#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jan s MET 80 N 0.00 0.05 0.02 3.97 -1.94 -1.26 -4.90 119.30 115.25 1jan s MET 80 Ca 0.00 0.39 -0.16 0.00 -1.71 0.00 0.00 55.69 54.21 1jan s MET 80 Cb 0.00 -0.23 -0.06 0.00 2.01 0.00 0.00 34.83 36.55 1jan s MET 80 CO 0.00 -0.21 0.47 -0.51 -0.01 0.00 0.00 175.02 174.76 1jan s LEU 81 N 1.49 4.49 0.08 -0.03 1.43 -1.26 0.71 118.68 125.59 1jan s LEU 81 Ca -0.05 1.07 -0.36 0.00 -1.03 0.00 0.00 54.13 53.75 1jan s LEU 81 Cb -0.12 -2.70 -0.16 0.00 0.03 0.00 0.00 46.19 43.24 1jan s LEU 81 CO -0.05 0.30 1.45 0.41 0.23 0.00 0.00 176.35 178.68 1jan n THR 82 N 1.85 0.04 -1.71 5.49 -1.04 -0.96 -4.60 114.28 113.35 1jan n THR 82 Ca -0.12 -0.01 -0.43 0.00 -2.04 0.00 0.00 64.05 61.45 1jan n THR 82 Cb 0.52 -1.09 -0.02 0.00 -1.82 0.00 0.00 70.33 67.92 1jan n THR 82 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1jan n PRO 83 N 3.08 2.36 0.00 -2.82 -0.04 -1.26 -1.39 135.00 134.93 1jan n PRO 83 Ca 0.19 0.84 0.00 0.00 -0.04 0.00 0.00 63.50 64.49 1jan n PRO 83 Cb 0.22 -2.56 0.00 0.00 -0.04 0.00 0.00 33.50 31.12 1jan n PRO 83 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1jan n GLY 84 N 2.22 0.42 3.54 0.55 0.00 -1.26 -4.61 105.19 106.06 1jan n GLY 84 Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 1jan n GLY 84 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jan n ASN 85 N 0.00 -5.84 -4.76 1.61 5.03 -0.49 -4.93 115.26 105.89 1jan n ASN 85 Ca 0.00 -0.86 -0.40 0.00 0.87 0.00 0.00 54.58 54.19 1jan n ASN 85 Cb 0.00 -3.84 -0.06 0.00 -1.02 0.00 0.00 39.78 34.86 1jan n ASN 85 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1jan s PRO 86 N -5.29 4.70 0.02 3.52 0.04 -1.26 -5.03 135.00 131.69 1jan s PRO 86 Ca 0.40 1.32 -0.09 0.00 0.04 0.00 0.00 61.00 62.67 1jan s PRO 86 Cb -0.12 -3.29 0.00 0.00 0.04 0.00 0.00 34.50 31.14 1jan s PRO 86 CO 0.83 0.50 0.18 -1.59 0.04 0.00 0.00 177.00 176.95 1jan s LYS 87 N -0.97 0.59 -0.02 4.56 -2.85 -1.26 -4.43 119.74 115.37 1jan s LYS 87 Ca 0.39 -0.49 -0.30 0.00 -1.00 0.00 0.00 55.97 54.57 1jan s LYS 87 Cb -0.24 0.25 -0.04 0.00 -2.06 0.00 0.00 37.83 35.74 1jan s LYS 87 CO 0.29 -0.16 1.13 -1.58 0.10 0.00 0.00 175.35 175.13 1jan s TRP 88 N -1.93 3.40 -0.48 1.78 0.52 -1.26 -4.87 118.94 116.10 1jan s TRP 88 Ca -0.10 1.39 0.02 0.00 0.02 0.00 0.00 56.10 57.43 1jan s TRP 88 Cb -0.04 -3.33 0.20 0.00 -1.15 0.00 0.00 33.47 29.15 1jan s TRP 88 CO -0.01 -0.89 1.02 0.39 0.02 0.00 0.00 176.95 177.49 1jan n GLU 89 N 4.53 1.70 -3.91 4.98 -0.58 -1.26 -4.79 120.64 121.31 1jan n GLU 89 Ca 0.09 -0.81 -0.10 0.00 -0.42 0.00 0.00 57.16 55.93 1jan n GLU 89 Cb 0.48 -1.52 -0.09 0.00 -0.57 0.00 0.00 31.44 29.74 1jan n GLU 89 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 1jan s ARG 90 N -1.18 0.59 -0.04 3.49 3.52 -1.26 -5.09 118.95 118.98 1jan s ARG 90 Ca 0.15 -0.69 0.09 0.00 -0.13 0.00 0.00 55.73 55.14 1jan s ARG 90 Cb 0.12 0.23 -0.13 0.00 -1.56 0.00 0.00 34.95 33.61 1jan s ARG 90 CO 0.04 -0.15 0.14 0.25 -0.81 0.00 0.00 175.30 174.77 1jan n THR 91 N 0.86 0.20 -3.53 4.11 -2.24 -1.26 -4.87 114.28 107.54 1jan n THR 91 Ca -0.20 -0.26 -0.41 0.00 -2.27 0.00 0.00 64.05 60.91 1jan n THR 91 Cb 0.58 -0.07 -0.11 0.00 -2.10 0.00 0.00 70.33 68.63 1jan n THR 91 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1jan s ASN 92 N -3.38 5.99 0.11 3.42 3.04 -1.26 -0.63 114.94 122.23 1jan s ASN 92 Ca -0.04 -0.67 0.10 0.00 0.04 0.00 0.00 52.86 52.29 1jan s ASN 92 Cb 0.05 -2.12 -0.04 0.00 -1.54 0.00 0.00 41.25 37.60 1jan s ASN 92 CO 0.37 -0.32 -0.22 -0.76 -3.04 0.00 0.00 177.10 173.13 1jan s LEU 93 N 1.68 2.53 0.17 3.21 1.43 -0.46 -4.98 118.68 122.26 1jan s LEU 93 Ca 0.05 -0.62 0.06 0.00 -1.03 0.00 0.00 54.13 52.59 1jan s LEU 93 Cb -0.18 -1.41 -0.04 0.00 0.03 0.00 0.00 46.19 44.59 1jan s LEU 93 CO 0.09 0.19 0.05 0.42 0.23 0.00 0.00 176.35 177.33 1jan s THR 94 N -1.09 4.02 0.07 5.49 -4.23 -1.25 -0.66 115.64 117.99 1jan s THR 94 Ca 0.16 -1.30 0.02 0.00 -1.18 0.00 0.00 61.69 59.39 1jan s THR 94 Cb -0.10 -3.03 -0.03 0.00 1.34 0.00 0.00 72.50 70.67 1jan s THR 94 CO 0.08 -0.11 -0.07 -0.72 -0.54 0.00 0.00 174.62 173.26 1jan s TYR 95 N -1.75 0.79 -0.03 3.99 1.13 -0.36 -1.45 117.35 119.68 1jan s TYR 95 Ca 0.29 -0.76 -0.00 0.00 -1.41 0.00 0.00 57.07 55.19 1jan s TYR 95 Cb -0.10 -0.47 0.03 0.00 -1.10 0.00 0.00 41.96 40.33 1jan s TYR 95 CO 0.20 -0.13 0.03 0.50 -2.51 0.00 0.00 175.55 173.64 1jan s ARG 96 N -2.94 0.08 -0.54 -3.49 3.52 0.06 -1.65 118.95 113.98 1jan s ARG 96 Ca 0.03 0.20 -0.21 0.00 -0.13 0.00 0.00 55.73 55.62 1jan s ARG 96 Cb -0.01 -0.41 0.06 0.00 -1.56 0.00 0.00 34.95 33.03 1jan s ARG 96 CO -0.03 -0.21 0.76 0.42 -0.81 0.00 0.00 175.30 175.44 1jan s ILE 97 N 1.38 4.66 0.17 4.11 1.01 -1.26 -0.07 121.20 131.20 1jan s ILE 97 Ca -0.05 -0.27 -0.08 0.00 0.00 0.00 0.00 60.65 60.25 1jan s ILE 97 Cb -0.13 -4.43 -0.03 0.00 0.01 0.00 0.00 42.46 37.88 1jan s ILE 97 CO -0.03 -0.99 1.51 0.03 0.00 0.00 0.00 174.94 175.46 1jan h ARG 98 N 9.17 0.82 -3.89 2.79 3.08 -0.87 -3.48 114.38 122.00 1jan h ARG 98 Ca -0.27 -0.43 -0.20 0.00 0.07 0.00 0.00 59.98 59.15 1jan h ARG 98 Cb 1.09 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 31.08 1jan h ARG 98 CO 1.04 1.06 -0.12 0.54 -1.07 0.00 0.00 179.97 181.42 1jan s ASN 99 N -6.85 0.60 0.37 7.04 2.20 -1.26 -5.07 114.94 111.98 1jan s ASN 99 Ca -0.10 -1.34 0.04 0.00 -0.94 0.00 0.00 52.86 50.52 1jan s ASN 99 Cb 0.12 0.67 -0.05 0.00 -2.00 0.00 0.00 41.25 39.99 1jan s ASN 99 CO 0.86 -1.32 0.07 -0.31 -2.94 0.00 0.00 177.10 173.46 1jan s TYR 100 N -3.13 1.94 -0.10 1.54 1.51 -1.26 -4.59 117.35 113.25 1jan s TYR 100 Ca 0.27 -1.03 -0.02 0.00 -1.01 0.00 0.00 57.07 55.28 1jan s TYR 100 Cb -0.01 -1.30 -0.03 0.00 -0.11 0.00 0.00 41.96 40.50 1jan s TYR 100 CO 0.17 -0.04 -0.01 -0.08 -1.11 0.00 0.00 175.55 174.49 1jan s THR 101 N -3.20 4.24 -1.83 -0.71 -1.32 -1.26 -4.92 115.64 106.63 1jan s THR 101 Ca 0.30 -0.27 0.31 0.00 -1.21 0.00 0.00 61.69 60.83 1jan s THR 101 Cb 0.06 -2.79 0.80 0.00 -1.51 0.00 0.00 72.50 69.06 1jan s THR 101 CO 0.14 0.59 2.18 -0.81 -2.21 0.00 0.00 174.62 174.50 1jan n PRO 102 N 2.37 0.83 -0.12 7.08 -0.04 -1.26 -3.32 135.00 140.55 1jan n PRO 102 Ca -0.18 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.18 1jan n PRO 102 Cb 0.53 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.54 1jan n PRO 102 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1jan h GLN 103 N 0.00 0.88 -6.10 0.54 1.08 -1.94 -3.45 115.11 106.13 1jan h GLN 103 Ca 0.00 -0.37 -0.58 0.00 -1.45 0.00 0.00 58.65 56.25 1jan h GLN 103 Cb 0.08 -0.03 -0.11 0.00 -0.05 0.00 0.00 27.48 27.38 1jan h GLN 103 CO 0.00 1.02 -0.64 -0.51 -0.95 0.00 0.00 178.83 177.75 1jan s LEU 104 N -8.97 3.01 0.88 1.46 1.43 -1.21 -5.03 118.68 110.24 1jan s LEU 104 Ca -0.10 -0.89 -0.12 0.00 -1.03 0.00 0.00 54.13 51.99 1jan s LEU 104 Cb 0.13 -1.44 0.12 0.00 0.03 0.00 0.00 46.19 45.02 1jan s LEU 104 CO 0.85 -0.15 1.12 -0.94 0.23 0.00 0.00 176.35 177.46 1jan s SER 105 N -3.69 3.78 0.19 2.29 1.04 -1.26 -4.74 113.70 111.30 1jan s SER 105 Ca 0.34 1.15 -0.07 0.00 0.48 0.00 0.00 55.95 57.84 1jan s SER 105 Cb -0.03 -1.79 0.09 0.00 0.10 0.00 0.00 66.02 64.39 1jan s SER 105 CO 0.19 -2.40 1.57 -0.33 0.98 0.00 0.00 173.24 173.25 1jan h GLU 106 N -1.39 0.84 0.14 4.02 5.08 -1.99 -2.35 114.58 118.94 1jan h GLU 106 Ca -0.50 -0.38 -0.01 0.00 -1.00 0.00 0.00 59.36 57.48 1jan h GLU 106 Cb 1.31 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 1jan h GLU 106 CO 0.60 1.02 -0.08 0.00 -1.00 0.00 0.00 179.01 179.55 1jan h ALA 107 N 0.96 -0.21 -0.61 3.43 0.00 -1.98 0.96 119.26 121.82 1jan h ALA 107 Ca 0.08 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1jan h ALA 107 Cb 0.83 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1jan h ALA 107 CO 0.07 -0.62 0.33 0.93 0.00 0.00 0.00 179.25 179.96 1jan h GLU 108 N -0.21 0.83 -0.24 0.00 5.08 -1.93 0.24 114.58 118.35 1jan h GLU 108 Ca -0.02 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.23 1jan h GLU 108 Cb 0.18 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1jan h GLU 108 CO 0.02 0.62 0.03 0.28 -1.00 0.00 0.00 179.01 178.96 1jan h VAL 109 N 0.84 1.24 -0.02 3.13 2.07 -1.01 -0.63 116.25 121.88 1jan h VAL 109 Ca 0.22 -0.80 -0.06 0.00 0.82 0.00 0.00 66.70 66.87 1jan h VAL 109 Cb 0.03 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1jan h VAL 109 CO -0.03 0.25 -0.29 -0.33 0.02 0.00 0.00 177.57 177.18 1jan h GLU 110 N 0.20 0.03 -0.08 1.57 5.08 -0.26 -2.31 114.58 118.81 1jan h GLU 110 Ca 0.07 -0.01 -0.20 0.00 -1.00 0.00 0.00 59.36 58.22 1jan h GLU 110 Cb 0.35 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.61 1jan h GLU 110 CO 0.01 0.33 -0.75 -0.09 -1.00 0.00 0.00 179.01 177.51 1jan h ARG 111 N 0.03 0.65 -0.93 2.33 9.65 -0.38 -2.78 114.38 122.95 1jan h ARG 111 Ca 0.00 -0.59 0.00 0.00 -1.10 0.00 0.00 59.98 58.29 1jan h ARG 111 Cb 0.54 0.14 -0.05 0.00 -1.39 0.00 0.00 29.97 29.22 1jan h ARG 111 CO 0.04 1.20 0.59 0.00 2.80 0.00 0.00 179.97 184.60 1jan h ALA 112 N 0.46 1.19 -0.34 2.80 0.00 -0.70 -1.78 119.26 120.88 1jan h ALA 112 Ca -0.07 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 1jan h ALA 112 Cb 1.40 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1jan h ALA 112 CO 0.15 0.62 -0.43 0.82 0.00 0.00 0.00 179.25 180.41 1jan h ILE 113 N 1.28 1.28 0.03 0.00 1.08 -1.49 -2.03 117.51 117.65 1jan h ILE 113 Ca 0.34 -1.61 -0.00 0.00 -0.39 0.00 0.00 64.86 63.20 1jan h ILE 113 Cb -0.09 1.49 0.00 0.00 -3.07 0.00 0.00 36.82 35.15 1jan h ILE 113 CO -0.07 0.53 -0.01 0.50 -0.69 0.00 0.00 178.15 178.41 1jan h LYS 114 N 0.70 -0.04 -0.07 2.37 3.64 -1.31 -0.25 116.57 121.61 1jan h LYS 114 Ca 0.04 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 1jan h LYS 114 Cb 1.03 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.85 1jan h LYS 114 CO 0.10 0.20 -0.21 -0.44 -2.27 0.00 0.00 179.45 176.84 1jan h ASP 115 N -0.27 0.11 -0.25 4.20 5.19 -1.38 -1.97 116.42 122.05 1jan h ASP 115 Ca -0.00 -0.02 -0.10 0.00 -0.62 0.00 0.00 57.03 56.28 1jan h ASP 115 Cb 0.26 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 39.73 1jan h ASP 115 CO 0.01 0.33 -0.22 0.00 -3.12 0.00 0.00 179.24 176.23 1jan h ALA 116 N 1.69 0.36 -0.27 3.45 0.00 -1.10 -3.00 119.26 120.39 1jan h ALA 116 Ca 0.02 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 1jan h ALA 116 Cb 0.43 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1jan h ALA 116 CO 0.03 0.32 -0.12 0.74 0.00 0.00 0.00 179.25 180.22 1jan h PHE 117 N 0.30 0.49 0.00 0.00 0.04 -0.80 -3.23 116.94 113.73 1jan h PHE 117 Ca 0.04 -0.07 -0.05 0.00 2.80 0.00 0.00 57.97 60.70 1jan h PHE 117 Cb 0.78 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.79 1jan h PHE 117 CO 0.07 0.56 -0.22 0.93 -0.60 0.00 0.00 178.31 179.06 1jan h GLU 118 N 0.42 0.00 -0.37 1.51 4.39 -1.22 -2.49 114.58 116.82 1jan h GLU 118 Ca 0.08 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 1jan h GLU 118 Cb 0.46 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.10 1jan h GLU 118 CO 0.03 0.22 0.18 -0.07 -1.16 0.00 0.00 179.01 178.21 1jan h LEU 119 N 0.00 0.48 -0.63 1.33 3.38 -1.56 -0.90 115.31 117.42 1jan h LEU 119 Ca -0.00 -0.12 -0.15 0.00 0.09 0.00 0.00 57.88 57.70 1jan h LEU 119 Cb 0.43 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1jan h LEU 119 CO 0.03 0.46 -0.53 -0.50 0.09 0.00 0.00 178.44 177.99 1jan h TRP 120 N 0.46 0.52 -0.18 1.13 4.06 -1.71 -3.27 115.95 116.97 1jan h TRP 120 Ca 0.13 -0.18 -0.01 0.00 2.06 0.00 0.00 58.89 60.89 1jan h TRP 120 Cb 0.10 -0.10 -0.01 0.00 -1.00 0.00 0.00 29.16 28.16 1jan h TRP 120 CO -0.02 0.86 0.06 1.03 -3.56 0.00 0.00 178.44 176.82 1jan h SER 121 N 0.33 0.25 0.10 -3.49 0.87 -1.20 -2.63 113.55 107.78 1jan h SER 121 Ca 0.01 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.38 1jan h SER 121 Cb 1.04 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1jan h SER 121 CO 0.09 0.37 0.00 1.33 -0.53 0.00 0.00 176.83 178.10 1jan n VAL 122 N -4.83 0.17 -0.03 2.23 0.24 -0.36 -2.56 118.33 113.18 1jan n VAL 122 Ca -0.04 0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1jan n VAL 122 Cb 0.14 -0.77 0.00 0.00 -1.47 0.00 0.00 33.84 31.74 1jan n VAL 122 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jan n ALA 123 N -1.09 2.21 -2.88 2.33 0.00 -1.12 -5.06 120.51 114.89 1jan n ALA 123 Ca 0.11 -0.71 -0.15 0.00 0.00 0.00 0.00 53.44 52.69 1jan n ALA 123 Cb 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.49 1jan n ALA 123 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1jan s SER 124 N -0.43 1.06 0.00 0.00 1.04 -1.01 -4.61 113.70 109.74 1jan s SER 124 Ca 0.00 -1.54 0.23 0.00 0.48 0.00 0.00 55.95 55.12 1jan s SER 124 Cb 0.00 0.68 1.06 0.00 0.10 0.00 0.00 66.02 67.86 1jan s SER 124 CO 0.00 -1.33 1.72 -0.81 0.98 0.00 0.00 173.24 173.81 1jan n PRO 125 N -0.60 1.42 -2.45 4.02 -0.04 -1.26 -4.82 135.00 131.28 1jan n PRO 125 Ca 0.01 -0.63 -0.40 0.00 -0.04 0.00 0.00 63.50 62.44 1jan n PRO 125 Cb 0.61 -1.40 -0.04 0.00 -0.04 0.00 0.00 33.50 32.63 1jan n PRO 125 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1jan s LEU 126 N -1.72 4.53 -0.02 1.53 1.43 -1.26 -4.86 118.68 118.31 1jan s LEU 126 Ca 0.34 2.26 0.06 0.00 -1.03 0.00 0.00 54.13 55.77 1jan s LEU 126 Cb 0.17 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.76 1jan s LEU 126 CO 0.28 -0.20 -0.22 -0.63 0.23 0.00 0.00 176.35 175.82 1jan s ILE 127 N -0.92 1.72 -0.16 -0.59 1.01 0.19 -4.57 121.20 117.89 1jan s ILE 127 Ca 0.46 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 60.20 1jan s ILE 127 Cb -0.32 -1.44 0.01 0.00 0.01 0.00 0.00 42.46 40.72 1jan s ILE 127 CO 0.40 0.49 -0.17 -0.36 0.00 0.00 0.00 174.94 175.30 1jan s PHE 128 N -0.40 2.77 -0.10 3.97 0.08 -1.26 -1.36 117.98 121.68 1jan s PHE 128 Ca 0.06 -1.25 0.04 0.00 0.12 0.00 0.00 56.93 55.89 1jan s PHE 128 Cb -0.09 -1.90 -0.00 0.00 -0.57 0.00 0.00 43.02 40.46 1jan s PHE 128 CO 0.00 -0.59 -0.24 0.99 -0.10 0.00 0.00 175.22 175.28 1jan s THR 129 N 0.98 2.09 0.01 0.64 2.01 0.17 -4.99 115.64 116.55 1jan s THR 129 Ca -0.02 -1.01 -0.25 0.00 0.31 0.00 0.00 61.69 60.72 1jan s THR 129 Cb -0.15 -1.79 -0.05 0.00 0.01 0.00 0.00 72.50 70.52 1jan s THR 129 CO -0.04 0.56 0.75 -0.60 -0.69 0.00 0.00 174.62 174.61 1jan s ARG 130 N 0.30 4.48 -0.04 4.92 3.52 -1.26 -1.22 118.95 129.65 1jan s ARG 130 Ca -0.18 1.03 0.06 0.00 -0.13 0.00 0.00 55.73 56.51 1jan s ARG 130 Cb -0.18 -3.39 -0.01 0.00 -1.56 0.00 0.00 34.95 29.81 1jan s ARG 130 CO 0.09 0.21 -0.23 0.96 -0.81 0.00 0.00 175.30 175.52 1jan s ILE 131 N 0.21 1.88 0.21 4.11 -4.36 -0.66 -4.91 121.20 117.68 1jan s ILE 131 Ca 0.39 -0.99 0.24 0.00 -0.26 0.00 0.00 60.65 60.03 1jan s ILE 131 Cb -0.20 -1.58 0.24 0.00 1.25 0.00 0.00 42.46 42.18 1jan s ILE 131 CO 0.22 0.53 1.88 0.28 0.24 0.00 0.00 174.94 178.09 1jan h SER 132 N 5.88 0.00 -5.03 4.36 0.02 -1.98 -3.41 113.55 113.39 1jan h SER 132 Ca -0.36 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.62 1jan h SER 132 Cb 1.16 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.67 1jan h SER 132 CO 0.47 0.21 0.28 -1.10 -1.14 0.00 0.00 176.83 175.55 1jan s GLN 133 N -3.79 1.98 0.14 3.45 -0.21 -1.26 -4.91 119.66 115.05 1jan s GLN 133 Ca -0.00 -1.20 0.00 0.00 0.02 0.00 0.00 55.36 54.17 1jan s GLN 133 Cb 0.11 0.60 0.00 0.00 1.00 0.00 0.00 33.01 34.72 1jan s GLN 133 CO 0.63 -0.92 0.00 0.41 -2.12 0.00 0.00 175.29 173.29 1jan n GLY 134 N -0.51 -2.89 3.54 3.09 0.00 -1.26 -4.83 105.19 102.33 1jan n GLY 134 Ca -0.06 -1.91 -0.43 0.00 0.00 0.00 0.00 46.02 43.62 1jan n GLY 134 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jan s GLU 135 N -0.56 3.39 0.35 1.61 0.41 -1.26 -5.03 118.70 117.62 1jan s GLU 135 Ca 0.00 -0.13 0.03 0.00 -0.41 0.00 0.00 54.97 54.46 1jan s GLU 135 Cb 0.00 -4.03 -0.02 0.00 -1.78 0.00 0.00 34.13 28.31 1jan s GLU 135 CO 0.00 -1.47 0.53 0.00 -0.49 0.00 0.00 175.26 173.83 1jan s ALA 136 N 4.05 3.91 0.10 5.21 0.00 -1.26 -5.02 121.76 128.75 1jan s ALA 136 Ca 0.33 -1.17 -0.14 0.00 0.00 0.00 0.00 51.96 50.98 1jan s ALA 136 Cb -0.11 -1.93 -0.11 0.00 0.00 0.00 0.00 23.12 20.97 1jan s ALA 136 CO 0.21 -0.08 1.37 -0.44 0.00 0.00 0.00 175.76 176.82 1jan h ASP 137 N 0.76 0.83 -3.24 0.00 3.32 -1.70 -3.41 116.42 112.97 1jan h ASP 137 Ca -0.48 -0.54 -0.65 0.00 0.02 0.00 0.00 57.03 55.38 1jan h ASP 137 Cb 1.24 -0.24 -0.36 0.00 0.22 0.00 0.00 39.33 40.20 1jan h ASP 137 CO 0.58 1.21 -0.84 -0.63 -1.72 0.00 0.00 179.24 177.84 1jan s ILE 138 N -4.09 1.95 -0.12 0.35 1.01 -0.53 -4.56 121.20 115.21 1jan s ILE 138 Ca -0.12 -1.01 -0.07 0.00 0.00 0.00 0.00 60.65 59.45 1jan s ILE 138 Cb 0.09 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.67 1jan s ILE 138 CO 0.86 0.39 0.14 0.20 0.00 0.00 0.00 174.94 176.53 1jan s ASN 139 N 1.30 6.38 -0.04 3.58 0.01 -1.26 -0.76 114.94 124.15 1jan s ASN 139 Ca 0.02 0.46 0.06 0.00 -0.71 0.00 0.00 52.86 52.69 1jan s ASN 139 Cb -0.14 -2.07 -0.02 0.00 0.41 0.00 0.00 41.25 39.43 1jan s ASN 139 CO -0.11 0.40 -0.22 -0.63 -1.51 0.00 0.00 177.10 175.02 1jan s ILE 140 N -0.95 2.33 -0.02 0.60 1.09 0.90 -2.28 121.20 122.88 1jan s ILE 140 Ca 0.15 -0.99 -0.30 0.00 -1.10 0.00 0.00 60.65 58.41 1jan s ILE 140 Cb -0.12 -1.85 0.07 0.00 -1.06 0.00 0.00 42.46 39.50 1jan s ILE 140 CO 0.04 0.58 0.68 0.00 -0.10 0.00 0.00 174.94 176.13 1jan s ALA 141 N -0.47 -1.74 -0.27 9.38 0.00 -1.10 -0.06 121.76 127.49 1jan s ALA 141 Ca 0.06 1.18 -0.06 0.00 0.00 0.00 0.00 51.96 53.13 1jan s ALA 141 Cb -0.11 0.14 -0.00 0.00 0.00 0.00 0.00 23.12 23.14 1jan s ALA 141 CO 0.01 -0.44 0.05 -0.06 0.00 0.00 0.00 175.76 175.32 1jan s PHE 142 N -1.67 3.09 0.41 0.00 0.40 -1.26 -0.66 117.98 118.30 1jan s PHE 142 Ca -0.08 -0.82 0.04 0.00 -0.60 0.00 0.00 56.93 55.47 1jan s PHE 142 Cb -0.00 -2.22 -0.05 0.00 0.51 0.00 0.00 43.02 41.26 1jan s PHE 142 CO 0.05 -0.51 0.04 0.71 0.70 0.00 0.00 175.22 176.21 1jan s TYR 143 N 1.53 2.11 0.00 0.36 2.02 -0.44 -4.73 117.35 118.19 1jan s TYR 143 Ca 0.04 -0.91 0.08 0.00 -0.37 0.00 0.00 57.07 55.91 1jan s TYR 143 Cb -0.16 -1.51 -0.02 0.00 -0.40 0.00 0.00 41.96 39.87 1jan s TYR 143 CO 0.02 0.17 -0.23 -0.65 -1.57 0.00 0.00 175.55 173.28 1jan s GLN 144 N -3.80 1.80 0.00 -0.62 -0.21 -1.26 0.42 119.66 115.99 1jan s GLN 144 Ca 0.27 -0.89 0.00 0.00 0.02 0.00 0.00 55.36 54.76 1jan s GLN 144 Cb 0.07 -1.80 0.00 0.00 1.00 0.00 0.00 33.01 32.27 1jan s GLN 144 CO 0.13 0.49 0.00 0.54 -2.12 0.00 0.00 175.29 174.33 1jan n ARG 145 N 2.30 0.00 -2.24 2.91 5.12 -1.26 -4.12 116.66 119.37 1jan n ARG 145 Ca -0.16 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.35 1jan n ARG 145 Cb 0.52 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.79 1jan n ARG 145 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1jan s ASP 146 N -2.89 6.94 -0.24 0.55 1.01 -1.26 -0.98 116.67 119.80 1jan s ASP 146 Ca 0.00 2.50 0.15 0.00 0.71 0.00 0.00 52.55 55.92 1jan s ASP 146 Cb 0.00 -2.63 0.38 0.00 1.01 0.00 0.00 42.92 41.68 1jan s ASP 146 CO 0.00 -0.42 1.31 0.00 0.21 0.00 0.00 175.17 176.27 1jan n HIS 147 N 1.33 -0.63 -0.05 4.23 1.44 -1.26 -4.97 115.22 115.31 1jan n HIS 147 Ca 0.01 -1.57 0.00 0.00 -2.01 0.00 0.00 57.72 54.15 1jan n HIS 147 Cb 0.43 0.75 0.00 0.00 0.12 0.00 0.00 29.99 31.29 1jan n HIS 147 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1jan n GLY 148 N -0.89 2.19 0.60 -1.39 0.00 -1.26 -4.91 105.19 99.54 1jan n GLY 148 Ca -0.10 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.98 1jan n GLY 148 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1jan n ASP 149 N 0.00 3.00 -0.21 1.61 5.68 -1.26 -4.99 116.55 120.38 1jan n ASP 149 Ca 0.00 -2.23 -0.03 0.00 -0.50 0.00 0.00 54.79 52.03 1jan n ASP 149 Cb 0.00 -0.27 -0.01 0.00 -1.14 0.00 0.00 41.12 39.70 1jan n ASP 149 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1jan n ASN 150 N 0.15 -3.89 -3.23 -1.12 3.02 -1.26 -4.91 115.26 104.01 1jan n ASN 150 Ca 0.12 0.07 -0.23 0.00 -0.03 0.00 0.00 54.58 54.51 1jan n ASN 150 Cb 0.50 -1.63 -0.07 0.00 -0.61 0.00 0.00 39.78 37.97 1jan n ASN 150 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1jan n SER 151 N 0.19 -0.57 -4.73 6.41 7.64 -1.26 -5.12 113.62 116.17 1jan n SER 151 Ca -0.03 -2.59 -0.37 0.00 1.01 0.00 0.00 58.87 56.90 1jan n SER 151 Cb 0.18 -0.29 0.06 0.00 -1.01 0.00 0.00 64.21 63.15 1jan n SER 151 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1jan s PRO 152 N -0.34 2.62 0.91 1.43 0.04 -1.26 -4.87 135.00 133.53 1jan s PRO 152 Ca 0.34 2.02 -0.14 0.00 0.04 0.00 0.00 61.00 63.26 1jan s PRO 152 Cb 0.10 -1.86 0.17 0.00 0.04 0.00 0.00 34.50 32.95 1jan s PRO 152 CO -0.16 -1.54 1.27 -0.06 0.04 0.00 0.00 177.00 176.55 1jan s PHE 153 N -1.43 1.87 -0.13 0.56 0.08 -0.15 -4.92 117.98 113.86 1jan s PHE 153 Ca 0.82 0.35 0.15 0.00 0.12 0.00 0.00 56.93 58.37 1jan s PHE 153 Cb -0.36 -3.91 0.29 0.00 -0.57 0.00 0.00 43.02 38.46 1jan s PHE 153 CO 0.39 -2.40 1.15 -0.40 -0.10 0.00 0.00 175.22 173.85 1jan n ASP 154 N -3.60 1.89 0.00 1.36 5.75 -1.26 -4.23 116.55 116.46 1jan n ASP 154 Ca 0.14 -3.08 0.00 0.00 -0.01 0.00 0.00 54.79 51.84 1jan n ASP 154 Cb 0.60 -0.42 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 1jan n ASP 154 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1jan n GLY 155 N -1.13 -2.14 3.54 6.12 0.00 -1.26 -4.90 105.19 105.41 1jan n GLY 155 Ca 0.14 -1.50 -0.44 0.00 0.00 0.00 0.00 46.02 44.22 1jan n GLY 155 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1jan n PRO 156 N -0.16 1.01 0.00 1.61 -0.02 -1.26 -4.71 135.00 131.47 1jan n PRO 156 Ca 0.00 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 1jan n PRO 156 Cb 0.00 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 1jan n PRO 156 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1jan n ASN 157 N 1.28 -2.81 0.00 2.55 3.02 -1.26 -4.92 115.26 113.12 1jan n ASN 157 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.66 1jan n ASN 157 Cb 0.33 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 1jan n ASN 157 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jan n GLY 158 N 0.00 1.84 3.69 7.41 0.00 -1.26 -4.57 105.19 112.31 1jan n GLY 158 Ca 0.00 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.06 1jan n GLY 158 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1jan s ILE 159 N 0.00 3.57 -0.05 -0.61 2.07 -1.26 -4.93 121.20 120.00 1jan s ILE 159 Ca 0.00 1.01 0.09 0.00 -1.41 0.00 0.00 60.65 60.34 1jan s ILE 159 Cb 0.00 -3.65 -0.24 0.00 0.13 0.00 0.00 42.46 38.70 1jan s ILE 159 CO 0.00 0.02 0.65 -0.07 -1.91 0.00 0.00 174.94 173.63 1jan h LEU 160 N 8.00 0.08 -7.08 8.50 4.07 -1.94 -3.43 115.31 123.51 1jan h LEU 160 Ca -0.39 -0.18 0.37 0.00 0.08 0.00 0.00 57.88 57.76 1jan h LEU 160 Cb 1.19 -0.03 -0.14 0.00 1.08 0.00 0.00 40.66 42.76 1jan h LEU 160 CO 0.89 1.16 0.93 0.00 -1.08 0.00 0.00 178.44 180.34 1jan s ALA 161 N -2.60 -2.40 0.15 1.53 0.00 -1.26 -0.89 121.76 116.29 1jan s ALA 161 Ca -0.07 0.94 -0.18 0.00 0.00 0.00 0.00 51.96 52.64 1jan s ALA 161 Cb 0.08 0.23 0.04 0.00 0.00 0.00 0.00 23.12 23.47 1jan s ALA 161 CO 0.82 -1.02 0.49 -3.38 0.00 0.00 0.00 175.76 172.66 1jan s HIS 162 N -2.17 -0.26 0.06 0.00 -3.43 -0.36 -4.99 115.29 104.14 1jan s HIS 162 Ca 0.14 -0.04 -0.02 0.00 -0.80 0.00 0.00 55.06 54.35 1jan s HIS 162 Cb 0.06 0.37 -0.03 0.00 -1.43 0.00 0.00 32.58 31.55 1jan s HIS 162 CO -0.06 -0.80 0.01 0.00 -2.00 0.00 0.00 174.74 171.89 1jan s ALA 163 N -3.81 0.38 -0.14 -1.38 0.00 -1.26 -1.03 121.76 114.52 1jan s ALA 163 Ca 0.04 -1.10 -0.07 0.00 0.00 0.00 0.00 51.96 50.84 1jan s ALA 163 Cb 0.00 0.30 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 1jan s ALA 163 CO -0.10 -0.39 0.10 -0.06 0.00 0.00 0.00 175.76 175.31 1jan s PHE 164 N -3.85 3.43 1.02 0.00 0.40 0.67 -4.80 117.98 114.85 1jan s PHE 164 Ca 0.06 0.35 -0.12 0.00 -0.60 0.00 0.00 56.93 56.63 1jan s PHE 164 Cb 0.07 -1.97 0.18 0.00 0.51 0.00 0.00 43.02 41.82 1jan s PHE 164 CO -0.10 0.52 0.99 0.00 0.70 0.00 0.00 175.22 177.33 1jan n GLN 165 N 2.52 -1.17 -1.61 0.44 10.64 -1.26 -0.92 117.38 126.02 1jan n GLN 165 Ca -0.19 -0.29 -0.44 0.00 -1.83 0.00 0.00 57.00 54.26 1jan n GLN 165 Cb 0.54 -2.23 -0.01 0.00 -0.86 0.00 0.00 30.24 27.67 1jan n GLN 165 CO 0.00 0.00 0.00 -2.30 -1.83 0.00 0.00 177.06 172.93 1jan n PRO 166 N -4.18 1.46 0.00 2.61 -0.02 -1.20 -1.35 135.00 132.32 1jan n PRO 166 Ca 0.08 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1jan n PRO 166 Cb 0.53 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 1jan n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jan n GLY 167 N 1.16 0.19 3.88 -1.23 0.00 -1.26 -4.77 105.19 103.15 1jan n GLY 167 Ca 0.09 -1.15 -0.31 0.00 0.00 0.00 0.00 46.02 44.65 1jan n GLY 167 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1jan s GLN 168 N -2.00 3.79 3.23 1.61 2.00 -1.26 -4.21 119.66 122.81 1jan s GLN 168 Ca 0.00 0.36 0.00 0.00 -2.00 0.00 0.00 55.36 53.72 1jan s GLN 168 Cb 0.00 -2.50 0.00 0.00 0.80 0.00 0.00 33.01 31.31 1jan s GLN 168 CO 0.00 0.12 0.00 0.41 -0.50 0.00 0.00 175.29 175.32 1jan n GLY 169 N -0.85 0.53 0.15 2.59 0.00 -1.26 -3.32 105.19 103.02 1jan n GLY 169 Ca 0.01 -1.08 0.11 0.00 0.00 0.00 0.00 46.02 45.06 1jan n GLY 169 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1jan n ILE 170 N 0.00 1.05 -1.75 -0.61 0.13 -1.26 -4.70 119.36 112.22 1jan n ILE 170 Ca 0.00 0.67 -0.42 0.00 -1.10 0.00 0.00 62.75 61.91 1jan n ILE 170 Cb 0.00 -1.66 -0.01 0.00 -0.84 0.00 0.00 39.64 37.13 1jan n ILE 170 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1jan n GLY 171 N -1.16 1.12 2.78 4.50 0.00 -1.21 -1.20 105.19 110.02 1jan n GLY 171 Ca -0.01 0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.38 1jan n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jan n GLY 172 N 1.18 3.06 3.77 -0.02 0.00 -0.10 -4.48 105.19 108.60 1jan n GLY 172 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1jan n GLY 172 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1jan s ASP 173 N -1.21 6.59 -0.20 1.61 1.11 -0.34 -4.58 116.67 119.65 1jan s ASP 173 Ca 0.00 2.46 0.01 0.00 0.18 0.00 0.00 52.55 55.20 1jan s ASP 173 Cb 0.00 -2.63 0.03 0.00 1.07 0.00 0.00 42.92 41.39 1jan s ASP 173 CO 0.00 -0.63 -0.18 0.00 1.18 0.00 0.00 175.17 175.54 1jan s ALA 174 N -1.31 2.37 -0.12 5.23 0.00 -0.96 -0.24 121.76 126.73 1jan s ALA 174 Ca 0.54 -1.34 -0.02 0.00 0.00 0.00 0.00 51.96 51.15 1jan s ALA 174 Cb -0.34 -1.28 -0.03 0.00 0.00 0.00 0.00 23.12 21.48 1jan s ALA 174 CO 0.43 -0.56 -0.05 -1.01 0.00 0.00 0.00 175.76 174.57 1jan s HIS 175 N 1.25 2.98 -0.08 0.00 3.76 -0.20 -2.73 115.29 120.28 1jan s HIS 175 Ca 0.02 -0.19 0.01 0.00 -0.15 0.00 0.00 55.06 54.75 1jan s HIS 175 Cb -0.15 -1.85 -0.03 0.00 1.11 0.00 0.00 32.58 31.67 1jan s HIS 175 CO -0.11 0.11 -0.08 -0.06 -0.85 0.00 0.00 174.74 173.75 1jan s PHE 176 N -0.13 2.89 -0.06 1.40 0.40 0.17 -1.23 117.98 121.42 1jan s PHE 176 Ca 0.02 -0.09 -0.29 0.00 -0.60 0.00 0.00 56.93 55.97 1jan s PHE 176 Cb -0.13 -1.73 -0.07 0.00 0.51 0.00 0.00 43.02 41.61 1jan s PHE 176 CO 0.03 0.23 1.87 0.34 0.70 0.00 0.00 175.22 178.39 1jan s ASP 177 N -0.60 6.35 0.50 1.36 -1.08 -0.07 -1.33 116.67 121.79 1jan s ASP 177 Ca 0.09 2.30 0.33 0.00 -0.52 0.00 0.00 52.55 54.74 1jan s ASP 177 Cb -0.12 -2.53 1.41 0.00 -1.46 0.00 0.00 42.92 40.23 1jan s ASP 177 CO 0.02 -1.18 1.97 0.00 0.52 0.00 0.00 175.17 176.49 1jan h ALA 178 N 10.98 1.00 -0.00 3.66 0.00 -0.33 -2.94 119.26 131.63 1jan h ALA 178 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1jan h ALA 178 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1jan h ALA 178 CO 0.96 0.00 -0.03 0.39 0.00 0.00 0.00 179.25 180.56 1jan n GLU 179 N -2.88 0.64 -2.02 0.00 1.02 -1.26 -4.89 120.64 111.25 1jan n GLU 179 Ca 0.00 -0.08 -0.29 0.00 -0.02 0.00 0.00 57.16 56.77 1jan n GLU 179 Cb 0.25 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.21 1jan n GLU 179 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1jan s GLU 180 N -2.42 3.05 -0.37 3.49 0.41 -1.11 -4.33 118.70 117.42 1jan s GLU 180 Ca 0.33 0.42 -0.20 0.00 -0.41 0.00 0.00 54.97 55.11 1jan s GLU 180 Cb 0.21 -2.10 0.01 0.00 -1.78 0.00 0.00 34.13 30.46 1jan s GLU 180 CO 0.44 -0.84 0.60 0.99 -0.49 0.00 0.00 175.26 175.96 1jan s THR 181 N -3.22 4.92 -0.16 3.63 2.01 -1.26 -5.03 115.64 116.52 1jan s THR 181 Ca 0.56 0.39 -0.09 0.00 0.31 0.00 0.00 61.69 62.86 1jan s THR 181 Cb -0.11 -4.07 -0.05 0.00 0.01 0.00 0.00 72.50 68.29 1jan s THR 181 CO 0.51 -0.35 0.15 0.26 -0.69 0.00 0.00 174.62 174.50 1jan s TRP 182 N 2.62 3.49 0.31 4.92 0.52 -1.26 -0.07 118.94 129.47 1jan s TRP 182 Ca 0.22 0.44 0.05 0.00 0.02 0.00 0.00 56.10 56.83 1jan s TRP 182 Cb -0.15 -2.10 -0.03 0.00 -1.15 0.00 0.00 33.47 30.04 1jan s TRP 182 CO 0.15 0.45 0.27 0.95 0.02 0.00 0.00 176.95 178.80 1jan s THR 183 N -0.15 0.00 -0.20 2.01 -4.23 0.52 -4.66 115.64 108.93 1jan s THR 183 Ca 0.11 -1.97 0.18 0.00 -1.18 0.00 0.00 61.69 58.84 1jan s THR 183 Cb -0.12 -2.51 0.46 0.00 1.34 0.00 0.00 72.50 71.68 1jan s THR 183 CO 0.01 0.00 1.16 -0.46 -0.54 0.00 0.00 174.62 174.79 1jan n ASN 184 N -1.35 2.30 0.00 3.99 2.04 -1.26 -1.28 115.26 119.70 1jan n ASN 184 Ca 0.06 -2.77 0.00 0.00 -0.44 0.00 0.00 54.58 51.43 1jan n ASN 184 Cb 0.63 -0.41 0.00 0.00 -2.53 0.00 0.00 39.78 37.47 1jan n ASN 184 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 1jan n THR 185 N -0.46 0.00 0.21 5.53 -2.24 -1.26 -5.06 114.28 111.00 1jan n THR 185 Ca 0.18 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.07 1jan n THR 185 Cb 0.91 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.09 1jan n THR 185 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1jan n SER 186 N 0.00 0.54 -4.75 3.42 3.41 -1.26 -4.70 113.62 110.28 1jan n SER 186 Ca 0.00 0.08 -0.38 0.00 -0.26 0.00 0.00 58.87 58.31 1jan n SER 186 Cb 0.00 0.99 0.04 0.00 -0.26 0.00 0.00 64.21 64.98 1jan n SER 186 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jan s ALA 187 N -3.36 2.80 0.19 7.33 0.00 -1.26 -4.90 121.76 122.56 1jan s ALA 187 Ca -0.01 1.34 -0.30 0.00 0.00 0.00 0.00 51.96 52.99 1jan s ALA 187 Cb 0.12 -3.57 -0.08 0.00 0.00 0.00 0.00 23.12 19.59 1jan s ALA 187 CO 0.83 -1.41 1.17 -0.80 0.00 0.00 0.00 175.76 175.55 1jan s ASN 188 N -0.96 7.13 0.32 0.00 0.01 -1.26 -4.13 114.94 116.05 1jan s ASN 188 Ca 0.72 2.22 0.09 0.00 -0.71 0.00 0.00 52.86 55.18 1jan s ASN 188 Cb -0.41 -2.61 -0.04 0.00 0.41 0.00 0.00 41.25 38.60 1jan s ASN 188 CO 0.48 -0.33 0.08 -0.31 -1.51 0.00 0.00 177.10 175.51 1jan s TYR 189 N -0.20 2.68 -0.27 2.20 2.02 0.90 -4.70 117.35 119.97 1jan s TYR 189 Ca 0.51 -0.35 -0.07 0.00 -0.37 0.00 0.00 57.07 56.79 1jan s TYR 189 Cb -0.32 -1.51 -0.01 0.00 -0.40 0.00 0.00 41.96 39.73 1jan s TYR 189 CO 0.37 0.43 0.07 1.21 -1.57 0.00 0.00 175.55 176.06 1jan s ASN 190 N -3.78 5.07 0.34 2.29 3.84 -1.26 0.19 114.94 121.63 1jan s ASN 190 Ca 0.36 -0.48 0.03 0.00 0.21 0.00 0.00 52.86 52.97 1jan s ASN 190 Cb -0.03 -1.89 0.64 0.00 -0.55 0.00 0.00 41.25 39.42 1jan s ASN 190 CO 0.21 -0.12 1.96 0.25 -2.79 0.00 0.00 177.10 176.62 1jan h LEU 191 N 8.23 0.76 0.32 3.21 5.85 -1.55 -2.50 115.31 129.63 1jan h LEU 191 Ca -0.35 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.35 1jan h LEU 191 Cb 1.15 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.01 1jan h LEU 191 CO 0.60 0.51 -0.15 0.15 -0.34 0.00 0.00 178.44 179.21 1jan h PHE 192 N 0.88 -0.39 -0.72 1.25 3.57 -1.82 0.29 116.94 119.99 1jan h PHE 192 Ca 0.31 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.78 1jan h PHE 192 Cb 0.13 0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1jan h PHE 192 CO -0.00 -0.13 0.35 -0.07 -2.23 0.00 0.00 178.31 176.23 1jan h LEU 193 N -0.62 0.93 -0.35 0.59 3.38 -1.91 -0.67 115.31 116.67 1jan h LEU 193 Ca -0.04 -0.10 -0.18 0.00 0.09 0.00 0.00 57.88 57.65 1jan h LEU 193 Cb 0.44 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1jan h LEU 193 CO 0.07 0.79 -0.49 0.58 0.09 0.00 0.00 178.44 179.48 1jan h VAL 194 N 1.03 1.27 -0.19 1.22 2.07 -1.34 -2.64 116.25 117.68 1jan h VAL 194 Ca 0.25 -1.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.08 1jan h VAL 194 Cb 0.11 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1jan h VAL 194 CO -0.03 0.55 0.05 0.00 0.02 0.00 0.00 177.57 178.15 1jan h ALA 195 N 0.74 0.25 -0.51 1.67 0.00 -0.14 -0.78 119.26 120.49 1jan h ALA 195 Ca 0.03 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 54.90 1jan h ALA 195 Cb 1.09 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1jan h ALA 195 CO 0.11 -0.11 0.35 0.00 0.00 0.00 0.00 179.25 179.60 1jan h ALA 196 N 0.86 2.20 0.06 0.00 0.00 -1.16 0.72 119.26 121.94 1jan h ALA 196 Ca 0.06 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1jan h ALA 196 Cb 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1jan h ALA 196 CO 0.00 -0.32 -0.03 1.25 0.00 0.00 0.00 179.25 180.15 1jan h HIS 197 N 0.21 -0.08 -0.90 0.00 6.17 -1.01 -3.20 115.15 116.34 1jan h HIS 197 Ca 0.24 -0.00 0.06 0.00 0.71 0.00 0.00 60.37 61.38 1jan h HIS 197 Cb 0.66 0.03 -0.06 0.00 2.52 0.00 0.00 27.41 30.56 1jan h HIS 197 CO -0.00 0.36 0.59 0.93 0.71 0.00 0.00 177.93 180.52 1jan h GLU 198 N -0.54 1.00 0.00 5.26 4.39 0.10 -2.45 114.58 122.33 1jan h GLU 198 Ca -0.01 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 1jan h GLU 198 Cb 0.47 -0.23 -0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1jan h GLU 198 CO 0.01 0.66 -0.07 0.74 -1.16 0.00 0.00 179.01 179.19 1jan h PHE 199 N 1.03 0.00 -0.19 4.33 0.04 -0.93 -1.70 116.94 119.53 1jan h PHE 199 Ca 0.39 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 61.06 1jan h PHE 199 Cb 0.19 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.34 1jan h PHE 199 CO -0.00 0.07 -0.25 0.78 -0.60 0.00 0.00 178.31 178.32 1jan h GLY 200 N 0.81 0.54 0.81 -1.45 0.00 -1.43 -1.40 103.07 100.95 1jan h GLY 200 Ca -0.00 -0.59 0.02 0.00 0.00 0.00 0.00 47.33 46.77 1jan h GLY 200 CO 0.01 0.53 0.08 0.45 0.00 0.00 0.00 176.54 177.61 1jan h HIS 201 N 0.15 0.15 -0.32 5.60 3.86 -1.38 -0.16 115.15 123.05 1jan h HIS 201 Ca 0.02 0.01 0.07 0.00 -1.16 0.00 0.00 60.37 59.32 1jan h HIS 201 Cb 0.81 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 29.23 1jan h HIS 201 CO 0.09 0.07 0.23 0.77 0.86 0.00 0.00 177.93 179.95 1jan h SER 202 N 0.19 0.10 0.42 2.45 0.02 -1.32 0.77 113.55 116.18 1jan h SER 202 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1jan h SER 202 Cb 0.07 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.59 1jan h SER 202 CO -0.10 0.06 -0.20 0.18 -1.14 0.00 0.00 176.83 175.63 1jan n LEU 203 N -4.46 0.56 0.00 5.07 4.77 -0.53 -3.25 117.00 119.16 1jan n LEU 203 Ca 0.04 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1jan n LEU 203 Cb 0.32 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1jan n LEU 203 CO 0.35 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1jan n GLY 204 N 1.35 1.20 3.88 -0.72 0.00 0.26 -4.71 105.19 106.46 1jan n GLY 204 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1jan n GLY 204 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jan s LEU 205 N 0.00 4.36 0.00 0.99 1.02 -0.22 -2.28 118.68 122.55 1jan s LEU 205 Ca 0.00 0.58 0.01 0.00 0.02 0.00 0.00 54.13 54.74 1jan s LEU 205 Cb 0.00 -2.76 0.01 0.00 0.02 0.00 0.00 46.19 43.46 1jan s LEU 205 CO 0.00 0.23 0.10 0.00 0.02 0.00 0.00 176.35 176.70 1jan n ALA 206 N 1.00 0.17 -1.79 4.21 0.00 0.22 -3.77 120.51 120.55 1jan n ALA 206 Ca -0.10 -0.31 -0.35 0.00 0.00 0.00 0.00 53.44 52.68 1jan n ALA 206 Cb 0.53 0.09 -0.03 0.00 0.00 0.00 0.00 19.45 20.04 1jan n ALA 206 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1jan s HIS 207 N 0.28 3.06 0.11 0.00 3.76 -1.26 -4.53 115.29 116.70 1jan s HIS 207 Ca 0.08 1.59 0.03 0.00 -0.15 0.00 0.00 55.06 56.61 1jan s HIS 207 Cb -0.01 -3.13 -0.04 0.00 1.11 0.00 0.00 32.58 30.51 1jan s HIS 207 CO 0.05 -0.88 0.15 0.45 -0.85 0.00 0.00 174.74 173.67 1jan s SER 208 N -1.76 5.83 0.00 1.40 0.15 -0.35 -4.01 113.70 114.96 1jan s SER 208 Ca 0.64 0.05 0.26 0.00 0.70 0.00 0.00 55.95 57.59 1jan s SER 208 Cb -0.20 -1.64 0.76 0.00 -1.71 0.00 0.00 66.02 63.23 1jan s SER 208 CO 0.24 0.13 1.58 -1.54 1.20 0.00 0.00 173.24 174.85 1jan n SER 209 N 0.06 2.01 -4.59 5.45 3.41 -1.26 -4.23 113.62 114.47 1jan n SER 209 Ca -0.07 -1.68 -0.42 0.00 -0.26 0.00 0.00 58.87 56.43 1jan n SER 209 Cb 0.53 -0.03 -0.04 0.00 -0.26 0.00 0.00 64.21 64.40 1jan n SER 209 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1jan s ASP 210 N -1.89 6.61 0.62 4.04 -1.08 -1.26 -4.90 116.67 118.80 1jan s ASP 210 Ca 0.35 0.45 0.42 0.00 -0.52 0.00 0.00 52.55 53.25 1jan s ASP 210 Cb 0.20 -2.43 2.26 0.00 -1.46 0.00 0.00 42.92 41.50 1jan s ASP 210 CO 0.31 -0.79 2.28 1.55 0.52 0.00 0.00 175.17 179.04 1jan h PRO 211 N 8.49 0.00 0.00 4.34 0.13 -2.01 -1.51 132.00 141.43 1jan h PRO 211 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1jan h PRO 211 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1jan h PRO 211 CO 0.95 0.00 -0.70 0.78 -0.23 0.00 0.00 178.00 178.80 1jan h GLY 212 N 0.02 0.00 -1.63 1.56 0.00 -1.97 -3.48 103.07 97.57 1jan h GLY 212 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 1jan h GLY 212 CO 0.00 0.00 0.36 0.00 0.00 0.00 0.00 176.54 176.90 1jan s ALA 213 N -3.25 2.43 0.23 3.60 0.00 -0.57 -4.83 121.76 119.36 1jan s ALA 213 Ca 0.04 0.49 0.10 0.00 0.00 0.00 0.00 51.96 52.59 1jan s ALA 213 Cb 0.11 -3.31 0.22 0.00 0.00 0.00 0.00 23.12 20.14 1jan s ALA 213 CO 0.74 -1.37 1.53 1.25 0.00 0.00 0.00 175.76 177.92 1jan h LEU 214 N -0.19 0.00 -0.55 0.00 5.85 -1.91 -3.08 115.31 115.42 1jan h LEU 214 Ca -0.46 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1jan h LEU 214 Cb 1.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.27 1jan h LEU 214 CO 0.54 0.70 0.00 0.23 -0.34 0.00 0.00 178.44 179.57 1jan n MET 215 N -3.68 0.96 -2.18 1.25 2.81 -1.26 -4.83 117.12 110.20 1jan n MET 215 Ca -0.01 0.00 -0.39 0.00 -1.81 0.00 0.00 57.70 55.49 1jan n MET 215 Cb 0.69 -1.27 -0.02 0.00 -0.71 0.00 0.00 33.22 31.92 1jan n MET 215 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 1jan s TYR 216 N -1.45 3.01 0.34 2.03 5.04 -1.17 -1.21 117.35 123.94 1jan s TYR 216 Ca 0.00 1.48 0.09 0.00 -2.44 0.00 0.00 57.07 56.20 1jan s TYR 216 Cb 0.00 -3.55 0.83 0.00 0.35 0.00 0.00 41.96 39.59 1jan s TYR 216 CO 0.00 -1.67 1.81 -1.35 -1.34 0.00 0.00 175.55 173.00 1jan h PRO 217 N 2.91 0.66 -6.21 4.97 0.11 -1.90 -3.43 132.00 129.11 1jan h PRO 217 Ca -0.49 -0.04 -0.67 0.00 0.11 0.00 0.00 66.00 64.92 1jan h PRO 217 Cb 1.24 -0.15 -0.14 0.00 0.11 0.00 0.00 31.00 32.06 1jan h PRO 217 CO 0.63 0.44 -0.66 -0.80 -0.21 0.00 0.00 178.00 177.40 1jan s ASN 218 N -5.52 5.01 0.42 -2.05 0.02 -1.26 -5.10 114.94 106.47 1jan s ASN 218 Ca -0.10 -0.06 -0.25 0.00 -1.02 0.00 0.00 52.86 51.43 1jan s ASN 218 Cb 0.24 -1.27 -0.08 0.00 0.02 0.00 0.00 41.25 40.16 1jan s ASN 218 CO 0.80 0.27 1.25 -0.47 0.02 0.00 0.00 177.10 178.96 1jan s TYR 219 N -1.10 2.88 -0.18 2.20 6.14 -1.26 -5.06 117.35 120.96 1jan s TYR 219 Ca 0.20 1.47 -0.14 0.00 0.64 0.00 0.00 57.07 59.24 1jan s TYR 219 Cb -0.11 -3.56 0.05 0.00 0.42 0.00 0.00 41.96 38.76 1jan s TYR 219 CO 0.11 -1.83 0.47 0.00 0.64 0.00 0.00 175.55 174.94 1jan s ALA 220 N -1.34 -1.18 0.26 3.97 0.00 -1.26 -5.16 121.76 117.05 1jan s ALA 220 Ca 0.58 1.50 -0.29 0.00 0.00 0.00 0.00 51.96 53.75 1jan s ALA 220 Cb -0.35 -0.89 -0.09 0.00 0.00 0.00 0.00 23.12 21.79 1jan s ALA 220 CO 0.44 -0.25 1.01 0.12 0.00 0.00 0.00 175.76 177.08 1jan s PHE 221 N 0.82 3.78 0.02 0.00 5.36 -1.26 -5.06 117.98 121.64 1jan s PHE 221 Ca -0.05 1.81 0.02 0.00 -0.96 0.00 0.00 56.93 57.75 1jan s PHE 221 Cb -0.05 -3.12 -0.01 0.00 -0.34 0.00 0.00 43.02 39.50 1jan s PHE 221 CO -0.06 -0.02 -0.06 1.03 -1.46 0.00 0.00 175.22 174.65 1jan s ARG 222 N -1.35 0.42 0.10 10.12 3.00 -1.26 -5.10 118.95 124.87 1jan s ARG 222 Ca 0.43 -0.45 -0.34 0.00 0.00 0.00 0.00 55.73 55.37 1jan s ARG 222 Cb -0.28 -0.28 -0.14 0.00 0.00 0.00 0.00 34.95 34.25 1jan s ARG 222 CO 0.36 0.06 1.61 0.39 0.00 0.00 0.00 175.30 177.72 1jan n GLU 223 N 2.22 2.03 0.01 3.54 -0.58 -1.26 -4.87 120.64 121.73 1jan n GLU 223 Ca -0.18 0.73 0.10 0.00 -0.42 0.00 0.00 57.16 57.39 1jan n GLU 223 Cb 0.57 -2.50 -0.13 0.00 -0.57 0.00 0.00 31.44 28.81 1jan n GLU 223 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1jan n THR 224 N 3.66 0.25 -0.31 2.62 -2.24 -1.26 -4.43 114.28 112.56 1jan n THR 224 Ca 0.18 -0.53 0.09 0.00 -2.27 0.00 0.00 64.05 61.52 1jan n THR 224 Cb 0.28 -0.12 0.21 0.00 -2.10 0.00 0.00 70.33 68.59 1jan n THR 224 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1jan h SER 225 N 0.00 -0.53 -2.05 3.42 4.64 -2.00 -2.53 113.55 114.50 1jan h SER 225 Ca -0.03 0.25 -0.50 0.00 -0.47 0.00 0.00 61.79 61.04 1jan h SER 225 Cb 1.08 0.46 -0.40 0.00 -0.31 0.00 0.00 62.40 63.23 1jan h SER 225 CO 0.00 -0.28 -1.10 0.59 -0.87 0.00 0.00 176.83 175.17 1jan n ASN 226 N -5.47 1.46 -4.79 4.97 3.02 -1.26 -5.11 115.26 108.08 1jan n ASN 226 Ca 0.18 -3.12 -0.38 0.00 -0.03 0.00 0.00 54.58 51.23 1jan n ASN 226 Cb 0.59 -0.61 -0.06 0.00 -0.61 0.00 0.00 39.78 39.09 1jan n ASN 226 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1jan s TYR 227 N -2.57 3.79 0.04 3.10 6.14 -0.96 -5.09 117.35 121.81 1jan s TYR 227 Ca 0.41 1.54 -0.02 0.00 0.64 0.00 0.00 57.07 59.64 1jan s TYR 227 Cb 0.33 -2.71 -0.02 0.00 0.42 0.00 0.00 41.96 39.98 1jan s TYR 227 CO -0.09 0.43 0.01 -1.54 0.64 0.00 0.00 175.55 175.00 1jan s SER 228 N -1.36 0.32 0.21 4.32 1.04 -1.26 -5.01 113.70 111.95 1jan s SER 228 Ca 0.39 -0.70 -0.32 0.00 0.48 0.00 0.00 55.95 55.79 1jan s SER 228 Cb -0.20 0.18 -0.13 0.00 0.10 0.00 0.00 66.02 65.96 1jan s SER 228 CO 0.24 -0.48 1.50 -0.11 0.98 0.00 0.00 173.24 175.37 1jan n LEU 229 N 0.77 3.18 -4.74 2.42 7.94 -1.26 -4.99 117.00 120.32 1jan n LEU 229 Ca -0.19 1.11 -0.32 0.00 -1.11 0.00 0.00 56.01 55.51 1jan n LEU 229 Cb 0.58 -1.44 0.09 0.00 0.53 0.00 0.00 43.42 43.19 1jan n LEU 229 CO 0.24 -0.35 0.72 -2.84 -1.11 0.00 0.00 177.39 174.05 1jan s PRO 230 N 0.21 2.14 0.46 1.96 0.02 -1.26 -4.83 135.00 133.69 1jan s PRO 230 Ca 0.73 1.41 0.13 0.00 0.02 0.00 0.00 61.00 63.28 1jan s PRO 230 Cb -0.65 -1.87 1.06 0.00 0.02 0.00 0.00 34.50 33.06 1jan s PRO 230 CO 0.44 -1.77 2.06 1.96 -0.33 0.00 0.00 177.00 179.36 1jan h GLN 231 N -0.82 0.31 0.00 5.54 1.08 -1.94 -2.08 115.11 117.21 1jan h GLN 231 Ca -0.45 -0.02 -0.08 0.00 -1.45 0.00 0.00 58.65 56.65 1jan h GLN 231 Cb 1.25 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 28.60 1jan h GLN 231 CO 0.50 0.21 -0.36 0.22 -0.95 0.00 0.00 178.83 178.44 1jan h ASP 232 N 0.32 0.00 0.56 1.46 3.58 -1.95 -2.19 116.42 118.22 1jan h ASP 232 Ca 0.16 0.00 -0.29 0.00 0.42 0.00 0.00 57.03 57.32 1jan h ASP 232 Cb 0.22 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.27 1jan h ASP 232 CO -0.03 0.36 -1.31 0.44 -2.88 0.00 0.00 179.24 175.82 1jan h ASP 233 N 0.00 0.48 -0.11 2.28 3.32 -1.75 -2.49 116.42 118.15 1jan h ASP 233 Ca -0.00 -0.53 -0.00 0.00 0.02 0.00 0.00 57.03 56.52 1jan h ASP 233 Cb 0.70 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 1jan h ASP 233 CO 0.05 1.42 0.07 0.40 -1.72 0.00 0.00 179.24 179.45 1jan h ILE 234 N 0.08 1.07 -0.99 0.35 2.04 -1.39 -1.77 117.51 116.89 1jan h ILE 234 Ca -0.16 -0.19 0.15 0.00 1.00 0.00 0.00 64.86 65.66 1jan h ILE 234 Cb 2.01 0.99 -0.09 0.00 -0.74 0.00 0.00 36.82 38.98 1jan h ILE 234 CO 0.21 0.06 0.62 0.44 0.00 0.00 0.00 178.15 179.49 1jan h ASP 235 N 0.11 0.86 0.23 1.72 5.19 -1.40 -1.27 116.42 121.85 1jan h ASP 235 Ca 0.04 0.06 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 1jan h ASP 235 Cb 0.04 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.45 1jan h ASP 235 CO -0.01 0.41 -0.11 1.23 -3.12 0.00 0.00 179.24 177.64 1jan h GLY 236 N 0.89 -0.32 1.46 2.75 0.00 -0.87 -0.63 103.07 106.36 1jan h GLY 236 Ca 0.52 0.12 -0.14 0.00 0.00 0.00 0.00 47.33 47.83 1jan h GLY 236 CO -0.29 -0.11 -0.42 -2.22 0.00 0.00 0.00 176.54 173.49 1jan h ILE 237 N -0.52 1.30 -0.72 2.60 5.03 -1.30 -2.76 117.51 121.14 1jan h ILE 237 Ca -0.03 -1.60 0.04 0.00 -0.12 0.00 0.00 64.86 63.15 1jan h ILE 237 Cb 0.39 1.57 -0.05 0.00 -3.03 0.00 0.00 36.82 35.70 1jan h ILE 237 CO 0.05 0.50 0.44 1.56 -0.68 0.00 0.00 178.15 180.02 1jan h GLN 238 N 0.48 0.81 0.00 2.37 1.08 -1.27 0.43 115.11 119.02 1jan h GLN 238 Ca 0.04 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 1jan h GLN 238 Cb 0.93 -0.18 -0.00 0.00 -0.05 0.00 0.00 27.48 28.18 1jan h GLN 238 CO 0.08 0.54 -0.08 0.00 -0.95 0.00 0.00 178.83 178.42 1jan h ALA 239 N 1.33 1.19 0.02 3.87 0.00 -0.86 -0.13 119.26 124.67 1jan h ALA 239 Ca 0.30 -0.07 -0.33 0.00 0.00 0.00 0.00 54.91 54.81 1jan h ALA 239 Cb 0.08 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 1jan h ALA 239 CO -0.13 0.10 -1.84 -0.89 0.00 0.00 0.00 179.25 176.49 1jan n ILE 240 N -3.46 1.57 -0.04 0.00 5.41 0.11 -4.76 119.36 118.19 1jan n ILE 240 Ca -0.02 -0.26 -0.02 0.00 1.00 0.00 0.00 62.75 63.46 1jan n ILE 240 Cb 0.22 -1.91 -0.09 0.00 -0.71 0.00 0.00 39.64 37.15 1jan n ILE 240 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 1jan n TYR 241 N -4.16 0.00 -0.94 1.39 4.01 0.13 -5.08 117.16 112.51 1jan n TYR 241 Ca -0.40 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.34 1jan n TYR 241 Cb 0.82 -0.47 0.00 0.00 -0.31 0.00 0.00 39.34 39.37 1jan n TYR 241 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81