#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k78 n ALA 26 N 0.00 0.00 -2.27 -0.43 0.00 -1.26 -4.99 120.51 111.56 2k78 n ALA 26 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 2k78 n ALA 26 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2k78 n ALA 26 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2k78 n ASN 27 N 0.00 -5.12 -3.56 0.00 4.05 -1.26 -4.97 115.26 104.40 2k78 n ASN 27 Ca 0.00 0.02 -0.26 0.00 0.45 0.00 0.00 54.58 54.78 2k78 n ASN 27 Cb 0.00 -4.20 -0.16 0.00 1.23 0.00 0.00 39.78 36.65 2k78 n ASN 27 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2k78 s ALA 28 N -2.86 0.41 0.00 5.20 0.00 -1.26 -4.93 121.76 118.32 2k78 s ALA 28 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.39 2k78 s ALA 28 Cb 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 23.12 21.89 2k78 s ALA 28 CO 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 175.76 174.37 2k78 n ALA 29 N 5.27 0.00 -2.35 0.00 0.00 -1.26 -5.01 120.51 117.16 2k78 n ALA 29 Ca -0.06 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.20 2k78 n ALA 29 Cb 0.46 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.90 2k78 n ALA 29 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2k78 n ASP 30 N -1.16 -5.19 -3.42 0.00 8.00 -1.26 -4.91 116.55 108.60 2k78 n ASP 30 Ca 0.00 0.09 -0.12 0.00 0.71 0.00 0.00 54.79 55.46 2k78 n ASP 30 Cb 0.00 -4.36 -0.02 0.00 -0.02 0.00 0.00 41.12 36.71 2k78 n ASP 30 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2k78 s SER 31 N -2.08 -0.57 0.00 -2.24 0.15 -1.26 -0.88 113.70 106.82 2k78 s SER 31 Ca 0.00 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.67 2k78 s SER 31 Cb 0.00 0.59 0.00 0.00 -1.71 0.00 0.00 66.02 64.90 2k78 s SER 31 CO 0.00 -0.95 0.00 0.61 1.20 0.00 0.00 173.24 174.10 2k78 n GLY 32 N -0.35 0.89 3.59 9.45 0.00 -0.59 -4.96 105.19 113.23 2k78 n GLY 32 Ca -0.17 -1.09 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 2k78 n GLY 32 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2k78 s THR 33 N -2.00 4.80 -0.01 2.61 -4.23 -1.26 0.61 115.64 116.15 2k78 s THR 33 Ca 0.00 0.86 -0.10 0.00 -1.18 0.00 0.00 61.69 61.27 2k78 s THR 33 Cb 0.00 -4.15 -0.05 0.00 1.34 0.00 0.00 72.50 69.64 2k78 s THR 33 CO 0.00 -0.35 0.31 -0.22 -0.54 0.00 0.00 174.62 173.83 2k78 s LEU 34 N 2.94 4.41 0.15 4.79 0.20 0.18 -4.86 118.68 126.49 2k78 s LEU 34 Ca 0.29 0.74 -0.30 0.00 0.69 0.00 0.00 54.13 55.55 2k78 s LEU 34 Cb -0.14 -2.54 -0.07 0.00 -0.43 0.00 0.00 46.19 43.01 2k78 s LEU 34 CO 0.15 0.31 0.99 0.21 -0.29 0.00 0.00 176.35 177.72 2k78 s ASN 35 N -1.30 7.47 0.19 3.68 3.04 -1.08 -2.56 114.94 124.38 2k78 s ASN 35 Ca 0.24 1.89 -0.24 0.00 0.04 0.00 0.00 52.86 54.79 2k78 s ASN 35 Cb -0.14 -2.60 0.06 0.00 -1.54 0.00 0.00 41.25 37.03 2k78 s ASN 35 CO 0.12 -0.06 0.93 -0.72 -3.04 0.00 0.00 177.10 174.34 2k78 s TYR 36 N -0.27 -0.09 0.26 0.43 1.13 -1.26 0.65 117.35 118.20 2k78 s TYR 36 Ca 0.46 -0.26 -0.06 0.00 -1.41 0.00 0.00 57.07 55.79 2k78 s TYR 36 Cb -0.25 0.67 0.03 0.00 -1.10 0.00 0.00 41.96 41.30 2k78 s TYR 36 CO 0.31 -0.93 0.46 -1.91 -2.51 0.00 0.00 175.55 170.97 2k78 n GLU 37 N -0.50 0.66 -3.57 -3.49 2.13 -1.04 -4.89 120.64 109.94 2k78 n GLU 37 Ca -0.05 -1.71 -0.25 0.00 0.66 0.00 0.00 57.16 55.81 2k78 n GLU 37 Cb 0.60 1.90 -0.16 0.00 0.27 0.00 0.00 31.44 34.06 2k78 n GLU 37 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 2k78 s VAL 38 N -2.52 -0.14 0.42 6.31 -7.23 -1.26 -2.26 120.40 113.71 2k78 s VAL 38 Ca 0.15 -0.24 -0.00 0.00 -1.81 0.00 0.00 61.98 60.08 2k78 s VAL 38 Cb -0.02 -0.66 -0.02 0.00 0.56 0.00 0.00 36.38 36.24 2k78 s VAL 38 CO 0.11 -0.33 0.64 -0.31 -0.31 0.00 0.00 175.10 174.90 2k78 s TYR 39 N 2.18 3.34 0.35 2.82 2.02 -1.24 -4.01 117.35 122.80 2k78 s TYR 39 Ca 0.04 0.31 -0.28 0.00 -0.37 0.00 0.00 57.07 56.77 2k78 s TYR 39 Cb -0.16 -2.17 -0.10 0.00 -0.40 0.00 0.00 41.96 39.13 2k78 s TYR 39 CO -0.14 -0.19 1.28 0.21 -1.57 0.00 0.00 175.55 175.14 2k78 s LYS 40 N -4.49 4.28 0.54 -0.62 2.47 -0.79 -1.31 119.74 119.83 2k78 s LYS 40 Ca 0.45 2.15 -0.21 0.00 -1.56 0.00 0.00 55.97 56.80 2k78 s LYS 40 Cb -0.10 -2.99 -0.05 0.00 -1.46 0.00 0.00 37.83 33.23 2k78 s LYS 40 CO 0.38 -0.22 1.25 -0.47 0.16 0.00 0.00 175.35 176.45 2k78 s TYR 41 N -1.19 2.47 0.00 4.03 5.04 -1.26 -1.90 117.35 124.53 2k78 s TYR 41 Ca 0.51 1.47 0.00 0.00 -2.44 0.00 0.00 57.07 56.60 2k78 s TYR 41 Cb -0.38 -3.58 0.00 0.00 0.35 0.00 0.00 41.96 38.35 2k78 s TYR 41 CO 0.50 -2.31 0.00 -1.71 -1.34 0.00 0.00 175.55 170.70 2k78 n ASN 42 N -1.11 -1.32 -0.94 4.32 2.85 -1.26 -4.93 115.26 112.86 2k78 n ASN 42 Ca 0.11 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.58 2k78 n ASN 42 Cb 0.47 -1.35 0.00 0.00 1.24 0.00 0.00 39.78 40.14 2k78 n ASN 42 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2k78 n THR 43 N -2.17 0.00 -0.67 -0.44 -2.24 -0.80 -5.07 114.28 102.90 2k78 n THR 43 Ca 0.00 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.79 2k78 n THR 43 Cb 0.07 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.32 2k78 n THR 43 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2k78 n ASN 44 N -2.27 1.19 -3.88 3.42 5.15 -1.26 -4.68 115.26 112.93 2k78 n ASN 44 Ca 0.00 -1.81 -0.17 0.00 -0.60 0.00 0.00 54.58 51.99 2k78 n ASN 44 Cb 0.00 -0.08 -0.16 0.00 -0.53 0.00 0.00 39.78 39.02 2k78 n ASN 44 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2k78 s ASP 45 N -0.92 0.61 0.34 1.20 2.15 -1.26 -4.86 116.67 113.94 2k78 s ASP 45 Ca 0.04 -0.08 -0.29 0.00 0.43 0.00 0.00 52.55 52.66 2k78 s ASP 45 Cb 0.04 -0.24 -0.11 0.00 -0.30 0.00 0.00 42.92 42.31 2k78 s ASP 45 CO 0.00 -0.03 1.41 0.28 -0.17 0.00 0.00 175.17 176.66 2k78 s THR 46 N 0.62 2.38 0.00 1.71 -1.32 -1.26 -1.89 115.64 115.89 2k78 s THR 46 Ca -0.07 0.37 0.00 0.00 -1.21 0.00 0.00 61.69 60.78 2k78 s THR 46 Cb -0.10 -3.24 0.00 0.00 -1.51 0.00 0.00 72.50 67.65 2k78 s THR 46 CO -0.01 0.09 0.00 -0.24 -2.21 0.00 0.00 174.62 172.25 2k78 n SER 47 N 0.81 2.00 0.00 8.08 2.88 -1.26 -4.77 113.62 121.36 2k78 n SER 47 Ca 0.01 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 2k78 n SER 47 Cb 0.40 0.53 0.00 0.00 -0.75 0.00 0.00 64.21 64.39 2k78 n SER 47 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 2k78 n ILE 48 N -0.73 0.00 0.20 2.46 5.41 -1.26 -4.88 119.36 120.56 2k78 n ILE 48 Ca 0.00 0.00 -0.15 0.00 1.00 0.00 0.00 62.75 63.60 2k78 n ILE 48 Cb 0.00 -0.60 -0.07 0.00 -0.71 0.00 0.00 39.64 38.26 2k78 n ILE 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2k78 h ALA 49 N 0.00 -0.56 -0.63 -1.39 0.00 -1.93 -2.02 119.26 112.73 2k78 h ALA 49 Ca 0.00 -0.10 0.18 0.00 0.00 0.00 0.00 54.91 55.00 2k78 h ALA 49 Cb 0.10 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2k78 h ALA 49 CO 0.00 -0.84 0.77 -0.97 0.00 0.00 0.00 179.25 178.20 2k78 h ASN 50 N -0.57 0.00 0.16 0.00 -0.73 -1.91 0.69 115.58 113.21 2k78 h ASN 50 Ca -0.02 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.15 2k78 h ASN 50 Cb 0.51 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.10 2k78 h ASN 50 CO -0.02 0.00 0.00 0.47 -0.37 0.00 0.00 177.43 177.51 2k78 n ASP 51 N -3.44 0.00 -1.27 1.15 9.92 -0.76 -3.40 116.55 118.75 2k78 n ASP 51 Ca 0.13 -0.38 0.01 0.00 -0.53 0.00 0.00 54.79 54.02 2k78 n ASP 51 Cb 0.98 -0.12 -0.00 0.00 -0.64 0.00 0.00 41.12 41.34 2k78 n ASP 51 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2k78 n TYR 52 N -1.12 0.00 -3.81 1.24 4.01 0.24 -5.05 117.16 112.66 2k78 n TYR 52 Ca 0.13 -0.44 -0.29 0.00 -0.16 0.00 0.00 57.90 57.15 2k78 n TYR 52 Cb 0.11 0.01 -0.16 0.00 -0.31 0.00 0.00 39.34 38.99 2k78 n TYR 52 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2k78 s PHE 53 N 0.00 1.60 0.52 -0.72 0.08 -1.15 -3.07 117.98 115.23 2k78 s PHE 53 Ca 0.23 -1.25 -0.20 0.00 0.12 0.00 0.00 56.93 55.83 2k78 s PHE 53 Cb 0.26 -1.28 -0.07 0.00 -0.57 0.00 0.00 43.02 41.36 2k78 s PHE 53 CO -0.11 -0.69 1.08 -0.80 -0.10 0.00 0.00 175.22 174.60 2k78 s ASN 54 N 1.66 6.03 0.20 1.36 0.01 -1.14 -4.93 114.94 118.13 2k78 s ASN 54 Ca -0.02 2.04 -0.08 0.00 -0.71 0.00 0.00 52.86 54.09 2k78 s ASN 54 Cb -0.18 -2.57 -0.02 0.00 0.41 0.00 0.00 41.25 38.90 2k78 s ASN 54 CO -0.08 -1.00 0.30 -1.59 -1.51 0.00 0.00 177.10 173.22 2k78 s LYS 55 N -3.28 1.29 0.61 -0.60 -2.85 -1.26 -4.50 119.74 109.16 2k78 s LYS 55 Ca 0.70 -1.33 -0.10 0.00 -1.00 0.00 0.00 55.97 54.24 2k78 s LYS 55 Cb -0.20 0.38 0.15 0.00 -2.06 0.00 0.00 37.83 36.09 2k78 s LYS 55 CO 0.24 -0.48 0.72 -0.35 0.10 0.00 0.00 175.35 175.58 2k78 n PRO 56 N -0.28 -1.26 -3.41 1.78 -0.04 -1.26 -5.15 135.00 125.38 2k78 n PRO 56 Ca -0.03 -1.13 -0.19 0.00 -0.04 0.00 0.00 63.50 62.11 2k78 n PRO 56 Cb 0.63 -0.84 -0.01 0.00 -0.04 0.00 0.00 33.50 33.23 2k78 n PRO 56 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k78 s ALA 57 N -3.65 4.20 -0.26 0.55 0.00 -1.06 -4.91 121.76 116.62 2k78 s ALA 57 Ca 0.43 -1.71 -0.09 0.00 0.00 0.00 0.00 51.96 50.59 2k78 s ALA 57 Cb -0.02 -1.34 -0.04 0.00 0.00 0.00 0.00 23.12 21.72 2k78 s ALA 57 CO 0.31 -0.17 0.12 0.21 0.00 0.00 0.00 175.76 176.23 2k78 s LYS 58 N -4.18 3.77 0.38 0.00 2.20 -1.12 0.52 119.74 121.30 2k78 s LYS 58 Ca 0.49 -0.41 0.04 0.00 -0.36 0.00 0.00 55.97 55.72 2k78 s LYS 58 Cb -0.07 -3.47 -0.01 0.00 -1.51 0.00 0.00 37.83 32.77 2k78 s LYS 58 CO 0.30 -0.19 0.55 1.52 -0.36 0.00 0.00 175.35 177.17 2k78 s TYR 59 N 1.68 3.20 -0.26 4.03 -0.85 0.20 -0.74 117.35 124.61 2k78 s TYR 59 Ca 0.07 0.01 -0.06 0.00 -0.52 0.00 0.00 57.07 56.56 2k78 s TYR 59 Cb -0.16 -2.09 0.13 0.00 0.38 0.00 0.00 41.96 40.23 2k78 s TYR 59 CO 0.07 -0.11 0.53 -1.50 -1.52 0.00 0.00 175.55 173.01 2k78 s ILE 60 N -2.32 -0.84 -0.13 -3.49 2.07 -0.05 -1.54 121.20 114.90 2k78 s ILE 60 Ca 0.45 0.04 -0.00 0.00 -1.41 0.00 0.00 60.65 59.73 2k78 s ILE 60 Cb -0.10 -0.87 0.03 0.00 0.13 0.00 0.00 42.46 41.65 2k78 s ILE 60 CO 0.34 0.00 -0.10 -0.54 -1.91 0.00 0.00 174.94 172.73 2k78 s LYS 61 N 2.75 1.80 -1.09 3.50 3.01 -0.06 -0.07 119.74 129.59 2k78 s LYS 61 Ca 0.04 -0.40 -0.03 0.00 -1.01 0.00 0.00 55.97 54.58 2k78 s LYS 61 Cb -0.13 -1.82 0.29 0.00 -1.01 0.00 0.00 37.83 35.15 2k78 s LYS 61 CO -0.17 -0.27 1.83 1.63 0.51 0.00 0.00 175.35 178.87 2k78 n LYS 62 N 4.87 5.08 -2.99 1.68 5.02 -0.94 -4.24 118.16 126.64 2k78 n LYS 62 Ca -0.14 -4.45 -0.01 0.00 -2.02 0.00 0.00 58.31 51.69 2k78 n LYS 62 Cb 0.50 -2.52 -0.01 0.00 -0.02 0.00 0.00 35.03 32.98 2k78 n LYS 62 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2k78 n ASN 63 N 0.60 -6.15 0.00 4.39 5.15 -1.26 -4.30 115.26 113.69 2k78 n ASN 63 Ca 0.44 0.92 0.00 0.00 -0.60 0.00 0.00 54.58 55.34 2k78 n ASN 63 Cb 0.28 -2.58 0.00 0.00 -0.53 0.00 0.00 39.78 36.95 2k78 n ASN 63 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k78 n GLY 64 N 1.87 1.01 3.54 8.20 0.00 -1.26 -5.06 105.19 113.48 2k78 n GLY 64 Ca -0.07 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 2k78 n GLY 64 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k78 s LYS 65 N -0.92 0.76 -0.25 1.61 0.00 -1.26 -5.18 119.74 114.49 2k78 s LYS 65 Ca 0.00 -0.29 -0.26 0.00 0.00 0.00 0.00 55.97 55.42 2k78 s LYS 65 Cb 0.00 0.34 0.11 0.00 0.00 0.00 0.00 37.83 38.28 2k78 s LYS 65 CO 0.00 -0.33 0.95 -0.48 0.00 0.00 0.00 175.35 175.49 2k78 s LEU 66 N -2.47 -0.51 0.00 2.77 2.34 -1.26 -2.22 118.68 117.33 2k78 s LEU 66 Ca 0.06 0.91 0.06 0.00 0.06 0.00 0.00 54.13 55.23 2k78 s LEU 66 Cb -0.01 2.02 -0.02 0.00 -0.56 0.00 0.00 46.19 47.62 2k78 s LEU 66 CO -0.07 -0.22 0.23 -1.22 -1.06 0.00 0.00 176.35 174.01 2k78 n TYR 67 N 2.05 -0.63 -3.67 3.48 4.02 0.91 -3.80 117.16 119.52 2k78 n TYR 67 Ca -0.13 -2.31 -0.10 0.00 -0.01 0.00 0.00 57.90 55.36 2k78 n TYR 67 Cb 0.56 0.23 -0.09 0.00 -0.02 0.00 0.00 39.34 40.02 2k78 n TYR 67 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2k78 s VAL 68 N -3.11 -0.01 -0.14 -0.72 1.01 -0.69 -0.87 120.40 115.88 2k78 s VAL 68 Ca 0.32 0.03 -0.12 0.00 0.00 0.00 0.00 61.98 62.22 2k78 s VAL 68 Cb 0.02 -0.82 -0.05 0.00 0.00 0.00 0.00 36.38 35.53 2k78 s VAL 68 CO 0.23 0.01 0.25 0.00 0.00 0.00 0.00 175.10 175.59 2k78 s GLN 69 N 1.30 4.05 -0.12 2.72 -2.07 0.08 -0.35 119.66 125.26 2k78 s GLN 69 Ca -0.08 0.03 0.01 0.00 -1.82 0.00 0.00 55.36 53.50 2k78 s GLN 69 Cb -0.06 -3.36 -0.01 0.00 -1.09 0.00 0.00 33.01 28.49 2k78 s GLN 69 CO -0.13 0.41 -0.14 0.42 -1.32 0.00 0.00 175.29 174.52 2k78 s ILE 70 N -0.02 2.94 -0.32 3.63 1.09 -0.25 -2.81 121.20 125.46 2k78 s ILE 70 Ca 0.15 -0.71 -0.23 0.00 -1.10 0.00 0.00 60.65 58.77 2k78 s ILE 70 Cb -0.13 -2.22 0.00 0.00 -1.06 0.00 0.00 42.46 39.06 2k78 s ILE 70 CO 0.04 0.54 0.76 -0.89 -0.10 0.00 0.00 174.94 175.28 2k78 s THR 71 N 0.22 4.81 -0.04 2.92 2.01 -1.26 -2.15 115.64 122.14 2k78 s THR 71 Ca -0.09 1.05 -0.02 0.00 0.31 0.00 0.00 61.69 62.94 2k78 s THR 71 Cb -0.15 -4.13 -0.04 0.00 0.01 0.00 0.00 72.50 68.19 2k78 s THR 71 CO 0.05 -0.27 0.08 0.68 -0.69 0.00 0.00 174.62 174.47 2k78 s VAL 72 N 2.92 4.80 0.18 3.82 -7.23 0.33 -2.91 120.40 122.31 2k78 s VAL 72 Ca 0.31 -0.28 0.04 0.00 -1.81 0.00 0.00 61.98 60.24 2k78 s VAL 72 Cb -0.14 -3.15 -0.03 0.00 0.56 0.00 0.00 36.38 33.62 2k78 s VAL 72 CO 0.13 0.44 0.28 0.21 -0.31 0.00 0.00 175.10 175.85 2k78 s ASN 73 N -1.48 6.19 -0.28 4.85 2.47 -1.17 -1.77 114.94 123.75 2k78 s ASN 73 Ca 0.20 0.09 -0.10 0.00 0.42 0.00 0.00 52.86 53.47 2k78 s ASN 73 Cb -0.12 -1.81 0.01 0.00 -1.45 0.00 0.00 41.25 37.88 2k78 s ASN 73 CO 0.10 0.02 0.24 1.41 -3.72 0.00 0.00 177.10 175.16 2k78 n HIS 74 N -0.74 -2.64 0.20 0.43 8.25 0.39 -4.55 115.22 116.57 2k78 n HIS 74 Ca -0.08 1.13 0.04 0.00 -0.26 0.00 0.00 57.72 58.55 2k78 n HIS 74 Cb 0.55 -2.88 0.43 0.00 1.12 0.00 0.00 29.99 29.21 2k78 n HIS 74 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2k78 h SER 75 N 2.82 0.01 -0.24 0.41 0.87 -1.69 -2.39 113.55 113.34 2k78 h SER 75 Ca -0.09 -0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.42 2k78 h SER 75 Cb 0.71 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.65 2k78 h SER 75 CO 0.12 0.28 0.01 0.45 -0.53 0.00 0.00 176.83 177.16 2k78 h HIS 76 N 0.01 0.55 0.09 2.24 3.86 -1.88 -3.25 115.15 116.78 2k78 h HIS 76 Ca -0.00 -0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.15 2k78 h HIS 76 Cb 0.47 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.78 2k78 h HIS 76 CO 0.00 0.53 -0.04 -1.49 0.86 0.00 0.00 177.93 177.79 2k78 h TRP 77 N 0.51 -0.12 -3.43 2.45 4.06 -1.68 -3.40 115.95 114.34 2k78 h TRP 77 Ca 0.11 -0.00 -0.60 0.00 2.06 0.00 0.00 58.89 60.46 2k78 h TRP 77 Cb 0.31 0.04 -0.10 0.00 -1.00 0.00 0.00 29.16 28.40 2k78 h TRP 77 CO 0.01 0.10 0.19 -1.50 -3.56 0.00 0.00 178.44 173.68 2k78 s ILE 78 N -2.17 4.98 -0.15 1.49 2.07 -1.02 -3.12 121.20 123.27 2k78 s ILE 78 Ca -0.05 1.21 0.17 0.00 -1.41 0.00 0.00 60.65 60.56 2k78 s ILE 78 Cb -0.00 -3.96 -0.05 0.00 0.13 0.00 0.00 42.46 38.58 2k78 s ILE 78 CO 0.19 0.04 1.06 0.00 -1.91 0.00 0.00 174.94 174.32 2k78 h THR 79 N 5.34 0.55 0.00 4.00 1.03 -1.56 -3.42 112.91 118.86 2k78 h THR 79 Ca -0.28 -1.94 0.00 0.00 -0.01 0.00 0.00 66.41 64.18 2k78 h THR 79 Cb 1.13 2.10 0.00 0.00 -1.07 0.00 0.00 68.15 70.31 2k78 h THR 79 CO 0.79 0.32 0.00 0.61 -0.01 0.00 0.00 175.52 177.22 2k78 n GLY 80 N 1.31 -1.22 3.11 2.99 0.00 -1.15 -4.94 105.19 105.29 2k78 n GLY 80 Ca -0.05 -1.02 -0.07 0.00 0.00 0.00 0.00 46.02 44.88 2k78 n GLY 80 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2k78 s MET 81 N -1.85 0.36 0.44 1.61 -1.94 -1.26 -2.72 119.30 113.95 2k78 s MET 81 Ca 0.00 0.83 -0.10 0.00 -1.71 0.00 0.00 55.69 54.71 2k78 s MET 81 Cb 0.00 0.01 -0.06 0.00 2.01 0.00 0.00 34.83 36.80 2k78 s MET 81 CO 0.00 -0.45 0.80 0.45 -0.01 0.00 0.00 175.02 175.81 2k78 s SER 82 N 2.61 6.45 -0.23 3.03 0.15 0.46 -4.11 113.70 122.05 2k78 s SER 82 Ca 0.06 1.12 -0.17 0.00 0.70 0.00 0.00 55.95 57.67 2k78 s SER 82 Cb -0.14 -2.32 0.07 0.00 -1.71 0.00 0.00 66.02 61.92 2k78 s SER 82 CO -0.15 -0.48 0.59 -0.63 1.20 0.00 0.00 173.24 173.77 2k78 s ILE 83 N -2.52 -0.01 0.00 6.45 1.01 -1.02 -0.53 121.20 124.58 2k78 s ILE 83 Ca 0.51 0.02 0.00 0.00 0.00 0.00 0.00 60.65 61.18 2k78 s ILE 83 Cb -0.10 -0.85 0.00 0.00 0.01 0.00 0.00 42.46 41.52 2k78 s ILE 83 CO 0.36 0.01 0.00 1.21 0.00 0.00 0.00 174.94 176.52 2k78 n GLU 84 N 3.64 -0.34 0.00 2.79 0.00 -0.98 -2.78 120.64 122.97 2k78 n GLU 84 Ca -0.18 0.09 0.00 0.00 0.00 0.00 0.00 57.16 57.07 2k78 n GLU 84 Cb 0.57 -3.68 0.00 0.00 0.00 0.00 0.00 31.44 28.32 2k78 n GLU 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2k78 n GLY 85 N -1.65 1.26 3.16 8.31 0.00 -1.26 -5.08 105.19 109.91 2k78 n GLY 85 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2k78 n GLY 85 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k78 s HIS 86 N -2.00 0.83 0.00 1.61 -3.43 -1.12 -5.16 115.29 106.03 2k78 s HIS 86 Ca 0.00 -1.04 0.00 0.00 -0.80 0.00 0.00 55.06 53.22 2k78 s HIS 86 Cb 0.00 -0.50 0.00 0.00 -1.43 0.00 0.00 32.58 30.65 2k78 s HIS 86 CO 0.00 -0.30 0.00 1.63 -2.00 0.00 0.00 174.74 174.07 2k78 n LYS 87 N -0.04 -0.88 -3.69 -0.38 4.01 -1.26 -2.43 118.16 113.49 2k78 n LYS 87 Ca -0.10 0.00 -0.22 0.00 -0.51 0.00 0.00 58.31 57.48 2k78 n LYS 87 Cb 0.62 0.00 -0.04 0.00 -0.51 0.00 0.00 35.03 35.10 2k78 n LYS 87 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 2k78 s GLU 88 N -2.86 2.48 -0.09 1.97 4.04 -1.26 -4.57 118.70 118.40 2k78 s GLU 88 Ca 0.00 -1.59 0.03 0.00 0.04 0.00 0.00 54.97 53.45 2k78 s GLU 88 Cb 0.00 -2.30 0.01 0.00 0.02 0.00 0.00 34.13 31.86 2k78 s GLU 88 CO 0.00 -0.16 -0.18 1.21 -1.84 0.00 0.00 175.26 174.29 2k78 s ASN 89 N -4.08 2.51 -0.57 0.83 3.04 -1.25 -4.97 114.94 110.45 2k78 s ASN 89 Ca 0.46 -0.45 -0.27 0.00 0.04 0.00 0.00 52.86 52.65 2k78 s ASN 89 Cb -0.02 -1.15 -0.03 0.00 -1.54 0.00 0.00 41.25 38.52 2k78 s ASN 89 CO 0.27 0.08 1.93 0.27 -3.04 0.00 0.00 177.10 176.61 2k78 s ILE 90 N 0.62 3.32 -0.12 -5.21 -5.25 -1.26 -3.08 121.20 110.22 2k78 s ILE 90 Ca -0.14 0.21 0.16 0.00 -0.99 0.00 0.00 60.65 59.89 2k78 s ILE 90 Cb -0.16 -3.79 -0.23 0.00 2.95 0.00 0.00 42.46 41.23 2k78 s ILE 90 CO 0.04 -0.74 0.45 0.00 -1.79 0.00 0.00 174.94 172.90 2k78 n ILE 91 N 7.34 1.31 -3.14 8.37 3.06 -1.08 -4.88 119.36 130.35 2k78 n ILE 91 Ca 0.23 -0.78 0.04 0.00 -2.50 0.00 0.00 62.75 59.74 2k78 n ILE 91 Cb 0.52 -0.67 -0.00 0.00 0.54 0.00 0.00 39.64 40.03 2k78 n ILE 91 CO 0.00 0.00 0.00 -0.44 -2.50 0.00 0.00 176.55 173.61 2k78 s SER 92 N -5.66 -1.11 -0.48 9.51 0.01 -1.24 -4.98 113.70 109.74 2k78 s SER 92 Ca -0.07 0.06 -0.18 0.00 1.31 0.00 0.00 55.95 57.06 2k78 s SER 92 Cb 0.08 1.67 0.05 0.00 0.21 0.00 0.00 66.02 68.03 2k78 s SER 92 CO 0.83 -0.19 0.56 -0.75 0.41 0.00 0.00 173.24 174.10 2k78 s LYS 93 N 2.77 3.11 -0.54 12.44 2.20 -1.26 -2.01 119.74 136.45 2k78 s LYS 93 Ca 0.17 -0.91 -0.17 0.00 -0.36 0.00 0.00 55.97 54.70 2k78 s LYS 93 Cb -0.06 -4.08 0.10 0.00 -1.51 0.00 0.00 37.83 32.28 2k78 s LYS 93 CO -0.23 -1.13 0.58 -0.80 -0.36 0.00 0.00 175.35 173.41 2k78 s ASN 94 N 2.51 6.19 0.17 1.43 0.02 -0.79 -4.89 114.94 119.57 2k78 s ASN 94 Ca 0.13 -1.43 0.09 0.00 -1.02 0.00 0.00 52.86 50.64 2k78 s ASN 94 Cb -0.19 -2.25 -0.07 0.00 0.02 0.00 0.00 41.25 38.75 2k78 s ASN 94 CO 0.12 -0.92 1.36 0.71 0.02 0.00 0.00 177.10 178.39 2k78 h THR 95 N 5.87 1.51 0.09 1.60 1.35 -1.94 0.13 112.91 121.53 2k78 h THR 95 Ca -0.29 -3.02 -0.00 0.00 -0.55 0.00 0.00 66.41 62.55 2k78 h THR 95 Cb 1.10 2.67 0.00 0.00 -1.73 0.00 0.00 68.15 70.19 2k78 h THR 95 CO 1.02 0.83 -0.04 0.00 -0.25 0.00 0.00 175.52 177.08 2k78 h ALA 96 N 1.15 -0.13 -0.53 6.62 0.00 -1.94 -2.81 119.26 121.63 2k78 h ALA 96 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2k78 h ALA 96 Cb 1.60 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2k78 h ALA 96 CO 0.11 -0.51 0.00 1.63 0.00 0.00 0.00 179.25 180.48 2k78 n LYS 97 N -5.09 3.44 -1.74 0.00 5.02 -1.25 -4.89 118.16 113.64 2k78 n LYS 97 Ca -0.08 -2.41 -0.14 0.00 -2.02 0.00 0.00 58.31 53.66 2k78 n LYS 97 Cb 0.13 -1.85 -0.04 0.00 -0.02 0.00 0.00 35.03 33.24 2k78 n LYS 97 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2k78 n ASP 98 N 0.83 -3.98 -4.71 4.39 -0.08 -0.76 -4.75 116.55 107.49 2k78 n ASP 98 Ca 0.22 0.29 -0.23 0.00 -1.51 0.00 0.00 54.79 53.55 2k78 n ASP 98 Cb 0.81 -3.56 0.10 0.00 2.34 0.00 0.00 41.12 40.81 2k78 n ASP 98 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2k78 s GLU 99 N -3.80 1.74 -0.29 -0.67 2.02 0.37 -0.46 118.70 117.61 2k78 s GLU 99 Ca 0.00 -1.18 -0.31 0.00 0.02 0.00 0.00 54.97 53.51 2k78 s GLU 99 Cb 0.00 -2.36 0.19 0.00 0.10 0.00 0.00 34.13 32.05 2k78 s GLU 99 CO 0.00 -1.39 1.38 0.50 0.02 0.00 0.00 175.26 175.77 2k78 s ARG 100 N -5.09 0.04 0.05 1.61 3.52 -0.73 -1.89 118.95 116.46 2k78 s ARG 100 Ca 0.66 0.00 -0.03 0.00 -0.13 0.00 0.00 55.73 56.24 2k78 s ARG 100 Cb -0.05 0.02 -0.03 0.00 -1.56 0.00 0.00 34.95 33.33 2k78 s ARG 100 CO 0.44 -0.01 0.02 0.99 -0.81 0.00 0.00 175.30 175.92 2k78 s THR 101 N -1.19 0.18 -0.05 4.11 2.01 -0.85 0.12 115.64 119.98 2k78 s THR 101 Ca 0.10 -1.51 -0.07 0.00 0.31 0.00 0.00 61.69 60.51 2k78 s THR 101 Cb -0.01 -1.25 0.01 0.00 0.01 0.00 0.00 72.50 71.26 2k78 s THR 101 CO -0.07 -0.84 0.18 -0.94 -0.69 0.00 0.00 174.62 172.26 2k78 s SER 102 N -2.62 -0.13 0.06 3.53 1.04 -0.91 -2.62 113.70 112.05 2k78 s SER 102 Ca 0.02 0.20 -0.12 0.00 0.48 0.00 0.00 55.95 56.53 2k78 s SER 102 Cb 0.04 0.33 -0.06 0.00 0.10 0.00 0.00 66.02 66.43 2k78 s SER 102 CO -0.08 -0.17 0.43 -0.70 0.98 0.00 0.00 173.24 173.70 2k78 s GLU 103 N -0.37 3.85 -0.05 4.02 2.56 -1.18 -1.10 118.70 126.43 2k78 s GLU 103 Ca -0.05 0.30 0.02 0.00 0.00 0.00 0.00 54.97 55.25 2k78 s GLU 103 Cb -0.03 -3.06 0.01 0.00 2.00 0.00 0.00 34.13 33.05 2k78 s GLU 103 CO 0.01 0.59 -0.11 -0.06 -0.56 0.00 0.00 175.26 175.13 2k78 s PHE 104 N -1.31 1.28 -0.14 5.30 0.08 0.52 -3.84 117.98 119.87 2k78 s PHE 104 Ca 0.31 -0.41 -0.18 0.00 0.12 0.00 0.00 56.93 56.77 2k78 s PHE 104 Cb -0.15 -0.93 -0.04 0.00 -0.57 0.00 0.00 43.02 41.33 2k78 s PHE 104 CO 0.17 -0.20 0.46 -1.21 -0.10 0.00 0.00 175.22 174.34 2k78 s GLU 105 N 0.48 4.30 -0.08 0.44 2.02 -1.26 -1.70 118.70 122.90 2k78 s GLU 105 Ca -0.10 0.40 -0.14 0.00 0.02 0.00 0.00 54.97 55.16 2k78 s GLU 105 Cb -0.13 -3.46 0.03 0.00 0.10 0.00 0.00 34.13 30.67 2k78 s GLU 105 CO 0.02 0.11 0.34 0.14 0.02 0.00 0.00 175.26 175.89 2k78 s VAL 106 N 0.79 0.03 -0.27 2.63 -7.23 -1.25 -4.72 120.40 110.38 2k78 s VAL 106 Ca 0.25 -0.22 -0.28 0.00 -1.81 0.00 0.00 61.98 59.91 2k78 s VAL 106 Cb -0.15 -0.56 -0.04 0.00 0.56 0.00 0.00 36.38 36.19 2k78 s VAL 106 CO 0.09 -0.12 2.05 -0.55 -0.31 0.00 0.00 175.10 176.26 2k78 s SER 107 N -0.54 5.61 0.29 4.85 0.15 -1.26 -4.68 113.70 118.12 2k78 s SER 107 Ca -0.07 1.63 0.00 0.00 0.70 0.00 0.00 55.95 58.22 2k78 s SER 107 Cb -0.04 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 2k78 s SER 107 CO 0.02 -1.88 0.00 0.29 1.20 0.00 0.00 173.24 172.88 2k78 n LYS 108 N 8.63 -2.18 -2.99 5.44 4.76 -1.26 -4.82 118.16 125.76 2k78 n LYS 108 Ca 0.27 1.53 -0.16 0.00 -2.87 0.00 0.00 58.31 57.08 2k78 n LYS 108 Cb 0.46 -2.69 -0.02 0.00 -1.84 0.00 0.00 35.03 30.94 2k78 n LYS 108 CO 0.00 0.00 0.00 1.47 -1.37 0.00 0.00 177.40 177.50 2k78 n LEU 109 N -3.41 -1.46 -2.78 -0.35 -0.00 -1.26 -4.96 117.00 102.78 2k78 n LEU 109 Ca -0.01 -3.95 -0.01 0.00 -0.00 0.00 0.00 56.01 52.04 2k78 n LEU 109 Cb 0.63 0.73 0.07 0.00 -0.00 0.00 0.00 43.42 44.85 2k78 n LEU 109 CO 0.01 2.02 0.19 -3.20 -0.00 0.00 0.00 177.39 176.40 2k78 n ASN 110 N 1.73 0.63 -1.17 1.45 5.15 -1.09 -1.42 115.26 120.52 2k78 n ASN 110 Ca 0.16 -2.10 -0.00 0.00 -0.60 0.00 0.00 54.58 52.04 2k78 n ASN 110 Cb 0.57 -0.12 0.00 0.00 -0.53 0.00 0.00 39.78 39.70 2k78 n ASN 110 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k78 n GLY 111 N -0.87 1.19 3.80 8.20 0.00 0.16 -4.82 105.19 112.84 2k78 n GLY 111 Ca -0.00 -0.93 -0.36 0.00 0.00 0.00 0.00 46.02 44.73 2k78 n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k78 s LYS 112 N -2.00 4.44 -0.01 1.61 -2.85 -1.26 -0.35 119.74 119.31 2k78 s LYS 112 Ca 0.02 1.18 0.01 0.00 -1.00 0.00 0.00 55.97 56.18 2k78 s LYS 112 Cb -0.00 -2.70 0.00 0.00 -2.06 0.00 0.00 37.83 33.07 2k78 s LYS 112 CO 0.00 0.25 -0.03 0.42 0.10 0.00 0.00 175.35 176.10 2k78 s ILE 113 N -1.70 0.23 -0.11 3.79 -1.09 0.34 -4.92 121.20 117.74 2k78 s ILE 113 Ca 0.51 -0.09 -0.30 0.00 -2.23 0.00 0.00 60.65 58.54 2k78 s ILE 113 Cb -0.16 -0.22 -0.02 0.00 -1.58 0.00 0.00 42.46 40.47 2k78 s ILE 113 CO 0.21 0.08 1.19 -1.81 -1.23 0.00 0.00 174.94 173.39 2k78 s ASP 114 N 0.13 7.04 0.33 3.58 1.01 -1.26 -1.82 116.67 125.68 2k78 s ASP 114 Ca -0.01 1.71 0.04 0.00 0.71 0.00 0.00 52.55 55.00 2k78 s ASP 114 Cb -0.03 -2.55 -0.03 0.00 1.01 0.00 0.00 42.92 41.31 2k78 s ASP 114 CO -0.00 -0.64 0.17 -0.83 0.21 0.00 0.00 175.17 174.07 2k78 s GLY 115 N 1.59 2.22 0.31 0.21 0.00 -1.15 -2.32 107.32 108.18 2k78 s GLY 115 Ca 0.54 -1.69 -0.00 0.00 0.00 0.00 0.00 44.72 43.57 2k78 s GLY 115 CO 0.18 -1.63 0.37 0.54 0.00 0.00 0.00 173.10 172.55 2k78 s LYS 116 N -3.74 1.74 -0.16 2.90 1.02 0.31 -2.93 119.74 118.87 2k78 s LYS 116 Ca 0.34 -1.78 -0.26 0.00 0.02 0.00 0.00 55.97 54.29 2k78 s LYS 116 Cb 0.04 0.38 0.06 0.00 -0.52 0.00 0.00 37.83 37.80 2k78 s LYS 116 CO 0.18 -0.68 0.65 -1.50 -0.92 0.00 0.00 175.35 173.08 2k78 s ILE 117 N -3.41 0.00 0.21 2.17 2.07 0.24 0.17 121.20 122.66 2k78 s ILE 117 Ca 0.34 -0.03 0.07 0.00 -1.41 0.00 0.00 60.65 59.62 2k78 s ILE 117 Cb 0.01 -0.93 -0.04 0.00 0.13 0.00 0.00 42.46 41.63 2k78 s ILE 117 CO 0.21 -0.02 0.07 -1.81 -1.91 0.00 0.00 174.94 171.48 2k78 s ASP 118 N -0.34 5.06 0.02 4.50 1.11 -1.10 0.08 116.67 126.00 2k78 s ASP 118 Ca -0.05 -0.35 -0.03 0.00 0.18 0.00 0.00 52.55 52.30 2k78 s ASP 118 Cb -0.03 -1.17 -0.02 0.00 1.07 0.00 0.00 42.92 42.78 2k78 s ASP 118 CO 0.05 0.04 0.03 -0.69 1.18 0.00 0.00 175.17 175.78 2k78 s VAL 119 N -1.94 0.12 -0.27 -1.27 1.01 -0.67 -1.92 120.40 115.47 2k78 s VAL 119 Ca 0.30 -0.98 -0.00 0.00 0.00 0.00 0.00 61.98 61.29 2k78 s VAL 119 Cb -0.09 -0.54 0.15 0.00 0.00 0.00 0.00 36.38 35.90 2k78 s VAL 119 CO 0.21 -0.54 0.38 -0.47 0.00 0.00 0.00 175.10 174.68 2k78 s TYR 120 N -1.90 -0.86 0.08 5.22 6.14 -1.18 -2.85 117.35 122.01 2k78 s TYR 120 Ca -0.11 0.48 0.04 0.00 0.64 0.00 0.00 57.07 58.11 2k78 s TYR 120 Cb -0.06 -0.12 -0.03 0.00 0.42 0.00 0.00 41.96 42.17 2k78 s TYR 120 CO -0.02 -0.86 -0.11 0.42 0.64 0.00 0.00 175.55 175.62 2k78 s ILE 121 N 2.52 0.90 -0.34 3.14 1.01 0.17 -4.57 121.20 124.04 2k78 s ILE 121 Ca 0.11 -1.47 0.07 0.00 0.00 0.00 0.00 60.65 59.36 2k78 s ILE 121 Cb -0.14 -1.17 0.19 0.00 0.01 0.00 0.00 42.46 41.36 2k78 s ILE 121 CO -0.24 -0.46 0.60 1.51 0.00 0.00 0.00 174.94 176.35 2k78 s ASP 122 N -2.14 -1.52 0.00 3.58 1.47 -1.26 0.04 116.67 116.84 2k78 s ASP 122 Ca 0.01 -0.23 0.00 0.00 1.18 0.00 0.00 52.55 53.51 2k78 s ASP 122 Cb -0.06 1.97 0.00 0.00 -0.34 0.00 0.00 42.92 44.50 2k78 s ASP 122 CO 0.01 -0.25 0.00 -1.84 0.68 0.00 0.00 175.17 173.77 2k78 n GLU 123 N 5.01 0.00 -4.76 2.11 0.28 -1.16 -5.02 120.64 117.10 2k78 n GLU 123 Ca 0.07 0.00 -0.30 0.00 -0.16 0.00 0.00 57.16 56.77 2k78 n GLU 123 Cb 0.55 0.00 -0.17 0.00 1.43 0.00 0.00 31.44 33.25 2k78 n GLU 123 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2k78 s LYS 124 N 1.42 2.63 -0.96 3.44 1.02 -1.26 -0.07 119.74 125.97 2k78 s LYS 124 Ca 0.00 -0.72 -0.24 0.00 0.02 0.00 0.00 55.97 55.03 2k78 s LYS 124 Cb 0.00 -2.11 0.01 0.00 -0.52 0.00 0.00 37.83 35.21 2k78 s LYS 124 CO 0.00 0.03 1.63 0.08 -0.92 0.00 0.00 175.35 176.17 2k78 s VAL 125 N 0.71 3.73 -1.15 3.17 1.01 0.93 -3.95 120.40 124.85 2k78 s VAL 125 Ca -0.11 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.31 2k78 s VAL 125 Cb -0.16 -4.66 0.00 0.00 0.00 0.00 0.00 36.38 31.56 2k78 s VAL 125 CO 0.02 -1.57 0.00 0.59 0.00 0.00 0.00 175.10 174.15 2k78 n ASN 126 N 10.78 -3.81 0.00 3.32 5.03 -1.26 -2.63 115.26 126.68 2k78 n ASN 126 Ca 0.34 0.22 0.00 0.00 0.87 0.00 0.00 54.58 56.01 2k78 n ASN 126 Cb 0.50 -3.32 0.00 0.00 -1.02 0.00 0.00 39.78 35.94 2k78 n ASN 126 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2k78 n GLY 127 N -0.66 1.82 2.66 7.41 0.00 -1.25 -5.10 105.19 110.07 2k78 n GLY 127 Ca -0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 2k78 n GLY 127 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k78 s LYS 128 N -0.09 0.58 0.02 1.61 1.02 -1.08 -5.09 119.74 116.73 2k78 s LYS 128 Ca 0.00 -0.97 -0.33 0.00 0.02 0.00 0.00 55.97 54.69 2k78 s LYS 128 Cb 0.00 -0.91 -0.12 0.00 -0.52 0.00 0.00 37.83 36.28 2k78 s LYS 128 CO 0.00 -1.19 1.83 -2.30 -0.92 0.00 0.00 175.35 172.77 2k78 n PRO 129 N 4.25 2.41 -3.74 -1.68 -0.02 -1.26 -0.05 135.00 134.92 2k78 n PRO 129 Ca 0.10 0.88 -0.12 0.00 -2.02 0.00 0.00 63.50 62.34 2k78 n PRO 129 Cb 0.43 -2.74 -0.12 0.00 -0.02 0.00 0.00 33.50 31.04 2k78 n PRO 129 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2k78 s PHE 130 N 3.23 -0.37 -0.16 6.00 -0.71 0.89 -4.92 117.98 121.95 2k78 s PHE 130 Ca 0.87 0.86 -0.06 0.00 -1.04 0.00 0.00 56.93 57.56 2k78 s PHE 130 Cb -0.61 0.10 -0.04 0.00 -1.21 0.00 0.00 43.02 41.27 2k78 s PHE 130 CO 0.44 -0.23 0.06 0.15 -1.34 0.00 0.00 175.22 174.30 2k78 s LYS 131 N 0.99 3.77 -0.07 1.99 -0.14 -1.26 -2.99 119.74 122.02 2k78 s LYS 131 Ca -0.07 -0.33 0.03 0.00 -1.36 0.00 0.00 55.97 54.24 2k78 s LYS 131 Cb -0.08 -3.14 0.01 0.00 -1.68 0.00 0.00 37.83 32.94 2k78 s LYS 131 CO -0.07 0.39 -0.17 -0.47 -0.76 0.00 0.00 175.35 174.28 2k78 s TYR 132 N 0.03 1.83 -0.39 3.18 5.04 0.11 -4.96 117.35 122.18 2k78 s TYR 132 Ca 0.06 -0.68 -0.02 0.00 -2.44 0.00 0.00 57.07 53.99 2k78 s TYR 132 Cb -0.12 -1.28 0.20 0.00 0.35 0.00 0.00 41.96 41.11 2k78 s TYR 132 CO 0.01 -0.30 0.92 0.34 -1.34 0.00 0.00 175.55 175.18 2k78 s ASP 133 N 0.45 -0.79 0.27 4.32 -1.08 -1.26 -0.65 116.67 117.93 2k78 s ASP 133 Ca -0.14 -0.69 -0.05 0.00 -0.52 0.00 0.00 52.55 51.15 2k78 s ASP 133 Cb -0.16 1.02 0.02 0.00 -1.46 0.00 0.00 42.92 42.35 2k78 s ASP 133 CO 0.05 -0.06 0.45 1.57 0.52 0.00 0.00 175.17 177.70 2k78 n HIS 134 N 3.31 -1.54 -3.94 -5.34 -0.00 -1.13 -5.01 115.22 101.58 2k78 n HIS 134 Ca 0.11 -1.54 -0.30 0.00 0.46 0.00 0.00 57.72 56.45 2k78 n HIS 134 Cb 0.61 0.52 -0.14 0.00 -0.12 0.00 0.00 29.99 30.86 2k78 n HIS 134 CO 0.00 0.00 0.00 -3.38 0.46 0.00 0.00 176.34 173.42 2k78 s HIS 135 N -3.78 3.14 0.85 1.57 -3.43 -1.26 -1.67 115.29 110.72 2k78 s HIS 135 Ca 0.17 -3.15 -0.10 0.00 -0.80 0.00 0.00 55.06 51.18 2k78 s HIS 135 Cb -0.02 -2.77 0.19 0.00 -1.43 0.00 0.00 32.58 28.55 2k78 s HIS 135 CO 0.12 -0.73 1.16 0.66 -2.00 0.00 0.00 174.74 173.95 2k78 n TYR 136 N 3.07 -3.60 -3.96 0.38 4.01 0.11 -4.82 117.16 112.36 2k78 n TYR 136 Ca 0.06 -1.35 -0.09 0.00 -0.16 0.00 0.00 57.90 56.36 2k78 n TYR 136 Cb 0.32 -0.88 -0.06 0.00 -0.31 0.00 0.00 39.34 38.42 2k78 n TYR 136 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2k78 s ASN 137 N -5.40 -0.08 0.38 7.72 2.20 -1.26 0.83 114.94 119.32 2k78 s ASN 137 Ca 0.69 -0.86 -0.12 0.00 -0.94 0.00 0.00 52.86 51.63 2k78 s ASN 137 Cb -0.03 0.55 0.04 0.00 -2.00 0.00 0.00 41.25 39.82 2k78 s ASN 137 CO 0.48 -1.07 0.70 0.27 -2.94 0.00 0.00 177.10 174.54 2k78 s ILE 138 N -3.99 0.00 0.45 0.54 -4.36 -1.15 -4.46 121.20 108.23 2k78 s ILE 138 Ca 0.20 -1.17 -0.01 0.00 -0.26 0.00 0.00 60.65 59.41 2k78 s ILE 138 Cb 0.00 -2.82 -0.01 0.00 1.25 0.00 0.00 42.46 40.88 2k78 s ILE 138 CO 0.06 0.00 0.69 -0.89 0.24 0.00 0.00 174.94 175.04 2k78 s THR 139 N -2.49 4.36 -0.25 8.37 2.01 -0.43 -2.95 115.64 124.27 2k78 s THR 139 Ca 0.20 -0.30 -0.03 0.00 0.31 0.00 0.00 61.69 61.87 2k78 s THR 139 Cb -0.04 -3.63 0.11 0.00 0.01 0.00 0.00 72.50 68.95 2k78 s THR 139 CO 0.14 -0.49 0.24 -0.31 -0.69 0.00 0.00 174.62 173.51 2k78 s TYR 140 N -2.59 -0.28 -0.39 4.92 2.02 -0.75 -3.71 117.35 116.56 2k78 s TYR 140 Ca 0.47 -0.04 -0.11 0.00 -0.37 0.00 0.00 57.07 57.02 2k78 s TYR 140 Cb -0.10 -0.45 0.04 0.00 -0.40 0.00 0.00 41.96 41.04 2k78 s TYR 140 CO 0.40 -0.75 0.24 0.15 -1.57 0.00 0.00 175.55 174.01 2k78 s LYS 141 N 2.32 2.81 0.14 -0.62 1.02 -0.96 0.13 119.74 124.57 2k78 s LYS 141 Ca 0.08 -1.14 -0.12 0.00 0.02 0.00 0.00 55.97 54.81 2k78 s LYS 141 Cb -0.15 -3.79 -0.07 0.00 -0.52 0.00 0.00 37.83 33.30 2k78 s LYS 141 CO -0.23 -0.76 0.49 -0.06 -0.92 0.00 0.00 175.35 173.88 2k78 s PHE 142 N 1.56 3.57 -0.21 3.18 0.08 0.52 -2.50 117.98 124.18 2k78 s PHE 142 Ca 0.02 0.93 -0.02 0.00 0.12 0.00 0.00 56.93 57.98 2k78 s PHE 142 Cb -0.20 -2.27 0.06 0.00 -0.57 0.00 0.00 43.02 40.04 2k78 s PHE 142 CO 0.06 0.44 0.03 -0.80 -0.10 0.00 0.00 175.22 174.86 2k78 s ASN 143 N -1.84 3.07 0.00 1.36 0.01 0.21 0.36 114.94 118.11 2k78 s ASN 143 Ca 0.38 -0.91 0.00 0.00 -0.71 0.00 0.00 52.86 51.61 2k78 s ASN 143 Cb -0.14 -0.65 0.00 0.00 0.41 0.00 0.00 41.25 40.87 2k78 s ASN 143 CO 0.19 -0.31 0.00 0.61 -1.51 0.00 0.00 177.10 176.08 2k78 n GLY 144 N 5.01 4.03 1.06 0.66 0.00 -0.51 -2.64 105.19 112.80 2k78 n GLY 144 Ca -0.09 -0.30 -0.08 0.00 0.00 0.00 0.00 46.02 45.56 2k78 n GLY 144 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k78 n PRO 145 N 0.00 -1.69 0.16 1.61 -0.04 -1.26 -4.86 135.00 128.92 2k78 n PRO 145 Ca 0.00 -0.37 0.00 0.00 -0.04 0.00 0.00 63.50 63.09 2k78 n PRO 145 Cb 0.00 -0.58 0.00 0.00 -0.04 0.00 0.00 33.50 32.88 2k78 n PRO 145 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2k78 n THR 146 N -3.56 0.00 0.03 0.52 -2.24 -1.26 -4.58 114.28 103.19 2k78 n THR 146 Ca 0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 2k78 n THR 146 Cb 0.15 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.14 2k78 n THR 146 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2k78 n ASP 147 N -3.31 0.48 -3.69 3.42 2.03 -1.26 -5.03 116.55 109.19 2k78 n ASP 147 Ca 0.00 0.08 -0.23 0.00 0.52 0.00 0.00 54.79 55.16 2k78 n ASP 147 Cb 0.00 -0.13 0.05 0.00 -0.72 0.00 0.00 41.12 40.31 2k78 n ASP 147 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 2k78 n VAL 148 N -2.97 -3.98 -2.73 5.18 0.31 -1.26 -4.91 118.33 107.97 2k78 n VAL 148 Ca 0.00 -0.32 -0.43 0.00 -0.01 0.00 0.00 64.34 63.58 2k78 n VAL 148 Cb 0.00 -3.80 -0.03 0.00 -0.91 0.00 0.00 33.84 29.10 2k78 n VAL 148 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k78 s ALA 149 N -3.49 3.60 0.00 3.52 0.00 -1.26 -5.28 121.76 118.86 2k78 s ALA 149 Ca 0.23 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.16 2k78 s ALA 149 Cb -0.11 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.50 2k78 s ALA 149 CO 0.79 -1.19 0.00 0.41 0.00 0.00 0.00 175.76 175.77