#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mce n LEU 75 N 0.00 0.82 -4.78 1.53 4.32 -1.26 -4.92 117.00 112.70 3mce n LEU 75 Ca 0.00 1.16 -0.35 0.00 -0.02 0.00 0.00 56.01 56.79 3mce n LEU 75 Cb 0.00 -1.16 -0.02 0.00 -1.62 0.00 0.00 43.42 40.62 3mce n LEU 75 CO 0.00 -1.83 0.76 -0.83 -1.22 0.00 0.00 177.39 174.27 3mce s GLY 76 N -0.51 2.64 -0.30 -0.72 0.00 -1.26 -5.02 107.32 102.15 3mce s GLY 76 Ca 0.65 0.76 -0.13 0.00 0.00 0.00 0.00 44.72 46.00 3mce s GLY 76 CO 0.57 1.13 0.27 -0.45 0.00 0.00 0.00 173.10 174.62 3mce s SER 77 N -1.71 6.11 0.38 1.64 0.15 -1.26 -4.96 113.70 114.04 3mce s SER 77 Ca 0.66 -0.07 0.06 0.00 0.70 0.00 0.00 55.95 57.30 3mce s SER 77 Cb -0.22 -2.16 0.77 0.00 -1.71 0.00 0.00 66.02 62.70 3mce s SER 77 CO 0.26 -0.17 1.99 -0.65 1.20 0.00 0.00 173.24 175.87 3mce h PRO 78 N 8.37 0.68 0.08 5.44 0.11 -1.99 -2.15 132.00 142.55 3mce h PRO 78 Ca -0.32 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.74 3mce h PRO 78 Cb 1.17 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3mce h PRO 78 CO 0.62 0.45 -0.04 0.93 -0.21 0.00 0.00 178.00 179.74 3mce h GLU 79 N 0.70 -0.11 0.00 1.05 3.07 -1.99 -2.28 114.58 115.02 3mce h GLU 79 Ca 0.26 0.01 -0.08 0.00 -0.50 0.00 0.00 59.36 59.04 3mce h GLU 79 Cb 0.14 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 3mce h GLU 79 CO -0.07 0.31 -0.40 0.74 -1.40 0.00 0.00 179.01 178.19 3mce h PHE 80 N -0.56 0.00 0.33 4.33 0.04 -1.91 -1.67 116.94 117.49 3mce h PHE 80 Ca -0.01 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 3mce h PHE 80 Cb 0.47 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.59 3mce h PHE 80 CO 0.07 0.40 -0.52 0.77 -0.60 0.00 0.00 178.31 178.43 3mce h SER 81 N 0.00 -1.50 -0.53 2.17 0.02 -1.43 -2.32 113.55 109.97 3mce h SER 81 Ca -0.00 0.14 0.08 0.00 -0.84 0.00 0.00 61.79 61.16 3mce h SER 81 Cb 0.71 0.52 -0.03 0.00 0.14 0.00 0.00 62.40 63.74 3mce h SER 81 CO 0.05 -0.62 0.35 0.11 -1.14 0.00 0.00 176.83 175.58 3mce h LYS 82 N -0.90 0.39 0.00 3.45 1.57 -1.04 0.15 116.57 120.19 3mce h LYS 82 Ca -0.04 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 3mce h LYS 82 Cb 0.83 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.05 3mce h LYS 82 CO -0.17 0.26 -0.03 1.25 -0.57 0.00 0.00 179.45 180.19 3mce h LEU 83 N 0.40 0.00 0.00 2.94 5.85 -1.23 -3.46 115.31 119.81 3mce h LEU 83 Ca 0.24 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.96 3mce h LEU 83 Cb 0.41 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.44 3mce h LEU 83 CO -0.06 0.03 0.00 0.61 -0.34 0.00 0.00 178.44 178.67 3mce n GLY 84 N -0.79 0.99 3.89 3.75 0.00 0.53 -5.09 105.19 108.47 3mce n GLY 84 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 3mce n GLY 84 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mce s LEU 85 N 0.00 3.79 -0.07 0.99 1.43 -0.89 -4.30 118.68 119.63 3mce s LEU 85 Ca 0.00 1.03 0.05 0.00 -1.03 0.00 0.00 54.13 54.18 3mce s LEU 85 Cb 0.00 -3.93 -0.01 0.00 0.03 0.00 0.00 46.19 42.28 3mce s LEU 85 CO 0.00 -0.43 -0.23 -0.13 0.23 0.00 0.00 176.35 175.79 3mce s ARG 86 N -4.09 2.72 0.10 1.70 0.52 0.39 -4.03 118.95 116.26 3mce s ARG 86 Ca 0.49 -0.86 -0.31 0.00 -0.52 0.00 0.00 55.73 54.53 3mce s ARG 86 Cb -0.10 -2.25 -0.08 0.00 0.52 0.00 0.00 34.95 33.03 3mce s ARG 86 CO 0.35 0.35 1.54 -1.14 0.02 0.00 0.00 175.30 176.42 3mce s GLN 87 N -0.07 4.24 0.05 3.54 0.74 -1.26 -0.34 119.66 126.56 3mce s GLN 87 Ca -0.06 2.24 -0.21 0.00 0.05 0.00 0.00 55.36 57.38 3mce s GLN 87 Cb -0.14 -3.37 -0.06 0.00 1.10 0.00 0.00 33.01 30.53 3mce s GLN 87 CO 0.05 -0.61 0.63 0.08 -0.55 0.00 0.00 175.29 174.89 3mce s VAL 88 N 1.77 4.76 0.01 1.34 1.01 0.19 -4.90 120.40 124.59 3mce s VAL 88 Ca 0.69 1.34 -0.02 0.00 0.00 0.00 0.00 61.98 64.00 3mce s VAL 88 Cb -0.39 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 31.98 3mce s VAL 88 CO 0.31 0.47 0.17 -0.89 0.00 0.00 0.00 175.10 175.15 3mce s THR 89 N -0.59 5.28 -0.44 3.92 2.01 -1.26 -4.54 115.64 120.03 3mce s THR 89 Ca 0.32 -0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.06 3mce s THR 89 Cb -0.20 -3.48 0.00 0.00 0.01 0.00 0.00 72.50 68.83 3mce s THR 89 CO 0.20 0.29 0.00 0.61 -0.69 0.00 0.00 174.62 175.02 3mce n GLY 90 N 0.84 0.51 3.67 4.40 0.00 -1.26 -5.01 105.19 108.35 3mce n GLY 90 Ca -0.10 -0.80 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 3mce n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mce s VAL 91 N -2.19 4.24 -0.10 1.61 1.01 -1.26 -4.88 120.40 118.82 3mce s VAL 91 Ca 0.00 1.52 0.15 0.00 0.00 0.00 0.00 61.98 63.65 3mce s VAL 91 Cb 0.00 -3.98 -0.21 0.00 0.00 0.00 0.00 36.38 32.19 3mce s VAL 91 CO 0.00 -0.09 0.59 0.41 0.00 0.00 0.00 175.10 176.01 3mce n THR 92 N 5.14 1.37 -3.64 3.92 -1.04 -1.26 -4.19 114.28 114.58 3mce n THR 92 Ca 0.13 -0.76 -0.07 0.00 -2.04 0.00 0.00 64.05 61.31 3mce n THR 92 Cb 0.45 -0.79 -0.07 0.00 -1.82 0.00 0.00 70.33 68.10 3mce n THR 92 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 3mce s ARG 93 N -2.72 0.36 -0.03 -2.82 3.52 -1.26 -1.36 118.95 114.65 3mce s ARG 93 Ca -0.05 0.45 0.07 0.00 -0.13 0.00 0.00 55.73 56.07 3mce s ARG 93 Cb 0.08 0.17 -0.02 0.00 -1.56 0.00 0.00 34.95 33.62 3mce s ARG 93 CO 0.83 -0.05 -0.24 0.08 -0.81 0.00 0.00 175.30 175.11 3mce s VAL 94 N 0.27 1.89 -0.10 7.11 1.01 -0.51 -4.98 120.40 125.10 3mce s VAL 94 Ca 0.03 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.01 3mce s VAL 94 Cb -0.05 -1.57 0.02 0.00 0.00 0.00 0.00 36.38 34.78 3mce s VAL 94 CO -0.10 0.53 -0.10 -0.89 0.00 0.00 0.00 175.10 174.55 3mce s THR 95 N -0.48 1.09 -0.01 3.92 2.01 -1.26 -0.64 115.64 120.27 3mce s THR 95 Ca 0.07 -0.38 0.05 0.00 0.31 0.00 0.00 61.69 61.73 3mce s THR 95 Cb -0.10 -1.06 -0.03 0.00 0.01 0.00 0.00 72.50 71.32 3mce s THR 95 CO -0.00 0.37 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.52 3mce s ILE 96 N 1.27 3.09 -0.20 1.82 1.01 0.17 -4.94 121.20 123.42 3mce s ILE 96 Ca -0.03 -0.87 0.01 0.00 0.00 0.00 0.00 60.65 59.76 3mce s ILE 96 Cb -0.14 -2.26 0.03 0.00 0.01 0.00 0.00 42.46 40.10 3mce s ILE 96 CO -0.04 0.48 -0.16 -0.13 0.00 0.00 0.00 174.94 175.10 3mce s ARG 97 N -1.07 2.57 -0.16 2.79 1.81 -1.26 -0.35 118.95 123.29 3mce s ARG 97 Ca 0.13 -0.92 -0.17 0.00 -1.72 0.00 0.00 55.73 53.05 3mce s ARG 97 Cb -0.11 -2.57 -0.04 0.00 -0.45 0.00 0.00 34.95 31.79 3mce s ARG 97 CO 0.03 -0.33 0.44 0.15 -0.68 0.00 0.00 175.30 174.91 3mce s LYS 98 N 1.29 4.27 3.81 3.54 1.02 -0.85 -4.95 119.74 127.87 3mce s LYS 98 Ca 0.01 0.34 0.00 0.00 0.02 0.00 0.00 55.97 56.34 3mce s LYS 98 Cb -0.15 -3.48 0.00 0.00 -0.52 0.00 0.00 37.83 33.68 3mce s LYS 98 CO -0.10 0.08 0.00 0.43 -0.92 0.00 0.00 175.35 174.83 3mce n SER 99 N 4.02 0.00 -0.13 2.83 7.64 -1.26 -2.97 113.62 123.74 3mce n SER 99 Ca -0.08 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.57 3mce n SER 99 Cb 0.51 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.60 3mce n SER 99 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 3mce n LYS 100 N 14.00 0.62 0.00 1.43 3.00 -1.26 -4.79 118.16 131.17 3mce n LYS 100 Ca 0.00 0.21 0.00 0.00 -0.00 0.00 0.00 58.31 58.52 3mce n LYS 100 Cb 0.00 -1.52 0.00 0.00 0.00 0.00 0.00 35.03 33.51 3mce n LYS 100 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3mce n ASN 101 N -3.73 1.13 -4.72 3.14 3.02 -1.25 -5.02 115.26 107.83 3mce n ASN 101 Ca -0.49 -1.38 -0.35 0.00 -0.03 0.00 0.00 54.58 52.32 3mce n ASN 101 Cb 0.94 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 40.03 3mce n ASN 101 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3mce s ILE 102 N -0.38 5.17 -0.10 2.41 1.01 -1.16 -2.30 121.20 125.86 3mce s ILE 102 Ca 0.00 0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.76 3mce s ILE 102 Cb 0.00 -3.33 0.02 0.00 0.01 0.00 0.00 42.46 39.16 3mce s ILE 102 CO 0.00 0.48 -0.12 -0.22 0.00 0.00 0.00 174.94 175.08 3mce s LEU 103 N 0.12 1.52 -0.36 2.97 2.96 -0.29 -2.00 118.68 123.61 3mce s LEU 103 Ca 0.07 -0.35 -0.11 0.00 -0.22 0.00 0.00 54.13 53.52 3mce s LEU 103 Cb -0.12 -0.93 0.01 0.00 0.50 0.00 0.00 46.19 45.66 3mce s LEU 103 CO -0.00 -0.03 0.21 -0.36 -1.32 0.00 0.00 176.35 174.85 3mce s PHE 104 N 1.15 3.22 -0.33 5.38 0.08 0.53 -1.93 117.98 126.07 3mce s PHE 104 Ca -0.05 -0.73 -0.08 0.00 0.12 0.00 0.00 56.93 56.20 3mce s PHE 104 Cb -0.14 -2.44 0.03 0.00 -0.57 0.00 0.00 43.02 39.89 3mce s PHE 104 CO -0.03 -0.56 0.12 0.08 -0.10 0.00 0.00 175.22 174.74 3mce s VAL 105 N 1.60 4.01 -0.49 -0.44 1.01 -0.44 -0.65 120.40 125.00 3mce s VAL 105 Ca 0.04 -0.95 -0.18 0.00 0.00 0.00 0.00 61.98 60.89 3mce s VAL 105 Cb -0.18 -3.21 0.06 0.00 0.00 0.00 0.00 36.38 33.05 3mce s VAL 105 CO 0.07 -0.12 0.53 -0.63 0.00 0.00 0.00 175.10 174.96 3mce s ILE 106 N 1.46 5.02 0.01 2.22 1.01 0.18 -1.58 121.20 129.52 3mce s ILE 106 Ca 0.00 -0.71 -0.24 0.00 0.00 0.00 0.00 60.65 59.71 3mce s ILE 106 Cb -0.19 -4.22 -0.05 0.00 0.01 0.00 0.00 42.46 38.01 3mce s ILE 106 CO 0.04 -0.71 0.72 -0.89 0.00 0.00 0.00 174.94 174.10 3mce s THR 107 N 2.23 4.85 -0.77 2.92 2.01 -1.26 -1.42 115.64 124.20 3mce s THR 107 Ca 0.11 1.51 -0.01 0.00 0.31 0.00 0.00 61.69 63.61 3mce s THR 107 Cb -0.21 -4.06 0.00 0.00 0.01 0.00 0.00 72.50 68.24 3mce s THR 107 CO 0.10 0.34 0.56 0.29 -0.69 0.00 0.00 174.62 175.23 3mce n LYS 108 N 3.04 -1.46 -2.28 4.92 5.02 -0.46 -4.90 118.16 122.04 3mce n LYS 108 Ca -0.03 0.71 -0.27 0.00 -2.02 0.00 0.00 58.31 56.70 3mce n LYS 108 Cb 0.51 -2.07 0.15 0.00 -0.02 0.00 0.00 35.03 33.60 3mce n LYS 108 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3mce s PRO 109 N -4.75 1.06 -0.30 1.97 0.04 -1.26 -5.00 135.00 126.76 3mce s PRO 109 Ca 0.01 -0.84 -0.06 0.00 0.04 0.00 0.00 61.00 60.15 3mce s PRO 109 Cb -0.00 -2.09 0.02 0.00 0.04 0.00 0.00 34.50 32.48 3mce s PRO 109 CO 0.84 -2.00 0.06 0.34 0.04 0.00 0.00 177.00 176.29 3mce s ASP 110 N -4.85 5.05 -0.08 6.66 -1.08 -0.92 -4.75 116.67 116.71 3mce s ASP 110 Ca 0.71 -0.90 0.02 0.00 -0.52 0.00 0.00 52.55 51.86 3mce s ASP 110 Cb -0.04 -1.83 -0.02 0.00 -1.46 0.00 0.00 42.92 39.56 3mce s ASP 110 CO 0.49 -0.23 -0.12 -0.69 0.52 0.00 0.00 175.17 175.14 3mce s VAL 111 N 1.43 3.25 -0.02 1.11 1.01 -1.26 -2.04 120.40 123.87 3mce s VAL 111 Ca 0.00 -0.63 0.07 0.00 0.00 0.00 0.00 61.98 61.42 3mce s VAL 111 Cb -0.18 -2.32 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 3mce s VAL 111 CO 0.01 0.57 -0.24 -0.31 0.00 0.00 0.00 175.10 175.13 3mce s TYR 112 N -0.43 2.18 0.02 5.22 1.51 -0.84 0.55 117.35 125.57 3mce s TYR 112 Ca 0.05 -0.43 0.08 0.00 -1.01 0.00 0.00 57.07 55.76 3mce s TYR 112 Cb -0.12 -1.41 -0.02 0.00 -0.11 0.00 0.00 41.96 40.30 3mce s TYR 112 CO 0.02 -0.05 -0.25 0.21 -1.11 0.00 0.00 175.55 174.37 3mce s LYS 113 N -0.53 1.79 0.37 -0.62 2.20 0.54 -1.52 119.74 121.97 3mce s LYS 113 Ca 0.08 -0.99 -0.27 0.00 -0.36 0.00 0.00 55.97 54.43 3mce s LYS 113 Cb -0.10 -1.87 -0.10 0.00 -1.51 0.00 0.00 37.83 34.26 3mce s LYS 113 CO -0.01 0.49 1.36 0.45 -0.36 0.00 0.00 175.35 177.29 3mce s SER 114 N -0.98 6.46 0.34 1.43 0.15 -0.91 -0.46 113.70 119.73 3mce s SER 114 Ca 0.10 2.79 0.18 0.00 0.70 0.00 0.00 55.95 59.72 3mce s SER 114 Cb -0.10 -2.65 0.38 0.00 -1.71 0.00 0.00 66.02 61.95 3mce s SER 114 CO 0.01 -0.76 1.59 1.55 1.20 0.00 0.00 173.24 176.83 3mce h PRO 115 N 2.99 0.00 0.00 5.44 0.13 -1.92 -3.24 132.00 135.39 3mce h PRO 115 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3mce h PRO 115 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3mce h PRO 115 CO 0.64 0.38 -0.60 0.00 -0.23 0.00 0.00 178.00 178.19 3mce n ALA 116 N -2.23 3.59 -3.48 -0.56 0.00 -1.26 -5.01 120.51 111.56 3mce n ALA 116 Ca 0.01 -0.37 -0.10 0.00 0.00 0.00 0.00 53.44 52.99 3mce n ALA 116 Cb 0.61 -1.08 -0.01 0.00 0.00 0.00 0.00 19.45 18.97 3mce n ALA 116 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3mce s SER 117 N -3.18 0.15 -0.86 0.00 0.01 -1.23 -4.98 113.70 103.61 3mce s SER 117 Ca 0.10 -1.08 -0.03 0.00 1.31 0.00 0.00 55.95 56.24 3mce s SER 117 Cb 0.17 0.73 0.21 0.00 0.21 0.00 0.00 66.02 67.34 3mce s SER 117 CO 0.72 -1.43 2.29 0.47 0.41 0.00 0.00 173.24 175.70 3mce n ASP 118 N -1.03 7.28 -4.38 2.44 8.00 -1.26 -4.43 116.55 123.17 3mce n ASP 118 Ca -0.04 -3.48 -0.34 0.00 0.71 0.00 0.00 54.79 51.65 3mce n ASP 118 Cb 0.60 -1.20 -0.14 0.00 -0.02 0.00 0.00 41.12 40.37 3mce n ASP 118 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3mce s THR 119 N -3.28 3.36 0.16 -3.53 2.01 -1.26 -5.05 115.64 108.05 3mce s THR 119 Ca 0.52 -0.53 0.10 0.00 0.31 0.00 0.00 61.69 62.09 3mce s THR 119 Cb 0.32 -2.47 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 3mce s THR 119 CO -0.24 0.48 -0.23 -0.31 -0.69 0.00 0.00 174.62 173.64 3mce s TYR 120 N 0.73 2.13 -0.12 4.92 1.51 -1.26 -2.15 117.35 123.11 3mce s TYR 120 Ca -0.04 -0.39 0.03 0.00 -1.01 0.00 0.00 57.07 55.66 3mce s TYR 120 Cb -0.15 -1.09 0.01 0.00 -0.11 0.00 0.00 41.96 40.62 3mce s TYR 120 CO 0.02 0.39 -0.20 0.42 -1.11 0.00 0.00 175.55 175.07 3mce s ILE 121 N -1.56 1.86 -0.08 2.71 1.01 -0.58 -5.01 121.20 119.56 3mce s ILE 121 Ca 0.16 -0.87 0.05 0.00 0.00 0.00 0.00 60.65 59.99 3mce s ILE 121 Cb -0.08 -1.65 -0.00 0.00 0.01 0.00 0.00 42.46 40.74 3mce s ILE 121 CO 0.08 0.51 -0.23 -0.69 0.00 0.00 0.00 174.94 174.61 3mce s VAL 122 N 0.75 1.94 -0.23 2.92 1.01 -1.26 -1.98 120.40 123.55 3mce s VAL 122 Ca -0.10 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 60.93 3mce s VAL 122 Cb -0.16 -1.67 0.05 0.00 0.00 0.00 0.00 36.38 34.60 3mce s VAL 122 CO 0.01 0.54 -0.14 -0.36 0.00 0.00 0.00 175.10 175.14 3mce s PHE 123 N 0.14 3.06 0.00 5.22 0.40 -0.86 -5.00 117.98 120.94 3mce s PHE 123 Ca -0.11 -2.06 0.00 0.00 -0.60 0.00 0.00 56.93 54.16 3mce s PHE 123 Cb -0.16 -1.91 0.00 0.00 0.51 0.00 0.00 43.02 41.46 3mce s PHE 123 CO 0.06 -0.85 0.00 0.41 0.70 0.00 0.00 175.22 175.54 3mce n GLY 124 N 4.51 2.89 3.70 4.36 0.00 -1.26 -2.16 105.19 117.23 3mce n GLY 124 Ca -0.16 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.48 3mce n GLY 124 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3mce s GLU 125 N -2.02 4.42 -0.19 1.61 2.12 -1.26 -4.96 118.70 118.41 3mce s GLU 125 Ca 0.00 1.08 -0.29 0.00 0.36 0.00 0.00 54.97 56.12 3mce s GLU 125 Cb 0.00 -3.50 0.00 0.00 0.26 0.00 0.00 34.13 30.89 3mce s GLU 125 CO 0.00 -0.12 1.02 0.00 -0.54 0.00 0.00 175.26 175.63 3mce s ALA 126 N 1.37 3.59 -0.17 6.30 0.00 -1.26 -4.24 121.76 127.36 3mce s ALA 126 Ca 0.42 0.24 -0.20 0.00 0.00 0.00 0.00 51.96 52.41 3mce s ALA 126 Cb -0.18 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.40 3mce s ALA 126 CO 0.18 -0.90 0.59 0.15 0.00 0.00 0.00 175.76 175.78 3mce s LYS 127 N 2.80 4.26 0.05 0.00 1.02 -0.62 -4.83 119.74 122.42 3mce s LYS 127 Ca 0.45 0.57 -0.05 0.00 0.02 0.00 0.00 55.97 56.96 3mce s LYS 127 Cb -0.16 -3.53 -0.05 0.00 -0.52 0.00 0.00 37.83 33.57 3mce s LYS 127 CO 0.10 -0.11 0.29 0.42 -0.92 0.00 0.00 175.35 175.13 3mce s ILE 128 N 1.48 5.27 0.01 2.17 1.01 -1.26 -1.33 121.20 128.55 3mce s ILE 128 Ca 0.28 0.08 -0.10 0.00 0.00 0.00 0.00 60.65 60.91 3mce s ILE 128 Cb -0.16 -3.59 0.01 0.00 0.01 0.00 0.00 42.46 38.73 3mce s ILE 128 CO 0.11 0.26 0.21 -1.83 0.00 0.00 0.00 174.94 173.69 3mce s GLU 129 N -2.06 0.60 0.25 2.79 -1.05 -0.81 -4.99 118.70 113.42 3mce s GLU 129 Ca 0.32 -0.38 0.11 0.00 -0.15 0.00 0.00 54.97 54.87 3mce s GLU 129 Cb -0.13 0.25 -0.05 0.00 -0.44 0.00 0.00 34.13 33.77 3mce s GLU 129 CO 0.20 -0.16 -0.18 0.34 0.95 0.00 0.00 175.26 176.41 3mce s ASP 130 N -1.53 3.72 -0.16 0.83 -1.08 -1.26 -1.14 116.67 116.05 3mce s ASP 130 Ca -0.12 -0.91 0.00 0.00 -0.52 0.00 0.00 52.55 51.00 3mce s ASP 130 Cb -0.05 -0.39 0.03 0.00 -1.46 0.00 0.00 42.92 41.05 3mce s ASP 130 CO 0.01 0.06 -0.11 -0.76 0.52 0.00 0.00 175.17 174.89 3mce s LEU 131 N -3.29 1.84 0.00 -1.34 1.43 -0.97 -5.00 118.68 111.35 3mce s LEU 131 Ca 0.28 -0.63 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 3mce s LEU 131 Cb -0.06 -1.14 0.00 0.00 0.03 0.00 0.00 46.19 45.02 3mce s LEU 131 CO 0.14 -0.11 0.00 -0.24 0.23 0.00 0.00 176.35 176.38