#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8b n ASN 50 N 0.00 4.83 -1.30 0.00 4.13 -1.26 -4.61 115.26 117.06 2k8b n ASN 50 Ca 0.00 -3.01 -0.08 0.00 1.68 0.00 0.00 54.58 53.17 2k8b n ASN 50 Cb 0.00 -1.56 0.15 0.00 -1.54 0.00 0.00 39.78 36.83 2k8b n ASN 50 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k8b n GLN 51 N 5.09 2.24 -2.67 3.52 10.64 -1.26 -4.89 117.38 130.06 2k8b n GLN 51 Ca 0.43 -3.47 -0.43 0.00 -1.83 0.00 0.00 57.00 51.70 2k8b n GLN 51 Cb 0.39 -1.91 0.00 0.00 -0.86 0.00 0.00 30.24 27.87 2k8b n GLN 51 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 2k8b n GLN 52 N -1.01 3.52 -1.80 2.61 3.00 -1.26 -4.89 117.38 117.54 2k8b n GLN 52 Ca 0.34 -3.73 -0.39 0.00 -0.01 0.00 0.00 57.00 53.21 2k8b n GLN 52 Cb 0.90 -2.97 0.02 0.00 0.00 0.00 0.00 30.24 28.20 2k8b n GLN 52 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 2k8b s THR 53 N 0.85 2.08 0.19 5.09 -4.23 -1.26 -4.93 115.64 113.44 2k8b s THR 53 Ca 0.41 0.07 -0.06 0.00 -1.18 0.00 0.00 61.69 60.93 2k8b s THR 53 Cb 0.03 -3.04 -0.00 0.00 1.34 0.00 0.00 72.50 70.83 2k8b s THR 53 CO 0.00 0.01 1.56 0.77 -0.54 0.00 0.00 174.62 176.43 2k8b h SER 54 N 2.14 0.81 -2.29 3.99 4.64 -1.98 -3.32 113.55 117.54 2k8b h SER 54 Ca -0.51 -0.34 -0.79 0.00 -0.47 0.00 0.00 61.79 59.68 2k8b h SER 54 Cb 1.27 -0.22 -0.24 0.00 -0.31 0.00 0.00 62.40 62.90 2k8b h SER 54 CO 0.60 1.07 1.25 0.61 -0.87 0.00 0.00 176.83 179.49 2k8b n GLY 55 N -0.04 5.31 3.57 -0.77 0.00 -1.26 -4.97 105.19 107.03 2k8b n GLY 55 Ca -0.01 -2.47 -0.41 0.00 0.00 0.00 0.00 46.02 43.12 2k8b n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8b s LYS 56 N -2.32 3.18 0.09 1.61 -0.14 -1.25 -4.78 119.74 116.14 2k8b s LYS 56 Ca 0.37 0.53 -0.30 0.00 -1.36 0.00 0.00 55.97 55.20 2k8b s LYS 56 Cb 0.10 -4.18 -0.06 0.00 -1.68 0.00 0.00 37.83 32.01 2k8b s LYS 56 CO 0.02 -2.08 1.17 0.08 -0.76 0.00 0.00 175.35 173.78 2k8b s VAL 57 N 6.63 4.01 -0.23 3.17 1.01 -0.03 -4.71 120.40 130.26 2k8b s VAL 57 Ca 0.56 1.50 -0.13 0.00 0.00 0.00 0.00 61.98 63.92 2k8b s VAL 57 Cb -0.12 -3.96 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 2k8b s VAL 57 CO 0.24 0.15 0.25 -0.22 0.00 0.00 0.00 175.10 175.52 2k8b s LEU 58 N 0.74 4.12 -0.04 3.92 2.96 -1.26 -1.02 118.68 128.10 2k8b s LEU 58 Ca 0.56 0.25 0.05 0.00 -0.22 0.00 0.00 54.13 54.78 2k8b s LEU 58 Cb -0.29 -2.26 -0.01 0.00 0.50 0.00 0.00 46.19 44.13 2k8b s LEU 58 CO 0.31 0.00 -0.21 -0.72 -1.32 0.00 0.00 176.35 174.41 2k8b s TYR 59 N 1.21 2.00 0.00 5.38 1.13 -0.41 -4.97 117.35 121.68 2k8b s TYR 59 Ca 0.12 -0.54 0.00 0.00 -1.41 0.00 0.00 57.07 55.24 2k8b s TYR 59 Cb -0.14 -1.32 0.00 0.00 -1.10 0.00 0.00 41.96 39.40 2k8b s TYR 59 CO 0.06 -0.16 0.00 0.39 -2.51 0.00 0.00 175.55 173.34 2k8b n GLU 60 N 2.96 0.00 -0.59 -3.49 -0.58 -1.26 -0.80 120.64 116.88 2k8b n GLU 60 Ca -0.17 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.57 2k8b n GLU 60 Cb 0.53 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.40 2k8b n GLU 60 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k8b n GLY 61 N 0.00 0.60 2.91 0.62 0.00 -1.26 -5.08 105.19 102.99 2k8b n GLY 61 Ca 0.00 -0.07 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 2k8b n GLY 61 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k8b s LYS 62 N 0.00 0.47 -0.09 1.61 2.20 0.02 -5.14 119.74 118.81 2k8b s LYS 62 Ca 0.03 -0.11 -0.15 0.00 -0.36 0.00 0.00 55.97 55.38 2k8b s LYS 62 Cb 0.03 -0.51 -0.05 0.00 -1.51 0.00 0.00 37.83 35.80 2k8b s LYS 62 CO -0.01 0.02 0.36 -1.83 -0.36 0.00 0.00 175.35 173.53 2k8b s GLU 63 N 0.34 4.08 0.34 4.03 -1.05 -1.26 -1.29 118.70 123.89 2k8b s GLU 63 Ca -0.04 0.27 0.06 0.00 -0.15 0.00 0.00 54.97 55.11 2k8b s GLU 63 Cb -0.07 -3.33 -0.03 0.00 -0.44 0.00 0.00 34.13 30.26 2k8b s GLU 63 CO -0.00 0.43 0.23 -0.06 0.95 0.00 0.00 175.26 176.80 2k8b s PHE 64 N -0.20 1.72 0.00 4.83 0.40 -0.19 -4.98 117.98 119.57 2k8b s PHE 64 Ca 0.21 -1.54 0.00 0.00 -0.60 0.00 0.00 56.93 55.00 2k8b s PHE 64 Cb -0.15 -0.83 0.00 0.00 0.51 0.00 0.00 43.02 42.56 2k8b s PHE 64 CO 0.09 -0.69 0.75 -0.25 0.70 0.00 0.00 175.22 175.81 2k8b n ASP 65 N -1.38 0.00 -3.78 1.36 9.92 -1.23 -0.85 116.55 120.60 2k8b n ASP 65 Ca 0.03 0.80 -0.20 0.00 -0.53 0.00 0.00 54.79 54.89 2k8b n ASP 65 Cb 0.63 -0.36 -0.17 0.00 -0.64 0.00 0.00 41.12 40.58 2k8b n ASP 65 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 2k8b s TYR 66 N -2.23 0.46 -0.37 1.24 2.02 -0.74 -3.09 117.35 114.64 2k8b s TYR 66 Ca 0.00 -0.04 -0.11 0.00 -0.37 0.00 0.00 57.07 56.55 2k8b s TYR 66 Cb 0.00 -0.62 0.03 0.00 -0.40 0.00 0.00 41.96 40.97 2k8b s TYR 66 CO 0.00 -0.23 0.20 0.14 -1.57 0.00 0.00 175.55 174.09 2k8b s VAL 67 N 1.64 4.55 0.21 0.71 -7.23 -1.26 -0.46 120.40 118.57 2k8b s VAL 67 Ca -0.01 -0.86 -0.30 0.00 -1.81 0.00 0.00 61.98 59.01 2k8b s VAL 67 Cb -0.13 -3.54 -0.08 0.00 0.56 0.00 0.00 36.38 33.19 2k8b s VAL 67 CO -0.03 -0.23 0.98 -0.36 -0.31 0.00 0.00 175.10 175.16 2k8b s PHE 68 N 1.55 3.85 -0.22 2.82 0.08 -0.13 -4.74 117.98 121.19 2k8b s PHE 68 Ca 0.02 1.83 -0.25 0.00 0.12 0.00 0.00 56.93 58.64 2k8b s PHE 68 Cb -0.19 -3.07 -0.01 0.00 -0.57 0.00 0.00 43.02 39.18 2k8b s PHE 68 CO 0.07 0.15 0.85 -1.12 -0.10 0.00 0.00 175.22 175.07 2k8b s SER 69 N -0.75 6.90 -0.05 1.36 0.01 -1.26 -1.02 113.70 118.89 2k8b s SER 69 Ca 0.44 1.12 0.07 0.00 1.31 0.00 0.00 55.95 58.88 2k8b s SER 69 Cb -0.27 -2.45 -0.01 0.00 0.21 0.00 0.00 66.02 63.50 2k8b s SER 69 CO 0.33 -0.50 -0.25 -0.63 0.41 0.00 0.00 173.24 172.60 2k8b s ILE 70 N 2.68 2.07 0.08 1.44 1.01 0.76 -5.00 121.20 124.24 2k8b s ILE 70 Ca 0.37 -1.08 0.07 0.00 0.00 0.00 0.00 60.65 60.01 2k8b s ILE 70 Cb -0.16 -1.73 -0.04 0.00 0.01 0.00 0.00 42.46 40.54 2k8b s ILE 70 CO 0.09 0.57 -0.13 1.51 0.00 0.00 0.00 174.94 176.98 2k8b s ASP 71 N -0.31 4.17 -0.21 3.58 1.47 -1.26 -1.16 116.67 122.94 2k8b s ASP 71 Ca 0.01 -0.41 -0.01 0.00 1.18 0.00 0.00 52.55 53.32 2k8b s ASP 71 Cb -0.13 -0.74 -0.20 0.00 -0.34 0.00 0.00 42.92 41.51 2k8b s ASP 71 CO 0.02 0.20 -0.02 0.55 0.68 0.00 0.00 175.17 176.61 2k8b n VAL 72 N 0.98 1.59 0.00 2.11 3.14 -1.26 -5.00 118.33 119.89 2k8b n VAL 72 Ca -0.15 -0.61 0.00 0.00 -2.96 0.00 0.00 64.34 60.63 2k8b n VAL 72 Cb 0.52 -1.51 0.00 0.00 -1.06 0.00 0.00 33.84 31.80 2k8b n VAL 72 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2k8b n ASN 73 N -3.32 0.00 -4.78 6.55 4.05 -1.26 -5.15 115.26 111.35 2k8b n ASN 73 Ca -0.41 0.00 -0.27 0.00 0.45 0.00 0.00 54.58 54.35 2k8b n ASN 73 Cb 1.01 0.00 0.10 0.00 1.23 0.00 0.00 39.78 42.12 2k8b n ASN 73 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 2k8b s GLU 74 N 0.00 1.85 0.00 1.20 2.02 -1.26 -4.99 118.70 117.52 2k8b s GLU 74 Ca 0.00 -0.20 0.27 0.00 0.02 0.00 0.00 54.97 55.06 2k8b s GLU 74 Cb 0.00 -2.05 0.85 0.00 0.10 0.00 0.00 34.13 33.03 2k8b s GLU 74 CO 0.00 -1.56 1.64 0.41 0.02 0.00 0.00 175.26 175.77 2k8b n GLY 75 N -3.19 -1.15 3.19 -1.39 0.00 -1.26 -4.82 105.19 96.57 2k8b n GLY 75 Ca 0.09 -0.29 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 2k8b n GLY 75 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2k8b s GLY 76 N -2.82 -0.24 0.60 -0.02 0.00 -1.26 -4.55 107.32 99.02 2k8b s GLY 76 Ca 0.17 1.19 -0.07 0.00 0.00 0.00 0.00 44.72 46.01 2k8b s GLY 76 CO 0.59 1.30 0.82 -1.55 0.00 0.00 0.00 173.10 174.26 2k8b n PRO 77 N 3.86 -0.53 -4.43 2.90 -0.05 -1.26 -5.08 135.00 130.41 2k8b n PRO 77 Ca -0.21 -1.54 -0.29 0.00 -0.05 0.00 0.00 63.50 61.41 2k8b n PRO 77 Cb 0.55 -0.76 -0.13 0.00 -0.05 0.00 0.00 33.50 33.11 2k8b n PRO 77 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 175.50 174.33 2k8b s SER 78 N -4.09 3.38 0.06 3.54 0.01 -1.26 -4.76 113.70 110.58 2k8b s SER 78 Ca 0.49 -0.71 0.04 0.00 1.31 0.00 0.00 55.95 57.08 2k8b s SER 78 Cb -0.02 -0.27 -0.04 0.00 0.21 0.00 0.00 66.02 65.90 2k8b s SER 78 CO 0.34 0.19 -0.01 -0.31 0.41 0.00 0.00 173.24 173.86 2k8b s TYR 79 N -1.05 3.00 -0.14 2.43 2.02 -0.31 -4.98 117.35 118.31 2k8b s TYR 79 Ca 0.14 -0.01 -0.01 0.00 -0.37 0.00 0.00 57.07 56.83 2k8b s TYR 79 Cb -0.10 -1.57 0.04 0.00 -0.40 0.00 0.00 41.96 39.92 2k8b s TYR 79 CO 0.06 0.47 -0.06 0.15 -1.57 0.00 0.00 175.55 174.60 2k8b s LYS 80 N -2.06 1.40 -0.36 -0.62 -0.14 -1.26 -0.17 119.74 116.53 2k8b s LYS 80 Ca 0.24 -0.39 -0.16 0.00 -1.36 0.00 0.00 55.97 54.30 2k8b s LYS 80 Cb -0.12 -1.81 -0.00 0.00 -1.68 0.00 0.00 37.83 34.22 2k8b s LYS 80 CO 0.16 -0.37 0.41 -1.17 -0.76 0.00 0.00 175.35 173.61 2k8b s LEU 81 N 1.68 4.50 -0.72 3.17 0.20 -0.19 -4.87 118.68 122.46 2k8b s LEU 81 Ca 0.02 -0.27 -0.27 0.00 0.69 0.00 0.00 54.13 54.30 2k8b s LEU 81 Cb -0.14 -2.40 0.03 0.00 -0.43 0.00 0.00 46.19 43.25 2k8b s LEU 81 CO -0.08 -0.41 1.24 -2.16 -0.29 0.00 0.00 176.35 174.64 2k8b s PRO 82 N 2.12 3.21 -0.00 0.98 0.04 -1.26 -0.95 135.00 139.13 2k8b s PRO 82 Ca 0.13 -0.26 -0.06 0.00 0.04 0.00 0.00 61.00 60.85 2k8b s PRO 82 Cb -0.16 -4.17 -0.05 0.00 0.04 0.00 0.00 34.50 30.16 2k8b s PRO 82 CO 0.12 -2.07 0.24 -0.47 0.04 0.00 0.00 177.00 174.86 2k8b s TYR 83 N 5.48 3.57 0.01 0.56 5.04 0.40 -4.96 117.35 127.45 2k8b s TYR 83 Ca 0.34 0.52 0.02 0.00 -2.44 0.00 0.00 57.07 55.51 2k8b s TYR 83 Cb -0.09 -1.95 -0.04 0.00 0.35 0.00 0.00 41.96 40.24 2k8b s TYR 83 CO 0.15 0.63 -0.01 1.21 -1.34 0.00 0.00 175.55 176.19 2k8b s ASN 84 N -1.73 5.03 0.21 4.32 3.84 -1.26 -1.80 114.94 123.55 2k8b s ASN 84 Ca 0.27 -0.05 -0.09 0.00 0.21 0.00 0.00 52.86 53.19 2k8b s ASN 84 Cb -0.13 -1.28 0.27 0.00 -0.55 0.00 0.00 41.25 39.56 2k8b s ASN 84 CO 0.16 0.27 1.76 0.71 -2.79 0.00 0.00 177.10 177.21 2k8b h THR 85 N 3.48 0.83 -2.18 -5.21 1.35 -1.97 -2.98 112.91 106.23 2k8b h THR 85 Ca -0.49 -0.16 -0.76 0.00 -0.55 0.00 0.00 66.41 64.45 2k8b h THR 85 Cb 1.17 0.30 -0.30 0.00 -1.73 0.00 0.00 68.15 67.60 2k8b h THR 85 CO 0.57 0.09 0.71 -1.20 -0.25 0.00 0.00 175.52 175.44 2k8b n SER 86 N -4.94 6.85 -4.09 5.36 7.64 -1.26 -4.98 113.62 118.20 2k8b n SER 86 Ca 0.09 -3.72 -0.08 0.00 1.01 0.00 0.00 58.87 56.17 2k8b n SER 86 Cb 0.25 -1.03 -0.10 0.00 -1.01 0.00 0.00 64.21 62.32 2k8b n SER 86 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k8b s ASP 87 N -1.71 0.56 -0.07 6.43 2.15 -1.13 -5.13 116.67 117.76 2k8b s ASP 87 Ca 0.43 -0.97 -0.26 0.00 0.43 0.00 0.00 52.55 52.18 2k8b s ASP 87 Cb 0.26 0.18 -0.03 0.00 -0.30 0.00 0.00 42.92 43.03 2k8b s ASP 87 CO -0.19 -0.57 0.81 -0.62 -0.17 0.00 0.00 175.17 174.43 2k8b s ASP 88 N -2.86 7.09 0.35 -0.34 -1.08 -1.26 -4.93 116.67 113.64 2k8b s ASP 88 Ca 0.06 1.32 0.10 0.00 -0.52 0.00 0.00 52.55 53.51 2k8b s ASP 88 Cb 0.07 -2.47 0.84 0.00 -1.46 0.00 0.00 42.92 39.91 2k8b s ASP 88 CO -0.09 -0.22 1.82 1.55 0.52 0.00 0.00 175.17 178.75 2k8b h PRO 89 N 6.90 0.64 -0.08 4.34 0.13 -1.94 -0.30 132.00 141.70 2k8b h PRO 89 Ca -0.38 -0.04 -0.22 0.00 -0.87 0.00 0.00 66.00 64.49 2k8b h PRO 89 Cb 1.19 -0.15 0.01 0.00 0.13 0.00 0.00 31.00 32.18 2k8b h PRO 89 CO 0.77 0.43 -0.83 -1.49 -0.23 0.00 0.00 178.00 176.65 2k8b h TRP 90 N 0.66 0.82 -0.04 1.56 6.55 -1.93 -2.21 115.95 121.37 2k8b h TRP 90 Ca 0.51 -0.39 -0.01 0.00 0.95 0.00 0.00 58.89 59.95 2k8b h TRP 90 Cb 0.92 -0.12 -0.00 0.00 -0.86 0.00 0.00 29.16 29.10 2k8b h TRP 90 CO -0.00 1.20 -0.02 -0.07 -1.05 0.00 0.00 178.44 178.50 2k8b h LEU 91 N 0.38 0.09 -1.17 -4.49 3.38 -1.64 -1.42 115.31 110.44 2k8b h LEU 91 Ca -0.06 -0.41 -0.06 0.00 0.09 0.00 0.00 57.88 57.44 2k8b h LEU 91 Cb 1.45 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 42.16 2k8b h LEU 91 CO 0.16 0.47 -0.05 0.74 0.09 0.00 0.00 178.44 179.85 2k8b h THR 92 N -0.30 1.21 -0.34 0.22 2.02 -1.19 0.12 112.91 114.66 2k8b h THR 92 Ca 0.01 -0.88 -0.04 0.00 0.77 0.00 0.00 66.41 66.27 2k8b h THR 92 Cb 0.44 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 2k8b h THR 92 CO 0.01 0.29 0.04 0.00 0.37 0.00 0.00 175.52 176.23 2k8b h ALA 93 N 1.47 0.45 -0.06 6.16 0.00 -1.32 -2.49 119.26 123.47 2k8b h ALA 93 Ca 0.10 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2k8b h ALA 93 Cb 0.39 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2k8b h ALA 93 CO 0.02 0.17 -0.34 -0.92 0.00 0.00 0.00 179.25 178.17 2k8b h TYR 94 N 0.40 0.13 0.15 0.00 3.20 -0.88 -0.75 116.97 119.22 2k8b h TYR 94 Ca 0.10 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 2k8b h TYR 94 Cb 0.38 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.61 2k8b h TYR 94 CO 0.03 0.45 -0.10 -0.97 -1.64 0.00 0.00 178.16 175.92 2k8b h ASN 95 N 0.10 -0.26 0.38 -2.11 -0.73 -0.64 0.08 115.58 112.40 2k8b h ASN 95 Ca 0.01 0.02 -0.13 0.00 1.87 0.00 0.00 56.30 58.07 2k8b h ASN 95 Cb 0.66 0.08 -0.01 0.00 0.27 0.00 0.00 38.32 39.32 2k8b h ASN 95 CO 0.05 -0.17 -0.56 0.15 -0.37 0.00 0.00 177.43 176.54 2k8b h PHE 96 N -0.25 0.24 -0.29 0.67 3.57 -1.31 -1.87 116.94 117.69 2k8b h PHE 96 Ca -0.01 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.41 2k8b h PHE 96 Cb 0.22 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2k8b h PHE 96 CO -0.09 0.70 0.19 1.25 -2.23 0.00 0.00 178.31 178.13 2k8b h LEU 97 N 0.15 0.33 -0.21 0.59 5.85 -0.70 -2.10 115.31 119.21 2k8b h LEU 97 Ca -0.00 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 2k8b h LEU 97 Cb 1.02 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.97 2k8b h LEU 97 CO 0.08 0.24 -0.14 0.06 -0.34 0.00 0.00 178.44 178.34 2k8b h GLN 98 N 0.39 0.00 -0.36 1.25 3.07 -0.95 0.15 115.11 118.66 2k8b h GLN 98 Ca 0.11 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.81 2k8b h GLN 98 Cb -0.04 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.50 2k8b h GLN 98 CO -0.02 0.14 0.07 -0.22 0.09 0.00 0.00 178.83 178.89 2k8b h LYS 99 N 0.00 0.59 -0.25 0.06 3.11 -0.73 -3.13 116.57 116.22 2k8b h LYS 99 Ca -0.00 -0.15 0.00 0.00 -2.81 0.00 0.00 60.65 57.69 2k8b h LYS 99 Cb 1.03 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 32.19 2k8b h LYS 99 CO 0.02 0.65 0.00 0.09 -2.81 0.00 0.00 179.45 177.39 2k8b n ASN 100 N -4.58 2.81 -3.25 4.20 4.13 -0.85 -5.01 115.26 112.71 2k8b n ASN 100 Ca -0.01 -1.83 -0.08 0.00 1.68 0.00 0.00 54.58 54.34 2k8b n ASN 100 Cb 0.21 -0.16 0.01 0.00 -1.54 0.00 0.00 39.78 38.30 2k8b n ASN 100 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2k8b n ASP 101 N 0.93 -7.01 -4.90 6.41 9.92 -0.14 -5.02 116.55 116.74 2k8b n ASP 101 Ca 0.13 -0.35 -0.21 0.00 -0.53 0.00 0.00 54.79 53.83 2k8b n ASP 101 Cb 0.45 -4.51 -0.03 0.00 -0.64 0.00 0.00 41.12 36.39 2k8b n ASP 101 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2k8b s LEU 102 N -4.45 3.83 0.29 0.64 2.01 0.34 -5.02 118.68 116.32 2k8b s LEU 102 Ca 0.07 -0.30 -0.29 0.00 0.01 0.00 0.00 54.13 53.62 2k8b s LEU 102 Cb -0.02 -2.46 -0.10 0.00 0.01 0.00 0.00 46.19 43.63 2k8b s LEU 102 CO 0.78 -0.27 1.10 0.21 1.01 0.00 0.00 176.35 179.18 2k8b s ASN 103 N -4.01 7.21 0.61 2.29 3.84 -1.26 -4.85 114.94 118.77 2k8b s ASN 103 Ca 0.39 2.28 0.27 0.00 0.21 0.00 0.00 52.86 56.01 2k8b s ASN 103 Cb -0.08 -2.63 1.31 0.00 -0.55 0.00 0.00 41.25 39.31 2k8b s ASN 103 CO 0.28 -0.18 1.73 -0.65 -2.79 0.00 0.00 177.10 175.48 2k8b h PRO 104 N 3.71 0.00 -0.54 0.43 0.11 -1.98 0.24 132.00 133.97 2k8b h PRO 104 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2k8b h PRO 104 Cb 1.21 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 2k8b h PRO 104 CO 0.67 0.00 0.26 1.98 -0.21 0.00 0.00 178.00 180.69 2k8b h MET 105 N 0.00 0.75 -0.08 1.05 1.85 -2.02 -1.61 114.93 114.87 2k8b h MET 105 Ca 0.24 -0.09 -0.11 0.00 -0.61 0.00 0.00 59.70 59.13 2k8b h MET 105 Cb 1.54 -0.15 -0.01 0.00 0.43 0.00 0.00 31.60 33.41 2k8b h MET 105 CO -0.00 0.58 -0.44 0.74 -0.40 0.00 0.00 176.91 177.39 2k8b h PHE 106 N 0.75 0.20 -0.18 1.39 -1.00 -1.32 -2.94 116.94 113.85 2k8b h PHE 106 Ca 0.19 -0.06 0.04 0.00 2.81 0.00 0.00 57.97 60.95 2k8b h PHE 106 Cb 0.08 -0.04 -0.04 0.00 3.61 0.00 0.00 35.95 39.56 2k8b h PHE 106 CO 0.01 0.59 -0.06 1.25 -1.61 0.00 0.00 178.31 178.49 2k8b h LEU 107 N 0.14 -0.21 -0.55 1.54 5.85 -1.34 0.96 115.31 121.71 2k8b h LEU 107 Ca 0.01 0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 2k8b h LEU 107 Cb 0.84 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 2k8b h LEU 107 CO 0.07 -0.08 -0.00 -0.78 -0.34 0.00 0.00 178.44 177.30 2k8b h ASP 108 N -0.02 0.95 0.09 1.25 3.58 -1.48 -0.97 116.42 119.82 2k8b h ASP 108 Ca 0.09 -0.31 -0.00 0.00 0.42 0.00 0.00 57.03 57.23 2k8b h ASP 108 Cb 0.16 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 40.95 2k8b h ASP 108 CO -0.20 1.03 -0.04 -0.61 -2.88 0.00 0.00 179.24 176.54 2k8b h GLN 109 N 0.85 -0.11 -0.17 0.28 4.15 -1.27 -1.88 115.11 116.96 2k8b h GLN 109 Ca 0.16 0.01 -0.12 0.00 0.77 0.00 0.00 58.65 59.46 2k8b h GLN 109 Cb 0.54 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.25 2k8b h GLN 109 CO 0.03 -0.00 -0.41 -0.39 -1.93 0.00 0.00 178.83 176.13 2k8b h VAL 110 N -0.20 1.31 -0.67 2.39 -1.51 -0.81 -2.92 116.25 113.84 2k8b h VAL 110 Ca -0.01 -1.55 -0.04 0.00 -1.23 0.00 0.00 66.70 63.87 2k8b h VAL 110 Cb 0.16 1.63 -0.03 0.00 -2.13 0.00 0.00 31.29 30.92 2k8b h VAL 110 CO 0.02 0.47 0.28 0.00 -1.23 0.00 0.00 177.57 177.11 2k8b h ALA 111 N 1.25 1.22 -0.77 5.19 0.00 -1.01 -2.06 119.26 123.08 2k8b h ALA 111 Ca 0.03 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.81 2k8b h ALA 111 Cb 0.86 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 2k8b h ALA 111 CO 0.07 0.57 0.48 0.87 0.00 0.00 0.00 179.25 181.25 2k8b h LYS 112 N 0.97 0.89 -0.36 0.00 1.79 -1.14 0.14 116.57 118.86 2k8b h LYS 112 Ca 0.23 -0.05 -0.15 0.00 -2.18 0.00 0.00 60.65 58.50 2k8b h LYS 112 Cb 0.17 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 30.62 2k8b h LYS 112 CO -0.02 0.59 -0.35 0.35 -1.08 0.00 0.00 179.45 178.94 2k8b h PHE 113 N 0.92 1.05 -0.77 -1.35 3.57 -1.48 -2.57 116.94 116.31 2k8b h PHE 113 Ca 0.32 -0.31 -0.05 0.00 3.53 0.00 0.00 57.97 61.46 2k8b h PHE 113 Cb 0.07 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 2k8b h PHE 113 CO -0.04 1.12 0.29 0.82 -2.23 0.00 0.00 178.31 178.27 2k8b h ILE 114 N 0.68 1.26 -0.94 1.41 2.04 -0.82 -2.44 117.51 118.71 2k8b h ILE 114 Ca 0.06 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 2k8b h ILE 114 Cb 0.94 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 2k8b h ILE 114 CO 0.09 0.34 0.55 0.40 0.00 0.00 0.00 178.15 179.52 2k8b h ILE 115 N 1.12 1.26 0.00 -0.67 2.04 -0.63 -1.78 117.51 118.86 2k8b h ILE 115 Ca 0.26 -0.60 -0.04 0.00 1.00 0.00 0.00 64.86 65.48 2k8b h ILE 115 Cb 0.23 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 2k8b h ILE 115 CO -0.02 0.28 -0.19 -0.78 0.00 0.00 0.00 178.15 177.44 2k8b h ASP 116 N 1.30 0.00 -0.04 1.72 1.82 -1.03 0.22 116.42 120.41 2k8b h ASP 116 Ca 0.33 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.96 2k8b h ASP 116 Cb -0.03 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 39.98 2k8b h ASP 116 CO -0.06 0.19 -0.01 -1.13 -1.61 0.00 0.00 179.24 176.62 2k8b h ASN 117 N 0.00 0.08 0.01 2.28 -1.24 -1.03 0.58 115.58 116.26 2k8b h ASN 117 Ca -0.00 -0.39 -0.16 0.00 0.71 0.00 0.00 56.30 56.46 2k8b h ASN 117 Cb 0.37 -0.02 -0.01 0.00 0.73 0.00 0.00 38.32 39.40 2k8b h ASN 117 CO 0.02 0.45 -0.56 0.74 -1.29 0.00 0.00 177.43 176.79 2k8b h THR 118 N -0.30 1.32 -0.26 -3.57 2.02 -1.19 -3.08 112.91 107.86 2k8b h THR 118 Ca 0.01 -1.81 -0.17 0.00 0.77 0.00 0.00 66.41 65.21 2k8b h THR 118 Cb 0.41 1.78 -0.00 0.00 -1.74 0.00 0.00 68.15 68.60 2k8b h THR 118 CO 0.00 0.56 -0.51 0.50 0.37 0.00 0.00 175.52 176.45 2k8b h LYS 119 N 0.44 0.74 -1.84 6.66 3.64 -0.56 -3.45 116.57 122.20 2k8b h LYS 119 Ca 0.01 -0.45 -0.08 0.00 -1.27 0.00 0.00 60.65 58.86 2k8b h LYS 119 Cb 1.11 0.04 0.02 0.00 -0.41 0.00 0.00 32.23 33.00 2k8b h LYS 119 CO 0.11 1.07 -0.13 0.41 -2.27 0.00 0.00 179.45 178.63 2k8b n GLY 120 N 0.25 0.61 0.11 5.01 0.00 0.20 -4.24 105.19 107.14 2k8b n GLY 120 Ca -0.03 -0.51 -0.12 0.00 0.00 0.00 0.00 46.02 45.35 2k8b n GLY 120 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2k8b h GLN 121 N -0.49 -0.15 -0.87 1.61 4.15 -1.86 0.35 115.11 117.85 2k8b h GLN 121 Ca -0.11 0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.27 2k8b h GLN 121 Cb 1.07 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.77 2k8b h GLN 121 CO 0.11 0.30 0.06 0.00 -1.93 0.00 0.00 178.83 177.38 2k8b n MET 122 N -4.92 2.35 0.04 1.69 0.00 -1.26 -4.18 117.12 110.83 2k8b n MET 122 Ca -0.08 -1.28 0.00 0.00 0.00 0.00 0.00 57.70 56.34 2k8b n MET 122 Cb 0.26 -1.74 0.00 0.00 0.00 0.00 0.00 33.22 31.75 2k8b n MET 122 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 2k8b n LEU 123 N 0.16 0.64 0.00 3.17 7.94 -1.11 -5.07 117.00 122.72 2k8b n LEU 123 Ca 0.14 0.12 0.00 0.00 -1.11 0.00 0.00 56.01 55.17 2k8b n LEU 123 Cb 0.72 -0.17 0.00 0.00 0.53 0.00 0.00 43.42 44.50 2k8b n LEU 123 CO 0.16 -0.68 0.00 0.61 -1.11 0.00 0.00 177.39 176.38 2k8b n GLY 124 N 3.27 0.00 7.00 -3.96 0.00 0.28 -5.10 105.19 106.68 2k8b n GLY 124 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2k8b n GLY 124 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k8b n LEU 125 N 0.00 0.00 -0.05 0.99 4.77 0.96 -4.98 117.00 118.69 2k8b n LEU 125 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2k8b n LEU 125 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2k8b n LEU 125 CO 0.00 -0.13 0.00 0.61 -1.33 0.00 0.00 177.39 176.54 2k8b n GLY 126 N 0.00 0.86 0.11 -0.72 0.00 -1.26 -4.85 105.19 99.33 2k8b n GLY 126 Ca 0.00 -0.05 -0.21 0.00 0.00 0.00 0.00 46.02 45.76 2k8b n GLY 126 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2k8b h ASN 127 N 0.00 0.05 0.00 1.61 4.21 -1.87 -3.52 115.58 116.07 2k8b h ASN 127 Ca 0.00 -0.60 0.00 0.00 1.21 0.00 0.00 56.30 56.91 2k8b h ASN 127 Cb 0.08 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 37.27 2k8b h ASN 127 CO 0.00 1.49 0.00 -2.65 -1.29 0.00 0.00 177.43 174.98