.00 0.00 0.00 179.25 178.21 1jwe h ARG 73 N 0.38 0.39 0.01 0.00 0.11 -0.85 -2.02 114.38 112.39 1jwe h ARG 73 Ca 0.18 -0.33 -0.00 0.00 0.10 0.00 0.00 59.98 59.93 1jwe h ARG 73 Cb 0.11 0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.26 1jwe h ARG 73 CO -0.14 0.97 -0.00 -0.07 0.10 0.00 0.00 179.97 180.82 1jwe h LEU 74 N 0.26 -0.01 -1.25 0.08 3.38 -0.68 -2.08 115.31 115.00 1jwe h LEU 74 Ca -0.03 -0.05 0.08 0.00 0.09 0.00 0.00 57.88 57.97 1jwe h LEU 74 Cb 1.33 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.03 1jwe h LEU 74 CO 0.13 0.05 0.55 -0.61 0.09 0.00 0.00 178.44 178.64 1jwe h GLN 75 N -0.06 0.83 -0.57 1.13 5.75 -0.89 0.14 115.11 121.44 1jwe h GLN 75 Ca -0.00 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.44 1jwe h GLN 75 Cb 0.06 -0.19 -0.03 0.00 1.07 0.00 0.00 27.48 28.39 1jwe h GLN 75 CO 0.00 0.55 0.34 1.49 -2.65 0.00 0.00 178.83 178.57 1jwe h GLU 76 N 0.86 0.78 -0.41 1.69 4.57 -1.00 -1.42 114.58 119.65 1jwe h GLU 76 Ca 0.38 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.48 1jwe h GLU 76 Cb 0.34 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 1jwe h GLU 76 CO -0.15 0.57 0.00 -1.13 -1.18 0.00 0.00 179.01 177.12 1jwe n SER 77 N -4.63 1.22 -0.61 1.04 3.41 -0.32 -4.88 113.62 108.85 1jwe n SER 77 Ca 0.04 -2.07 -0.07 0.00 -0.26 0.00 0.00 58.87 56.51 1jwe n SER 77 Cb 0.06 -0.25 -0.02 0.00 -0.26 0.00 0.00 64.21 63.74 1jwe n SER 77 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jwe n GLY 78 N 0.53 0.52 3.83 5.00 0.00 -0.48 -5.02 105.19 109.57 1jwe n GLY 78 Ca 0.05 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.83 6.03 0.89 1.61 0.01 0.34 -4.97 113.70 114.78 1jwe s SER 79 Ca 0.00 0.30 -0.11 0.00 1.31 0.00 0.00 55.95 57.45 1jwe s SER 79 Cb 0.00 -1.85 0.12 0.00 0.21 0.00 0.00 66.02 64.51 1jwe s SER 79 CO 0.00 0.33 1.09 -2.16 0.41 0.00 0.00 173.24 172.91 1jwe s PRO 80 N -1.45 1.31 -0.23 12.44 0.04 -1.26 -2.70 135.00 143.15 1jwe s PRO 80 Ca 0.20 0.87 0.06 0.00 0.04 0.00 0.00 61.00 62.18 1jwe s PRO 80 Cb -0.12 -1.81 0.52 0.00 0.04 0.00 0.00 34.50 33.13 1jwe s PRO 80 CO 0.10 -2.22 1.49 0.44 0.04 0.00 0.00 177.00 176.86 1jwe n ILE 81 N -3.87 2.20 -1.74 0.56 -5.35 -1.26 -4.62 119.36 105.27 1jwe n ILE 81 Ca 0.07 -1.13 -0.35 0.00 -0.27 0.00 0.00 62.75 61.07 1jwe n ILE 81 Cb 0.55 -0.48 0.06 0.00 -1.74 0.00 0.00 39.64 38.03 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 -0.56 4.71 0.09 7.28 -1.08 -1.26 -4.16 116.67 121.69 1jwe s ASP 82 Ca 0.38 2.41 -0.35 0.00 -0.52 0.00 0.00 52.55 54.47 1jwe s ASP 82 Cb 0.31 -2.60 -0.17 0.00 -1.46 0.00 0.00 42.92 39.00 1jwe s ASP 82 CO 0.09 -1.92 1.55 0.25 0.52 0.00 0.00 175.17 175.66 1jwe h LEU 83 N 0.36 -1.40 -0.67 -1.34 7.12 -1.93 0.39 115.31 117.83 1jwe h LEU 83 Ca -0.49 0.12 -0.14 0.00 0.13 0.00 0.00 57.88 57.49 1jwe h LEU 83 Cb 1.30 0.47 -0.01 0.00 -0.53 0.00 0.00 40.66 41.89 1jwe h LEU 83 CO 0.53 -0.65 -0.56 0.40 -0.13 0.00 0.00 178.44 178.02 1jwe h ILE 84 N -0.97 1.36 0.32 4.05 1.08 -1.98 -0.47 117.51 120.89 1jwe h ILE 84 Ca -0.06 -1.88 -0.01 0.00 -0.39 0.00 0.00 64.86 62.53 1jwe h ILE 84 Cb 0.85 1.91 -0.01 0.00 -3.07 0.00 0.00 36.82 36.50 1jwe h ILE 84 CO -0.09 0.56 -0.24 0.74 -0.69 0.00 0.00 178.15 178.44 1jwe h THR 85 N 0.23 0.50 -0.05 -0.27 2.02 -1.85 -1.40 112.91 112.09 1jwe h THR 85 Ca 0.00 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.20 1jwe h THR 85 Cb 1.06 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 1jwe h THR 85 CO 0.09 0.00 -0.05 0.25 0.37 0.00 0.00 175.52 176.18 1jwe h LEU 86 N -0.55 -0.16 0.02 2.58 5.85 -0.72 -0.09 115.31 122.25 1jwe h LEU 86 Ca -0.02 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.74 1jwe h LEU 86 Cb 0.48 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 1jwe h LEU 86 CO -0.00 -0.07 -0.06 0.00 -0.34 0.00 0.00 178.44 177.96 1jwe h ALA 87 N 0.97 -0.08 -0.02 1.25 0.00 -1.06 -0.14 119.26 120.19 1jwe h ALA 87 Ca 0.04 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1jwe h ALA 87 Cb 0.12 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1jwe h ALA 87 CO -0.09 -0.56 -0.32 0.93 0.00 0.00 0.00 179.25 179.21 1jwe h GLU 88 N -0.12 0.03 -0.49 0.00 5.08 -1.14 -2.07 114.58 115.87 1jwe h GLU 88 Ca 0.02 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.28 1jwe h GLU 88 Cb 0.14 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 1jwe h GLU 88 CO -0.05 0.35 -0.04 1.03 -1.00 0.00 0.00 179.01 179.30 1jwe h SER 89 N 0.03 0.89 -0.47 1.42 0.87 -0.36 0.12 113.55 116.04 1jwe h SER 89 Ca 0.00 -0.33 0.03 0.00 -1.23 0.00 0.00 61.79 60.27 1jwe h SER 89 Cb 0.57 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.27 1jwe h SER 89 CO 0.04 1.00 0.31 -0.07 -0.53 0.00 0.00 176.83 177.59 1jwe h LEU 90 N 0.75 0.45 -0.64 2.23 3.38 -0.84 -0.32 115.31 120.33 1jwe h LEU 90 Ca 0.13 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 1jwe h LEU 90 Cb 0.57 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1jwe h LEU 90 CO 0.03 0.32 -0.02 -0.08 0.09 0.00 0.00 178.44 178.78 1jwe h GLU 91 N 0.53 1.05 -0.54 1.13 4.81 -0.61 0.44 114.58 121.39 1jwe h GLU 91 Ca 0.19 -0.34 0.06 0.00 -0.13 0.00 0.00 59.36 59.15 1jwe h GLU 91 Cb 0.10 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.36 1jwe h GLU 91 CO -0.05 1.03 0.36 0.00 -0.73 0.00 0.00 179.01 179.62 1jwe h ARG 92 N 0.95 0.46 0.00 1.92 2.47 0.78 0.65 114.38 121.61 1jwe h ARG 92 Ca 0.17 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.86 1jwe h ARG 92 Cb 0.57 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.79 1jwe h ARG 92 CO 0.03 0.30 0.00 1.04 0.56 0.00 0.00 179.97 181.91 1jwe n GLN 93 N -4.47 0.24 -3.60 0.04 1.13 -0.30 -4.93 117.38 105.48 1jwe n GLN 93 Ca 0.08 0.28 -0.24 0.00 -1.94 0.00 0.00 57.00 55.18 1jwe n GLN 93 Cb 0.26 -1.82 0.08 0.00 0.11 0.00 0.00 30.24 28.86 1jwe n GLN 93 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1jwe n GLY 94 N 0.87 -0.52 0.11 1.08 0.00 0.22 -4.92 105.19 102.04 1jwe n GLY 94 Ca 0.04 0.23 0.01 0.00 0.00 0.00 0.00 46.02 46.30 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 -4.87 0.55 -0.29 1.61 1.13 0.07 -4.85 117.38 110.73 1jwe n GLN 95 Ca -0.03 -0.89 -0.06 0.00 -1.94 0.00 0.00 57.00 54.08 1jwe n GLN 95 Cb 0.57 -0.64 0.07 0.00 0.11 0.00 0.00 30.24 30.35 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 1.09 -1.23 1.08 5.85 -1.77 -0.97 115.31 119.36 1jwe h LEU 96 Ca 0.00 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 1jwe h LEU 96 Cb 1.01 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1jwe h LEU 96 CO 0.00 0.95 0.15 -0.78 -0.34 0.00 0.00 178.44 178.42 1jwe h ASP 97 N 1.15 0.63 0.25 1.25 3.58 -1.90 0.79 116.42 122.17 1jwe h ASP 97 Ca 0.27 -0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.62 1jwe h ASP 97 Cb 0.19 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 41.08 1jwe h ASP 97 CO -0.03 0.60 -0.06 -1.28 -2.88 0.00 0.00 179.24 175.60 1jwe h SER 98 N 0.68 0.00 1.14 2.28 0.87 -1.52 0.10 113.55 117.09 1jwe h SER 98 Ca 0.16 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 1jwe h SER 98 Cb 0.19 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 1jwe h SER 98 CO -0.01 0.06 -0.68 -0.37 -0.53 0.00 0.00 176.83 175.30 1jwe h VAL 99 N 0.00 0.00 0.00 2.23 -1.51 -1.14 -3.38 116.25 112.45 1jwe h VAL 99 Ca -0.00 -0.82 0.00 0.00 -1.23 0.00 0.00 66.70 64.65 1jwe h VAL 99 Cb 0.20 1.44 0.00 0.00 -2.13 0.00 0.00 31.29 30.80 1jwe h VAL 99 CO 0.01 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.96 1jwe n GLY 100 N 1.22 1.70 0.00 5.19 0.00 0.02 -4.84 105.19 108.49 1jwe n GLY 100 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.39 -1.06 0.36 -0.02 0.00 0.25 -3.58 105.19 100.75 1jwe n GLY 101 Ca 0.00 -1.64 0.11 0.00 0.00 0.00 0.00 46.02 44.50 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 1.09 -0.42 1.61 3.04 -1.95 -1.41 116.94 118.90 1jwe h PHE 102 Ca 0.00 0.03 0.11 0.00 3.98 0.00 0.00 57.97 62.09 1jwe h PHE 102 Cb 0.00 -0.33 -0.02 0.00 2.56 0.00 0.00 35.95 38.16 1jwe h PHE 102 CO 0.00 0.30 0.30 0.00 -2.02 0.00 0.00 178.31 176.89 1jwe h ALA 103 N 1.62 2.30 -0.26 2.41 0.00 -1.97 -0.27 119.26 123.09 1jwe h ALA 103 Ca 0.56 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.38 1jwe h ALA 103 Cb 0.79 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1jwe h ALA 103 CO -0.35 -0.41 -0.12 -0.92 0.00 0.00 0.00 179.25 177.45 1jwe h TYR 104 N 0.07 0.62 -0.45 0.00 3.20 -1.31 0.46 116.97 119.56 1jwe h TYR 104 Ca 0.20 -0.15 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 1jwe h TYR 104 Cb 0.69 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.80 1jwe h TYR 104 CO -0.00 0.79 0.15 -0.07 -1.64 0.00 0.00 178.16 177.39 1jwe h LEU 105 N 0.27 0.65 -0.83 2.82 3.38 -1.24 -0.03 115.31 120.32 1jwe h LEU 105 Ca 0.06 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1jwe h LEU 105 Cb 0.63 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 1jwe h LEU 105 CO 0.04 0.68 0.54 0.00 0.09 0.00 0.00 178.44 179.78 1jwe h ALA 106 N 1.00 1.06 -0.13 1.53 0.00 -1.08 -1.04 119.26 120.59 1jwe h ALA 106 Ca 0.15 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1jwe h ALA 106 Cb 0.25 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1jwe h ALA 106 CO -0.01 0.48 0.08 1.49 0.00 0.00 0.00 179.25 181.30 1jwe h GLU 107 N 1.13 0.18 -0.73 0.00 4.57 -0.48 -1.31 114.58 117.95 1jwe h GLU 107 Ca 0.30 -0.02 0.04 0.00 -1.18 0.00 0.00 59.36 58.51 1jwe h GLU 107 Cb -0.11 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.40 1jwe h GLU 107 CO -0.06 0.16 0.44 -0.07 -1.18 0.00 0.00 179.01 178.30 1jwe h LEU 108 N 0.15 0.71 -1.13 1.64 3.38 -0.63 0.24 115.31 119.66 1jwe h LEU 108 Ca 0.05 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.07 1jwe h LEU 108 Cb 0.03 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 1jwe h LEU 108 CO -0.01 0.47 0.59 -1.28 0.09 0.00 0.00 178.44 178.31 1jwe h SER 109 N 0.84 0.96 1.09 -0.43 0.87 -0.93 0.72 113.55 116.69 1jwe h SER 109 Ca 0.31 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.86 1jwe h SER 109 Cb 0.09 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 61.83 1jwe h SER 109 CO -0.14 0.65 0.00 0.11 -0.53 0.00 0.00 176.83 176.92 1jwe h LYS 110 N 1.11 0.00 -0.70 2.24 6.56 0.04 -3.34 116.57 122.48 1jwe h LYS 110 Ca 0.37 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.96 1jwe h LYS 110 Cb 0.05 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.71 1jwe h LYS 110 CO -0.12 0.00 0.00 -1.71 -2.06 0.00 0.00 179.45 175.56 1jwe n ASN 111 N -2.39 3.39 -3.88 0.86 2.85 0.25 -4.87 115.26 111.48 1jwe n ASN 111 Ca 0.03 -2.42 -0.15 0.00 -0.11 0.00 0.00 54.58 51.93 1jwe n ASN 111 Cb 0.32 -0.54 -0.15 0.00 1.24 0.00 0.00 39.78 40.65 1jwe n ASN 111 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1jwe s THR 112 N -1.89 0.19 -1.06 -0.44 2.01 -1.25 -4.39 115.64 108.83 1jwe s THR 112 Ca 0.30 -0.03 -0.19 0.00 0.31 0.00 0.00 61.69 62.08 1jwe s THR 112 Cb 0.22 -0.22 -0.08 0.00 0.01 0.00 0.00 72.50 72.43 1jwe s THR 112 CO 0.11 0.09 2.03 -0.81 -0.69 0.00 0.00 174.62 175.35 1jwe n PRO 113 N 3.46 2.05 0.00 4.92 -0.04 -1.26 -4.83 135.00 139.30 1jwe n PRO 113 Ca -0.18 -2.20 0.00 0.00 -0.04 0.00 0.00 63.50 61.08 1jwe n PRO 113 Cb 0.56 -3.11 0.00 0.00 -0.04 0.00 0.00 33.50 30.90 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 7.37 0.00 -0.42 3.54 7.64 -1.26 -0.95 113.62 129.54 1jwe n SER 114 Ca 0.50 0.00 0.01 0.00 1.01 0.00 0.00 58.87 60.39 1jwe n SER 114 Cb 0.40 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.62 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 7.62 1.99 -1.77 -0.43 0.00 -1.26 -4.41 120.51 122.26 1jwe n ALA 115 Ca 0.00 -1.18 -0.40 0.00 0.00 0.00 0.00 53.44 51.85 1jwe n ALA 115 Cb 0.00 -0.46 0.01 0.00 0.00 0.00 0.00 19.45 18.99 1jwe n ALA 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jwe s ALA 116 N -0.36 3.42 -1.78 0.00 0.00 -0.13 -2.87 121.76 120.04 1jwe s ALA 116 Ca 0.04 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.53 1jwe s ALA 116 Cb 0.03 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.55 1jwe s ALA 116 CO 0.00 -1.13 0.00 0.09 0.00 0.00 0.00 175.76 174.72 1jwe n ASN 117 N 0.15 -5.32 -0.27 0.00 3.02 -1.26 -4.75 115.26 106.82 1jwe n ASN 117 Ca 0.03 0.42 -0.00 0.00 -0.03 0.00 0.00 54.58 54.99 1jwe n ASN 117 Cb 0.40 -4.30 0.12 0.00 -0.61 0.00 0.00 39.78 35.39 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 0.00 1.02 -0.80 2.41 2.10 -1.90 -0.08 117.51 120.25 1jwe h ILE 118 Ca -0.34 -0.29 -0.01 0.00 1.08 0.00 0.00 64.86 65.29 1jwe h ILE 118 Cb 1.20 0.09 -0.04 0.00 -1.09 0.00 0.00 36.82 36.98 1jwe h ILE 118 CO 0.50 0.15 0.45 -1.28 -1.08 0.00 0.00 178.15 176.90 1jwe h SER 119 N 0.85 0.99 -0.64 2.19 0.87 -1.90 0.35 113.55 116.26 1jwe h SER 119 Ca 0.34 -0.09 -0.03 0.00 -1.23 0.00 0.00 61.79 60.77 1jwe h SER 119 Cb 0.17 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 61.84 1jwe h SER 119 CO -0.17 0.80 0.28 0.00 -0.53 0.00 0.00 176.83 177.21 1jwe h ALA 120 N 1.24 0.82 -0.54 6.23 0.00 -1.46 0.39 119.26 125.94 1jwe h ALA 120 Ca 0.28 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1jwe h ALA 120 Cb 0.02 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1jwe h ALA 120 CO -0.05 0.42 0.17 1.88 0.00 0.00 0.00 179.25 181.66 1jwe h TYR 121 N 0.88 0.87 -0.53 0.00 0.05 -0.91 -0.34 116.97 117.00 1jwe h TYR 121 Ca 0.22 -0.09 -0.08 0.00 0.05 0.00 0.00 58.73 58.82 1jwe h TYR 121 Cb 0.16 -0.25 -0.02 0.00 1.01 0.00 0.00 36.73 37.63 1jwe h TYR 121 CO 0.01 0.74 0.01 0.00 -1.05 0.00 0.00 178.16 177.87 1jwe h ALA 122 N 1.03 0.71 -0.41 3.88 0.00 -0.44 -1.52 119.26 122.51 1jwe h ALA 122 Ca 0.17 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1jwe h ALA 122 Cb 0.28 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1jwe h ALA 122 CO -0.00 0.52 -0.03 -0.44 0.00 0.00 0.00 179.25 179.29 1jwe h ASP 123 N 0.80 0.65 0.50 0.00 3.32 -0.12 0.84 116.42 122.40 1jwe h ASP 123 Ca 0.15 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1jwe h ASP 123 Cb 0.52 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 1jwe h ASP 123 CO 0.03 0.74 -0.37 0.40 -1.72 0.00 0.00 179.24 178.32 1jwe h ILE 124 N 0.63 0.25 -0.01 0.35 2.04 -0.87 -1.35 117.51 118.55 1jwe h ILE 124 Ca 0.12 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.02 1jwe h ILE 124 Cb 0.44 0.25 -0.05 0.00 -0.74 0.00 0.00 36.82 36.72 1jwe h ILE 124 CO 0.02 0.00 -0.29 0.58 0.00 0.00 0.00 178.15 178.46 1jwe h VAL 125 N -0.85 0.36 -0.50 1.67 2.07 -0.48 0.13 116.25 118.66 1jwe h VAL 125 Ca -0.05 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.38 1jwe h VAL 125 Cb 0.71 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 1jwe h VAL 125 CO 0.02 0.00 -0.03 -0.09 0.02 0.00 0.00 177.57 177.49 1jwe h ARG 126 N -0.42 0.85 0.16 1.57 1.12 -0.86 0.32 114.38 117.12 1jwe h ARG 126 Ca 0.07 -0.25 -0.01 0.00 -1.11 0.00 0.00 59.98 58.68 1jwe h ARG 126 Cb 0.52 -0.09 0.00 0.00 -0.01 0.00 0.00 29.97 30.39 1jwe h ARG 126 CO -0.25 0.87 -0.08 1.49 -3.11 0.00 0.00 179.97 178.89 1jwe h GLU 127 N 0.79 -0.21 0.00 0.20 4.81 -0.99 -1.72 114.58 117.45 1jwe h GLU 127 Ca 0.15 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 1jwe h GLU 127 Cb 0.51 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.94 1jwe h GLU 127 CO 0.03 -0.05 -0.04 0.00 -0.73 0.00 0.00 179.01 178.22 1jwe h ARG 128 N -0.33 0.00 -0.00 1.92 2.47 -0.29 0.14 114.38 118.29 1jwe h ARG 128 Ca -0.02 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1jwe h ARG 128 Cb 0.26 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.58 1jwe h ARG 128 CO 0.04 0.04 -0.00 0.00 0.56 0.00 0.00 179.97 180.60 1jwe h ALA 129 N 1.96 0.00 -0.69 0.04 0.00 -0.08 0.84 119.26 121.34 1jwe h ALA 129 Ca -0.00 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.61 1jwe h ALA 129 Cb 0.19 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1jwe h ALA 129 CO 0.00 -0.19 0.45 0.28 0.00 0.00 0.00 179.25 179.80 1jwe h VAL 130 N -0.60 1.17 -0.66 0.00 2.07 -0.52 -1.92 116.25 115.79 1jwe h VAL 130 Ca -0.00 -0.32 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 1jwe h VAL 130 Cb 0.61 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 1jwe h VAL 130 CO 0.00 0.17 0.23 0.58 0.02 0.00 0.00 177.57 178.57 1jwe h VAL 131 N 0.93 1.25 0.00 2.57 2.07 -0.78 -0.43 116.25 121.85 1jwe h VAL 131 Ca 0.25 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1jwe h VAL 131 Cb -0.10 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1jwe h VAL 131 CO -0.06 0.32 0.00 -0.09 0.02 0.00 0.00 177.57 177.76 1jwe h ARG 132 N 0.95 0.00 0.00 1.57 1.12 -0.23 -1.62 114.38 116.17 1jwe h ARG 132 Ca 0.22 0.00 -0.03 0.00 -1.11 0.00 0.00 59.98 59.06 1jwe h ARG 132 Cb 0.26 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.22 1jwe h ARG 132 CO -0.01 0.00 -0.23 1.49 -3.11 0.00 0.00 179.97 178.11 1jwe h GLU 133 N 0.00 0.00 -1.06 0.20 4.57 -0.48 -3.40 114.58 114.41 1jwe h GLU 133 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1jwe h GLU 133 Cb 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.65 1jwe h GLU 133 CO 0.00 0.45 0.00 -0.12 -1.18 0.00 0.00 179.01 178.16 1jwe n MET 134 N -4.66 0.70 -2.16 1.92 1.56 -0.29 -4.92 117.12 109.27 1jwe n MET 134 Ca -0.08 0.00 -0.36 0.00 -0.27 0.00 0.00 57.70 56.99 1jwe n MET 134 Cb 0.28 -1.23 0.01 0.00 2.15 0.00 0.00 33.22 34.43 1jwe n MET 134 CO 0.00 0.00 0.00 0.42 -0.73 0.00 0.00 175.97 175.66 1jwe s ILE 135 N -0.21 2.93 0.00 1.12 -1.09 -1.05 -4.96 121.20 117.93 1jwe s ILE 135 Ca 0.00 0.61 0.00 0.00 -2.23 0.00 0.00 60.65 59.03 1jwe s ILE 135 Cb 0.00 -3.27 0.00 0.00 -1.58 0.00 0.00 42.46 37.61 1jwe s ILE 135 CO 0.00 -0.09 0.42 -1.20 -1.23 0.00 0.00 174.94 172.84