#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 2.76 -1.22 -1.46 0.00 -1.26 -3.83 121.76 116.75 2k78 s ALA 26 Ca 0.00 -1.83 -0.04 0.00 0.00 0.00 0.00 51.96 50.09 2k78 s ALA 26 Cb 0.00 -4.37 0.00 0.00 0.00 0.00 0.00 23.12 18.76 2k78 s ALA 26 CO 0.00 -3.42 0.52 -1.71 0.00 0.00 0.00 175.76 171.16 2k78 n ASN 27 N 9.03 -5.22 -3.41 0.00 2.85 -1.26 -4.96 115.26 112.30 2k78 n ASN 27 Ca 0.17 -0.24 -0.27 0.00 -0.11 0.00 0.00 54.58 54.13 2k78 n ASN 27 Cb 0.50 -4.04 -0.10 0.00 1.24 0.00 0.00 39.78 37.38 2k78 n ASN 27 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k78 n ALA 28 N -3.30 2.87 -0.01 5.20 0.00 -1.25 -4.98 120.51 119.04 2k78 n ALA 28 Ca -0.08 -3.20 -0.12 0.00 0.00 0.00 0.00 53.44 50.04 2k78 n ALA 28 Cb 0.59 -0.77 -0.10 0.00 0.00 0.00 0.00 19.45 19.17 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 5.52 -0.06 -4.87 0.00 0.00 -1.93 -3.46 119.26 114.47 2k78 h ALA 29 Ca 0.25 -0.31 -0.37 0.00 0.00 0.00 0.00 54.91 54.48 2k78 h ALA 29 Cb 0.90 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 2k78 h ALA 29 CO 0.40 -0.18 -0.54 -0.25 0.00 0.00 0.00 179.25 178.68 2k78 n ASP 30 N -4.79 -4.53 -3.54 0.00 8.00 -1.26 -4.84 116.55 105.58 2k78 n ASP 30 Ca -0.08 -0.27 -0.17 0.00 0.71 0.00 0.00 54.79 54.98 2k78 n ASP 30 Cb 0.32 -3.73 -0.06 0.00 -0.02 0.00 0.00 41.12 37.63 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 -2.60 -0.65 0.00 -2.24 1.04 -1.26 0.39 113.70 108.37 2k78 s SER 31 Ca 0.30 0.83 0.00 0.00 0.48 0.00 0.00 55.95 57.57 2k78 s SER 31 Cb -0.15 0.70 0.00 0.00 0.10 0.00 0.00 66.02 66.66 2k78 s SER 31 CO 0.37 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.68 2k78 n GLY 32 N 1.24 0.16 3.51 7.32 0.00 -0.17 -4.97 105.19 112.28 2k78 n GLY 32 Ca -0.17 -1.04 -0.43 0.00 0.00 0.00 0.00 46.02 44.38 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 4.67 0.29 2.61 -4.23 -1.26 0.11 115.64 115.82 2k78 s THR 33 Ca 0.00 0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.61 2k78 s THR 33 Cb 0.00 -4.35 -0.04 0.00 1.34 0.00 0.00 72.50 69.45 2k78 s THR 33 CO 0.00 -0.83 0.48 -0.22 -0.54 0.00 0.00 174.62 173.51 2k78 s LEU 34 N 3.22 4.12 0.31 4.79 2.96 0.29 -4.88 118.68 129.48 2k78 s LEU 34 Ca 0.25 0.40 -0.26 0.00 -0.22 0.00 0.00 54.13 54.30 2k78 s LEU 34 Cb -0.14 -3.22 -0.10 0.00 0.50 0.00 0.00 46.19 43.23 2k78 s LEU 34 CO 0.18 -0.18 0.93 0.20 -1.32 0.00 0.00 176.35 176.16 2k78 s ASN 35 N -3.72 7.36 -0.01 3.68 0.01 -1.09 -2.65 114.94 118.53 2k78 s ASN 35 Ca 0.39 1.82 -0.28 0.00 -0.71 0.00 0.00 52.86 54.08 2k78 s ASN 35 Cb -0.10 -2.57 0.10 0.00 0.41 0.00 0.00 41.25 39.08 2k78 s ASN 35 CO 0.33 -0.03 0.82 -0.72 -1.51 0.00 0.00 177.10 175.98 2k78 s TYR 36 N -1.55 -0.44 0.22 2.20 1.13 -1.26 0.16 117.35 117.81 2k78 s TYR 36 Ca 0.48 0.47 -0.06 0.00 -1.41 0.00 0.00 57.07 56.56 2k78 s TYR 36 Cb -0.19 0.50 0.02 0.00 -1.10 0.00 0.00 41.96 41.19 2k78 s TYR 36 CO 0.25 -0.58 0.39 -1.91 -2.51 0.00 0.00 175.55 171.19 2k78 n GLU 37 N 0.11 0.57 -4.24 -3.49 2.13 0.16 -4.85 120.64 111.03 2k78 n GLU 37 Ca -0.12 -1.45 -0.16 0.00 0.66 0.00 0.00 57.16 56.09 2k78 n GLU 37 Cb 0.61 1.62 -0.09 0.00 0.27 0.00 0.00 31.44 33.85 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 -2.55 0.00 0.11 6.31 -7.23 -1.26 0.11 120.40 115.88 2k78 s VAL 38 Ca 0.13 -1.98 -0.11 0.00 -1.81 0.00 0.00 61.98 58.20 2k78 s VAL 38 Cb -0.02 -2.50 0.01 0.00 0.56 0.00 0.00 36.38 34.43 2k78 s VAL 38 CO 0.09 0.00 0.26 -0.31 -0.31 0.00 0.00 175.10 174.84 2k78 s TYR 39 N -3.75 0.07 -0.07 2.82 2.02 -0.09 -3.99 117.35 114.36 2k78 s TYR 39 Ca 0.40 -0.46 -0.30 0.00 -0.37 0.00 0.00 57.07 56.34 2k78 s TYR 39 Cb 0.04 0.04 -0.05 0.00 -0.40 0.00 0.00 41.96 41.59 2k78 s TYR 39 CO 0.21 -0.61 1.61 0.21 -1.57 0.00 0.00 175.55 175.39 2k78 s LYS 40 N -3.85 4.19 0.45 -0.62 2.36 -1.05 -1.99 119.74 119.23 2k78 s LYS 40 Ca 0.06 2.12 -0.22 0.00 -2.55 0.00 0.00 55.97 55.38 2k78 s LYS 40 Cb 0.04 -3.96 -0.11 0.00 -1.05 0.00 0.00 37.83 32.75 2k78 s LYS 40 CO -0.10 -0.83 0.67 0.98 1.55 0.00 0.00 175.35 177.62 2k78 n TYR 41 N 7.08 -0.07 -0.86 4.03 9.36 -1.26 -0.57 117.16 134.86 2k78 n TYR 41 Ca 0.17 0.56 0.00 0.00 3.32 0.00 0.00 57.90 61.95 2k78 n TYR 41 Cb 0.43 -2.05 0.00 0.00 -0.63 0.00 0.00 39.34 37.09 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 0.86 -0.96 -0.37 2.98 2.85 -1.26 -4.94 115.26 114.42 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 0.41 -1.09 0.00 0.00 1.24 0.00 0.00 39.78 40.34 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 -2.15 0.00 -1.14 -0.44 -2.24 0.26 -5.07 114.28 103.51 2k78 n THR 43 Ca 0.00 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.79 2k78 n THR 43 Cb 0.04 0.00 0.02 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 -0.76 0.58 -3.81 3.42 4.13 -1.26 -4.75 115.26 112.81 2k78 n ASN 44 Ca 0.00 -1.68 -0.22 0.00 1.68 0.00 0.00 54.58 54.36 2k78 n ASN 44 Cb 0.00 -0.11 -0.17 0.00 -1.54 0.00 0.00 39.78 37.96 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 -0.77 1.32 0.23 6.41 -1.08 -1.26 -4.90 116.67 116.61 2k78 s ASP 45 Ca 0.03 -0.10 -0.31 0.00 -0.52 0.00 0.00 52.55 51.65 2k78 s ASP 45 Cb 0.03 -0.43 -0.12 0.00 -1.46 0.00 0.00 42.92 40.94 2k78 s ASP 45 CO 0.00 -0.15 1.68 -0.89 0.52 0.00 0.00 175.17 176.34 2k78 s THR 46 N 1.59 2.08 0.00 1.71 2.01 -1.26 -2.52 115.64 119.25 2k78 s THR 46 Ca -0.01 0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.05 2k78 s THR 46 Cb -0.13 -3.04 0.00 0.00 0.01 0.00 0.00 72.50 69.34 2k78 s THR 46 CO -0.04 0.01 0.00 -1.20 -0.69 0.00 0.00 174.62 172.70 2k78 n SER 47 N 3.51 2.14 0.06 3.53 7.64 -1.26 -4.79 113.62 124.44 2k78 n SER 47 Ca 0.14 -0.09 0.00 0.00 1.01 0.00 0.00 58.87 59.93 2k78 n SER 47 Cb 0.36 0.60 0.00 0.00 -1.01 0.00 0.00 64.21 64.16 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 -0.81 0.08 0.17 0.44 5.41 -1.26 -4.83 119.36 118.55 2k78 n ILE 48 Ca 0.00 0.02 0.17 0.00 1.00 0.00 0.00 62.75 63.95 2k78 n ILE 48 Cb 0.00 -0.36 0.65 0.00 -0.71 0.00 0.00 39.64 39.22 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 1.93 0.00 -1.39 0.00 -1.94 0.36 119.26 118.23 2k78 h ALA 49 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2k78 h ALA 49 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2k78 h ALA 49 CO 0.00 -0.72 0.00 -1.71 0.00 0.00 0.00 179.25 176.82 2k78 n ASN 50 N -3.22 0.00 -1.44 0.00 2.85 -1.26 -2.47 115.26 109.71 2k78 n ASN 50 Ca 0.05 0.44 0.09 0.00 -0.11 0.00 0.00 54.58 55.05 2k78 n ASN 50 Cb 0.69 -0.47 0.33 0.00 1.24 0.00 0.00 39.78 41.57 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 -1.47 4.54 0.00 1.20 8.00 0.13 -4.33 116.55 124.62 2k78 n ASP 51 Ca 0.04 -2.47 0.00 0.00 0.71 0.00 0.00 54.79 53.07 2k78 n ASP 51 Cb 0.17 -0.55 0.00 0.00 -0.02 0.00 0.00 41.12 40.73 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 -3.95 1.24 4.01 -1.03 -5.02 117.16 113.32 2k78 n TYR 52 Ca 0.24 -0.04 -0.30 0.00 -0.16 0.00 0.00 57.90 57.64 2k78 n TYR 52 Cb 0.86 -0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.72 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 -0.09 2.32 0.87 -0.72 0.08 -1.23 -3.00 117.98 116.21 2k78 s PHE 53 Ca 0.00 -1.64 -0.12 0.00 0.12 0.00 0.00 56.93 55.29 2k78 s PHE 53 Cb 0.00 -1.56 0.11 0.00 -0.57 0.00 0.00 43.02 41.00 2k78 s PHE 53 CO 0.00 -0.75 1.10 -0.80 -0.10 0.00 0.00 175.22 174.67 2k78 s ASN 54 N 1.42 3.77 0.15 1.36 0.01 -1.26 -4.98 114.94 115.41 2k78 s ASN 54 Ca -0.04 1.36 -0.09 0.00 -0.71 0.00 0.00 52.86 53.38 2k78 s ASN 54 Cb -0.18 -2.05 -0.01 0.00 0.41 0.00 0.00 41.25 39.43 2k78 s ASN 54 CO -0.07 -2.44 0.26 -1.59 -1.51 0.00 0.00 177.10 171.76 2k78 s LYS 55 N -5.04 1.11 0.55 -0.60 -2.85 -1.26 -4.62 119.74 107.03 2k78 s LYS 55 Ca 0.63 -1.15 -0.09 0.00 -1.00 0.00 0.00 55.97 54.35 2k78 s LYS 55 Cb -0.16 0.37 0.13 0.00 -2.06 0.00 0.00 37.83 36.10 2k78 s LYS 55 CO 0.56 -0.40 0.75 -0.35 0.10 0.00 0.00 175.35 176.01 2k78 n PRO 56 N -0.19 -0.68 -3.30 1.78 -0.04 -1.26 -5.15 135.00 126.15 2k78 n PRO 56 Ca -0.08 -1.20 -0.19 0.00 -0.04 0.00 0.00 63.50 61.99 2k78 n PRO 56 Cb 0.63 -0.75 -0.01 0.00 -0.04 0.00 0.00 33.50 33.33 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 -3.92 4.29 -0.26 0.55 0.00 -1.08 -4.93 121.76 116.42 2k78 s ALA 57 Ca 0.43 -1.70 -0.10 0.00 0.00 0.00 0.00 51.96 50.59 2k78 s ALA 57 Cb -0.01 -1.42 -0.04 0.00 0.00 0.00 0.00 23.12 21.64 2k78 s ALA 57 CO 0.30 -0.20 0.15 0.21 0.00 0.00 0.00 175.76 176.21 2k78 s LYS 58 N -4.23 3.89 0.25 0.00 2.36 -1.16 -0.55 119.74 120.30 2k78 s LYS 58 Ca 0.50 -0.36 0.03 0.00 -2.55 0.00 0.00 55.97 53.60 2k78 s LYS 58 Cb -0.08 -3.52 -0.03 0.00 -1.05 0.00 0.00 37.83 33.15 2k78 s LYS 58 CO 0.31 -0.12 0.40 1.52 1.55 0.00 0.00 175.35 179.01 2k78 s TYR 59 N 1.54 3.47 -0.07 4.03 1.13 0.30 -0.61 117.35 127.13 2k78 s TYR 59 Ca 0.07 0.13 -0.22 0.00 -1.41 0.00 0.00 57.07 55.63 2k78 s TYR 59 Cb -0.15 -1.69 0.05 0.00 -1.10 0.00 0.00 41.96 39.06 2k78 s TYR 59 CO 0.07 0.37 0.51 -1.50 -2.51 0.00 0.00 175.55 172.49 2k78 s ILE 60 N -2.02 0.02 0.34 -3.49 2.07 -0.98 -1.00 121.20 116.14 2k78 s ILE 60 Ca 0.36 -0.17 0.03 0.00 -1.41 0.00 0.00 60.65 59.46 2k78 s ILE 60 Cb -0.10 -0.80 -0.04 0.00 0.13 0.00 0.00 42.46 41.65 2k78 s ILE 60 CO 0.31 -0.09 0.12 -0.54 -1.91 0.00 0.00 174.94 172.82 2k78 s LYS 61 N -0.89 1.70 -0.45 3.50 1.02 0.16 0.48 119.74 125.26 2k78 s LYS 61 Ca -0.09 -1.99 0.07 0.00 0.02 0.00 0.00 55.97 53.98 2k78 s LYS 61 Cb -0.03 -0.47 0.31 0.00 -0.52 0.00 0.00 37.83 37.12 2k78 s LYS 61 CO 0.06 -0.38 1.01 1.63 -0.92 0.00 0.00 175.35 176.75 2k78 n LYS 62 N -0.71 0.96 -3.13 1.68 4.76 0.12 -4.70 118.16 117.14 2k78 n LYS 62 Ca -0.02 -2.13 -0.13 0.00 -2.87 0.00 0.00 58.31 53.16 2k78 n LYS 62 Cb 0.65 -1.20 0.01 0.00 -1.84 0.00 0.00 35.03 32.66 2k78 n LYS 62 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2k78 n ASN 63 N 0.61 -6.79 0.00 4.39 4.13 -1.26 -3.93 115.26 112.41 2k78 n ASN 63 Ca 0.09 0.47 0.00 0.00 1.68 0.00 0.00 54.58 56.82 2k78 n ASN 63 Cb 0.68 -3.01 0.00 0.00 -1.54 0.00 0.00 39.78 35.90 2k78 n ASN 63 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2k78 n GLY 64 N 0.46 0.76 3.59 7.41 0.00 -1.26 -5.05 105.19 111.09 2k78 n GLY 64 Ca -0.01 -0.34 -0.07 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.77 1.07 -0.21 1.61 -2.85 -1.25 -5.13 119.74 112.21 2k78 s LYS 65 Ca 0.00 -0.48 -0.32 0.00 -1.00 0.00 0.00 55.97 54.17 2k78 s LYS 65 Cb 0.00 0.44 0.15 0.00 -2.06 0.00 0.00 37.83 36.36 2k78 s LYS 65 CO 0.00 -0.48 1.20 -0.48 0.10 0.00 0.00 175.35 175.69 2k78 s LEU 66 N -2.69 -0.17 0.00 2.77 2.34 -1.26 0.11 118.68 119.79 2k78 s LEU 66 Ca 0.07 0.10 0.00 0.00 0.06 0.00 0.00 54.13 54.36 2k78 s LEU 66 Cb -0.01 1.42 0.00 0.00 -0.56 0.00 0.00 46.19 47.04 2k78 s LEU 66 CO -0.05 -0.21 0.00 -1.22 -1.06 0.00 0.00 176.35 173.80 2k78 n TYR 67 N 0.27 0.00 -3.64 3.48 4.02 0.18 -3.52 117.16 117.94 2k78 n TYR 67 Ca -0.02 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.82 2k78 n TYR 67 Cb 0.58 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 -0.05 0.00 -0.13 -0.72 1.01 -0.38 -2.32 120.40 117.80 2k78 s VAL 68 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 61.98 61.87 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 0.23 0.00 0.00 0.00 0.00 175.10 175.33 2k78 s GLN 69 N 0.79 3.94 -0.06 2.72 1.03 0.22 0.31 119.66 128.62 2k78 s GLN 69 Ca -0.03 0.01 0.03 0.00 0.04 0.00 0.00 55.36 55.40 2k78 s GLN 69 Cb -0.04 -3.32 -0.03 0.00 0.03 0.00 0.00 33.01 29.65 2k78 s GLN 69 CO -0.12 0.49 -0.12 0.42 -2.54 0.00 0.00 175.29 173.42 2k78 s ILE 70 N -0.26 3.23 -0.03 3.63 -1.09 0.57 -2.97 121.20 124.28 2k78 s ILE 70 Ca 0.15 -0.66 -0.20 0.00 -2.23 0.00 0.00 60.65 57.71 2k78 s ILE 70 Cb -0.13 -2.28 -0.05 0.00 -1.58 0.00 0.00 42.46 38.42 2k78 s ILE 70 CO 0.04 0.59 0.58 -0.89 -1.23 0.00 0.00 174.94 174.03 2k78 s THR 71 N -0.70 4.98 -0.22 2.92 2.01 -1.26 -1.83 115.64 121.53 2k78 s THR 71 Ca 0.11 1.20 -0.09 0.00 0.31 0.00 0.00 61.69 63.22 2k78 s THR 71 Cb -0.11 -3.91 -0.04 0.00 0.01 0.00 0.00 72.50 68.44 2k78 s THR 71 CO 0.01 0.39 0.11 -0.69 -0.69 0.00 0.00 174.62 173.74 2k78 s VAL 72 N 0.04 4.94 -0.22 3.82 1.01 0.44 -4.14 120.40 126.29 2k78 s VAL 72 Ca 0.31 0.03 -0.11 0.00 0.00 0.00 0.00 61.98 62.20 2k78 s VAL 72 Cb -0.17 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.88 2k78 s VAL 72 CO 0.16 0.38 0.18 0.21 0.00 0.00 0.00 175.10 176.03 2k78 s ASN 73 N 0.96 6.20 -0.18 3.32 2.47 -1.16 -2.59 114.94 123.95 2k78 s ASN 73 Ca 0.05 0.21 -0.11 0.00 0.42 0.00 0.00 52.86 53.44 2k78 s ASN 73 Cb -0.14 -2.12 0.04 0.00 -1.45 0.00 0.00 41.25 37.59 2k78 s ASN 73 CO 0.03 0.09 0.22 1.41 -3.72 0.00 0.00 177.10 175.13 2k78 n HIS 74 N 4.02 -4.18 0.18 0.43 8.25 -0.91 -4.63 115.22 118.37 2k78 n HIS 74 Ca -0.14 2.40 0.05 0.00 -0.26 0.00 0.00 57.72 59.77 2k78 n HIS 74 Cb 0.52 -3.74 0.26 0.00 1.12 0.00 0.00 29.99 28.15 2k78 n HIS 74 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2k78 h SER 75 N 4.14 0.00 -0.66 0.41 0.02 -1.81 -2.98 113.55 112.67 2k78 h SER 75 Ca -0.51 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.47 2k78 h SER 75 Cb 1.14 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.65 2k78 h SER 75 CO 0.01 0.40 0.43 -0.74 -1.14 0.00 0.00 176.83 175.80 2k78 h HIS 76 N 0.00 0.79 0.00 3.45 -0.00 -1.89 -3.12 115.15 114.38 2k78 h HIS 76 Ca -0.00 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.33 2k78 h HIS 76 Cb 1.03 -0.26 -0.01 0.00 -0.00 0.00 0.00 27.41 28.16 2k78 h HIS 76 CO 0.00 0.48 -0.31 -1.49 -0.00 0.00 0.00 177.93 176.61 2k78 h TRP 77 N 0.83 0.00 -3.43 5.26 6.55 -1.75 -3.38 115.95 120.03 2k78 h TRP 77 Ca 0.25 0.00 -0.60 0.00 0.95 0.00 0.00 58.89 59.49 2k78 h TRP 77 Cb -0.01 0.00 -0.10 0.00 -0.86 0.00 0.00 29.16 28.19 2k78 h TRP 77 CO -0.00 0.90 0.13 -1.50 -1.05 0.00 0.00 178.44 176.92 2k78 s ILE 78 N -2.15 5.01 -0.13 1.49 2.07 -1.13 -3.13 121.20 123.23 2k78 s ILE 78 Ca -0.18 1.17 0.16 0.00 -1.41 0.00 0.00 60.65 60.39 2k78 s ILE 78 Cb -0.00 -3.94 -0.08 0.00 0.13 0.00 0.00 42.46 38.57 2k78 s ILE 78 CO 0.54 0.09 1.01 0.00 -1.91 0.00 0.00 174.94 174.66 2k78 h THR 79 N 5.23 0.60 -1.82 4.00 1.03 -1.60 -3.42 112.91 116.94 2k78 h THR 79 Ca -0.30 -2.05 0.41 0.00 -0.01 0.00 0.00 66.41 64.46 2k78 h THR 79 Cb 1.14 2.13 -0.09 0.00 -1.07 0.00 0.00 68.15 70.26 2k78 h THR 79 CO 0.77 0.34 1.02 -0.83 -0.01 0.00 0.00 175.52 176.81 2k78 s GLY 80 N -4.69 -0.27 0.11 2.99 0.00 -1.12 -4.94 107.32 99.41 2k78 s GLY 80 Ca -0.01 0.31 -0.13 0.00 0.00 0.00 0.00 44.72 44.89 2k78 s GLY 80 CO 0.79 5.73 0.32 1.06 0.00 0.00 0.00 173.10 181.00 2k78 s MET 81 N -2.01 0.99 0.15 2.90 -1.94 -1.26 -2.73 119.30 115.40 2k78 s MET 81 Ca 0.29 -0.82 -0.17 0.00 -1.71 0.00 0.00 55.69 53.28 2k78 s MET 81 Cb 0.01 0.42 0.04 0.00 2.01 0.00 0.00 34.83 37.31 2k78 s MET 81 CO -0.04 -0.36 0.46 0.45 -0.01 0.00 0.00 175.02 175.52 2k78 s SER 82 N -2.83 -0.29 0.02 3.03 0.15 0.45 -3.06 113.70 111.17 2k78 s SER 82 Ca 0.04 -0.32 -0.14 0.00 0.70 0.00 0.00 55.95 56.23 2k78 s SER 82 Cb 0.03 0.52 0.02 0.00 -1.71 0.00 0.00 66.02 64.88 2k78 s SER 82 CO -0.11 -0.92 0.31 -0.63 1.20 0.00 0.00 173.24 173.09 2k78 s ILE 83 N -3.81 0.07 -0.48 6.45 1.01 -0.57 -0.89 121.20 122.98 2k78 s ILE 83 Ca 0.04 -0.59 0.00 0.00 0.00 0.00 0.00 60.65 60.11 2k78 s ILE 83 Cb 0.01 -0.79 0.00 0.00 0.01 0.00 0.00 42.46 41.69 2k78 s ILE 83 CO -0.10 -0.32 0.00 1.21 0.00 0.00 0.00 174.94 175.73 2k78 n GLU 84 N 0.90 -1.61 -0.67 2.79 0.00 -1.23 -1.58 120.64 119.24 2k78 n GLU 84 Ca -0.20 0.61 0.00 0.00 0.00 0.00 0.00 57.16 57.57 2k78 n GLU 84 Cb 0.58 -4.89 0.00 0.00 0.00 0.00 0.00 31.44 27.12 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 0.14 0.62 3.11 8.31 0.00 -1.26 -5.06 105.19 111.05 2k78 n GLY 85 Ca -0.05 -0.70 -0.09 0.00 0.00 0.00 0.00 46.02 45.19 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 0.64 1.03 1.61 -3.43 -0.62 -5.14 115.29 107.39 2k78 s HIS 86 Ca 0.00 -0.95 -0.14 0.00 -0.80 0.00 0.00 55.06 53.17 2k78 s HIS 86 Cb 0.00 -0.42 0.21 0.00 -1.43 0.00 0.00 32.58 30.93 2k78 s HIS 86 CO 0.00 -0.27 1.12 0.21 -2.00 0.00 0.00 174.74 173.80 2k78 s LYS 87 N -3.60 0.14 0.43 -0.38 2.36 -1.26 -1.51 119.74 115.92 2k78 s LYS 87 Ca 0.06 0.27 0.08 0.00 -2.55 0.00 0.00 55.97 53.83 2k78 s LYS 87 Cb 0.05 -1.73 0.01 0.00 -1.05 0.00 0.00 37.83 35.12 2k78 s LYS 87 CO -0.07 -2.87 0.57 -1.83 1.55 0.00 0.00 175.35 172.70 2k78 s GLU 88 N -5.18 2.78 -0.18 4.03 -1.05 -1.17 -4.67 118.70 113.25 2k78 s GLU 88 Ca 0.67 -1.29 -0.06 0.00 -0.15 0.00 0.00 54.97 54.14 2k78 s GLU 88 Cb -0.15 -2.72 -0.04 0.00 -0.44 0.00 0.00 34.13 30.78 2k78 s GLU 88 CO 0.56 -0.30 0.03 1.21 0.95 0.00 0.00 175.26 177.72 2k78 s ASN 89 N -4.35 5.38 -0.54 0.83 3.04 -1.21 -4.96 114.94 113.13 2k78 s ASN 89 Ca 0.55 0.01 -0.27 0.00 0.04 0.00 0.00 52.86 53.19 2k78 s ASN 89 Cb -0.09 -1.91 -0.03 0.00 -1.54 0.00 0.00 41.25 37.68 2k78 s ASN 89 CO 0.33 0.16 1.95 0.27 -3.04 0.00 0.00 177.10 176.77 2k78 s ILE 90 N 0.42 3.31 -0.12 -5.21 -4.36 -1.26 -2.89 121.20 111.08 2k78 s ILE 90 Ca 0.01 0.22 0.18 0.00 -0.26 0.00 0.00 60.65 60.80 2k78 s ILE 90 Cb -0.13 -3.72 -0.21 0.00 1.25 0.00 0.00 42.46 39.64 2k78 s ILE 90 CO 0.01 -0.66 0.52 0.00 0.24 0.00 0.00 174.94 175.05 2k78 n ILE 91 N 7.39 1.08 -3.15 8.37 3.06 -0.78 -4.88 119.36 130.44 2k78 n ILE 91 Ca 0.24 -0.72 0.05 0.00 -2.50 0.00 0.00 62.75 59.82 2k78 n ILE 91 Cb 0.52 -0.55 -0.00 0.00 0.54 0.00 0.00 39.64 40.14 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 -5.50 -1.06 0.10 9.51 0.01 -1.19 -4.96 113.70 110.61 2k78 s SER 92 Ca -0.06 0.14 -0.06 0.00 1.31 0.00 0.00 55.95 57.28 2k78 s SER 92 Cb 0.09 1.68 -0.05 0.00 0.21 0.00 0.00 66.02 67.94 2k78 s SER 92 CO 0.83 -0.19 0.35 -0.75 0.41 0.00 0.00 173.24 173.89 2k78 s LYS 93 N 2.89 3.63 -0.40 12.44 2.20 -1.26 -0.91 119.74 138.32 2k78 s LYS 93 Ca 0.18 -0.06 0.03 0.00 -0.36 0.00 0.00 55.97 55.77 2k78 s LYS 93 Cb -0.06 -2.94 0.16 0.00 -1.51 0.00 0.00 37.83 33.48 2k78 s LYS 93 CO -0.24 0.53 0.35 1.21 -0.36 0.00 0.00 175.35 176.83 2k78 s ASN 94 N -2.16 1.51 0.31 1.43 3.04 0.40 -4.91 114.94 114.57 2k78 s ASN 94 Ca 0.36 -2.49 0.12 0.00 0.04 0.00 0.00 52.86 50.90 2k78 s ASN 94 Cb -0.13 -0.06 0.49 0.00 -1.54 0.00 0.00 41.25 40.01 2k78 s ASN 94 CO 0.22 -0.21 1.68 0.71 -3.04 0.00 0.00 177.10 176.46 2k78 h THR 95 N 4.83 1.32 0.22 -5.21 1.35 -1.95 0.54 112.91 114.01 2k78 h THR 95 Ca 0.16 -1.84 -0.01 0.00 -0.55 0.00 0.00 66.41 64.17 2k78 h THR 95 Cb 0.97 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 69.40 2k78 h THR 95 CO 0.28 0.52 -0.11 0.00 -0.25 0.00 0.00 175.52 175.96 2k78 h ALA 96 N 1.47 -0.30 -0.53 6.62 0.00 -1.93 -2.95 119.26 121.65 2k78 h ALA 96 Ca -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2k78 h ALA 96 Cb 0.97 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2k78 h ALA 96 CO 0.07 -0.60 0.00 1.63 0.00 0.00 0.00 179.25 180.35 2k78 n LYS 97 N -5.16 3.47 -3.51 0.00 5.02 -1.22 -4.95 118.16 111.81 2k78 n LYS 97 Ca -0.09 -2.43 -0.23 0.00 -2.02 0.00 0.00 58.31 53.54 2k78 n LYS 97 Cb 0.19 -1.86 0.04 0.00 -0.02 0.00 0.00 35.03 33.38 2k78 n LYS 97 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2k78 n ASP 98 N 0.84 -5.93 -3.84 4.39 9.92 -0.20 -4.86 116.55 116.86 2k78 n ASP 98 Ca 0.22 -0.81 -0.09 0.00 -0.53 0.00 0.00 54.79 53.58 2k78 n ASP 98 Cb 0.82 -3.86 -0.07 0.00 -0.64 0.00 0.00 41.12 37.37 2k78 n ASP 98 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2k78 s GLU 99 N -5.12 0.93 0.02 -1.24 2.02 0.17 -2.15 118.70 113.34 2k78 s GLU 99 Ca 0.35 -0.95 -0.28 0.00 0.02 0.00 0.00 54.97 54.11 2k78 s GLU 99 Cb -0.11 0.37 0.10 0.00 0.10 0.00 0.00 34.13 34.59 2k78 s GLU 99 CO 0.82 -0.32 0.89 0.50 0.02 0.00 0.00 175.26 177.18 2k78 s ARG 100 N -3.87 0.89 0.02 1.61 3.52 -1.07 0.15 118.95 120.21 2k78 s ARG 100 Ca 0.07 -0.36 -0.05 0.00 -0.13 0.00 0.00 55.73 55.26 2k78 s ARG 100 Cb 0.04 0.39 -0.01 0.00 -1.56 0.00 0.00 34.95 33.81 2k78 s ARG 100 CO -0.09 -0.39 0.08 0.99 -0.81 0.00 0.00 175.30 175.07 2k78 s THR 101 N -3.17 0.11 -0.06 4.11 2.01 -0.09 0.17 115.64 118.72 2k78 s THR 101 Ca 0.06 -0.92 -0.09 0.00 0.31 0.00 0.00 61.69 61.05 2k78 s THR 101 Cb -0.01 -0.59 0.02 0.00 0.01 0.00 0.00 72.50 71.93 2k78 s THR 101 CO -0.08 -0.51 0.22 -0.94 -0.69 0.00 0.00 174.62 172.62 2k78 s SER 102 N -1.71 -0.17 0.16 3.53 1.04 -0.76 -1.87 113.70 113.91 2k78 s SER 102 Ca -0.11 0.26 -0.09 0.00 0.48 0.00 0.00 55.95 56.49 2k78 s SER 102 Cb -0.05 0.39 -0.06 0.00 0.10 0.00 0.00 66.02 66.39 2k78 s SER 102 CO -0.02 -0.19 0.47 -0.70 0.98 0.00 0.00 173.24 173.78 2k78 s GLU 103 N -0.40 3.77 -0.03 4.02 2.12 -1.14 -0.31 118.70 126.73 2k78 s GLU 103 Ca -0.05 0.19 0.03 0.00 0.36 0.00 0.00 54.97 55.50 2k78 s GLU 103 Cb -0.03 -2.83 0.00 0.00 0.26 0.00 0.00 34.13 31.53 2k78 s GLU 103 CO 0.01 0.44 -0.12 -0.06 -0.54 0.00 0.00 175.26 175.00 2k78 s PHE 104 N -1.61 1.20 -0.22 5.30 0.08 0.15 -3.31 117.98 119.57 2k78 s PHE 104 Ca 0.41 -0.32 -0.13 0.00 0.12 0.00 0.00 56.93 57.01 2k78 s PHE 104 Cb -0.13 -0.83 -0.04 0.00 -0.57 0.00 0.00 43.02 41.45 2k78 s PHE 104 CO 0.21 -0.12 0.28 -2.00 -0.10 0.00 0.00 175.22 173.49 2k78 s GLU 105 N 0.13 4.12 0.11 0.44 -6.30 -1.26 -1.25 118.70 114.69 2k78 s GLU 105 Ca -0.03 -0.04 -0.11 0.00 -2.50 0.00 0.00 54.97 52.29 2k78 s GLU 105 Cb -0.09 -3.54 0.01 0.00 0.00 0.00 0.00 34.13 30.51 2k78 s GLU 105 CO 0.01 0.01 0.28 0.54 0.02 0.00 0.00 175.26 176.12 2k78 s VAL 106 N 1.18 0.11 -0.28 3.70 0.11 -1.23 -4.85 120.40 119.14 2k78 s VAL 106 Ca 0.13 -1.03 -0.29 0.00 -2.93 0.00 0.00 61.98 57.86 2k78 s VAL 106 Cb -0.14 -1.38 -0.02 0.00 -1.53 0.00 0.00 36.38 33.31 2k78 s VAL 106 CO 0.06 -0.48 1.63 -0.94 -3.33 0.00 0.00 175.10 172.03 2k78 s SER 107 N -2.86 6.26 0.24 3.54 1.04 -1.26 -4.67 113.70 115.99 2k78 s SER 107 Ca 0.06 1.42 0.00 0.00 0.48 0.00 0.00 55.95 57.92 2k78 s SER 107 Cb 0.04 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.62 2k78 s SER 107 CO -0.09 -1.39 0.00 0.29 0.98 0.00 0.00 173.24 173.03 2k78 n LYS 108 N 7.90 0.00 -2.95 4.02 4.76 -1.26 -4.66 118.16 125.96 2k78 n LYS 108 Ca 0.19 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.48 2k78 n LYS 108 Cb 0.46 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.65 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 -1.36 -3.33 -0.35 -0.00 -1.26 -5.00 117.00 105.70 2k78 n LEU 109 Ca 0.00 -4.02 -0.19 0.00 -0.00 0.00 0.00 56.01 51.80 2k78 n LEU 109 Cb 0.00 0.76 -0.08 0.00 -0.00 0.00 0.00 43.42 44.10 2k78 n LEU 109 CO 0.00 2.06 -0.17 0.21 -0.00 0.00 0.00 177.39 179.48 2k78 s ASN 110 N -1.52 1.19 0.00 1.45 3.84 -1.19 -0.49 114.94 118.23 2k78 s ASN 110 Ca 0.33 -1.88 0.00 0.00 0.21 0.00 0.00 52.86 51.52 2k78 s ASN 110 Cb 0.22 0.42 0.00 0.00 -0.55 0.00 0.00 41.25 41.35 2k78 s ASN 110 CO -0.16 -0.23 0.00 0.61 -2.79 0.00 0.00 177.10 174.52 2k78 n GLY 111 N 3.91 0.16 3.43 1.21 0.00 0.24 -4.93 105.19 109.22 2k78 n GLY 111 Ca 0.15 -0.51 -0.16 0.00 0.00 0.00 0.00 46.02 45.49 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 0.00 0.95 0.06 1.61 2.36 -1.26 -1.39 119.74 122.08 2k78 s LYS 112 Ca 0.00 0.10 0.02 0.00 -2.55 0.00 0.00 55.97 53.54 2k78 s LYS 112 Cb 0.00 0.44 -0.03 0.00 -1.05 0.00 0.00 37.83 37.20 2k78 s LYS 112 CO 0.00 -0.29 -0.08 0.42 1.55 0.00 0.00 175.35 176.95 2k78 s ILE 113 N -1.33 0.62 -0.69 5.43 1.01 -0.78 -4.94 121.20 120.51 2k78 s ILE 113 Ca -0.11 -1.28 -0.27 0.00 0.00 0.00 0.00 60.65 58.99 2k78 s ILE 113 Cb -0.01 -0.88 0.01 0.00 0.01 0.00 0.00 42.46 41.59 2k78 s ILE 113 CO 0.07 -0.48 1.51 -1.81 0.00 0.00 0.00 174.94 174.24 2k78 s ASP 114 N -1.91 5.80 0.59 3.58 1.01 -1.26 -1.73 116.67 122.75 2k78 s ASP 114 Ca -0.05 -0.14 0.10 0.00 0.71 0.00 0.00 52.55 53.18 2k78 s ASP 114 Cb -0.07 -2.55 0.09 0.00 1.01 0.00 0.00 42.92 41.41 2k78 s ASP 114 CO -0.01 -2.06 0.81 -0.83 0.21 0.00 0.00 175.17 173.30 2k78 s GLY 115 N 5.48 1.71 0.07 0.21 0.00 -1.08 -3.55 107.32 110.15 2k78 s GLY 115 Ca 0.48 -2.19 -0.08 0.00 0.00 0.00 0.00 44.72 42.93 2k78 s GLY 115 CO 0.17 -1.70 0.17 0.54 0.00 0.00 0.00 173.10 172.28 2k78 s LYS 116 N -4.70 0.77 -0.12 2.90 1.02 -0.07 -2.99 119.74 116.56 2k78 s LYS 116 Ca 0.62 -0.88 -0.25 0.00 0.02 0.00 0.00 55.97 55.48 2k78 s LYS 116 Cb -0.05 0.31 0.06 0.00 -0.52 0.00 0.00 37.83 37.63 2k78 s LYS 116 CO 0.40 -0.23 0.61 -1.50 -0.92 0.00 0.00 175.35 173.71 2k78 s ILE 117 N -3.45 0.01 0.28 2.17 -1.16 0.62 0.17 121.20 119.84 2k78 s ILE 117 Ca 0.02 -0.07 0.08 0.00 -0.51 0.00 0.00 60.65 60.17 2k78 s ILE 117 Cb 0.03 -0.90 -0.04 0.00 0.61 0.00 0.00 42.46 42.17 2k78 s ILE 117 CO -0.09 -0.04 0.15 -1.81 -2.81 0.00 0.00 174.94 170.35 2k78 s ASP 118 N -0.60 5.15 0.04 4.50 1.11 -1.11 -1.94 116.67 123.84 2k78 s ASP 118 Ca -0.07 -0.44 0.02 0.00 0.18 0.00 0.00 52.55 52.24 2k78 s ASP 118 Cb -0.02 -1.13 -0.02 0.00 1.07 0.00 0.00 42.92 42.81 2k78 s ASP 118 CO 0.06 -0.10 -0.07 -0.69 1.18 0.00 0.00 175.17 175.55 2k78 s VAL 119 N -2.24 0.50 -0.23 -1.27 1.01 -1.17 -2.16 120.40 114.84 2k78 s VAL 119 Ca 0.34 -1.13 -0.04 0.00 0.00 0.00 0.00 61.98 61.15 2k78 s VAL 119 Cb -0.07 -0.65 0.12 0.00 0.00 0.00 0.00 36.38 35.78 2k78 s VAL 119 CO 0.24 -0.43 0.40 -0.47 0.00 0.00 0.00 175.10 174.83 2k78 s TYR 120 N -1.57 -0.84 0.03 5.22 5.04 -1.18 -2.72 117.35 121.32 2k78 s TYR 120 Ca -0.09 1.15 -0.02 0.00 -2.44 0.00 0.00 57.07 55.67 2k78 s TYR 120 Cb -0.09 0.16 -0.02 0.00 0.35 0.00 0.00 41.96 42.36 2k78 s TYR 120 CO -0.00 -0.62 0.02 0.42 -1.34 0.00 0.00 175.55 174.03 2k78 s ILE 121 N 2.58 0.14 -0.29 3.14 1.01 0.31 -4.42 121.20 123.67 2k78 s ILE 121 Ca 0.07 -1.11 0.06 0.00 0.00 0.00 0.00 60.65 59.66 2k78 s ILE 121 Cb -0.14 -0.70 0.20 0.00 0.01 0.00 0.00 42.46 41.83 2k78 s ILE 121 CO -0.15 -0.61 0.58 1.51 0.00 0.00 0.00 174.94 176.27 2k78 s ASP 122 N -1.92 -1.49 0.07 3.58 -4.77 -1.26 -1.30 116.67 109.57 2k78 s ASP 122 Ca -0.08 0.15 -0.26 0.00 -3.30 0.00 0.00 52.55 49.06 2k78 s ASP 122 Cb -0.04 1.97 0.09 0.00 -1.09 0.00 0.00 42.92 43.85 2k78 s ASP 122 CO -0.03 -0.30 1.18 -1.83 0.70 0.00 0.00 175.17 174.88 2k78 s GLU 123 N 2.81 0.78 -0.29 2.11 -1.05 -1.15 -5.02 118.70 116.89 2k78 s GLU 123 Ca 0.10 -0.50 -0.11 0.00 -0.15 0.00 0.00 54.97 54.32 2k78 s GLU 123 Cb -0.10 0.22 -0.04 0.00 -0.44 0.00 0.00 34.13 33.77 2k78 s GLU 123 CO -0.26 -0.36 0.18 0.15 0.95 0.00 0.00 175.26 175.91 2k78 s LYS 124 N -2.14 3.78 -0.92 -4.83 1.02 -1.26 0.08 119.74 115.46 2k78 s LYS 124 Ca 0.25 -0.43 -0.24 0.00 0.02 0.00 0.00 55.97 55.56 2k78 s LYS 124 Cb -0.01 -3.63 0.02 0.00 -0.52 0.00 0.00 37.83 33.69 2k78 s LYS 124 CO 0.02 -0.25 1.57 0.08 -0.92 0.00 0.00 175.35 175.85 2k78 s VAL 125 N 1.72 3.74 -1.48 3.17 1.01 0.16 -3.90 120.40 124.83 2k78 s VAL 125 Ca 0.07 -0.42 -0.07 0.00 0.00 0.00 0.00 61.98 61.56 2k78 s VAL 125 Cb -0.16 -4.71 0.02 0.00 0.00 0.00 0.00 36.38 31.53 2k78 s VAL 125 CO 0.09 -1.62 0.69 0.59 0.00 0.00 0.00 175.10 174.85 2k78 n ASN 126 N 10.42 -5.62 -0.01 3.32 5.03 -1.26 -2.62 115.26 124.52 2k78 n ASN 126 Ca 0.29 -0.37 0.00 0.00 0.87 0.00 0.00 54.58 55.37 2k78 n ASN 126 Cb 0.50 -4.53 0.00 0.00 -1.02 0.00 0.00 39.78 34.72 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 -1.53 1.72 2.69 7.41 0.00 -1.25 -5.07 105.19 109.15 2k78 n GLY 127 Ca -0.07 -0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.22 0.35 -0.21 1.61 -0.14 -1.08 -5.09 119.74 113.96 2k78 s LYS 128 Ca 0.00 -0.40 -0.39 0.00 -1.36 0.00 0.00 55.97 53.82 2k78 s LYS 128 Cb 0.00 -0.82 -0.15 0.00 -1.68 0.00 0.00 37.83 35.17 2k78 s LYS 128 CO 0.00 -1.06 1.72 -2.30 -0.76 0.00 0.00 175.35 172.95 2k78 n PRO 129 N 5.08 1.32 -4.34 -1.68 -0.02 -1.26 0.40 135.00 134.50 2k78 n PRO 129 Ca -0.00 0.48 -0.28 0.00 -2.02 0.00 0.00 63.50 61.68 2k78 n PRO 129 Cb 0.45 -2.19 -0.17 0.00 -0.02 0.00 0.00 33.50 31.57 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 3.28 1.85 -0.09 6.00 5.36 0.11 -4.85 117.98 129.63 2k78 s PHE 130 Ca 0.96 -0.88 -0.04 0.00 -0.96 0.00 0.00 56.93 56.01 2k78 s PHE 130 Cb -1.00 -1.36 -0.04 0.00 -0.34 0.00 0.00 43.02 40.28 2k78 s PHE 130 CO 0.61 -0.48 0.07 0.21 -1.46 0.00 0.00 175.22 174.18 2k78 s LYS 131 N 1.11 3.19 -0.17 10.12 2.20 -1.26 -2.95 119.74 131.97 2k78 s LYS 131 Ca -0.05 -0.29 -0.07 0.00 -0.36 0.00 0.00 55.97 55.20 2k78 s LYS 131 Cb -0.14 -2.97 0.08 0.00 -1.51 0.00 0.00 37.83 33.28 2k78 s LYS 131 CO -0.03 0.73 0.38 -0.47 -0.36 0.00 0.00 175.35 175.60 2k78 s TYR 132 N -0.98 -0.66 -0.33 4.03 5.04 -0.42 -4.95 117.35 119.08 2k78 s TYR 132 Ca 0.15 1.33 -0.09 0.00 -2.44 0.00 0.00 57.07 56.03 2k78 s TYR 132 Cb -0.12 0.23 0.19 0.00 0.35 0.00 0.00 41.96 42.61 2k78 s TYR 132 CO 0.04 -0.41 1.06 0.16 -1.34 0.00 0.00 175.55 175.06 2k78 s ASP 133 N 2.19 -0.32 0.00 4.32 1.47 -1.25 0.11 116.67 123.19 2k78 s ASP 133 Ca -0.04 -0.21 0.00 0.00 1.18 0.00 0.00 52.55 53.48 2k78 s ASP 133 Cb -0.11 0.41 0.00 0.00 -0.34 0.00 0.00 42.92 42.88 2k78 s ASP 133 CO -0.12 -0.03 0.00 1.41 0.68 0.00 0.00 175.17 177.11 2k78 n HIS 134 N 3.41 -0.32 -5.25 2.11 8.25 -1.10 -5.02 115.22 117.30 2k78 n HIS 134 Ca 0.07 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.22 2k78 n HIS 134 Cb 0.64 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.59 2k78 n HIS 134 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2k78 s HIS 135 N -4.42 2.38 0.38 4.41 -3.43 -1.26 -3.06 115.29 110.29 2k78 s HIS 135 Ca 0.00 -0.41 -0.09 0.00 -0.80 0.00 0.00 55.06 53.76 2k78 s HIS 135 Cb 0.00 -1.52 0.03 0.00 -1.43 0.00 0.00 32.58 29.66 2k78 s HIS 135 CO 0.00 -0.02 0.65 0.66 -2.00 0.00 0.00 174.74 174.03 2k78 n TYR 136 N 2.44 -1.94 -3.99 0.38 4.01 -0.82 -5.01 117.16 112.24 2k78 n TYR 136 Ca -0.16 -2.11 -0.13 0.00 -0.16 0.00 0.00 57.90 55.34 2k78 n TYR 136 Cb 0.51 0.75 -0.02 0.00 -0.31 0.00 0.00 39.34 40.28 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 -3.13 0.62 0.27 7.72 4.22 -1.26 -0.27 114.94 123.11 2k78 s ASN 137 Ca 0.22 -1.38 -0.18 0.00 -2.14 0.00 0.00 52.86 49.39 2k78 s ASN 137 Cb -0.03 0.74 0.01 0.00 1.28 0.00 0.00 41.25 43.25 2k78 s ASN 137 CO 0.16 -1.45 0.64 0.27 -2.04 0.00 0.00 177.10 174.68 2k78 s ILE 138 N -2.74 0.00 -0.23 0.54 -4.36 -1.16 -4.56 121.20 108.69 2k78 s ILE 138 Ca 0.25 -1.14 -0.19 0.00 -0.26 0.00 0.00 60.65 59.31 2k78 s ILE 138 Cb -0.02 -2.11 -0.03 0.00 1.25 0.00 0.00 42.46 41.55 2k78 s ILE 138 CO 0.17 0.00 0.54 -0.89 0.24 0.00 0.00 174.94 175.00 2k78 s THR 139 N -3.88 5.07 0.36 8.37 2.01 -0.84 -2.64 115.64 124.09 2k78 s THR 139 Ca 0.15 0.96 -0.07 0.00 0.31 0.00 0.00 61.69 63.04 2k78 s THR 139 Cb -0.04 -3.85 -0.05 0.00 0.01 0.00 0.00 72.50 68.56 2k78 s THR 139 CO 0.08 0.12 0.66 -0.31 -0.69 0.00 0.00 174.62 174.48 2k78 s TYR 140 N 2.05 3.49 -0.28 4.92 1.51 -0.70 -0.91 117.35 127.41 2k78 s TYR 140 Ca 0.23 0.80 -0.02 0.00 -1.01 0.00 0.00 57.07 57.07 2k78 s TYR 140 Cb -0.16 -2.25 0.11 0.00 -0.11 0.00 0.00 41.96 39.56 2k78 s TYR 140 CO 0.09 0.01 0.20 0.21 -1.11 0.00 0.00 175.55 174.96 2k78 s LYS 141 N -3.84 0.25 -0.13 -0.62 2.36 0.30 -1.87 119.74 116.18 2k78 s LYS 141 Ca 0.47 -0.33 -0.18 0.00 -2.55 0.00 0.00 55.97 53.38 2k78 s LYS 141 Cb -0.10 -0.95 -0.04 0.00 -1.05 0.00 0.00 37.83 35.68 2k78 s LYS 141 CO 0.32 -1.01 0.49 -0.06 1.55 0.00 0.00 175.35 176.65 2k78 s PHE 142 N 2.22 3.49 -0.36 4.03 0.08 -0.48 0.37 117.98 127.33 2k78 s PHE 142 Ca 0.09 0.88 -0.02 0.00 0.12 0.00 0.00 56.93 58.00 2k78 s PHE 142 Cb -0.15 -2.57 0.08 0.00 -0.57 0.00 0.00 43.02 39.81 2k78 s PHE 142 CO -0.34 0.13 0.11 -0.80 -0.10 0.00 0.00 175.22 174.22 2k78 s ASN 143 N 0.71 5.09 0.00 1.36 0.01 0.43 0.81 114.94 123.35 2k78 s ASN 143 Ca 0.26 -1.70 0.00 0.00 -0.71 0.00 0.00 52.86 50.71 2k78 s ASN 143 Cb -0.15 -1.77 0.00 0.00 0.41 0.00 0.00 41.25 39.73 2k78 s ASN 143 CO 0.10 -0.41 0.00 0.61 -1.51 0.00 0.00 177.10 175.89 2k78 n GLY 144 N 4.60 2.69 3.77 0.66 0.00 0.36 -2.66 105.19 114.62 2k78 n GLY 144 Ca -0.07 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.84 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 1.10 4.12 -0.15 1.61 0.04 -1.26 -4.52 135.00 135.94 2k78 s PRO 145 Ca 0.00 2.43 -0.10 0.00 0.04 0.00 0.00 61.00 63.36 2k78 s PRO 145 Cb 0.00 -2.94 -0.24 0.00 0.04 0.00 0.00 34.50 31.35 2k78 s PRO 145 CO 0.00 -0.47 0.30 2.41 0.04 0.00 0.00 177.00 179.29 2k78 n THR 146 N 0.45 1.72 0.00 1.26 -1.04 -1.26 -4.04 114.28 111.37 2k78 n THR 146 Ca 0.01 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.52 2k78 n THR 146 Cb 0.41 -1.80 0.00 0.00 -1.82 0.00 0.00 70.33 67.11 2k78 n THR 146 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2k78 n ASP 147 N -3.72 0.00 -3.52 8.00 -0.08 -1.26 -4.84 116.55 111.13 2k78 n ASP 147 Ca -0.33 0.00 -0.20 0.00 -1.51 0.00 0.00 54.79 52.75 2k78 n ASP 147 Cb 0.96 0.04 0.06 0.00 2.34 0.00 0.00 41.12 44.51 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 -1.16 -6.16 -1.41 5.18 0.31 -1.26 -4.83 118.33 108.99 2k78 n VAL 148 Ca 0.00 -0.76 -0.39 0.00 -0.01 0.00 0.00 64.34 63.18 2k78 n VAL 148 Cb 0.00 -4.82 -0.03 0.00 -0.91 0.00 0.00 33.84 28.09 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 -3.98 7.38 0.00 3.52 0.00 -1.26 -5.29 120.51 120.88 2k78 n ALA 149 Ca -0.22 -3.61 0.00 0.00 0.00 0.00 0.00 53.44 49.61 2k78 n ALA 149 Cb 0.65 -3.32 0.00 0.00 0.00 0.00 0.00 19.45 16.78 2k78 n ALA 149 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91