#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 -7.27 -0.39 0.00 4.13 -1.26 -4.90 115.26 105.57 2k89 n ASN 50 Ca 0.00 1.00 0.10 0.00 1.68 0.00 0.00 54.58 57.36 2k89 n ASN 50 Cb 0.00 -4.83 0.43 0.00 -1.54 0.00 0.00 39.78 33.85 2k89 n ASN 50 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k89 n GLN 51 N 0.31 1.51 -3.50 3.52 6.02 -1.26 -4.53 117.38 119.44 2k89 n GLN 51 Ca 0.03 -0.76 -0.21 0.00 -0.01 0.00 0.00 57.00 56.05 2k89 n GLN 51 Cb 0.13 -1.37 -0.13 0.00 1.02 0.00 0.00 30.24 29.90 2k89 n GLN 51 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2k89 s GLN 52 N -1.86 0.20 0.49 -1.09 2.00 -1.26 -5.14 119.66 113.00 2k89 s GLN 52 Ca 0.31 -0.04 -0.24 0.00 -2.00 0.00 0.00 55.36 53.39 2k89 s GLN 52 Cb 0.16 -1.19 -0.07 0.00 0.80 0.00 0.00 33.01 32.72 2k89 s GLN 52 CO 0.25 -0.80 1.37 0.99 -0.50 0.00 0.00 175.29 176.60 2k89 s THR 53 N 2.26 2.19 0.00 -0.34 2.01 -1.26 -5.00 115.64 115.51 2k89 s THR 53 Ca 0.07 0.16 0.00 0.00 0.31 0.00 0.00 61.69 62.23 2k89 s THR 53 Cb -0.15 -3.09 0.00 0.00 0.01 0.00 0.00 72.50 69.27 2k89 s THR 53 CO -0.20 0.01 0.00 -1.20 -0.69 0.00 0.00 174.62 172.54 2k89 n SER 54 N -0.56 0.00 0.00 3.53 7.64 -1.26 -4.90 113.62 118.07 2k89 n SER 54 Ca 0.07 -0.72 0.00 0.00 1.01 0.00 0.00 58.87 59.24 2k89 n SER 54 Cb 0.44 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 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 0.00 2.72 3.61 0.23 0.00 -1.26 -4.99 105.19 105.50 2k89 n GLY 55 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.03 -0.24 -0.26 1.61 3.01 -1.26 -4.97 119.74 117.60 2k89 s LYS 56 Ca 0.00 0.52 -0.16 0.00 -1.01 0.00 0.00 55.97 55.32 2k89 s LYS 56 Cb 0.00 -1.66 -0.04 0.00 -1.01 0.00 0.00 37.83 35.13 2k89 s LYS 56 CO 0.00 -3.18 0.41 0.08 0.51 0.00 0.00 175.35 173.16 2k89 s VAL 57 N -2.82 5.15 -0.39 3.17 1.01 0.06 -4.87 120.40 121.71 2k89 s VAL 57 Ca 0.67 0.65 -0.18 0.00 0.00 0.00 0.00 61.98 63.12 2k89 s VAL 57 Cb -0.20 -3.73 0.01 0.00 0.00 0.00 0.00 36.38 32.47 2k89 s VAL 57 CO 0.59 0.15 0.50 -0.22 0.00 0.00 0.00 175.10 176.13 2k89 s LEU 58 N 2.04 4.57 -0.25 3.92 2.96 -1.26 -0.31 118.68 130.35 2k89 s LEU 58 Ca 0.17 -0.35 -0.04 0.00 -0.22 0.00 0.00 54.13 53.69 2k89 s LEU 58 Cb -0.16 -2.52 0.01 0.00 0.50 0.00 0.00 46.19 44.02 2k89 s LEU 58 CO 0.09 -0.57 -0.01 -0.72 -1.32 0.00 0.00 176.35 173.82 2k89 s TYR 59 N 2.37 3.05 -0.58 5.38 1.13 0.12 -4.68 117.35 124.13 2k89 s TYR 59 Ca 0.17 -1.15 0.00 0.00 -1.41 0.00 0.00 57.07 54.67 2k89 s TYR 59 Cb -0.16 -2.13 0.00 0.00 -1.10 0.00 0.00 41.96 38.57 2k89 s TYR 59 CO 0.15 -0.62 0.00 0.39 -2.51 0.00 0.00 175.55 172.96 2k89 n GLU 60 N 4.77 -1.77 0.00 -3.49 -0.58 -1.26 -1.12 120.64 117.19 2k89 n GLU 60 Ca -0.17 0.56 0.00 0.00 -0.42 0.00 0.00 57.16 57.14 2k89 n GLU 60 Cb 0.49 -4.66 0.00 0.00 -0.57 0.00 0.00 31.44 26.70 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 0.38 1.70 3.93 0.62 0.00 -1.26 -5.11 105.19 105.45 2k89 n GLY 61 Ca -0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.69 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 3.48 -0.06 1.61 2.20 -0.28 -5.07 119.74 121.63 2k89 s LYS 62 Ca 0.00 -0.44 0.00 0.00 -0.36 0.00 0.00 55.97 55.17 2k89 s LYS 62 Cb 0.00 -2.92 -0.03 0.00 -1.51 0.00 0.00 37.83 33.36 2k89 s LYS 62 CO 0.00 0.49 -0.04 -1.21 -0.36 0.00 0.00 175.35 174.23 2k89 s GLU 63 N -3.09 2.79 0.25 4.03 2.02 -1.26 0.11 118.70 123.54 2k89 s GLU 63 Ca 0.36 -0.54 0.02 0.00 0.02 0.00 0.00 54.97 54.84 2k89 s GLU 63 Cb -0.11 -2.64 -0.04 0.00 0.10 0.00 0.00 34.13 31.44 2k89 s GLU 63 CO 0.28 0.66 0.18 -0.06 0.02 0.00 0.00 175.26 176.35 2k89 s PHE 64 N -0.88 1.38 0.00 1.61 0.08 0.57 -4.97 117.98 115.77 2k89 s PHE 64 Ca 0.14 -1.48 -0.07 0.00 0.12 0.00 0.00 56.93 55.64 2k89 s PHE 64 Cb -0.11 -0.62 -0.04 0.00 -0.57 0.00 0.00 43.02 41.68 2k89 s PHE 64 CO 0.03 -0.72 0.82 -0.44 -0.10 0.00 0.00 175.22 174.81 2k89 h ASP 65 N 2.44 -0.21 -3.22 1.36 3.32 -1.70 0.22 116.42 118.62 2k89 h ASP 65 Ca -0.32 0.01 -0.41 0.00 0.02 0.00 0.00 57.03 56.33 2k89 h ASP 65 Cb 1.24 0.05 -0.40 0.00 0.22 0.00 0.00 39.33 40.45 2k89 h ASP 65 CO 0.47 -0.11 -0.75 -0.31 -1.72 0.00 0.00 179.24 176.82 2k89 s TYR 66 N -3.02 0.17 -0.06 4.55 2.02 -0.06 -3.47 117.35 117.48 2k89 s TYR 66 Ca -0.04 0.02 -0.02 0.00 -0.37 0.00 0.00 57.07 56.66 2k89 s TYR 66 Cb 0.00 -0.59 -0.04 0.00 -0.40 0.00 0.00 41.96 40.94 2k89 s TYR 66 CO 0.11 -0.31 0.05 0.14 -1.57 0.00 0.00 175.55 173.97 2k89 s VAL 67 N 2.14 4.64 0.27 0.71 -7.23 -1.26 -1.31 120.40 118.36 2k89 s VAL 67 Ca 0.04 -0.25 -0.02 0.00 -1.81 0.00 0.00 61.98 59.93 2k89 s VAL 67 Cb -0.13 -3.03 -0.04 0.00 0.56 0.00 0.00 36.38 33.73 2k89 s VAL 67 CO -0.05 0.50 0.50 0.12 -0.31 0.00 0.00 175.10 175.87 2k89 s PHE 68 N -1.03 3.48 -0.28 2.82 5.36 0.59 -4.80 117.98 124.13 2k89 s PHE 68 Ca 0.17 0.49 -0.15 0.00 -0.96 0.00 0.00 56.93 56.48 2k89 s PHE 68 Cb -0.12 -1.98 -0.03 0.00 -0.34 0.00 0.00 43.02 40.55 2k89 s PHE 68 CO 0.07 0.22 0.38 0.45 -1.46 0.00 0.00 175.22 174.89 2k89 s SER 69 N -3.35 6.25 -0.25 6.13 0.15 -1.26 0.11 113.70 121.47 2k89 s SER 69 Ca 0.41 0.23 -0.08 0.00 0.70 0.00 0.00 55.95 57.22 2k89 s SER 69 Cb -0.11 -2.21 -0.03 0.00 -1.71 0.00 0.00 66.02 61.96 2k89 s SER 69 CO 0.31 -0.22 0.08 -0.63 1.20 0.00 0.00 173.24 173.98 2k89 s ILE 70 N 2.09 4.41 -0.22 6.45 -1.09 0.18 -4.95 121.20 128.06 2k89 s ILE 70 Ca 0.15 -0.14 -0.09 0.00 -2.23 0.00 0.00 60.65 58.34 2k89 s ILE 70 Cb -0.16 -3.06 -0.04 0.00 -1.58 0.00 0.00 42.46 37.61 2k89 s ILE 70 CO 0.10 0.33 0.11 1.51 -1.23 0.00 0.00 174.94 175.77 2k89 s ASP 71 N 1.62 5.82 -0.01 3.58 -4.77 -1.26 -0.56 116.67 121.08 2k89 s ASP 71 Ca 0.06 0.06 0.16 0.00 -3.30 0.00 0.00 52.55 49.54 2k89 s ASP 71 Cb -0.15 -2.03 -0.22 0.00 -1.09 0.00 0.00 42.92 39.43 2k89 s ASP 71 CO 0.04 0.09 0.51 0.55 0.70 0.00 0.00 175.17 177.07 2k89 n VAL 72 N 4.09 0.00 -3.60 2.11 3.14 -1.26 -5.01 118.33 117.81 2k89 n VAL 72 Ca -0.16 -0.26 -0.12 0.00 -2.96 0.00 0.00 64.34 60.84 2k89 n VAL 72 Cb 0.52 0.53 -0.06 0.00 -1.06 0.00 0.00 33.84 33.77 2k89 n VAL 72 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 2k89 s ASN 73 N -3.25 -0.53 0.04 6.55 3.84 -1.26 -5.01 114.94 115.32 2k89 s ASN 73 Ca -0.00 0.83 -0.30 0.00 0.21 0.00 0.00 52.86 53.59 2k89 s ASN 73 Cb 0.11 0.77 -0.08 0.00 -0.55 0.00 0.00 41.25 41.51 2k89 s ASN 73 CO 0.68 -0.31 1.69 -1.61 -2.79 0.00 0.00 177.10 174.75 2k89 s GLU 74 N -0.38 4.19 0.00 0.43 8.01 -1.26 -1.90 118.70 127.79 2k89 s GLU 74 Ca -0.02 2.33 0.00 0.00 0.01 0.00 0.00 54.97 57.30 2k89 s GLU 74 Cb -0.03 -3.75 0.00 0.00 -4.31 0.00 0.00 34.13 26.04 2k89 s GLU 74 CO 0.01 -0.79 0.00 0.41 0.01 0.00 0.00 175.26 174.90 2k89 n GLY 75 N 4.09 0.70 0.00 -1.39 0.00 -1.26 -4.95 105.19 102.38 2k89 n GLY 75 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -2.08 2.67 3.82 -0.02 0.00 -0.80 -4.91 105.19 103.87 2k89 n GLY 76 Ca 0.00 -2.12 -0.33 0.00 0.00 0.00 0.00 46.02 43.57 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 -2.14 4.22 -0.24 1.61 0.04 -1.26 -4.22 135.00 133.01 2k89 s PRO 77 Ca 0.00 1.14 -0.22 0.00 0.04 0.00 0.00 61.00 61.96 2k89 s PRO 77 Cb 0.00 -2.20 -0.01 0.00 0.04 0.00 0.00 34.50 32.33 2k89 s PRO 77 CO 0.00 -0.04 0.72 0.45 0.04 0.00 0.00 177.00 178.17 2k89 s SER 78 N -2.15 6.71 0.33 6.66 0.15 -1.26 -4.08 113.70 120.07 2k89 s SER 78 Ca 0.62 0.88 0.07 0.00 0.70 0.00 0.00 55.95 58.22 2k89 s SER 78 Cb -0.10 -2.38 -0.02 0.00 -1.71 0.00 0.00 66.02 61.80 2k89 s SER 78 CO 0.14 -0.41 0.32 -0.31 1.20 0.00 0.00 173.24 174.17 2k89 s TYR 79 N 2.53 2.95 0.03 3.44 2.02 0.27 -4.96 117.35 123.63 2k89 s TYR 79 Ca 0.31 -0.28 0.04 0.00 -0.37 0.00 0.00 57.07 56.76 2k89 s TYR 79 Cb -0.16 -1.81 -0.02 0.00 -0.40 0.00 0.00 41.96 39.58 2k89 s TYR 79 CO 0.08 0.17 -0.11 0.15 -1.57 0.00 0.00 175.55 174.28 2k89 s LYS 80 N -4.02 0.74 -0.58 -0.62 -0.14 -1.26 0.47 119.74 114.33 2k89 s LYS 80 Ca 0.41 -0.64 -0.02 0.00 -1.36 0.00 0.00 55.97 54.37 2k89 s LYS 80 Cb -0.06 -0.68 0.15 0.00 -1.68 0.00 0.00 37.83 35.55 2k89 s LYS 80 CO 0.27 0.17 0.38 -1.17 -0.76 0.00 0.00 175.35 174.23 2k89 s LEU 81 N -1.03 5.08 0.09 3.17 0.20 0.12 -4.89 118.68 121.41 2k89 s LEU 81 Ca -0.01 -2.78 -0.31 0.00 0.69 0.00 0.00 54.13 51.72 2k89 s LEU 81 Cb -0.07 -1.81 -0.08 0.00 -0.43 0.00 0.00 46.19 43.80 2k89 s LEU 81 CO 0.01 -0.36 1.44 -2.84 -0.29 0.00 0.00 176.35 174.30 2k89 s PRO 82 N 0.04 4.29 -0.06 0.98 0.02 -1.26 -0.30 135.00 138.71 2k89 s PRO 82 Ca 0.16 2.10 0.02 0.00 0.02 0.00 0.00 61.00 63.30 2k89 s PRO 82 Cb -0.21 -3.36 0.02 0.00 0.02 0.00 0.00 34.50 30.96 2k89 s PRO 82 CO -0.03 -0.52 -0.09 -0.47 -0.33 0.00 0.00 177.00 175.56 2k89 s TYR 83 N 1.60 1.18 -0.10 6.54 5.04 -0.43 -4.92 117.35 126.27 2k89 s TYR 83 Ca 0.66 -0.42 -0.02 0.00 -2.44 0.00 0.00 57.07 54.86 2k89 s TYR 83 Cb -0.36 -0.92 -0.03 0.00 0.35 0.00 0.00 41.96 40.99 2k89 s TYR 83 CO 0.30 -0.25 -0.04 0.54 -1.34 0.00 0.00 175.55 174.76 2k89 s ASN 84 N 0.81 4.88 0.01 4.32 2.20 -1.26 -0.88 114.94 125.02 2k89 s ASN 84 Ca -0.12 -0.00 0.09 0.00 -0.94 0.00 0.00 52.86 51.89 2k89 s ASN 84 Cb -0.15 -1.47 0.40 0.00 -2.00 0.00 0.00 41.25 38.03 2k89 s ASN 84 CO 0.02 0.30 1.30 0.35 -2.94 0.00 0.00 177.10 176.13 2k89 n THR 85 N 2.63 1.38 0.83 0.54 -2.24 -1.26 -0.98 114.28 115.18 2k89 n THR 85 Ca -0.18 0.35 0.13 0.00 -2.27 0.00 0.00 64.05 62.08 2k89 n THR 85 Cb 0.53 -1.21 0.41 0.00 -2.10 0.00 0.00 70.33 67.96 2k89 n THR 85 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2k89 n SER 86 N -1.53 0.43 -4.99 3.42 2.88 -1.26 -4.90 113.62 107.68 2k89 n SER 86 Ca 0.02 0.30 -0.19 0.00 -1.33 0.00 0.00 58.87 57.67 2k89 n SER 86 Cb 0.10 -0.30 -0.00 0.00 -0.75 0.00 0.00 64.21 63.26 2k89 n SER 86 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2k89 s ASP 87 N -3.61 5.97 0.12 -3.46 2.15 -0.15 -5.10 116.67 112.60 2k89 s ASP 87 Ca 0.11 -0.18 -0.17 0.00 0.43 0.00 0.00 52.55 52.74 2k89 s ASP 87 Cb 0.16 -1.24 -0.07 0.00 -0.30 0.00 0.00 42.92 41.47 2k89 s ASP 87 CO 0.62 -0.43 0.57 -1.81 -0.17 0.00 0.00 175.17 173.94 2k89 s ASP 88 N -4.17 6.95 0.26 -0.34 1.01 -1.26 -4.94 116.67 114.17 2k89 s ASP 88 Ca 0.45 1.18 -0.03 0.00 0.71 0.00 0.00 52.55 54.86 2k89 s ASP 88 Cb -0.10 -2.33 0.33 0.00 1.01 0.00 0.00 42.92 41.83 2k89 s ASP 88 CO 0.31 0.17 1.83 -0.65 0.21 0.00 0.00 175.17 177.05 2k89 h PRO 89 N 3.98 0.99 0.00 8.23 0.11 -1.93 0.35 132.00 143.73 2k89 h PRO 89 Ca -0.49 -0.17 -0.12 0.00 0.11 0.00 0.00 66.00 65.33 2k89 h PRO 89 Cb 1.20 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 2k89 h PRO 89 CO 0.65 0.82 -0.57 0.11 -0.21 0.00 0.00 178.00 178.79 2k89 h TRP 90 N 0.97 0.00 -0.05 0.65 5.08 -1.91 0.14 115.95 120.83 2k89 h TRP 90 Ca 0.22 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 60.11 2k89 h TRP 90 Cb 0.21 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.37 2k89 h TRP 90 CO 0.02 0.57 -0.28 -0.07 -1.28 0.00 0.00 178.44 177.40 2k89 h LEU 91 N 0.00 0.34 -0.06 0.11 3.38 -1.64 -1.22 115.31 116.22 2k89 h LEU 91 Ca -0.01 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 57.30 2k89 h LEU 91 Cb 1.03 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.67 2k89 h LEU 91 CO 0.07 0.95 0.04 0.74 0.09 0.00 0.00 178.44 180.33 2k89 h THR 92 N -0.25 1.03 -0.72 0.22 2.02 -0.26 0.10 112.91 115.06 2k89 h THR 92 Ca -0.02 -0.08 -0.07 0.00 0.77 0.00 0.00 66.41 67.01 2k89 h THR 92 Cb 0.94 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 68.31 2k89 h THR 92 CO 0.06 0.03 0.19 0.00 0.37 0.00 0.00 175.52 176.17 2k89 h ALA 93 N 1.00 0.98 -0.50 6.16 0.00 -0.81 -2.34 119.26 123.74 2k89 h ALA 93 Ca 0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 2k89 h ALA 93 Cb 0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2k89 h ALA 93 CO -0.00 0.66 0.17 -0.92 0.00 0.00 0.00 179.25 179.17 2k89 h TYR 94 N 1.08 0.78 -0.42 0.00 5.03 -0.94 0.18 116.97 122.68 2k89 h TYR 94 Ca 0.23 -0.07 0.00 0.00 2.58 0.00 0.00 58.73 61.47 2k89 h TYR 94 Cb 0.35 -0.23 -0.02 0.00 1.55 0.00 0.00 36.73 38.38 2k89 h TYR 94 CO 0.03 0.67 0.27 -0.97 -1.32 0.00 0.00 178.16 176.84 2k89 h ASN 95 N 0.67 0.49 -0.58 -2.11 -1.24 -0.74 0.18 115.58 112.25 2k89 h ASN 95 Ca 0.16 -0.03 -0.09 0.00 0.71 0.00 0.00 56.30 57.05 2k89 h ASN 95 Cb 0.24 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 39.14 2k89 h ASN 95 CO -0.01 0.37 0.00 0.15 -1.29 0.00 0.00 177.43 176.66 2k89 h PHE 96 N 0.56 1.12 -0.25 0.67 3.57 -1.24 -0.14 116.94 121.24 2k89 h PHE 96 Ca 0.15 -0.19 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 2k89 h PHE 96 Cb -0.04 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.39 2k89 h PHE 96 CO -0.04 0.99 0.15 1.25 -2.23 0.00 0.00 178.31 178.43 2k89 h LEU 97 N 0.95 0.31 -0.56 0.59 5.85 0.04 0.57 115.31 123.05 2k89 h LEU 97 Ca 0.17 -0.06 -0.15 0.00 0.84 0.00 0.00 57.88 58.69 2k89 h LEU 97 Cb 0.54 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 2k89 h LEU 97 CO 0.03 0.28 -0.43 0.06 -0.34 0.00 0.00 178.44 178.04 2k89 h GLN 98 N 0.31 0.67 -0.33 1.25 3.07 -0.60 0.69 115.11 120.17 2k89 h GLN 98 Ca 0.09 -0.36 -0.01 0.00 0.09 0.00 0.00 58.65 58.46 2k89 h GLN 98 Cb 0.03 0.02 -0.01 0.00 0.08 0.00 0.00 27.48 27.59 2k89 h GLN 98 CO -0.02 0.97 0.15 -0.22 0.09 0.00 0.00 178.83 179.80 2k89 h LYS 99 N 0.55 0.48 -0.00 0.06 3.64 -0.68 -2.69 116.57 117.92 2k89 h LYS 99 Ca 0.04 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2k89 h LYS 99 Cb 0.96 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.70 2k89 h LYS 99 CO 0.09 0.46 -0.40 -1.71 -2.27 0.00 0.00 179.45 175.61 2k89 n ASN 100 N -4.74 0.83 -2.67 4.20 4.05 0.16 -4.95 115.26 112.15 2k89 n ASN 100 Ca -0.01 -0.63 -0.14 0.00 0.45 0.00 0.00 54.58 54.25 2k89 n ASN 100 Cb 0.12 0.23 0.06 0.00 1.23 0.00 0.00 39.78 41.42 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 -1.04 -3.14 -4.89 1.20 2.03 0.38 -5.03 116.55 106.06 2k89 n ASP 101 Ca 0.09 -0.41 -0.29 0.00 0.52 0.00 0.00 54.79 54.70 2k89 n ASP 101 Cb 0.35 -3.68 0.01 0.00 -0.72 0.00 0.00 41.12 37.07 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 -5.15 3.41 0.27 -2.67 2.01 0.21 -4.99 118.68 111.77 2k89 s LEU 102 Ca 0.15 1.10 -0.29 0.00 0.01 0.00 0.00 54.13 55.09 2k89 s LEU 102 Cb -0.07 -4.07 -0.09 0.00 0.01 0.00 0.00 46.19 41.97 2k89 s LEU 102 CO 0.51 -0.76 1.19 0.21 1.01 0.00 0.00 176.35 178.50 2k89 s ASN 103 N -4.16 7.07 0.16 2.29 3.04 -1.26 -4.69 114.94 117.38 2k89 s ASN 103 Ca 0.51 2.39 0.09 0.00 0.04 0.00 0.00 52.86 55.89 2k89 s ASN 103 Cb -0.11 -2.63 0.50 0.00 -1.54 0.00 0.00 41.25 37.48 2k89 s ASN 103 CO 0.49 -0.32 1.23 -2.65 -3.04 0.00 0.00 177.10 172.81 2k89 n PRO 104 N 1.43 0.06 0.28 0.43 -0.02 -1.26 -0.24 135.00 135.67 2k89 n PRO 104 Ca 0.01 0.52 0.14 0.00 -2.02 0.00 0.00 63.50 62.16 2k89 n PRO 104 Cb 0.44 -1.78 0.81 0.00 -0.02 0.00 0.00 33.50 32.95 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 1.85 -2.04 -2.40 114.93 111.82 2k89 h MET 105 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 2k89 h MET 105 Cb 0.15 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.18 2k89 h MET 105 CO 0.00 0.08 -0.62 0.74 -0.40 0.00 0.00 176.91 176.70 2k89 h PHE 106 N 0.00 0.00 -0.60 1.39 0.04 -0.99 -3.35 116.94 113.42 2k89 h PHE 106 Ca -0.00 0.00 0.09 0.00 2.80 0.00 0.00 57.97 60.86 2k89 h PHE 106 Cb 0.24 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.32 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 0.21 -0.73 1.54 5.85 -1.55 -1.03 115.31 119.60 2k89 h LEU 107 Ca 0.00 0.08 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 2k89 h LEU 107 Cb 0.97 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 2k89 h LEU 107 CO 0.00 0.12 0.05 -0.78 -0.34 0.00 0.00 178.44 177.49 2k89 h ASP 108 N 0.39 0.99 -0.01 1.25 3.58 -1.73 0.05 116.42 120.95 2k89 h ASP 108 Ca 0.31 -0.25 -0.00 0.00 0.42 0.00 0.00 57.03 57.50 2k89 h ASP 108 Cb 0.38 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.17 2k89 h ASP 108 CO -0.31 1.01 0.00 -0.61 -2.88 0.00 0.00 179.24 176.46 2k89 h GLN 109 N 0.95 0.02 -0.18 0.28 4.15 -1.42 -0.35 115.11 118.55 2k89 h GLN 109 Ca 0.18 -0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.52 2k89 h GLN 109 Cb 0.48 -0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.17 2k89 h GLN 109 CO 0.02 0.19 -0.19 -0.39 -1.93 0.00 0.00 178.83 176.52 2k89 h VAL 110 N -0.15 1.34 -0.57 2.39 -1.51 -1.22 -2.85 116.25 113.67 2k89 h VAL 110 Ca 0.00 -1.37 -0.05 0.00 -1.23 0.00 0.00 66.70 64.06 2k89 h VAL 110 Cb 0.17 1.82 -0.03 0.00 -2.13 0.00 0.00 31.29 31.13 2k89 h VAL 110 CO -0.00 0.41 0.16 0.00 -1.23 0.00 0.00 177.57 176.91 2k89 h ALA 111 N 0.63 1.20 -0.43 5.19 0.00 -0.97 -0.43 119.26 124.44 2k89 h ALA 111 Ca 0.03 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 2k89 h ALA 111 Cb 0.74 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2k89 h ALA 111 CO 0.05 0.55 0.17 0.87 0.00 0.00 0.00 179.25 180.89 2k89 h LYS 112 N 0.84 0.65 -0.78 0.00 6.56 -1.04 0.35 116.57 123.15 2k89 h LYS 112 Ca 0.19 -0.12 -0.01 0.00 -1.06 0.00 0.00 60.65 59.65 2k89 h LYS 112 Cb 0.27 -0.11 -0.04 0.00 -0.57 0.00 0.00 32.23 31.79 2k89 h LYS 112 CO -0.01 0.60 0.46 0.35 -2.06 0.00 0.00 179.45 178.80 2k89 h PHE 113 N 0.56 1.04 -0.55 -1.35 3.04 -1.22 0.14 116.94 118.60 2k89 h PHE 113 Ca 0.14 -0.01 0.04 0.00 3.98 0.00 0.00 57.97 62.12 2k89 h PHE 113 Cb 0.19 -0.34 -0.04 0.00 2.56 0.00 0.00 35.95 38.32 2k89 h PHE 113 CO 0.00 0.70 0.31 0.82 -2.02 0.00 0.00 178.31 178.13 2k89 h ILE 114 N 1.07 1.02 -0.36 1.41 2.04 -0.54 -2.04 117.51 120.10 2k89 h ILE 114 Ca 0.28 -0.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.93 2k89 h ILE 114 Cb -0.03 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 2k89 h ILE 114 CO -0.05 0.11 0.21 0.40 0.00 0.00 0.00 178.15 178.82 2k89 h ILE 115 N 0.61 1.13 -0.93 -0.67 2.04 0.44 -2.21 117.51 117.91 2k89 h ILE 115 Ca 0.23 -0.30 0.19 0.00 1.00 0.00 0.00 64.86 65.98 2k89 h ILE 115 Cb 0.08 0.68 -0.08 0.00 -0.74 0.00 0.00 36.82 36.76 2k89 h ILE 115 CO -0.13 0.13 0.60 0.44 0.00 0.00 0.00 178.15 179.19 2k89 h ASP 116 N 0.46 0.57 0.26 1.72 3.32 -0.31 0.50 116.42 122.94 2k89 h ASP 116 Ca 0.13 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.21 2k89 h ASP 116 Cb 0.02 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.52 2k89 h ASP 116 CO -0.02 0.24 -0.12 -1.13 -1.72 0.00 0.00 179.24 176.48 2k89 h ASN 117 N 0.57 0.00 0.00 6.45 -1.24 -0.73 -1.91 115.58 118.72 2k89 h ASN 117 Ca 0.50 0.00 -0.18 0.00 0.71 0.00 0.00 56.30 57.33 2k89 h ASN 117 Cb 1.00 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 40.01 2k89 h ASN 117 CO -0.24 0.12 -1.68 0.35 -1.29 0.00 0.00 177.43 174.70 2k89 n THR 118 N -3.88 0.68 0.09 -3.57 -2.24 0.05 -4.68 114.28 100.73 2k89 n THR 118 Ca -0.02 -0.35 -0.14 0.00 -2.27 0.00 0.00 64.05 61.27 2k89 n THR 118 Cb 0.22 -0.83 -0.11 0.00 -2.10 0.00 0.00 70.33 67.51 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 0.00 0.25 0.00 -0.78 2.10 -0.15 -3.48 116.57 114.51 2k89 h LYS 119 Ca -0.27 -0.38 0.00 0.00 -2.00 0.00 0.00 60.65 58.00 2k89 h LYS 119 Cb 1.52 0.13 0.00 0.00 -0.90 0.00 0.00 32.23 32.99 2k89 h LYS 119 CO -0.01 1.15 0.00 0.41 -2.00 0.00 0.00 179.45 179.00 2k89 n GLY 120 N 1.36 2.46 0.13 0.07 0.00 -0.78 -2.99 105.19 105.43 2k89 n GLY 120 Ca -0.07 0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 0.32 -0.74 1.61 7.50 -1.59 -2.91 115.11 119.30 2k89 h GLN 121 Ca 0.00 -0.22 0.03 0.00 0.50 0.00 0.00 58.65 58.96 2k89 h GLN 121 Cb 0.00 0.03 -0.04 0.00 0.05 0.00 0.00 27.48 27.52 2k89 h GLN 121 CO 0.00 0.83 0.49 1.98 -1.50 0.00 0.00 178.83 180.63 2k89 h MET 122 N -0.15 0.90 0.00 1.46 4.05 -1.98 -3.44 114.93 115.78 2k89 h MET 122 Ca -0.00 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.36 2k89 h MET 122 Cb 0.84 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 31.44 2k89 h MET 122 CO 0.05 0.60 0.00 -0.11 0.23 0.00 0.00 176.91 177.68 2k89 n LEU 123 N -4.45 0.00 0.00 3.39 -0.00 -1.17 -5.15 117.00 109.62 2k89 n LEU 123 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.10 2k89 n LEU 123 Cb 0.10 0.06 0.00 0.00 -0.00 0.00 0.00 43.42 43.58 2k89 n LEU 123 CO 0.35 -0.06 0.00 0.61 -0.00 0.00 0.00 177.39 178.29 2k89 n GLY 124 N -0.94 -0.97 3.46 -3.96 0.00 -1.11 -4.74 105.19 96.94 2k89 n GLY 124 Ca 0.00 -0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 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 0.00 -0.54 -2.21 0.99 4.77 -1.16 -4.28 117.00 114.57 2k89 n LEU 125 Ca 0.00 0.02 -0.15 0.00 -0.03 0.00 0.00 56.01 55.84 2k89 n LEU 125 Cb 0.00 -1.23 -0.14 0.00 -2.33 0.00 0.00 43.42 39.71 2k89 n LEU 125 CO 0.00 -3.07 1.82 0.61 -1.33 0.00 0.00 177.39 175.42 2k89 n GLY 126 N 1.14 3.08 3.34 -0.72 0.00 -1.26 -4.70 105.19 106.07 2k89 n GLY 126 Ca 0.05 -1.19 -0.09 0.00 0.00 0.00 0.00 46.02 44.78 2k89 n GLY 126 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k89 s ASN 127 N 2.09 -0.57 0.00 1.61 4.22 -1.26 -5.27 114.94 115.75 2k89 s ASN 127 Ca 0.64 1.02 0.29 0.00 -2.14 0.00 0.00 52.86 52.68 2k89 s ASN 127 Cb 0.28 0.97 1.33 0.00 1.28 0.00 0.00 41.25 45.11 2k89 s ASN 127 CO -0.01 -0.21 1.90 -0.81 -2.04 0.00 0.00 177.10 175.94