#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 -2.72 -4.91 0.00 2.85 -1.26 -5.00 115.26 104.22 2k89 n ASN 50 Ca 0.00 -0.61 -0.28 0.00 -0.11 0.00 0.00 54.58 53.58 2k89 n ASN 50 Cb 0.00 -4.99 -0.03 0.00 1.24 0.00 0.00 39.78 36.01 2k89 n ASN 50 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 2k89 s GLN 51 N -5.17 3.59 -1.34 1.20 -0.21 -1.26 -4.99 119.66 111.49 2k89 s GLN 51 Ca 0.07 -0.10 -0.06 0.00 0.02 0.00 0.00 55.36 55.29 2k89 s GLN 51 Cb -0.01 -2.68 0.11 0.00 1.00 0.00 0.00 33.01 31.43 2k89 s GLN 51 CO 0.71 0.24 2.40 0.94 -2.12 0.00 0.00 175.29 177.46 2k89 n GLN 52 N -0.99 4.55 -0.11 2.91 7.27 -1.26 -4.66 117.38 125.09 2k89 n GLN 52 Ca -0.03 -3.41 -0.10 0.00 0.07 0.00 0.00 57.00 53.54 2k89 n GLN 52 Cb 0.54 -2.64 -0.02 0.00 2.41 0.00 0.00 30.24 30.53 2k89 n GLN 52 CO 0.00 0.00 0.00 1.15 0.07 0.00 0.00 177.06 178.28 2k89 h THR 53 N 2.63 1.20 -3.44 1.69 2.02 -2.03 -3.41 112.91 111.56 2k89 h THR 53 Ca 0.71 -0.64 -0.54 0.00 0.77 0.00 0.00 66.41 66.71 2k89 h THR 53 Cb 0.30 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 2k89 h THR 53 CO 1.49 0.22 0.26 -0.44 0.37 0.00 0.00 175.52 177.43 2k89 s SER 54 N -5.84 7.28 -0.45 4.18 0.01 -1.26 -4.97 113.70 112.66 2k89 s SER 54 Ca -0.13 1.54 -0.26 0.00 1.31 0.00 0.00 55.95 58.41 2k89 s SER 54 Cb 0.09 -2.52 -0.07 0.00 0.21 0.00 0.00 66.02 63.74 2k89 s SER 54 CO 0.75 -0.12 2.38 -0.83 0.41 0.00 0.00 173.24 175.82 2k89 s GLY 55 N 0.47 -0.30 0.29 3.44 0.00 -1.26 -4.89 107.32 105.07 2k89 s GLY 55 Ca 0.45 0.13 -0.29 0.00 0.00 0.00 0.00 44.72 45.00 2k89 s GLY 55 CO 0.25 4.09 1.39 0.54 0.00 0.00 0.00 173.10 179.37 2k89 s LYS 56 N 7.97 4.29 -0.22 2.90 -0.14 -1.26 -4.73 119.74 128.55 2k89 s LYS 56 Ca 0.98 2.28 -0.14 0.00 -1.36 0.00 0.00 55.97 57.72 2k89 s LYS 56 Cb -0.19 -3.09 -0.04 0.00 -1.68 0.00 0.00 37.83 32.83 2k89 s LYS 56 CO 0.27 -0.34 0.34 0.08 -0.76 0.00 0.00 175.35 174.94 2k89 s VAL 57 N -0.49 5.23 -0.41 3.17 1.01 0.35 -4.84 120.40 124.42 2k89 s VAL 57 Ca 0.55 0.56 -0.19 0.00 0.00 0.00 0.00 61.98 62.90 2k89 s VAL 57 Cb -0.41 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.31 2k89 s VAL 57 CO 0.48 0.25 0.55 -0.22 0.00 0.00 0.00 175.10 176.16 2k89 s LEU 58 N 1.41 4.56 -0.19 3.92 2.96 -1.26 -0.82 118.68 129.26 2k89 s LEU 58 Ca 0.16 -0.34 -0.02 0.00 -0.22 0.00 0.00 54.13 53.70 2k89 s LEU 58 Cb -0.15 -2.59 -0.00 0.00 0.50 0.00 0.00 46.19 43.96 2k89 s LEU 58 CO 0.08 -0.63 -0.10 -0.72 -1.32 0.00 0.00 176.35 173.65 2k89 s TYR 59 N 2.50 2.88 0.00 5.38 1.13 0.64 -4.72 117.35 125.16 2k89 s TYR 59 Ca 0.18 -1.10 0.00 0.00 -1.41 0.00 0.00 57.07 54.75 2k89 s TYR 59 Cb -0.15 -2.01 0.00 0.00 -1.10 0.00 0.00 41.96 38.69 2k89 s TYR 59 CO 0.16 -0.57 0.00 0.39 -2.51 0.00 0.00 175.55 173.01 2k89 n GLU 60 N 4.55 0.00 0.00 -3.49 -0.58 -1.26 -1.02 120.64 118.84 2k89 n GLU 60 Ca -0.19 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.55 2k89 n GLU 60 Cb 0.51 -2.15 0.00 0.00 -0.57 0.00 0.00 31.44 29.22 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 -0.75 -0.46 3.62 0.62 0.00 -1.26 -5.15 105.19 101.81 2k89 n GLY 61 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 2.27 -0.12 1.61 2.20 -0.19 -5.10 119.74 120.41 2k89 s LYS 62 Ca 0.00 -1.01 -0.03 0.00 -0.36 0.00 0.00 55.97 54.56 2k89 s LYS 62 Cb 0.00 -2.36 -0.03 0.00 -1.51 0.00 0.00 37.83 33.93 2k89 s LYS 62 CO 0.00 0.50 0.00 -1.21 -0.36 0.00 0.00 175.35 174.28 2k89 s GLU 63 N -2.42 3.34 0.18 4.03 2.02 -1.26 -0.26 118.70 124.33 2k89 s GLU 63 Ca 0.24 -0.42 -0.02 0.00 0.02 0.00 0.00 54.97 54.79 2k89 s GLU 63 Cb -0.11 -2.90 -0.04 0.00 0.10 0.00 0.00 34.13 31.19 2k89 s GLU 63 CO 0.16 0.51 0.13 -0.06 0.02 0.00 0.00 175.26 176.02 2k89 s PHE 64 N -0.34 1.00 0.02 1.61 0.08 0.00 -4.92 117.98 115.44 2k89 s PHE 64 Ca 0.07 -1.28 -0.15 0.00 0.12 0.00 0.00 56.93 55.69 2k89 s PHE 64 Cb -0.12 -0.48 -0.08 0.00 -0.57 0.00 0.00 43.02 41.77 2k89 s PHE 64 CO 0.02 -0.62 1.22 -0.44 -0.10 0.00 0.00 175.22 175.30 2k89 h ASP 65 N 2.68 -0.47 -3.24 1.36 5.19 -1.76 1.01 116.42 121.20 2k89 h ASP 65 Ca -0.35 0.02 -0.36 0.00 -0.62 0.00 0.00 57.03 55.72 2k89 h ASP 65 Cb 1.23 0.13 -0.39 0.00 0.18 0.00 0.00 39.33 40.48 2k89 h ASP 65 CO 0.54 -0.31 -0.72 -0.31 -3.12 0.00 0.00 179.24 175.32 2k89 s TYR 66 N -4.15 0.02 0.03 4.55 2.02 0.25 -3.48 117.35 116.60 2k89 s TYR 66 Ca -0.08 0.28 0.02 0.00 -0.37 0.00 0.00 57.07 56.92 2k89 s TYR 66 Cb 0.01 -0.46 -0.04 0.00 -0.40 0.00 0.00 41.96 41.08 2k89 s TYR 66 CO 0.23 -0.24 0.05 0.14 -1.57 0.00 0.00 175.55 174.17 2k89 s VAL 67 N 2.19 4.43 0.21 0.71 -7.23 -1.26 -1.01 120.40 118.45 2k89 s VAL 67 Ca 0.04 -0.64 -0.02 0.00 -1.81 0.00 0.00 61.98 59.56 2k89 s VAL 67 Cb -0.12 -3.06 -0.05 0.00 0.56 0.00 0.00 36.38 33.71 2k89 s VAL 67 CO -0.04 0.26 0.42 0.12 -0.31 0.00 0.00 175.10 175.55 2k89 s PHE 68 N -1.24 3.48 -0.29 2.82 5.36 0.66 -4.81 117.98 123.97 2k89 s PHE 68 Ca 0.24 0.43 -0.10 0.00 -0.96 0.00 0.00 56.93 56.54 2k89 s PHE 68 Cb -0.12 -1.92 -0.03 0.00 -0.34 0.00 0.00 43.02 40.61 2k89 s PHE 68 CO 0.16 0.35 0.17 0.45 -1.46 0.00 0.00 175.22 174.88 2k89 s SER 69 N -3.06 5.76 -0.25 6.13 0.15 -1.26 0.02 113.70 121.18 2k89 s SER 69 Ca 0.40 -0.21 -0.03 0.00 0.70 0.00 0.00 55.95 56.80 2k89 s SER 69 Cb -0.11 -2.06 0.01 0.00 -1.71 0.00 0.00 66.02 62.15 2k89 s SER 69 CO 0.29 -0.10 -0.03 -0.63 1.20 0.00 0.00 173.24 173.97 2k89 s ILE 70 N 1.70 3.26 -0.29 6.45 1.01 0.14 -4.98 121.20 128.49 2k89 s ILE 70 Ca 0.06 -0.78 -0.10 0.00 0.00 0.00 0.00 60.65 59.83 2k89 s ILE 70 Cb -0.16 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.67 2k89 s ILE 70 CO 0.09 0.25 0.17 -1.81 0.00 0.00 0.00 174.94 173.64 2k89 s ASP 71 N 1.41 5.82 -0.16 3.58 1.01 -1.26 -0.32 116.67 126.75 2k89 s ASP 71 Ca 0.03 -0.15 -0.05 0.00 0.71 0.00 0.00 52.55 53.08 2k89 s ASP 71 Cb -0.16 -2.07 -0.24 0.00 1.01 0.00 0.00 42.92 41.46 2k89 s ASP 71 CO -0.03 -0.09 0.21 0.52 0.21 0.00 0.00 175.17 176.00 2k89 n VAL 72 N 5.03 1.71 -3.89 -1.27 0.31 -1.26 -4.79 118.33 114.17 2k89 n VAL 72 Ca -0.14 -0.61 -0.28 0.00 -0.01 0.00 0.00 64.34 63.29 2k89 n VAL 72 Cb 0.51 -1.67 -0.16 0.00 -0.91 0.00 0.00 33.84 31.61 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 -6.92 2.81 0.06 4.52 3.84 -1.26 -5.05 114.94 112.94 2k89 s ASN 73 Ca -0.26 -0.65 -0.31 0.00 0.21 0.00 0.00 52.86 51.85 2k89 s ASN 73 Cb 0.07 -0.90 -0.08 0.00 -0.55 0.00 0.00 41.25 39.79 2k89 s ASN 73 CO 0.72 -0.19 1.69 -1.61 -2.79 0.00 0.00 177.10 174.93 2k89 s GLU 74 N 1.64 4.18 0.00 0.43 2.02 -1.26 -1.44 118.70 124.28 2k89 s GLU 74 Ca 0.01 2.37 0.00 0.00 0.02 0.00 0.00 54.97 57.37 2k89 s GLU 74 Cb -0.15 -3.66 0.00 0.00 0.10 0.00 0.00 34.13 30.42 2k89 s GLU 74 CO -0.08 -0.77 0.00 0.41 0.02 0.00 0.00 175.26 174.84 2k89 n GLY 75 N 4.07 3.17 0.00 -1.39 0.00 -1.26 -4.99 105.19 104.79 2k89 n GLY 75 Ca 0.16 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 0.00 1.86 3.93 -0.02 0.00 -0.52 -4.81 105.19 105.64 2k89 n GLY 76 Ca 0.00 0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.77 2.93 -0.21 1.61 0.04 -1.25 -4.46 135.00 132.89 2k89 s PRO 77 Ca 0.00 -0.21 -0.05 0.00 0.04 0.00 0.00 61.00 60.77 2k89 s PRO 77 Cb 0.00 -2.38 -0.02 0.00 0.04 0.00 0.00 34.50 32.14 2k89 s PRO 77 CO 0.00 -0.57 0.01 -1.12 0.04 0.00 0.00 177.00 175.36 2k89 s SER 78 N -4.29 4.88 0.30 6.66 0.01 -1.26 -4.14 113.70 115.87 2k89 s SER 78 Ca 0.52 -0.20 0.08 0.00 1.31 0.00 0.00 55.95 57.66 2k89 s SER 78 Cb -0.10 -1.84 -0.03 0.00 0.21 0.00 0.00 66.02 64.25 2k89 s SER 78 CO 0.42 0.04 0.21 -0.31 0.41 0.00 0.00 173.24 174.02 2k89 s TYR 79 N 1.13 2.92 0.02 2.43 2.02 0.56 -4.96 117.35 121.46 2k89 s TYR 79 Ca 0.03 -0.25 0.02 0.00 -0.37 0.00 0.00 57.07 56.50 2k89 s TYR 79 Cb -0.14 -1.60 -0.01 0.00 -0.40 0.00 0.00 41.96 39.80 2k89 s TYR 79 CO 0.02 0.35 -0.07 0.15 -1.57 0.00 0.00 175.55 174.43 2k89 s LYS 80 N -3.90 0.50 -0.41 -0.62 -0.14 -1.26 0.28 119.74 114.20 2k89 s LYS 80 Ca 0.37 -0.49 0.02 0.00 -1.36 0.00 0.00 55.97 54.51 2k89 s LYS 80 Cb -0.06 -0.38 0.11 0.00 -1.68 0.00 0.00 37.83 35.82 2k89 s LYS 80 CO 0.25 0.09 0.15 -1.17 -0.76 0.00 0.00 175.35 173.91 2k89 s LEU 81 N -0.88 4.80 0.07 3.17 0.20 0.10 -4.88 118.68 121.26 2k89 s LEU 81 Ca -0.04 -2.36 -0.31 0.00 0.69 0.00 0.00 54.13 52.11 2k89 s LEU 81 Cb -0.06 -1.69 -0.07 0.00 -0.43 0.00 0.00 46.19 43.95 2k89 s LEU 81 CO 0.00 -0.38 1.35 -2.84 -0.29 0.00 0.00 176.35 174.19 2k89 s PRO 82 N 0.63 4.34 -0.04 0.98 0.02 -1.26 -0.24 135.00 139.42 2k89 s PRO 82 Ca 0.12 1.97 0.02 0.00 0.02 0.00 0.00 61.00 63.13 2k89 s PRO 82 Cb -0.21 -3.36 0.01 0.00 0.02 0.00 0.00 34.50 30.96 2k89 s PRO 82 CO -0.05 -0.43 -0.07 -0.47 -0.33 0.00 0.00 177.00 175.64 2k89 s TYR 83 N 1.44 0.94 -0.16 6.54 5.04 -0.18 -4.91 117.35 126.06 2k89 s TYR 83 Ca 0.63 -0.28 -0.05 0.00 -2.44 0.00 0.00 57.07 54.93 2k89 s TYR 83 Cb -0.34 -0.74 -0.03 0.00 0.35 0.00 0.00 41.96 41.20 2k89 s TYR 83 CO 0.29 -0.18 -0.00 0.54 -1.34 0.00 0.00 175.55 174.86 2k89 s ASN 84 N 0.62 5.11 0.17 4.32 4.22 -1.26 -0.58 114.94 127.53 2k89 s ASN 84 Ca -0.10 -0.04 0.16 0.00 -2.14 0.00 0.00 52.86 50.74 2k89 s ASN 84 Cb -0.13 -1.83 0.75 0.00 1.28 0.00 0.00 41.25 41.32 2k89 s ASN 84 CO 0.01 0.18 1.49 0.35 -2.04 0.00 0.00 177.10 177.09 2k89 n THR 85 N 3.47 1.18 1.48 0.54 -2.24 -1.26 -0.70 114.28 116.74 2k89 n THR 85 Ca -0.17 0.44 0.14 0.00 -2.27 0.00 0.00 64.05 62.19 2k89 n THR 85 Cb 0.52 -1.37 0.62 0.00 -2.10 0.00 0.00 70.33 68.01 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 -1.94 0.59 -3.52 3.42 7.64 -1.26 -4.91 113.62 113.64 2k89 n SER 86 Ca 0.01 -0.78 -0.10 0.00 1.01 0.00 0.00 58.87 59.01 2k89 n SER 86 Cb 0.11 -0.04 0.03 0.00 -1.01 0.00 0.00 64.21 63.31 2k89 n SER 86 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2k89 n ASP 87 N -0.78 1.13 -4.60 6.43 9.92 0.12 -5.12 116.55 123.64 2k89 n ASP 87 Ca 0.16 -1.81 -0.32 0.00 -0.53 0.00 0.00 54.79 52.29 2k89 n ASP 87 Cb 0.27 -0.21 -0.10 0.00 -0.64 0.00 0.00 41.12 40.44 2k89 n ASP 87 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 2k89 s ASP 88 N -2.86 4.67 0.10 -2.24 1.01 -1.26 -5.02 116.67 111.06 2k89 s ASP 88 Ca 0.31 -0.13 -0.32 0.00 0.71 0.00 0.00 52.55 53.11 2k89 s ASP 88 Cb -0.02 -1.10 -0.14 0.00 1.01 0.00 0.00 42.92 42.67 2k89 s ASP 88 CO 0.20 0.28 1.51 1.55 0.21 0.00 0.00 175.17 178.92 2k89 h PRO 89 N 4.51 -0.67 -0.24 8.23 0.13 -1.94 0.53 132.00 142.55 2k89 h PRO 89 Ca -0.48 0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 64.68 2k89 h PRO 89 Cb 1.17 0.15 -0.01 0.00 0.13 0.00 0.00 31.00 32.44 2k89 h PRO 89 CO 0.54 -0.45 0.11 0.11 -0.23 0.00 0.00 178.00 178.08 2k89 h TRP 90 N -0.70 0.32 -0.07 1.56 5.08 -1.89 0.22 115.95 120.47 2k89 h TRP 90 Ca -0.01 -0.00 -0.07 0.00 1.08 0.00 0.00 58.89 59.90 2k89 h TRP 90 Cb 0.70 -0.10 0.00 0.00 -3.00 0.00 0.00 29.16 26.76 2k89 h TRP 90 CO -0.45 0.24 -0.22 -0.07 -1.28 0.00 0.00 178.44 176.66 2k89 h LEU 91 N 0.33 0.31 -0.17 0.11 3.38 -1.84 0.15 115.31 117.57 2k89 h LEU 91 Ca 0.09 -0.62 -0.01 0.00 0.09 0.00 0.00 57.88 57.43 2k89 h LEU 91 Cb 0.04 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2k89 h LEU 91 CO -0.01 0.88 0.08 0.74 0.09 0.00 0.00 178.44 180.21 2k89 h THR 92 N -0.24 1.14 -0.72 0.22 2.02 -0.37 0.26 112.91 115.22 2k89 h THR 92 Ca -0.01 -0.42 -0.02 0.00 0.77 0.00 0.00 66.41 66.73 2k89 h THR 92 Cb 0.85 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 68.33 2k89 h THR 92 CO 0.05 0.13 0.37 0.00 0.37 0.00 0.00 175.52 176.44 2k89 h ALA 93 N 0.93 0.93 -0.65 6.16 0.00 -0.64 -1.95 119.26 124.03 2k89 h ALA 93 Ca 0.06 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 2k89 h ALA 93 Cb 0.14 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2k89 h ALA 93 CO -0.01 0.47 0.07 -0.92 0.00 0.00 0.00 179.25 178.87 2k89 h TYR 94 N 1.00 1.18 -0.38 0.00 5.03 -0.72 0.13 116.97 123.21 2k89 h TYR 94 Ca 0.25 -0.18 0.02 0.00 2.58 0.00 0.00 58.73 61.41 2k89 h TYR 94 Cb 0.08 -0.32 -0.03 0.00 1.55 0.00 0.00 36.73 38.01 2k89 h TYR 94 CO 0.00 1.00 0.21 -0.91 -1.32 0.00 0.00 178.16 177.15 2k89 h ASN 95 N 1.02 0.33 -0.34 -2.11 2.35 -0.50 0.20 115.58 116.54 2k89 h ASN 95 Ca 0.20 0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.81 2k89 h ASN 95 Cb 0.48 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 2k89 h ASN 95 CO 0.02 0.24 -0.34 0.15 -1.65 0.00 0.00 177.43 175.85 2k89 h PHE 96 N 0.43 1.04 -0.32 1.19 3.57 -1.13 0.74 116.94 122.46 2k89 h PHE 96 Ca 0.16 -0.29 0.00 0.00 3.53 0.00 0.00 57.97 61.37 2k89 h PHE 96 Cb 0.03 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.53 2k89 h PHE 96 CO -0.08 1.10 0.21 1.25 -2.23 0.00 0.00 178.31 178.55 2k89 h LEU 97 N 0.73 0.36 -0.60 0.59 5.85 -0.26 0.16 115.31 122.13 2k89 h LEU 97 Ca 0.07 -0.01 -0.14 0.00 0.84 0.00 0.00 57.88 58.64 2k89 h LEU 97 Cb 0.92 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 2k89 h LEU 97 CO 0.08 0.26 -0.44 0.06 -0.34 0.00 0.00 178.44 178.06 2k89 h GLN 98 N 0.42 0.60 -0.58 1.25 3.07 -0.60 0.59 115.11 119.87 2k89 h GLN 98 Ca 0.12 -0.32 -0.02 0.00 0.09 0.00 0.00 58.65 58.52 2k89 h GLN 98 Cb -0.04 0.01 -0.03 0.00 0.08 0.00 0.00 27.48 27.51 2k89 h GLN 98 CO -0.03 0.92 0.30 -0.22 0.09 0.00 0.00 178.83 179.89 2k89 h LYS 99 N 0.49 0.82 -0.01 0.06 3.11 -0.15 -2.75 116.57 118.15 2k89 h LYS 99 Ca 0.03 -0.11 0.00 0.00 -2.81 0.00 0.00 60.65 57.77 2k89 h LYS 99 Cb 0.96 -0.15 0.00 0.00 -1.00 0.00 0.00 32.23 32.03 2k89 h LYS 99 CO 0.09 0.65 -0.70 -1.71 -2.81 0.00 0.00 179.45 174.97 2k89 n ASN 100 N -4.56 1.33 -2.81 4.20 2.85 0.48 -4.98 115.26 111.77 2k89 n ASN 100 Ca 0.04 -1.10 -0.12 0.00 -0.11 0.00 0.00 54.58 53.28 2k89 n ASN 100 Cb 0.10 0.66 0.06 0.00 1.24 0.00 0.00 39.78 41.85 2k89 n ASN 100 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 2k89 n ASP 101 N -0.89 -2.56 -4.65 1.20 2.03 0.42 -5.04 116.55 107.05 2k89 n ASP 101 Ca 0.07 -0.47 -0.27 0.00 0.52 0.00 0.00 54.79 54.63 2k89 n ASP 101 Cb 0.38 -3.95 0.11 0.00 -0.72 0.00 0.00 41.12 36.94 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 -5.17 2.74 0.19 -2.67 2.01 0.18 -5.00 118.68 110.95 2k89 s LEU 102 Ca 0.05 0.37 -0.30 0.00 0.01 0.00 0.00 54.13 54.26 2k89 s LEU 102 Cb -0.01 -2.76 -0.08 0.00 0.01 0.00 0.00 46.19 43.36 2k89 s LEU 102 CO 0.54 -2.04 0.96 0.21 1.01 0.00 0.00 176.35 177.03 2k89 s ASN 103 N -4.67 7.57 0.15 2.29 3.84 -1.26 -4.80 114.94 118.06 2k89 s ASN 103 Ca 0.65 1.90 0.10 0.00 0.21 0.00 0.00 52.86 55.72 2k89 s ASN 103 Cb -0.08 -2.60 0.55 0.00 -0.55 0.00 0.00 41.25 38.57 2k89 s ASN 103 CO 0.48 0.05 1.30 -2.65 -2.79 0.00 0.00 177.10 173.48 2k89 n PRO 104 N 2.04 0.07 0.25 0.43 -0.02 -1.26 -0.58 135.00 135.93 2k89 n PRO 104 Ca -0.00 0.56 0.15 0.00 -2.02 0.00 0.00 63.50 62.18 2k89 n PRO 104 Cb 0.48 -1.74 0.48 0.00 -0.02 0.00 0.00 33.50 32.70 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 -2.94 114.93 113.48 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 0.04 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.84 2k89 h MET 105 CO 0.00 0.01 -0.07 0.74 0.23 0.00 0.00 176.91 177.83 2k89 h PHE 106 N 0.00 0.00 -0.87 1.39 0.04 -1.23 -3.33 116.94 112.95 2k89 h PHE 106 Ca -0.00 0.00 0.12 0.00 2.80 0.00 0.00 57.97 60.89 2k89 h PHE 106 Cb 0.71 0.00 -0.08 0.00 2.20 0.00 0.00 35.95 38.78 2k89 h PHE 106 CO 0.00 0.00 0.49 1.25 -0.60 0.00 0.00 178.31 179.45 2k89 h LEU 107 N 0.00 0.67 -0.30 1.54 5.85 -1.65 -1.40 115.31 120.02 2k89 h LEU 107 Ca 0.00 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 2k89 h LEU 107 Cb 0.95 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 2k89 h LEU 107 CO 0.00 0.34 0.02 -0.78 -0.34 0.00 0.00 178.44 177.68 2k89 h ASP 108 N 0.76 0.51 -0.48 1.25 3.58 -1.78 -1.60 116.42 118.66 2k89 h ASP 108 Ca 0.44 -0.29 -0.06 0.00 0.42 0.00 0.00 57.03 57.54 2k89 h ASP 108 Cb 0.50 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.40 2k89 h ASP 108 CO -0.29 0.67 0.07 0.06 -2.88 0.00 0.00 179.24 176.87 2k89 h GLN 109 N 0.32 0.80 -0.27 0.28 3.07 -1.49 0.69 115.11 118.52 2k89 h GLN 109 Ca 0.09 -0.22 -0.10 0.00 0.09 0.00 0.00 58.65 58.50 2k89 h GLN 109 Cb 0.40 -0.09 -0.00 0.00 0.08 0.00 0.00 27.48 27.87 2k89 h GLN 109 CO 0.01 0.81 -0.24 -0.39 0.09 0.00 0.00 178.83 179.12 2k89 h VAL 110 N 0.67 1.31 -0.62 1.86 -1.51 -1.38 -2.67 116.25 113.92 2k89 h VAL 110 Ca 0.15 -1.40 -0.04 0.00 -1.23 0.00 0.00 66.70 64.17 2k89 h VAL 110 Cb 0.41 1.61 -0.03 0.00 -2.13 0.00 0.00 31.29 31.15 2k89 h VAL 110 CO 0.01 0.44 0.21 0.00 -1.23 0.00 0.00 177.57 177.00 2k89 h ALA 111 N 0.70 1.20 -0.47 5.19 0.00 -1.06 -0.87 119.26 123.95 2k89 h ALA 111 Ca 0.05 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 2k89 h ALA 111 Cb 0.80 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2k89 h ALA 111 CO 0.06 0.57 -0.03 0.87 0.00 0.00 0.00 179.25 180.71 2k89 h LYS 112 N 0.90 0.80 -0.41 0.00 1.79 -0.81 0.18 116.57 119.03 2k89 h LYS 112 Ca 0.21 -0.23 -0.13 0.00 -2.18 0.00 0.00 60.65 58.31 2k89 h LYS 112 Cb 0.24 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 2k89 h LYS 112 CO -0.01 0.83 -0.28 0.35 -1.08 0.00 0.00 179.45 179.25 2k89 h PHE 113 N 0.74 1.01 -0.37 -1.35 3.04 -1.09 0.11 116.94 119.03 2k89 h PHE 113 Ca 0.14 -0.26 0.04 0.00 3.98 0.00 0.00 57.97 61.87 2k89 h PHE 113 Cb 0.50 -0.23 -0.04 0.00 2.56 0.00 0.00 35.95 38.74 2k89 h PHE 113 CO 0.03 1.04 0.13 0.82 -2.02 0.00 0.00 178.31 178.31 2k89 h ILE 114 N 0.74 0.90 -0.01 1.41 2.04 -0.60 -2.12 117.51 119.86 2k89 h ILE 114 Ca 0.09 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 2k89 h ILE 114 Cb 0.83 0.59 -0.00 0.00 -0.74 0.00 0.00 36.82 37.50 2k89 h ILE 114 CO 0.07 0.05 0.01 0.40 0.00 0.00 0.00 178.15 178.68 2k89 h ILE 115 N 0.29 1.04 -0.81 -0.67 2.04 -0.36 -2.98 117.51 116.06 2k89 h ILE 115 Ca 0.17 -0.12 0.11 0.00 1.00 0.00 0.00 64.86 66.02 2k89 h ILE 115 Cb 0.13 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.26 2k89 h ILE 115 CO -0.16 0.03 0.53 -0.78 0.00 0.00 0.00 178.15 177.77 2k89 h ASP 116 N -0.03 0.62 -0.72 1.72 3.58 -0.52 0.58 116.42 121.65 2k89 h ASP 116 Ca 0.00 0.02 0.07 0.00 0.42 0.00 0.00 57.03 57.54 2k89 h ASP 116 Cb 0.05 -0.10 -0.05 0.00 1.72 0.00 0.00 39.33 40.95 2k89 h ASP 116 CO -0.00 0.35 0.48 -1.13 -2.88 0.00 0.00 179.24 176.05 2k89 h ASN 117 N 0.68 0.66 -0.01 2.28 -1.24 -1.23 -2.02 115.58 114.70 2k89 h ASN 117 Ca 0.39 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.40 2k89 h ASN 117 Cb 0.57 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 39.48 2k89 h ASN 117 CO -0.15 0.42 -0.50 0.35 -1.29 0.00 0.00 177.43 176.26 2k89 n THR 118 N -4.48 0.00 -2.96 -3.57 -2.24 0.11 -4.91 114.28 96.22 2k89 n THR 118 Ca 0.11 -0.25 -0.29 0.00 -2.27 0.00 0.00 64.05 61.35 2k89 n THR 118 Cb 0.23 1.16 -0.02 0.00 -2.10 0.00 0.00 70.33 69.60 2k89 n THR 118 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2k89 s LYS 119 N -2.25 3.66 -1.08 -0.78 2.20 0.18 -4.81 119.74 116.86 2k89 s LYS 119 Ca 0.13 0.22 -0.02 0.00 -0.36 0.00 0.00 55.97 55.94 2k89 s LYS 119 Cb 0.14 -2.47 0.26 0.00 -1.51 0.00 0.00 37.83 34.25 2k89 s LYS 119 CO 0.53 0.00 2.03 0.41 -0.36 0.00 0.00 175.35 177.97 2k89 n GLY 120 N -1.47 5.78 0.34 5.54 0.00 -1.26 -3.57 105.19 110.56 2k89 n GLY 120 Ca 0.00 -2.40 -0.08 0.00 0.00 0.00 0.00 46.02 43.55 2k89 n GLY 120 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2k89 n GLN 121 N 0.45 0.39 0.17 1.61 7.27 -1.26 -4.62 117.38 121.39 2k89 n GLN 121 Ca 0.52 0.16 0.03 0.00 0.07 0.00 0.00 57.00 57.78 2k89 n GLN 121 Cb 0.26 -1.19 0.26 0.00 2.41 0.00 0.00 30.24 31.98 2k89 n GLN 121 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2k89 h MET 122 N -0.74 0.00 0.00 3.69 -0.00 -1.87 -3.46 114.93 112.56 2k89 h MET 122 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.66 2k89 h MET 122 Cb 0.79 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.39 2k89 h MET 122 CO -0.02 0.46 0.00 -0.11 -0.00 0.00 0.00 176.91 177.24 2k89 n LEU 123 N -3.56 -0.07 0.00 -0.10 0.00 -1.26 -5.16 117.00 106.85 2k89 n LEU 123 Ca -0.00 0.03 0.00 0.00 0.00 0.00 0.00 56.01 56.03 2k89 n LEU 123 Cb 0.57 0.27 0.00 0.00 0.00 0.00 0.00 43.42 44.26 2k89 n LEU 123 CO 0.39 -0.19 0.00 0.61 0.00 0.00 0.00 177.39 178.19 2k89 n GLY 124 N -1.49 -0.02 3.77 -3.96 0.00 -1.23 -4.62 105.19 97.63 2k89 n GLY 124 Ca 0.00 -0.97 -0.01 0.00 0.00 0.00 0.00 46.02 45.03 2k89 n GLY 124 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2k89 s LEU 125 N 0.00 -0.08 0.00 0.99 2.34 -1.26 -4.96 118.68 115.70 2k89 s LEU 125 Ca 0.00 -0.37 0.00 0.00 0.06 0.00 0.00 54.13 53.82 2k89 s LEU 125 Cb 0.00 1.84 0.00 0.00 -0.56 0.00 0.00 46.19 47.47 2k89 s LEU 125 CO 0.00 -0.69 0.00 0.61 -1.06 0.00 0.00 176.35 175.21 2k89 n GLY 126 N -0.57 0.61 0.81 -3.48 0.00 -1.26 -4.90 105.19 96.40 2k89 n GLY 126 Ca -0.05 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2k89 n GLY 126 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k89 n ASN 127 N -0.52 -5.02 -0.17 1.61 4.13 -1.26 -5.20 115.26 108.83 2k89 n ASN 127 Ca 0.00 0.61 0.15 0.00 1.68 0.00 0.00 54.58 57.02 2k89 n ASN 127 Cb 0.23 -1.78 0.80 0.00 -1.54 0.00 0.00 39.78 37.49 2k89 n ASN 127 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73