#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 -1.33 -1.79 -0.43 0.00 -1.26 -4.89 121.76 112.07 2k78 s ALA 26 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.04 2k78 s ALA 26 Cb 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 23.12 20.91 2k78 s ALA 26 CO 0.00 -1.90 0.00 -1.71 0.00 0.00 0.00 175.76 172.15 2k78 n ASN 27 N 5.03 -5.24 -3.30 0.00 2.85 -1.26 -4.92 115.26 108.42 2k78 n ASN 27 Ca 0.04 0.26 -0.23 0.00 -0.11 0.00 0.00 54.58 54.55 2k78 n ASN 27 Cb 0.50 -4.33 -0.08 0.00 1.24 0.00 0.00 39.78 37.10 2k78 n ASN 27 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k78 s ALA 28 N -2.77 0.63 1.00 5.20 0.00 -1.26 -5.13 121.76 119.42 2k78 s ALA 28 Ca 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 51.96 50.03 2k78 s ALA 28 Cb 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 23.12 21.31 2k78 s ALA 28 CO 0.00 -2.05 0.00 0.00 0.00 0.00 0.00 175.76 173.71 2k78 n ALA 29 N 3.13 0.00 -2.29 0.00 0.00 -1.26 -4.30 120.51 115.78 2k78 n ALA 29 Ca 0.24 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.51 2k78 n ALA 29 Cb 0.48 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.91 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 -0.30 -4.98 -3.53 0.00 8.00 -1.26 -4.84 116.55 109.64 2k78 n ASP 30 Ca 0.00 0.12 -0.18 0.00 0.71 0.00 0.00 54.79 55.45 2k78 n ASP 30 Cb 0.00 -4.21 -0.06 0.00 -0.02 0.00 0.00 41.12 36.83 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 -2.10 -0.66 0.00 -2.24 1.04 -1.26 0.11 113.70 108.59 2k78 s SER 31 Ca 0.00 0.75 0.00 0.00 0.48 0.00 0.00 55.95 57.18 2k78 s SER 31 Cb 0.00 0.59 0.00 0.00 0.10 0.00 0.00 66.02 66.71 2k78 s SER 31 CO 0.00 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.24 2k78 n GLY 32 N 1.00 -0.28 3.48 7.32 0.00 -0.77 -4.97 105.19 110.96 2k78 n GLY 32 Ca -0.19 -1.12 -0.43 0.00 0.00 0.00 0.00 46.02 44.28 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 4.41 0.22 2.61 -4.23 -1.26 -0.85 115.64 114.54 2k78 s THR 33 Ca 0.00 -0.10 -0.05 0.00 -1.18 0.00 0.00 61.69 60.36 2k78 s THR 33 Cb 0.00 -4.58 -0.06 0.00 1.34 0.00 0.00 72.50 69.20 2k78 s THR 33 CO 0.00 -1.24 0.48 -0.22 -0.54 0.00 0.00 174.62 173.09 2k78 s LEU 34 N 3.87 4.16 0.35 4.79 0.20 0.03 -4.90 118.68 127.19 2k78 s LEU 34 Ca 0.25 0.68 -0.25 0.00 0.69 0.00 0.00 54.13 55.49 2k78 s LEU 34 Cb -0.15 -3.45 -0.10 0.00 -0.43 0.00 0.00 46.19 42.06 2k78 s LEU 34 CO 0.14 -0.08 0.98 0.20 -0.29 0.00 0.00 176.35 177.31 2k78 s ASN 35 N -2.79 7.15 -0.00 3.68 0.01 -0.98 -2.62 114.94 119.39 2k78 s ASN 35 Ca 0.43 1.91 -0.28 0.00 -0.71 0.00 0.00 52.86 54.21 2k78 s ASN 35 Cb -0.11 -2.58 0.10 0.00 0.41 0.00 0.00 41.25 39.06 2k78 s ASN 35 CO 0.26 -0.21 0.82 -0.72 -1.51 0.00 0.00 177.10 175.75 2k78 s TYR 36 N -1.63 -0.43 0.31 2.20 1.13 -1.26 0.16 117.35 117.82 2k78 s TYR 36 Ca 0.53 0.43 -0.07 0.00 -1.41 0.00 0.00 57.07 56.54 2k78 s TYR 36 Cb -0.20 0.51 0.03 0.00 -1.10 0.00 0.00 41.96 41.20 2k78 s TYR 36 CO 0.25 -0.58 0.54 -1.91 -2.51 0.00 0.00 175.55 171.34 2k78 n GLU 37 N 0.05 0.77 -4.24 -3.49 2.13 0.13 -4.84 120.64 111.14 2k78 n GLU 37 Ca -0.12 -2.01 -0.17 0.00 0.66 0.00 0.00 57.16 55.52 2k78 n GLU 37 Cb 0.61 2.23 -0.08 0.00 0.27 0.00 0.00 31.44 34.47 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 -2.48 0.00 0.12 6.31 -7.23 -1.26 -0.63 120.40 115.23 2k78 s VAL 38 Ca 0.18 -1.97 -0.10 0.00 -1.81 0.00 0.00 61.98 58.27 2k78 s VAL 38 Cb -0.03 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.41 2k78 s VAL 38 CO 0.13 0.00 0.27 -0.31 -0.31 0.00 0.00 175.10 174.88 2k78 s TYR 39 N -3.66 0.16 0.24 2.82 2.02 -0.24 -3.93 117.35 114.77 2k78 s TYR 39 Ca 0.39 -0.55 -0.30 0.00 -0.37 0.00 0.00 57.07 56.25 2k78 s TYR 39 Cb 0.04 0.02 -0.10 0.00 -0.40 0.00 0.00 41.96 41.52 2k78 s TYR 39 CO 0.22 -0.64 1.35 0.21 -1.57 0.00 0.00 175.55 175.12 2k78 s LYS 40 N -3.89 4.35 0.55 -0.62 2.47 0.11 -1.59 119.74 121.12 2k78 s LYS 40 Ca 0.09 2.16 -0.21 0.00 -1.56 0.00 0.00 55.97 56.45 2k78 s LYS 40 Cb 0.04 -3.14 -0.05 0.00 -1.46 0.00 0.00 37.83 33.22 2k78 s LYS 40 CO -0.07 -0.29 1.33 -0.47 0.16 0.00 0.00 175.35 176.01 2k78 s TYR 41 N -0.19 2.33 0.00 4.03 5.04 -1.26 -1.73 117.35 125.57 2k78 s TYR 41 Ca 0.56 1.40 0.00 0.00 -2.44 0.00 0.00 57.07 56.59 2k78 s TYR 41 Cb -0.39 -3.74 0.00 0.00 0.35 0.00 0.00 41.96 38.18 2k78 s TYR 41 CO 0.43 -2.75 0.00 -1.71 -1.34 0.00 0.00 175.55 170.17 2k78 n ASN 42 N -1.05 -2.02 -0.55 4.32 2.85 -1.26 -4.93 115.26 112.61 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 0.46 -1.52 0.00 0.00 1.24 0.00 0.00 39.78 39.96 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 -2.24 0.00 -0.96 -0.44 -2.24 -0.70 -5.07 114.28 102.63 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 0.11 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.36 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 -1.15 0.98 -3.99 3.42 3.02 -1.26 -4.74 115.26 111.53 2k78 n ASN 44 Ca 0.00 -1.88 -0.15 0.00 -0.03 0.00 0.00 54.58 52.52 2k78 n ASN 44 Cb 0.00 -0.12 -0.14 0.00 -0.61 0.00 0.00 39.78 38.91 2k78 n ASN 44 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2k78 s ASP 45 N -1.02 0.67 0.18 6.41 1.01 -1.26 -4.88 116.67 117.77 2k78 s ASP 45 Ca 0.06 -0.22 -0.30 0.00 0.71 0.00 0.00 52.55 52.80 2k78 s ASP 45 Cb 0.05 -0.04 -0.07 0.00 1.01 0.00 0.00 42.92 43.87 2k78 s ASP 45 CO 0.01 -0.01 1.04 -0.89 0.21 0.00 0.00 175.17 175.52 2k78 s THR 46 N -0.48 4.03 0.00 -1.27 2.01 -1.25 0.09 115.64 118.76 2k78 s THR 46 Ca -0.02 1.79 0.00 0.00 0.31 0.00 0.00 61.69 63.77 2k78 s THR 46 Cb -0.04 -4.14 0.00 0.00 0.01 0.00 0.00 72.50 68.33 2k78 s THR 46 CO -0.00 0.32 0.00 -1.20 -0.69 0.00 0.00 174.62 173.05 2k78 n SER 47 N 2.28 2.13 0.02 3.53 7.64 -1.26 -4.79 113.62 123.16 2k78 n SER 47 Ca 0.02 -0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.84 2k78 n SER 47 Cb 0.47 0.55 0.00 0.00 -1.01 0.00 0.00 64.21 64.22 2k78 n SER 47 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2k78 n ILE 48 N -0.76 0.02 0.04 0.44 5.41 -1.26 -4.84 119.36 118.41 2k78 n ILE 48 Ca 0.00 0.01 0.21 0.00 1.00 0.00 0.00 62.75 63.96 2k78 n ILE 48 Cb 0.00 -0.17 0.62 0.00 -0.71 0.00 0.00 39.64 39.38 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 2.27 0.00 -1.39 0.00 -1.95 0.45 119.26 118.63 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 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2k78 h ALA 49 CO 0.00 -0.96 0.00 -1.71 0.00 0.00 0.00 179.25 176.58 2k78 n ASN 50 N -3.39 0.57 -1.48 0.00 2.85 -1.26 -2.09 115.26 110.46 2k78 n ASN 50 Ca 0.11 0.67 0.09 0.00 -0.11 0.00 0.00 54.58 55.33 2k78 n ASN 50 Cb 0.89 -0.78 0.34 0.00 1.24 0.00 0.00 39.78 41.47 2k78 n ASN 50 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 2k78 n ASP 51 N -2.16 4.62 0.00 1.20 8.00 0.16 -4.31 116.55 124.06 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 0.18 -0.56 0.00 0.00 -0.02 0.00 0.00 41.12 40.72 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 0.91 0.00 -3.80 1.24 4.01 -0.89 -4.99 117.16 113.63 2k78 n TYR 52 Ca 0.25 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.62 2k78 n TYR 52 Cb 0.88 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.78 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 -0.34 3.18 -0.39 -0.72 0.08 -1.22 -2.26 117.98 116.30 2k78 s PHE 53 Ca 0.00 -1.30 -0.29 0.00 0.12 0.00 0.00 56.93 55.47 2k78 s PHE 53 Cb 0.00 -2.22 0.00 0.00 -0.57 0.00 0.00 43.02 40.23 2k78 s PHE 53 CO 0.00 -0.67 1.54 1.21 -0.10 0.00 0.00 175.22 177.20 2k78 s ASN 54 N 1.42 6.18 0.44 1.36 2.47 -1.14 -4.99 114.94 120.67 2k78 s ASN 54 Ca 0.00 0.96 0.00 0.00 0.42 0.00 0.00 52.86 54.24 2k78 s ASN 54 Cb -0.18 -2.54 -0.01 0.00 -1.45 0.00 0.00 41.25 37.08 2k78 s ASN 54 CO 0.01 -1.54 0.66 -1.59 -3.72 0.00 0.00 177.10 170.92 2k78 s LYS 55 N 5.20 3.11 0.59 0.43 -2.85 -1.26 -4.53 119.74 120.43 2k78 s LYS 55 Ca 0.67 -0.48 -0.10 0.00 -1.00 0.00 0.00 55.97 55.06 2k78 s LYS 55 Cb -0.16 -2.57 0.14 0.00 -2.06 0.00 0.00 37.83 33.17 2k78 s LYS 55 CO 0.33 -0.23 0.79 -0.35 0.10 0.00 0.00 175.35 175.98 2k78 n PRO 56 N -2.05 -0.83 -3.64 1.78 -0.04 -1.26 -5.16 135.00 123.79 2k78 n PRO 56 Ca 0.01 -1.21 -0.20 0.00 -0.04 0.00 0.00 63.50 62.05 2k78 n PRO 56 Cb 0.57 -0.82 -0.02 0.00 -0.04 0.00 0.00 33.50 33.19 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 -3.95 4.03 -0.34 0.55 0.00 -1.08 -4.94 121.76 116.04 2k78 s ALA 57 Ca 0.45 -1.60 -0.10 0.00 0.00 0.00 0.00 51.96 50.71 2k78 s ALA 57 Cb -0.01 -1.36 0.01 0.00 0.00 0.00 0.00 23.12 21.75 2k78 s ALA 57 CO 0.31 -0.03 0.18 0.21 0.00 0.00 0.00 175.76 176.43 2k78 s LYS 58 N -4.08 3.11 0.39 0.00 2.20 -1.16 -0.79 119.74 119.42 2k78 s LYS 58 Ca 0.43 -0.88 0.05 0.00 -0.36 0.00 0.00 55.97 55.22 2k78 s LYS 58 Cb -0.07 -3.64 -0.00 0.00 -1.51 0.00 0.00 37.83 32.61 2k78 s LYS 58 CO 0.29 -0.54 0.55 1.52 -0.36 0.00 0.00 175.35 176.81 2k78 s TYR 59 N 1.59 3.05 0.12 4.03 1.13 -0.03 -0.15 117.35 127.09 2k78 s TYR 59 Ca 0.03 -0.16 -0.19 0.00 -1.41 0.00 0.00 57.07 55.35 2k78 s TYR 59 Cb -0.18 -2.19 0.05 0.00 -1.10 0.00 0.00 41.96 38.53 2k78 s TYR 59 CO 0.06 -0.23 0.47 -1.50 -2.51 0.00 0.00 175.55 171.85 2k78 s ILE 60 N -2.33 0.05 0.26 -3.49 2.07 -0.87 -1.85 121.20 115.03 2k78 s ILE 60 Ca 0.49 -0.37 0.02 0.00 -1.41 0.00 0.00 60.65 59.37 2k78 s ILE 60 Cb -0.10 -1.08 -0.04 0.00 0.13 0.00 0.00 42.46 41.37 2k78 s ILE 60 CO 0.33 -0.20 0.17 -0.54 -1.91 0.00 0.00 174.94 172.79 2k78 s LYS 61 N -3.51 1.42 -0.45 3.50 1.02 0.30 -0.37 119.74 121.65 2k78 s LYS 61 Ca 0.01 -1.79 0.07 0.00 0.02 0.00 0.00 55.97 54.28 2k78 s LYS 61 Cb 0.01 0.18 0.31 0.00 -0.52 0.00 0.00 37.83 37.81 2k78 s LYS 61 CO -0.10 -0.46 0.98 1.63 -0.92 0.00 0.00 175.35 176.48 2k78 n LYS 62 N -0.43 0.96 -3.15 1.68 5.02 0.41 -4.73 118.16 117.92 2k78 n LYS 62 Ca 0.03 -2.21 -0.16 0.00 -2.02 0.00 0.00 58.31 53.95 2k78 n LYS 62 Cb 0.65 -1.23 0.02 0.00 -0.02 0.00 0.00 35.03 34.44 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 0.61 -6.76 0.00 4.39 4.05 -1.26 -4.01 115.26 112.28 2k78 n ASN 63 Ca 0.11 0.42 0.00 0.00 0.45 0.00 0.00 54.58 55.55 2k78 n ASN 63 Cb 0.67 -3.10 0.00 0.00 1.23 0.00 0.00 39.78 38.58 2k78 n ASN 63 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2k78 n GLY 64 N 0.33 0.79 3.50 8.20 0.00 -1.26 -5.06 105.19 111.68 2k78 n GLY 64 Ca -0.00 -0.36 -0.10 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.69 0.89 0.07 1.61 -2.85 -1.26 -5.11 119.74 112.40 2k78 s LYS 65 Ca 0.00 -0.20 -0.26 0.00 -1.00 0.00 0.00 55.97 54.50 2k78 s LYS 65 Cb 0.00 0.41 0.07 0.00 -2.06 0.00 0.00 37.83 36.26 2k78 s LYS 65 CO 0.00 -0.36 0.65 -0.48 0.10 0.00 0.00 175.35 175.26 2k78 s LEU 66 N -2.18 -0.59 0.00 2.77 -0.00 -1.26 -0.44 118.68 116.98 2k78 s LEU 66 Ca 0.02 0.29 0.00 0.00 -0.00 0.00 0.00 54.13 54.43 2k78 s LEU 66 Cb -0.01 2.54 0.00 0.00 -0.00 0.00 0.00 46.19 48.72 2k78 s LEU 66 CO -0.06 -0.80 0.00 -1.22 -0.00 0.00 0.00 176.35 174.27 2k78 n TYR 67 N 0.15 -0.02 -3.64 3.48 4.02 0.50 -3.66 117.16 117.98 2k78 n TYR 67 Ca -0.17 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.65 2k78 n TYR 67 Cb 0.62 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.87 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 -1.38 0.00 -0.16 -0.72 0.11 -0.54 -2.04 120.40 115.67 2k78 s VAL 68 Ca 0.00 0.00 -0.09 0.00 -2.93 0.00 0.00 61.98 58.96 2k78 s VAL 68 Cb 0.00 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.80 2k78 s VAL 68 CO 0.00 0.00 0.15 0.00 -3.33 0.00 0.00 175.10 171.92 2k78 s GLN 69 N 0.30 3.84 -0.14 1.54 -2.07 0.79 -0.47 119.66 123.45 2k78 s GLN 69 Ca 0.03 -0.15 -0.01 0.00 -1.82 0.00 0.00 55.36 53.41 2k78 s GLN 69 Cb -0.05 -3.31 -0.01 0.00 -1.09 0.00 0.00 33.01 28.55 2k78 s GLN 69 CO -0.09 0.53 -0.12 0.42 -1.32 0.00 0.00 175.29 174.71 2k78 s ILE 70 N -0.31 3.10 -0.21 3.63 1.09 -0.51 -2.99 121.20 125.00 2k78 s ILE 70 Ca 0.12 -0.63 -0.22 0.00 -1.10 0.00 0.00 60.65 58.82 2k78 s ILE 70 Cb -0.12 -2.32 -0.02 0.00 -1.06 0.00 0.00 42.46 38.94 2k78 s ILE 70 CO 0.01 0.51 0.67 -0.89 -0.10 0.00 0.00 174.94 175.15 2k78 s THR 71 N 0.52 4.98 0.08 2.92 2.01 -1.26 -2.47 115.64 122.42 2k78 s THR 71 Ca -0.08 1.26 0.02 0.00 0.31 0.00 0.00 61.69 63.20 2k78 s THR 71 Cb -0.16 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 2k78 s THR 71 CO 0.04 0.06 0.14 0.68 -0.69 0.00 0.00 174.62 174.85 2k78 s VAL 72 N 2.16 4.87 -0.16 3.82 -7.23 0.14 -2.88 120.40 121.12 2k78 s VAL 72 Ca 0.30 -0.64 -0.07 0.00 -1.81 0.00 0.00 61.98 59.76 2k78 s VAL 72 Cb -0.16 -3.37 -0.04 0.00 0.56 0.00 0.00 36.38 33.37 2k78 s VAL 72 CO 0.10 0.11 0.09 0.20 -0.31 0.00 0.00 175.10 175.29 2k78 s ASN 73 N -2.50 5.91 -0.17 4.85 -0.87 -0.96 -2.76 114.94 118.45 2k78 s ASN 73 Ca 0.32 0.22 -0.11 0.00 -1.57 0.00 0.00 52.86 51.71 2k78 s ASN 73 Cb -0.12 -1.96 0.04 0.00 -0.02 0.00 0.00 41.25 39.18 2k78 s ASN 73 CO 0.24 0.25 0.22 1.57 -2.57 0.00 0.00 177.10 176.82 2k78 n HIS 74 N 3.01 -3.96 -0.18 2.20 -0.00 -0.58 -4.45 115.22 111.26 2k78 n HIS 74 Ca -0.17 2.29 -0.08 0.00 0.46 0.00 0.00 57.72 60.22 2k78 n HIS 74 Cb 0.53 -3.58 0.01 0.00 -0.12 0.00 0.00 29.99 26.83 2k78 n HIS 74 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 2k78 h SER 75 N 4.22 0.67 -0.96 0.26 0.87 -1.84 -2.52 113.55 114.24 2k78 h SER 75 Ca -0.49 -0.14 0.17 0.00 -1.23 0.00 0.00 61.79 60.10 2k78 h SER 75 Cb 1.12 -0.17 -0.09 0.00 -0.44 0.00 0.00 62.40 62.82 2k78 h SER 75 CO 0.01 0.62 0.61 0.45 -0.53 0.00 0.00 176.83 177.99 2k78 h HIS 76 N 0.67 0.92 0.54 2.24 3.86 -1.89 -2.66 115.15 118.84 2k78 h HIS 76 Ca 0.17 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.38 2k78 h HIS 76 Cb 0.13 -0.28 0.01 0.00 1.06 0.00 0.00 27.41 28.32 2k78 h HIS 76 CO -0.00 0.27 -0.26 -1.49 0.86 0.00 0.00 177.93 177.31 2k78 h TRP 77 N 0.72 -0.67 -3.47 2.45 4.06 -1.66 -3.36 115.95 114.02 2k78 h TRP 77 Ca 0.52 -0.02 -0.61 0.00 2.06 0.00 0.00 58.89 60.84 2k78 h TRP 77 Cb 0.85 0.22 -0.11 0.00 -1.00 0.00 0.00 29.16 29.12 2k78 h TRP 77 CO -0.00 -0.38 0.27 -1.50 -3.56 0.00 0.00 178.44 173.26 2k78 s ILE 78 N -4.14 4.89 -0.13 1.49 1.10 -1.00 -3.09 121.20 120.31 2k78 s ILE 78 Ca -0.12 1.08 0.16 0.00 -0.51 0.00 0.00 60.65 61.27 2k78 s ILE 78 Cb 0.01 -4.05 -0.07 0.00 0.15 0.00 0.00 42.46 38.50 2k78 s ILE 78 CO 0.37 -0.14 1.02 0.00 -2.11 0.00 0.00 174.94 174.09 2k78 h THR 79 N 5.53 0.60 0.00 4.00 1.03 -1.57 -3.43 112.91 119.07 2k78 h THR 79 Ca -0.26 -2.04 0.00 0.00 -0.01 0.00 0.00 66.41 64.10 2k78 h THR 79 Cb 1.11 2.14 0.00 0.00 -1.07 0.00 0.00 68.15 70.33 2k78 h THR 79 CO 0.83 0.34 0.00 0.61 -0.01 0.00 0.00 175.52 177.29 2k78 n GLY 80 N 1.34 -0.17 3.14 2.99 0.00 -1.14 -4.94 105.19 106.41 2k78 n GLY 80 Ca -0.06 -0.99 -0.07 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.00 0.36 0.72 1.61 -1.94 -1.26 -2.37 119.30 114.43 2k78 s MET 81 Ca 0.00 0.86 -0.07 0.00 -1.71 0.00 0.00 55.69 54.77 2k78 s MET 81 Cb 0.00 0.06 0.08 0.00 2.01 0.00 0.00 34.83 36.98 2k78 s MET 81 CO 0.00 -0.43 1.04 0.45 -0.01 0.00 0.00 175.02 176.06 2k78 s SER 82 N 2.62 4.65 -0.29 3.03 0.15 0.47 -3.21 113.70 121.11 2k78 s SER 82 Ca 0.06 0.37 -0.17 0.00 0.70 0.00 0.00 55.95 56.90 2k78 s SER 82 Cb -0.14 -0.95 0.16 0.00 -1.71 0.00 0.00 66.02 63.38 2k78 s SER 82 CO -0.15 -1.71 1.07 -0.63 1.20 0.00 0.00 173.24 173.02 2k78 s ILE 83 N -3.29 0.00 0.00 6.45 1.01 0.60 -2.49 121.20 123.48 2k78 s ILE 83 Ca 0.62 0.00 0.00 0.00 0.00 0.00 0.00 60.65 61.27 2k78 s ILE 83 Cb -0.10 -1.00 0.00 0.00 0.01 0.00 0.00 42.46 41.37 2k78 s ILE 83 CO 0.45 0.00 0.00 -0.62 0.00 0.00 0.00 174.94 174.77 2k78 n GLU 84 N 3.31 -1.66 0.00 2.79 -0.58 -1.19 -2.01 120.64 121.29 2k78 n GLU 84 Ca -0.17 0.42 0.00 0.00 -0.42 0.00 0.00 57.16 56.98 2k78 n GLU 84 Cb 0.57 -4.74 0.00 0.00 -0.57 0.00 0.00 31.44 26.71 2k78 n GLU 84 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k78 n GLY 85 N 0.38 0.82 3.11 0.62 0.00 -1.26 -5.10 105.19 103.76 2k78 n GLY 85 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 0.79 0.00 1.61 -3.43 -0.85 -5.15 115.29 106.26 2k78 s HIS 86 Ca 0.00 -0.67 0.00 0.00 -0.80 0.00 0.00 55.06 53.59 2k78 s HIS 86 Cb 0.00 -0.46 0.00 0.00 -1.43 0.00 0.00 32.58 30.69 2k78 s HIS 86 CO 0.00 -0.10 0.00 1.63 -2.00 0.00 0.00 174.74 174.27 2k78 n LYS 87 N 0.82 -0.39 -3.63 -0.38 5.02 -1.26 -0.29 118.16 118.05 2k78 n LYS 87 Ca -0.18 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 55.89 2k78 n LYS 87 Cb 0.57 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.55 2k78 n LYS 87 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2k78 s GLU 88 N -2.15 2.49 -0.09 1.97 -1.05 -1.20 -4.60 118.70 114.07 2k78 s GLU 88 Ca 0.00 -1.58 0.02 0.00 -0.15 0.00 0.00 54.97 53.26 2k78 s GLU 88 Cb 0.00 -2.33 -0.02 0.00 -0.44 0.00 0.00 34.13 31.35 2k78 s GLU 88 CO 0.00 -0.20 -0.16 1.21 0.95 0.00 0.00 175.26 177.06 2k78 s ASN 89 N -4.11 3.82 -0.51 0.83 3.04 -1.24 -4.96 114.94 111.81 2k78 s ASN 89 Ca 0.47 -0.32 -0.27 0.00 0.04 0.00 0.00 52.86 52.78 2k78 s ASN 89 Cb -0.02 -1.21 -0.03 0.00 -1.54 0.00 0.00 41.25 38.45 2k78 s ASN 89 CO 0.27 0.24 1.92 0.27 -3.04 0.00 0.00 177.10 176.76 2k78 s ILE 90 N -0.11 3.34 -0.11 -5.21 -4.36 -1.26 -3.12 121.20 110.37 2k78 s ILE 90 Ca -0.02 0.26 0.15 0.00 -0.26 0.00 0.00 60.65 60.78 2k78 s ILE 90 Cb -0.14 -3.71 -0.23 0.00 1.25 0.00 0.00 42.46 39.62 2k78 s ILE 90 CO 0.04 -0.63 0.42 0.00 0.24 0.00 0.00 174.94 175.01 2k78 n ILE 91 N 7.39 1.45 -3.15 8.37 3.06 -0.96 -4.91 119.36 130.61 2k78 n ILE 91 Ca 0.23 -0.81 0.05 0.00 -2.50 0.00 0.00 62.75 59.72 2k78 n ILE 91 Cb 0.51 -0.75 -0.01 0.00 0.54 0.00 0.00 39.64 39.93 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 -5.78 -1.00 -0.44 9.51 0.01 -1.24 -4.99 113.70 109.77 2k78 s SER 92 Ca -0.07 0.37 -0.18 0.00 1.31 0.00 0.00 55.95 57.38 2k78 s SER 92 Cb 0.07 1.73 0.03 0.00 0.21 0.00 0.00 66.02 68.07 2k78 s SER 92 CO 0.83 -0.18 0.49 -0.75 0.41 0.00 0.00 173.24 174.03 2k78 s LYS 93 N 2.90 3.11 -0.96 12.44 2.20 -1.26 -2.18 119.74 135.99 2k78 s LYS 93 Ca 0.14 -0.79 -0.14 0.00 -0.36 0.00 0.00 55.97 54.81 2k78 s LYS 93 Cb -0.10 -4.00 0.21 0.00 -1.51 0.00 0.00 37.83 32.43 2k78 s LYS 93 CO -0.20 -0.95 1.00 -0.80 -0.36 0.00 0.00 175.35 174.04 2k78 s ASN 94 N 2.05 6.90 0.43 1.43 0.02 0.26 -4.84 114.94 121.19 2k78 s ASN 94 Ca 0.13 -2.79 0.23 0.00 -1.02 0.00 0.00 52.86 49.41 2k78 s ASN 94 Cb -0.18 -2.27 0.91 0.00 0.02 0.00 0.00 41.25 39.73 2k78 s ASN 94 CO 0.13 -0.63 1.82 0.74 0.02 0.00 0.00 177.10 179.18 2k78 h THR 95 N 4.74 0.63 0.31 1.60 2.02 -1.95 0.41 112.91 120.67 2k78 h THR 95 Ca 0.16 -1.16 -0.02 0.00 0.77 0.00 0.00 66.41 66.16 2k78 h THR 95 Cb 0.98 1.77 0.00 0.00 -1.74 0.00 0.00 68.15 69.16 2k78 h THR 95 CO 0.94 0.25 -0.15 0.00 0.37 0.00 0.00 175.52 176.93 2k78 h ALA 96 N 1.75 -0.41 -0.52 6.16 0.00 -1.93 -2.92 119.26 121.38 2k78 h ALA 96 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2k78 h ALA 96 Cb 0.75 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2k78 h ALA 96 CO 0.03 -0.67 0.00 1.17 0.00 0.00 0.00 179.25 179.78 2k78 n LYS 97 N -5.21 4.29 -3.51 0.00 4.81 -1.21 -4.95 118.16 112.38 2k78 n LYS 97 Ca -0.10 -2.74 -0.20 0.00 -0.87 0.00 0.00 58.31 54.40 2k78 n LYS 97 Cb 0.22 -2.13 0.02 0.00 0.02 0.00 0.00 35.03 33.16 2k78 n LYS 97 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2k78 n ASP 98 N 0.62 -6.01 -3.83 3.14 8.00 -0.62 -4.82 116.55 113.03 2k78 n ASP 98 Ca 0.24 -0.71 -0.09 0.00 0.71 0.00 0.00 54.79 54.94 2k78 n ASP 98 Cb 1.05 -3.57 -0.07 0.00 -0.02 0.00 0.00 41.12 38.50 2k78 n ASP 98 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2k78 s GLU 99 N -4.74 0.83 0.14 -1.24 2.02 0.13 -1.52 118.70 114.31 2k78 s GLU 99 Ca 0.20 -0.83 -0.16 0.00 0.02 0.00 0.00 54.97 54.20 2k78 s GLU 99 Cb -0.07 0.34 0.03 0.00 0.10 0.00 0.00 34.13 34.54 2k78 s GLU 99 CO 0.83 -0.26 0.42 0.50 0.02 0.00 0.00 175.26 176.77 2k78 s ARG 100 N -3.46 1.12 0.04 1.61 3.52 -1.11 0.89 118.95 121.57 2k78 s ARG 100 Ca 0.02 -0.74 -0.02 0.00 -0.13 0.00 0.00 55.73 54.86 2k78 s ARG 100 Cb 0.03 0.48 -0.03 0.00 -1.56 0.00 0.00 34.95 33.87 2k78 s ARG 100 CO -0.09 -0.45 0.01 0.99 -0.81 0.00 0.00 175.30 174.95 2k78 s THR 101 N -3.82 0.18 -0.05 4.11 2.01 -0.93 0.24 115.64 117.39 2k78 s THR 101 Ca 0.04 -1.45 -0.08 0.00 0.31 0.00 0.00 61.69 60.52 2k78 s THR 101 Cb 0.01 -1.13 0.01 0.00 0.01 0.00 0.00 72.50 71.41 2k78 s THR 101 CO -0.10 -0.80 0.19 -0.94 -0.69 0.00 0.00 174.62 172.28 2k78 s SER 102 N -2.46 -0.14 -0.05 3.53 1.04 -1.03 -2.26 113.70 112.32 2k78 s SER 102 Ca -0.00 0.22 -0.16 0.00 0.48 0.00 0.00 55.95 56.49 2k78 s SER 102 Cb 0.02 0.35 -0.05 0.00 0.10 0.00 0.00 66.02 66.44 2k78 s SER 102 CO -0.07 -0.18 0.42 -0.70 0.98 0.00 0.00 173.24 173.69 2k78 s GLU 103 N -0.40 4.09 0.10 4.02 -6.30 -1.18 -1.43 118.70 117.59 2k78 s GLU 103 Ca -0.05 0.40 0.10 0.00 -2.50 0.00 0.00 54.97 52.91 2k78 s GLU 103 Cb -0.03 -3.31 -0.03 0.00 0.00 0.00 0.00 34.13 30.75 2k78 s GLU 103 CO 0.01 0.48 -0.25 -0.06 0.02 0.00 0.00 175.26 175.47 2k78 s PHE 104 N -0.41 2.14 -0.14 5.30 0.08 0.38 -3.72 117.98 121.61 2k78 s PHE 104 Ca 0.24 -0.39 0.00 0.00 0.12 0.00 0.00 56.93 56.89 2k78 s PHE 104 Cb -0.16 -1.20 -0.01 0.00 -0.57 0.00 0.00 43.02 41.08 2k78 s PHE 104 CO 0.12 0.24 -0.14 -1.21 -0.10 0.00 0.00 175.22 174.12 2k78 s GLU 105 N -1.75 3.32 0.20 0.44 8.01 -1.26 -1.47 118.70 126.18 2k78 s GLU 105 Ca 0.11 -0.71 -0.02 0.00 0.01 0.00 0.00 54.97 54.36 2k78 s GLU 105 Cb -0.10 -2.62 0.01 0.00 -4.31 0.00 0.00 34.13 27.11 2k78 s GLU 105 CO 0.04 0.15 0.29 1.33 0.01 0.00 0.00 175.26 177.08 2k78 n VAL 106 N 3.71 0.00 -2.90 2.63 0.24 -1.24 -4.82 118.33 115.94 2k78 n VAL 106 Ca -0.18 -0.95 -0.42 0.00 -2.04 0.00 0.00 64.34 60.74 2k78 n VAL 106 Cb 0.52 0.61 -0.05 0.00 -1.47 0.00 0.00 33.84 33.45 2k78 n VAL 106 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2k78 s SER 107 N -2.21 6.57 0.37 -1.34 1.04 -1.26 -4.60 113.70 112.27 2k78 s SER 107 Ca 0.16 0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.93 2k78 s SER 107 Cb -0.01 -2.42 0.00 0.00 0.10 0.00 0.00 66.02 63.69 2k78 s SER 107 CO 0.11 -0.82 0.00 0.29 0.98 0.00 0.00 173.24 173.80 2k78 n LYS 108 N 6.63 0.00 -2.78 4.02 4.76 -1.26 -4.57 118.16 124.96 2k78 n LYS 108 Ca 0.04 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.39 2k78 n LYS 108 Cb 0.48 0.00 0.06 0.00 -1.84 0.00 0.00 35.03 33.74 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 -0.60 -3.28 -0.35 -0.00 -1.26 -4.94 117.00 106.57 2k78 n LEU 109 Ca 0.00 -3.84 -0.20 0.00 -0.00 0.00 0.00 56.01 51.97 2k78 n LEU 109 Cb 0.00 0.44 -0.08 0.00 -0.00 0.00 0.00 43.42 43.79 2k78 n LEU 109 CO 0.00 1.91 -0.19 0.21 -0.00 0.00 0.00 177.39 179.31 2k78 s ASN 110 N -1.96 1.02 0.00 1.45 2.47 -1.25 -1.01 114.94 115.66 2k78 s ASN 110 Ca 0.26 -2.29 0.00 0.00 0.42 0.00 0.00 52.86 51.26 2k78 s ASN 110 Cb 0.39 0.28 0.00 0.00 -1.45 0.00 0.00 41.25 40.46 2k78 s ASN 110 CO -0.04 -0.19 0.00 0.61 -3.72 0.00 0.00 177.10 173.75 2k78 n GLY 111 N 3.42 2.78 3.79 1.21 0.00 -0.83 -4.95 105.19 110.61 2k78 n GLY 111 Ca 0.20 -1.20 -0.37 0.00 0.00 0.00 0.00 46.02 44.65 2k78 n GLY 111 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k78 s LYS 112 N -2.10 4.50 0.02 1.61 2.36 -1.26 -2.44 119.74 122.43 2k78 s LYS 112 Ca 0.00 1.19 0.01 0.00 -2.55 0.00 0.00 55.97 54.63 2k78 s LYS 112 Cb 0.00 -2.87 -0.02 0.00 -1.05 0.00 0.00 37.83 33.90 2k78 s LYS 112 CO 0.00 0.34 -0.06 0.42 1.55 0.00 0.00 175.35 177.60 2k78 s ILE 113 N -1.55 0.38 0.05 5.43 1.01 -0.38 -4.94 121.20 121.21 2k78 s ILE 113 Ca 0.47 -0.74 -0.30 0.00 0.00 0.00 0.00 60.65 60.08 2k78 s ILE 113 Cb -0.19 -0.43 -0.05 0.00 0.01 0.00 0.00 42.46 41.81 2k78 s ILE 113 CO 0.23 -0.24 1.10 -1.81 0.00 0.00 0.00 174.94 174.22 2k78 s ASP 114 N -1.05 7.22 0.30 3.58 1.01 -1.26 -0.78 116.67 125.68 2k78 s ASP 114 Ca -0.07 1.88 0.05 0.00 0.71 0.00 0.00 52.55 55.12 2k78 s ASP 114 Cb -0.07 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.25 2k78 s ASP 114 CO -0.00 -0.36 0.22 -0.83 0.21 0.00 0.00 175.17 174.41 2k78 s GLY 115 N 0.91 2.13 0.13 0.21 0.00 -1.10 -3.20 107.32 106.39 2k78 s GLY 115 Ca 0.55 -1.90 -0.04 0.00 0.00 0.00 0.00 44.72 43.33 2k78 s GLY 115 CO 0.29 -1.50 0.13 0.54 0.00 0.00 0.00 173.10 172.57 2k78 s LYS 116 N -3.67 0.97 -0.20 2.90 1.02 -1.04 -3.04 119.74 116.68 2k78 s LYS 116 Ca 0.39 -1.29 -0.25 0.00 0.02 0.00 0.00 55.97 54.84 2k78 s LYS 116 Cb 0.04 0.29 0.06 0.00 -0.52 0.00 0.00 37.83 37.70 2k78 s LYS 116 CO 0.22 -0.30 0.66 -1.50 -0.92 0.00 0.00 175.35 173.51 2k78 s ILE 117 N -4.00 0.00 0.31 2.17 -1.16 0.15 0.18 121.20 118.85 2k78 s ILE 117 Ca 0.19 -0.01 0.09 0.00 -0.51 0.00 0.00 60.65 60.40 2k78 s ILE 117 Cb 0.06 -0.94 -0.04 0.00 0.61 0.00 0.00 42.46 42.15 2k78 s ILE 117 CO -0.01 -0.01 0.08 -1.81 -2.81 0.00 0.00 174.94 170.38 2k78 s ASP 118 N -0.01 4.65 0.03 4.50 1.11 -1.00 0.34 116.67 126.28 2k78 s ASP 118 Ca -0.03 -0.70 -0.01 0.00 0.18 0.00 0.00 52.55 51.98 2k78 s ASP 118 Cb -0.04 -0.80 -0.02 0.00 1.07 0.00 0.00 42.92 43.13 2k78 s ASP 118 CO 0.03 -0.16 -0.00 0.68 1.18 0.00 0.00 175.17 176.89 2k78 s VAL 119 N -2.37 0.14 -0.26 -1.27 -7.23 -0.93 -2.09 120.40 106.39 2k78 s VAL 119 Ca 0.35 -1.19 -0.01 0.00 -1.81 0.00 0.00 61.98 59.31 2k78 s VAL 119 Cb -0.04 -0.73 0.14 0.00 0.56 0.00 0.00 36.38 36.31 2k78 s VAL 119 CO 0.21 -0.66 0.39 -0.47 -0.31 0.00 0.00 175.10 174.27 2k78 s TYR 120 N -2.34 -0.90 0.08 2.82 5.04 -1.18 -2.81 117.35 118.06 2k78 s TYR 120 Ca -0.08 0.73 0.05 0.00 -2.44 0.00 0.00 57.07 55.33 2k78 s TYR 120 Cb -0.03 -0.01 -0.03 0.00 0.35 0.00 0.00 41.96 42.24 2k78 s TYR 120 CO -0.04 -0.80 -0.14 0.42 -1.34 0.00 0.00 175.55 173.66 2k78 s ILE 121 N 2.56 1.13 -0.29 3.14 1.01 0.04 -4.39 121.20 124.40 2k78 s ILE 121 Ca 0.12 -1.42 0.03 0.00 0.00 0.00 0.00 60.65 59.38 2k78 s ILE 121 Cb -0.15 -1.19 0.19 0.00 0.01 0.00 0.00 42.46 41.33 2k78 s ILE 121 CO -0.20 -0.30 0.57 1.51 0.00 0.00 0.00 174.94 176.53 2k78 s ASP 122 N -1.95 -1.34 0.00 3.58 1.47 -1.25 -1.18 116.67 116.00 2k78 s ASP 122 Ca 0.01 0.43 0.00 0.00 1.18 0.00 0.00 52.55 54.17 2k78 s ASP 122 Cb -0.08 2.00 0.00 0.00 -0.34 0.00 0.00 42.92 44.49 2k78 s ASP 122 CO 0.02 -0.29 0.00 -1.84 0.68 0.00 0.00 175.17 173.74 2k78 n GLU 123 N 5.42 0.00 -4.05 2.11 0.28 -1.14 -4.99 120.64 118.26 2k78 n GLU 123 Ca 0.02 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.70 2k78 n GLU 123 Cb 0.52 0.00 -0.15 0.00 1.43 0.00 0.00 31.44 33.24 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 1.13 2.10 -0.24 3.44 1.02 -1.26 0.31 119.74 126.23 2k78 s LYS 124 Ca 0.00 -1.45 -0.29 0.00 0.02 0.00 0.00 55.97 54.25 2k78 s LYS 124 Cb 0.00 -2.96 -0.00 0.00 -0.52 0.00 0.00 37.83 34.35 2k78 s LYS 124 CO 0.00 -0.65 1.21 0.08 -0.92 0.00 0.00 175.35 175.07 2k78 s VAL 125 N 1.07 4.34 -0.87 3.17 1.01 0.29 -3.49 120.40 125.91 2k78 s VAL 125 Ca -0.05 1.58 0.00 0.00 0.00 0.00 0.00 61.98 63.51 2k78 s VAL 125 Cb -0.20 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.02 2k78 s VAL 125 CO -0.05 -0.30 0.00 0.59 0.00 0.00 0.00 175.10 175.34 2k78 n ASN 126 N 6.91 -3.28 -0.13 3.32 5.03 -1.26 -0.58 115.26 125.26 2k78 n ASN 126 Ca 0.14 0.25 0.00 0.00 0.87 0.00 0.00 54.58 55.84 2k78 n ASN 126 Cb 0.46 -2.85 0.00 0.00 -1.02 0.00 0.00 39.78 36.37 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 -0.69 1.10 2.83 7.41 0.00 -1.23 -5.08 105.19 109.54 2k78 n GLY 127 Ca -0.12 -0.35 -0.17 0.00 0.00 0.00 0.00 46.02 45.39 2k78 n GLY 127 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k78 s LYS 128 N -2.30 0.11 0.20 1.61 2.20 0.25 -5.07 119.74 116.73 2k78 s LYS 128 Ca 0.00 0.46 -0.32 0.00 -0.36 0.00 0.00 55.97 55.75 2k78 s LYS 128 Cb 0.00 -0.58 -0.15 0.00 -1.51 0.00 0.00 37.83 35.59 2k78 s LYS 128 CO 0.00 -0.43 1.15 -2.30 -0.36 0.00 0.00 175.35 173.42 2k78 n PRO 129 N 5.33 1.25 -3.72 4.03 -0.02 -1.26 0.11 135.00 140.72 2k78 n PRO 129 Ca -0.05 0.45 -0.26 0.00 -2.02 0.00 0.00 63.50 61.62 2k78 n PRO 129 Cb 0.50 -1.93 -0.17 0.00 -0.02 0.00 0.00 33.50 31.87 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 -0.32 0.70 -0.24 6.00 5.36 0.15 -4.76 117.98 124.88 2k78 s PHE 130 Ca 0.70 -0.49 -0.08 0.00 -0.96 0.00 0.00 56.93 56.10 2k78 s PHE 130 Cb -0.81 -0.86 -0.04 0.00 -0.34 0.00 0.00 43.02 40.97 2k78 s PHE 130 CO 0.53 -0.49 0.10 0.21 -1.46 0.00 0.00 175.22 174.11 2k78 s LYS 131 N 1.97 3.81 -0.06 10.12 2.20 -1.26 -2.91 119.74 133.61 2k78 s LYS 131 Ca 0.02 -0.40 0.01 0.00 -0.36 0.00 0.00 55.97 55.24 2k78 s LYS 131 Cb -0.15 -3.37 0.02 0.00 -1.51 0.00 0.00 37.83 32.81 2k78 s LYS 131 CO -0.07 -0.06 -0.08 -0.47 -0.36 0.00 0.00 175.35 174.31 2k78 s TYR 132 N 1.30 1.09 -0.32 4.03 5.04 -0.32 -4.96 117.35 123.21 2k78 s TYR 132 Ca 0.05 -0.38 -0.08 0.00 -2.44 0.00 0.00 57.07 54.22 2k78 s TYR 132 Cb -0.15 -0.88 0.19 0.00 0.35 0.00 0.00 41.96 41.47 2k78 s TYR 132 CO 0.05 -0.26 0.99 0.34 -1.34 0.00 0.00 175.55 175.33 2k78 s ASP 133 N 0.92 -0.52 0.19 4.32 -1.08 -1.25 -0.78 116.67 118.47 2k78 s ASP 133 Ca -0.11 -0.12 -0.04 0.00 -0.52 0.00 0.00 52.55 51.76 2k78 s ASP 133 Cb -0.15 0.94 0.02 0.00 -1.46 0.00 0.00 42.92 42.27 2k78 s ASP 133 CO 0.01 -0.07 0.32 1.57 0.52 0.00 0.00 175.17 177.51 2k78 n HIS 134 N 4.36 -1.30 -3.92 -5.34 -0.00 -1.13 -4.99 115.22 102.90 2k78 n HIS 134 Ca 0.07 -1.09 -0.29 0.00 0.46 0.00 0.00 57.72 56.87 2k78 n HIS 134 Cb 0.60 0.37 -0.13 0.00 -0.12 0.00 0.00 29.99 30.71 2k78 n HIS 134 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2k78 s HIS 135 N -4.67 3.26 0.80 1.57 0.09 -1.26 -2.18 115.29 112.89 2k78 s HIS 135 Ca 0.12 -3.20 -0.10 0.00 -0.00 0.00 0.00 55.06 51.88 2k78 s HIS 135 Cb -0.01 -2.73 0.18 0.00 -0.00 0.00 0.00 32.58 30.01 2k78 s HIS 135 CO 0.09 -0.67 1.09 0.66 -0.00 0.00 0.00 174.74 175.90 2k78 n TYR 136 N 2.71 -3.63 -3.98 1.40 4.01 0.15 -4.84 117.16 112.99 2k78 n TYR 136 Ca 0.11 -1.25 -0.10 0.00 -0.16 0.00 0.00 57.90 56.50 2k78 n TYR 136 Cb 0.33 -0.83 -0.06 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 -5.12 -0.04 0.18 7.72 2.20 -1.26 0.33 114.94 118.96 2k78 s ASN 137 Ca 0.65 -0.90 -0.19 0.00 -0.94 0.00 0.00 52.86 51.48 2k78 s ASN 137 Cb -0.02 0.51 0.04 0.00 -2.00 0.00 0.00 41.25 39.77 2k78 s ASN 137 CO 0.45 -1.01 0.53 0.27 -2.94 0.00 0.00 177.10 174.40 2k78 s ILE 138 N -4.00 0.03 -0.19 0.54 -4.36 -1.17 -4.37 121.20 107.68 2k78 s ILE 138 Ca 0.21 -0.60 -0.18 0.00 -0.26 0.00 0.00 60.65 59.81 2k78 s ILE 138 Cb 0.01 -1.42 -0.03 0.00 1.25 0.00 0.00 42.46 42.27 2k78 s ILE 138 CO 0.05 -0.12 0.49 -0.89 0.24 0.00 0.00 174.94 174.71 2k78 s THR 139 N -3.84 5.14 0.52 8.37 2.01 -0.62 -2.72 115.64 124.49 2k78 s THR 139 Ca 0.07 0.91 -0.02 0.00 0.31 0.00 0.00 61.69 62.96 2k78 s THR 139 Cb -0.01 -3.82 0.01 0.00 0.01 0.00 0.00 72.50 68.69 2k78 s THR 139 CO -0.06 0.22 0.77 -0.31 -0.69 0.00 0.00 174.62 174.55 2k78 s TYR 140 N 1.40 3.20 -0.29 4.92 2.02 0.04 -1.08 117.35 127.56 2k78 s TYR 140 Ca 0.24 0.38 0.02 0.00 -0.37 0.00 0.00 57.07 57.34 2k78 s TYR 140 Cb -0.15 -2.53 0.20 0.00 -0.40 0.00 0.00 41.96 39.07 2k78 s TYR 140 CO 0.09 -0.60 0.66 0.21 -1.57 0.00 0.00 175.55 174.35 2k78 s LYS 141 N -4.75 0.50 0.38 -0.62 2.36 0.20 -1.25 119.74 116.55 2k78 s LYS 141 Ca 0.51 0.55 -0.03 0.00 -2.55 0.00 0.00 55.97 54.46 2k78 s LYS 141 Cb -0.10 0.26 -0.04 0.00 -1.05 0.00 0.00 37.83 36.90 2k78 s LYS 141 CO 0.41 -0.87 0.63 -0.06 1.55 0.00 0.00 175.35 177.00 2k78 s PHE 142 N 2.85 3.51 -0.31 4.03 0.08 -1.02 0.20 117.98 127.32 2k78 s PHE 142 Ca 0.13 0.57 -0.01 0.00 0.12 0.00 0.00 56.93 57.74 2k78 s PHE 142 Cb -0.10 -2.08 0.13 0.00 -0.57 0.00 0.00 43.02 40.40 2k78 s PHE 142 CO -0.25 0.01 0.23 -0.80 -0.10 0.00 0.00 175.22 174.31 2k78 s ASN 143 N -3.84 2.50 0.00 1.36 0.01 0.41 -1.96 114.94 113.42 2k78 s ASN 143 Ca 0.43 -1.31 0.00 0.00 -0.71 0.00 0.00 52.86 51.28 2k78 s ASN 143 Cb -0.10 0.05 0.00 0.00 0.41 0.00 0.00 41.25 41.61 2k78 s ASN 143 CO 0.37 -0.38 0.00 0.61 -1.51 0.00 0.00 177.10 176.20 2k78 n GLY 144 N 4.93 4.03 3.37 0.66 0.00 -0.18 -2.32 105.19 115.68 2k78 n GLY 144 Ca 0.01 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.13 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 -3.28 0.20 1.61 -0.04 -1.26 -4.75 135.00 127.47 2k78 n PRO 145 Ca 0.00 -0.95 0.00 0.00 -0.04 0.00 0.00 63.50 62.51 2k78 n PRO 145 Cb 0.00 -2.06 0.00 0.00 -0.04 0.00 0.00 33.50 31.40 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 -5.27 0.00 -0.05 0.52 -2.24 -1.26 -4.38 114.28 101.60 2k78 n THR 146 Ca 0.05 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.80 2k78 n THR 146 Cb 0.56 -0.25 -0.09 0.00 -2.10 0.00 0.00 70.33 68.45 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 -3.49 2.19 -3.70 3.42 -0.08 -1.26 -5.02 116.55 108.62 2k78 n ASP 147 Ca 0.00 0.00 -0.23 0.00 -1.51 0.00 0.00 54.79 53.05 2k78 n ASP 147 Cb 0.00 0.95 0.05 0.00 2.34 0.00 0.00 41.12 44.45 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 -2.32 -3.89 -2.64 5.18 0.31 -1.26 -4.89 118.33 108.83 2k78 n VAL 148 Ca -0.15 -0.31 -0.42 0.00 -0.01 0.00 0.00 64.34 63.45 2k78 n VAL 148 Cb 0.75 -3.76 -0.03 0.00 -0.91 0.00 0.00 33.84 29.89 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 -3.48 2.96 0.00 3.52 0.00 -1.26 -5.27 121.76 118.24 2k78 s ALA 149 Ca 0.25 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 51.09 2k78 s ALA 149 Cb -0.12 -4.03 0.00 0.00 0.00 0.00 0.00 23.12 18.97 2k78 s ALA 149 CO 0.79 -2.80 0.46 0.41 0.00 0.00 0.00 175.76 174.62