#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k78 s ALA 26 N 0.00 3.75 -1.60 -0.43 0.00 -1.26 -4.26 121.76 117.97 2k78 s ALA 26 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.29 2k78 s ALA 26 Cb 0.00 -1.99 0.00 0.00 0.00 0.00 0.00 23.12 21.13 2k78 s ALA 26 CO 0.00 0.45 0.00 0.09 0.00 0.00 0.00 175.76 176.30 2k78 n ASN 27 N 2.55 -5.07 -2.70 0.00 3.02 -1.26 -4.82 115.26 106.98 2k78 n ASN 27 Ca -0.19 0.15 -0.06 0.00 -0.03 0.00 0.00 54.58 54.45 2k78 n ASN 27 Cb 0.54 -4.31 0.08 0.00 -0.61 0.00 0.00 39.78 35.48 2k78 n ASN 27 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k78 n ALA 28 N -1.40 2.49 0.03 5.41 0.00 -1.26 -4.93 120.51 120.84 2k78 n ALA 28 Ca -0.20 -2.18 -0.14 0.00 0.00 0.00 0.00 53.44 50.92 2k78 n ALA 28 Cb 0.64 -0.94 -0.03 0.00 0.00 0.00 0.00 19.45 19.13 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 2.35 0.43 -2.91 0.00 0.00 -1.88 -3.37 119.26 113.87 2k78 h ALA 29 Ca -0.21 -0.63 -0.37 0.00 0.00 0.00 0.00 54.91 53.69 2k78 h ALA 29 Cb 1.25 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 2k78 h ALA 29 CO 0.17 0.74 -0.46 -0.25 0.00 0.00 0.00 179.25 179.46 2k78 n ASP 30 N -3.85 -5.30 -3.56 0.00 8.00 -1.26 -4.92 116.55 105.67 2k78 n ASP 30 Ca -0.06 0.11 -0.17 0.00 0.71 0.00 0.00 54.79 55.37 2k78 n ASP 30 Cb 0.76 -4.47 -0.06 0.00 -0.02 0.00 0.00 41.12 37.32 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 -0.66 0.00 -2.24 1.04 -1.26 -1.05 113.70 107.41 2k78 s SER 31 Ca 0.00 0.86 0.00 0.00 0.48 0.00 0.00 55.95 57.29 2k78 s SER 31 Cb 0.00 0.74 0.00 0.00 0.10 0.00 0.00 66.02 66.86 2k78 s SER 31 CO 0.00 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.31 2k78 n GLY 32 N 1.34 -0.38 3.49 7.32 0.00 -0.55 -4.98 105.19 111.43 2k78 n GLY 32 Ca -0.18 -0.97 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 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 4.51 0.31 2.61 -4.23 -1.26 0.15 115.64 115.74 2k78 s THR 33 Ca 0.00 -0.02 0.01 0.00 -1.18 0.00 0.00 61.69 60.50 2k78 s THR 33 Cb 0.00 -4.50 -0.03 0.00 1.34 0.00 0.00 72.50 69.31 2k78 s THR 33 CO 0.00 -1.08 0.51 -0.22 -0.54 0.00 0.00 174.62 173.29 2k78 s LEU 34 N 3.61 4.08 0.24 4.79 2.96 0.72 -4.88 118.68 130.20 2k78 s LEU 34 Ca 0.25 0.41 -0.30 0.00 -0.22 0.00 0.00 54.13 54.27 2k78 s LEU 34 Cb -0.15 -3.25 -0.09 0.00 0.50 0.00 0.00 46.19 43.20 2k78 s LEU 34 CO 0.16 -0.23 0.98 0.20 -1.32 0.00 0.00 176.35 176.14 2k78 s ASN 35 N -3.89 7.55 -0.09 3.68 -0.87 -1.06 -2.43 114.94 117.85 2k78 s ASN 35 Ca 0.39 2.01 -0.30 0.00 -1.57 0.00 0.00 52.86 53.40 2k78 s ASN 35 Cb -0.10 -2.61 0.10 0.00 -0.02 0.00 0.00 41.25 38.62 2k78 s ASN 35 CO 0.34 0.08 0.87 -0.72 -2.57 0.00 0.00 177.10 175.09 2k78 s TYR 36 N -1.09 -0.46 0.12 2.20 1.13 -1.26 0.18 117.35 118.17 2k78 s TYR 36 Ca 0.42 0.69 -0.03 0.00 -1.41 0.00 0.00 57.07 56.74 2k78 s TYR 36 Cb -0.27 0.46 0.01 0.00 -1.10 0.00 0.00 41.96 41.06 2k78 s TYR 36 CO 0.34 -0.48 0.22 -1.91 -2.51 0.00 0.00 175.55 171.20 2k78 n GLU 37 N 0.56 0.31 -4.26 -3.49 2.13 0.25 -4.76 120.64 111.38 2k78 n GLU 37 Ca -0.13 -0.81 -0.18 0.00 0.66 0.00 0.00 57.16 56.70 2k78 n GLU 37 Cb 0.59 0.90 -0.08 0.00 0.27 0.00 0.00 31.44 33.12 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 -2.64 0.00 0.06 6.31 -7.23 -1.26 0.11 120.40 115.74 2k78 s VAL 38 Ca 0.07 -1.95 -0.11 0.00 -1.81 0.00 0.00 61.98 58.18 2k78 s VAL 38 Cb -0.01 -2.52 0.01 0.00 0.56 0.00 0.00 36.38 34.42 2k78 s VAL 38 CO 0.05 0.00 0.24 -0.31 -0.31 0.00 0.00 175.10 174.77 2k78 s TYR 39 N -3.44 0.02 -0.00 2.82 2.02 0.57 -3.90 117.35 115.44 2k78 s TYR 39 Ca 0.39 -0.29 -0.30 0.00 -0.37 0.00 0.00 57.07 56.51 2k78 s TYR 39 Cb 0.02 0.02 -0.06 0.00 -0.40 0.00 0.00 41.96 41.54 2k78 s TYR 39 CO 0.26 -0.50 1.59 0.21 -1.57 0.00 0.00 175.55 175.53 2k78 s LYS 40 N -3.03 4.21 0.54 -0.62 2.36 0.24 -1.89 119.74 121.55 2k78 s LYS 40 Ca -0.02 2.17 -0.19 0.00 -2.55 0.00 0.00 55.97 55.39 2k78 s LYS 40 Cb 0.01 -3.76 -0.09 0.00 -1.05 0.00 0.00 37.83 32.94 2k78 s LYS 40 CO -0.06 -0.75 0.63 0.98 1.55 0.00 0.00 175.35 177.70 2k78 n TYR 41 N 6.23 -0.30 -0.85 4.03 9.36 -1.26 -0.80 117.16 133.57 2k78 n TYR 41 Ca 0.16 0.47 0.00 0.00 3.32 0.00 0.00 57.90 61.85 2k78 n TYR 41 Cb 0.42 -2.01 0.00 0.00 -0.63 0.00 0.00 39.34 37.13 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 0.42 -1.20 0.00 2.98 2.85 -1.26 -4.92 115.26 114.12 2k78 n ASN 42 Ca 0.12 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.59 2k78 n ASN 42 Cb 0.46 -1.26 0.00 0.00 1.24 0.00 0.00 39.78 40.22 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 -2.16 0.00 -0.76 -0.44 -2.24 0.02 -5.07 114.28 103.63 2k78 n THR 43 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2k78 n THR 43 Cb 0.06 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 2k78 n THR 43 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2k78 n ASN 44 N 0.00 0.45 -4.09 3.42 4.13 -1.26 -4.80 115.26 113.10 2k78 n ASN 44 Ca 0.00 -1.20 -0.14 0.00 1.68 0.00 0.00 54.58 54.92 2k78 n ASN 44 Cb 0.00 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.13 2k78 n ASN 44 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2k78 s ASP 45 N -0.20 1.01 0.12 6.41 -1.08 -1.26 -4.87 116.67 116.79 2k78 s ASP 45 Ca 0.00 -0.60 -0.30 0.00 -0.52 0.00 0.00 52.55 51.13 2k78 s ASP 45 Cb 0.00 0.03 -0.06 0.00 -1.46 0.00 0.00 42.92 41.43 2k78 s ASP 45 CO 0.00 -0.20 1.05 -0.89 0.52 0.00 0.00 175.17 175.65 2k78 s THR 46 N -1.53 4.24 0.00 1.71 2.01 -1.25 0.79 115.64 121.61 2k78 s THR 46 Ca -0.07 1.82 0.00 0.00 0.31 0.00 0.00 61.69 63.74 2k78 s THR 46 Cb -0.09 -4.16 0.00 0.00 0.01 0.00 0.00 72.50 68.26 2k78 s THR 46 CO 0.00 0.26 0.00 -0.24 -0.69 0.00 0.00 174.62 173.95 2k78 n SER 47 N 2.93 1.98 0.01 3.53 2.88 -1.26 -4.78 113.62 118.90 2k78 n SER 47 Ca 0.04 -0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.50 2k78 n SER 47 Cb 0.48 0.55 0.00 0.00 -0.75 0.00 0.00 64.21 64.49 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 -0.75 0.01 0.09 2.46 -0.00 -1.26 -4.83 119.36 115.08 2k78 n ILE 48 Ca 0.00 0.00 0.20 0.00 -0.00 0.00 0.00 62.75 62.95 2k78 n ILE 48 Cb 0.00 -0.18 0.65 0.00 -0.00 0.00 0.00 39.64 40.10 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 2.13 0.00 -1.39 0.00 -1.95 0.32 119.26 118.37 2k78 h ALA 49 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2k78 h ALA 49 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2k78 h ALA 49 CO 0.00 -0.85 0.00 0.27 0.00 0.00 0.00 179.25 178.67 2k78 n ASN 50 N -3.36 0.45 -1.61 0.00 0.23 -1.26 -1.97 115.26 107.74 2k78 n ASN 50 Ca 0.08 0.65 0.09 0.00 -0.53 0.00 0.00 54.58 54.87 2k78 n ASN 50 Cb 0.79 -0.73 0.36 0.00 -2.08 0.00 0.00 39.78 38.12 2k78 n ASN 50 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2k78 n ASP 51 N -2.04 4.80 -0.00 0.53 8.00 0.11 -4.24 116.55 123.71 2k78 n ASP 51 Ca 0.01 -2.49 0.00 0.00 0.71 0.00 0.00 54.79 53.02 2k78 n ASP 51 Cb 0.14 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.65 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 1.07 0.00 -4.02 1.24 4.02 -0.83 -5.01 117.16 113.63 2k78 n TYR 52 Ca 0.26 -0.08 -0.31 0.00 -0.01 0.00 0.00 57.90 57.75 2k78 n TYR 52 Cb 0.91 -0.01 -0.15 0.00 -0.02 0.00 0.00 39.34 40.07 2k78 n TYR 52 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 2k78 s PHE 53 N -0.16 3.39 -0.48 -0.72 0.08 -1.23 -2.92 117.98 115.95 2k78 s PHE 53 Ca 0.00 -2.60 -0.28 0.00 0.12 0.00 0.00 56.93 54.17 2k78 s PHE 53 Cb 0.00 -2.38 -0.00 0.00 -0.57 0.00 0.00 43.02 40.06 2k78 s PHE 53 CO 0.00 -0.91 1.60 1.21 -0.10 0.00 0.00 175.22 177.03 2k78 s ASN 54 N 1.04 5.94 0.50 1.36 2.47 -1.26 -4.99 114.94 120.01 2k78 s ASN 54 Ca 0.02 0.67 0.01 0.00 0.42 0.00 0.00 52.86 53.98 2k78 s ASN 54 Cb -0.19 -2.54 0.02 0.00 -1.45 0.00 0.00 41.25 37.09 2k78 s ASN 54 CO -0.07 -1.78 0.72 -1.59 -3.72 0.00 0.00 177.10 170.66 2k78 s LYS 55 N 5.73 2.76 0.61 0.43 -2.85 -1.26 -4.56 119.74 120.61 2k78 s LYS 55 Ca 0.64 -0.68 -0.10 0.00 -1.00 0.00 0.00 55.97 54.83 2k78 s LYS 55 Cb -0.15 -2.53 0.14 0.00 -2.06 0.00 0.00 37.83 33.24 2k78 s LYS 55 CO 0.28 -0.52 0.76 -0.35 0.10 0.00 0.00 175.35 175.63 2k78 n PRO 56 N -2.21 -1.08 -3.28 1.78 -0.04 -1.26 -5.15 135.00 123.76 2k78 n PRO 56 Ca 0.05 -1.18 -0.19 0.00 -0.04 0.00 0.00 63.50 62.14 2k78 n PRO 56 Cb 0.59 -0.85 -0.00 0.00 -0.04 0.00 0.00 33.50 33.20 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 -3.78 4.37 -0.29 0.55 0.00 -1.02 -4.92 121.76 116.66 2k78 s ALA 57 Ca 0.44 -1.79 -0.09 0.00 0.00 0.00 0.00 51.96 50.52 2k78 s ALA 57 Cb -0.02 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.76 2k78 s ALA 57 CO 0.32 -0.34 0.14 0.15 0.00 0.00 0.00 175.76 176.03 2k78 s LYS 58 N -4.30 3.48 0.36 0.00 1.02 -1.14 -0.20 119.74 118.97 2k78 s LYS 58 Ca 0.52 -0.61 0.03 0.00 0.02 0.00 0.00 55.97 55.92 2k78 s LYS 58 Cb -0.06 -3.52 -0.02 0.00 -0.52 0.00 0.00 37.83 33.71 2k78 s LYS 58 CO 0.31 -0.34 0.54 1.52 -0.92 0.00 0.00 175.35 176.47 2k78 s TYR 59 N 1.63 3.29 -0.24 3.18 1.13 0.12 -1.22 117.35 125.25 2k78 s TYR 59 Ca 0.05 0.09 -0.07 0.00 -1.41 0.00 0.00 57.07 55.73 2k78 s TYR 59 Cb -0.16 -2.02 0.11 0.00 -1.10 0.00 0.00 41.96 38.79 2k78 s TYR 59 CO 0.06 -0.03 0.50 -1.50 -2.51 0.00 0.00 175.55 172.07 2k78 s ILE 60 N -2.31 -0.78 -0.02 -3.49 2.07 -0.96 -1.48 121.20 114.24 2k78 s ILE 60 Ca 0.43 0.09 0.00 0.00 -1.41 0.00 0.00 60.65 59.77 2k78 s ILE 60 Cb -0.10 -0.80 0.02 0.00 0.13 0.00 0.00 42.46 41.72 2k78 s ILE 60 CO 0.34 0.03 0.01 -0.54 -1.91 0.00 0.00 174.94 172.88 2k78 s LYS 61 N 2.71 0.10 -0.70 3.50 1.02 -0.22 0.96 119.74 127.12 2k78 s LYS 61 Ca -0.01 0.11 0.04 0.00 0.02 0.00 0.00 55.97 56.13 2k78 s LYS 61 Cb -0.12 -0.31 0.30 0.00 -0.52 0.00 0.00 37.83 37.18 2k78 s LYS 61 CO -0.15 -0.13 1.01 1.17 -0.92 0.00 0.00 175.35 176.33 2k78 n LYS 62 N 3.99 3.29 -2.97 1.68 4.81 -0.58 -4.30 118.16 124.08 2k78 n LYS 62 Ca -0.25 -4.74 -0.01 0.00 -0.87 0.00 0.00 58.31 52.44 2k78 n LYS 62 Cb 0.52 -2.30 -0.01 0.00 0.02 0.00 0.00 35.03 33.26 2k78 n LYS 62 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2k78 n ASN 63 N 0.41 -5.99 0.00 3.14 3.02 -1.26 -4.34 115.26 110.24 2k78 n ASN 63 Ca 0.32 0.95 0.00 0.00 -0.03 0.00 0.00 54.58 55.81 2k78 n ASN 63 Cb 0.38 -2.76 0.00 0.00 -0.61 0.00 0.00 39.78 36.79 2k78 n ASN 63 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k78 n GLY 64 N 1.81 1.01 3.61 7.41 0.00 -1.26 -5.06 105.19 112.70 2k78 n GLY 64 Ca -0.08 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 -0.67 0.36 -0.17 1.61 -2.85 -1.26 -5.18 119.74 111.58 2k78 s LYS 65 Ca 0.00 0.10 -0.26 0.00 -1.00 0.00 0.00 55.97 54.81 2k78 s LYS 65 Cb 0.00 0.17 0.07 0.00 -2.06 0.00 0.00 37.83 36.01 2k78 s LYS 65 CO 0.00 -0.11 0.66 -0.48 0.10 0.00 0.00 175.35 175.52 2k78 s LEU 66 N -1.03 -0.55 0.00 2.77 -0.00 -1.26 -1.53 118.68 117.09 2k78 s LEU 66 Ca 0.03 1.07 0.00 0.00 -0.00 0.00 0.00 54.13 55.23 2k78 s LEU 66 Cb -0.01 2.36 0.00 0.00 -0.00 0.00 0.00 46.19 48.54 2k78 s LEU 66 CO -0.03 -0.38 0.00 -1.22 -0.00 0.00 0.00 176.35 174.72 2k78 n TYR 67 N 1.98 -0.01 -3.59 3.48 4.02 0.27 -4.16 117.16 119.15 2k78 n TYR 67 Ca -0.16 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.68 2k78 n TYR 67 Cb 0.56 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.86 2k78 n TYR 67 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2k78 s VAL 68 N -1.27 0.00 -0.00 -0.72 0.11 -0.94 -2.27 120.40 115.30 2k78 s VAL 68 Ca 0.00 -0.17 -0.02 0.00 -2.93 0.00 0.00 61.98 58.86 2k78 s VAL 68 Cb 0.00 -1.35 -0.00 0.00 -1.53 0.00 0.00 36.38 33.50 2k78 s VAL 68 CO 0.00 0.00 0.04 0.00 -3.33 0.00 0.00 175.10 171.81 2k78 s GLN 69 N -2.89 0.21 0.08 1.54 -2.07 -0.35 0.78 119.66 116.95 2k78 s GLN 69 Ca 0.09 -0.21 0.08 0.00 -1.82 0.00 0.00 55.36 53.50 2k78 s GLN 69 Cb -0.00 0.08 -0.04 0.00 -1.09 0.00 0.00 33.01 31.96 2k78 s GLN 69 CO -0.05 -0.04 -0.19 0.42 -1.32 0.00 0.00 175.29 174.11 2k78 s ILE 70 N -0.65 2.74 -0.01 3.63 1.09 -0.68 -2.89 121.20 124.43 2k78 s ILE 70 Ca -0.07 -1.37 -0.20 0.00 -1.10 0.00 0.00 60.65 57.91 2k78 s ILE 70 Cb -0.04 -2.20 -0.05 0.00 -1.06 0.00 0.00 42.46 39.11 2k78 s ILE 70 CO -0.00 0.22 0.58 -0.89 -0.10 0.00 0.00 174.94 174.75 2k78 s THR 71 N -1.02 4.94 -0.27 2.92 2.01 -1.26 -2.21 115.64 120.74 2k78 s THR 71 Ca 0.16 1.21 -0.10 0.00 0.31 0.00 0.00 61.69 63.27 2k78 s THR 71 Cb -0.10 -3.92 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 2k78 s THR 71 CO 0.07 0.41 0.15 -0.69 -0.69 0.00 0.00 174.62 173.87 2k78 s VAL 72 N -0.14 4.93 -0.14 3.82 1.01 0.42 -4.07 120.40 126.23 2k78 s VAL 72 Ca 0.31 0.01 -0.08 0.00 0.00 0.00 0.00 61.98 62.22 2k78 s VAL 72 Cb -0.18 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 2k78 s VAL 72 CO 0.17 0.26 0.14 0.20 0.00 0.00 0.00 175.10 175.86 2k78 s ASN 73 N 1.70 6.32 -0.25 3.32 -0.87 -1.15 -1.86 114.94 122.16 2k78 s ASN 73 Ca 0.07 0.40 -0.03 0.00 -1.57 0.00 0.00 52.86 51.73 2k78 s ASN 73 Cb -0.16 -2.07 0.01 0.00 -0.02 0.00 0.00 41.25 39.01 2k78 s ASN 73 CO 0.08 0.35 0.05 1.57 -2.57 0.00 0.00 177.10 176.58 2k78 n HIS 74 N 2.39 -3.66 0.16 2.20 -0.00 -1.07 -4.67 115.22 110.57 2k78 n HIS 74 Ca -0.19 1.75 0.04 0.00 0.46 0.00 0.00 57.72 59.78 2k78 n HIS 74 Cb 0.54 -3.66 0.17 0.00 -0.12 0.00 0.00 29.99 26.92 2k78 n HIS 74 CO 0.00 0.00 0.00 0.77 0.46 0.00 0.00 176.34 177.57 2k78 h SER 75 N 3.39 0.00 0.03 0.26 0.02 -1.82 -2.97 113.55 112.46 2k78 h SER 75 Ca -0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 2k78 h SER 75 Cb 0.36 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.90 2k78 h SER 75 CO 0.07 0.45 0.00 -0.74 -1.14 0.00 0.00 176.83 175.47 2k78 h HIS 76 N 0.00 0.00 0.00 3.45 6.17 -1.91 -3.17 115.15 119.69 2k78 h HIS 76 Ca -0.00 0.00 -0.28 0.00 0.71 0.00 0.00 60.37 60.80 2k78 h HIS 76 Cb 1.17 0.00 -0.04 0.00 2.52 0.00 0.00 27.41 31.06 2k78 h HIS 76 CO 0.00 0.00 -1.87 0.91 0.71 0.00 0.00 177.93 177.68 2k78 n TRP 77 N -2.64 0.00 -3.15 5.26 8.01 -1.16 -4.54 117.44 119.22 2k78 n TRP 77 Ca -0.02 0.00 -0.40 0.00 -1.31 0.00 0.00 57.50 55.77 2k78 n TRP 77 Cb 0.06 -0.63 -0.06 0.00 -2.01 0.00 0.00 31.31 28.67 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 -2.39 5.06 -0.02 -0.99 2.07 -1.13 -3.12 121.20 120.68 2k78 s ILE 78 Ca -0.26 1.16 0.04 0.00 -1.41 0.00 0.00 60.65 60.18 2k78 s ILE 78 Cb 0.09 -3.93 -0.25 0.00 0.13 0.00 0.00 42.46 38.51 2k78 s ILE 78 CO 0.33 0.17 0.77 0.00 -1.91 0.00 0.00 174.94 174.29 2k78 h THR 79 N 5.06 1.03 0.00 4.00 1.03 -1.74 -3.42 112.91 118.87 2k78 h THR 79 Ca -0.34 -2.78 0.00 0.00 -0.01 0.00 0.00 66.41 63.28 2k78 h THR 79 Cb 1.16 2.61 0.00 0.00 -1.07 0.00 0.00 68.15 70.84 2k78 h THR 79 CO 0.76 0.72 0.00 0.61 -0.01 0.00 0.00 175.52 177.61 2k78 n GLY 80 N 1.63 -1.26 3.61 2.99 0.00 -1.16 -4.98 105.19 106.02 2k78 n GLY 80 Ca -0.17 -0.94 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 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 -1.08 1.61 -0.09 1.61 -1.94 -1.26 -2.71 119.30 115.44 2k78 s MET 81 Ca 0.00 -1.27 -0.21 0.00 -1.71 0.00 0.00 55.69 52.50 2k78 s MET 81 Cb 0.00 0.48 0.05 0.00 2.01 0.00 0.00 34.83 37.37 2k78 s MET 81 CO 0.00 -0.68 0.49 0.45 -0.01 0.00 0.00 175.02 175.28 2k78 s SER 82 N -3.03 -0.46 0.00 3.03 0.15 0.46 -3.16 113.70 110.69 2k78 s SER 82 Ca 0.22 0.63 -0.01 0.00 0.70 0.00 0.00 55.95 57.49 2k78 s SER 82 Cb -0.01 0.66 -0.01 0.00 -1.71 0.00 0.00 66.02 64.95 2k78 s SER 82 CO 0.10 -0.39 0.02 -0.63 1.20 0.00 0.00 173.24 173.54 2k78 s ILE 83 N -0.68 0.05 0.00 6.45 1.01 -1.07 0.12 121.20 127.07 2k78 s ILE 83 Ca -0.08 -0.38 0.00 0.00 0.00 0.00 0.00 60.65 60.19 2k78 s ILE 83 Cb -0.03 -0.16 0.00 0.00 0.01 0.00 0.00 42.46 42.28 2k78 s ILE 83 CO 0.05 -0.21 0.00 1.21 0.00 0.00 0.00 174.94 175.98 2k78 n GLU 84 N 2.40 -0.20 0.00 2.79 0.00 -1.08 -2.86 120.64 121.69 2k78 n GLU 84 Ca -0.17 0.05 0.00 0.00 0.00 0.00 0.00 57.16 57.04 2k78 n GLU 84 Cb 0.58 -3.48 0.00 0.00 0.00 0.00 0.00 31.44 28.53 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 -1.83 1.16 3.13 8.31 0.00 -1.26 -5.08 105.19 109.62 2k78 n GLY 85 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 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 0.71 0.52 1.61 -3.43 -1.13 -5.15 115.29 106.41 2k78 s HIS 86 Ca 0.00 -1.00 -0.09 0.00 -0.80 0.00 0.00 55.06 53.17 2k78 s HIS 86 Cb 0.00 -0.45 0.13 0.00 -1.43 0.00 0.00 32.58 30.83 2k78 s HIS 86 CO 0.00 -0.27 0.49 1.63 -2.00 0.00 0.00 174.74 174.59 2k78 n LYS 87 N 0.03 -1.77 -3.81 -0.38 4.01 -1.26 -2.59 118.16 112.38 2k78 n LYS 87 Ca -0.13 -0.78 -0.23 0.00 -0.51 0.00 0.00 58.31 56.67 2k78 n LYS 87 Cb 0.61 -0.70 -0.05 0.00 -0.51 0.00 0.00 35.03 34.38 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 -4.11 2.40 -0.09 1.97 -1.05 -1.19 -4.63 118.70 111.99 2k78 s GLU 88 Ca 0.31 -1.68 0.04 0.00 -0.15 0.00 0.00 54.97 53.50 2k78 s GLU 88 Cb -0.03 -2.20 -0.00 0.00 -0.44 0.00 0.00 34.13 31.46 2k78 s GLU 88 CO 0.24 -0.16 -0.24 -0.80 0.95 0.00 0.00 175.26 175.24 2k78 s ASN 89 N -4.03 3.07 -0.49 0.83 -0.87 -1.23 -4.97 114.94 107.25 2k78 s ASN 89 Ca 0.45 -0.55 -0.27 0.00 -1.57 0.00 0.00 52.86 50.92 2k78 s ASN 89 Cb -0.00 -1.34 -0.03 0.00 -0.02 0.00 0.00 41.25 39.86 2k78 s ASN 89 CO 0.25 0.17 1.93 0.27 -2.57 0.00 0.00 177.10 177.15 2k78 s ILE 90 N 0.29 3.34 -0.12 0.60 -5.25 -1.26 -3.00 121.20 115.79 2k78 s ILE 90 Ca -0.17 0.27 0.17 0.00 -0.99 0.00 0.00 60.65 59.92 2k78 s ILE 90 Cb -0.17 -3.68 -0.23 0.00 2.95 0.00 0.00 42.46 41.33 2k78 s ILE 90 CO 0.08 -0.59 0.45 0.00 -1.79 0.00 0.00 174.94 173.10 2k78 n ILE 91 N 7.41 1.22 -3.07 8.37 3.06 -0.91 -4.87 119.36 130.57 2k78 n ILE 91 Ca 0.24 -0.76 0.03 0.00 -2.50 0.00 0.00 62.75 59.76 2k78 n ILE 91 Cb 0.50 -0.61 -0.00 0.00 0.54 0.00 0.00 39.64 40.07 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 -5.59 -1.01 0.07 9.51 0.01 -1.24 -4.97 113.70 110.48 2k78 s SER 92 Ca -0.07 -0.21 -0.04 0.00 1.31 0.00 0.00 55.95 56.94 2k78 s SER 92 Cb 0.08 1.44 -0.05 0.00 0.21 0.00 0.00 66.02 67.71 2k78 s SER 92 CO 0.83 -0.15 0.30 -0.75 0.41 0.00 0.00 173.24 173.88 2k78 s LYS 93 N 2.36 3.56 -0.28 12.44 2.20 -1.26 -1.89 119.74 136.88 2k78 s LYS 93 Ca 0.17 -0.17 -0.03 0.00 -0.36 0.00 0.00 55.97 55.58 2k78 s LYS 93 Cb -0.03 -2.98 0.11 0.00 -1.51 0.00 0.00 37.83 33.42 2k78 s LYS 93 CO -0.17 0.57 0.19 1.21 -0.36 0.00 0.00 175.35 176.79 2k78 s ASN 94 N -2.18 2.68 0.20 1.43 3.04 -0.25 -4.95 114.94 114.91 2k78 s ASN 94 Ca 0.34 -1.00 0.04 0.00 0.04 0.00 0.00 52.86 52.29 2k78 s ASN 94 Cb -0.13 0.00 0.12 0.00 -1.54 0.00 0.00 41.25 39.71 2k78 s ASN 94 CO 0.22 -0.41 1.47 0.71 -3.04 0.00 0.00 177.10 176.05 2k78 h THR 95 N 6.35 1.46 -0.44 -5.21 1.35 -1.96 0.22 112.91 114.68 2k78 h THR 95 Ca -0.17 -2.35 -0.02 0.00 -0.55 0.00 0.00 66.41 63.32 2k78 h THR 95 Cb 1.05 2.26 -0.02 0.00 -1.73 0.00 0.00 68.15 69.71 2k78 h THR 95 CO 0.39 0.68 0.21 0.00 -0.25 0.00 0.00 175.52 176.55 2k78 h ALA 96 N 1.10 0.57 -0.02 6.62 0.00 -1.96 -2.86 119.26 122.72 2k78 h ALA 96 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2k78 h ALA 96 Cb 1.32 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2k78 h ALA 96 CO 0.11 0.14 -0.28 1.17 0.00 0.00 0.00 179.25 180.39 2k78 n LYS 97 N -4.65 1.40 -3.42 0.00 4.81 -1.22 -4.97 118.16 110.10 2k78 n LYS 97 Ca 0.01 -1.06 -0.17 0.00 -0.87 0.00 0.00 58.31 56.22 2k78 n LYS 97 Cb 0.12 -1.48 0.09 0.00 0.02 0.00 0.00 35.03 33.78 2k78 n LYS 97 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2k78 n ASP 98 N 0.12 -2.21 -3.71 3.14 -0.08 0.65 -4.91 116.55 109.56 2k78 n ASP 98 Ca 0.12 -0.62 -0.12 0.00 -1.51 0.00 0.00 54.79 52.65 2k78 n ASP 98 Cb 0.45 -5.13 -0.13 0.00 2.34 0.00 0.00 41.12 38.66 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 -5.33 0.23 0.31 -0.67 2.02 -0.50 -2.60 118.70 112.15 2k78 s GLU 99 Ca 0.02 0.61 0.03 0.00 0.02 0.00 0.00 54.97 55.64 2k78 s GLU 99 Cb -0.00 -0.09 -0.05 0.00 0.10 0.00 0.00 34.13 34.09 2k78 s GLU 99 CO 0.73 -0.18 0.11 1.03 0.02 0.00 0.00 175.26 176.97 2k78 s ARG 100 N 1.47 1.59 0.04 1.61 0.52 -0.77 -1.10 118.95 122.31 2k78 s ARG 100 Ca -0.08 -1.90 -0.02 0.00 -0.52 0.00 0.00 55.73 53.21 2k78 s ARG 100 Cb -0.10 -0.40 -0.03 0.00 0.52 0.00 0.00 34.95 34.94 2k78 s ARG 100 CO -0.09 -0.34 0.01 0.99 0.02 0.00 0.00 175.30 175.88 2k78 s THR 101 N -3.54 0.18 -0.07 0.02 2.01 -0.79 0.16 115.64 113.60 2k78 s THR 101 Ca 0.35 -1.46 -0.06 0.00 0.31 0.00 0.00 61.69 60.83 2k78 s THR 101 Cb 0.06 -1.15 0.02 0.00 0.01 0.00 0.00 72.50 71.45 2k78 s THR 101 CO 0.15 -0.81 0.19 -0.94 -0.69 0.00 0.00 174.62 172.53 2k78 s SER 102 N -2.49 -0.20 0.10 3.53 1.04 -0.94 -2.14 113.70 112.61 2k78 s SER 102 Ca 0.00 0.39 -0.11 0.00 0.48 0.00 0.00 55.95 56.71 2k78 s SER 102 Cb 0.03 0.37 -0.06 0.00 0.10 0.00 0.00 66.02 66.46 2k78 s SER 102 CO -0.07 -0.08 0.45 -0.70 0.98 0.00 0.00 173.24 173.81 2k78 s GLU 103 N 0.32 3.83 0.03 4.02 2.12 -1.16 -1.69 118.70 126.18 2k78 s GLU 103 Ca -0.02 0.28 0.04 0.00 0.36 0.00 0.00 54.97 55.64 2k78 s GLU 103 Cb -0.03 -2.98 -0.02 0.00 0.26 0.00 0.00 34.13 31.35 2k78 s GLU 103 CO -0.01 0.54 -0.13 -0.06 -0.54 0.00 0.00 175.26 175.05 2k78 s PHE 104 N -1.41 1.15 -0.19 5.30 0.08 0.23 -3.51 117.98 119.63 2k78 s PHE 104 Ca 0.34 -0.34 -0.15 0.00 0.12 0.00 0.00 56.93 56.90 2k78 s PHE 104 Cb -0.14 -0.69 -0.04 0.00 -0.57 0.00 0.00 43.02 41.58 2k78 s PHE 104 CO 0.18 0.02 0.34 -2.00 -0.10 0.00 0.00 175.22 173.66 2k78 s GLU 105 N -1.08 4.19 0.34 0.44 2.12 -1.26 -2.23 118.70 121.21 2k78 s GLU 105 Ca 0.01 0.11 -0.05 0.00 0.36 0.00 0.00 54.97 55.40 2k78 s GLU 105 Cb -0.08 -3.51 0.01 0.00 0.26 0.00 0.00 34.13 30.82 2k78 s GLU 105 CO 0.01 0.05 0.51 0.14 -0.54 0.00 0.00 175.26 175.43 2k78 s VAL 106 N 1.04 0.00 -0.43 3.70 -7.23 -1.26 -4.75 120.40 111.47 2k78 s VAL 106 Ca 0.17 -1.51 -0.22 0.00 -1.81 0.00 0.00 61.98 58.60 2k78 s VAL 106 Cb -0.14 -2.62 0.02 0.00 0.56 0.00 0.00 36.38 34.20 2k78 s VAL 106 CO 0.06 0.00 0.74 -0.55 -0.31 0.00 0.00 175.10 175.04 2k78 s SER 107 N -3.19 6.40 0.48 4.85 0.15 -1.26 -4.77 113.70 116.37 2k78 s SER 107 Ca 0.28 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.83 2k78 s SER 107 Cb -0.01 -2.36 0.00 0.00 -1.71 0.00 0.00 66.02 61.94 2k78 s SER 107 CO 0.18 -0.83 0.00 0.29 1.20 0.00 0.00 173.24 174.08 2k78 n LYS 108 N 6.51 0.00 -2.71 5.44 4.76 -1.26 -4.58 118.16 126.32 2k78 n LYS 108 Ca 0.01 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.37 2k78 n LYS 108 Cb 0.48 0.00 0.08 0.00 -1.84 0.00 0.00 35.03 33.75 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 -0.50 -3.31 -0.35 -0.00 -1.26 -4.91 117.00 106.67 2k78 n LEU 109 Ca 0.00 -3.63 -0.22 0.00 -0.00 0.00 0.00 56.01 52.16 2k78 n LEU 109 Cb 0.00 0.26 -0.08 0.00 -0.00 0.00 0.00 43.42 43.60 2k78 n LEU 109 CO 0.00 1.79 -0.22 0.21 -0.00 0.00 0.00 177.39 179.17 2k78 s ASN 110 N -2.01 1.21 0.00 1.45 3.84 -1.25 -1.17 114.94 117.02 2k78 s ASN 110 Ca 0.25 -2.35 0.00 0.00 0.21 0.00 0.00 52.86 50.96 2k78 s ASN 110 Cb 0.42 0.16 0.00 0.00 -0.55 0.00 0.00 41.25 41.27 2k78 s ASN 110 CO -0.04 -0.20 0.00 0.61 -2.79 0.00 0.00 177.10 174.68 2k78 n GLY 111 N 3.42 2.33 3.80 1.21 0.00 0.31 -4.91 105.19 111.35 2k78 n GLY 111 Ca 0.20 -1.32 -0.36 0.00 0.00 0.00 0.00 46.02 44.55 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 -1.99 4.40 -0.00 1.61 0.00 -1.26 -1.44 119.74 121.06 2k78 s LYS 112 Ca 0.00 1.14 0.01 0.00 0.00 0.00 0.00 55.97 57.12 2k78 s LYS 112 Cb 0.00 -2.67 -0.00 0.00 0.00 0.00 0.00 37.83 35.15 2k78 s LYS 112 CO 0.00 0.24 -0.03 0.42 0.00 0.00 0.00 175.35 175.98 2k78 s ILE 113 N -1.73 0.28 -0.15 3.79 1.01 0.15 -4.94 121.20 119.60 2k78 s ILE 113 Ca 0.51 -0.14 -0.29 0.00 0.00 0.00 0.00 60.65 60.73 2k78 s ILE 113 Cb -0.16 -0.24 -0.01 0.00 0.01 0.00 0.00 42.46 42.05 2k78 s ILE 113 CO 0.21 0.08 1.21 -1.81 0.00 0.00 0.00 174.94 174.63 2k78 s ASP 114 N -0.01 7.00 0.42 3.58 1.11 -1.26 -1.26 116.67 126.24 2k78 s ASP 114 Ca 0.01 1.66 0.04 0.00 0.18 0.00 0.00 52.55 54.43 2k78 s ASP 114 Cb -0.02 -2.54 -0.02 0.00 1.07 0.00 0.00 42.92 41.40 2k78 s ASP 114 CO -0.00 -0.70 0.12 -0.83 1.18 0.00 0.00 175.17 174.94 2k78 s GLY 115 N 1.73 2.66 0.16 0.21 0.00 -1.14 -2.63 107.32 108.31 2k78 s GLY 115 Ca 0.53 -1.16 -0.06 0.00 0.00 0.00 0.00 44.72 44.03 2k78 s GLY 115 CO 0.15 -1.86 0.20 0.54 0.00 0.00 0.00 173.10 172.13 2k78 s LYS 116 N -3.72 1.10 -0.03 2.90 3.01 0.12 -3.08 119.74 120.04 2k78 s LYS 116 Ca 0.22 -1.30 -0.27 0.00 -1.01 0.00 0.00 55.97 53.61 2k78 s LYS 116 Cb 0.02 0.33 0.06 0.00 -1.01 0.00 0.00 37.83 37.23 2k78 s LYS 116 CO 0.14 -0.37 0.60 -1.50 0.51 0.00 0.00 175.35 174.72 2k78 s ILE 117 N -4.01 0.01 0.28 2.17 2.07 0.13 0.17 121.20 122.03 2k78 s ILE 117 Ca 0.21 -0.11 0.08 0.00 -1.41 0.00 0.00 60.65 59.43 2k78 s ILE 117 Cb 0.05 -0.93 -0.04 0.00 0.13 0.00 0.00 42.46 41.67 2k78 s ILE 117 CO 0.02 -0.06 0.14 -1.81 -1.91 0.00 0.00 174.94 171.32 2k78 s ASP 118 N -1.30 5.06 0.02 4.50 1.11 -1.10 -0.31 116.67 124.64 2k78 s ASP 118 Ca -0.11 -0.48 -0.05 0.00 0.18 0.00 0.00 52.55 52.08 2k78 s ASP 118 Cb -0.01 -1.07 -0.01 0.00 1.07 0.00 0.00 42.92 42.90 2k78 s ASP 118 CO 0.08 -0.10 0.09 -0.69 1.18 0.00 0.00 175.17 175.73 2k78 s VAL 119 N -2.26 0.11 -0.20 -1.27 1.01 -0.92 -2.97 120.40 113.91 2k78 s VAL 119 Ca 0.34 -0.87 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 2k78 s VAL 119 Cb -0.06 -0.56 0.09 0.00 0.00 0.00 0.00 36.38 35.85 2k78 s VAL 119 CO 0.23 -0.48 0.40 -0.47 0.00 0.00 0.00 175.10 174.79 2k78 s TYR 120 N -1.83 -0.78 0.02 5.22 5.04 -1.18 -2.71 117.35 121.14 2k78 s TYR 120 Ca -0.12 1.41 -0.04 0.00 -2.44 0.00 0.00 57.07 55.88 2k78 s TYR 120 Cb -0.06 0.25 -0.01 0.00 0.35 0.00 0.00 41.96 42.49 2k78 s TYR 120 CO -0.01 -0.50 0.06 0.42 -1.34 0.00 0.00 175.55 174.18 2k78 s ILE 121 N 2.59 0.11 -0.34 3.14 1.01 0.39 -4.47 121.20 123.63 2k78 s ILE 121 Ca 0.00 -0.92 0.06 0.00 0.00 0.00 0.00 60.65 59.80 2k78 s ILE 121 Cb -0.12 -0.53 0.19 0.00 0.01 0.00 0.00 42.46 42.00 2k78 s ILE 121 CO -0.13 -0.50 0.62 1.51 0.00 0.00 0.00 174.94 176.44 2k78 s ASP 122 N -1.66 -1.57 -0.04 3.58 -4.77 -1.26 -1.99 116.67 108.97 2k78 s ASP 122 Ca -0.12 -0.23 -0.31 0.00 -3.30 0.00 0.00 52.55 48.60 2k78 s ASP 122 Cb -0.06 1.98 0.12 0.00 -1.09 0.00 0.00 42.92 43.86 2k78 s ASP 122 CO -0.01 -0.24 1.18 -1.83 0.70 0.00 0.00 175.17 174.97 2k78 s GLU 123 N 2.41 0.54 -0.37 2.11 -1.05 -1.16 -5.00 118.70 116.17 2k78 s GLU 123 Ca 0.13 -0.27 -0.21 0.00 -0.15 0.00 0.00 54.97 54.47 2k78 s GLU 123 Cb -0.07 0.20 0.01 0.00 -0.44 0.00 0.00 34.13 33.83 2k78 s GLU 123 CO -0.18 -0.24 0.67 0.15 0.95 0.00 0.00 175.26 176.61 2k78 s LYS 124 N -2.62 3.62 -0.97 -4.83 1.02 -1.26 -0.19 119.74 114.51 2k78 s LYS 124 Ca 0.12 0.03 -0.24 0.00 0.02 0.00 0.00 55.97 55.90 2k78 s LYS 124 Cb 0.02 -3.84 0.02 0.00 -0.52 0.00 0.00 37.83 33.51 2k78 s LYS 124 CO -0.04 -0.82 1.61 0.08 -0.92 0.00 0.00 175.35 175.27 2k78 s VAL 125 N 2.82 3.75 -1.01 3.17 1.01 0.36 -3.92 120.40 126.60 2k78 s VAL 125 Ca 0.26 -0.59 -0.00 0.00 0.00 0.00 0.00 61.98 61.64 2k78 s VAL 125 Cb -0.14 -4.70 -0.00 0.00 0.00 0.00 0.00 36.38 31.54 2k78 s VAL 125 CO 0.16 -1.60 0.84 -3.20 0.00 0.00 0.00 175.10 171.30 2k78 n ASN 126 N 10.61 -2.08 -0.04 3.32 4.05 -1.26 -3.03 115.26 126.84 2k78 n ASN 126 Ca 0.34 -0.52 -0.00 0.00 0.45 0.00 0.00 54.58 54.85 2k78 n ASN 126 Cb 0.50 -4.39 -0.00 0.00 1.23 0.00 0.00 39.78 37.12 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 -1.11 0.36 2.71 8.20 0.00 -1.25 -5.03 105.19 109.06 2k78 n GLY 127 Ca -0.24 -0.88 -0.20 0.00 0.00 0.00 0.00 46.02 44.70 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 -4.01 0.28 0.21 1.61 1.02 -1.17 -5.09 119.74 112.59 2k78 s LYS 128 Ca 0.00 -0.19 -0.31 0.00 0.02 0.00 0.00 55.97 55.49 2k78 s LYS 128 Cb 0.00 -0.84 -0.15 0.00 -0.52 0.00 0.00 37.83 36.31 2k78 s LYS 128 CO 0.00 -0.98 1.07 -2.30 -0.92 0.00 0.00 175.35 172.21 2k78 n PRO 129 N 5.30 1.11 -3.72 -1.68 -0.02 -1.26 0.14 135.00 134.87 2k78 n PRO 129 Ca -0.03 0.39 -0.25 0.00 -2.02 0.00 0.00 63.50 61.59 2k78 n PRO 129 Cb 0.46 -1.81 -0.17 0.00 -0.02 0.00 0.00 33.50 31.95 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 -0.51 0.62 -0.18 6.00 5.36 0.74 -4.74 117.98 125.27 2k78 s PHE 130 Ca 0.68 -0.37 -0.07 0.00 -0.96 0.00 0.00 56.93 56.20 2k78 s PHE 130 Cb -0.82 -0.82 -0.04 0.00 -0.34 0.00 0.00 43.02 41.00 2k78 s PHE 130 CO 0.55 -0.44 0.07 0.21 -1.46 0.00 0.00 175.22 174.14 2k78 s LYS 131 N 1.99 3.97 -0.17 10.12 2.20 -1.26 -3.01 119.74 133.58 2k78 s LYS 131 Ca 0.02 -0.33 -0.04 0.00 -0.36 0.00 0.00 55.97 55.26 2k78 s LYS 131 Cb -0.15 -3.22 0.08 0.00 -1.51 0.00 0.00 37.83 33.03 2k78 s LYS 131 CO -0.07 0.30 0.22 -0.47 -0.36 0.00 0.00 175.35 174.97 2k78 s TYR 132 N 0.31 -0.29 -0.37 4.03 5.04 -0.84 -4.96 117.35 120.26 2k78 s TYR 132 Ca 0.04 0.44 0.04 0.00 -2.44 0.00 0.00 57.07 55.15 2k78 s TYR 132 Cb -0.12 -0.28 0.18 0.00 0.35 0.00 0.00 41.96 42.09 2k78 s TYR 132 CO -0.00 -0.49 0.70 0.34 -1.34 0.00 0.00 175.55 174.75 2k78 s ASP 133 N 2.34 -1.34 0.00 4.32 -1.08 -1.25 0.15 116.67 119.80 2k78 s ASP 133 Ca 0.05 -0.49 0.00 0.00 -0.52 0.00 0.00 52.55 51.59 2k78 s ASP 133 Cb -0.14 1.74 0.00 0.00 -1.46 0.00 0.00 42.92 43.05 2k78 s ASP 133 CO -0.10 -0.17 0.00 1.41 0.52 0.00 0.00 175.17 176.83 2k78 n HIS 134 N 4.52 -0.67 -3.92 -5.34 8.25 -1.10 -5.00 115.22 111.96 2k78 n HIS 134 Ca 0.09 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.26 2k78 n HIS 134 Cb 0.57 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.55 2k78 n HIS 134 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2k78 s HIS 135 N -6.73 3.34 0.81 4.41 2.46 -1.26 -2.15 115.29 116.17 2k78 s HIS 135 Ca 0.00 -3.22 -0.10 0.00 0.47 0.00 0.00 55.06 52.21 2k78 s HIS 135 Cb 0.00 -2.80 0.18 0.00 -0.13 0.00 0.00 32.58 29.83 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 2.68 -3.62 -4.02 3.88 4.01 0.57 -4.84 117.16 115.83 2k78 n TYR 136 Ca 0.11 -1.28 -0.10 0.00 -0.16 0.00 0.00 57.90 56.47 2k78 n TYR 136 Cb 0.33 -0.84 -0.06 0.00 -0.31 0.00 0.00 39.34 38.46 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 -5.20 -0.02 0.21 7.72 2.20 -1.26 0.21 114.94 118.81 2k78 s ASN 137 Ca 0.66 -1.01 -0.19 0.00 -0.94 0.00 0.00 52.86 51.39 2k78 s ASN 137 Cb -0.02 0.57 0.03 0.00 -2.00 0.00 0.00 41.25 39.83 2k78 s ASN 137 CO 0.46 -1.12 0.57 0.27 -2.94 0.00 0.00 177.10 174.34 2k78 s ILE 138 N -3.97 0.01 -0.30 0.54 -4.36 -1.18 -4.48 121.20 107.47 2k78 s ILE 138 Ca 0.24 -0.77 -0.19 0.00 -0.26 0.00 0.00 60.65 59.67 2k78 s ILE 138 Cb 0.00 -1.64 -0.01 0.00 1.25 0.00 0.00 42.46 42.05 2k78 s ILE 138 CO 0.10 -0.07 0.56 -0.89 0.24 0.00 0.00 174.94 174.88 2k78 s THR 139 N -3.88 5.00 0.27 8.37 2.01 -0.79 -2.89 115.64 123.74 2k78 s THR 139 Ca 0.09 0.76 -0.10 0.00 0.31 0.00 0.00 61.69 62.76 2k78 s THR 139 Cb -0.02 -3.93 -0.07 0.00 0.01 0.00 0.00 72.50 68.49 2k78 s THR 139 CO -0.01 -0.07 0.60 -0.31 -0.69 0.00 0.00 174.62 174.14 2k78 s TYR 140 N 2.45 3.43 -0.23 4.92 2.02 -0.39 -0.32 117.35 129.23 2k78 s TYR 140 Ca 0.22 0.90 -0.03 0.00 -0.37 0.00 0.00 57.07 57.79 2k78 s TYR 140 Cb -0.15 -2.29 0.10 0.00 -0.40 0.00 0.00 41.96 39.22 2k78 s TYR 140 CO 0.11 0.19 0.20 0.21 -1.57 0.00 0.00 175.55 174.69 2k78 s LYS 141 N -3.07 0.20 0.19 -0.62 2.20 0.29 0.34 119.74 119.27 2k78 s LYS 141 Ca 0.48 -0.04 -0.10 0.00 -0.36 0.00 0.00 55.97 55.95 2k78 s LYS 141 Cb -0.11 -1.17 -0.07 0.00 -1.51 0.00 0.00 37.83 34.98 2k78 s LYS 141 CO 0.23 -0.80 0.52 -0.06 -0.36 0.00 0.00 175.35 174.88 2k78 s PHE 142 N 2.27 3.48 -0.26 4.03 0.08 -0.52 0.85 117.98 127.91 2k78 s PHE 142 Ca 0.07 0.87 -0.01 0.00 0.12 0.00 0.00 56.93 57.98 2k78 s PHE 142 Cb -0.15 -2.25 0.08 0.00 -0.57 0.00 0.00 43.02 40.13 2k78 s PHE 142 CO -0.21 0.34 0.05 -0.80 -0.10 0.00 0.00 175.22 174.50 2k78 s ASN 143 N -2.19 3.68 0.00 1.36 0.01 0.46 -0.53 114.94 117.74 2k78 s ASN 143 Ca 0.44 -1.32 0.00 0.00 -0.71 0.00 0.00 52.86 51.27 2k78 s ASN 143 Cb -0.12 -0.87 0.00 0.00 0.41 0.00 0.00 41.25 40.67 2k78 s ASN 143 CO 0.21 -0.35 0.00 0.61 -1.51 0.00 0.00 177.10 176.06 2k78 n GLY 144 N 4.85 2.78 0.00 0.66 0.00 -0.31 -2.55 105.19 110.62 2k78 n GLY 144 Ca -0.06 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.63 -0.53 1.61 -0.04 -1.26 -4.64 135.00 129.51 2k78 n PRO 145 Ca 0.00 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2k78 n PRO 145 Cb 0.00 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.46 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 -2.46 0.00 0.00 0.52 -2.24 -1.26 -4.33 114.28 104.50 2k78 n THR 146 Ca 0.00 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2k78 n THR 146 Cb 0.00 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 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 0.01 -0.06 -3.51 3.42 -0.08 -1.26 -5.04 116.55 110.03 2k78 n ASP 147 Ca -0.00 0.41 -0.19 0.00 -1.51 0.00 0.00 54.79 53.50 2k78 n ASP 147 Cb 0.62 0.46 0.06 0.00 2.34 0.00 0.00 41.12 44.60 2k78 n ASP 147 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 2k78 n VAL 148 N -2.74 -6.11 -2.67 5.18 0.31 -1.26 -4.90 118.33 106.14 2k78 n VAL 148 Ca 0.00 -0.72 -0.43 0.00 -0.01 0.00 0.00 64.34 63.18 2k78 n VAL 148 Cb 0.00 -4.83 -0.03 0.00 -0.91 0.00 0.00 33.84 28.07 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 3.22 0.00 3.52 0.00 -1.26 -5.06 121.76 118.70 2k78 s ALA 149 Ca 0.14 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.59 2k78 s ALA 149 Cb -0.03 -3.79 0.00 0.00 0.00 0.00 0.00 23.12 19.30 2k78 s ALA 149 CO 0.77 -2.09 0.00 0.41 0.00 0.00 0.00 175.76 174.85