#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 0.21 0.25 2.12 2.20 -1.26 -5.10 119.74 118.16 1jwe s LYS 24 Ca 0.00 0.64 0.00 0.00 -0.36 0.00 0.00 55.97 56.25 1jwe s LYS 24 Cb 0.00 -0.07 0.00 0.00 -1.51 0.00 0.00 37.83 36.25 1jwe s LYS 24 CO 0.00 -0.20 0.00 0.28 -0.36 0.00 0.00 175.35 175.07 1jwe n VAL 25 N 4.60 -2.51 -1.73 4.02 0.31 -1.26 -4.91 118.33 116.85 1jwe n VAL 25 Ca -0.19 0.98 -0.39 0.00 -0.01 0.00 0.00 64.34 64.73 1jwe n VAL 25 Cb 0.52 -1.40 0.04 0.00 -0.91 0.00 0.00 33.84 32.09 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 -1.25 1.64 -0.12 5.55 -0.04 -1.26 -4.93 135.00 134.59 1jwe n PRO 26 Ca 0.00 0.60 -0.11 0.00 -0.04 0.00 0.00 63.50 63.95 1jwe n PRO 26 Cb 0.06 -2.53 -0.02 0.00 -0.04 0.00 0.00 33.50 30.97 1jwe n PRO 26 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1jwe h PRO 27 N 1.40 0.68 0.00 0.54 0.13 -1.91 -3.49 132.00 129.36 1jwe h PRO 27 Ca -0.50 -0.26 0.03 0.00 -0.87 0.00 0.00 66.00 64.39 1jwe h PRO 27 Cb 1.31 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 1jwe h PRO 27 CO 0.57 0.84 -0.04 -2.39 -0.23 0.00 0.00 178.00 176.75 1jwe n HIS 28 N -4.40 -1.58 -2.87 1.56 1.44 -1.26 -4.91 115.22 103.20 1jwe n HIS 28 Ca -0.02 0.13 -0.03 0.00 -2.01 0.00 0.00 57.72 55.79 1jwe n HIS 28 Cb 0.34 -0.16 0.01 0.00 0.12 0.00 0.00 29.99 30.30 1jwe n HIS 28 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 1jwe s SER 29 N -3.76 -1.45 0.13 4.39 0.01 -1.26 -4.97 113.70 106.79 1jwe s SER 29 Ca 0.00 -1.47 -0.28 0.00 1.31 0.00 0.00 55.95 55.51 1jwe s SER 29 Cb 0.00 1.89 -0.04 0.00 0.21 0.00 0.00 66.02 68.08 1jwe s SER 29 CO 0.00 -0.08 1.59 0.40 0.41 0.00 0.00 173.24 175.56 1jwe h ILE 30 N 4.95 0.19 -0.25 1.44 1.08 -1.98 0.05 117.51 122.99 1jwe h ILE 30 Ca 0.06 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.44 1jwe h ILE 30 Cb 1.13 0.19 -0.01 0.00 -3.07 0.00 0.00 36.82 35.06 1jwe h ILE 30 CO 0.03 0.00 -0.23 -0.33 -0.69 0.00 0.00 178.15 176.93 1jwe h GLU 31 N -0.46 0.46 0.02 2.37 5.08 -1.98 0.21 114.58 120.28 1jwe h GLU 31 Ca 0.08 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1jwe h GLU 31 Cb 0.60 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1jwe h GLU 31 CO -0.38 0.66 -0.01 0.00 -1.00 0.00 0.00 179.01 178.28 1jwe h ALA 32 N 1.35 -0.03 -0.80 3.43 0.00 -1.90 -1.81 119.26 119.49 1jwe h ALA 32 Ca 0.06 -0.13 0.16 0.00 0.00 0.00 0.00 54.91 55.01 1jwe h ALA 32 Cb 0.62 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.32 1jwe h ALA 32 CO 0.04 -0.39 0.34 0.93 0.00 0.00 0.00 179.25 180.17 1jwe h GLU 33 N -0.28 0.44 0.68 0.00 5.08 -0.39 0.45 114.58 120.56 1jwe h GLU 33 Ca -0.00 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1jwe h GLU 33 Cb 0.27 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1jwe h GLU 33 CO 0.00 0.29 -0.48 1.96 -1.00 0.00 0.00 179.01 179.78 1jwe h GLN 34 N 0.45 -1.06 0.00 2.33 4.20 -0.50 -2.79 115.11 117.74 1jwe h GLN 34 Ca 0.46 0.07 -0.02 0.00 0.06 0.00 0.00 58.65 59.22 1jwe h GLN 34 Cb 0.74 0.24 -0.00 0.00 0.30 0.00 0.00 27.48 28.76 1jwe h GLN 34 CO -0.43 -0.71 -0.09 0.77 -0.67 0.00 0.00 178.83 177.70 1jwe h SER 35 N -1.11 0.00 0.49 1.46 0.02 -0.66 -0.17 113.55 113.60 1jwe h SER 35 Ca -0.09 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.84 1jwe h SER 35 Cb 0.91 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1jwe h SER 35 CO 0.05 0.09 -0.24 0.58 -1.14 0.00 0.00 176.83 176.17 1jwe h VAL 36 N 0.00 0.48 -0.47 2.27 2.07 -0.88 -0.45 116.25 119.27 1jwe h VAL 36 Ca -0.00 -0.25 -0.11 0.00 0.82 0.00 0.00 66.70 67.16 1jwe h VAL 36 Cb 0.48 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1jwe h VAL 36 CO 0.01 0.04 -0.16 -0.07 0.02 0.00 0.00 177.57 177.41 1jwe h LEU 37 N -0.82 0.90 -0.82 2.57 3.38 -1.13 -0.52 115.31 118.87 1jwe h LEU 37 Ca -0.07 -0.31 0.02 0.00 0.09 0.00 0.00 57.88 57.61 1jwe h LEU 37 Cb 0.58 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 1jwe h LEU 37 CO 0.11 1.06 0.54 1.23 0.09 0.00 0.00 178.44 181.47 1jwe h GLY 38 N 0.94 1.17 1.66 0.83 0.00 -1.14 -2.80 103.07 103.74 1jwe h GLY 38 Ca 0.12 -0.42 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 1jwe h GLY 38 CO 0.05 0.40 0.12 -1.33 0.00 0.00 0.00 176.54 175.78 1jwe h GLY 39 N 1.09 0.47 1.67 4.60 0.00 0.44 -1.26 103.07 110.07 1jwe h GLY 39 Ca 0.31 -0.21 -0.07 0.00 0.00 0.00 0.00 47.33 47.35 1jwe h GLY 39 CO -0.08 0.21 -0.18 1.41 0.00 0.00 0.00 176.54 177.89 1jwe h LEU 40 N 0.44 0.38 -0.71 3.11 3.38 -0.96 0.42 115.31 121.38 1jwe h LEU 40 Ca 0.11 -0.11 -0.14 0.00 0.09 0.00 0.00 57.88 57.84 1jwe h LEU 40 Cb 0.11 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1jwe h LEU 40 CO -0.01 0.59 -0.64 0.24 0.09 0.00 0.00 178.44 178.71 1jwe h MET 41 N 0.36 0.01 0.41 1.13 2.86 -1.14 -2.89 114.93 115.67 1jwe h MET 41 Ca 0.06 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.67 1jwe h MET 41 Cb 0.53 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 1jwe h MET 41 CO 0.03 0.65 -0.20 -0.07 1.06 0.00 0.00 176.91 178.39 1jwe h LEU 42 N 0.01 -0.46 -6.53 1.22 4.07 -0.65 -3.44 115.31 109.53 1jwe h LEU 42 Ca -0.01 -0.12 -0.57 0.00 0.08 0.00 0.00 57.88 57.26 1jwe h LEU 42 Cb 1.13 0.12 -0.38 0.00 1.08 0.00 0.00 40.66 42.61 1jwe h LEU 42 CO 0.08 -0.09 -0.87 -0.62 -1.08 0.00 0.00 178.44 175.87 1jwe s ASP 43 N -4.93 2.62 0.31 -0.43 -1.08 0.08 -5.01 116.67 108.22 1jwe s ASP 43 Ca -0.14 -2.31 0.24 0.00 -0.52 0.00 0.00 52.55 49.83 1jwe s ASP 43 Cb 0.02 -0.36 1.11 0.00 -1.46 0.00 0.00 42.92 42.23 1jwe s ASP 43 CO 0.50 -0.28 1.73 -0.55 0.52 0.00 0.00 175.17 177.08 1jwe h ASN 44 N 6.78 0.00 0.55 -0.34 7.08 -1.73 -1.49 115.58 126.43 1jwe h ASN 44 Ca 0.09 0.00 -0.03 0.00 -3.08 0.00 0.00 56.30 53.29 1jwe h ASN 44 Cb 0.96 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 37.20 1jwe h ASN 44 CO 0.28 0.00 -0.12 -0.33 -2.08 0.00 0.00 177.43 175.17 1jwe h GLU 45 N 0.00 0.00 0.00 4.14 5.08 -1.95 -1.88 114.58 119.97 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 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1jwe h GLU 45 CO 0.00 0.12 0.00 0.54 -1.00 0.00 0.00 179.01 178.67 1jwe n ARG 46 N -3.47 0.19 -0.20 2.33 5.12 -0.56 -2.83 116.66 117.24 1jwe n ARG 46 Ca -0.01 0.12 -0.01 0.00 -1.93 0.00 0.00 57.85 56.02 1jwe n ARG 46 Cb 0.28 -1.50 0.07 0.00 -1.16 0.00 0.00 32.46 30.15 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 -0.28 0.00 -1.55 2.91 -1.52 0.36 115.95 115.88 1jwe h TRP 47 Ca 0.00 0.05 -0.04 0.00 1.13 0.00 0.00 58.89 60.03 1jwe h TRP 47 Cb 0.24 0.22 -0.01 0.00 -0.51 0.00 0.00 29.16 29.10 1jwe h TRP 47 CO 0.00 -0.25 -0.21 -0.44 -1.03 0.00 0.00 178.44 176.51 1jwe h ASP 48 N 0.02 0.00 0.18 2.65 5.19 -1.76 0.21 116.42 122.91 1jwe h ASP 48 Ca 0.30 0.00 -0.33 0.00 -0.62 0.00 0.00 57.03 56.38 1jwe h ASP 48 Cb 0.47 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.99 1jwe h ASP 48 CO -0.61 0.21 -1.63 -0.78 -3.12 0.00 0.00 179.24 173.30 1jwe h ASP 49 N 0.00 0.60 0.15 6.45 3.58 -1.47 -3.02 116.42 122.72 1jwe h ASP 49 Ca -0.00 -0.92 -0.01 0.00 0.42 0.00 0.00 57.03 56.52 1jwe h ASP 49 Cb 0.47 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.33 1jwe h ASP 49 CO 0.03 1.74 -0.07 0.58 -2.88 0.00 0.00 179.24 178.63 1jwe h VAL 50 N 0.02 0.95 -0.06 2.25 2.07 -0.86 -2.76 116.25 117.86 1jwe h VAL 50 Ca -0.32 -0.46 0.02 0.00 0.82 0.00 0.00 66.70 66.76 1jwe h VAL 50 Cb 2.03 1.23 -0.00 0.00 -1.52 0.00 0.00 31.29 33.03 1jwe h VAL 50 CO 0.17 0.11 0.06 0.00 0.02 0.00 0.00 177.57 177.92 1jwe h ALA 51 N 0.39 1.72 0.00 1.67 0.00 -0.72 0.28 119.26 122.59 1jwe h ALA 51 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1jwe h ALA 51 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1jwe h ALA 51 CO 0.03 -0.09 0.00 0.39 0.00 0.00 0.00 179.25 179.58 1jwe n GLU 52 N -3.99 0.99 0.00 0.00 -0.58 -1.06 -3.54 120.64 112.46 1jwe n GLU 52 Ca -0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 1jwe n GLU 52 Cb 0.16 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.53 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 -1.00 2.69 -3.88 3.49 5.12 0.49 -5.05 116.66 118.51 1jwe n ARG 53 Ca 0.24 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 56.04 1jwe n ARG 53 Cb 0.11 -0.99 -0.13 0.00 -1.16 0.00 0.00 32.46 30.28 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 -1.98 0.02 0.42 1.55 -7.23 0.68 -4.64 120.40 109.22 1jwe s VAL 54 Ca 0.00 -0.15 0.07 0.00 -1.81 0.00 0.00 61.98 60.09 1jwe s VAL 54 Cb 0.00 -0.07 -0.07 0.00 0.56 0.00 0.00 36.38 36.80 1jwe s VAL 54 CO 0.00 -0.08 0.06 0.68 -0.31 0.00 0.00 175.10 175.45 1jwe s VAL 55 N -0.23 2.03 0.56 1.32 -7.23 -1.26 -4.14 120.40 111.45 1jwe s VAL 55 Ca -0.03 -1.91 0.25 0.00 -1.81 0.00 0.00 61.98 58.48 1jwe s VAL 55 Cb -0.02 -2.94 0.34 0.00 0.56 0.00 0.00 36.38 34.33 1jwe s VAL 55 CO -0.00 0.00 2.12 0.00 -0.31 0.00 0.00 175.10 176.91 1jwe h ALA 56 N 1.64 1.93 0.00 1.32 0.00 -1.94 -0.85 119.26 121.37 1jwe h ALA 56 Ca -0.44 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.36 1jwe h ALA 56 Cb 1.25 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1jwe h ALA 56 CO 0.77 -0.24 -0.50 -0.44 0.00 0.00 0.00 179.25 178.84 1jwe h ASP 57 N 0.00 0.00 0.10 0.00 3.32 -1.99 -3.12 116.42 114.73 1jwe h ASP 57 Ca 0.08 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.93 1jwe h ASP 57 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1jwe h ASP 57 CO -0.00 0.50 -0.74 0.44 -1.72 0.00 0.00 179.24 177.72 1jwe h ASP 58 N 0.00 0.66 -3.18 6.45 3.32 -1.55 -3.42 116.42 118.70 1jwe h ASP 58 Ca -0.01 -0.43 -0.53 0.00 0.02 0.00 0.00 57.03 56.09 1jwe h ASP 58 Cb 0.98 -0.19 0.06 0.00 0.22 0.00 0.00 39.33 40.39 1jwe h ASP 58 CO 0.07 1.19 0.83 -0.36 -1.72 0.00 0.00 179.24 179.25 1jwe s PHE 59 N -3.68 2.98 -0.24 4.55 0.40 -1.16 -4.68 117.98 116.16 1jwe s PHE 59 Ca -0.07 0.83 0.02 0.00 -0.60 0.00 0.00 56.93 57.11 1jwe s PHE 59 Cb 0.10 -3.91 -0.15 0.00 0.51 0.00 0.00 43.02 39.56 1jwe s PHE 59 CO 0.86 -3.13 -0.21 0.98 0.70 0.00 0.00 175.22 174.43 1jwe n TYR 60 N 2.86 0.00 -2.40 0.36 9.36 -1.26 -4.90 117.16 121.17 1jwe n TYR 60 Ca 0.09 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 60.90 1jwe n TYR 60 Cb 0.39 -0.91 -0.03 0.00 -0.63 0.00 0.00 39.34 38.16 1jwe n TYR 60 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 1jwe s THR 61 N -2.47 3.83 0.13 2.97 2.01 -1.26 -4.91 115.64 115.95 1jwe s THR 61 Ca -0.32 1.41 -0.28 0.00 0.31 0.00 0.00 61.69 62.81 1jwe s THR 61 Cb 0.08 -3.90 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 1jwe s THR 61 CO 0.55 0.16 1.59 -0.09 -0.69 0.00 0.00 174.62 176.14 1jwe h ARG 62 N 6.12 -0.44 -0.11 4.92 9.65 -1.95 -0.95 114.38 131.62 1jwe h ARG 62 Ca -0.43 0.03 -0.11 0.00 -1.10 0.00 0.00 59.98 58.37 1jwe h ARG 62 Cb 1.21 0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 29.88 1jwe h ARG 62 CO 0.78 -0.29 -0.41 -1.00 2.80 0.00 0.00 179.97 181.85 1jwe h PRO 63 N -0.45 0.25 -0.20 0.20 0.13 -1.88 -2.66 132.00 127.39 1jwe h PRO 63 Ca 0.08 -0.12 -0.02 0.00 -0.87 0.00 0.00 66.00 65.08 1jwe h PRO 63 Cb 0.60 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 1jwe h PRO 63 CO -0.38 0.62 0.05 0.45 -0.23 0.00 0.00 178.00 178.52 1jwe h HIS 64 N 0.21 0.33 -0.04 1.56 3.86 -1.76 -2.57 115.15 116.74 1jwe h HIS 64 Ca 0.02 -0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1jwe h HIS 64 Cb 0.82 -0.09 -0.00 0.00 1.06 0.00 0.00 27.41 29.19 1jwe h HIS 64 CO 0.01 0.43 0.02 -0.09 0.86 0.00 0.00 177.93 179.17 1jwe h ARG 65 N 0.14 0.06 -0.78 2.45 2.43 -1.06 -2.49 114.38 115.13 1jwe h ARG 65 Ca 0.06 -0.01 0.17 0.00 -0.81 0.00 0.00 59.98 59.40 1jwe h ARG 65 Cb 0.26 -0.01 -0.14 0.00 -0.42 0.00 0.00 29.97 29.65 1jwe h ARG 65 CO -0.00 0.09 -0.10 0.45 -1.51 0.00 0.00 179.97 178.90 1jwe h HIS 66 N 0.01 -0.24 0.52 2.20 3.86 -1.45 -0.12 115.15 119.92 1jwe h HIS 66 Ca 0.01 0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.27 1jwe h HIS 66 Cb 0.05 0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.75 1jwe h HIS 66 CO -0.06 -0.30 -0.27 0.82 0.86 0.00 0.00 177.93 178.97 1jwe h ILE 67 N 0.04 0.44 -0.65 2.45 2.04 -1.05 -0.73 117.51 120.05 1jwe h ILE 67 Ca 0.40 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.31 1jwe h ILE 67 Cb 0.67 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 1jwe h ILE 67 CO -0.75 0.00 0.43 0.15 0.00 0.00 0.00 178.15 177.98 1jwe h PHE 68 N -0.73 0.68 -0.17 1.37 3.57 -0.95 0.13 116.94 120.84 1jwe h PHE 68 Ca -0.07 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.43 1jwe h PHE 68 Cb 0.58 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1jwe h PHE 68 CO -0.06 0.38 0.01 1.15 -2.23 0.00 0.00 178.31 177.56 1jwe h THR 69 N 0.69 1.24 0.00 4.41 2.02 -0.71 0.87 112.91 121.43 1jwe h THR 69 Ca 0.27 -0.81 -0.16 0.00 0.77 0.00 0.00 66.41 66.48 1jwe h THR 69 Cb 0.20 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 1jwe h THR 69 CO -0.08 0.24 -0.75 -0.08 0.37 0.00 0.00 175.52 175.22 1jwe h GLU 70 N 0.06 0.00 -0.09 6.66 4.57 -0.37 -0.23 114.58 125.18 1jwe h GLU 70 Ca 0.05 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.23 1jwe h GLU 70 Cb 0.36 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.95 1jwe h GLU 70 CO 0.01 0.75 0.04 0.52 -1.18 0.00 0.00 179.01 179.15 1jwe h MET 71 N 0.00 0.13 -0.38 1.92 2.86 -0.75 0.02 114.93 118.73 1jwe h MET 71 Ca -0.01 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.65 1jwe h MET 71 Cb 1.40 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 33.00 1jwe h MET 71 CO 0.10 0.23 0.15 0.00 1.06 0.00 0.00 176.91 178.44 1jwe h ALA 72 N 0.90 0.45 -0.71 6.32 0.00 -0.54 0.47 119.26 126.15 1jwe h ALA 72 Ca 0.03 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1jwe h ALA 72 Cb 0.14 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1jwe h ALA 72 CO -0.00 -0.23 0.32 0.00 0.00 0.00 0.00 179.25 179.33 1jwe h ARG 73 N 0.32 1.03 -0.06 0.00 3.08 -0.96 0.44 114.38 118.23 1jwe h ARG 73 Ca 0.17 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1jwe h ARG 73 Cb 0.13 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.00 1jwe h ARG 73 CO -0.16 0.83 0.04 -0.07 -1.07 0.00 0.00 179.97 179.54 1jwe h LEU 74 N 1.00 0.07 -1.18 3.04 3.38 -0.38 -1.68 115.31 119.56 1jwe h LEU 74 Ca 0.24 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.22 1jwe h LEU 74 Cb 0.15 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 1jwe h LEU 74 CO -0.03 0.07 0.56 -0.61 0.09 0.00 0.00 178.44 178.53 1jwe h GLN 75 N 0.06 1.04 -0.36 1.13 5.75 -0.80 0.97 115.11 122.90 1jwe h GLN 75 Ca 0.02 -0.06 -0.00 0.00 -0.15 0.00 0.00 58.65 58.45 1jwe h GLN 75 Cb 0.01 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.31 1jwe h GLN 75 CO -0.00 0.69 0.20 1.49 -2.65 0.00 0.00 178.83 178.55 1jwe h GLU 76 N 1.07 0.49 -0.00 1.69 4.57 -0.42 0.41 114.58 122.37 1jwe h GLU 76 Ca 0.34 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.48 1jwe h GLU 76 Cb 0.01 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 1jwe h GLU 76 CO -0.10 0.36 -0.10 -1.13 -1.18 0.00 0.00 179.01 176.86 1jwe n SER 77 N -4.45 0.31 -1.20 1.04 3.41 -0.34 -4.91 113.62 107.48 1jwe n SER 77 Ca 0.02 -0.35 -0.08 0.00 -0.26 0.00 0.00 58.87 58.20 1jwe n SER 77 Cb 0.09 -0.14 0.01 0.00 -0.26 0.00 0.00 64.21 63.91 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 1.31 0.27 3.75 5.00 0.00 0.13 -5.07 105.19 110.59 1jwe n GLY 78 Ca 0.13 -0.47 -0.27 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.90 5.28 0.67 1.61 0.01 0.19 -4.98 113.70 113.59 1jwe s SER 79 Ca 0.11 -0.19 -0.15 0.00 1.31 0.00 0.00 55.95 57.02 1jwe s SER 79 Cb -0.05 -1.31 0.01 0.00 0.21 0.00 0.00 66.02 64.88 1jwe s SER 79 CO 0.13 0.09 1.13 -2.16 0.41 0.00 0.00 173.24 172.84 1jwe s PRO 80 N -2.94 2.67 -0.25 12.44 0.04 -1.26 -3.37 135.00 142.32 1jwe s PRO 80 Ca 0.29 1.45 0.10 0.00 0.04 0.00 0.00 61.00 62.89 1jwe s PRO 80 Cb -0.10 -1.93 0.70 0.00 0.04 0.00 0.00 34.50 33.21 1jwe s PRO 80 CO 0.22 -1.36 1.65 0.44 0.04 0.00 0.00 177.00 177.99 1jwe n ILE 81 N -2.49 2.56 -1.77 0.56 -5.35 -1.26 -4.55 119.36 107.06 1jwe n ILE 81 Ca 0.11 -1.34 -0.36 0.00 -0.27 0.00 0.00 62.75 60.89 1jwe n ILE 81 Cb 0.52 -0.36 0.06 0.00 -1.74 0.00 0.00 39.64 38.12 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 -0.76 4.76 0.17 7.28 -1.08 -1.26 -4.48 116.67 121.30 1jwe s ASP 82 Ca 0.49 2.43 -0.21 0.00 -0.52 0.00 0.00 52.55 54.73 1jwe s ASP 82 Cb 0.38 -2.60 0.09 0.00 -1.46 0.00 0.00 42.92 39.33 1jwe s ASP 82 CO 0.13 -1.89 1.61 0.25 0.52 0.00 0.00 175.17 175.79 1jwe h LEU 83 N 0.44 -0.96 -0.04 -1.34 7.12 -1.94 0.16 115.31 118.74 1jwe h LEU 83 Ca -0.50 0.19 -0.00 0.00 0.13 0.00 0.00 57.88 57.70 1jwe h LEU 83 Cb 1.31 0.47 -0.00 0.00 -0.53 0.00 0.00 40.66 41.91 1jwe h LEU 83 CO 0.53 -0.29 0.01 0.40 -0.13 0.00 0.00 178.44 178.95 1jwe h ILE 84 N -0.20 1.20 -0.81 4.05 5.03 -1.99 -1.10 117.51 123.69 1jwe h ILE 84 Ca 0.19 -0.60 -0.03 0.00 -0.12 0.00 0.00 64.86 64.30 1jwe h ILE 84 Cb 0.51 1.53 -0.04 0.00 -3.03 0.00 0.00 36.82 35.80 1jwe h ILE 84 CO -0.55 0.16 0.37 0.74 -0.68 0.00 0.00 178.15 178.19 1jwe h THR 85 N -0.17 1.26 0.36 -0.27 2.02 -1.73 0.10 112.91 114.47 1jwe h THR 85 Ca 0.01 -0.74 -0.01 0.00 0.77 0.00 0.00 66.41 66.44 1jwe h THR 85 Cb 0.25 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 1jwe h THR 85 CO 0.00 0.31 -0.28 0.25 0.37 0.00 0.00 175.52 176.17 1jwe h LEU 86 N 1.16 -0.74 -1.06 2.58 5.85 -0.65 0.13 115.31 122.58 1jwe h LEU 86 Ca 0.28 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 59.03 1jwe h LEU 86 Cb 0.15 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 1jwe h LEU 86 CO -0.03 -0.43 0.33 0.00 -0.34 0.00 0.00 178.44 177.98 1jwe h ALA 87 N -0.09 1.27 -0.19 1.25 0.00 -0.84 0.64 119.26 121.30 1jwe h ALA 87 Ca -0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1jwe h ALA 87 Cb 0.56 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1jwe h ALA 87 CO -0.01 0.56 0.07 0.93 0.00 0.00 0.00 179.25 180.80 1jwe h GLU 88 N 0.99 0.29 -0.32 0.00 5.08 -0.65 -1.16 114.58 118.82 1jwe h GLU 88 Ca 0.24 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1jwe h GLU 88 Cb 0.10 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 1jwe h GLU 88 CO -0.03 0.37 0.19 1.03 -1.00 0.00 0.00 179.01 179.57 1jwe h SER 89 N 0.16 0.38 -0.31 1.42 0.87 0.02 -0.77 113.55 115.32 1jwe h SER 89 Ca 0.06 -0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1jwe h SER 89 Cb 0.19 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 1jwe h SER 89 CO -0.00 0.32 0.20 -0.07 -0.53 0.00 0.00 176.83 176.74 1jwe h LEU 90 N 0.41 0.34 -1.16 2.23 3.38 -0.89 -1.05 115.31 118.56 1jwe h LEU 90 Ca 0.11 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 1jwe h LEU 90 Cb 0.01 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1jwe h LEU 90 CO -0.02 0.25 -0.23 1.05 0.09 0.00 0.00 178.44 179.57 1jwe h GLU 91 N 0.41 0.30 -0.64 1.13 4.11 -0.81 0.31 114.58 119.39 1jwe h GLU 91 Ca 0.12 -0.10 -0.01 0.00 0.07 0.00 0.00 59.36 59.44 1jwe h GLU 91 Cb -0.03 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 1jwe h GLU 91 CO -0.03 0.52 0.37 0.00 0.07 0.00 0.00 179.01 179.94 1jwe h ARG 92 N 0.27 0.87 0.00 1.06 3.08 -0.63 -1.16 114.38 117.87 1jwe h ARG 92 Ca 0.04 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1jwe h ARG 92 Cb 0.56 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1jwe h ARG 92 CO 0.04 0.64 0.00 1.04 -1.07 0.00 0.00 179.97 180.62 1jwe n GLN 93 N -4.58 0.19 -1.17 0.04 1.13 -0.45 -4.90 117.38 107.65 1jwe n GLN 93 Ca 0.05 0.11 -0.06 0.00 -1.94 0.00 0.00 57.00 55.16 1jwe n GLN 93 Cb 0.07 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 28.89 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 0.57 0.73 0.48 1.08 0.00 -0.19 -4.88 105.19 102.98 1jwe n GLY 94 Ca 0.08 -0.20 0.13 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.52 1.39 -0.31 1.61 1.13 0.91 -4.31 117.38 116.28 1jwe n GLN 95 Ca -0.06 -0.97 -0.03 0.00 -1.94 0.00 0.00 57.00 54.00 1jwe n GLN 95 Cb 0.35 -1.48 0.09 0.00 0.11 0.00 0.00 30.24 29.32 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 2.37 0.95 -1.24 1.08 5.85 -1.81 -1.19 115.31 121.32 1jwe h LEU 96 Ca 0.00 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 1jwe h LEU 96 Cb 0.65 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 1jwe h LEU 96 CO 0.00 0.67 -0.33 0.44 -0.34 0.00 0.00 178.44 178.88 1jwe h ASP 97 N 1.11 0.00 0.50 1.25 5.19 -1.90 -0.22 116.42 122.36 1jwe h ASP 97 Ca 0.32 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.62 1jwe h ASP 97 Cb -0.08 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.42 1jwe h ASP 97 CO -0.09 0.33 -0.53 0.28 -3.12 0.00 0.00 179.24 176.11 1jwe h SER 98 N 0.00 0.03 0.22 6.45 0.02 -1.50 -2.94 113.55 115.84 1jwe h SER 98 Ca -0.00 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1jwe h SER 98 Cb 0.71 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1jwe h SER 98 CO 0.04 0.55 -0.09 1.33 -1.14 0.00 0.00 176.83 177.53 1jwe n VAL 99 N -3.91 0.00 -0.26 2.27 0.24 -0.72 -4.10 118.33 111.85 1jwe n VAL 99 Ca -0.01 -0.09 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 1jwe n VAL 99 Cb 0.54 -0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.91 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 1.22 0.86 0.00 7.63 0.00 -1.09 -4.72 105.19 109.09 1jwe n GLY 100 Ca 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.26 0.64 0.30 -0.02 0.00 -0.13 -4.02 105.19 99.69 1jwe n GLY 101 Ca 0.00 -1.87 0.01 0.00 0.00 0.00 0.00 46.02 44.16 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 0.84 0.00 1.61 3.04 -1.94 -1.24 116.94 119.26 1jwe h PHE 102 Ca 0.00 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.98 1jwe h PHE 102 Cb 0.00 -0.26 0.00 0.00 2.56 0.00 0.00 35.95 38.25 1jwe h PHE 102 CO 0.00 0.38 0.00 0.00 -2.02 0.00 0.00 178.31 176.67 1jwe h ALA 103 N 1.41 1.00 0.03 2.41 0.00 -1.98 0.48 119.26 122.61 1jwe h ALA 103 Ca 0.37 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.23 1jwe h ALA 103 Cb 0.26 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.06 1jwe h ALA 103 CO -0.21 0.00 -0.20 -0.92 0.00 0.00 0.00 179.25 177.92 1jwe h TYR 104 N 0.00 0.15 -0.49 0.00 3.20 -1.36 -2.90 116.97 115.56 1jwe h TYR 104 Ca 0.00 -0.10 0.04 0.00 3.14 0.00 0.00 58.73 61.81 1jwe h TYR 104 Cb 0.10 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.33 1jwe h TYR 104 CO 0.00 1.04 0.26 -0.07 -1.64 0.00 0.00 178.16 177.75 1jwe h LEU 105 N -0.78 0.40 -0.28 2.82 3.38 -1.09 0.58 115.31 120.34 1jwe h LEU 105 Ca -0.03 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1jwe h LEU 105 Cb 1.11 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 1jwe h LEU 105 CO 0.04 0.28 0.05 0.00 0.09 0.00 0.00 178.44 178.89 1jwe h ALA 106 N 1.25 0.28 -0.16 1.53 0.00 -1.12 -1.92 119.26 119.11 1jwe h ALA 106 Ca 0.21 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.18 1jwe h ALA 106 Cb 0.09 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1jwe h ALA 106 CO -0.13 -0.37 0.09 1.49 0.00 0.00 0.00 179.25 180.33 1jwe h GLU 107 N 0.15 0.18 -0.28 0.00 4.57 -1.11 -1.29 114.58 116.80 1jwe h GLU 107 Ca 0.13 -0.01 0.05 0.00 -1.18 0.00 0.00 59.36 58.35 1jwe h GLU 107 Cb 0.14 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.65 1jwe h GLU 107 CO -0.18 0.12 -0.01 -0.07 -1.18 0.00 0.00 179.01 177.69 1jwe h LEU 108 N 0.18 -0.12 0.04 1.64 3.38 -0.65 0.17 115.31 119.95 1jwe h LEU 108 Ca 0.06 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.13 1jwe h LEU 108 Cb 0.01 0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1jwe h LEU 108 CO -0.04 -0.03 -0.29 -1.28 0.09 0.00 0.00 178.44 176.90 1jwe h SER 109 N 0.08 -0.84 0.00 -0.43 0.87 -1.17 -1.62 113.55 110.44 1jwe h SER 109 Ca 0.13 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 1jwe h SER 109 Cb 0.18 0.33 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1jwe h SER 109 CO -0.23 -0.36 0.00 0.29 -0.53 0.00 0.00 176.83 176.00 1jwe n LYS 110 N -5.39 0.59 -1.89 2.24 5.02 -0.50 -2.89 118.16 115.34 1jwe n LYS 110 Ca -0.05 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.06 1jwe n LYS 110 Cb 0.31 -1.36 0.05 0.00 -0.02 0.00 0.00 35.03 34.01 1jwe n LYS 110 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1jwe n ASN 111 N -0.86 4.10 -3.81 4.39 5.15 0.52 -4.95 115.26 119.81 1jwe n ASN 111 Ca 0.10 -3.58 -0.25 0.00 -0.60 0.00 0.00 54.58 50.25 1jwe n ASN 111 Cb 0.05 -0.38 -0.17 0.00 -0.53 0.00 0.00 39.78 38.75 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 -4.26 0.63 -0.91 -0.44 2.01 -1.14 -4.30 115.64 107.23 1jwe s THR 112 Ca 0.47 -0.17 -0.24 0.00 0.31 0.00 0.00 61.69 62.05 1jwe s THR 112 Cb 0.40 -0.82 -0.03 0.00 0.01 0.00 0.00 72.50 72.06 1jwe s THR 112 CO 0.01 0.19 1.86 -2.16 -0.69 0.00 0.00 174.62 173.83 1jwe s PRO 113 N 1.86 2.72 -0.12 4.92 0.04 -1.26 -4.26 135.00 138.90 1jwe s PRO 113 Ca 0.03 -0.39 0.00 0.00 0.04 0.00 0.00 61.00 60.69 1jwe s PRO 113 Cb -0.13 -5.08 0.00 0.00 0.04 0.00 0.00 34.50 29.33 1jwe s PRO 113 CO -0.07 -3.17 0.00 0.43 0.04 0.00 0.00 177.00 174.23 1jwe n SER 114 N 13.13 -4.69 -0.03 6.66 7.64 -1.26 -2.40 113.62 132.67 1jwe n SER 114 Ca 0.38 0.03 -0.00 0.00 1.01 0.00 0.00 58.87 60.29 1jwe n SER 114 Cb 0.48 -2.93 -0.00 0.00 -1.01 0.00 0.00 64.21 60.74 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 0.79 -0.01 0.28 -0.43 0.00 -1.26 -4.85 120.51 115.03 1jwe n ALA 115 Ca -0.01 0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.47 1jwe n ALA 115 Cb 0.40 -1.22 0.17 0.00 0.00 0.00 0.00 19.45 18.80 1jwe n ALA 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jwe n ALA 116 N 0.81 1.38 -0.88 0.00 0.00 -1.01 -1.40 120.51 119.41 1jwe n ALA 116 Ca -0.00 -0.03 0.03 0.00 0.00 0.00 0.00 53.44 53.44 1jwe n ALA 116 Cb 0.41 -1.13 0.04 0.00 0.00 0.00 0.00 19.45 18.77 1jwe n ALA 116 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1jwe n ASN 117 N -1.49 1.32 -0.19 0.00 3.02 -1.26 -4.91 115.26 111.74 1jwe n ASN 117 Ca 0.02 -2.10 0.00 0.00 -0.03 0.00 0.00 54.58 52.47 1jwe n ASN 117 Cb 0.09 -0.16 0.10 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 1.90 0.66 -0.71 2.41 2.10 -1.59 0.69 117.51 122.98 1jwe h ILE 118 Ca 0.00 -0.09 0.03 0.00 1.08 0.00 0.00 64.86 65.88 1jwe h ILE 118 Cb 0.91 0.37 -0.04 0.00 -1.09 0.00 0.00 36.82 36.96 1jwe h ILE 118 CO 0.00 0.05 0.45 -1.28 -1.08 0.00 0.00 178.15 176.29 1jwe h SER 119 N 0.27 0.74 -0.49 2.19 0.87 -1.91 0.39 113.55 115.60 1jwe h SER 119 Ca 0.31 -0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.75 1jwe h SER 119 Cb 0.45 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 1jwe h SER 119 CO -0.39 0.52 -0.16 0.00 -0.53 0.00 0.00 176.83 176.27 1jwe h ALA 120 N 1.30 0.68 -0.41 6.23 0.00 -1.41 -0.42 119.26 125.22 1jwe h ALA 120 Ca 0.28 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1jwe h ALA 120 Cb 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1jwe h ALA 120 CO -0.10 0.63 0.14 1.88 0.00 0.00 0.00 179.25 181.80 1jwe h TYR 121 N 0.83 0.65 -0.39 0.00 0.05 -0.42 -0.67 116.97 117.01 1jwe h TYR 121 Ca 0.12 -0.06 -0.01 0.00 0.05 0.00 0.00 58.73 58.83 1jwe h TYR 121 Cb 0.73 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 38.26 1jwe h TYR 121 CO 0.05 0.59 0.19 0.00 -1.05 0.00 0.00 178.16 177.94 1jwe h ALA 122 N 0.99 0.51 -0.45 3.88 0.00 -0.80 0.88 119.26 124.26 1jwe h ALA 122 Ca 0.13 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.99 1jwe h ALA 122 Cb 0.23 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1jwe h ALA 122 CO -0.01 0.06 0.20 0.22 0.00 0.00 0.00 179.25 179.72 1jwe h ASP 123 N 0.50 0.26 -0.21 0.00 1.82 -0.87 -0.72 116.42 117.20 1jwe h ASP 123 Ca 0.14 0.03 -0.00 0.00 -0.39 0.00 0.00 57.03 56.81 1jwe h ASP 123 Cb 0.11 -0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.10 1jwe h ASP 123 CO -0.02 0.19 0.13 0.40 -1.61 0.00 0.00 179.24 178.33 1jwe h ILE 124 N 0.40 1.09 -0.46 2.25 2.04 -0.83 0.41 117.51 122.41 1jwe h ILE 124 Ca 0.20 -0.21 0.07 0.00 1.00 0.00 0.00 64.86 65.91 1jwe h ILE 124 Cb 0.14 0.84 -0.06 0.00 -0.74 0.00 0.00 36.82 37.01 1jwe h ILE 124 CO -0.17 0.08 0.12 0.58 0.00 0.00 0.00 178.15 178.77 1jwe h VAL 125 N 0.26 0.80 -0.33 1.67 2.07 -0.24 0.15 116.25 120.63 1jwe h VAL 125 Ca 0.08 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.46 1jwe h VAL 125 Cb 0.02 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1jwe h VAL 125 CO -0.01 0.05 0.03 -0.09 0.02 0.00 0.00 177.57 177.57 1jwe h ARG 126 N 0.27 0.56 -0.57 1.57 1.12 -0.93 -0.96 114.38 115.45 1jwe h ARG 126 Ca 0.22 -0.16 -0.02 0.00 -1.11 0.00 0.00 59.98 58.91 1jwe h ARG 126 Cb 0.26 -0.06 -0.03 0.00 -0.01 0.00 0.00 29.97 30.13 1jwe h ARG 126 CO -0.26 0.67 0.27 1.49 -3.11 0.00 0.00 179.97 179.03 1jwe h GLU 127 N 0.38 0.80 -0.63 0.20 4.57 -0.17 0.16 114.58 119.89 1jwe h GLU 127 Ca 0.10 -0.10 -0.06 0.00 -1.18 0.00 0.00 59.36 58.12 1jwe h GLU 127 Cb 0.39 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.80 1jwe h GLU 127 CO 0.01 0.62 0.16 0.00 -1.18 0.00 0.00 179.01 178.62 1jwe h ARG 128 N 0.80 1.00 -0.22 1.92 2.47 -0.65 -1.37 114.38 118.32 1jwe h ARG 128 Ca 0.20 -0.24 -0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1jwe h ARG 128 Cb 0.08 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.26 1jwe h ARG 128 CO -0.03 0.90 0.13 0.00 0.56 0.00 0.00 179.97 181.54 1jwe h ALA 129 N 1.05 0.28 -0.36 0.04 0.00 0.21 -0.90 119.26 119.58 1jwe h ALA 129 Ca 0.20 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.14 1jwe h ALA 129 Cb 0.35 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.98 1jwe h ALA 129 CO 0.00 -0.21 -0.07 0.28 0.00 0.00 0.00 179.25 179.25 1jwe h VAL 130 N 0.27 0.66 -0.29 0.00 2.07 -0.65 0.74 116.25 119.06 1jwe h VAL 130 Ca 0.08 -0.01 -0.05 0.00 0.82 0.00 0.00 66.70 67.54 1jwe h VAL 130 Cb 0.02 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1jwe h VAL 130 CO -0.01 0.00 -0.04 0.58 0.02 0.00 0.00 177.57 178.12 1jwe h VAL 131 N 0.02 1.19 -0.33 2.57 2.07 -1.05 0.11 116.25 120.85 1jwe h VAL 131 Ca 0.18 -0.79 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 1jwe h VAL 131 Cb 0.26 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1jwe h VAL 131 CO -0.35 0.26 -0.02 -0.09 0.02 0.00 0.00 177.57 177.39 1jwe h ARG 132 N 0.43 0.59 -0.11 1.57 1.12 0.30 -0.86 114.38 117.42 1jwe h ARG 132 Ca 0.09 -0.20 -0.16 0.00 -1.11 0.00 0.00 59.98 58.60 1jwe h ARG 132 Cb 0.35 -0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 30.25 1jwe h ARG 132 CO 0.01 0.73 -0.63 1.05 -3.11 0.00 0.00 179.97 178.03 1jwe h GLU 133 N 0.39 0.40 -2.37 0.20 4.11 -0.61 -3.40 114.58 113.31 1jwe h GLU 133 Ca 0.09 -0.28 -0.57 0.00 0.07 0.00 0.00 59.36 58.67 1jwe h GLU 133 Cb 0.48 0.04 -0.37 0.00 0.50 0.00 0.00 28.75 29.40 1jwe h GLU 133 CO 0.02 0.90 -0.92 -1.64 0.07 0.00 0.00 179.01 177.44 1jwe s MET 134 N -3.79 0.80 0.24 1.06 -1.94 0.37 -5.10 119.30 110.94 1jwe s MET 134 Ca -0.06 -1.84 -0.31 0.00 -1.71 0.00 0.00 55.69 51.77 1jwe s MET 134 Cb 0.11 -1.32 -0.12 0.00 2.01 0.00 0.00 34.83 35.51 1jwe s MET 134 CO 0.83 -1.34 1.65 -0.89 -0.01 0.00 0.00 175.02 175.27 1jwe n ILE 135 N 3.20 0.43 -0.03 2.53 -0.00 -0.33 -4.16 119.36 121.00 1jwe n ILE 135 Ca 0.24 -0.11 0.00 0.00 -0.00 0.00 0.00 62.75 62.89 1jwe n ILE 135 Cb 0.45 -1.93 0.00 0.00 -0.00 0.00 0.00 39.64 38.16 1jwe n ILE 135 CO 0.00 0.00 0.00 -1.20 -0.00 0.00 0.00 176.55 175.35