#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 -2.91 -1.56 -0.43 0.00 -1.26 -2.90 120.51 111.45 2k78 n ALA 26 Ca 0.00 0.99 -0.18 0.00 0.00 0.00 0.00 53.44 54.25 2k78 n ALA 26 Cb 0.00 -3.36 -0.07 0.00 0.00 0.00 0.00 19.45 16.01 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 -0.21 -5.18 -2.99 0.00 4.05 -1.26 -4.85 115.26 104.82 2k78 n ASN 27 Ca 0.08 0.43 -0.32 0.00 0.45 0.00 0.00 54.58 55.21 2k78 n ASN 27 Cb 0.48 -4.27 -0.06 0.00 1.23 0.00 0.00 39.78 37.16 2k78 n ASN 27 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2k78 n ALA 28 N 1.19 7.12 0.06 5.20 0.00 -1.14 -4.52 120.51 128.41 2k78 n ALA 28 Ca -0.18 -3.21 -0.11 0.00 0.00 0.00 0.00 53.44 49.94 2k78 n ALA 28 Cb 0.60 -2.96 0.00 0.00 0.00 0.00 0.00 19.45 17.09 2k78 n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k78 h ALA 29 N 4.35 0.52 -2.91 0.00 0.00 -1.91 -3.45 119.26 115.87 2k78 h ALA 29 Ca 0.66 -0.65 -0.38 0.00 0.00 0.00 0.00 54.91 54.55 2k78 h ALA 29 Cb 0.59 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 2k78 h ALA 29 CO 1.33 0.79 -0.47 -0.25 0.00 0.00 0.00 179.25 180.65 2k78 n ASP 30 N -3.79 -5.43 -3.59 0.00 8.00 -1.26 -4.83 116.55 105.65 2k78 n ASP 30 Ca -0.05 0.09 -0.16 0.00 0.71 0.00 0.00 54.79 55.38 2k78 n ASP 30 Cb 0.75 -4.57 -0.07 0.00 -0.02 0.00 0.00 41.12 37.22 2k78 n ASP 30 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2k78 s SER 31 N -2.12 -0.71 0.00 -2.24 1.04 -1.26 0.12 113.70 108.53 2k78 s SER 31 Ca 0.00 1.14 0.00 0.00 0.48 0.00 0.00 55.95 57.57 2k78 s SER 31 Cb 0.00 1.08 0.00 0.00 0.10 0.00 0.00 66.02 67.20 2k78 s SER 31 CO 0.00 -0.39 0.00 0.61 0.98 0.00 0.00 173.24 174.44 2k78 n GLY 32 N 1.96 -1.58 3.53 7.32 0.00 -0.84 -5.00 105.19 110.58 2k78 n GLY 32 Ca -0.16 -1.07 -0.43 0.00 0.00 0.00 0.00 46.02 44.36 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 -2.25 4.59 0.16 2.61 -4.23 -1.26 -1.30 115.64 113.96 2k78 s THR 33 Ca 0.00 0.30 -0.05 0.00 -1.18 0.00 0.00 61.69 60.76 2k78 s THR 33 Cb 0.00 -4.38 -0.06 0.00 1.34 0.00 0.00 72.50 69.40 2k78 s THR 33 CO 0.00 -0.84 0.40 -0.22 -0.54 0.00 0.00 174.62 173.42 2k78 s LEU 34 N 3.42 4.25 0.27 4.79 1.98 0.03 -4.91 118.68 128.52 2k78 s LEU 34 Ca 0.29 0.64 -0.29 0.00 -2.89 0.00 0.00 54.13 51.88 2k78 s LEU 34 Cb -0.13 -3.37 -0.09 0.00 0.66 0.00 0.00 46.19 43.26 2k78 s LEU 34 CO 0.21 0.03 0.97 0.20 -1.89 0.00 0.00 176.35 175.87 2k78 s ASN 35 N -2.42 7.48 -0.02 3.68 0.01 -1.09 -2.56 114.94 120.01 2k78 s ASN 35 Ca 0.42 1.97 -0.28 0.00 -0.71 0.00 0.00 52.86 54.26 2k78 s ASN 35 Cb -0.12 -2.60 0.10 0.00 0.41 0.00 0.00 41.25 39.03 2k78 s ASN 35 CO 0.24 0.03 0.84 -0.72 -1.51 0.00 0.00 177.10 175.98 2k78 s TYR 36 N -1.31 -0.43 0.23 2.20 1.13 -1.26 0.17 117.35 118.09 2k78 s TYR 36 Ca 0.45 0.45 -0.06 0.00 -1.41 0.00 0.00 57.07 56.49 2k78 s TYR 36 Cb -0.25 0.51 0.02 0.00 -1.10 0.00 0.00 41.96 41.14 2k78 s TYR 36 CO 0.31 -0.56 0.40 -1.91 -2.51 0.00 0.00 175.55 171.28 2k78 n GLU 37 N 0.10 0.58 -4.20 -3.49 2.13 0.36 -4.83 120.64 111.29 2k78 n GLU 37 Ca -0.12 -1.47 -0.14 0.00 0.66 0.00 0.00 57.16 56.09 2k78 n GLU 37 Cb 0.61 1.64 -0.09 0.00 0.27 0.00 0.00 31.44 33.87 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 -2.54 0.00 0.11 6.31 -7.23 -1.26 0.16 120.40 115.94 2k78 s VAL 38 Ca 0.13 -1.92 -0.09 0.00 -1.81 0.00 0.00 61.98 58.28 2k78 s VAL 38 Cb -0.02 -2.49 0.00 0.00 0.56 0.00 0.00 36.38 34.44 2k78 s VAL 38 CO 0.09 0.00 0.23 -0.31 -0.31 0.00 0.00 175.10 174.80 2k78 s TYR 39 N -3.86 0.16 0.18 2.82 2.02 0.41 -4.01 117.35 115.07 2k78 s TYR 39 Ca 0.37 -0.57 -0.31 0.00 -0.37 0.00 0.00 57.07 56.20 2k78 s TYR 39 Cb 0.04 -0.03 -0.09 0.00 -0.40 0.00 0.00 41.96 41.49 2k78 s TYR 39 CO 0.17 -0.60 1.40 0.21 -1.57 0.00 0.00 175.55 175.17 2k78 s LYS 40 N -3.88 4.31 0.52 -0.62 2.47 -0.31 -1.83 119.74 120.40 2k78 s LYS 40 Ca 0.07 2.17 -0.22 0.00 -1.56 0.00 0.00 55.97 56.43 2k78 s LYS 40 Cb 0.04 -3.18 -0.06 0.00 -1.46 0.00 0.00 37.83 33.17 2k78 s LYS 40 CO -0.09 -0.40 1.22 0.98 0.16 0.00 0.00 175.35 177.22 2k78 n TYR 41 N 3.10 1.83 -0.84 4.03 9.36 -1.26 -1.34 117.16 132.03 2k78 n TYR 41 Ca 0.09 0.46 0.00 0.00 3.32 0.00 0.00 57.90 61.77 2k78 n TYR 41 Cb 0.41 -2.30 0.00 0.00 -0.63 0.00 0.00 39.34 36.82 2k78 n TYR 41 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 2k78 n ASN 42 N -0.57 -1.26 -0.54 2.98 5.15 -1.26 -4.93 115.26 114.83 2k78 n ASN 42 Ca 0.10 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.08 2k78 n ASN 42 Cb 0.44 -1.33 0.00 0.00 -0.53 0.00 0.00 39.78 38.36 2k78 n ASN 42 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 2k78 n THR 43 N -2.16 0.00 -1.02 -0.44 -2.24 -0.45 -5.07 114.28 102.89 2k78 n THR 43 Ca 0.00 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.80 2k78 n THR 43 Cb 0.06 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 -1.15 0.88 -3.94 3.42 2.85 -1.26 -4.72 115.26 111.34 2k78 n ASN 44 Ca 0.00 -1.85 -0.18 0.00 -0.11 0.00 0.00 54.58 52.44 2k78 n ASN 44 Cb 0.00 -0.12 -0.15 0.00 1.24 0.00 0.00 39.78 40.74 2k78 n ASN 44 CO 0.00 0.00 0.00 -1.81 -2.11 0.00 0.00 177.26 173.34 2k78 s ASP 45 N -0.98 0.82 0.19 1.20 1.11 -1.26 -4.87 116.67 112.88 2k78 s ASP 45 Ca 0.06 -0.12 -0.30 0.00 0.18 0.00 0.00 52.55 52.36 2k78 s ASP 45 Cb 0.05 -0.23 -0.09 0.00 1.07 0.00 0.00 42.92 43.71 2k78 s ASP 45 CO 0.01 0.02 1.37 -0.89 1.18 0.00 0.00 175.17 176.86 2k78 s THR 46 N 0.31 3.05 0.00 -1.27 2.01 -1.26 -1.17 115.64 117.31 2k78 s THR 46 Ca -0.04 0.84 0.00 0.00 0.31 0.00 0.00 61.69 62.80 2k78 s THR 46 Cb -0.08 -3.53 0.00 0.00 0.01 0.00 0.00 72.50 68.90 2k78 s THR 46 CO -0.00 0.11 0.00 -0.24 -0.69 0.00 0.00 174.62 173.80 2k78 n SER 47 N 2.88 1.96 0.12 3.53 2.88 -1.26 -4.79 113.62 118.93 2k78 n SER 47 Ca 0.08 -0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2k78 n SER 47 Cb 0.42 0.53 0.00 0.00 -0.75 0.00 0.00 64.21 64.40 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 -0.72 0.16 0.25 2.46 5.41 -1.26 -4.82 119.36 120.84 2k78 n ILE 48 Ca 0.00 0.05 0.04 0.00 1.00 0.00 0.00 62.75 63.84 2k78 n ILE 48 Cb 0.00 -0.67 0.16 0.00 -0.71 0.00 0.00 39.64 38.43 2k78 n ILE 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2k78 n ALA 49 N -3.37 1.34 0.35 -1.39 0.00 -1.26 -2.10 120.51 114.07 2k78 n ALA 49 Ca 0.00 -0.02 0.14 0.00 0.00 0.00 0.00 53.44 53.55 2k78 n ALA 49 Cb 0.01 -1.12 0.41 0.00 0.00 0.00 0.00 19.45 18.75 2k78 n ALA 49 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2k78 h ASN 50 N 0.00 0.00 -0.59 0.00 -0.73 -1.89 -3.06 115.58 109.31 2k78 h ASN 50 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2k78 h ASN 50 Cb 0.13 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.72 2k78 h ASN 50 CO 0.00 0.00 0.00 0.47 -0.37 0.00 0.00 177.43 177.53 2k78 n ASP 51 N -2.80 4.68 0.00 1.15 8.00 -0.89 -4.28 116.55 122.41 2k78 n ASP 51 Ca 0.03 -2.52 0.00 0.00 0.71 0.00 0.00 54.79 53.01 2k78 n ASP 51 Cb 0.40 -0.56 0.00 0.00 -0.02 0.00 0.00 41.12 40.94 2k78 n ASP 51 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2k78 n TYR 52 N 0.90 0.00 -3.91 1.24 4.01 -1.16 -5.01 117.16 113.24 2k78 n TYR 52 Ca 0.25 -0.09 -0.28 0.00 -0.16 0.00 0.00 57.90 57.62 2k78 n TYR 52 Cb 0.89 -0.01 -0.17 0.00 -0.31 0.00 0.00 39.34 39.75 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 -0.18 1.65 0.88 -0.72 0.08 -1.24 -2.86 117.98 115.58 2k78 s PHE 53 Ca 0.00 -0.95 -0.12 0.00 0.12 0.00 0.00 56.93 55.98 2k78 s PHE 53 Cb 0.00 -1.30 0.12 0.00 -0.57 0.00 0.00 43.02 41.27 2k78 s PHE 53 CO 0.00 -0.58 1.10 -0.80 -0.10 0.00 0.00 175.22 174.85 2k78 s ASN 54 N 1.65 3.72 0.09 1.36 0.01 -1.26 -4.98 114.94 115.54 2k78 s ASN 54 Ca 0.03 1.26 -0.09 0.00 -0.71 0.00 0.00 52.86 53.35 2k78 s ASN 54 Cb -0.14 -1.93 -0.00 0.00 0.41 0.00 0.00 41.25 39.58 2k78 s ASN 54 CO -0.08 -2.45 0.19 -1.59 -1.51 0.00 0.00 177.10 171.66 2k78 s LYS 55 N -5.10 0.86 0.55 -0.60 -2.85 -1.26 -4.61 119.74 106.74 2k78 s LYS 55 Ca 0.63 -0.98 -0.09 0.00 -1.00 0.00 0.00 55.97 54.53 2k78 s LYS 55 Cb -0.16 0.34 0.13 0.00 -2.06 0.00 0.00 37.83 36.08 2k78 s LYS 55 CO 0.55 -0.28 0.72 -0.35 0.10 0.00 0.00 175.35 176.09 2k78 n PRO 56 N -0.07 -0.84 -3.15 1.78 -0.04 -1.26 -5.16 135.00 126.26 2k78 n PRO 56 Ca -0.15 -1.11 -0.18 0.00 -0.04 0.00 0.00 63.50 62.02 2k78 n PRO 56 Cb 0.62 -0.76 0.00 0.00 -0.04 0.00 0.00 33.50 33.32 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 -3.90 4.42 -0.33 0.55 0.00 -1.06 -4.93 121.76 116.50 2k78 s ALA 57 Ca 0.41 -1.73 -0.08 0.00 0.00 0.00 0.00 51.96 50.56 2k78 s ALA 57 Cb -0.01 -1.47 0.03 0.00 0.00 0.00 0.00 23.12 21.67 2k78 s ALA 57 CO 0.29 -0.28 0.12 0.15 0.00 0.00 0.00 175.76 176.04 2k78 s LYS 58 N -4.30 2.83 0.38 0.00 -0.14 -1.18 -0.79 119.74 116.54 2k78 s LYS 58 Ca 0.53 -1.05 0.05 0.00 -1.36 0.00 0.00 55.97 54.14 2k78 s LYS 58 Cb -0.08 -3.49 -0.01 0.00 -1.68 0.00 0.00 37.83 32.57 2k78 s LYS 58 CO 0.32 -0.60 0.54 1.52 -0.76 0.00 0.00 175.35 176.37 2k78 s TYR 59 N 1.47 3.13 0.04 3.18 1.13 -0.42 -0.37 117.35 125.51 2k78 s TYR 59 Ca 0.01 -0.09 -0.22 0.00 -1.41 0.00 0.00 57.07 55.36 2k78 s TYR 59 Cb -0.19 -2.12 0.05 0.00 -1.10 0.00 0.00 41.96 38.60 2k78 s TYR 59 CO 0.04 -0.15 0.50 -1.50 -2.51 0.00 0.00 175.55 171.93 2k78 s ILE 60 N -2.30 0.03 0.28 -3.49 2.07 -0.90 -1.98 121.20 114.90 2k78 s ILE 60 Ca 0.46 -0.29 0.02 0.00 -1.41 0.00 0.00 60.65 59.44 2k78 s ILE 60 Cb -0.10 -0.95 -0.05 0.00 0.13 0.00 0.00 42.46 41.49 2k78 s ILE 60 CO 0.33 -0.16 0.10 -0.54 -1.91 0.00 0.00 174.94 172.76 2k78 s LYS 61 N -2.30 1.48 -0.43 3.50 1.02 0.32 0.27 119.74 123.60 2k78 s LYS 61 Ca -0.06 -1.81 0.08 0.00 0.02 0.00 0.00 55.97 54.19 2k78 s LYS 61 Cb -0.01 -0.36 0.31 0.00 -0.52 0.00 0.00 37.83 37.25 2k78 s LYS 61 CO -0.01 -0.30 0.93 1.63 -0.92 0.00 0.00 175.35 176.68 2k78 n LYS 62 N -0.53 0.94 -3.10 1.68 5.02 0.89 -4.72 118.16 118.35 2k78 n LYS 62 Ca -0.00 -2.41 -0.17 0.00 -2.02 0.00 0.00 58.31 53.71 2k78 n LYS 62 Cb 0.66 -1.30 0.02 0.00 -0.02 0.00 0.00 35.03 34.39 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 0.62 -6.94 0.00 4.39 5.15 -1.26 -4.02 115.26 113.20 2k78 n ASN 63 Ca 0.13 0.42 0.00 0.00 -0.60 0.00 0.00 54.58 54.53 2k78 n ASN 63 Cb 0.66 -3.58 0.00 0.00 -0.53 0.00 0.00 39.78 36.33 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 0.11 0.81 3.59 8.20 0.00 -1.26 -5.05 105.19 111.58 2k78 n GLY 64 Ca 0.01 -0.50 -0.06 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.23 0.94 -0.19 1.61 -2.85 -1.26 -5.18 119.74 111.58 2k78 s LYS 65 Ca 0.00 -0.43 -0.31 0.00 -1.00 0.00 0.00 55.97 54.23 2k78 s LYS 65 Cb 0.00 0.38 0.15 0.00 -2.06 0.00 0.00 37.83 36.30 2k78 s LYS 65 CO 0.00 -0.42 1.16 -0.48 0.10 0.00 0.00 175.35 175.71 2k78 s LEU 66 N -2.66 -0.20 0.00 2.77 2.34 -1.26 -0.07 118.68 119.61 2k78 s LEU 66 Ca 0.08 0.13 0.00 0.00 0.06 0.00 0.00 54.13 54.40 2k78 s LEU 66 Cb -0.01 1.49 0.00 0.00 -0.56 0.00 0.00 46.19 47.11 2k78 s LEU 66 CO -0.05 -0.24 0.00 -1.22 -1.06 0.00 0.00 176.35 173.78 2k78 n TYR 67 N 0.32 0.00 -3.64 3.48 4.02 0.14 -3.68 117.16 117.79 2k78 n TYR 67 Ca -0.04 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.80 2k78 n TYR 67 Cb 0.59 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.84 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 -0.07 0.00 -0.16 -0.72 1.01 -0.46 -2.13 120.40 117.87 2k78 s VAL 68 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.88 2k78 s VAL 68 Cb 0.00 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 2k78 s VAL 68 CO 0.00 0.00 0.16 0.00 0.00 0.00 0.00 175.10 175.26 2k78 s GLN 69 N 0.64 3.94 -0.05 2.72 1.03 0.50 0.85 119.66 129.29 2k78 s GLN 69 Ca -0.01 -0.13 0.03 0.00 0.04 0.00 0.00 55.36 55.29 2k78 s GLN 69 Cb -0.04 -3.34 -0.03 0.00 0.03 0.00 0.00 33.01 29.63 2k78 s GLN 69 CO -0.11 0.47 -0.12 0.42 -2.54 0.00 0.00 175.29 173.41 2k78 s ILE 70 N -0.15 3.27 -0.09 3.63 1.09 0.11 -3.10 121.20 125.95 2k78 s ILE 70 Ca 0.12 -0.67 -0.21 0.00 -1.10 0.00 0.00 60.65 58.79 2k78 s ILE 70 Cb -0.12 -2.31 -0.04 0.00 -1.06 0.00 0.00 42.46 38.94 2k78 s ILE 70 CO 0.01 0.57 0.59 -0.89 -0.10 0.00 0.00 174.94 175.12 2k78 s THR 71 N -0.78 5.12 -0.20 2.92 2.01 -1.26 -1.59 115.64 121.86 2k78 s THR 71 Ca 0.12 1.20 -0.08 0.00 0.31 0.00 0.00 61.69 63.24 2k78 s THR 71 Cb -0.11 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.43 2k78 s THR 71 CO 0.01 0.29 0.08 -0.69 -0.69 0.00 0.00 174.62 173.61 2k78 s VAL 72 N 0.73 4.81 -0.16 3.82 1.01 0.45 -4.19 120.40 126.87 2k78 s VAL 72 Ca 0.32 -0.02 -0.08 0.00 0.00 0.00 0.00 61.98 62.20 2k78 s VAL 72 Cb -0.16 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 2k78 s VAL 72 CO 0.14 0.43 0.12 0.20 0.00 0.00 0.00 175.10 175.99 2k78 s ASN 73 N 0.59 6.15 -0.19 3.32 -0.87 -1.14 -2.30 114.94 120.50 2k78 s ASN 73 Ca 0.04 0.31 -0.04 0.00 -1.57 0.00 0.00 52.86 51.60 2k78 s ASN 73 Cb -0.13 -2.02 0.02 0.00 -0.02 0.00 0.00 41.25 39.09 2k78 s ASN 73 CO 0.01 0.29 0.08 1.41 -2.57 0.00 0.00 177.10 176.32 2k78 n HIS 74 N 2.77 -3.15 0.15 2.20 8.25 -1.07 -4.65 115.22 119.71 2k78 n HIS 74 Ca -0.18 1.59 0.01 0.00 -0.26 0.00 0.00 57.72 58.88 2k78 n HIS 74 Cb 0.53 -3.22 0.18 0.00 1.12 0.00 0.00 29.99 28.61 2k78 n HIS 74 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2k78 h SER 75 N 3.69 0.00 -0.21 0.41 4.64 -1.82 -3.00 113.55 117.28 2k78 h SER 75 Ca -0.18 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.20 2k78 h SER 75 Cb 0.56 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 2k78 h SER 75 CO 0.05 0.55 0.19 -0.74 -0.87 0.00 0.00 176.83 176.01 2k78 h HIS 76 N 0.00 0.00 0.00 4.77 2.76 -1.91 -2.99 115.15 117.78 2k78 h HIS 76 Ca -0.01 0.00 -0.23 0.00 -2.20 0.00 0.00 60.37 57.94 2k78 h HIS 76 Cb 1.13 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 30.06 2k78 h HIS 76 CO 0.00 0.00 -1.38 0.91 -1.30 0.00 0.00 177.93 176.16 2k78 n TRP 77 N -4.03 0.75 -3.05 5.26 8.01 -1.15 -4.33 117.44 118.89 2k78 n TRP 77 Ca 0.02 0.32 -0.41 0.00 -1.31 0.00 0.00 57.50 56.12 2k78 n TRP 77 Cb 0.32 -0.99 -0.06 0.00 -2.01 0.00 0.00 31.31 28.57 2k78 n TRP 77 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.69 175.18 2k78 s ILE 78 N -2.40 4.93 -0.18 -0.99 2.07 -1.13 -3.14 121.20 120.36 2k78 s ILE 78 Ca -0.28 1.16 0.18 0.00 -1.41 0.00 0.00 60.65 60.29 2k78 s ILE 78 Cb 0.07 -4.00 -0.02 0.00 0.13 0.00 0.00 42.46 38.64 2k78 s ILE 78 CO 0.50 -0.05 1.08 0.00 -1.91 0.00 0.00 174.94 174.55 2k78 h THR 79 N 5.46 0.43 -1.96 4.00 1.03 -1.51 -3.42 112.91 116.94 2k78 h THR 79 Ca -0.26 -1.74 0.34 0.00 -0.01 0.00 0.00 66.41 64.74 2k78 h THR 79 Cb 1.11 2.00 -0.06 0.00 -1.07 0.00 0.00 68.15 70.13 2k78 h THR 79 CO 0.81 0.24 0.86 0.61 -0.01 0.00 0.00 175.52 178.03 2k78 n GLY 80 N 1.28 0.18 3.38 2.99 0.00 -1.10 -4.94 105.19 106.99 2k78 n GLY 80 Ca -0.04 -1.00 -0.10 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 -2.01 1.17 -0.18 1.61 -1.94 -1.26 -2.72 119.30 113.97 2k78 s MET 81 Ca 0.28 -0.89 -0.20 0.00 -1.71 0.00 0.00 55.69 53.17 2k78 s MET 81 Cb -0.00 0.45 0.05 0.00 2.01 0.00 0.00 34.83 37.34 2k78 s MET 81 CO -0.02 -0.46 0.54 -1.54 -0.01 0.00 0.00 175.02 173.54 2k78 s SER 82 N -2.87 -0.55 -0.00 3.03 1.04 0.46 -3.11 113.70 111.69 2k78 s SER 82 Ca 0.08 1.02 0.02 0.00 0.48 0.00 0.00 55.95 57.55 2k78 s SER 82 Cb 0.02 1.03 -0.01 0.00 0.10 0.00 0.00 66.02 67.16 2k78 s SER 82 CO -0.06 -0.23 -0.06 -0.63 0.98 0.00 0.00 173.24 173.24 2k78 s ILE 83 N 0.09 0.44 0.00 -1.02 1.01 -1.08 0.12 121.20 120.77 2k78 s ILE 83 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.36 2k78 s ILE 83 Cb -0.04 -0.38 0.00 0.00 0.01 0.00 0.00 42.46 42.05 2k78 s ILE 83 CO 0.02 0.10 0.00 1.21 0.00 0.00 0.00 174.94 176.27 2k78 n GLU 84 N 2.87 -0.18 0.00 2.79 0.00 -0.87 -2.91 120.64 122.35 2k78 n GLU 84 Ca -0.13 0.04 0.00 0.00 0.00 0.00 0.00 57.16 57.07 2k78 n GLU 84 Cb 0.58 -3.48 0.00 0.00 0.00 0.00 0.00 31.44 28.54 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 -1.85 1.25 3.13 8.31 0.00 -1.26 -5.07 105.19 109.71 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 0.74 0.92 1.61 -3.43 -1.14 -5.16 115.29 106.84 2k78 s HIS 86 Ca 0.00 -0.90 -0.16 0.00 -0.80 0.00 0.00 55.06 53.21 2k78 s HIS 86 Cb 0.00 -0.46 0.23 0.00 -1.43 0.00 0.00 32.58 30.92 2k78 s HIS 86 CO 0.00 -0.21 0.88 1.63 -2.00 0.00 0.00 174.74 175.04 2k78 n LYS 87 N 0.22 -2.41 -3.81 -0.38 4.01 -1.26 -2.62 118.16 111.91 2k78 n LYS 87 Ca -0.14 -1.39 -0.23 0.00 -0.51 0.00 0.00 58.31 56.04 2k78 n LYS 87 Cb 0.60 -1.24 -0.05 0.00 -0.51 0.00 0.00 35.03 33.83 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 -4.98 2.39 -0.09 1.97 -1.05 -1.18 -4.68 118.70 111.09 2k78 s GLU 88 Ca 0.56 -1.68 0.03 0.00 -0.15 0.00 0.00 54.97 53.72 2k78 s GLU 88 Cb -0.05 -2.20 -0.02 0.00 -0.44 0.00 0.00 34.13 31.42 2k78 s GLU 88 CO 0.42 -0.17 -0.16 1.21 0.95 0.00 0.00 175.26 177.51 2k78 s ASN 89 N -4.04 3.81 -0.54 0.83 3.84 -1.23 -4.96 114.94 112.66 2k78 s ASN 89 Ca 0.45 -0.32 -0.27 0.00 0.21 0.00 0.00 52.86 52.93 2k78 s ASN 89 Cb -0.00 -1.17 -0.02 0.00 -0.55 0.00 0.00 41.25 39.50 2k78 s ASN 89 CO 0.25 0.25 1.90 0.27 -2.79 0.00 0.00 177.10 176.98 2k78 s ILE 90 N -0.15 3.35 -0.13 -5.21 -4.36 -1.26 -3.19 121.20 110.25 2k78 s ILE 90 Ca -0.01 0.25 0.17 0.00 -0.26 0.00 0.00 60.65 60.80 2k78 s ILE 90 Cb -0.14 -3.78 -0.23 0.00 1.25 0.00 0.00 42.46 39.56 2k78 s ILE 90 CO 0.03 -0.71 0.44 0.00 0.24 0.00 0.00 174.94 174.95 2k78 n ILE 91 N 7.33 1.19 -3.15 8.37 3.06 -0.96 -4.90 119.36 130.31 2k78 n ILE 91 Ca 0.23 -0.75 0.05 0.00 -2.50 0.00 0.00 62.75 59.77 2k78 n ILE 91 Cb 0.51 -0.58 -0.00 0.00 0.54 0.00 0.00 39.64 40.10 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 -5.55 -0.97 0.14 9.51 0.01 -1.22 -4.97 113.70 110.65 2k78 s SER 92 Ca -0.07 0.27 -0.05 0.00 1.31 0.00 0.00 55.95 57.42 2k78 s SER 92 Cb 0.08 1.68 -0.06 0.00 0.21 0.00 0.00 66.02 67.93 2k78 s SER 92 CO 0.83 -0.18 0.37 -0.75 0.41 0.00 0.00 173.24 173.93 2k78 s LYS 93 N 2.90 3.62 -0.39 12.44 2.20 -1.26 -1.30 119.74 137.96 2k78 s LYS 93 Ca 0.15 -0.08 0.10 0.00 -0.36 0.00 0.00 55.97 55.79 2k78 s LYS 93 Cb -0.08 -2.86 0.33 0.00 -1.51 0.00 0.00 37.83 33.70 2k78 s LYS 93 CO -0.21 0.48 0.76 -1.71 -0.36 0.00 0.00 175.35 174.31 2k78 n ASN 94 N 0.16 0.20 -0.03 1.43 4.05 0.29 -4.92 115.26 116.43 2k78 n ASN 94 Ca -0.03 -3.07 0.20 0.00 0.45 0.00 0.00 54.58 52.13 2k78 n ASN 94 Cb 0.52 -0.20 0.67 0.00 1.23 0.00 0.00 39.78 42.00 2k78 n ASN 94 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 177.26 174.95 2k78 h THR 95 N 1.47 0.74 -0.06 -0.44 2.02 -1.95 0.40 112.91 115.09 2k78 h THR 95 Ca 0.06 -0.02 -0.00 0.00 0.77 0.00 0.00 66.41 67.22 2k78 h THR 95 Cb 0.98 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 68.06 2k78 h THR 95 CO 0.44 0.01 0.02 0.00 0.37 0.00 0.00 175.52 176.36 2k78 h ALA 96 N 1.71 0.08 -0.59 6.16 0.00 -1.92 -2.86 119.26 121.84 2k78 h ALA 96 Ca 0.28 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2k78 h ALA 96 Cb 1.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2k78 h ALA 96 CO -0.02 -0.34 0.00 1.63 0.00 0.00 0.00 179.25 180.52 2k78 n LYS 97 N -4.96 2.38 -3.35 0.00 5.02 -0.58 -4.95 118.16 111.72 2k78 n LYS 97 Ca -0.06 -2.14 -0.17 0.00 -2.02 0.00 0.00 58.31 53.92 2k78 n LYS 97 Cb 0.11 -1.46 0.08 0.00 -0.02 0.00 0.00 35.03 33.73 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 1.24 -4.56 -3.84 4.39 -0.08 0.13 -4.92 116.55 108.91 2k78 n ASP 98 Ca 0.20 -0.69 -0.09 0.00 -1.51 0.00 0.00 54.79 52.70 2k78 n ASP 98 Cb 0.50 -5.09 -0.07 0.00 2.34 0.00 0.00 41.12 38.81 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 -4.88 0.84 0.12 -0.67 2.02 -0.44 -2.60 118.70 113.10 2k78 s GLU 99 Ca 0.26 -0.89 -0.25 0.00 0.02 0.00 0.00 54.97 54.12 2k78 s GLU 99 Cb -0.04 0.35 0.07 0.00 0.10 0.00 0.00 34.13 34.61 2k78 s GLU 99 CO 0.74 -0.27 0.76 0.50 0.02 0.00 0.00 175.26 177.01 2k78 s ARG 100 N -3.66 1.20 0.03 1.61 3.52 -0.97 0.10 118.95 120.78 2k78 s ARG 100 Ca 0.03 -0.52 -0.02 0.00 -0.13 0.00 0.00 55.73 55.10 2k78 s ARG 100 Cb 0.04 0.50 -0.02 0.00 -1.56 0.00 0.00 34.95 33.91 2k78 s ARG 100 CO -0.10 -0.53 0.01 0.99 -0.81 0.00 0.00 175.30 174.85 2k78 s THR 101 N -3.51 0.13 -0.05 4.11 2.01 -0.42 0.17 115.64 118.08 2k78 s THR 101 Ca 0.05 -1.09 -0.08 0.00 0.31 0.00 0.00 61.69 60.88 2k78 s THR 101 Cb -0.02 -0.62 0.02 0.00 0.01 0.00 0.00 72.50 71.88 2k78 s THR 101 CO -0.07 -0.60 0.19 -0.94 -0.69 0.00 0.00 174.62 172.51 2k78 s SER 102 N -1.84 -0.15 0.08 3.53 1.04 -0.62 -2.26 113.70 113.47 2k78 s SER 102 Ca -0.10 0.22 -0.12 0.00 0.48 0.00 0.00 55.95 56.43 2k78 s SER 102 Cb -0.05 0.35 -0.06 0.00 0.10 0.00 0.00 66.02 66.36 2k78 s SER 102 CO -0.03 -0.18 0.44 -0.70 0.98 0.00 0.00 173.24 173.75 2k78 s GLU 103 N -0.40 3.85 0.05 4.02 2.12 -1.19 0.04 118.70 127.18 2k78 s GLU 103 Ca -0.05 0.30 0.07 0.00 0.36 0.00 0.00 54.97 55.65 2k78 s GLU 103 Cb -0.03 -3.04 -0.03 0.00 0.26 0.00 0.00 34.13 31.30 2k78 s GLU 103 CO 0.01 0.57 -0.20 -0.06 -0.54 0.00 0.00 175.26 175.05 2k78 s PHE 104 N -1.34 1.70 -0.19 5.30 0.08 0.25 -3.56 117.98 120.23 2k78 s PHE 104 Ca 0.32 -0.37 -0.09 0.00 0.12 0.00 0.00 56.93 56.91 2k78 s PHE 104 Cb -0.15 -1.01 -0.05 0.00 -0.57 0.00 0.00 43.02 41.25 2k78 s PHE 104 CO 0.17 0.09 0.10 -2.00 -0.10 0.00 0.00 175.22 173.49 2k78 s GLU 105 N -1.23 4.06 -0.01 0.44 2.12 -1.26 -1.36 118.70 121.47 2k78 s GLU 105 Ca 0.06 -0.26 -0.14 0.00 0.36 0.00 0.00 54.97 54.99 2k78 s GLU 105 Cb -0.09 -3.32 0.02 0.00 0.26 0.00 0.00 34.13 31.00 2k78 s GLU 105 CO 0.02 0.32 0.28 0.54 -0.54 0.00 0.00 175.26 175.88 2k78 s VAL 106 N 0.28 0.06 0.32 3.70 0.11 -1.24 -4.71 120.40 118.92 2k78 s VAL 106 Ca 0.07 -0.53 0.08 0.00 -2.93 0.00 0.00 61.98 58.66 2k78 s VAL 106 Cb -0.12 -0.63 0.31 0.00 -1.53 0.00 0.00 36.38 34.42 2k78 s VAL 106 CO -0.01 -0.29 1.77 0.28 -3.33 0.00 0.00 175.10 173.51 2k78 h SER 107 N 3.84 0.73 0.00 3.54 0.02 -1.98 -3.42 113.55 116.27 2k78 h SER 107 Ca -0.30 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 2k78 h SER 107 Cb 1.18 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2k78 h SER 107 CO 0.41 0.21 0.00 0.29 -1.14 0.00 0.00 176.83 176.60 2k78 n LYS 108 N -4.78 0.00 -3.00 3.45 4.76 -1.26 -4.84 118.16 112.48 2k78 n LYS 108 Ca 0.24 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.53 2k78 n LYS 108 Cb 0.64 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.84 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 0.00 -0.64 -3.06 -0.35 -0.00 -1.26 -4.99 117.00 106.70 2k78 n LEU 109 Ca 0.00 -4.38 -0.17 0.00 -0.00 0.00 0.00 56.01 51.46 2k78 n LEU 109 Cb 0.00 0.79 -0.01 0.00 -0.00 0.00 0.00 43.42 44.20 2k78 n LEU 109 CO 0.00 2.16 -0.09 -3.20 -0.00 0.00 0.00 177.39 176.26 2k78 n ASN 110 N 0.64 -0.28 0.00 1.45 2.85 -1.22 -0.89 115.26 117.81 2k78 n ASN 110 Ca 0.17 -3.11 0.00 0.00 -0.11 0.00 0.00 54.58 51.53 2k78 n ASN 110 Cb 0.65 0.11 0.00 0.00 1.24 0.00 0.00 39.78 41.78 2k78 n ASN 110 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2k78 n GLY 111 N 0.65 -2.52 3.80 8.20 0.00 0.27 -4.89 105.19 110.70 2k78 n GLY 111 Ca 0.19 -1.40 -0.36 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.89 4.42 0.03 1.61 -2.85 -1.26 -1.13 119.74 118.66 2k78 s LYS 112 Ca 0.00 1.13 0.01 0.00 -1.00 0.00 0.00 55.97 56.11 2k78 s LYS 112 Cb 0.00 -2.74 -0.02 0.00 -2.06 0.00 0.00 37.83 33.01 2k78 s LYS 112 CO 0.00 0.28 -0.06 0.42 0.10 0.00 0.00 175.35 176.09 2k78 s ILE 113 N -1.66 0.35 -0.16 3.79 1.01 0.34 -4.95 121.20 119.91 2k78 s ILE 113 Ca 0.49 -0.98 -0.29 0.00 0.00 0.00 0.00 60.65 59.87 2k78 s ILE 113 Cb -0.17 -0.45 -0.01 0.00 0.01 0.00 0.00 42.46 41.84 2k78 s ILE 113 CO 0.21 -0.42 1.22 -1.81 0.00 0.00 0.00 174.94 174.14 2k78 s ASP 114 N -1.48 6.99 0.38 3.58 1.01 -1.26 -1.46 116.67 124.42 2k78 s ASP 114 Ca -0.12 1.66 0.05 0.00 0.71 0.00 0.00 52.55 54.85 2k78 s ASP 114 Cb -0.10 -2.54 -0.06 0.00 1.01 0.00 0.00 42.92 41.23 2k78 s ASP 114 CO -0.00 -0.71 0.04 -0.83 0.21 0.00 0.00 175.17 173.88 2k78 s GLY 115 N 1.77 2.34 0.08 0.21 0.00 -1.10 -2.05 107.32 108.58 2k78 s GLY 115 Ca 0.53 -1.96 -0.08 0.00 0.00 0.00 0.00 44.72 43.21 2k78 s GLY 115 CO 0.15 -1.95 0.17 0.54 0.00 0.00 0.00 173.10 172.01 2k78 s LYS 116 N -3.81 0.82 -0.16 2.90 1.02 0.31 -2.99 119.74 117.84 2k78 s LYS 116 Ca 0.33 -0.98 -0.25 0.00 0.02 0.00 0.00 55.97 55.09 2k78 s LYS 116 Cb 0.08 0.33 0.06 0.00 -0.52 0.00 0.00 37.83 37.79 2k78 s LYS 116 CO 0.15 -0.25 0.64 -1.50 -0.92 0.00 0.00 175.35 173.47 2k78 s ILE 117 N -3.85 0.00 0.22 2.17 -1.16 -0.30 0.17 121.20 118.45 2k78 s ILE 117 Ca 0.05 -0.04 0.07 0.00 -0.51 0.00 0.00 60.65 60.22 2k78 s ILE 117 Cb 0.05 -0.92 -0.04 0.00 0.61 0.00 0.00 42.46 42.17 2k78 s ILE 117 CO -0.11 -0.02 0.16 -1.81 -2.81 0.00 0.00 174.94 170.35 2k78 s ASP 118 N -0.33 5.44 0.07 4.50 1.01 -1.10 -1.23 116.67 125.02 2k78 s ASP 118 Ca -0.05 -0.24 0.04 0.00 0.71 0.00 0.00 52.55 53.02 2k78 s ASP 118 Cb -0.03 -1.37 -0.03 0.00 1.01 0.00 0.00 42.92 42.50 2k78 s ASP 118 CO 0.04 0.00 -0.12 -0.69 0.21 0.00 0.00 175.17 174.61 2k78 s VAL 119 N -2.00 1.00 -0.29 -1.27 1.01 -1.08 -1.76 120.40 116.00 2k78 s VAL 119 Ca 0.32 -1.33 0.02 0.00 0.00 0.00 0.00 61.98 60.98 2k78 s VAL 119 Cb -0.09 -1.05 0.16 0.00 0.00 0.00 0.00 36.38 35.40 2k78 s VAL 119 CO 0.24 -0.31 0.40 -0.47 0.00 0.00 0.00 175.10 174.96 2k78 s TYR 120 N -1.50 -0.96 0.09 5.22 5.04 -1.19 -2.68 117.35 121.38 2k78 s TYR 120 Ca -0.02 0.29 0.06 0.00 -2.44 0.00 0.00 57.07 54.96 2k78 s TYR 120 Cb -0.09 -0.18 -0.03 0.00 0.35 0.00 0.00 41.96 42.01 2k78 s TYR 120 CO 0.02 -0.98 -0.15 0.42 -1.34 0.00 0.00 175.55 173.52 2k78 s ILE 121 N 2.53 1.25 -0.33 3.14 1.01 0.43 -4.62 121.20 124.60 2k78 s ILE 121 Ca 0.10 -1.50 0.06 0.00 0.00 0.00 0.00 60.65 59.31 2k78 s ILE 121 Cb -0.13 -1.31 0.19 0.00 0.01 0.00 0.00 42.46 41.23 2k78 s ILE 121 CO -0.30 -0.30 0.62 1.51 0.00 0.00 0.00 174.94 176.47 2k78 s ASP 122 N -2.06 -1.57 0.03 3.58 1.47 -1.25 -0.68 116.67 116.19 2k78 s ASP 122 Ca 0.03 -0.14 -0.15 0.00 1.18 0.00 0.00 52.55 53.47 2k78 s ASP 122 Cb -0.08 1.98 0.05 0.00 -0.34 0.00 0.00 42.92 44.54 2k78 s ASP 122 CO 0.03 -0.25 0.69 -1.84 0.68 0.00 0.00 175.17 174.48 2k78 n GLU 123 N 5.06 0.21 -3.01 2.11 0.28 -1.12 -5.00 120.64 119.17 2k78 n GLU 123 Ca 0.07 -0.60 -0.43 0.00 -0.16 0.00 0.00 57.16 56.03 2k78 n GLU 123 Cb 0.55 0.90 -0.05 0.00 1.43 0.00 0.00 31.44 34.28 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 -2.02 3.18 -0.82 3.44 3.01 -1.26 0.56 119.74 125.83 2k78 s LYS 124 Ca 0.16 -0.73 -0.25 0.00 -1.01 0.00 0.00 55.97 54.13 2k78 s LYS 124 Cb -0.01 -4.12 0.02 0.00 -1.01 0.00 0.00 37.83 32.70 2k78 s LYS 124 CO 0.01 -1.43 1.53 0.08 0.51 0.00 0.00 175.35 176.06 2k78 s VAL 125 N 3.26 3.67 -1.22 3.17 1.01 0.41 -3.76 120.40 126.94 2k78 s VAL 125 Ca 0.20 -0.08 -0.05 0.00 0.00 0.00 0.00 61.98 62.06 2k78 s VAL 125 Cb -0.17 -4.64 0.01 0.00 0.00 0.00 0.00 36.38 31.57 2k78 s VAL 125 CO 0.13 -1.57 1.04 -3.20 0.00 0.00 0.00 175.10 171.50 2k78 n ASN 126 N 10.54 -4.33 -0.02 3.32 4.05 -1.26 -2.46 115.26 125.10 2k78 n ASN 126 Ca 0.20 -0.54 -0.00 0.00 0.45 0.00 0.00 54.58 54.69 2k78 n ASN 126 Cb 0.50 -4.82 -0.00 0.00 1.23 0.00 0.00 39.78 36.69 2k78 n ASN 126 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2k78 n GLY 127 N -1.57 0.37 2.74 8.20 0.00 -1.25 -5.03 105.19 108.65 2k78 n GLY 127 Ca -0.12 -0.88 -0.18 0.00 0.00 0.00 0.00 46.02 44.84 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 -4.02 0.22 -0.39 1.61 1.02 -1.03 -5.08 119.74 112.07 2k78 s LYS 128 Ca 0.00 0.11 -0.33 0.00 0.02 0.00 0.00 55.97 55.77 2k78 s LYS 128 Cb -0.00 -1.10 -0.11 0.00 -0.52 0.00 0.00 37.83 36.10 2k78 s LYS 128 CO 0.00 -0.74 2.25 -2.30 -0.92 0.00 0.00 175.35 173.64 2k78 n PRO 129 N 5.31 1.09 -3.87 -1.68 -0.02 -1.26 0.15 135.00 134.74 2k78 n PRO 129 Ca -0.05 0.27 -0.35 0.00 -2.02 0.00 0.00 63.50 61.34 2k78 n PRO 129 Cb 0.49 -2.58 -0.14 0.00 -0.02 0.00 0.00 33.50 31.25 2k78 n PRO 129 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2k78 s PHE 130 N 8.05 3.00 -0.28 6.00 5.36 0.19 -4.85 117.98 135.46 2k78 s PHE 130 Ca 1.09 -0.87 -0.08 0.00 -0.96 0.00 0.00 56.93 56.12 2k78 s PHE 130 Cb -0.76 -2.14 -0.01 0.00 -0.34 0.00 0.00 43.02 39.77 2k78 s PHE 130 CO 0.45 -0.52 0.10 0.15 -1.46 0.00 0.00 175.22 173.93 2k78 s LYS 131 N 1.50 3.39 -0.13 10.12 3.01 -1.26 -2.80 119.74 133.57 2k78 s LYS 131 Ca 0.05 -0.66 0.00 0.00 -1.01 0.00 0.00 55.97 54.36 2k78 s LYS 131 Cb -0.15 -3.40 0.02 0.00 -1.01 0.00 0.00 37.83 33.29 2k78 s LYS 131 CO -0.02 -0.33 -0.12 -0.47 0.51 0.00 0.00 175.35 174.92 2k78 s TYR 132 N 1.58 1.88 -0.37 3.18 5.04 0.14 -4.96 117.35 123.85 2k78 s TYR 132 Ca 0.05 -0.99 0.01 0.00 -2.44 0.00 0.00 57.07 53.69 2k78 s TYR 132 Cb -0.16 -1.43 0.18 0.00 0.35 0.00 0.00 41.96 40.90 2k78 s TYR 132 CO 0.04 -0.57 0.81 0.34 -1.34 0.00 0.00 175.55 174.82 2k78 s ASP 133 N 1.45 -1.03 0.00 4.32 2.15 -1.25 0.16 116.67 122.48 2k78 s ASP 133 Ca 0.02 -0.49 0.00 0.00 0.43 0.00 0.00 52.55 52.52 2k78 s ASP 133 Cb -0.13 1.33 0.00 0.00 -0.30 0.00 0.00 42.92 43.82 2k78 s ASP 133 CO -0.08 -0.12 0.00 1.57 -0.17 0.00 0.00 175.17 176.37 2k78 n HIS 134 N 4.17 -0.36 -3.91 -5.34 -0.00 -1.09 -5.00 115.22 103.69 2k78 n HIS 134 Ca 0.09 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 57.97 2k78 n HIS 134 Cb 0.59 0.00 -0.13 0.00 -0.12 0.00 0.00 29.99 30.33 2k78 n HIS 134 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2k78 s HIS 135 N -4.70 3.23 0.82 1.57 2.46 -1.26 -2.64 115.29 114.77 2k78 s HIS 135 Ca 0.00 -3.19 -0.09 0.00 0.47 0.00 0.00 55.06 52.25 2k78 s HIS 135 Cb 0.00 -2.70 0.18 0.00 -0.13 0.00 0.00 32.58 29.93 2k78 s HIS 135 CO 0.00 -0.67 1.11 0.66 -2.47 0.00 0.00 174.74 173.37 2k78 n TYR 136 N 2.69 -3.55 -4.01 3.88 4.01 -0.37 -4.90 117.16 114.92 2k78 n TYR 136 Ca 0.11 -1.35 -0.10 0.00 -0.16 0.00 0.00 57.90 56.41 2k78 n TYR 136 Cb 0.34 -0.84 -0.05 0.00 -0.31 0.00 0.00 39.34 38.47 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 -5.24 0.01 0.17 7.72 2.20 -1.26 -1.15 114.94 117.39 2k78 s ASN 137 Ca 0.67 -1.00 -0.19 0.00 -0.94 0.00 0.00 52.86 51.40 2k78 s ASN 137 Cb -0.03 0.59 0.04 0.00 -2.00 0.00 0.00 41.25 39.86 2k78 s ASN 137 CO 0.46 -1.16 0.52 0.27 -2.94 0.00 0.00 177.10 174.25 2k78 s ILE 138 N -3.88 0.03 -0.24 0.54 -4.36 -1.16 -4.55 121.20 107.58 2k78 s ILE 138 Ca 0.24 -0.51 -0.18 0.00 -0.26 0.00 0.00 60.65 59.93 2k78 s ILE 138 Cb -0.01 -1.31 -0.03 0.00 1.25 0.00 0.00 42.46 42.37 2k78 s ILE 138 CO 0.10 -0.14 0.54 -0.89 0.24 0.00 0.00 174.94 174.79 2k78 s THR 139 N -3.82 5.06 0.34 8.37 2.01 -0.76 -2.71 115.64 124.13 2k78 s THR 139 Ca 0.05 0.95 -0.06 0.00 0.31 0.00 0.00 61.69 62.93 2k78 s THR 139 Cb -0.00 -3.85 -0.05 0.00 0.01 0.00 0.00 72.50 68.60 2k78 s THR 139 CO -0.08 0.10 0.63 -0.31 -0.69 0.00 0.00 174.62 174.27 2k78 s TYR 140 N 2.15 3.48 -0.29 4.92 1.51 -0.53 -0.45 117.35 128.13 2k78 s TYR 140 Ca 0.23 0.76 -0.02 0.00 -1.01 0.00 0.00 57.07 57.04 2k78 s TYR 140 Cb -0.16 -2.21 0.12 0.00 -0.11 0.00 0.00 41.96 39.61 2k78 s TYR 140 CO 0.09 0.06 0.24 0.15 -1.11 0.00 0.00 175.55 174.98 2k78 s LYS 141 N -3.73 0.28 0.11 -0.62 -0.14 0.43 -0.51 119.74 115.56 2k78 s LYS 141 Ca 0.46 -0.29 -0.13 0.00 -1.36 0.00 0.00 55.97 54.65 2k78 s LYS 141 Cb -0.10 -0.83 -0.06 0.00 -1.68 0.00 0.00 37.83 35.15 2k78 s LYS 141 CO 0.31 -1.03 0.49 -0.06 -0.76 0.00 0.00 175.35 174.31 2k78 s PHE 142 N 2.26 3.63 -0.30 3.18 0.08 -0.28 0.14 117.98 126.68 2k78 s PHE 142 Ca 0.09 1.00 -0.01 0.00 0.12 0.00 0.00 56.93 58.13 2k78 s PHE 142 Cb -0.15 -2.31 0.10 0.00 -0.57 0.00 0.00 43.02 40.09 2k78 s PHE 142 CO -0.34 0.49 0.09 -0.80 -0.10 0.00 0.00 175.22 174.57 2k78 s ASN 143 N -1.61 3.89 0.00 1.36 0.01 0.45 0.97 114.94 120.01 2k78 s ASN 143 Ca 0.34 -1.53 0.00 0.00 -0.71 0.00 0.00 52.86 50.96 2k78 s ASN 143 Cb -0.15 -0.79 0.00 0.00 0.41 0.00 0.00 41.25 40.72 2k78 s ASN 143 CO 0.18 -0.41 0.00 0.61 -1.51 0.00 0.00 177.10 175.97 2k78 n GLY 144 N 4.91 3.16 3.77 0.66 0.00 -0.07 -2.67 105.19 114.94 2k78 n GLY 144 Ca -0.03 -0.24 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 2k78 n GLY 144 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k78 s PRO 145 N 3.79 4.21 -0.21 1.61 0.04 -1.26 -4.69 135.00 138.50 2k78 s PRO 145 Ca 0.00 2.42 -0.18 0.00 0.04 0.00 0.00 61.00 63.28 2k78 s PRO 145 Cb 0.00 -3.03 -0.15 0.00 0.04 0.00 0.00 34.50 31.36 2k78 s PRO 145 CO 0.00 -0.43 0.04 2.41 0.04 0.00 0.00 177.00 179.06 2k78 n THR 146 N 1.17 1.51 0.00 1.26 -1.04 -1.26 -4.28 114.28 111.65 2k78 n THR 146 Ca 0.03 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 2k78 n THR 146 Cb 0.40 -2.09 0.00 0.00 -1.82 0.00 0.00 70.33 66.82 2k78 n THR 146 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 2k78 n ASP 147 N -4.44 0.00 0.00 8.00 5.75 -1.26 -4.89 116.55 119.71 2k78 n ASP 147 Ca -0.31 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.47 2k78 n ASP 147 Cb 0.64 0.19 0.00 0.00 -1.03 0.00 0.00 41.12 40.92 2k78 n ASP 147 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 2k78 n VAL 148 N -2.40 0.00 0.00 2.12 0.31 -1.26 -4.13 118.33 112.97 2k78 n VAL 148 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2k78 n VAL 148 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2k78 n VAL 148 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k78 n ALA 149 N 8.20 0.16 -0.93 3.52 0.00 -1.26 -5.29 120.51 124.91 2k78 n ALA 149 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2k78 n ALA 149 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2k78 n ALA 149 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91