#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jol s ILE 2 N 0.00 2.96 0.14 3.17 1.01 -1.26 0.97 121.20 128.19 1jol s ILE 2 Ca 0.00 -0.71 0.11 0.00 0.00 0.00 0.00 60.65 60.04 1jol s ILE 2 Cb 0.00 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 1jol s ILE 2 CO 0.00 0.54 -0.25 -0.44 0.00 0.00 0.00 174.94 174.79 1jol s SER 3 N 0.09 3.20 -0.05 3.58 0.01 0.44 -1.69 113.70 119.27 1jol s SER 3 Ca -0.06 -0.76 0.02 0.00 1.31 0.00 0.00 55.95 56.46 1jol s SER 3 Cb -0.15 -0.21 -0.03 0.00 0.21 0.00 0.00 66.02 65.84 1jol s SER 3 CO 0.05 0.15 -0.09 -0.76 0.41 0.00 0.00 173.24 172.99 1jol s LEU 4 N -2.15 3.05 -0.09 2.44 1.02 -0.66 -0.11 118.68 122.18 1jol s LEU 4 Ca 0.14 -0.09 0.00 0.00 0.02 0.00 0.00 54.13 54.20 1jol s LEU 4 Cb -0.10 -1.67 0.02 0.00 0.02 0.00 0.00 46.19 44.46 1jol s LEU 4 CO 0.06 0.34 -0.07 -0.51 0.02 0.00 0.00 176.35 176.19 1jol s ILE 5 N -0.82 0.93 0.13 -0.59 2.07 -0.66 -0.51 121.20 121.75 1jol s ILE 5 Ca 0.13 -0.27 -0.14 0.00 -1.41 0.00 0.00 60.65 58.96 1jol s ILE 5 Cb -0.11 -0.94 0.02 0.00 0.13 0.00 0.00 42.46 41.56 1jol s ILE 5 CO 0.02 0.34 0.36 0.00 -1.91 0.00 0.00 174.94 173.75 1jol s ALA 6 N 1.44 -0.68 -0.21 1.50 0.00 -0.56 -4.56 121.76 118.69 1jol s ALA 6 Ca -0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 51.96 51.66 1jol s ALA 6 Cb -0.13 0.69 0.02 0.00 0.00 0.00 0.00 23.12 23.69 1jol s ALA 6 CO -0.05 -0.64 -0.12 0.00 0.00 0.00 0.00 175.76 174.96 1jol s ALA 7 N -3.84 2.56 -0.12 0.00 0.00 -1.26 -1.19 121.76 117.91 1jol s ALA 7 Ca 0.06 -1.31 0.00 0.00 0.00 0.00 0.00 51.96 50.71 1jol s ALA 7 Cb 0.02 -1.47 -0.02 0.00 0.00 0.00 0.00 23.12 21.66 1jol s ALA 7 CO -0.09 -0.55 -0.13 -0.51 0.00 0.00 0.00 175.76 174.48 1jol s LEU 8 N 1.33 2.76 0.00 0.00 1.02 0.75 -4.56 118.68 119.98 1jol s LEU 8 Ca 0.03 -0.29 -0.04 0.00 0.02 0.00 0.00 54.13 53.85 1jol s LEU 8 Cb -0.15 -1.61 0.11 0.00 0.02 0.00 0.00 46.19 44.56 1jol s LEU 8 CO -0.08 0.20 0.71 0.00 0.02 0.00 0.00 176.35 177.20 1jol n ALA 9 N 3.29 -0.28 -1.63 4.21 0.00 0.65 -0.49 120.51 126.27 1jol n ALA 9 Ca -0.18 -1.19 -0.37 0.00 0.00 0.00 0.00 53.44 51.70 1jol n ALA 9 Cb 0.53 0.11 0.07 0.00 0.00 0.00 0.00 19.45 20.16 1jol n ALA 9 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1jol n VAL 10 N -2.63 4.36 -1.39 0.00 0.31 -0.69 -1.86 118.33 116.43 1jol n VAL 10 Ca 0.10 -0.47 -0.13 0.00 -0.01 0.00 0.00 64.34 63.83 1jol n VAL 10 Cb 0.37 -1.38 -0.06 0.00 -0.91 0.00 0.00 33.84 31.87 1jol n VAL 10 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1jol n ASP 11 N -1.81 -4.65 -1.30 4.52 8.00 -1.26 -3.01 116.55 117.03 1jol n ASP 11 Ca 0.15 0.33 -0.16 0.00 0.71 0.00 0.00 54.79 55.82 1jol n ASP 11 Cb 0.48 -3.33 -0.06 0.00 -0.02 0.00 0.00 41.12 38.18 1jol n ASP 11 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1jol n ARG 12 N -2.56 -1.15 -2.06 -1.24 1.74 -0.78 -4.85 116.66 105.77 1jol n ARG 12 Ca -0.13 1.05 -0.42 0.00 -0.77 0.00 0.00 57.85 57.58 1jol n ARG 12 Cb 0.45 -5.26 -0.03 0.00 -1.02 0.00 0.00 32.46 26.60 1jol n ARG 12 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1jol s VAL 13 N -2.62 2.94 -0.03 1.55 1.01 -1.17 -0.64 120.40 121.44 1jol s VAL 13 Ca 0.00 0.69 0.03 0.00 0.00 0.00 0.00 61.98 62.70 1jol s VAL 13 Cb 0.00 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 1jol s VAL 13 CO 0.00 0.06 0.03 2.30 0.00 0.00 0.00 175.10 177.49 1jol n ILE 14 N 3.67 0.18 -3.93 2.22 -5.35 -0.57 -0.25 119.36 115.33 1jol n ILE 14 Ca 0.11 -0.13 -0.09 0.00 -0.27 0.00 0.00 62.75 62.38 1jol n ILE 14 Cb 0.40 -0.59 -0.09 0.00 -1.74 0.00 0.00 39.64 37.63 1jol n ILE 14 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1jol s GLY 15 N -3.18 0.20 0.40 3.28 0.00 -1.15 -4.98 107.32 101.89 1jol s GLY 15 Ca -0.02 -0.72 0.04 0.00 0.00 0.00 0.00 44.72 44.02 1jol s GLY 15 CO 0.14 -0.87 0.11 1.06 0.00 0.00 0.00 173.10 173.54 1jol s MET 16 N -3.45 1.89 0.21 2.90 -1.94 -1.26 0.14 119.30 117.79 1jol s MET 16 Ca 0.02 -2.14 -0.08 0.00 -1.71 0.00 0.00 55.69 51.78 1jol s MET 16 Cb 0.04 -0.69 0.16 0.00 2.01 0.00 0.00 34.83 36.35 1jol s MET 16 CO -0.09 -0.43 1.79 0.93 -0.01 0.00 0.00 175.02 177.22 1jol h GLU 17 N 1.83 1.16 0.00 2.03 5.08 -1.94 -3.45 114.58 119.29 1jol h GLU 17 Ca -0.37 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 57.81 1jol h GLU 17 Cb 1.27 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1jol h GLU 17 CO 0.60 0.91 0.00 0.09 -1.00 0.00 0.00 179.01 179.61 1jol n ASN 18 N -4.33 1.94 -4.68 1.42 3.02 -1.26 -5.09 115.26 106.28 1jol n ASN 18 Ca 0.07 -0.83 -0.41 0.00 -0.03 0.00 0.00 54.58 53.38 1jol n ASN 18 Cb 0.16 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.34 1jol n ASN 18 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1jol n ALA 19 N -3.00 0.99 -1.78 5.41 0.00 -1.26 -4.91 120.51 115.96 1jol n ALA 19 Ca 0.00 0.25 -0.41 0.00 0.00 0.00 0.00 53.44 53.28 1jol n ALA 19 Cb 0.00 -2.22 -0.01 0.00 0.00 0.00 0.00 19.45 17.22 1jol n ALA 19 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1jol s MET 20 N -2.17 4.20 -1.23 0.00 -1.94 -1.26 -4.88 119.30 112.02 1jol s MET 20 Ca 0.62 2.45 -0.09 0.00 -1.71 0.00 0.00 55.69 56.96 1jol s MET 20 Cb -0.52 -3.01 -0.13 0.00 2.01 0.00 0.00 34.83 33.18 1jol s MET 20 CO 0.57 -0.42 3.10 -0.35 -0.01 0.00 0.00 175.02 177.92 1jol n PRO 21 N 0.70 3.26 -3.69 2.03 -0.04 -1.26 -4.83 135.00 131.17 1jol n PRO 21 Ca 0.01 -1.90 -0.10 0.00 -0.04 0.00 0.00 63.50 61.47 1jol n PRO 21 Cb 0.40 -2.60 -0.05 0.00 -0.04 0.00 0.00 33.50 31.21 1jol n PRO 21 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 1jol s TRP 22 N 1.92 -0.12 -0.34 0.54 -2.14 -1.26 -5.06 118.94 112.49 1jol s TRP 22 Ca 0.68 -0.22 -0.01 0.00 2.66 0.00 0.00 56.10 59.22 1jol s TRP 22 Cb 0.21 0.22 0.11 0.00 -3.10 0.00 0.00 33.47 30.91 1jol s TRP 22 CO -0.05 -0.71 0.15 1.21 -2.66 0.00 0.00 176.95 174.90 1jol s ASN 23 N -2.83 3.73 -0.64 -2.66 2.47 -1.26 -5.02 114.94 108.73 1jol s ASN 23 Ca 0.05 -1.85 0.06 0.00 0.42 0.00 0.00 52.86 51.53 1jol s ASN 23 Cb 0.02 -0.75 0.22 0.00 -1.45 0.00 0.00 41.25 39.29 1jol s ASN 23 CO -0.10 -0.38 0.63 0.18 -3.72 0.00 0.00 177.10 173.71 1jol n LEU 24 N 4.55 3.06 0.19 3.21 4.77 -1.26 -0.73 117.00 130.79 1jol n LEU 24 Ca 0.01 -5.26 0.10 0.00 -0.03 0.00 0.00 56.01 50.83 1jol n LEU 24 Cb 0.40 -0.55 0.64 0.00 -2.33 0.00 0.00 43.42 41.58 1jol n LEU 24 CO 0.13 1.95 1.10 1.55 -1.33 0.00 0.00 177.39 180.78 1jol h PRO 25 N 4.64 0.02 0.00 3.23 0.13 -1.98 -0.37 132.00 137.68 1jol h PRO 25 Ca 0.18 -0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.25 1jol h PRO 25 Cb 0.72 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 1jol h PRO 25 CO 0.75 0.01 -0.25 0.00 -0.23 0.00 0.00 178.00 178.28 1jol h ALA 26 N 1.93 1.02 -0.06 -0.56 0.00 -1.91 0.20 119.26 119.89 1jol h ALA 26 Ca 0.06 -0.23 -0.23 0.00 0.00 0.00 0.00 54.91 54.51 1jol h ALA 26 Cb 0.22 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1jol h ALA 26 CO -0.00 0.31 -0.89 0.22 0.00 0.00 0.00 179.25 178.89 1jol h ASP 27 N 0.00 0.75 -0.34 0.00 3.58 -1.51 -1.33 116.42 117.56 1jol h ASP 27 Ca -0.00 -0.55 -0.10 0.00 0.42 0.00 0.00 57.03 56.80 1jol h ASP 27 Cb 0.77 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.58 1jol h ASP 27 CO 0.03 1.34 -0.15 -0.07 -2.88 0.00 0.00 179.24 177.52 1jol h LEU 28 N 0.37 0.80 -0.82 2.28 3.38 -0.96 -0.73 115.31 119.62 1jol h LEU 28 Ca -0.08 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.55 1jol h LEU 28 Cb 1.52 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 1jol h LEU 28 CO 0.17 0.95 -0.05 0.00 0.09 0.00 0.00 178.44 179.59 1jol h ALA 29 N 1.12 1.01 -0.77 1.53 0.00 -0.80 -1.17 119.26 120.18 1jol h ALA 29 Ca 0.11 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1jol h ALA 29 Cb 0.64 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1jol h ALA 29 CO 0.05 0.60 0.26 2.35 0.00 0.00 0.00 179.25 182.51 1jol h TRP 30 N 0.76 1.21 -0.17 0.00 2.91 -0.60 -1.22 115.95 118.84 1jol h TRP 30 Ca 0.14 -0.11 0.00 0.00 1.13 0.00 0.00 58.89 60.05 1jol h TRP 30 Cb 0.54 -0.35 -0.01 0.00 -0.51 0.00 0.00 29.16 28.82 1jol h TRP 30 CO 0.03 0.94 0.11 0.35 -1.03 0.00 0.00 178.44 178.84 1jol h PHE 31 N 1.13 0.22 -0.52 2.65 3.04 -0.93 -0.73 116.94 121.79 1jol h PHE 31 Ca 0.25 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.18 1jol h PHE 31 Cb 0.28 -0.07 -0.02 0.00 2.56 0.00 0.00 35.95 38.69 1jol h PHE 31 CO 0.02 0.15 0.24 -0.22 -2.02 0.00 0.00 178.31 176.49 1jol h LYS 32 N 0.22 0.76 -1.00 1.11 3.64 -1.04 -1.45 116.57 118.81 1jol h LYS 32 Ca 0.06 -0.12 0.06 0.00 -1.27 0.00 0.00 60.65 59.38 1jol h LYS 32 Cb -0.01 -0.13 -0.07 0.00 -0.41 0.00 0.00 32.23 31.61 1jol h LYS 32 CO -0.01 0.64 0.65 -0.09 -2.27 0.00 0.00 179.45 178.36 1jol h ARG 33 N 0.70 1.15 -0.01 1.90 2.43 -0.90 0.46 114.38 120.12 1jol h ARG 33 Ca 0.18 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1jol h ARG 33 Cb 0.14 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1jol h ARG 33 CO -0.02 0.76 -0.17 0.09 -1.51 0.00 0.00 179.97 179.12 1jol n ASN 34 N -4.49 1.14 -0.00 -3.80 3.02 -0.31 -4.15 115.26 106.68 1jol n ASN 34 Ca 0.15 -1.06 0.01 0.00 -0.03 0.00 0.00 54.58 53.65 1jol n ASN 34 Cb 0.17 0.08 -0.02 0.00 -0.61 0.00 0.00 39.78 39.41 1jol n ASN 34 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1jol n THR 35 N -0.41 0.00 -1.60 3.41 -2.24 -0.58 -4.97 114.28 107.88 1jol n THR 35 Ca 0.14 -0.13 -0.46 0.00 -2.27 0.00 0.00 64.05 61.33 1jol n THR 35 Cb 0.35 0.56 -0.02 0.00 -2.10 0.00 0.00 70.33 69.11 1jol n THR 35 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1jol n LEU 36 N -1.47 1.95 -1.21 3.22 7.94 0.12 -1.19 117.00 126.35 1jol n LEU 36 Ca -0.00 1.16 -0.15 0.00 -1.11 0.00 0.00 56.01 55.91 1jol n LEU 36 Cb 0.05 -1.29 -0.06 0.00 0.53 0.00 0.00 43.42 42.65 1jol n LEU 36 CO 0.05 -1.22 -0.15 0.47 -1.11 0.00 0.00 177.39 175.43 1jol n ASP 37 N 1.57 -4.84 -4.34 1.96 8.00 -0.73 -4.99 116.55 113.18 1jol n ASP 37 Ca 0.11 0.36 -0.22 0.00 0.71 0.00 0.00 54.79 55.75 1jol n ASP 37 Cb 0.30 -3.71 -0.11 0.00 -0.02 0.00 0.00 41.12 37.58 1jol n ASP 37 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1jol s LYS 38 N -3.39 1.30 0.34 -1.24 1.02 -0.33 -5.00 119.74 112.43 1jol s LYS 38 Ca 0.00 -1.44 -0.23 0.00 0.02 0.00 0.00 55.97 54.32 1jol s LYS 38 Cb 0.00 -1.35 -0.10 0.00 -0.52 0.00 0.00 37.83 35.86 1jol s LYS 38 CO 0.00 0.27 0.90 -2.14 -0.92 0.00 0.00 175.35 173.46 1jol s PRO 39 N -2.88 4.40 -0.03 -1.68 0.02 -1.26 -3.25 135.00 130.30 1jol s PRO 39 Ca 0.17 1.15 0.06 0.00 0.02 0.00 0.00 61.00 62.40 1jol s PRO 39 Cb -0.05 -2.62 -0.01 0.00 0.02 0.00 0.00 34.50 31.83 1jol s PRO 39 CO 0.07 0.21 -0.21 0.14 -0.33 0.00 0.00 177.00 176.88 1jol s VAL 40 N -1.78 1.71 -0.14 3.83 -7.23 0.80 -1.81 120.40 115.78 1jol s VAL 40 Ca 0.52 -0.90 -0.02 0.00 -1.81 0.00 0.00 61.98 59.78 1jol s VAL 40 Cb -0.15 -1.43 -0.02 0.00 0.56 0.00 0.00 36.38 35.33 1jol s VAL 40 CO 0.20 0.48 -0.07 -0.63 -0.31 0.00 0.00 175.10 174.77 1jol s ILE 41 N -0.29 3.58 0.19 -0.62 1.01 -0.40 -0.75 121.20 123.93 1jol s ILE 41 Ca 0.02 -0.48 -0.06 0.00 0.00 0.00 0.00 60.65 60.14 1jol s ILE 41 Cb -0.10 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.80 1jol s ILE 41 CO 0.01 0.51 0.23 0.00 0.00 0.00 0.00 174.94 175.70 1jol s MET 42 N 0.24 1.22 0.52 2.79 0.23 -0.75 -0.88 119.30 122.67 1jol s MET 42 Ca -0.05 -1.40 0.04 0.00 -1.03 0.00 0.00 55.69 53.25 1jol s MET 42 Cb -0.14 0.34 0.04 0.00 -1.53 0.00 0.00 34.83 33.53 1jol s MET 42 CO 0.04 -0.43 0.72 0.20 -2.03 0.00 0.00 175.02 173.51 1jol s GLY 43 N -3.06 1.86 0.25 3.16 0.00 -0.60 0.14 107.32 109.07 1jol s GLY 43 Ca 0.27 -1.56 -0.03 0.00 0.00 0.00 0.00 44.72 43.41 1jol s GLY 43 CO 0.07 -1.28 1.74 -0.09 0.00 0.00 0.00 173.10 173.54 1jol h ARG 44 N 0.24 0.82 -0.26 2.90 2.43 -1.91 -0.88 114.38 117.71 1jol h ARG 44 Ca -0.40 -0.23 -0.12 0.00 -0.81 0.00 0.00 59.98 58.43 1jol h ARG 44 Cb 1.29 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 1jol h ARG 44 CO 0.47 0.83 -0.34 0.45 -1.51 0.00 0.00 179.97 179.87 1jol h HIS 45 N 0.76 0.67 -0.48 2.20 3.86 -1.95 -0.15 115.15 120.05 1jol h HIS 45 Ca 0.15 -0.17 -0.10 0.00 -1.16 0.00 0.00 60.37 59.08 1jol h HIS 45 Cb 0.47 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.77 1jol h HIS 45 CO 0.03 0.84 -0.11 1.15 0.86 0.00 0.00 177.93 180.70 1jol h THR 46 N 0.49 1.27 0.01 2.45 2.02 -1.85 0.55 112.91 117.84 1jol h THR 46 Ca 0.05 -1.24 -0.00 0.00 0.77 0.00 0.00 66.41 66.00 1jol h THR 46 Cb 0.82 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 68.31 1jol h THR 46 CO 0.07 0.43 -0.00 -0.25 0.37 0.00 0.00 175.52 176.13 1jol h TRP 47 N 0.78 -0.01 -0.42 3.16 2.91 -0.68 -0.35 115.95 121.33 1jol h TRP 47 Ca 0.12 -0.00 0.08 0.00 1.13 0.00 0.00 58.89 60.22 1jol h TRP 47 Cb 0.66 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.29 1jol h TRP 47 CO 0.05 0.01 0.29 0.93 -1.03 0.00 0.00 178.44 178.69 1jol h GLU 48 N -0.03 0.23 -0.09 2.65 5.08 -0.78 -1.66 114.58 119.99 1jol h GLU 48 Ca -0.00 -0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 58.19 1jol h GLU 48 Cb 0.02 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.23 1jol h GLU 48 CO 0.00 0.15 -0.54 0.77 -1.00 0.00 0.00 179.01 178.40 1jol h SER 49 N 0.24 0.62 -0.63 1.42 0.02 -0.03 -3.27 113.55 111.92 1jol h SER 49 Ca 0.19 -0.66 0.04 0.00 -0.84 0.00 0.00 61.79 60.52 1jol h SER 49 Cb 0.45 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.76 1jol h SER 49 CO -0.04 1.19 0.38 0.40 -1.14 0.00 0.00 176.83 177.62 1jol h ILE 50 N 0.11 1.04 0.00 3.27 2.04 -0.19 -3.47 117.51 120.31 1jol h ILE 50 Ca -0.04 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1jol h ILE 50 Cb 1.19 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1jol h ILE 50 CO 0.11 0.13 0.00 0.61 0.00 0.00 0.00 178.15 179.00 1jol n GLY 51 N -1.28 0.77 0.00 5.37 0.00 -0.83 -4.97 105.19 104.24 1jol n GLY 51 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1jol n GLY 51 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1jol n ARG 52 N -2.19 0.00 -2.18 1.61 1.85 -1.26 -5.11 116.66 109.38 1jol n ARG 52 Ca 0.00 0.00 -0.39 0.00 -1.00 0.00 0.00 57.85 56.46 1jol n ARG 52 Cb 0.00 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.40 1jol n ARG 52 CO 0.00 0.00 0.00 -2.14 -0.01 0.00 0.00 177.63 175.48 1jol s PRO 53 N -2.00 4.08 -0.07 2.89 0.02 -1.26 -4.96 135.00 133.69 1jol s PRO 53 Ca 0.00 2.02 -0.30 0.00 0.02 0.00 0.00 61.00 62.74 1jol s PRO 53 Cb 0.00 -2.78 -0.03 0.00 0.02 0.00 0.00 34.50 31.71 1jol s PRO 53 CO 0.00 -0.35 1.16 -0.51 -0.33 0.00 0.00 177.00 176.97 1jol s LEU 54 N -2.33 4.26 0.50 -5.54 1.43 -1.26 -4.97 118.68 110.76 1jol s LEU 54 Ca 0.55 1.74 -0.22 0.00 -1.03 0.00 0.00 54.13 55.17 1jol s LEU 54 Cb -0.35 -3.56 -0.06 0.00 0.03 0.00 0.00 46.19 42.25 1jol s LEU 54 CO 0.45 -0.56 1.25 -2.16 0.23 0.00 0.00 176.35 175.56 1jol s PRO 55 N 2.24 3.46 -1.33 1.29 0.04 -1.26 -3.37 135.00 136.07 1jol s PRO 55 Ca 0.54 1.99 0.00 0.00 0.04 0.00 0.00 61.00 63.57 1jol s PRO 55 Cb -0.23 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 31.98 1jol s PRO 55 CO 0.20 -0.85 0.00 0.41 0.04 0.00 0.00 177.00 176.80 1jol n GLY 56 N 0.57 0.94 2.99 0.56 0.00 -1.26 -4.89 105.19 104.09 1jol n GLY 56 Ca 0.09 -0.38 -0.09 0.00 0.00 0.00 0.00 46.02 45.64 1jol n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1jol s ARG 57 N -3.59 0.32 -0.26 1.61 0.52 -1.22 -1.78 118.95 114.56 1jol s ARG 57 Ca 0.00 -0.59 -0.23 0.00 -0.52 0.00 0.00 55.73 54.39 1jol s ARG 57 Cb 0.00 0.12 -0.01 0.00 0.52 0.00 0.00 34.95 35.58 1jol s ARG 57 CO 0.00 -0.05 0.75 0.21 0.02 0.00 0.00 175.30 176.23 1jol s LYS 58 N -1.45 4.12 -0.29 3.54 2.20 -1.20 -4.82 119.74 121.83 1jol s LYS 58 Ca -0.16 0.74 -0.19 0.00 -0.36 0.00 0.00 55.97 55.99 1jol s LYS 58 Cb -0.10 -3.66 -0.02 0.00 -1.51 0.00 0.00 37.83 32.54 1jol s LYS 58 CO -0.01 -0.51 0.59 -0.80 -0.36 0.00 0.00 175.35 174.26 1jol s ASN 59 N 1.44 6.48 -0.13 1.43 0.02 -1.26 -0.14 114.94 122.77 1jol s ASN 59 Ca 0.31 0.48 0.03 0.00 -1.02 0.00 0.00 52.86 52.65 1jol s ASN 59 Cb -0.15 -2.31 0.01 0.00 0.02 0.00 0.00 41.25 38.81 1jol s ASN 59 CO 0.09 -0.40 -0.21 -0.63 0.02 0.00 0.00 177.10 175.96 1jol s ILE 60 N 2.49 1.98 -0.21 0.60 1.01 0.07 -1.64 121.20 125.50 1jol s ILE 60 Ca 0.24 -0.94 -0.07 0.00 0.00 0.00 0.00 60.65 59.88 1jol s ILE 60 Cb -0.15 -1.75 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 1jol s ILE 60 CO 0.10 0.54 0.05 -0.63 0.00 0.00 0.00 174.94 175.00 1jol s ILE 61 N 0.78 4.41 -0.32 2.92 -1.09 0.15 -1.82 121.20 126.23 1jol s ILE 61 Ca -0.09 -0.15 -0.17 0.00 -2.23 0.00 0.00 60.65 58.02 1jol s ILE 61 Cb -0.16 -3.02 -0.02 0.00 -1.58 0.00 0.00 42.46 37.69 1jol s ILE 61 CO -0.00 0.41 0.44 -0.22 -1.23 0.00 0.00 174.94 174.33 1jol s LEU 62 N 0.97 4.27 0.05 2.97 2.96 0.12 -0.55 118.68 129.48 1jol s LEU 62 Ca 0.03 0.04 -0.27 0.00 -0.22 0.00 0.00 54.13 53.71 1jol s LEU 62 Cb -0.14 -2.49 0.07 0.00 0.50 0.00 0.00 46.19 44.13 1jol s LEU 62 CO 0.03 -0.36 0.65 -0.55 -1.32 0.00 0.00 176.35 174.80 1jol s SER 63 N 1.71 -0.60 0.14 3.68 0.15 0.15 -3.92 113.70 115.00 1jol s SER 63 Ca 0.16 0.34 0.24 0.00 0.70 0.00 0.00 55.95 57.39 1jol s SER 63 Cb -0.16 0.56 0.35 0.00 -1.71 0.00 0.00 66.02 65.07 1jol s SER 63 CO 0.12 -0.78 1.34 0.28 1.20 0.00 0.00 173.24 175.40 1jol h SER 64 N 2.47 0.00 -2.08 5.45 0.02 -1.88 -3.35 113.55 114.18 1jol h SER 64 Ca -0.30 -0.17 -0.46 0.00 -0.84 0.00 0.00 61.79 60.02 1jol h SER 64 Cb 1.23 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 1jol h SER 64 CO 0.38 0.09 -0.42 -1.10 -1.14 0.00 0.00 176.83 174.64 1jol s GLN 65 N -3.18 3.29 0.62 3.45 1.11 -1.26 -5.06 119.66 118.63 1jol s GLN 65 Ca 0.06 -0.87 -0.19 0.00 0.01 0.00 0.00 55.36 54.37 1jol s GLN 65 Cb 0.13 -2.83 -0.02 0.00 -1.01 0.00 0.00 33.01 29.27 1jol s GLN 65 CO 0.72 0.32 1.30 -2.14 0.01 0.00 0.00 175.29 175.50 1jol s PRO 66 N -4.02 2.74 0.47 2.91 0.02 -1.26 -4.98 135.00 130.88 1jol s PRO 66 Ca 0.37 2.08 -0.04 0.00 0.02 0.00 0.00 61.00 63.43 1jol s PRO 66 Cb -0.09 -1.96 -0.03 0.00 0.02 0.00 0.00 34.50 32.44 1jol s PRO 66 CO 0.29 -1.46 0.76 0.20 -0.33 0.00 0.00 177.00 176.46 1jol s GLY 67 N -1.30 1.48 0.00 0.52 0.00 -1.26 -4.99 107.32 101.77 1jol s GLY 67 Ca 0.79 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.93 1jol s GLY 67 CO 0.41 -0.43 0.91 -1.30 0.00 0.00 0.00 173.10 172.69 1jol n THR 68 N -2.21 0.83 -4.25 0.90 -2.24 -1.26 -4.98 114.28 101.05 1jol n THR 68 Ca 0.00 -0.89 -0.25 0.00 -2.27 0.00 0.00 64.05 60.64 1jol n THR 68 Cb 0.55 0.59 -0.17 0.00 -2.10 0.00 0.00 70.33 69.21 1jol n THR 68 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1jol s ASP 69 N -0.83 1.86 0.00 3.42 -1.08 -1.26 -4.98 116.67 113.80 1jol s ASP 69 Ca 0.00 -0.28 0.29 0.00 -0.52 0.00 0.00 52.55 52.04 1jol s ASP 69 Cb 0.00 -0.79 1.28 0.00 -1.46 0.00 0.00 42.92 41.94 1jol s ASP 69 CO 0.00 -0.04 1.94 0.47 0.52 0.00 0.00 175.17 178.06 1jol n ASP 70 N 4.32 0.03 -0.06 -0.34 8.00 -1.26 -3.52 116.55 123.72 1jol n ASP 70 Ca -0.19 0.29 0.13 0.00 0.71 0.00 0.00 54.79 55.74 1jol n ASP 70 Cb 0.51 -0.41 0.41 0.00 -0.02 0.00 0.00 41.12 41.61 1jol n ASP 70 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1jol n ARG 71 N -1.44 0.26 -4.61 -1.24 1.74 -1.26 -4.91 116.66 105.21 1jol n ARG 71 Ca 0.09 -0.12 -0.28 0.00 -0.77 0.00 0.00 57.85 56.76 1jol n ARG 71 Cb 0.32 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.17 1jol n ARG 71 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1jol s VAL 72 N -2.82 1.02 -0.19 1.55 -7.23 -1.23 -4.90 120.40 106.61 1jol s VAL 72 Ca 0.17 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.26 1jol s VAL 72 Cb 0.19 -2.39 -0.04 0.00 0.56 0.00 0.00 36.38 34.69 1jol s VAL 72 CO 0.59 0.00 0.07 -0.89 -0.31 0.00 0.00 175.10 174.57 1jol s THR 73 N -3.05 4.87 -0.18 5.32 2.01 -0.65 -4.95 115.64 119.03 1jol s THR 73 Ca 0.20 -0.00 -0.06 0.00 0.31 0.00 0.00 61.69 62.13 1jol s THR 73 Cb 0.04 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.31 1jol s THR 73 CO 0.11 0.46 0.03 0.26 -0.69 0.00 0.00 174.62 174.78 1jol s TRP 74 N 0.39 3.16 0.18 4.92 0.52 -1.26 0.30 118.94 127.15 1jol s TRP 74 Ca 0.04 -0.09 0.04 0.00 0.02 0.00 0.00 56.10 56.11 1jol s TRP 74 Cb -0.12 -2.04 -0.05 0.00 -1.15 0.00 0.00 33.47 30.11 1jol s TRP 74 CO -0.00 0.06 -0.06 0.14 0.02 0.00 0.00 176.95 177.11 1jol s VAL 75 N 0.42 1.11 -0.24 4.03 -7.23 0.29 -4.93 120.40 113.85 1jol s VAL 75 Ca 0.01 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 58.14 1jol s VAL 75 Cb -0.13 -2.04 0.02 0.00 0.56 0.00 0.00 36.38 34.79 1jol s VAL 75 CO 0.01 -0.59 0.59 0.29 -0.31 0.00 0.00 175.10 175.09 1jol n LYS 76 N -0.28 -0.54 -3.72 4.82 4.76 -1.26 -0.68 118.16 121.27 1jol n LYS 76 Ca -0.08 -0.67 -0.12 0.00 -2.87 0.00 0.00 58.31 54.58 1jol n LYS 76 Cb 0.62 -1.04 -0.07 0.00 -1.84 0.00 0.00 35.03 32.70 1jol n LYS 76 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1jol s SER 77 N -0.21 -0.17 0.24 4.39 1.04 -1.26 -4.79 113.70 112.94 1jol s SER 77 Ca 0.02 -0.18 -0.06 0.00 0.48 0.00 0.00 55.95 56.22 1jol s SER 77 Cb 0.02 0.39 0.32 0.00 0.10 0.00 0.00 66.02 66.85 1jol s SER 77 CO 0.02 -0.66 1.85 0.58 0.98 0.00 0.00 173.24 176.01 1jol h VAL 78 N 3.03 1.03 -0.45 5.02 2.07 -1.98 0.59 116.25 125.56 1jol h VAL 78 Ca -0.32 -0.32 -0.09 0.00 0.82 0.00 0.00 66.70 66.79 1jol h VAL 78 Cb 1.21 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1jol h VAL 78 CO 0.46 0.17 -0.09 0.44 0.02 0.00 0.00 177.57 178.57 1jol h ASP 79 N 0.93 0.80 -0.51 0.57 3.32 -2.00 -0.67 116.42 118.86 1jol h ASP 79 Ca 0.36 -0.23 -0.11 0.00 0.02 0.00 0.00 57.03 57.07 1jol h ASP 79 Cb 0.17 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 1jol h ASP 79 CO -0.17 0.92 -0.09 -0.33 -1.72 0.00 0.00 179.24 177.85 1jol h GLU 80 N 0.74 0.99 -0.42 3.56 5.08 -1.55 -1.90 114.58 121.08 1jol h GLU 80 Ca 0.13 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1jol h GLU 80 Cb 0.58 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1jol h GLU 80 CO 0.04 1.03 0.27 0.00 -1.00 0.00 0.00 179.01 179.34 1jol h ALA 81 N 1.00 0.53 -0.33 3.43 0.00 0.71 -0.63 119.26 123.97 1jol h ALA 81 Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1jol h ALA 81 Cb 0.64 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1jol h ALA 81 CO 0.04 -0.01 0.18 0.82 0.00 0.00 0.00 179.25 180.28 1jol h ILE 82 N 0.56 1.14 -0.50 0.00 2.04 -0.95 -2.50 117.51 117.31 1jol h ILE 82 Ca 0.15 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1jol h ILE 82 Cb -0.05 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 1jol h ILE 82 CO -0.03 0.14 0.32 0.00 0.00 0.00 0.00 178.15 178.58 1jol h ALA 83 N 1.04 1.61 0.00 1.87 0.00 -1.14 0.28 119.26 122.92 1jol h ALA 83 Ca 0.11 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1jol h ALA 83 Cb 0.07 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1jol h ALA 83 CO -0.02 0.35 -0.00 0.00 0.00 0.00 0.00 179.25 179.58 1jol h ALA 84 N 1.66 1.05 0.00 0.00 0.00 -0.65 0.95 119.26 122.27 1jol h ALA 84 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1jol h ALA 84 Cb -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1jol h ALA 84 CO -0.04 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.22 1jol n GLY 86 N 1.09 1.65 3.38 0.00 0.00 0.33 -4.28 105.19 107.37 1jol n GLY 86 Ca 0.04 -0.65 -0.45 0.00 0.00 0.00 0.00 46.02 44.96 1jol n GLY 86 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1jol s ASP 87 N -4.00 7.04 0.07 1.61 1.11 -1.26 -4.93 116.67 116.31 1jol s ASP 87 Ca 0.00 -3.02 -0.00 0.00 0.18 0.00 0.00 52.55 49.71 1jol s ASP 87 Cb 0.00 -2.28 -0.04 0.00 1.07 0.00 0.00 42.92 41.67 1jol s ASP 87 CO 0.00 -0.58 -0.04 0.68 1.18 0.00 0.00 175.17 176.42 1jol s VAL 88 N 0.32 0.36 0.27 -1.27 -7.23 -1.26 -5.03 120.40 106.56 1jol s VAL 88 Ca 0.31 -1.85 0.09 0.00 -1.81 0.00 0.00 61.98 58.72 1jol s VAL 88 Cb -0.07 -1.58 -0.02 0.00 0.56 0.00 0.00 36.38 35.26 1jol s VAL 88 CO -0.06 -0.95 1.61 1.55 -0.31 0.00 0.00 175.10 176.93 1jol h PRO 89 N 3.09 0.07 -2.75 4.82 0.14 -1.94 -3.42 132.00 132.01 1jol h PRO 89 Ca -0.34 -0.05 -0.14 0.00 0.14 0.00 0.00 66.00 65.61 1jol h PRO 89 Cb 1.15 0.01 -0.27 0.00 0.14 0.00 0.00 31.00 32.03 1jol h PRO 89 CO 0.66 0.65 -0.34 -2.00 0.14 0.00 0.00 178.00 177.10 1jol s GLU 90 N -3.69 0.36 -0.14 0.86 2.12 -1.26 0.66 118.70 117.60 1jol s GLU 90 Ca -0.02 0.70 -0.06 0.00 0.36 0.00 0.00 54.97 55.95 1jol s GLU 90 Cb 0.13 -0.02 -0.04 0.00 0.26 0.00 0.00 34.13 34.46 1jol s GLU 90 CO 0.77 -0.15 0.06 0.42 -0.54 0.00 0.00 175.26 175.82 1jol s ILE 91 N 1.21 4.79 -0.17 -3.70 1.01 0.27 -4.48 121.20 120.14 1jol s ILE 91 Ca -0.08 -0.05 -0.06 0.00 0.00 0.00 0.00 60.65 60.46 1jol s ILE 91 Cb -0.08 -3.11 -0.04 0.00 0.01 0.00 0.00 42.46 39.25 1jol s ILE 91 CO -0.10 0.54 0.02 -0.04 0.00 0.00 0.00 174.94 175.36 1jol s MET 92 N -0.27 3.85 -0.19 2.79 -1.94 -0.75 -0.42 119.30 122.36 1jol s MET 92 Ca 0.08 -0.41 -0.04 0.00 -1.71 0.00 0.00 55.69 53.60 1jol s MET 92 Cb -0.12 -3.10 -0.02 0.00 2.01 0.00 0.00 34.83 33.60 1jol s MET 92 CO 0.02 0.25 -0.02 0.08 -0.01 0.00 0.00 175.02 175.34 1jol s VAL 93 N 0.39 3.81 -0.60 -6.03 1.01 0.85 -1.27 120.40 118.56 1jol s VAL 93 Ca 0.00 -0.36 0.16 0.00 0.00 0.00 0.00 61.98 61.78 1jol s VAL 93 Cb -0.13 -2.71 0.61 0.00 0.00 0.00 0.00 36.38 34.15 1jol s VAL 93 CO 0.01 0.44 1.52 2.30 0.00 0.00 0.00 175.10 179.38 1jol n ILE 94 N 4.18 2.04 -1.79 2.22 -5.35 -0.06 -1.66 119.36 118.95 1jol n ILE 94 Ca -0.17 -1.45 0.00 0.00 -0.27 0.00 0.00 62.75 60.86 1jol n ILE 94 Cb 0.52 -0.02 0.00 0.00 -1.74 0.00 0.00 39.64 38.39 1jol n ILE 94 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1jol n GLY 95 N 0.36 -1.98 0.00 3.28 0.00 -1.26 -4.96 105.19 100.63 1jol n GLY 95 Ca 0.22 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1jol n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jol n GLY 96 N -0.03 1.37 0.10 -0.02 0.00 -1.26 -1.56 105.19 103.78 1jol n GLY 96 Ca 0.00 -1.62 -0.03 0.00 0.00 0.00 0.00 46.02 44.38 1jol n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jol n GLY 97 N 5.00 -1.28 0.29 -0.02 0.00 -1.26 0.09 105.19 108.00 1jol n GLY 97 Ca 0.00 0.40 -0.03 0.00 0.00 0.00 0.00 46.02 46.39 1jol n GLY 97 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1jol h ARG 98 N 0.00 0.75 -0.20 1.61 2.47 -1.96 0.21 114.38 117.26 1jol h ARG 98 Ca 0.04 -0.18 -0.19 0.00 -1.26 0.00 0.00 59.98 58.38 1jol h ARG 98 Cb 0.09 -0.10 0.01 0.00 -1.65 0.00 0.00 29.97 28.32 1jol h ARG 98 CO -0.21 0.74 -0.63 0.28 0.56 0.00 0.00 179.97 180.71 1jol h VAL 99 N 0.71 1.29 -0.75 2.04 2.07 -1.50 -1.33 116.25 118.77 1jol h VAL 99 Ca 0.15 -1.83 -0.05 0.00 0.82 0.00 0.00 66.70 65.79 1jol h VAL 99 Cb 0.39 1.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.99 1jol h VAL 99 CO 0.01 0.58 0.29 1.88 0.02 0.00 0.00 177.57 180.35 1jol h TYR 100 N 0.53 1.16 -0.42 1.57 0.05 0.07 -2.22 116.97 117.71 1jol h TYR 100 Ca -0.02 -0.09 0.06 0.00 0.05 0.00 0.00 58.73 58.73 1jol h TYR 100 Cb 1.25 -0.35 -0.05 0.00 1.01 0.00 0.00 36.73 38.59 1jol h TYR 100 CO 0.09 0.89 0.11 1.49 -1.05 0.00 0.00 178.16 179.69 1jol h GLU 101 N 1.09 0.25 0.00 4.88 4.81 -0.79 -0.59 114.58 124.23 1jol h GLU 101 Ca 0.25 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.41 1jol h GLU 101 Cb 0.23 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1jol h GLU 101 CO -0.02 0.16 -0.27 1.96 -0.73 0.00 0.00 179.01 180.11 1jol h GLN 102 N 0.26 0.00 0.00 1.92 4.20 -1.06 -3.29 115.11 117.14 1jol h GLN 102 Ca 0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.91 1jol h GLN 102 Cb 0.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.00 1jol h GLN 102 CO -0.24 0.27 -1.25 1.19 -0.67 0.00 0.00 178.83 178.14 1jol n PHE 103 N -3.37 0.11 -0.20 2.96 3.01 -0.85 -4.56 117.46 114.55 1jol n PHE 103 Ca 0.01 0.03 0.01 0.00 1.01 0.00 0.00 57.45 58.50 1jol n PHE 103 Cb 0.49 -0.30 0.11 0.00 -0.01 0.00 0.00 39.48 39.77 1jol n PHE 103 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1jol h LEU 104 N 0.00 0.09 -2.15 4.37 5.85 -1.19 -2.17 115.31 120.11 1jol h LEU 104 Ca 0.00 0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.87 1jol h LEU 104 Cb 0.71 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 1jol h LEU 104 CO 0.00 0.05 0.13 -0.65 -0.34 0.00 0.00 178.44 177.63 1jol h PRO 105 N 0.31 0.00 -0.02 5.25 0.11 -1.80 -0.30 132.00 135.56 1jol h PRO 105 Ca 0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.43 1jol h PRO 105 Cb 0.46 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.57 1jol h PRO 105 CO -0.37 0.00 -0.17 1.63 -0.21 0.00 0.00 178.00 178.87 1jol n LYS 106 N -4.18 1.54 -3.20 1.05 5.02 -0.85 -4.96 118.16 112.58 1jol n LYS 106 Ca 0.01 -1.11 -0.36 0.00 -2.02 0.00 0.00 58.31 54.82 1jol n LYS 106 Cb 0.25 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.72 1jol n LYS 106 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1jol s ALA 107 N -2.23 3.48 -0.14 7.82 0.00 -0.12 -4.49 121.76 126.07 1jol s ALA 107 Ca 0.28 0.06 0.12 0.00 0.00 0.00 0.00 51.96 52.41 1jol s ALA 107 Cb 0.20 -2.71 -0.17 0.00 0.00 0.00 0.00 23.12 20.44 1jol s ALA 107 CO 0.43 0.38 0.32 1.04 0.00 0.00 0.00 175.76 177.92 1jol n GLN 108 N 0.86 1.03 -3.89 0.00 1.13 -0.68 -4.87 117.38 110.95 1jol n GLN 108 Ca -0.04 -0.08 -0.11 0.00 -1.94 0.00 0.00 57.00 54.83 1jol n GLN 108 Cb 0.51 -1.23 -0.11 0.00 0.11 0.00 0.00 30.24 29.53 1jol n GLN 108 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1jol s LYS 109 N -2.66 0.40 -0.04 -1.09 2.20 -1.24 -0.99 119.74 116.33 1jol s LYS 109 Ca -0.02 -0.36 0.04 0.00 -0.36 0.00 0.00 55.97 55.27 1jol s LYS 109 Cb 0.08 0.16 -0.00 0.00 -1.51 0.00 0.00 37.83 36.56 1jol s LYS 109 CO 0.49 -0.09 -0.16 -0.51 -0.36 0.00 0.00 175.35 174.73 1jol s LEU 110 N -1.18 1.90 -0.24 5.43 1.43 0.65 -1.66 118.68 125.01 1jol s LEU 110 Ca -0.13 -0.32 0.01 0.00 -1.03 0.00 0.00 54.13 52.67 1jol s LEU 110 Cb -0.07 -0.88 0.04 0.00 0.03 0.00 0.00 46.19 45.31 1jol s LEU 110 CO 0.01 0.14 -0.11 -0.31 0.23 0.00 0.00 176.35 176.31 1jol s TYR 111 N 0.02 3.12 0.10 0.29 1.51 0.33 -1.17 117.35 121.56 1jol s TYR 111 Ca -0.03 -1.97 0.10 0.00 -1.01 0.00 0.00 57.07 54.16 1jol s TYR 111 Cb -0.10 -1.97 -0.04 0.00 -0.11 0.00 0.00 41.96 39.74 1jol s TYR 111 CO 0.02 -0.83 -0.27 -0.51 -1.11 0.00 0.00 175.55 172.85 1jol s LEU 112 N 1.20 2.27 -0.23 -1.29 1.43 0.19 -1.49 118.68 120.77 1jol s LEU 112 Ca -0.04 -0.69 0.02 0.00 -1.03 0.00 0.00 54.13 52.40 1jol s LEU 112 Cb -0.18 -1.25 0.05 0.00 0.03 0.00 0.00 46.19 44.84 1jol s LEU 112 CO -0.06 0.21 -0.14 -0.89 0.23 0.00 0.00 176.35 175.70 1jol s THR 113 N -0.97 2.08 -0.23 5.49 2.01 -0.33 0.33 115.64 124.03 1jol s THR 113 Ca 0.13 -1.36 -0.16 0.00 0.31 0.00 0.00 61.69 60.62 1jol s THR 113 Cb -0.10 -2.09 -0.04 0.00 0.01 0.00 0.00 72.50 70.28 1jol s THR 113 CO 0.05 0.17 0.42 -1.00 -0.69 0.00 0.00 174.62 173.57 1jol s HIS 114 N 1.19 3.33 -0.09 4.92 0.09 0.00 -0.18 115.29 124.55 1jol s HIS 114 Ca -0.04 0.58 -0.01 0.00 -0.00 0.00 0.00 55.06 55.60 1jol s HIS 114 Cb -0.17 -2.58 -0.03 0.00 -0.00 0.00 0.00 32.58 29.80 1jol s HIS 114 CO -0.08 -0.11 -0.05 0.42 -0.00 0.00 0.00 174.74 174.92 1jol s ILE 115 N 1.68 3.88 -1.25 0.60 1.01 0.36 -0.56 121.20 126.93 1jol s ILE 115 Ca 0.19 -0.40 -0.16 0.00 0.00 0.00 0.00 60.65 60.28 1jol s ILE 115 Cb -0.15 -2.62 0.13 0.00 0.01 0.00 0.00 42.46 39.82 1jol s ILE 115 CO 0.09 0.58 1.57 -0.62 0.00 0.00 0.00 174.94 176.55 1jol s ASP 116 N -0.57 6.98 -0.02 3.58 2.15 -0.14 -3.77 116.67 124.87 1jol s ASP 116 Ca 0.09 -2.77 -0.00 0.00 0.43 0.00 0.00 52.55 50.30 1jol s ASP 116 Cb -0.12 -2.48 0.03 0.00 -0.30 0.00 0.00 42.92 40.05 1jol s ASP 116 CO 0.02 -0.93 0.03 0.00 -0.17 0.00 0.00 175.17 174.12 1jol s ALA 117 N 2.71 0.13 -0.41 3.66 0.00 -1.26 -4.58 121.76 122.00 1jol s ALA 117 Ca 0.48 0.28 -0.16 0.00 0.00 0.00 0.00 51.96 52.55 1jol s ALA 117 Cb 0.00 -0.29 0.02 0.00 0.00 0.00 0.00 23.12 22.85 1jol s ALA 117 CO 0.04 -0.14 0.39 -1.21 0.00 0.00 0.00 175.76 174.84 1jol s GLU 118 N 1.17 3.09 0.14 0.00 0.41 -1.26 -1.70 118.70 120.55 1jol s GLU 118 Ca -0.08 -0.81 -0.01 0.00 -0.41 0.00 0.00 54.97 53.66 1jol s GLU 118 Cb -0.13 -3.96 -0.04 0.00 -1.78 0.00 0.00 34.13 28.22 1jol s GLU 118 CO -0.03 -0.80 0.05 0.14 -0.49 0.00 0.00 175.26 174.13 1jol s VAL 119 N 2.00 0.17 -0.30 2.63 -7.23 -1.26 -5.05 120.40 111.36 1jol s VAL 119 Ca 0.10 -1.92 -0.26 0.00 -1.81 0.00 0.00 61.98 58.08 1jol s VAL 119 Cb -0.18 -2.07 0.01 0.00 0.56 0.00 0.00 36.38 34.70 1jol s VAL 119 CO 0.12 -0.45 0.94 -1.61 -0.31 0.00 0.00 175.10 173.80 1jol s GLU 120 N -4.04 4.04 0.42 4.82 0.41 -1.26 -4.97 118.70 118.12 1jol s GLU 120 Ca 0.25 0.88 0.08 0.00 -0.41 0.00 0.00 54.97 55.76 1jol s GLU 120 Cb 0.07 -3.72 -0.02 0.00 -1.78 0.00 0.00 34.13 28.68 1jol s GLU 120 CO 0.02 -0.77 0.37 0.20 -0.49 0.00 0.00 175.26 174.59 1jol s GLY 121 N 1.59 2.15 -0.25 -1.39 0.00 -1.26 -4.82 107.32 103.34 1jol s GLY 121 Ca 0.39 -1.90 -0.08 0.00 0.00 0.00 0.00 44.72 43.13 1jol s GLY 121 CO 0.13 -1.71 -0.29 1.34 0.00 0.00 0.00 173.10 172.57 1jol n ASP 122 N -1.53 1.91 -4.39 1.64 2.03 0.12 -4.96 116.55 111.38 1jol n ASP 122 Ca 0.03 0.17 -0.24 0.00 0.52 0.00 0.00 54.79 55.27 1jol n ASP 122 Cb 0.62 -0.63 -0.11 0.00 -0.72 0.00 0.00 41.12 40.28 1jol n ASP 122 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1jol s THR 123 N -2.47 2.13 0.16 5.18 -4.23 -0.89 -5.01 115.64 110.52 1jol s THR 123 Ca -0.34 -2.03 0.02 0.00 -1.18 0.00 0.00 61.69 58.15 1jol s THR 123 Cb 0.12 -2.03 -0.05 0.00 1.34 0.00 0.00 72.50 71.89 1jol s THR 123 CO 0.48 -0.25 -0.01 -1.00 -0.54 0.00 0.00 174.62 173.30 1jol s HIS 124 N -1.96 1.15 0.36 3.99 3.76 -1.26 -1.51 115.29 119.81 1jol s HIS 124 Ca 0.20 -0.99 -0.26 0.00 -0.15 0.00 0.00 55.06 53.85 1jol s HIS 124 Cb -0.06 -0.65 -0.09 0.00 1.11 0.00 0.00 32.58 32.88 1jol s HIS 124 CO 0.09 -0.19 1.06 0.12 -0.85 0.00 0.00 174.74 174.96 1jol s PHE 125 N -3.65 3.39 0.80 1.40 5.36 0.18 -4.69 117.98 120.78 1jol s PHE 125 Ca 0.21 1.67 -0.13 0.00 -0.96 0.00 0.00 56.93 57.72 1jol s PHE 125 Cb 0.06 -3.17 0.08 0.00 -0.34 0.00 0.00 43.02 39.65 1jol s PHE 125 CO 0.02 -0.56 1.20 -2.14 -1.46 0.00 0.00 175.22 172.29 1jol s PRO 126 N -2.12 1.66 -0.16 10.12 0.02 -1.26 -4.88 135.00 138.38 1jol s PRO 126 Ca 0.53 1.75 -0.29 0.00 0.02 0.00 0.00 61.00 63.01 1jol s PRO 126 Cb -0.25 -1.78 -0.02 0.00 0.02 0.00 0.00 34.50 32.47 1jol s PRO 126 CO 0.32 -2.20 1.38 0.34 -0.33 0.00 0.00 177.00 176.52 1jol s ASP 127 N -2.17 6.81 0.10 2.53 -1.08 -1.26 -5.00 116.67 116.60 1jol s ASP 127 Ca 0.73 1.75 0.03 0.00 -0.52 0.00 0.00 52.55 54.54 1jol s ASP 127 Cb -0.29 -2.54 -0.04 0.00 -1.46 0.00 0.00 42.92 38.60 1jol s ASP 127 CO 0.50 -0.87 0.11 -0.72 0.52 0.00 0.00 175.17 174.71 1jol s TYR 128 N 3.86 3.22 -0.47 -5.34 1.13 -1.26 -5.06 117.35 113.43 1jol s TYR 128 Ca 0.60 0.08 -0.20 0.00 -1.41 0.00 0.00 57.07 56.14 1jol s TYR 128 Cb -0.24 -1.61 0.04 0.00 -1.10 0.00 0.00 41.96 39.04 1jol s TYR 128 CO 0.20 0.53 0.62 -2.00 -2.51 0.00 0.00 175.55 172.39 1jol s GLU 129 N -2.56 3.20 0.23 -3.49 2.56 -1.26 -4.92 118.70 112.46 1jol s GLU 129 Ca 0.30 -0.60 0.16 0.00 0.00 0.00 0.00 54.97 54.84 1jol s GLU 129 Cb -0.12 -4.01 0.86 0.00 2.00 0.00 0.00 34.13 32.86 1jol s GLU 129 CO 0.23 -1.09 1.50 -0.35 -0.56 0.00 0.00 175.26 174.99 1jol n PRO 130 N 6.20 0.11 0.17 4.30 -0.05 -1.26 0.05 135.00 144.52 1jol n PRO 130 Ca -0.04 0.58 0.11 0.00 -0.05 0.00 0.00 63.50 64.10 1jol n PRO 130 Cb 0.47 -1.83 0.10 0.00 -0.05 0.00 0.00 33.50 32.19 1jol n PRO 130 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 175.50 175.01 1jol h ASP 131 N 0.00 0.00 0.26 3.54 3.32 -2.04 -3.23 116.42 118.27 1jol h ASP 131 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1jol h ASP 131 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1jol h ASP 131 CO 0.00 0.03 -0.51 0.47 -1.72 0.00 0.00 179.24 177.51 1jol n ASP 132 N -2.96 0.95 -4.43 6.45 8.00 0.11 -4.93 116.55 119.73 1jol n ASP 132 Ca 0.02 -0.74 -0.32 0.00 0.71 0.00 0.00 54.79 54.45 1jol n ASP 132 Cb 0.55 0.38 -0.14 0.00 -0.02 0.00 0.00 41.12 41.89 1jol n ASP 132 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1jol s TRP 133 N -2.78 2.65 -0.22 1.24 0.52 -1.13 0.11 118.94 119.34 1jol s TRP 133 Ca 0.16 -0.28 -0.06 0.00 0.02 0.00 0.00 56.10 55.94 1jol s TRP 133 Cb 0.18 -1.63 -0.02 0.00 -1.15 0.00 0.00 33.47 30.84 1jol s TRP 133 CO 0.66 0.09 0.02 -2.00 0.02 0.00 0.00 176.95 175.74 1jol s GLU 134 N -0.57 3.62 -0.19 4.98 2.12 0.21 -4.83 118.70 124.05 1jol s GLU 134 Ca 0.08 -0.51 -0.29 0.00 0.36 0.00 0.00 54.97 54.61 1jol s GLU 134 Cb -0.11 -3.15 -0.01 0.00 0.26 0.00 0.00 34.13 31.12 1jol s GLU 134 CO 0.01 -0.06 1.19 0.45 -0.54 0.00 0.00 175.26 176.32 1jol s SER 135 N 1.20 7.00 0.00 -1.70 0.15 -1.26 -0.79 113.70 118.29 1jol s SER 135 Ca 0.03 1.59 0.10 0.00 0.70 0.00 0.00 55.95 58.38 1jol s SER 135 Cb -0.14 -2.54 0.07 0.00 -1.71 0.00 0.00 66.02 61.70 1jol s SER 135 CO 0.02 -0.73 0.81 1.33 1.20 0.00 0.00 173.24 175.86 1jol n VAL 136 N 5.35 0.00 -3.64 4.45 0.24 0.12 -4.99 118.33 119.86 1jol n VAL 136 Ca 0.13 -0.49 -0.08 0.00 -2.04 0.00 0.00 64.34 61.86 1jol n VAL 136 Cb 0.45 1.20 -0.07 0.00 -1.47 0.00 0.00 33.84 33.96 1jol n VAL 136 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1jol s PHE 137 N -0.89 -0.49 -0.18 6.34 5.36 -1.18 -4.95 117.98 121.99 1jol s PHE 137 Ca 0.12 1.17 -0.16 0.00 -0.96 0.00 0.00 56.93 57.09 1jol s PHE 137 Cb 0.08 0.37 0.05 0.00 -0.34 0.00 0.00 43.02 43.18 1jol s PHE 137 CO 0.14 -0.24 0.47 -1.54 -1.46 0.00 0.00 175.22 172.59 1jol s SER 138 N 0.36 -0.49 -0.24 6.13 1.04 -1.25 -1.96 113.70 117.28 1jol s SER 138 Ca 0.02 0.95 -0.03 0.00 0.48 0.00 0.00 55.95 57.36 1jol s SER 138 Cb -0.05 0.95 0.13 0.00 0.10 0.00 0.00 66.02 67.16 1jol s SER 138 CO -0.07 -0.16 0.43 -0.70 0.98 0.00 0.00 173.24 173.71 1jol s GLU 139 N 0.29 0.38 0.01 4.02 2.12 0.59 -4.96 118.70 121.16 1jol s GLU 139 Ca -0.00 0.73 -0.24 0.00 0.36 0.00 0.00 54.97 55.81 1jol s GLU 139 Cb -0.03 -0.13 -0.05 0.00 0.26 0.00 0.00 34.13 34.17 1jol s GLU 139 CO 0.00 -0.55 0.72 0.12 -0.54 0.00 0.00 175.26 175.01 1jol s PHE 140 N 2.62 3.69 0.00 5.30 5.36 -1.26 -1.22 117.98 132.46 1jol s PHE 140 Ca 0.11 1.37 0.01 0.00 -0.96 0.00 0.00 56.93 57.46 1jol s PHE 140 Cb -0.15 -2.78 -0.00 0.00 -0.34 0.00 0.00 43.02 39.75 1jol s PHE 140 CO -0.16 0.25 -0.03 -1.01 -1.46 0.00 0.00 175.22 172.80 1jol s HIS 141 N 0.11 0.29 0.60 10.12 3.76 -0.26 -5.01 115.29 124.90 1jol s HIS 141 Ca 0.37 -0.09 -0.06 0.00 -0.15 0.00 0.00 55.06 55.12 1jol s HIS 141 Cb -0.19 -0.19 0.01 0.00 1.11 0.00 0.00 32.58 33.32 1jol s HIS 141 CO 0.21 -0.02 0.91 -0.51 -0.85 0.00 0.00 174.74 174.49 1jol s ASP 142 N -0.20 5.61 0.83 1.40 1.01 -1.26 -1.42 116.67 122.64 1jol s ASP 142 Ca -0.00 0.76 -0.11 0.00 0.71 0.00 0.00 52.55 53.91 1jol s ASP 142 Cb -0.02 -1.75 0.09 0.00 1.01 0.00 0.00 42.92 42.25 1jol s ASP 142 CO -0.00 -1.07 1.13 0.00 0.21 0.00 0.00 175.17 175.44 1jol s ALA 143 N -3.01 1.89 0.00 5.23 0.00 -1.23 -4.78 121.76 119.85 1jol s ALA 143 Ca 0.54 0.48 0.00 0.00 0.00 0.00 0.00 51.96 52.98 1jol s ALA 143 Cb -0.11 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.64 1jol s ALA 143 CO 0.46 -2.22 0.00 -0.40 0.00 0.00 0.00 175.76 173.59 1jol n ASP 144 N -3.75 0.00 0.20 0.00 5.68 -0.21 -4.95 116.55 113.52 1jol n ASP 144 Ca 0.11 -0.81 0.18 0.00 -0.50 0.00 0.00 54.79 53.76 1jol n ASP 144 Cb 0.52 0.00 0.83 0.00 -1.14 0.00 0.00 41.12 41.34 1jol n ASP 144 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1jol h ALA 145 N 1.71 1.78 0.00 2.12 0.00 -2.02 -2.80 119.26 120.06 1jol h ALA 145 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1jol h ALA 145 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1jol h ALA 145 CO 0.00 -0.34 -0.79 1.04 0.00 0.00 0.00 179.25 179.16 1jol n GLN 146 N -3.70 2.50 -4.56 0.00 6.02 -1.26 -4.98 117.38 111.41 1jol n GLN 146 Ca 0.02 -0.03 -0.33 0.00 -0.01 0.00 0.00 57.00 56.65 1jol n GLN 146 Cb 0.36 -0.96 -0.15 0.00 1.02 0.00 0.00 30.24 30.51 1jol n GLN 146 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1jol s ASN 147 N -2.12 3.83 0.46 1.08 0.01 -1.06 -4.44 114.94 112.70 1jol s ASN 147 Ca -0.00 -0.41 0.26 0.00 -0.71 0.00 0.00 52.86 51.99 1jol s ASN 147 Cb 0.04 -1.59 0.97 0.00 0.41 0.00 0.00 41.25 41.07 1jol s ASN 147 CO 0.23 0.10 1.84 0.77 -1.51 0.00 0.00 177.10 178.53 1jol h SER 148 N 7.16 0.00 -4.70 -1.22 4.64 -1.17 -0.54 113.55 117.73 1jol h SER 148 Ca -0.31 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.71 1jol h SER 148 Cb 1.20 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.14 1jol h SER 148 CO 0.57 0.17 -0.63 -1.00 -0.87 0.00 0.00 176.83 175.07 1jol s HIS 149 N -3.62 1.33 0.40 4.77 3.76 -1.26 -4.89 115.29 115.78 1jol s HIS 149 Ca 0.01 -1.15 -0.08 0.00 -0.15 0.00 0.00 55.06 53.68 1jol s HIS 149 Cb 0.10 -0.76 -0.06 0.00 1.11 0.00 0.00 32.58 32.97 1jol s HIS 149 CO 0.62 -0.34 0.73 -1.54 -0.85 0.00 0.00 174.74 173.36 1jol s SER 150 N -3.23 6.46 0.11 1.40 1.04 -1.26 -3.56 113.70 114.65 1jol s SER 150 Ca 0.32 1.02 -0.18 0.00 0.48 0.00 0.00 55.95 57.58 1jol s SER 150 Cb 0.07 -2.28 0.04 0.00 0.10 0.00 0.00 66.02 63.96 1jol s SER 150 CO 0.09 -0.40 0.45 -0.72 0.98 0.00 0.00 173.24 173.65 1jol s TYR 151 N -2.39 -0.30 -0.06 5.02 1.13 -0.51 -0.97 117.35 119.27 1jol s TYR 151 Ca 0.49 0.10 -0.00 0.00 -1.41 0.00 0.00 57.07 56.25 1jol s TYR 151 Cb -0.10 0.32 0.03 0.00 -1.10 0.00 0.00 41.96 41.10 1jol s TYR 151 CO 0.34 -0.70 -0.01 0.00 -2.51 0.00 0.00 175.55 172.67 1jol s PHE 153 N 1.51 3.85 -0.05 0.00 0.08 -0.36 -0.82 117.98 122.19 1jol s PHE 153 Ca -0.02 1.77 -0.04 0.00 0.12 0.00 0.00 56.93 58.75 1jol s PHE 153 Cb -0.13 -2.98 0.02 0.00 -0.57 0.00 0.00 43.02 39.35 1jol s PHE 153 CO -0.03 0.29 0.12 -2.00 -0.10 0.00 0.00 175.22 173.51 1jol s GLU 154 N -0.34 0.13 -0.10 0.44 2.12 0.15 -0.30 118.70 120.81 1jol s GLU 154 Ca 0.44 0.20 0.03 0.00 0.36 0.00 0.00 54.97 55.99 1jol s GLU 154 Cb -0.23 0.03 0.01 0.00 0.26 0.00 0.00 34.13 34.19 1jol s GLU 154 CO 0.29 -0.04 -0.19 0.42 -0.54 0.00 0.00 175.26 175.20 1jol s ILE 155 N 0.24 1.71 0.03 -3.70 1.01 -0.83 0.54 121.20 120.21 1jol s ILE 155 Ca -0.01 -0.79 0.08 0.00 0.00 0.00 0.00 60.65 59.93 1jol s ILE 155 Cb -0.03 -1.52 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 1jol s ILE 155 CO -0.01 0.48 -0.25 -0.76 0.00 0.00 0.00 174.94 174.41 1jol s LEU 156 N 0.70 2.13 -0.04 2.97 1.02 -0.31 -0.70 118.68 124.45 1jol s LEU 156 Ca -0.12 -0.53 0.06 0.00 0.02 0.00 0.00 54.13 53.55 1jol s LEU 156 Cb -0.16 -1.21 -0.01 0.00 0.02 0.00 0.00 46.19 44.83 1jol s LEU 156 CO 0.03 0.25 -0.22 -1.61 0.02 0.00 0.00 176.35 174.82 1jol s GLU 157 N -1.04 2.08 0.03 1.70 2.02 0.03 -0.25 118.70 123.27 1jol s GLU 157 Ca 0.10 -0.78 -0.30 0.00 0.02 0.00 0.00 54.97 54.01 1jol s GLU 157 Cb -0.10 -1.84 -0.07 0.00 0.10 0.00 0.00 34.13 32.22 1jol s GLU 157 CO 0.01 0.37 1.55 0.50 0.02 0.00 0.00 175.26 177.71 1jol s ARG 158 N -0.21 4.23 0.00 1.61 3.52 -0.16 0.68 118.95 128.63 1jol s ARG 158 Ca -0.00 2.17 0.04 0.00 -0.13 0.00 0.00 55.73 57.81 1jol s ARG 158 Cb -0.11 -3.62 0.25 0.00 -1.56 0.00 0.00 34.95 29.90 1jol s ARG 158 CO 0.02 -0.68 0.72 0.54 -0.81 0.00 0.00 175.30 175.09