#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mce h PRO 74 N 0.00 0.07 -0.59 1.61 0.11 -1.98 -3.09 132.00 128.12 3mce h PRO 74 Ca 0.00 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 66.03 3mce h PRO 74 Cb 0.00 0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.13 3mce h PRO 74 CO 0.00 0.89 0.00 1.28 -0.21 0.00 0.00 178.00 179.96 3mce n LEU 75 N -3.57 3.09 -0.18 2.35 4.77 -1.26 -4.86 117.00 117.33 3mce n LEU 75 Ca -0.02 -1.56 0.00 0.00 -0.03 0.00 0.00 56.01 54.41 3mce n LEU 75 Cb 0.81 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 3mce n LEU 75 CO 0.46 0.53 0.00 0.61 -1.33 0.00 0.00 177.39 177.67 3mce n GLY 76 N 0.80 0.81 3.52 -0.72 0.00 -1.17 -5.01 105.19 103.42 3mce n GLY 76 Ca 0.16 -0.64 -0.12 0.00 0.00 0.00 0.00 46.02 45.41 3mce n GLY 76 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3mce s SER 77 N -2.81 -0.47 0.44 1.61 1.04 -1.26 -4.96 113.70 107.29 3mce s SER 77 Ca 0.00 0.30 -0.24 0.00 0.48 0.00 0.00 55.95 56.49 3mce s SER 77 Cb 0.00 0.43 -0.08 0.00 0.10 0.00 0.00 66.02 66.48 3mce s SER 77 CO 0.00 -0.59 1.21 -2.84 0.98 0.00 0.00 173.24 171.99 3mce s PRO 78 N -2.15 3.84 0.29 4.02 0.02 -1.26 -2.06 135.00 137.69 3mce s PRO 78 Ca -0.02 1.90 0.03 0.00 0.02 0.00 0.00 61.00 62.93 3mce s PRO 78 Cb -0.01 -2.54 -0.01 0.00 0.02 0.00 0.00 34.50 31.96 3mce s PRO 78 CO -0.02 -0.52 0.31 -0.85 -0.33 0.00 0.00 177.00 175.59 3mce n GLU 79 N -0.25 0.45 0.00 5.54 -0.00 -1.26 -4.84 120.64 120.28 3mce n GLU 79 Ca 0.06 -2.64 0.02 0.00 -0.00 0.00 0.00 57.16 54.59 3mce n GLU 79 Cb 0.46 2.31 0.11 0.00 -0.00 0.00 0.00 31.44 34.33 3mce n GLU 79 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 3mce n PHE 80 N -0.52 0.00 1.01 -1.84 3.72 -1.26 -1.84 117.46 116.73 3mce n PHE 80 Ca 0.04 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.57 3mce n PHE 80 Cb 0.51 0.00 0.49 0.00 -0.94 0.00 0.00 39.48 39.54 3mce n PHE 80 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3mce n SER 81 N -0.87 0.18 0.25 4.37 3.41 -1.26 -2.64 113.62 117.06 3mce n SER 81 Ca 0.03 0.22 0.16 0.00 -0.26 0.00 0.00 58.87 59.01 3mce n SER 81 Cb 0.01 -0.23 0.54 0.00 -0.26 0.00 0.00 64.21 64.27 3mce n SER 81 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3mce h LYS 82 N 0.01 0.00 0.01 4.33 1.79 -1.66 -3.11 116.57 117.94 3mce h LYS 82 Ca 0.00 0.00 -0.26 0.00 -2.18 0.00 0.00 60.65 58.21 3mce h LYS 82 Cb 0.50 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.11 3mce h LYS 82 CO 0.00 0.00 -1.39 -0.07 -1.08 0.00 0.00 179.45 176.91 3mce h LEU 83 N 0.00 0.02 0.00 2.94 4.07 -1.74 -3.48 115.31 117.12 3mce h LEU 83 Ca 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.93 3mce h LEU 83 Cb 0.63 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.36 3mce h LEU 83 CO 0.00 1.03 0.00 0.61 -1.08 0.00 0.00 178.44 179.00 3mce n GLY 84 N 1.47 1.68 3.60 0.83 0.00 -1.17 -5.14 105.19 106.45 3mce n GLY 84 Ca -0.09 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.67 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 2.88 0.05 0.99 1.43 -1.21 -4.58 118.68 118.23 3mce s LEU 85 Ca 0.00 -1.09 0.05 0.00 -1.03 0.00 0.00 54.13 52.06 3mce s LEU 85 Cb 0.00 -1.20 -0.02 0.00 0.03 0.00 0.00 46.19 45.00 3mce s LEU 85 CO 0.00 -0.23 -0.13 -0.60 0.23 0.00 0.00 176.35 175.62 3mce s ARG 86 N -3.67 0.84 0.62 1.70 3.52 -0.19 -4.18 118.95 117.58 3mce s ARG 86 Ca 0.34 -0.80 -0.18 0.00 -0.13 0.00 0.00 55.73 54.96 3mce s ARG 86 Cb 0.01 -0.83 -0.02 0.00 -1.56 0.00 0.00 34.95 32.55 3mce s ARG 86 CO 0.18 0.20 1.20 -1.14 -0.81 0.00 0.00 175.30 174.93 3mce s GLN 87 N -1.32 2.85 -0.13 5.12 0.74 -1.26 -0.77 119.66 124.89 3mce s GLN 87 Ca -0.01 1.79 -0.05 0.00 0.05 0.00 0.00 55.36 57.14 3mce s GLN 87 Cb -0.08 -1.92 -0.04 0.00 1.10 0.00 0.00 33.01 32.07 3mce s GLN 87 CO 0.01 -1.29 0.04 0.08 -0.55 0.00 0.00 175.29 173.59 3mce s VAL 88 N -1.70 4.62 -0.16 1.34 1.01 -0.30 -4.81 120.40 120.40 3mce s VAL 88 Ca 0.76 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 62.56 3mce s VAL 88 Cb -0.29 -3.01 -0.23 0.00 0.00 0.00 0.00 36.38 32.84 3mce s VAL 88 CO 0.35 0.55 0.21 1.07 0.00 0.00 0.00 175.10 177.28 3mce n THR 89 N 2.72 1.70 1.28 3.92 5.66 -1.26 -4.44 114.28 123.86 3mce n THR 89 Ca -0.18 -0.57 0.13 0.00 -3.05 0.00 0.00 64.05 60.38 3mce n THR 89 Cb 0.53 -1.71 0.34 0.00 -1.55 0.00 0.00 70.33 67.94 3mce n THR 89 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3mce n GLY 90 N 1.97 0.27 3.64 1.09 0.00 -1.26 -4.98 105.19 105.93 3mce n GLY 90 Ca -0.35 -0.53 -0.47 0.00 0.00 0.00 0.00 46.02 44.66 3mce n GLY 90 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3mce n VAL 91 N 0.47 0.43 0.01 1.61 3.14 -1.26 -4.88 118.33 117.84 3mce n VAL 91 Ca 0.16 -0.11 0.00 0.00 -2.96 0.00 0.00 64.34 61.44 3mce n VAL 91 Cb 0.44 -1.29 -0.00 0.00 -1.06 0.00 0.00 33.84 31.92 3mce n VAL 91 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 3mce n THR 92 N 2.51 0.00 -3.60 1.55 -2.24 -1.26 -4.79 114.28 106.45 3mce n THR 92 Ca 0.15 -0.19 -0.10 0.00 -2.27 0.00 0.00 64.05 61.64 3mce n THR 92 Cb 0.27 0.68 -0.06 0.00 -2.10 0.00 0.00 70.33 69.13 3mce n THR 92 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3mce s ARG 93 N -1.67 0.54 -0.00 -0.78 3.52 -1.26 -4.80 118.95 114.50 3mce s ARG 93 Ca -0.00 0.30 0.00 0.00 -0.13 0.00 0.00 55.73 55.90 3mce s ARG 93 Cb 0.00 0.26 -0.00 0.00 -1.56 0.00 0.00 34.95 33.65 3mce s ARG 93 CO 0.03 -0.13 -0.01 0.54 -0.81 0.00 0.00 175.30 174.91 3mce s VAL 94 N -0.60 0.08 0.00 7.11 0.11 -0.76 -5.02 120.40 121.31 3mce s VAL 94 Ca 0.00 -0.06 0.02 0.00 -2.93 0.00 0.00 61.98 59.01 3mce s VAL 94 Cb -0.02 -0.08 -0.01 0.00 -1.53 0.00 0.00 36.38 34.74 3mce s VAL 94 CO -0.02 0.01 -0.07 0.42 -3.33 0.00 0.00 175.10 172.11 3mce s THR 95 N -0.06 0.57 -0.15 5.04 -4.23 -1.26 -0.28 115.64 115.27 3mce s THR 95 Ca 0.00 -0.39 0.00 0.00 -1.18 0.00 0.00 61.69 60.12 3mce s THR 95 Cb -0.01 -0.49 0.02 0.00 1.34 0.00 0.00 72.50 73.36 3mce s THR 95 CO -0.00 0.10 -0.14 -0.63 -0.54 0.00 0.00 174.62 173.41 3mce s ILE 96 N -0.29 1.58 -0.11 2.99 1.01 -0.20 -4.95 121.20 121.23 3mce s ILE 96 Ca 0.02 -0.64 -0.02 0.00 0.00 0.00 0.00 60.65 60.01 3mce s ILE 96 Cb -0.03 -1.48 -0.03 0.00 0.01 0.00 0.00 42.46 40.92 3mce s ILE 96 CO -0.00 0.46 -0.01 -0.60 0.00 0.00 0.00 174.94 174.79 3mce s ARG 97 N 1.48 3.18 0.42 2.79 3.52 -1.26 -0.12 118.95 128.95 3mce s ARG 97 Ca 0.05 -0.45 0.04 0.00 -0.13 0.00 0.00 55.73 55.24 3mce s ARG 97 Cb -0.13 -2.82 -0.02 0.00 -1.56 0.00 0.00 34.95 30.42 3mce s ARG 97 CO -0.11 0.56 0.12 -1.59 -0.81 0.00 0.00 175.30 173.48 3mce s LYS 98 N -0.50 1.95 0.67 5.12 -2.85 -0.77 -5.02 119.74 118.34 3mce s LYS 98 Ca 0.08 -2.19 -0.03 0.00 -1.00 0.00 0.00 55.97 52.83 3mce s LYS 98 Cb -0.12 -0.65 0.08 0.00 -2.06 0.00 0.00 37.83 35.08 3mce s LYS 98 CO 0.02 -0.48 0.94 -1.12 0.10 0.00 0.00 175.35 174.81 3mce s SER 99 N -3.62 4.75 -0.42 0.03 0.01 -1.26 -3.18 113.70 110.01 3mce s SER 99 Ca 0.23 0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.53 3mce s SER 99 Cb 0.02 -0.67 0.00 0.00 0.21 0.00 0.00 66.02 65.58 3mce s SER 99 CO 0.14 -1.57 0.00 0.29 0.41 0.00 0.00 173.24 172.51 3mce n LYS 100 N -2.74 -0.33 -3.83 12.44 5.02 -1.26 -4.14 118.16 123.32 3mce n LYS 100 Ca 0.10 0.40 -0.31 0.00 -2.02 0.00 0.00 58.31 56.48 3mce n LYS 100 Cb 0.60 -4.12 0.01 0.00 -0.02 0.00 0.00 35.03 31.50 3mce n LYS 100 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3mce n ASN 101 N 1.21 -3.41 -3.93 4.39 5.03 -1.25 -4.96 115.26 112.33 3mce n ASN 101 Ca -0.05 -0.94 -0.14 0.00 0.87 0.00 0.00 54.58 54.32 3mce n ASN 101 Cb 0.38 -1.24 -0.14 0.00 -1.02 0.00 0.00 39.78 37.75 3mce n ASN 101 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 3mce s ILE 102 N -3.44 0.27 -0.03 2.41 2.07 -1.19 -3.01 121.20 118.27 3mce s ILE 102 Ca 0.24 -0.21 0.05 0.00 -1.41 0.00 0.00 60.65 59.32 3mce s ILE 102 Cb -0.14 -0.24 -0.01 0.00 0.13 0.00 0.00 42.46 42.21 3mce s ILE 102 CO 0.74 0.03 -0.17 -0.22 -1.91 0.00 0.00 174.94 173.41 3mce s LEU 103 N -0.20 1.95 -0.22 8.50 2.96 -0.85 -1.84 118.68 128.98 3mce s LEU 103 Ca 0.00 -0.34 -0.09 0.00 -0.22 0.00 0.00 54.13 53.48 3mce s LEU 103 Cb -0.02 -0.95 -0.04 0.00 0.50 0.00 0.00 46.19 45.68 3mce s LEU 103 CO -0.00 0.17 0.11 -0.36 -1.32 0.00 0.00 176.35 174.95 3mce s PHE 104 N -0.10 3.25 -0.18 5.38 0.08 0.83 -1.75 117.98 125.49 3mce s PHE 104 Ca -0.00 0.07 -0.01 0.00 0.12 0.00 0.00 56.93 57.10 3mce s PHE 104 Cb -0.10 -2.20 -0.00 0.00 -0.57 0.00 0.00 43.02 40.14 3mce s PHE 104 CO 0.01 0.02 -0.12 0.08 -0.10 0.00 0.00 175.22 175.12 3mce s VAL 105 N 0.93 2.90 -0.16 -0.44 1.01 -0.76 -1.03 120.40 122.84 3mce s VAL 105 Ca 0.06 -0.68 -0.02 0.00 0.00 0.00 0.00 61.98 61.34 3mce s VAL 105 Cb -0.13 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 3mce s VAL 105 CO 0.03 0.49 -0.10 -0.63 0.00 0.00 0.00 175.10 174.89 3mce s ILE 106 N 1.02 3.21 -0.02 2.22 -1.09 0.62 -1.42 121.20 125.74 3mce s ILE 106 Ca -0.01 -0.58 0.09 0.00 -2.23 0.00 0.00 60.65 57.91 3mce s ILE 106 Cb -0.15 -2.39 -0.13 0.00 -1.58 0.00 0.00 42.46 38.21 3mce s ILE 106 CO -0.02 0.49 0.17 0.35 -1.23 0.00 0.00 174.94 174.70 3mce n THR 107 N 3.96 0.07 -3.48 2.92 -2.24 -1.25 -1.83 114.28 112.43 3mce n THR 107 Ca -0.18 -0.22 -0.27 0.00 -2.27 0.00 0.00 64.05 61.11 3mce n THR 107 Cb 0.52 0.16 -0.09 0.00 -2.10 0.00 0.00 70.33 68.82 3mce n THR 107 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3mce n LYS 108 N -1.87 1.91 -2.74 -0.78 5.02 -1.26 -4.75 118.16 113.70 3mce n LYS 108 Ca -0.03 -4.29 -0.29 0.00 -2.02 0.00 0.00 58.31 51.68 3mce n LYS 108 Cb 0.30 -2.04 -0.02 0.00 -0.02 0.00 0.00 35.03 33.24 3mce n LYS 108 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 3mce s PRO 109 N -1.87 3.70 -0.08 1.97 0.02 -1.26 -4.62 135.00 132.86 3mce s PRO 109 Ca 0.35 0.40 0.01 0.00 0.02 0.00 0.00 61.00 61.79 3mce s PRO 109 Cb 0.11 -2.37 0.02 0.00 0.02 0.00 0.00 34.50 32.27 3mce s PRO 109 CO -0.07 -0.11 -0.11 -0.51 -0.33 0.00 0.00 177.00 175.87 3mce s ASP 110 N -3.49 1.83 0.05 2.53 1.11 -0.53 -4.96 116.67 113.21 3mce s ASP 110 Ca 0.50 -0.29 0.05 0.00 0.18 0.00 0.00 52.55 52.99 3mce s ASP 110 Cb -0.10 -0.81 -0.03 0.00 1.07 0.00 0.00 42.92 43.05 3mce s ASP 110 CO 0.36 -0.01 -0.15 -0.69 1.18 0.00 0.00 175.17 175.87 3mce s VAL 111 N 0.95 1.17 -0.01 -1.27 1.01 -1.26 -0.93 120.40 120.06 3mce s VAL 111 Ca -0.09 -1.15 -0.02 0.00 0.00 0.00 0.00 61.98 60.72 3mce s VAL 111 Cb -0.15 -1.08 -0.00 0.00 0.00 0.00 0.00 36.38 35.15 3mce s VAL 111 CO 0.00 -0.07 0.05 -0.31 0.00 0.00 0.00 175.10 174.77 3mce s TYR 112 N -1.01 0.04 0.20 5.22 1.51 -0.88 -1.15 117.35 121.28 3mce s TYR 112 Ca 0.01 -0.08 0.02 0.00 -1.01 0.00 0.00 57.07 56.01 3mce s TYR 112 Cb -0.09 -0.05 -0.05 0.00 -0.11 0.00 0.00 41.96 41.67 3mce s TYR 112 CO 0.02 -0.12 0.01 0.21 -1.11 0.00 0.00 175.55 174.56 3mce s LYS 113 N -0.61 1.20 -0.11 -0.62 2.47 0.05 -2.08 119.74 120.05 3mce s LYS 113 Ca -0.07 -1.59 -0.09 0.00 -1.56 0.00 0.00 55.97 52.66 3mce s LYS 113 Cb -0.04 -0.35 -0.03 0.00 -1.46 0.00 0.00 37.83 35.95 3mce s LYS 113 CO 0.00 -0.14 -0.17 0.45 0.16 0.00 0.00 175.35 175.65 3mce n SER 114 N -0.31 1.26 0.00 1.43 2.88 -1.26 -1.02 113.62 116.60 3mce n SER 114 Ca -0.05 0.38 0.00 0.00 -1.33 0.00 0.00 58.87 57.86 3mce n SER 114 Cb 0.64 -0.71 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 3mce n SER 114 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 3mce n ASP 118 N -3.84 0.00 -3.87 -3.46 2.03 -1.26 -4.90 116.55 101.25 3mce n ASP 118 Ca -0.07 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.07 3mce n ASP 118 Cb 0.26 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.50 3mce n ASP 118 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 3mce s THR 119 N 0.00 0.32 0.10 5.18 -4.23 -1.26 -5.14 115.64 110.62 3mce s THR 119 Ca 0.00 -0.04 0.10 0.00 -1.18 0.00 0.00 61.69 60.57 3mce s THR 119 Cb 0.00 -0.36 -0.04 0.00 1.34 0.00 0.00 72.50 73.44 3mce s THR 119 CO 0.00 0.16 -0.26 -0.31 -0.54 0.00 0.00 174.62 173.67 3mce s TYR 120 N 0.72 2.21 -0.18 3.99 1.51 -1.26 -4.39 117.35 119.95 3mce s TYR 120 Ca -0.08 -0.39 -0.02 0.00 -1.01 0.00 0.00 57.07 55.57 3mce s TYR 120 Cb -0.11 -1.24 -0.01 0.00 -0.11 0.00 0.00 41.96 40.49 3mce s TYR 120 CO -0.01 0.26 -0.09 0.42 -1.11 0.00 0.00 175.55 175.02 3mce s ILE 121 N -1.00 3.13 -0.03 2.71 1.01 -0.88 -4.97 121.20 121.17 3mce s ILE 121 Ca 0.12 -0.60 0.07 0.00 0.00 0.00 0.00 60.65 60.25 3mce s ILE 121 Cb -0.10 -2.38 -0.02 0.00 0.01 0.00 0.00 42.46 39.98 3mce s ILE 121 CO 0.05 0.47 -0.26 -0.69 0.00 0.00 0.00 174.94 174.51 3mce s VAL 122 N 1.05 2.05 -0.09 2.92 1.01 -1.26 -2.08 120.40 124.00 3mce s VAL 122 Ca -0.00 -1.10 -0.27 0.00 0.00 0.00 0.00 61.98 60.61 3mce s VAL 122 Cb -0.15 -1.71 0.06 0.00 0.00 0.00 0.00 36.38 34.59 3mce s VAL 122 CO -0.01 0.58 0.64 0.72 0.00 0.00 0.00 175.10 177.02 3mce s PHE 123 N -0.49 -0.62 -4.98 5.22 -0.12 -0.11 -4.96 117.98 111.92 3mce s PHE 123 Ca 0.06 1.18 0.00 0.00 -0.05 0.00 0.00 56.93 58.13 3mce s PHE 123 Cb -0.11 0.34 0.00 0.00 -0.63 0.00 0.00 43.02 42.62 3mce s PHE 123 CO 0.00 -0.53 0.00 0.41 -0.05 0.00 0.00 175.22 175.06 3mce n GLY 124 N 1.36 -0.99 3.64 1.99 0.00 -1.26 -1.46 105.19 108.46 3mce n GLY 124 Ca -0.18 -1.18 -0.43 0.00 0.00 0.00 0.00 46.02 44.23 3mce n GLY 124 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mce s GLU 125 N -1.99 3.96 -0.01 1.61 0.41 -1.26 -4.97 118.70 116.45 3mce s GLU 125 Ca 0.00 1.34 -0.13 0.00 -0.41 0.00 0.00 54.97 55.77 3mce s GLU 125 Cb 0.00 -3.87 -0.05 0.00 -1.78 0.00 0.00 34.13 28.43 3mce s GLU 125 CO 0.00 -1.06 0.37 0.00 -0.49 0.00 0.00 175.26 174.09 3mce s ALA 126 N 4.26 3.72 -0.08 5.21 0.00 -1.26 -3.93 121.76 129.68 3mce s ALA 126 Ca 0.57 -0.28 -0.00 0.00 0.00 0.00 0.00 51.96 52.25 3mce s ALA 126 Cb -0.18 -2.33 0.02 0.00 0.00 0.00 0.00 23.12 20.64 3mce s ALA 126 CO 0.22 0.50 -0.05 0.15 0.00 0.00 0.00 175.76 176.58 3mce s LYS 127 N -1.12 1.10 -0.17 0.00 -0.14 -0.51 -4.93 119.74 113.97 3mce s LYS 127 Ca 0.23 -0.12 -0.18 0.00 -1.36 0.00 0.00 55.97 54.54 3mce s LYS 127 Cb -0.16 -1.20 -0.04 0.00 -1.68 0.00 0.00 37.83 34.75 3mce s LYS 127 CO 0.13 -0.20 0.49 0.42 -0.76 0.00 0.00 175.35 175.43 3mce s ILE 128 N 1.49 5.14 -0.10 2.17 1.01 -1.26 -1.83 121.20 127.82 3mce s ILE 128 Ca -0.01 0.93 0.02 0.00 0.00 0.00 0.00 60.65 61.59 3mce s ILE 128 Cb -0.13 -3.82 -0.01 0.00 0.01 0.00 0.00 42.46 38.50 3mce s ILE 128 CO -0.04 0.23 -0.17 -0.70 0.00 0.00 0.00 174.94 174.26 3mce s GLU 129 N 1.29 3.05 0.00 2.79 2.12 -0.72 -4.99 118.70 122.24 3mce s GLU 129 Ca 0.24 -0.75 0.00 0.00 0.36 0.00 0.00 54.97 54.82 3mce s GLU 129 Cb -0.15 -2.46 0.00 0.00 0.26 0.00 0.00 34.13 31.78 3mce s GLU 129 CO 0.10 0.31 0.00 -3.47 -0.54 0.00 0.00 175.26 171.65 3mce n ASP 130 N 3.22 -0.13 -3.36 -1.70 2.03 -1.26 -2.02 116.55 113.34 3mce n ASP 130 Ca -0.18 -0.26 0.02 0.00 0.52 0.00 0.00 54.79 54.89 3mce n ASP 130 Cb 0.53 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.90 3mce n ASP 130 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3mce s LEU 131 N 0.00 -1.21 0.00 -2.67 1.43 -1.16 -4.67 118.68 110.39 3mce s LEU 131 Ca 0.00 1.12 0.00 0.00 -1.03 0.00 0.00 54.13 54.22 3mce s LEU 131 Cb 0.00 2.16 0.00 0.00 0.03 0.00 0.00 46.19 48.38 3mce s LEU 131 CO 0.00 -0.23 0.14 -1.54 0.23 0.00 0.00 176.35 174.95