#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 0.00 -3.73 0.00 4.13 -1.26 -4.36 115.26 110.05 2k89 n ASN 50 Ca 0.00 0.00 -0.27 0.00 1.68 0.00 0.00 54.58 55.99 2k89 n ASN 50 Cb 0.00 0.00 -0.17 0.00 -1.54 0.00 0.00 39.78 38.07 2k89 n ASN 50 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k89 s GLN 51 N 0.00 0.59 0.71 3.52 -2.07 -1.26 -5.13 119.66 116.02 2k89 s GLN 51 Ca 0.00 -0.31 -0.16 0.00 -1.82 0.00 0.00 55.36 53.07 2k89 s GLN 51 Cb 0.00 -1.93 0.03 0.00 -1.09 0.00 0.00 33.01 30.02 2k89 s GLN 51 CO 0.00 -0.60 1.22 -0.65 -1.32 0.00 0.00 175.29 173.94 2k89 s GLN 52 N 1.90 2.25 -1.18 9.60 -0.21 -1.26 -4.84 119.66 125.92 2k89 s GLN 52 Ca 0.00 1.81 -0.11 0.00 0.02 0.00 0.00 55.36 57.08 2k89 s GLN 52 Cb -0.16 -1.84 -0.07 0.00 1.00 0.00 0.00 33.01 31.94 2k89 s GLN 52 CO -0.08 -1.77 2.33 0.25 -2.12 0.00 0.00 175.29 173.91 2k89 n THR 53 N -2.53 3.02 -4.98 -0.19 -2.24 -1.26 -4.84 114.28 101.26 2k89 n THR 53 Ca 0.14 -2.06 -0.32 0.00 -2.27 0.00 0.00 64.05 59.53 2k89 n THR 53 Cb 0.50 -2.39 -0.14 0.00 -2.10 0.00 0.00 70.33 66.20 2k89 n THR 53 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2k89 s SER 54 N 3.33 3.81 0.00 3.42 0.15 -1.26 -4.43 113.70 118.72 2k89 s SER 54 Ca 0.53 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.92 2k89 s SER 54 Cb 0.14 -0.74 0.00 0.00 -1.71 0.00 0.00 66.02 63.70 2k89 s SER 54 CO -0.02 0.34 0.00 0.61 1.20 0.00 0.00 173.24 175.37 2k89 n GLY 55 N 2.35 0.48 3.97 9.45 0.00 -1.26 -5.03 105.19 115.15 2k89 n GLY 55 Ca -0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.15 3.35 -0.06 1.61 -0.14 -1.26 -4.66 119.74 118.44 2k89 s LYS 56 Ca 0.00 -0.67 0.06 0.00 -1.36 0.00 0.00 55.97 54.00 2k89 s LYS 56 Cb 0.00 -2.79 -0.01 0.00 -1.68 0.00 0.00 37.83 33.35 2k89 s LYS 56 CO 0.00 0.22 -0.25 0.08 -0.76 0.00 0.00 175.35 174.64 2k89 s VAL 57 N -2.16 2.02 -0.27 3.17 1.01 0.24 -4.92 120.40 119.49 2k89 s VAL 57 Ca 0.39 -1.05 -0.12 0.00 0.00 0.00 0.00 61.98 61.21 2k89 s VAL 57 Cb -0.09 -1.71 -0.05 0.00 0.00 0.00 0.00 36.38 34.53 2k89 s VAL 57 CO 0.32 0.56 0.22 -0.22 0.00 0.00 0.00 175.10 175.98 2k89 s LEU 58 N -0.12 4.04 -0.17 3.92 2.96 -1.26 -0.31 118.68 127.73 2k89 s LEU 58 Ca -0.05 0.06 0.01 0.00 -0.22 0.00 0.00 54.13 53.93 2k89 s LEU 58 Cb -0.14 -2.18 0.03 0.00 0.50 0.00 0.00 46.19 44.40 2k89 s LEU 58 CO 0.04 -0.06 -0.13 -0.72 -1.32 0.00 0.00 176.35 174.16 2k89 s TYR 59 N 1.72 2.35 -1.28 5.38 1.13 0.12 -4.77 117.35 121.99 2k89 s TYR 59 Ca 0.09 -1.42 0.00 0.00 -1.41 0.00 0.00 57.07 54.32 2k89 s TYR 59 Cb -0.16 -1.66 0.00 0.00 -1.10 0.00 0.00 41.96 39.05 2k89 s TYR 59 CO 0.10 -0.72 0.00 0.39 -2.51 0.00 0.00 175.55 172.81 2k89 n GLU 60 N 4.72 -1.53 0.00 -3.49 -0.58 -1.26 -0.88 120.64 117.61 2k89 n GLU 60 Ca -0.17 0.82 0.00 0.00 -0.42 0.00 0.00 57.16 57.39 2k89 n GLU 60 Cb 0.49 -5.06 0.00 0.00 -0.57 0.00 0.00 31.44 26.30 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 -0.01 2.21 3.93 0.62 0.00 -1.26 -5.10 105.19 105.57 2k89 n GLY 61 Ca -0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.14 3.47 -0.08 1.61 2.20 -0.06 -5.07 119.74 121.67 2k89 s LYS 62 Ca 0.00 -0.43 0.02 0.00 -0.36 0.00 0.00 55.97 55.20 2k89 s LYS 62 Cb 0.00 -2.97 -0.02 0.00 -1.51 0.00 0.00 37.83 33.33 2k89 s LYS 62 CO 0.00 0.54 -0.13 -1.21 -0.36 0.00 0.00 175.35 174.19 2k89 s GLU 63 N -2.84 2.84 0.27 4.03 2.02 -1.26 0.10 118.70 123.87 2k89 s GLU 63 Ca 0.36 -0.67 0.03 0.00 0.02 0.00 0.00 54.97 54.71 2k89 s GLU 63 Cb -0.12 -2.50 -0.04 0.00 0.10 0.00 0.00 34.13 31.58 2k89 s GLU 63 CO 0.28 0.49 0.17 -0.06 0.02 0.00 0.00 175.26 176.16 2k89 s PHE 64 N -0.37 1.49 0.00 1.61 0.08 0.57 -4.93 117.98 116.43 2k89 s PHE 64 Ca 0.04 -1.42 0.00 0.00 0.12 0.00 0.00 56.93 55.67 2k89 s PHE 64 Cb -0.12 -0.74 0.00 0.00 -0.57 0.00 0.00 43.02 41.59 2k89 s PHE 64 CO 0.02 -0.62 0.88 -0.25 -0.10 0.00 0.00 175.22 175.16 2k89 n ASP 65 N -0.83 0.00 -3.84 1.36 8.00 -1.11 0.80 116.55 120.93 2k89 n ASP 65 Ca 0.03 0.91 -0.26 0.00 0.71 0.00 0.00 54.79 56.17 2k89 n ASP 65 Cb 0.65 -0.44 -0.17 0.00 -0.02 0.00 0.00 41.12 41.13 2k89 n ASP 65 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2k89 s TYR 66 N -2.66 1.28 -0.06 1.24 2.02 -0.24 -3.12 117.35 115.81 2k89 s TYR 66 Ca 0.00 -0.74 -0.01 0.00 -0.37 0.00 0.00 57.07 55.95 2k89 s TYR 66 Cb 0.00 -1.12 -0.03 0.00 -0.40 0.00 0.00 41.96 40.41 2k89 s TYR 66 CO 0.00 -0.52 0.01 0.14 -1.57 0.00 0.00 175.55 173.61 2k89 s VAL 67 N 1.77 4.34 0.23 0.71 -7.23 -1.26 -0.35 120.40 118.61 2k89 s VAL 67 Ca 0.02 -0.33 -0.06 0.00 -1.81 0.00 0.00 61.98 59.80 2k89 s VAL 67 Cb -0.14 -2.86 -0.06 0.00 0.56 0.00 0.00 36.38 33.88 2k89 s VAL 67 CO -0.07 0.53 0.49 0.12 -0.31 0.00 0.00 175.10 175.86 2k89 s PHE 68 N -0.96 3.46 -0.25 2.82 5.36 0.81 -4.80 117.98 124.42 2k89 s PHE 68 Ca 0.16 0.65 -0.10 0.00 -0.96 0.00 0.00 56.93 56.67 2k89 s PHE 68 Cb -0.11 -2.09 -0.05 0.00 -0.34 0.00 0.00 43.02 40.43 2k89 s PHE 68 CO 0.05 0.29 0.15 -1.12 -1.46 0.00 0.00 175.22 173.13 2k89 s SER 69 N -2.76 5.91 -0.21 6.13 0.01 -1.26 0.04 113.70 121.55 2k89 s SER 69 Ca 0.43 0.02 0.01 0.00 1.31 0.00 0.00 55.95 57.73 2k89 s SER 69 Cb -0.11 -2.08 0.04 0.00 0.21 0.00 0.00 66.02 64.08 2k89 s SER 69 CO 0.26 0.01 -0.13 -0.63 0.41 0.00 0.00 173.24 173.17 2k89 s ILE 70 N 1.37 1.89 -0.13 1.44 1.01 0.93 -4.98 121.20 122.74 2k89 s ILE 70 Ca 0.07 -1.18 -0.06 0.00 0.00 0.00 0.00 60.65 59.48 2k89 s ILE 70 Cb -0.15 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.37 2k89 s ILE 70 CO 0.07 0.20 0.09 -1.81 0.00 0.00 0.00 174.94 173.49 2k89 s ASP 71 N 1.29 5.97 0.00 3.58 1.01 -1.26 -0.32 116.67 126.94 2k89 s ASP 71 Ca -0.02 0.31 0.28 0.00 0.71 0.00 0.00 52.55 53.83 2k89 s ASP 71 Cb -0.17 -1.91 1.01 0.00 1.01 0.00 0.00 42.92 42.87 2k89 s ASP 71 CO -0.08 0.35 1.72 0.55 0.21 0.00 0.00 175.17 177.91 2k89 n VAL 72 N 2.38 0.00 0.00 -1.27 3.14 -1.26 -4.94 118.33 116.38 2k89 n VAL 72 Ca -0.19 -0.16 0.00 0.00 -2.96 0.00 0.00 64.34 61.03 2k89 n VAL 72 Cb 0.54 0.32 0.00 0.00 -1.06 0.00 0.00 33.84 33.64 2k89 n VAL 72 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 2k89 n ASN 73 N -0.37 0.00 -4.77 6.55 0.23 -1.26 -4.89 115.26 110.75 2k89 n ASN 73 Ca 0.16 0.00 -0.41 0.00 -0.53 0.00 0.00 54.58 53.80 2k89 n ASN 73 Cb 0.33 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 38.01 2k89 n ASN 73 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2k89 s GLU 74 N 0.00 4.32 -0.68 -3.83 2.02 -1.26 -4.86 118.70 114.41 2k89 s GLU 74 Ca 0.00 2.26 -0.26 0.00 0.02 0.00 0.00 54.97 56.99 2k89 s GLU 74 Cb 0.00 -3.07 -0.10 0.00 0.10 0.00 0.00 34.13 31.06 2k89 s GLU 74 CO 0.00 -0.26 2.37 0.20 0.02 0.00 0.00 175.26 177.59 2k89 s GLY 75 N -0.29 -0.60 0.00 -1.39 0.00 -1.26 -4.51 107.32 99.27 2k89 s GLY 75 Ca 0.51 -0.52 0.00 0.00 0.00 0.00 0.00 44.72 44.71 2k89 s GLY 75 CO 0.52 4.14 0.00 0.61 0.00 0.00 0.00 173.10 178.37 2k89 n GLY 76 N 6.47 -0.34 3.96 0.20 0.00 -1.26 -5.04 105.19 109.19 2k89 n GLY 76 Ca 0.42 -1.18 -0.22 0.00 0.00 0.00 0.00 46.02 45.03 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 -4.25 3.46 -0.10 1.61 0.04 -1.26 -5.06 135.00 129.44 2k89 s PRO 77 Ca 0.00 -0.61 -0.10 0.00 0.04 0.00 0.00 61.00 60.33 2k89 s PRO 77 Cb 0.00 -2.82 -0.05 0.00 0.04 0.00 0.00 34.50 31.67 2k89 s PRO 77 CO 0.00 0.34 0.23 -1.12 0.04 0.00 0.00 177.00 176.50 2k89 s SER 78 N -3.96 6.50 0.10 6.66 0.01 -1.26 -4.32 113.70 117.43 2k89 s SER 78 Ca 0.36 0.59 0.06 0.00 1.31 0.00 0.00 55.95 58.27 2k89 s SER 78 Cb -0.09 -2.14 -0.04 0.00 0.21 0.00 0.00 66.02 63.96 2k89 s SER 78 CO 0.31 0.33 -0.03 -0.31 0.41 0.00 0.00 173.24 173.94 2k89 s TYR 79 N -0.72 2.90 -0.01 2.43 2.02 0.57 -5.01 117.35 119.52 2k89 s TYR 79 Ca 0.17 -0.08 0.01 0.00 -0.37 0.00 0.00 57.07 56.80 2k89 s TYR 79 Cb -0.13 -1.49 0.00 0.00 -0.40 0.00 0.00 41.96 39.94 2k89 s TYR 79 CO 0.06 0.47 -0.04 0.15 -1.57 0.00 0.00 175.55 174.62 2k89 s LYS 80 N -2.32 0.39 -0.55 -0.62 -0.14 -1.26 -0.05 119.74 115.19 2k89 s LYS 80 Ca 0.24 -0.11 -0.05 0.00 -1.36 0.00 0.00 55.97 54.70 2k89 s LYS 80 Cb -0.11 -0.41 0.14 0.00 -1.68 0.00 0.00 37.83 35.77 2k89 s LYS 80 CO 0.17 0.03 0.38 -1.17 -0.76 0.00 0.00 175.35 174.00 2k89 s LEU 81 N 0.21 5.45 0.20 3.17 0.20 0.11 -4.87 118.68 123.14 2k89 s LEU 81 Ca -0.02 -2.42 -0.30 0.00 0.69 0.00 0.00 54.13 52.08 2k89 s LEU 81 Cb -0.05 -1.90 -0.09 0.00 -0.43 0.00 0.00 46.19 43.72 2k89 s LEU 81 CO -0.00 -0.50 1.28 -2.84 -0.29 0.00 0.00 176.35 174.00 2k89 s PRO 82 N 0.57 4.41 -0.03 0.98 0.02 -1.26 -0.13 135.00 139.56 2k89 s PRO 82 Ca 0.12 2.02 0.01 0.00 0.02 0.00 0.00 61.00 63.16 2k89 s PRO 82 Cb -0.21 -3.20 0.02 0.00 0.02 0.00 0.00 34.50 31.13 2k89 s PRO 82 CO -0.04 -0.22 -0.01 -0.47 -0.33 0.00 0.00 177.00 175.94 2k89 s TYR 83 N 0.07 0.37 -0.16 6.54 5.04 0.52 -4.89 117.35 124.83 2k89 s TYR 83 Ca 0.56 -0.03 -0.05 0.00 -2.44 0.00 0.00 57.07 55.10 2k89 s TYR 83 Cb -0.36 -0.43 -0.03 0.00 0.35 0.00 0.00 41.96 41.49 2k89 s TYR 83 CO 0.38 -0.13 0.02 0.54 -1.34 0.00 0.00 175.55 175.02 2k89 s ASN 84 N 0.92 5.26 0.09 4.32 4.22 -1.26 -1.08 114.94 127.40 2k89 s ASN 84 Ca -0.10 0.00 0.11 0.00 -2.14 0.00 0.00 52.86 50.74 2k89 s ASN 84 Cb -0.13 -1.85 0.52 0.00 1.28 0.00 0.00 41.25 41.07 2k89 s ASN 84 CO -0.01 0.19 1.35 0.35 -2.04 0.00 0.00 177.10 176.94 2k89 n THR 85 N 3.41 1.36 0.66 0.54 -2.24 -1.26 -1.02 114.28 115.73 2k89 n THR 85 Ca -0.17 0.42 0.12 0.00 -2.27 0.00 0.00 64.05 62.15 2k89 n THR 85 Cb 0.52 -1.33 0.47 0.00 -2.10 0.00 0.00 70.33 67.89 2k89 n THR 85 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2k89 n SER 86 N -1.73 0.42 -4.83 3.42 7.64 -1.26 -4.85 113.62 112.43 2k89 n SER 86 Ca 0.01 0.56 -0.22 0.00 1.01 0.00 0.00 58.87 60.23 2k89 n SER 86 Cb 0.09 -0.66 -0.05 0.00 -1.01 0.00 0.00 64.21 62.58 2k89 n SER 86 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k89 s ASP 87 N -3.78 4.87 0.24 6.43 2.15 -0.19 -5.12 116.67 121.27 2k89 s ASP 87 Ca 0.09 -0.82 -0.17 0.00 0.43 0.00 0.00 52.55 52.09 2k89 s ASP 87 Cb 0.13 -0.58 -0.08 0.00 -0.30 0.00 0.00 42.92 42.09 2k89 s ASP 87 CO 0.47 -0.58 0.68 -1.81 -0.17 0.00 0.00 175.17 173.77 2k89 s ASP 88 N -4.04 6.91 0.14 -0.34 1.01 -1.26 -4.95 116.67 114.14 2k89 s ASP 88 Ca 0.45 1.29 -0.15 0.00 0.71 0.00 0.00 52.55 54.85 2k89 s ASP 88 Cb -0.01 -2.37 0.02 0.00 1.01 0.00 0.00 42.92 41.56 2k89 s ASP 88 CO 0.26 -0.03 1.69 -0.65 0.21 0.00 0.00 175.17 176.66 2k89 h PRO 89 N 3.07 0.68 -0.90 8.23 0.11 -1.93 0.26 132.00 141.52 2k89 h PRO 89 Ca -0.48 -0.12 0.02 0.00 0.11 0.00 0.00 66.00 65.53 2k89 h PRO 89 Cb 1.19 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 32.14 2k89 h PRO 89 CO 0.66 0.62 0.59 2.35 -0.21 0.00 0.00 178.00 182.00 2k89 h TRP 90 N 0.59 1.11 -0.05 0.65 7.01 -1.91 0.30 115.95 123.65 2k89 h TRP 90 Ca 0.15 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.12 2k89 h TRP 90 Cb 0.19 -0.37 0.00 0.00 -2.10 0.00 0.00 29.16 26.88 2k89 h TRP 90 CO 0.00 0.68 -0.19 -0.07 -2.79 0.00 0.00 178.44 176.07 2k89 h LEU 91 N 1.18 0.26 -0.19 0.65 3.38 -1.79 -1.32 115.31 117.47 2k89 h LEU 91 Ca 0.34 -0.63 -0.00 0.00 0.09 0.00 0.00 57.88 57.68 2k89 h LEU 91 Cb -0.09 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2k89 h LEU 91 CO -0.08 0.84 0.12 0.74 0.09 0.00 0.00 178.44 180.14 2k89 h THR 92 N -0.31 1.08 -0.83 0.22 2.02 -0.22 0.19 112.91 115.07 2k89 h THR 92 Ca -0.01 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 66.96 2k89 h THR 92 Cb 0.82 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 68.06 2k89 h THR 92 CO 0.04 0.08 0.50 0.00 0.37 0.00 0.00 175.52 176.51 2k89 h ALA 93 N 1.03 1.05 -0.57 6.16 0.00 -0.48 -1.58 119.26 124.86 2k89 h ALA 93 Ca 0.07 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2k89 h ALA 93 Cb 0.03 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2k89 h ALA 93 CO -0.01 0.52 0.13 -0.92 0.00 0.00 0.00 179.25 178.96 2k89 h TYR 94 N 1.13 0.97 -0.34 0.00 5.03 -0.77 0.11 116.97 123.10 2k89 h TYR 94 Ca 0.30 -0.12 0.03 0.00 2.58 0.00 0.00 58.73 61.52 2k89 h TYR 94 Cb -0.05 -0.27 -0.03 0.00 1.55 0.00 0.00 36.73 37.93 2k89 h TYR 94 CO -0.00 0.84 0.15 -0.91 -1.32 0.00 0.00 178.16 176.92 2k89 h ASN 95 N 0.83 0.21 -0.45 -2.11 2.35 -0.13 0.87 115.58 117.15 2k89 h ASN 95 Ca 0.18 0.02 -0.13 0.00 -0.55 0.00 0.00 56.30 55.82 2k89 h ASN 95 Cb 0.36 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 2k89 h ASN 95 CO 0.00 0.16 -0.24 0.15 -1.65 0.00 0.00 177.43 175.86 2k89 h PHE 96 N 0.32 1.10 -0.45 1.19 3.57 -1.10 0.11 116.94 121.68 2k89 h PHE 96 Ca 0.15 -0.28 0.03 0.00 3.53 0.00 0.00 57.97 61.40 2k89 h PHE 96 Cb 0.08 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.54 2k89 h PHE 96 CO -0.11 1.09 0.25 1.25 -2.23 0.00 0.00 178.31 178.56 2k89 h LEU 97 N 0.79 0.39 -0.50 0.59 5.85 -0.35 0.15 115.31 122.23 2k89 h LEU 97 Ca 0.10 0.01 -0.16 0.00 0.84 0.00 0.00 57.88 58.67 2k89 h LEU 97 Cb 0.81 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 2k89 h LEU 97 CO 0.07 0.28 -0.46 1.56 -0.34 0.00 0.00 178.44 179.55 2k89 h GLN 98 N 0.50 0.72 -0.40 1.25 1.08 -0.77 0.54 115.11 118.02 2k89 h GLN 98 Ca 0.18 -0.40 -0.02 0.00 -1.45 0.00 0.00 58.65 56.97 2k89 h GLN 98 Cb 0.05 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.49 2k89 h GLN 98 CO -0.10 1.02 0.19 -0.22 -0.95 0.00 0.00 178.83 178.77 2k89 h LYS 99 N 0.57 0.59 -0.01 1.46 3.11 0.02 -2.90 116.57 119.41 2k89 h LYS 99 Ca 0.03 -0.09 0.00 0.00 -2.81 0.00 0.00 60.65 57.78 2k89 h LYS 99 Cb 1.01 -0.10 0.00 0.00 -1.00 0.00 0.00 32.23 32.14 2k89 h LYS 99 CO 0.10 0.52 -0.46 -1.71 -2.81 0.00 0.00 179.45 175.09 2k89 n ASN 100 N -4.68 1.75 -3.00 4.20 4.05 0.45 -4.97 115.26 113.07 2k89 n ASN 100 Ca 0.00 -1.35 -0.13 0.00 0.45 0.00 0.00 54.58 53.55 2k89 n ASN 100 Cb 0.12 0.43 0.07 0.00 1.23 0.00 0.00 39.78 41.63 2k89 n ASN 100 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 177.26 173.54 2k89 n ASP 101 N -0.25 -3.79 -4.56 1.20 2.03 -0.02 -5.04 116.55 106.12 2k89 n ASP 101 Ca 0.10 -0.55 -0.26 0.00 0.52 0.00 0.00 54.79 54.60 2k89 n ASP 101 Cb 0.44 -4.40 0.12 0.00 -0.72 0.00 0.00 41.12 36.55 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 -5.35 2.89 0.12 -2.67 2.01 0.17 -5.00 118.68 110.84 2k89 s LEU 102 Ca 0.18 -0.07 -0.23 0.00 0.01 0.00 0.00 54.13 54.02 2k89 s LEU 102 Cb -0.02 -2.24 -0.07 0.00 0.01 0.00 0.00 46.19 43.86 2k89 s LEU 102 CO 0.61 -2.06 0.68 0.21 1.01 0.00 0.00 176.35 176.80 2k89 s ASN 103 N -4.74 7.24 0.28 2.29 3.84 -1.26 -4.78 114.94 117.80 2k89 s ASN 103 Ca 0.67 1.46 0.17 0.00 0.21 0.00 0.00 52.86 55.37 2k89 s ASN 103 Cb -0.06 -2.44 0.90 0.00 -0.55 0.00 0.00 41.25 39.11 2k89 s ASN 103 CO 0.47 0.23 1.47 -2.65 -2.79 0.00 0.00 177.10 173.83 2k89 n PRO 104 N 1.72 0.11 0.27 0.43 -0.02 -1.26 -0.40 135.00 135.84 2k89 n PRO 104 Ca -0.08 0.59 0.17 0.00 -2.02 0.00 0.00 63.50 62.17 2k89 n PRO 104 Cb 0.50 -1.95 0.63 0.00 -0.02 0.00 0.00 33.50 32.66 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 4.05 -2.04 -2.82 114.93 113.60 2k89 h MET 105 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2k89 h MET 105 Cb 0.18 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.98 2k89 h MET 105 CO 0.00 0.00 -0.39 0.74 0.23 0.00 0.00 176.91 177.49 2k89 h PHE 106 N 0.00 0.00 -0.58 1.39 0.04 -1.12 -3.36 116.94 113.32 2k89 h PHE 106 Ca 0.00 0.00 0.08 0.00 2.80 0.00 0.00 57.97 60.85 2k89 h PHE 106 Cb 0.55 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.64 2k89 h PHE 106 CO 0.00 0.00 0.22 1.25 -0.60 0.00 0.00 178.31 179.18 2k89 h LEU 107 N 0.00 0.24 -0.47 1.54 5.85 -1.63 -0.48 115.31 120.36 2k89 h LEU 107 Ca 0.00 0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.73 2k89 h LEU 107 Cb 0.94 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 2k89 h LEU 107 CO 0.00 0.15 0.06 -0.78 -0.34 0.00 0.00 178.44 177.53 2k89 h ASP 108 N 0.41 0.76 -0.12 1.25 1.82 -1.77 0.10 116.42 118.88 2k89 h ASP 108 Ca 0.28 -0.27 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 2k89 h ASP 108 Cb 0.32 -0.20 -0.01 0.00 0.68 0.00 0.00 39.33 40.12 2k89 h ASP 108 CO -0.28 0.84 0.08 -0.61 -1.61 0.00 0.00 179.24 177.67 2k89 h GLN 109 N 0.66 0.15 -0.19 0.28 4.15 -1.46 0.21 115.11 118.92 2k89 h GLN 109 Ca 0.14 -0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.48 2k89 h GLN 109 Cb 0.42 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.07 2k89 h GLN 109 CO 0.01 0.11 -0.17 -0.39 -1.93 0.00 0.00 178.83 176.46 2k89 h VAL 110 N 0.16 1.33 -0.54 2.39 -1.51 -1.09 -2.81 116.25 114.17 2k89 h VAL 110 Ca 0.04 -1.32 -0.05 0.00 -1.23 0.00 0.00 66.70 64.14 2k89 h VAL 110 Cb -0.02 1.77 -0.03 0.00 -2.13 0.00 0.00 31.29 30.89 2k89 h VAL 110 CO -0.01 0.40 0.14 0.00 -1.23 0.00 0.00 177.57 176.87 2k89 h ALA 111 N 0.64 1.22 -0.37 5.19 0.00 -0.82 -0.93 119.26 124.20 2k89 h ALA 111 Ca 0.03 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 2k89 h ALA 111 Cb 0.70 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2k89 h ALA 111 CO 0.04 0.54 -0.18 0.87 0.00 0.00 0.00 179.25 180.52 2k89 h LYS 112 N 0.80 0.70 -0.41 0.00 1.79 -0.57 0.37 116.57 119.24 2k89 h LYS 112 Ca 0.18 -0.26 -0.06 0.00 -2.18 0.00 0.00 60.65 58.33 2k89 h LYS 112 Cb 0.29 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.87 2k89 h LYS 112 CO -0.00 0.84 0.01 0.35 -1.08 0.00 0.00 179.45 179.57 2k89 h PHE 113 N 0.62 0.78 -0.45 -1.35 3.04 -1.18 -0.81 116.94 117.59 2k89 h PHE 113 Ca 0.10 -0.13 0.04 0.00 3.98 0.00 0.00 57.97 61.96 2k89 h PHE 113 Cb 0.66 -0.21 -0.04 0.00 2.56 0.00 0.00 35.95 38.92 2k89 h PHE 113 CO 0.03 0.78 0.22 0.82 -2.02 0.00 0.00 178.31 178.14 2k89 h ILE 114 N 0.56 0.95 -0.12 1.41 2.04 -0.77 -2.69 117.51 118.89 2k89 h ILE 114 Ca 0.12 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.83 2k89 h ILE 114 Cb 0.46 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 2k89 h ILE 114 CO 0.02 0.08 0.07 0.40 0.00 0.00 0.00 178.15 178.72 2k89 h ILE 115 N 0.43 1.02 -0.76 -0.67 2.04 -0.06 -2.65 117.51 116.86 2k89 h ILE 115 Ca 0.20 -0.05 0.12 0.00 1.00 0.00 0.00 64.86 66.13 2k89 h ILE 115 Cb 0.12 0.86 -0.05 0.00 -0.74 0.00 0.00 36.82 37.01 2k89 h ILE 115 CO -0.15 0.03 0.50 -0.78 0.00 0.00 0.00 178.15 177.74 2k89 h ASP 116 N 0.15 0.53 -0.30 1.72 3.58 -0.88 1.13 116.42 122.35 2k89 h ASP 116 Ca 0.04 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.51 2k89 h ASP 116 Cb -0.01 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 40.94 2k89 h ASP 116 CO -0.02 0.30 0.15 -1.13 -2.88 0.00 0.00 179.24 175.67 2k89 h ASN 117 N 0.58 0.38 0.78 2.28 -1.24 -1.16 -2.24 115.58 114.96 2k89 h ASN 117 Ca 0.36 -0.10 -0.22 0.00 0.71 0.00 0.00 56.30 57.05 2k89 h ASN 117 Cb 0.61 -0.10 -0.04 0.00 0.73 0.00 0.00 38.32 39.53 2k89 h ASN 117 CO -0.13 0.37 -1.32 0.71 -1.29 0.00 0.00 177.43 175.77 2k89 h THR 118 N 0.35 0.98 -0.01 -3.57 1.35 -1.11 -3.36 112.91 107.54 2k89 h THR 118 Ca 0.10 -2.66 0.00 0.00 -0.55 0.00 0.00 66.41 63.31 2k89 h THR 118 Cb 0.09 2.43 -0.00 0.00 -1.73 0.00 0.00 68.15 68.93 2k89 h THR 118 CO -0.02 0.56 -0.04 0.50 -0.25 0.00 0.00 175.52 176.28 2k89 h LYS 119 N 0.00 -0.04 0.00 4.72 3.64 0.13 -3.48 116.57 121.54 2k89 h LYS 119 Ca -0.16 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2k89 h LYS 119 Cb 1.78 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.61 2k89 h LYS 119 CO 0.08 -0.03 0.00 0.41 -2.27 0.00 0.00 179.45 177.65 2k89 n GLY 120 N -1.03 0.53 0.21 5.01 0.00 -0.87 -4.67 105.19 104.37 2k89 n GLY 120 Ca -0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 2k89 n GLY 120 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2k89 h GLN 121 N 0.00 0.00 0.13 1.61 4.20 -1.70 0.48 115.11 119.83 2k89 h GLN 121 Ca 0.00 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.48 2k89 h GLN 121 Cb 0.00 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.79 2k89 h GLN 121 CO 0.00 0.00 -1.11 1.98 -0.67 0.00 0.00 178.83 179.03 2k89 h MET 122 N 0.00 0.28 0.15 1.46 4.05 -1.77 -3.40 114.93 115.70 2k89 h MET 122 Ca 0.00 -0.49 -0.36 0.00 -0.28 0.00 0.00 59.70 58.58 2k89 h MET 122 Cb 0.63 0.18 -0.00 0.00 -0.80 0.00 0.00 31.60 31.60 2k89 h MET 122 CO 0.00 1.23 -1.87 1.25 0.23 0.00 0.00 176.91 177.75 2k89 h LEU 123 N -0.33 0.51 0.00 3.39 7.12 -1.72 -3.49 115.31 120.80 2k89 h LEU 123 Ca -0.22 -0.95 0.00 0.00 0.13 0.00 0.00 57.88 56.84 2k89 h LEU 123 Cb 1.72 -0.16 0.00 0.00 -0.53 0.00 0.00 40.66 41.68 2k89 h LEU 123 CO 0.11 1.83 0.00 0.61 -0.13 0.00 0.00 178.44 180.86 2k89 n GLY 124 N 1.93 0.93 3.52 3.75 0.00 0.11 -5.13 105.19 110.31 2k89 n GLY 124 Ca -0.29 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.48 2k89 n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k89 s LEU 125 N 0.00 2.14 0.00 0.99 1.43 0.13 -5.02 118.68 118.35 2k89 s LEU 125 Ca 0.00 -1.54 0.00 0.00 -1.03 0.00 0.00 54.13 51.56 2k89 s LEU 125 Cb 0.00 -0.33 0.00 0.00 0.03 0.00 0.00 46.19 45.89 2k89 s LEU 125 CO 0.00 -0.77 0.00 0.61 0.23 0.00 0.00 176.35 176.42 2k89 n GLY 126 N -0.87 -1.18 3.85 -3.19 0.00 -1.26 -4.11 105.19 98.42 2k89 n GLY 126 Ca -0.06 0.47 -0.37 0.00 0.00 0.00 0.00 46.02 46.05 2k89 n GLY 126 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2k89 s ASN 127 N 0.00 6.59 0.00 1.61 0.01 -1.26 -5.17 114.94 116.72 2k89 s ASN 127 Ca 0.00 0.70 0.08 0.00 -0.71 0.00 0.00 52.86 52.94 2k89 s ASN 127 Cb 0.00 -2.16 0.50 0.00 0.41 0.00 0.00 41.25 40.00 2k89 s ASN 127 CO 0.00 0.35 0.96 -2.65 -1.51 0.00 0.00 177.10 174.25