#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k89 n ASN 50 N 0.00 -1.91 -1.14 0.00 4.05 -1.26 -5.04 115.26 109.96 2k89 n ASN 50 Ca 0.00 0.41 0.13 0.00 0.45 0.00 0.00 54.58 55.57 2k89 n ASN 50 Cb 0.00 2.05 -0.03 0.00 1.23 0.00 0.00 39.78 43.03 2k89 n ASN 50 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2k89 n GLN 51 N -2.93 -1.85 -0.00 1.20 1.13 -1.26 -4.62 117.38 109.05 2k89 n GLN 51 Ca 0.00 1.22 -0.00 0.00 -1.94 0.00 0.00 57.00 56.28 2k89 n GLN 51 Cb 0.00 -2.26 -0.00 0.00 0.11 0.00 0.00 30.24 28.09 2k89 n GLN 51 CO 0.00 0.00 0.00 0.37 -1.44 0.00 0.00 177.06 175.99 2k89 h GLN 52 N 0.00 0.00 -5.99 -1.09 4.15 -2.07 -3.44 115.11 106.67 2k89 h GLN 52 Ca 0.02 0.00 -0.61 0.00 0.77 0.00 0.00 58.65 58.83 2k89 h GLN 52 Cb 0.84 0.00 -0.12 0.00 0.21 0.00 0.00 27.48 28.41 2k89 h GLN 52 CO 0.01 0.00 0.49 0.99 -1.93 0.00 0.00 178.83 178.39 2k89 s THR 53 N -1.07 4.53 -0.27 2.39 2.01 -1.26 -4.86 115.64 117.11 2k89 s THR 53 Ca -0.01 0.58 -0.12 0.00 0.31 0.00 0.00 61.69 62.46 2k89 s THR 53 Cb 0.00 -4.40 -0.14 0.00 0.01 0.00 0.00 72.50 67.98 2k89 s THR 53 CO 0.01 -0.81 -0.28 -1.20 -0.69 0.00 0.00 174.62 171.65 2k89 n SER 54 N 7.01 1.96 0.00 3.53 7.64 -1.26 -5.05 113.62 127.45 2k89 n SER 54 Ca 0.04 0.27 0.00 0.00 1.01 0.00 0.00 58.87 60.19 2k89 n SER 54 Cb 0.48 -0.77 0.00 0.00 -1.01 0.00 0.00 64.21 62.92 2k89 n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2k89 n GLY 55 N 1.44 3.13 3.83 0.23 0.00 -1.26 -4.54 105.19 108.03 2k89 n GLY 55 Ca -0.51 -0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.00 2k89 n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k89 s LYS 56 N 0.00 4.13 -0.26 1.61 3.01 -1.26 -4.91 119.74 122.06 2k89 s LYS 56 Ca 0.00 0.89 -0.17 0.00 -1.01 0.00 0.00 55.97 55.68 2k89 s LYS 56 Cb 0.00 -2.36 -0.03 0.00 -1.01 0.00 0.00 37.83 34.43 2k89 s LYS 56 CO 0.00 0.09 0.47 0.08 0.51 0.00 0.00 175.35 176.51 2k89 s VAL 57 N -2.04 5.10 -0.39 3.17 1.01 0.87 -4.83 120.40 123.29 2k89 s VAL 57 Ca 0.57 0.80 -0.20 0.00 0.00 0.00 0.00 61.98 63.14 2k89 s VAL 57 Cb -0.10 -3.79 0.01 0.00 0.00 0.00 0.00 36.38 32.50 2k89 s VAL 57 CO 0.16 0.11 0.62 -0.22 0.00 0.00 0.00 175.10 175.77 2k89 s LEU 58 N 2.20 4.39 -0.24 3.92 2.96 -1.26 -0.73 118.68 129.92 2k89 s LEU 58 Ca 0.20 -0.11 -0.03 0.00 -0.22 0.00 0.00 54.13 53.97 2k89 s LEU 58 Cb -0.16 -2.72 0.01 0.00 0.50 0.00 0.00 46.19 43.83 2k89 s LEU 58 CO 0.09 -0.66 -0.05 -0.72 -1.32 0.00 0.00 176.35 173.69 2k89 s TYR 59 N 2.70 3.02 0.00 5.38 1.13 0.13 -4.70 117.35 125.01 2k89 s TYR 59 Ca 0.23 -1.34 0.00 0.00 -1.41 0.00 0.00 57.07 54.55 2k89 s TYR 59 Cb -0.14 -2.08 0.00 0.00 -1.10 0.00 0.00 41.96 38.63 2k89 s TYR 59 CO 0.16 -0.67 0.00 0.39 -2.51 0.00 0.00 175.55 172.92 2k89 n GLU 60 N 4.72 -1.09 0.00 -3.49 -0.58 -1.26 -1.06 120.64 117.87 2k89 n GLU 60 Ca -0.17 0.27 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 2k89 n GLU 60 Cb 0.48 -4.71 0.00 0.00 -0.57 0.00 0.00 31.44 26.64 2k89 n GLU 60 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k89 n GLY 61 N -0.34 1.39 3.83 0.62 0.00 -1.26 -5.12 105.19 104.30 2k89 n GLY 61 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2k89 n GLY 61 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k89 s LYS 62 N 0.00 3.07 -0.08 1.61 2.20 -0.22 -5.08 119.74 121.24 2k89 s LYS 62 Ca 0.00 -0.65 -0.01 0.00 -0.36 0.00 0.00 55.97 54.96 2k89 s LYS 62 Cb 0.00 -2.81 -0.03 0.00 -1.51 0.00 0.00 37.83 33.48 2k89 s LYS 62 CO 0.00 0.56 -0.02 -1.21 -0.36 0.00 0.00 175.35 174.32 2k89 s GLU 63 N -2.58 2.90 0.25 4.03 2.02 -1.26 0.17 118.70 124.23 2k89 s GLU 63 Ca 0.31 -0.45 0.02 0.00 0.02 0.00 0.00 54.97 54.86 2k89 s GLU 63 Cb -0.12 -2.73 -0.04 0.00 0.10 0.00 0.00 34.13 31.35 2k89 s GLU 63 CO 0.24 0.69 0.19 -0.06 0.02 0.00 0.00 175.26 176.35 2k89 s PHE 64 N -0.87 1.34 0.02 1.61 0.08 0.10 -4.94 117.98 115.32 2k89 s PHE 64 Ca 0.13 -1.46 -0.10 0.00 0.12 0.00 0.00 56.93 55.62 2k89 s PHE 64 Cb -0.11 -0.59 -0.05 0.00 -0.57 0.00 0.00 43.02 41.70 2k89 s PHE 64 CO 0.02 -0.74 1.15 -0.44 -0.10 0.00 0.00 175.22 175.11 2k89 h ASP 65 N 2.44 -0.32 -3.33 1.36 3.32 -1.83 0.25 116.42 118.31 2k89 h ASP 65 Ca -0.32 0.02 -0.30 0.00 0.02 0.00 0.00 57.03 56.44 2k89 h ASP 65 Cb 1.24 0.09 -0.35 0.00 0.22 0.00 0.00 39.33 40.53 2k89 h ASP 65 CO 0.47 -0.20 -0.68 -0.31 -1.72 0.00 0.00 179.24 176.80 2k89 s TYR 66 N -3.76 -0.06 0.08 4.55 2.02 -0.61 -3.48 117.35 116.08 2k89 s TYR 66 Ca -0.05 0.37 0.07 0.00 -0.37 0.00 0.00 57.07 57.10 2k89 s TYR 66 Cb 0.01 -0.27 -0.04 0.00 -0.40 0.00 0.00 41.96 41.26 2k89 s TYR 66 CO 0.15 -0.18 -0.15 0.14 -1.57 0.00 0.00 175.55 173.94 2k89 s VAL 67 N 1.71 3.00 0.19 0.71 -7.23 -1.26 -0.34 120.40 117.18 2k89 s VAL 67 Ca -0.02 -1.27 -0.05 0.00 -1.81 0.00 0.00 61.98 58.83 2k89 s VAL 67 Cb -0.12 -2.34 -0.05 0.00 0.56 0.00 0.00 36.38 34.43 2k89 s VAL 67 CO -0.04 0.22 0.43 0.12 -0.31 0.00 0.00 175.10 175.51 2k89 s PHE 68 N -1.06 3.47 -0.28 2.82 5.36 0.53 -4.84 117.98 123.98 2k89 s PHE 68 Ca 0.17 0.57 -0.09 0.00 -0.96 0.00 0.00 56.93 56.62 2k89 s PHE 68 Cb -0.11 -2.03 -0.02 0.00 -0.34 0.00 0.00 43.02 40.53 2k89 s PHE 68 CO 0.09 0.36 0.12 -1.12 -1.46 0.00 0.00 175.22 173.21 2k89 s SER 69 N -2.67 5.46 -0.24 6.13 0.01 -1.26 -0.11 113.70 121.01 2k89 s SER 69 Ca 0.42 -0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.37 2k89 s SER 69 Cb -0.12 -1.99 0.03 0.00 0.21 0.00 0.00 66.02 64.16 2k89 s SER 69 CO 0.26 -0.11 -0.10 -0.63 0.41 0.00 0.00 173.24 173.07 2k89 s ILE 70 N 1.64 2.54 -0.28 1.44 1.01 0.14 -5.00 121.20 122.69 2k89 s ILE 70 Ca 0.06 -1.17 -0.09 0.00 0.00 0.00 0.00 60.65 59.45 2k89 s ILE 70 Cb -0.16 -2.30 -0.02 0.00 0.01 0.00 0.00 42.46 39.98 2k89 s ILE 70 CO 0.06 0.20 0.13 -0.62 0.00 0.00 0.00 174.94 174.72 2k89 s ASP 71 N 1.26 5.51 -0.18 3.58 -1.08 -1.26 -1.39 116.67 123.11 2k89 s ASP 71 Ca -0.01 -0.29 0.01 0.00 -0.52 0.00 0.00 52.55 51.74 2k89 s ASP 71 Cb -0.17 -2.00 -0.11 0.00 -1.46 0.00 0.00 42.92 39.18 2k89 s ASP 71 CO -0.06 -0.10 -0.16 0.52 0.52 0.00 0.00 175.17 175.88 2k89 n VAL 72 N 4.98 1.00 -3.90 1.11 0.31 -1.26 -4.97 118.33 115.60 2k89 n VAL 72 Ca -0.15 -0.37 -0.27 0.00 -0.01 0.00 0.00 64.34 63.54 2k89 n VAL 72 Cb 0.51 -1.16 -0.17 0.00 -0.91 0.00 0.00 33.84 32.11 2k89 n VAL 72 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2k89 s ASN 73 N -5.76 2.22 0.11 4.52 3.04 -1.26 -5.08 114.94 112.75 2k89 s ASN 73 Ca -0.24 -0.33 -0.31 0.00 0.04 0.00 0.00 52.86 52.03 2k89 s ASN 73 Cb 0.06 -0.84 -0.09 0.00 -1.54 0.00 0.00 41.25 38.84 2k89 s ASN 73 CO 0.40 -0.13 1.65 -1.61 -3.04 0.00 0.00 177.10 174.37 2k89 s GLU 74 N 1.71 4.19 0.00 0.43 2.02 -1.26 -1.62 118.70 124.17 2k89 s GLU 74 Ca 0.05 2.39 0.00 0.00 0.02 0.00 0.00 54.97 57.43 2k89 s GLU 74 Cb -0.13 -3.42 0.00 0.00 0.10 0.00 0.00 34.13 30.68 2k89 s GLU 74 CO -0.08 -0.71 0.00 0.41 0.02 0.00 0.00 175.26 174.90 2k89 n GLY 75 N 3.95 3.08 0.00 -1.39 0.00 -1.26 -4.93 105.19 104.63 2k89 n GLY 75 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2k89 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k89 n GLY 76 N -2.00 4.50 3.89 -0.02 0.00 -0.64 -4.93 105.19 105.99 2k89 n GLY 76 Ca 0.00 -1.29 -0.29 0.00 0.00 0.00 0.00 46.02 44.44 2k89 n GLY 76 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k89 s PRO 77 N -4.07 3.55 -0.17 1.61 0.04 -1.26 -4.66 135.00 130.04 2k89 s PRO 77 Ca 0.00 0.45 -0.08 0.00 0.04 0.00 0.00 61.00 61.41 2k89 s PRO 77 Cb 0.00 -2.23 -0.04 0.00 0.04 0.00 0.00 34.50 32.26 2k89 s PRO 77 CO 0.00 -0.39 0.10 0.45 0.04 0.00 0.00 177.00 177.19 2k89 s SER 78 N -4.15 5.97 -0.11 6.66 0.15 -1.26 -4.13 113.70 116.82 2k89 s SER 78 Ca 0.51 0.22 -0.03 0.00 0.70 0.00 0.00 55.95 57.35 2k89 s SER 78 Cb -0.11 -2.00 -0.03 0.00 -1.71 0.00 0.00 66.02 62.17 2k89 s SER 78 CO 0.49 0.24 0.02 -0.31 1.20 0.00 0.00 173.24 174.87 2k89 s TYR 79 N -0.00 3.19 0.01 3.44 2.02 -0.49 -5.02 117.35 120.50 2k89 s TYR 79 Ca 0.08 0.13 0.04 0.00 -0.37 0.00 0.00 57.07 56.95 2k89 s TYR 79 Cb -0.12 -1.87 -0.01 0.00 -0.40 0.00 0.00 41.96 39.56 2k89 s TYR 79 CO 0.00 0.37 -0.13 0.15 -1.57 0.00 0.00 175.55 174.38 2k89 s LYS 80 N -0.54 0.94 -0.59 -0.62 -0.14 -1.26 0.25 119.74 117.78 2k89 s LYS 80 Ca 0.09 -0.56 -0.03 0.00 -1.36 0.00 0.00 55.97 54.11 2k89 s LYS 80 Cb -0.12 -0.92 0.15 0.00 -1.68 0.00 0.00 37.83 35.27 2k89 s LYS 80 CO 0.02 0.24 0.41 -1.17 -0.76 0.00 0.00 175.35 174.09 2k89 s LEU 81 N -0.64 5.29 0.27 3.17 0.20 0.84 -4.90 118.68 122.91 2k89 s LEU 81 Ca 0.03 -2.70 -0.29 0.00 0.69 0.00 0.00 54.13 51.85 2k89 s LEU 81 Cb -0.06 -1.86 -0.10 0.00 -0.43 0.00 0.00 46.19 43.74 2k89 s LEU 81 CO 0.00 -0.41 1.29 -2.84 -0.29 0.00 0.00 176.35 174.10 2k89 s PRO 82 N 0.16 4.40 -0.05 0.98 0.02 -1.26 -0.35 135.00 138.91 2k89 s PRO 82 Ca 0.15 2.11 -0.00 0.00 0.02 0.00 0.00 61.00 63.28 2k89 s PRO 82 Cb -0.20 -3.13 0.03 0.00 0.02 0.00 0.00 34.50 31.21 2k89 s PRO 82 CO -0.04 -0.17 -0.01 -0.47 -0.33 0.00 0.00 177.00 175.98 2k89 s TYR 83 N -0.62 0.53 -0.18 6.54 5.04 0.54 -4.91 117.35 124.28 2k89 s TYR 83 Ca 0.52 -0.09 -0.09 0.00 -2.44 0.00 0.00 57.07 54.97 2k89 s TYR 83 Cb -0.38 -0.60 -0.05 0.00 0.35 0.00 0.00 41.96 41.29 2k89 s TYR 83 CO 0.45 -0.21 0.12 1.21 -1.34 0.00 0.00 175.55 175.79 2k89 s ASN 84 N 1.33 6.16 0.00 4.32 3.84 -1.26 -1.57 114.94 127.76 2k89 s ASN 84 Ca -0.05 0.26 0.09 0.00 0.21 0.00 0.00 52.86 53.37 2k89 s ASN 84 Cb -0.13 -2.06 0.41 0.00 -0.55 0.00 0.00 41.25 38.91 2k89 s ASN 84 CO -0.02 0.23 1.30 0.35 -2.79 0.00 0.00 177.10 176.17 2k89 n THR 85 N 3.19 1.35 1.13 -5.21 -2.24 -1.26 -1.04 114.28 110.19 2k89 n THR 85 Ca -0.17 0.34 0.13 0.00 -2.27 0.00 0.00 64.05 62.08 2k89 n THR 85 Cb 0.53 -1.18 0.46 0.00 -2.10 0.00 0.00 70.33 68.04 2k89 n THR 85 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2k89 n SER 86 N -1.51 0.38 -4.84 3.42 3.41 -1.26 -4.89 113.62 108.34 2k89 n SER 86 Ca 0.02 -0.16 -0.25 0.00 -0.26 0.00 0.00 58.87 58.22 2k89 n SER 86 Cb 0.11 -0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 63.95 2k89 n SER 86 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2k89 s ASP 87 N -2.82 5.71 0.33 4.04 2.15 -0.21 -5.10 116.67 120.77 2k89 s ASP 87 Ca 0.18 -0.09 -0.25 0.00 0.43 0.00 0.00 52.55 52.82 2k89 s ASP 87 Cb 0.19 -1.54 -0.10 0.00 -0.30 0.00 0.00 42.92 41.17 2k89 s ASP 87 CO 0.58 0.04 0.93 -1.81 -0.17 0.00 0.00 175.17 174.73 2k89 s ASP 88 N -3.31 7.24 0.18 -0.34 1.11 -1.26 -4.89 116.67 115.40 2k89 s ASP 88 Ca 0.32 1.77 -0.11 0.00 0.18 0.00 0.00 52.55 54.72 2k89 s ASP 88 Cb -0.10 -2.56 0.09 0.00 1.07 0.00 0.00 42.92 41.42 2k89 s ASP 88 CO 0.25 -0.11 1.72 -0.65 1.18 0.00 0.00 175.17 177.55 2k89 h PRO 89 N 2.95 0.98 -0.13 8.23 0.11 -1.93 0.40 132.00 142.62 2k89 h PRO 89 Ca -0.47 -0.21 -0.05 0.00 0.11 0.00 0.00 66.00 65.38 2k89 h PRO 89 Cb 1.19 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2k89 h PRO 89 CO 0.64 0.86 -0.17 0.11 -0.21 0.00 0.00 178.00 179.23 2k89 h TRP 90 N 0.91 0.22 -0.05 0.65 5.08 -1.91 0.30 115.95 121.16 2k89 h TRP 90 Ca 0.21 -0.03 -0.09 0.00 1.08 0.00 0.00 58.89 60.06 2k89 h TRP 90 Cb 0.28 -0.06 0.01 0.00 -3.00 0.00 0.00 29.16 26.38 2k89 h TRP 90 CO 0.02 0.37 -0.34 -0.07 -1.28 0.00 0.00 178.44 177.15 2k89 h LEU 91 N 0.19 0.37 -0.08 0.11 3.38 -1.65 -1.62 115.31 116.02 2k89 h LEU 91 Ca 0.04 -0.69 -0.00 0.00 0.09 0.00 0.00 57.88 57.32 2k89 h LEU 91 Cb 0.42 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2k89 h LEU 91 CO 0.03 1.00 0.03 0.74 0.09 0.00 0.00 178.44 180.33 2k89 h THR 92 N -0.22 1.13 -0.74 0.22 2.02 0.08 0.13 112.91 115.52 2k89 h THR 92 Ca -0.03 -0.38 -0.05 0.00 0.77 0.00 0.00 66.41 66.72 2k89 h THR 92 Cb 1.01 1.24 -0.03 0.00 -1.74 0.00 0.00 68.15 68.63 2k89 h THR 92 CO 0.07 0.11 0.27 0.00 0.37 0.00 0.00 175.52 176.34 2k89 h ALA 93 N 0.89 1.09 -0.56 6.16 0.00 -0.52 -1.75 119.26 124.56 2k89 h ALA 93 Ca 0.03 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 2k89 h ALA 93 Cb 0.15 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2k89 h ALA 93 CO -0.00 0.64 -0.01 -0.92 0.00 0.00 0.00 179.25 178.96 2k89 h TYR 94 N 1.08 1.04 -0.26 0.00 5.03 -1.06 0.10 116.97 122.90 2k89 h TYR 94 Ca 0.24 -0.17 0.00 0.00 2.58 0.00 0.00 58.73 61.39 2k89 h TYR 94 Cb 0.24 -0.28 -0.01 0.00 1.55 0.00 0.00 36.73 38.23 2k89 h TYR 94 CO 0.02 0.94 0.17 -0.97 -1.32 0.00 0.00 178.16 177.00 2k89 h ASN 95 N 0.89 0.31 -0.36 -2.11 -0.73 -0.15 0.22 115.58 113.64 2k89 h ASN 95 Ca 0.16 -0.02 -0.14 0.00 1.87 0.00 0.00 56.30 58.17 2k89 h ASN 95 Cb 0.53 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 39.03 2k89 h ASN 95 CO 0.03 0.23 -0.30 0.15 -0.37 0.00 0.00 177.43 177.17 2k89 h PHE 96 N 0.35 1.04 -0.23 0.67 3.57 -1.18 -0.21 116.94 120.95 2k89 h PHE 96 Ca 0.10 -0.28 0.00 0.00 3.53 0.00 0.00 57.97 61.32 2k89 h PHE 96 Cb -0.03 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.47 2k89 h PHE 96 CO -0.06 1.08 0.15 1.25 -2.23 0.00 0.00 178.31 178.50 2k89 h LEU 97 N 0.75 0.26 -0.58 0.59 5.85 -0.35 -0.07 115.31 121.75 2k89 h LEU 97 Ca 0.08 -0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.65 2k89 h LEU 97 Cb 0.87 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.83 2k89 h LEU 97 CO 0.08 0.19 -0.48 0.06 -0.34 0.00 0.00 178.44 177.95 2k89 h GLN 98 N 0.31 0.57 -0.49 1.25 3.07 -0.55 0.65 115.11 119.93 2k89 h GLN 98 Ca 0.09 -0.33 -0.00 0.00 0.09 0.00 0.00 58.65 58.50 2k89 h GLN 98 Cb -0.03 0.02 -0.02 0.00 0.08 0.00 0.00 27.48 27.53 2k89 h GLN 98 CO -0.02 0.93 0.30 -0.22 0.09 0.00 0.00 178.83 179.90 2k89 h LYS 99 N 0.46 0.66 -0.01 0.06 3.11 -0.61 -2.71 116.57 117.52 2k89 h LYS 99 Ca 0.02 -0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.81 2k89 h LYS 99 Cb 1.00 -0.14 0.00 0.00 -1.00 0.00 0.00 32.23 32.09 2k89 h LYS 99 CO 0.09 0.48 -0.42 -1.71 -2.81 0.00 0.00 179.45 175.08 2k89 n ASN 100 N -4.71 1.55 -2.67 4.20 5.15 -0.08 -4.96 115.26 113.74 2k89 n ASN 100 Ca 0.02 -1.21 -0.13 0.00 -0.60 0.00 0.00 54.58 52.66 2k89 n ASN 100 Cb 0.05 0.37 0.06 0.00 -0.53 0.00 0.00 39.78 39.73 2k89 n ASN 100 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2k89 n ASP 101 N -0.38 -2.66 -4.56 1.20 2.03 0.32 -5.03 116.55 107.47 2k89 n ASP 101 Ca 0.10 -0.42 -0.28 0.00 0.52 0.00 0.00 54.79 54.71 2k89 n ASP 101 Cb 0.41 -3.68 0.13 0.00 -0.72 0.00 0.00 41.12 37.25 2k89 n ASP 101 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2k89 s LEU 102 N -5.08 2.72 0.10 -2.67 2.01 0.20 -5.00 118.68 110.96 2k89 s LEU 102 Ca 0.09 0.35 -0.27 0.00 0.01 0.00 0.00 54.13 54.31 2k89 s LEU 102 Cb -0.04 -2.67 -0.06 0.00 0.01 0.00 0.00 46.19 43.43 2k89 s LEU 102 CO 0.50 -2.17 0.83 0.21 1.01 0.00 0.00 176.35 176.73 2k89 s ASN 103 N -4.71 7.36 0.15 2.29 2.47 -1.26 -4.79 114.94 116.44 2k89 s ASN 103 Ca 0.67 1.62 0.09 0.00 0.42 0.00 0.00 52.86 55.66 2k89 s ASN 103 Cb -0.07 -2.52 0.50 0.00 -1.45 0.00 0.00 41.25 37.71 2k89 s ASN 103 CO 0.49 0.04 1.26 -2.65 -3.72 0.00 0.00 177.10 172.52 2k89 n PRO 104 N 2.46 0.06 0.23 0.43 -0.02 -1.26 -0.57 135.00 136.33 2k89 n PRO 104 Ca -0.02 0.54 0.16 0.00 -2.02 0.00 0.00 63.50 62.16 2k89 n PRO 104 Cb 0.49 -1.74 0.62 0.00 -0.02 0.00 0.00 33.50 32.85 2k89 n PRO 104 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 2k89 h MET 105 N 0.00 0.00 0.00 -0.52 -1.53 -2.04 -2.76 114.93 108.08 2k89 h MET 105 Ca 0.00 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.26 2k89 h MET 105 Cb 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.13 2k89 h MET 105 CO 0.00 0.00 -0.50 0.74 0.14 0.00 0.00 176.91 177.29 2k89 h PHE 106 N 0.00 0.00 -0.53 1.39 0.04 -1.23 -3.38 116.94 113.23 2k89 h PHE 106 Ca 0.00 0.00 0.07 0.00 2.80 0.00 0.00 57.97 60.84 2k89 h PHE 106 Cb 0.48 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.57 2k89 h PHE 106 CO 0.00 0.00 0.20 1.25 -0.60 0.00 0.00 178.31 179.16 2k89 h LEU 107 N 0.00 0.21 -0.65 1.54 5.85 -1.63 -1.61 115.31 119.03 2k89 h LEU 107 Ca 0.00 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.73 2k89 h LEU 107 Cb 0.88 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 2k89 h LEU 107 CO 0.00 0.15 0.20 -0.78 -0.34 0.00 0.00 178.44 177.67 2k89 h ASP 108 N 0.39 0.94 -0.07 1.25 3.58 -1.77 -0.33 116.42 120.40 2k89 h ASP 108 Ca 0.26 -0.21 -0.00 0.00 0.42 0.00 0.00 57.03 57.50 2k89 h ASP 108 Cb 0.28 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.07 2k89 h ASP 108 CO -0.25 0.90 0.04 -0.61 -2.88 0.00 0.00 179.24 176.44 2k89 h GLN 109 N 0.93 0.10 -0.29 0.28 4.15 -1.55 0.18 115.11 118.92 2k89 h GLN 109 Ca 0.21 -0.01 -0.12 0.00 0.77 0.00 0.00 58.65 59.50 2k89 h GLN 109 Cb 0.29 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.96 2k89 h GLN 109 CO -0.01 0.15 -0.27 -0.39 -1.93 0.00 0.00 178.83 176.38 2k89 h VAL 110 N 0.03 1.30 -0.42 2.39 -1.51 -1.32 -2.89 116.25 113.84 2k89 h VAL 110 Ca 0.03 -1.43 -0.09 0.00 -1.23 0.00 0.00 66.70 63.98 2k89 h VAL 110 Cb 0.08 1.57 -0.02 0.00 -2.13 0.00 0.00 31.29 30.79 2k89 h VAL 110 CO -0.00 0.46 -0.09 0.00 -1.23 0.00 0.00 177.57 176.70 2k89 h ALA 111 N 0.71 1.06 -0.84 5.19 0.00 -0.92 -1.58 119.26 122.88 2k89 h ALA 111 Ca 0.05 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 2k89 h ALA 111 Cb 0.84 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 2k89 h ALA 111 CO 0.07 0.58 0.39 0.87 0.00 0.00 0.00 179.25 181.16 2k89 h LYS 112 N 0.67 1.22 -0.46 0.00 1.79 -0.61 0.44 116.57 119.61 2k89 h LYS 112 Ca 0.12 -0.19 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 2k89 h LYS 112 Cb 0.55 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 30.96 2k89 h LYS 112 CO 0.03 0.94 0.22 0.35 -1.08 0.00 0.00 179.45 179.92 2k89 h PHE 113 N 1.20 0.67 -0.34 -1.35 3.04 -1.25 0.18 116.94 119.08 2k89 h PHE 113 Ca 0.29 -0.03 0.03 0.00 3.98 0.00 0.00 57.97 62.24 2k89 h PHE 113 Cb 0.14 -0.21 -0.03 0.00 2.56 0.00 0.00 35.95 38.41 2k89 h PHE 113 CO 0.02 0.54 0.14 0.82 -2.02 0.00 0.00 178.31 177.80 2k89 h ILE 114 N 0.61 0.94 -0.01 1.41 2.04 -0.73 -2.67 117.51 119.10 2k89 h ILE 114 Ca 0.16 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.92 2k89 h ILE 114 Cb 0.12 0.61 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 2k89 h ILE 114 CO -0.02 0.05 0.00 0.40 0.00 0.00 0.00 178.15 178.59 2k89 h ILE 115 N 0.30 1.02 -0.74 -0.67 2.04 0.17 -2.73 117.51 116.90 2k89 h ILE 115 Ca 0.15 -0.05 0.12 0.00 1.00 0.00 0.00 64.86 66.09 2k89 h ILE 115 Cb 0.10 1.03 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 2k89 h ILE 115 CO -0.14 0.01 0.49 -0.78 0.00 0.00 0.00 178.15 177.74 2k89 h ASP 116 N -0.01 0.49 -0.68 1.72 1.82 -0.80 0.74 116.42 119.71 2k89 h ASP 116 Ca 0.00 0.02 -0.02 0.00 -0.39 0.00 0.00 57.03 56.64 2k89 h ASP 116 Cb 0.02 -0.08 -0.03 0.00 0.68 0.00 0.00 39.33 39.92 2k89 h ASP 116 CO -0.00 0.27 0.34 -1.13 -1.61 0.00 0.00 179.24 177.12 2k89 h ASN 117 N 0.53 0.88 0.18 2.28 -1.24 -1.16 -1.60 115.58 115.46 2k89 h ASN 117 Ca 0.36 -0.12 -0.35 0.00 0.71 0.00 0.00 56.30 56.90 2k89 h ASN 117 Cb 0.65 -0.22 -0.06 0.00 0.73 0.00 0.00 38.32 39.42 2k89 h ASN 117 CO -0.12 0.75 -2.12 0.35 -1.29 0.00 0.00 177.43 175.00 2k89 n THR 118 N -4.47 1.53 0.14 -3.57 -2.24 -0.18 -4.11 114.28 101.38 2k89 n THR 118 Ca 0.05 -0.77 0.01 0.00 -2.27 0.00 0.00 64.05 61.07 2k89 n THR 118 Cb 0.12 -0.95 0.13 0.00 -2.10 0.00 0.00 70.33 67.53 2k89 n THR 118 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2k89 h LYS 119 N 0.01 0.00 0.00 -0.78 5.09 0.34 -3.48 116.57 117.75 2k89 h LYS 119 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.29 2k89 h LYS 119 Cb 2.09 0.00 0.00 0.00 0.10 0.00 0.00 32.23 34.42 2k89 h LYS 119 CO 0.04 0.59 0.00 0.41 -2.09 0.00 0.00 179.45 178.39 2k89 n GLY 120 N 0.74 0.67 5.31 0.07 0.00 -0.65 -4.88 105.19 106.46 2k89 n GLY 120 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.60 2k89 n GLY 120 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k89 n GLN 121 N 3.39 0.00 -0.02 1.61 6.02 0.12 -3.37 117.38 125.13 2k89 n GLN 121 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.80 2k89 n GLN 121 Cb 0.00 0.00 -0.13 0.00 1.02 0.00 0.00 30.24 31.13 2k89 n GLN 121 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 177.06 178.03 2k89 h MET 122 N 0.00 0.16 0.00 -1.09 -1.53 -1.85 -3.28 114.93 107.34 2k89 h MET 122 Ca 0.00 -0.27 0.00 0.00 -3.44 0.00 0.00 59.70 55.99 2k89 h MET 122 Cb 0.00 0.10 0.00 0.00 -0.55 0.00 0.00 31.60 31.15 2k89 h MET 122 CO 0.00 1.13 -0.67 -0.11 0.14 0.00 0.00 176.91 177.40 2k89 n LEU 123 N -4.23 1.31 0.06 3.39 7.94 -1.22 -4.50 117.00 119.74 2k89 n LEU 123 Ca -0.19 0.23 0.08 0.00 -1.11 0.00 0.00 56.01 55.01 2k89 n LEU 123 Cb 0.74 -0.66 0.35 0.00 0.53 0.00 0.00 43.42 44.38 2k89 n LEU 123 CO 0.38 -0.35 0.75 0.61 -1.11 0.00 0.00 177.39 177.67 2k89 n GLY 124 N 1.48 -1.01 5.41 -3.96 0.00 -0.93 -4.90 105.19 101.28 2k89 n GLY 124 Ca -0.09 0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2k89 n GLY 124 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k89 n LEU 125 N -1.82 0.00 -3.61 0.99 4.77 -1.24 -4.37 117.00 111.72 2k89 n LEU 125 Ca 0.02 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.82 2k89 n LEU 125 Cb 0.15 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.09 2k89 n LEU 125 CO 0.13 0.00 -0.23 -0.83 -1.33 0.00 0.00 177.39 175.14 2k89 s GLY 126 N 0.00 0.04 -0.50 -0.72 0.00 -1.26 0.11 107.32 104.99 2k89 s GLY 126 Ca 0.00 0.44 -0.04 0.00 0.00 0.00 0.00 44.72 45.12 2k89 s GLY 126 CO 0.00 1.85 0.31 0.21 0.00 0.00 0.00 173.10 175.47 2k89 s ASN 127 N 2.30 5.34 0.00 1.64 2.47 -1.26 -5.06 114.94 120.37 2k89 s ASN 127 Ca 0.04 -2.30 0.31 0.00 0.42 0.00 0.00 52.86 51.33 2k89 s ASN 127 Cb -0.13 -1.87 1.78 0.00 -1.45 0.00 0.00 41.25 39.58 2k89 s ASN 127 CO -0.08 -0.51 2.16 -0.81 -3.72 0.00 0.00 177.10 174.14