#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k78 n ALA 26 N 0.00 2.38 -3.24 7.33 0.00 -1.26 -4.90 120.51 120.82 2k78 n ALA 26 Ca 0.00 -3.08 -0.19 0.00 0.00 0.00 0.00 53.44 50.16 2k78 n ALA 26 Cb 0.00 -0.82 0.05 0.00 0.00 0.00 0.00 19.45 18.68 2k78 n ALA 26 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2k78 n ASN 27 N 2.25 -5.55 -4.65 0.00 5.15 -1.26 -4.93 115.26 106.27 2k78 n ASN 27 Ca 0.25 -0.38 -0.43 0.00 -0.60 0.00 0.00 54.58 53.43 2k78 n ASN 27 Cb 0.51 -4.23 -0.02 0.00 -0.53 0.00 0.00 39.78 35.50 2k78 n ASN 27 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k78 s ALA 28 N -3.20 3.60 0.00 5.20 0.00 -1.26 -4.94 121.76 121.16 2k78 s ALA 28 Ca 0.41 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.75 2k78 s ALA 28 Cb -0.18 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.29 2k78 s ALA 28 CO 0.51 -1.29 0.00 0.00 0.00 0.00 0.00 175.76 174.98 2k78 n ALA 29 N 6.81 0.00 -2.26 0.00 0.00 -1.26 -4.95 120.51 118.84 2k78 n ALA 29 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.45 2k78 n ALA 29 Cb 0.45 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.89 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 -0.49 -3.88 -3.63 0.00 8.00 -1.26 -4.83 116.55 110.46 2k78 n ASP 30 Ca 0.00 0.21 -0.14 0.00 0.71 0.00 0.00 54.79 55.56 2k78 n ASP 30 Cb 0.00 -3.35 -0.07 0.00 -0.02 0.00 0.00 41.12 37.68 2k78 n ASP 30 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2k78 s SER 31 N -2.04 -0.73 0.00 -2.24 0.15 -1.26 0.16 113.70 107.74 2k78 s SER 31 Ca 0.00 1.37 0.00 0.00 0.70 0.00 0.00 55.95 58.02 2k78 s SER 31 Cb 0.00 1.38 0.00 0.00 -1.71 0.00 0.00 66.02 65.69 2k78 s SER 31 CO 0.00 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.78 2k78 n GLY 32 N 2.57 -0.87 3.56 9.45 0.00 -0.66 -4.99 105.19 114.24 2k78 n GLY 32 Ca -0.14 -1.03 -0.43 0.00 0.00 0.00 0.00 46.02 44.42 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 0.19 2.61 -4.23 -1.26 -0.90 115.64 114.71 2k78 s THR 33 Ca 0.00 0.57 -0.05 0.00 -1.18 0.00 0.00 61.69 61.03 2k78 s THR 33 Cb 0.00 -4.29 -0.06 0.00 1.34 0.00 0.00 72.50 69.49 2k78 s THR 33 CO 0.00 -0.64 0.44 -0.22 -0.54 0.00 0.00 174.62 173.66 2k78 s LEU 34 N 3.26 4.21 0.05 4.79 0.20 0.07 -4.91 118.68 126.34 2k78 s LEU 34 Ca 0.31 0.66 -0.30 0.00 0.69 0.00 0.00 54.13 55.48 2k78 s LEU 34 Cb -0.12 -3.41 -0.04 0.00 -0.43 0.00 0.00 46.19 42.18 2k78 s LEU 34 CO 0.21 -0.02 1.01 0.21 -0.29 0.00 0.00 176.35 177.47 2k78 s ASN 35 N -2.60 7.36 -0.01 3.68 2.47 -1.10 -2.66 114.94 122.09 2k78 s ASN 35 Ca 0.43 1.76 -0.28 0.00 0.42 0.00 0.00 52.86 55.18 2k78 s ASN 35 Cb -0.12 -2.58 0.10 0.00 -1.45 0.00 0.00 41.25 37.21 2k78 s ASN 35 CO 0.25 -0.23 0.85 -0.72 -3.72 0.00 0.00 177.10 173.53 2k78 s TYR 36 N 0.69 -0.39 0.00 0.43 1.13 -1.26 -0.01 117.35 117.94 2k78 s TYR 36 Ca 0.51 0.33 0.00 0.00 -1.41 0.00 0.00 57.07 56.51 2k78 s TYR 36 Cb -0.23 0.52 0.00 0.00 -1.10 0.00 0.00 41.96 41.15 2k78 s TYR 36 CO 0.29 -0.56 0.00 -1.91 -2.51 0.00 0.00 175.55 170.86 2k78 n GLU 37 N -0.07 0.00 -4.22 -3.49 2.13 -0.97 -4.73 120.64 109.29 2k78 n GLU 37 Ca -0.11 0.00 -0.16 0.00 0.66 0.00 0.00 57.16 57.56 2k78 n GLU 37 Cb 0.61 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 32.24 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 -2.69 0.00 0.15 6.31 -7.23 -1.26 -1.83 120.40 113.85 2k78 s VAL 38 Ca 0.00 -1.94 -0.10 0.00 -1.81 0.00 0.00 61.98 58.13 2k78 s VAL 38 Cb 0.00 -2.50 -0.00 0.00 0.56 0.00 0.00 36.38 34.44 2k78 s VAL 38 CO 0.00 0.00 0.29 -0.31 -0.31 0.00 0.00 175.10 174.77 2k78 s TYR 39 N -3.72 0.29 0.09 2.82 2.02 -0.39 -4.03 117.35 114.42 2k78 s TYR 39 Ca 0.38 -0.66 -0.31 0.00 -0.37 0.00 0.00 57.07 56.12 2k78 s TYR 39 Cb 0.04 -0.01 -0.08 0.00 -0.40 0.00 0.00 41.96 41.51 2k78 s TYR 39 CO 0.20 -0.70 1.45 0.21 -1.57 0.00 0.00 175.55 175.14 2k78 s LYS 40 N -3.93 4.28 0.51 -0.62 2.47 0.66 -1.91 119.74 121.20 2k78 s LYS 40 Ca 0.14 2.12 -0.22 0.00 -1.56 0.00 0.00 55.97 56.45 2k78 s LYS 40 Cb 0.03 -3.34 -0.07 0.00 -1.46 0.00 0.00 37.83 32.99 2k78 s LYS 40 CO -0.03 -0.52 1.06 0.98 0.16 0.00 0.00 175.35 177.00 2k78 n TYR 41 N 4.43 1.25 -0.86 4.03 9.36 -1.26 -1.14 117.16 132.98 2k78 n TYR 41 Ca 0.13 0.48 0.00 0.00 3.32 0.00 0.00 57.90 61.83 2k78 n TYR 41 Cb 0.42 -2.22 0.00 0.00 -0.63 0.00 0.00 39.34 36.91 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 -0.21 -1.24 -0.28 2.98 2.85 -1.26 -4.93 115.26 113.17 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 0.43 -1.22 0.00 0.00 1.24 0.00 0.00 39.78 40.23 2k78 n ASN 42 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2k78 n THR 43 N -2.17 0.00 -1.24 -0.44 -2.24 -0.29 -5.07 114.28 102.82 2k78 n THR 43 Ca 0.00 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.80 2k78 n THR 43 Cb 0.06 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.32 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 -0.62 0.76 -3.96 3.42 4.13 -1.26 -4.74 115.26 113.00 2k78 n ASN 44 Ca 0.00 -1.94 -0.17 0.00 1.68 0.00 0.00 54.58 54.16 2k78 n ASN 44 Cb 0.00 -0.16 -0.15 0.00 -1.54 0.00 0.00 39.78 37.93 2k78 n ASN 44 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 2k78 s ASP 45 N -1.10 0.69 0.13 6.41 1.01 -1.26 -4.88 116.67 117.67 2k78 s ASP 45 Ca 0.06 -0.10 -0.30 0.00 0.71 0.00 0.00 52.55 52.92 2k78 s ASP 45 Cb 0.06 -0.11 -0.07 0.00 1.01 0.00 0.00 42.92 43.81 2k78 s ASP 45 CO 0.01 0.06 1.17 -0.89 0.21 0.00 0.00 175.17 175.73 2k78 s THR 46 N -0.03 3.85 0.00 -1.27 2.01 -1.26 -0.25 115.64 118.69 2k78 s THR 46 Ca 0.01 1.46 0.00 0.00 0.31 0.00 0.00 61.69 63.47 2k78 s THR 46 Cb -0.03 -3.93 0.00 0.00 0.01 0.00 0.00 72.50 68.54 2k78 s THR 46 CO -0.00 0.19 0.00 -0.24 -0.69 0.00 0.00 174.62 173.87 2k78 n SER 47 N 3.09 1.96 0.07 3.53 2.88 -1.26 -4.79 113.62 119.10 2k78 n SER 47 Ca 0.06 -0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.51 2k78 n SER 47 Cb 0.46 0.56 0.00 0.00 -0.75 0.00 0.00 64.21 64.48 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 -0.76 0.10 0.27 2.46 5.41 -1.26 -4.83 119.36 120.75 2k78 n ILE 48 Ca 0.00 0.03 0.14 0.00 1.00 0.00 0.00 62.75 63.93 2k78 n ILE 48 Cb 0.00 -0.42 0.77 0.00 -0.71 0.00 0.00 39.64 39.28 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 1.19 0.00 -1.39 0.00 -1.94 -0.30 119.26 116.81 2k78 h ALA 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k78 h ALA 49 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2k78 h ALA 49 CO 0.00 -0.19 0.00 -1.71 0.00 0.00 0.00 179.25 177.35 2k78 n ASN 50 N -2.65 0.12 -1.35 0.00 2.85 -1.26 -2.11 115.26 110.86 2k78 n ASN 50 Ca -0.02 0.53 0.10 0.00 -0.11 0.00 0.00 54.58 55.08 2k78 n ASN 50 Cb 0.25 -0.56 0.32 0.00 1.24 0.00 0.00 39.78 41.03 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 -1.64 4.22 0.00 1.20 8.00 -0.12 -4.31 116.55 123.90 2k78 n ASP 51 Ca 0.03 -2.27 0.00 0.00 0.71 0.00 0.00 54.79 53.26 2k78 n ASP 51 Cb 0.15 -0.50 0.00 0.00 -0.02 0.00 0.00 41.12 40.75 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 1.14 0.00 -3.81 1.24 4.02 -0.90 -4.98 117.16 113.87 2k78 n TYR 52 Ca 0.23 -0.06 -0.35 0.00 -0.01 0.00 0.00 57.90 57.71 2k78 n TYR 52 Cb 0.74 -0.01 -0.12 0.00 -0.02 0.00 0.00 39.34 39.94 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 -0.12 3.58 -0.55 -0.72 0.40 -1.19 -2.88 117.98 116.50 2k78 s PHE 53 Ca 0.00 -2.56 -0.27 0.00 -0.60 0.00 0.00 56.93 53.50 2k78 s PHE 53 Cb 0.00 -3.17 -0.01 0.00 0.51 0.00 0.00 43.02 40.35 2k78 s PHE 53 CO 0.00 -0.95 1.68 1.21 0.70 0.00 0.00 175.22 177.87 2k78 s ASN 54 N 1.49 5.69 0.46 1.36 2.47 -1.26 -4.98 114.94 120.17 2k78 s ASN 54 Ca 0.10 0.45 0.00 0.00 0.42 0.00 0.00 52.86 53.83 2k78 s ASN 54 Cb -0.22 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.04 2k78 s ASN 54 CO -0.04 -2.03 0.69 -1.59 -3.72 0.00 0.00 177.10 170.41 2k78 s LYS 55 N 6.26 3.01 0.66 0.43 -2.85 -1.26 -4.54 119.74 121.44 2k78 s LYS 55 Ca 0.63 -0.51 -0.11 0.00 -1.00 0.00 0.00 55.97 54.98 2k78 s LYS 55 Cb -0.13 -2.54 0.15 0.00 -2.06 0.00 0.00 37.83 33.25 2k78 s LYS 55 CO 0.24 -0.33 0.84 -0.35 0.10 0.00 0.00 175.35 175.85 2k78 n PRO 56 N -2.12 -1.06 -3.62 1.78 -0.04 -1.26 -5.13 135.00 123.55 2k78 n PRO 56 Ca 0.02 -1.31 -0.20 0.00 -0.04 0.00 0.00 63.50 61.97 2k78 n PRO 56 Cb 0.58 -0.91 -0.02 0.00 -0.04 0.00 0.00 33.50 33.10 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 -3.85 4.05 -0.40 0.55 0.00 -1.09 -4.93 121.76 116.10 2k78 s ALA 57 Ca 0.49 -1.57 -0.14 0.00 0.00 0.00 0.00 51.96 50.74 2k78 s ALA 57 Cb -0.02 -1.42 0.03 0.00 0.00 0.00 0.00 23.12 21.72 2k78 s ALA 57 CO 0.34 -0.02 0.27 0.21 0.00 0.00 0.00 175.76 176.56 2k78 s LYS 58 N -4.09 2.91 0.33 0.00 2.36 -1.15 -0.75 119.74 119.34 2k78 s LYS 58 Ca 0.43 -1.08 0.03 0.00 -2.55 0.00 0.00 55.97 52.80 2k78 s LYS 58 Cb -0.08 -3.90 -0.02 0.00 -1.05 0.00 0.00 37.83 32.78 2k78 s LYS 58 CO 0.29 -0.76 0.50 1.52 1.55 0.00 0.00 175.35 178.44 2k78 s TYR 59 N 1.63 3.36 0.02 4.03 1.13 -0.08 0.02 117.35 127.46 2k78 s TYR 59 Ca 0.04 0.11 -0.20 0.00 -1.41 0.00 0.00 57.07 55.61 2k78 s TYR 59 Cb -0.20 -1.89 0.04 0.00 -1.10 0.00 0.00 41.96 38.82 2k78 s TYR 59 CO 0.08 0.11 0.45 -1.50 -2.51 0.00 0.00 175.55 172.18 2k78 s ILE 60 N -2.23 0.04 0.30 -3.49 2.07 -0.14 -1.66 121.20 116.09 2k78 s ILE 60 Ca 0.41 -0.36 0.03 0.00 -1.41 0.00 0.00 60.65 59.32 2k78 s ILE 60 Cb -0.09 -0.89 -0.04 0.00 0.13 0.00 0.00 42.46 41.56 2k78 s ILE 60 CO 0.33 -0.20 0.16 -0.54 -1.91 0.00 0.00 174.94 172.78 2k78 s LYS 61 N -2.04 1.57 -0.47 3.50 3.01 0.41 0.43 119.74 126.16 2k78 s LYS 61 Ca -0.08 -1.89 0.06 0.00 -1.01 0.00 0.00 55.97 53.05 2k78 s LYS 61 Cb -0.02 -0.09 0.30 0.00 -1.01 0.00 0.00 37.83 37.01 2k78 s LYS 61 CO 0.01 -0.44 1.05 1.63 0.51 0.00 0.00 175.35 178.11 2k78 n LYS 62 N -0.56 0.96 -3.04 1.68 5.02 0.60 -4.69 118.16 118.12 2k78 n LYS 62 Ca 0.01 -1.92 -0.06 0.00 -2.02 0.00 0.00 58.31 54.32 2k78 n LYS 62 Cb 0.65 -1.16 0.01 0.00 -0.02 0.00 0.00 35.03 34.51 2k78 n LYS 62 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2k78 n ASN 63 N 0.70 -7.08 0.00 4.39 3.02 -1.26 -4.09 115.26 110.94 2k78 n ASN 63 Ca 0.07 0.70 0.00 0.00 -0.03 0.00 0.00 54.58 55.32 2k78 n ASN 63 Cb 0.68 -3.28 0.00 0.00 -0.61 0.00 0.00 39.78 36.57 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 0.73 0.81 3.56 7.41 0.00 -1.26 -5.05 105.19 111.39 2k78 n GLY 64 Ca 0.00 -0.62 -0.06 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.08 0.51 -0.22 1.61 -2.85 -1.26 -5.16 119.74 110.30 2k78 s LYS 65 Ca 0.00 -0.16 -0.30 0.00 -1.00 0.00 0.00 55.97 54.52 2k78 s LYS 65 Cb 0.00 0.23 0.16 0.00 -2.06 0.00 0.00 37.83 36.16 2k78 s LYS 65 CO 0.00 -0.22 1.16 -0.48 0.10 0.00 0.00 175.35 175.92 2k78 s LEU 66 N -2.16 -0.22 0.00 2.77 2.34 -1.26 -0.29 118.68 119.86 2k78 s LEU 66 Ca 0.07 0.23 0.00 0.00 0.06 0.00 0.00 54.13 54.49 2k78 s LEU 66 Cb -0.01 1.51 0.00 0.00 -0.56 0.00 0.00 46.19 47.13 2k78 s LEU 66 CO -0.06 -0.20 0.00 -1.22 -1.06 0.00 0.00 176.35 173.81 2k78 n TYR 67 N 0.61 -0.00 -3.62 3.48 4.02 0.17 -3.94 117.16 117.88 2k78 n TYR 67 Ca -0.05 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.73 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 0.54 -1.01 0.00 0.00 176.86 176.39 2k78 s VAL 68 N -1.11 0.00 -0.16 -0.72 0.11 -0.90 -0.97 120.40 116.66 2k78 s VAL 68 Ca 0.00 0.00 -0.08 0.00 -2.93 0.00 0.00 61.98 58.97 2k78 s VAL 68 Cb 0.00 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.81 2k78 s VAL 68 CO 0.00 0.00 0.11 0.00 -3.33 0.00 0.00 175.10 171.88 2k78 s GLN 69 N -0.15 3.76 -0.06 1.54 -2.07 0.10 -0.34 119.66 122.44 2k78 s GLN 69 Ca 0.01 -0.22 0.03 0.00 -1.82 0.00 0.00 55.36 53.36 2k78 s GLN 69 Cb -0.04 -3.25 -0.03 0.00 -1.09 0.00 0.00 33.01 28.61 2k78 s GLN 69 CO -0.03 0.52 -0.13 -1.50 -1.32 0.00 0.00 175.29 172.83 2k78 s ILE 70 N -0.30 3.13 0.01 3.63 1.10 0.07 -2.94 121.20 125.90 2k78 s ILE 70 Ca 0.10 -0.69 -0.20 0.00 -0.51 0.00 0.00 60.65 59.35 2k78 s ILE 70 Cb -0.12 -2.24 -0.06 0.00 0.15 0.00 0.00 42.46 40.20 2k78 s ILE 70 CO 0.01 0.58 0.59 -0.89 -2.11 0.00 0.00 174.94 173.12 2k78 s THR 71 N -0.62 4.88 -0.22 4.00 2.01 -1.26 -1.96 115.64 122.47 2k78 s THR 71 Ca 0.09 1.23 -0.06 0.00 0.31 0.00 0.00 61.69 63.26 2k78 s THR 71 Cb -0.11 -3.92 -0.03 0.00 0.01 0.00 0.00 72.50 68.45 2k78 s THR 71 CO 0.01 0.44 0.03 -0.69 -0.69 0.00 0.00 174.62 173.73 2k78 s VAL 72 N -0.36 4.12 -0.06 3.82 1.01 0.42 -4.18 120.40 125.17 2k78 s VAL 72 Ca 0.30 -0.25 -0.05 0.00 0.00 0.00 0.00 61.98 61.99 2k78 s VAL 72 Cb -0.18 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 2k78 s VAL 72 CO 0.17 0.39 0.16 0.20 0.00 0.00 0.00 175.10 176.02 2k78 s ASN 73 N 1.25 6.34 -0.54 3.32 0.01 -1.14 -1.90 114.94 122.29 2k78 s ASN 73 Ca 0.04 0.40 -0.07 0.00 -0.71 0.00 0.00 52.86 52.52 2k78 s ASN 73 Cb -0.15 -2.02 0.01 0.00 0.41 0.00 0.00 41.25 39.51 2k78 s ASN 73 CO 0.02 0.34 0.59 1.57 -1.51 0.00 0.00 177.10 178.10 2k78 n HIS 74 N 1.47 -2.89 0.31 2.20 -0.00 -1.06 -4.62 115.22 110.61 2k78 n HIS 74 Ca -0.15 1.13 0.19 0.00 0.46 0.00 0.00 57.72 59.35 2k78 n HIS 74 Cb 0.54 -3.85 0.92 0.00 -0.12 0.00 0.00 29.99 27.48 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 1.04 0.00 -0.08 0.26 0.02 -1.82 -1.77 113.55 111.20 2k78 h SER 75 Ca 0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 2k78 h SER 75 Cb 0.95 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.50 2k78 h SER 75 CO 0.23 0.00 -0.38 -0.74 -1.14 0.00 0.00 176.83 174.80 2k78 h HIS 76 N 0.00 0.53 0.06 3.45 6.17 -1.91 -3.33 115.15 120.12 2k78 h HIS 76 Ca 0.00 -0.23 -0.22 0.00 0.71 0.00 0.00 60.37 60.63 2k78 h HIS 76 Cb 0.21 -0.08 0.02 0.00 2.52 0.00 0.00 27.41 30.08 2k78 h HIS 76 CO 0.00 0.98 -0.90 -1.49 0.71 0.00 0.00 177.93 177.24 2k78 h TRP 77 N -0.07 0.78 -3.44 5.26 4.06 -1.75 -3.42 115.95 117.38 2k78 h TRP 77 Ca -0.02 -0.47 -0.61 0.00 2.06 0.00 0.00 58.89 59.85 2k78 h TRP 77 Cb 1.02 -0.07 -0.11 0.00 -1.00 0.00 0.00 29.16 29.01 2k78 h TRP 77 CO 0.12 1.31 0.28 -1.50 -3.56 0.00 0.00 178.44 175.09 2k78 s ILE 78 N -3.02 4.90 -0.18 1.49 1.10 -0.69 -3.19 121.20 121.61 2k78 s ILE 78 Ca -0.12 1.18 0.18 0.00 -0.51 0.00 0.00 60.65 61.37 2k78 s ILE 78 Cb 0.04 -4.03 0.00 0.00 0.15 0.00 0.00 42.46 38.62 2k78 s ILE 78 CO 0.87 -0.09 1.15 0.00 -2.11 0.00 0.00 174.94 174.76 2k78 h THR 79 N 5.49 0.50 0.00 4.00 1.03 -1.67 -3.42 112.91 118.83 2k78 h THR 79 Ca -0.25 -1.82 0.00 0.00 -0.01 0.00 0.00 66.41 64.32 2k78 h THR 79 Cb 1.11 2.08 0.00 0.00 -1.07 0.00 0.00 68.15 70.27 2k78 h THR 79 CO 0.82 0.29 0.00 0.61 -0.01 0.00 0.00 175.52 177.23 2k78 n GLY 80 N 1.27 -1.49 3.28 2.99 0.00 -1.03 -4.95 105.19 105.26 2k78 n GLY 80 Ca -0.03 -1.07 -0.10 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 -1.87 0.95 0.05 1.61 -1.94 -1.26 -2.68 119.30 114.16 2k78 s MET 81 Ca 0.00 -0.70 -0.20 0.00 -1.71 0.00 0.00 55.69 53.09 2k78 s MET 81 Cb 0.00 0.41 0.04 0.00 2.01 0.00 0.00 34.83 37.29 2k78 s MET 81 CO 0.00 -0.34 0.45 -1.12 -0.01 0.00 0.00 175.02 174.00 2k78 s SER 82 N -2.60 -0.34 0.04 3.03 0.01 0.43 -3.27 113.70 111.00 2k78 s SER 82 Ca 0.01 0.05 -0.03 0.00 1.31 0.00 0.00 55.95 57.29 2k78 s SER 82 Cb 0.02 0.45 -0.02 0.00 0.21 0.00 0.00 66.02 66.68 2k78 s SER 82 CO -0.09 -0.69 0.04 -0.63 0.41 0.00 0.00 173.24 172.27 2k78 s ILE 83 N -2.50 0.15 -1.37 1.44 1.01 -0.59 0.14 121.20 119.47 2k78 s ILE 83 Ca -0.05 -1.26 0.00 0.00 0.00 0.00 0.00 60.65 59.34 2k78 s ILE 83 Cb -0.01 -0.94 0.00 0.00 0.01 0.00 0.00 42.46 41.52 2k78 s ILE 83 CO -0.02 -0.69 0.00 1.21 0.00 0.00 0.00 174.94 175.43 2k78 n GLU 84 N 0.74 -1.63 -1.04 2.79 0.00 -1.13 -0.95 120.64 119.43 2k78 n GLU 84 Ca -0.19 0.93 0.00 0.00 0.00 0.00 0.00 57.16 57.90 2k78 n GLU 84 Cb 0.59 -5.30 0.00 0.00 0.00 0.00 0.00 31.44 26.73 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 0.08 0.46 3.16 8.31 0.00 -1.26 -5.05 105.19 110.89 2k78 n GLY 85 Ca -0.13 -0.95 -0.12 0.00 0.00 0.00 0.00 46.02 44.82 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 0.90 1.17 1.61 -3.43 -0.12 -5.15 115.29 108.26 2k78 s HIS 86 Ca 0.00 -0.79 -0.19 0.00 -0.80 0.00 0.00 55.06 53.28 2k78 s HIS 86 Cb 0.00 -0.51 0.28 0.00 -1.43 0.00 0.00 32.58 30.92 2k78 s HIS 86 CO 0.00 -0.10 1.17 0.15 -2.00 0.00 0.00 174.74 173.95 2k78 s LYS 87 N -3.25 -0.97 0.36 -0.38 3.01 -1.26 -1.55 119.74 115.71 2k78 s LYS 87 Ca 0.07 -0.21 0.08 0.00 -1.01 0.00 0.00 55.97 54.89 2k78 s LYS 87 Cb 0.01 -1.64 -0.03 0.00 -1.01 0.00 0.00 37.83 35.16 2k78 s LYS 87 CO -0.03 -3.52 0.26 -1.83 0.51 0.00 0.00 175.35 170.75 2k78 s GLU 88 N -5.57 2.54 -0.17 1.68 -1.05 -1.20 -4.64 118.70 110.28 2k78 s GLU 88 Ca 0.72 -1.47 -0.06 0.00 -0.15 0.00 0.00 54.97 54.01 2k78 s GLU 88 Cb -0.07 -2.33 -0.04 0.00 -0.44 0.00 0.00 34.13 31.25 2k78 s GLU 88 CO 0.55 0.01 0.03 1.21 0.95 0.00 0.00 175.26 178.02 2k78 s ASN 89 N -3.98 5.41 -0.52 0.83 2.47 -1.23 -4.95 114.94 112.97 2k78 s ASN 89 Ca 0.42 0.04 -0.27 0.00 0.42 0.00 0.00 52.86 53.47 2k78 s ASN 89 Cb -0.03 -1.89 -0.03 0.00 -1.45 0.00 0.00 41.25 37.85 2k78 s ASN 89 CO 0.25 0.19 1.91 0.27 -3.72 0.00 0.00 177.10 176.01 2k78 s ILE 90 N 0.24 3.34 -0.13 -5.21 -4.36 -1.26 -3.05 121.20 110.78 2k78 s ILE 90 Ca 0.02 0.25 0.18 0.00 -0.26 0.00 0.00 60.65 60.84 2k78 s ILE 90 Cb -0.13 -3.75 -0.23 0.00 1.25 0.00 0.00 42.46 39.61 2k78 s ILE 90 CO 0.01 -0.67 0.45 0.00 0.24 0.00 0.00 174.94 174.97 2k78 n ILE 91 N 7.36 1.10 -3.14 8.37 3.06 -0.78 -4.89 119.36 130.45 2k78 n ILE 91 Ca 0.23 -0.73 0.04 0.00 -2.50 0.00 0.00 62.75 59.79 2k78 n ILE 91 Cb 0.51 -0.53 -0.00 0.00 0.54 0.00 0.00 39.64 40.16 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 -5.47 -1.02 -0.52 9.51 0.01 -1.21 -4.97 113.70 110.03 2k78 s SER 92 Ca -0.07 0.06 -0.18 0.00 1.31 0.00 0.00 55.95 57.07 2k78 s SER 92 Cb 0.09 1.61 0.08 0.00 0.21 0.00 0.00 66.02 68.00 2k78 s SER 92 CO 0.84 -0.18 0.60 -0.75 0.41 0.00 0.00 173.24 174.16 2k78 s LYS 93 N 2.80 3.07 -0.72 12.44 2.20 -1.26 -1.82 119.74 136.45 2k78 s LYS 93 Ca 0.19 -1.12 -0.17 0.00 -0.36 0.00 0.00 55.97 54.50 2k78 s LYS 93 Cb -0.05 -4.16 0.15 0.00 -1.51 0.00 0.00 37.83 32.26 2k78 s LYS 93 CO -0.23 -1.27 0.77 1.21 -0.36 0.00 0.00 175.35 175.46 2k78 s ASN 94 N 2.96 6.45 0.24 1.43 3.04 -0.91 -4.87 114.94 123.28 2k78 s ASN 94 Ca 0.12 -2.01 0.10 0.00 0.04 0.00 0.00 52.86 51.11 2k78 s ASN 94 Cb -0.22 -2.28 0.22 0.00 -1.54 0.00 0.00 41.25 37.44 2k78 s ASN 94 CO 0.09 -0.89 1.53 0.74 -3.04 0.00 0.00 177.10 175.53 2k78 h THR 95 N 5.53 1.49 -0.41 -5.21 2.02 -1.95 0.51 112.91 114.89 2k78 h THR 95 Ca -0.09 -2.43 -0.02 0.00 0.77 0.00 0.00 66.41 64.65 2k78 h THR 95 Cb 1.06 2.31 -0.02 0.00 -1.74 0.00 0.00 68.15 69.77 2k78 h THR 95 CO 0.98 0.69 0.18 0.00 0.37 0.00 0.00 175.52 177.74 2k78 h ALA 96 N 1.29 0.53 -0.53 6.16 0.00 -1.94 -2.59 119.26 122.19 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 1.26 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2k78 h ALA 96 CO 0.09 0.11 0.00 1.17 0.00 0.00 0.00 179.25 180.62 2k78 n LYS 97 N -4.66 3.15 -3.72 0.00 4.81 -1.22 -4.94 118.16 111.58 2k78 n LYS 97 Ca 0.00 -2.29 -0.29 0.00 -0.87 0.00 0.00 58.31 54.86 2k78 n LYS 97 Cb 0.13 -1.75 0.03 0.00 0.02 0.00 0.00 35.03 33.46 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 0.89 -4.15 -2.43 3.14 2.03 -0.91 -4.89 116.55 110.23 2k78 n ASP 98 Ca 0.21 -0.99 -0.11 0.00 0.52 0.00 0.00 54.79 54.41 2k78 n ASP 98 Cb 0.73 -3.42 -0.03 0.00 -0.72 0.00 0.00 41.12 37.68 2k78 n ASP 98 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2k78 n GLU 99 N -4.21 0.45 -3.61 -0.67 1.02 0.12 -2.58 120.64 111.17 2k78 n GLU 99 Ca -0.15 -2.03 -0.02 0.00 -0.02 0.00 0.00 57.16 54.94 2k78 n GLU 99 Cb 0.61 1.89 -0.02 0.00 -0.02 0.00 0.00 31.44 33.91 2k78 n GLU 99 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2k78 s ARG 100 N -2.64 0.23 0.01 3.49 3.52 -0.80 -2.15 118.95 120.61 2k78 s ARG 100 Ca 0.22 -0.10 -0.04 0.00 -0.13 0.00 0.00 55.73 55.68 2k78 s ARG 100 Cb -0.00 0.10 -0.01 0.00 -1.56 0.00 0.00 34.95 33.47 2k78 s ARG 100 CO 0.16 -0.10 0.06 0.99 -0.81 0.00 0.00 175.30 175.60 2k78 s THR 101 N -2.29 0.10 -0.01 4.11 2.01 -0.75 0.16 115.64 118.96 2k78 s THR 101 Ca 0.11 -0.83 -0.10 0.00 0.31 0.00 0.00 61.69 61.18 2k78 s THR 101 Cb 0.01 -0.42 0.01 0.00 0.01 0.00 0.00 72.50 72.10 2k78 s THR 101 CO -0.04 -0.46 0.20 -0.94 -0.69 0.00 0.00 174.62 172.69 2k78 s SER 102 N -1.51 -0.07 0.13 3.53 1.04 -0.83 -1.86 113.70 114.14 2k78 s SER 102 Ca -0.14 -0.04 -0.10 0.00 0.48 0.00 0.00 55.95 56.15 2k78 s SER 102 Cb -0.08 0.27 -0.06 0.00 0.10 0.00 0.00 66.02 66.25 2k78 s SER 102 CO -0.00 -0.36 0.45 -0.70 0.98 0.00 0.00 173.24 173.62 2k78 s GLU 103 N -1.18 3.78 0.02 4.02 2.12 -1.17 -0.75 118.70 125.55 2k78 s GLU 103 Ca -0.13 0.21 0.04 0.00 0.36 0.00 0.00 54.97 55.45 2k78 s GLU 103 Cb -0.06 -2.89 -0.02 0.00 0.26 0.00 0.00 34.13 31.42 2k78 s GLU 103 CO 0.02 0.48 -0.12 -0.06 -0.54 0.00 0.00 175.26 175.04 2k78 s PHE 104 N -1.54 1.09 -0.21 5.30 0.08 0.53 -3.54 117.98 119.69 2k78 s PHE 104 Ca 0.38 -0.31 -0.11 0.00 0.12 0.00 0.00 56.93 57.02 2k78 s PHE 104 Cb -0.13 -0.66 -0.05 0.00 -0.57 0.00 0.00 43.02 41.61 2k78 s PHE 104 CO 0.20 0.01 0.17 -1.21 -0.10 0.00 0.00 175.22 174.28 2k78 s GLU 105 N -0.87 4.16 -0.10 0.44 2.02 -1.26 -2.11 118.70 120.98 2k78 s GLU 105 Ca 0.01 -0.18 -0.13 0.00 0.02 0.00 0.00 54.97 54.69 2k78 s GLU 105 Cb -0.07 -3.46 0.03 0.00 0.10 0.00 0.00 34.13 30.73 2k78 s GLU 105 CO 0.01 0.21 0.34 0.54 0.02 0.00 0.00 175.26 176.38 2k78 s VAL 106 N 0.61 0.02 -0.15 2.63 0.11 -1.25 -4.85 120.40 117.51 2k78 s VAL 106 Ca 0.09 -0.14 -0.29 0.00 -2.93 0.00 0.00 61.98 58.71 2k78 s VAL 106 Cb -0.12 -0.53 -0.06 0.00 -1.53 0.00 0.00 36.38 34.14 2k78 s VAL 106 CO 0.01 -0.08 2.08 -0.94 -3.33 0.00 0.00 175.10 172.84 2k78 s SER 107 N -0.28 5.83 0.36 3.54 1.04 -1.26 -4.71 113.70 118.21 2k78 s SER 107 Ca -0.04 2.05 0.00 0.00 0.48 0.00 0.00 55.95 58.44 2k78 s SER 107 Cb -0.03 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.57 2k78 s SER 107 CO 0.02 -1.64 0.00 0.29 0.98 0.00 0.00 173.24 172.89 2k78 n LYS 108 N 8.32 0.00 -2.93 4.02 4.76 -1.26 -4.65 118.16 126.42 2k78 n LYS 108 Ca 0.26 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.56 2k78 n LYS 108 Cb 0.44 0.00 0.02 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 -1.30 -3.00 -0.35 -0.00 -1.26 -4.99 117.00 106.09 2k78 n LEU 109 Ca 0.00 -4.08 -0.14 0.00 -0.00 0.00 0.00 56.01 51.78 2k78 n LEU 109 Cb 0.00 0.81 0.01 0.00 -0.00 0.00 0.00 43.42 44.24 2k78 n LEU 109 CO 0.00 2.10 -0.04 -3.20 -0.00 0.00 0.00 177.39 176.26 2k78 n ASN 110 N 0.89 -0.09 0.00 1.45 2.85 -1.24 0.00 115.26 119.12 2k78 n ASN 110 Ca 0.14 -3.15 0.00 0.00 -0.11 0.00 0.00 54.58 51.46 2k78 n ASN 110 Cb 0.64 0.15 0.00 0.00 1.24 0.00 0.00 39.78 41.81 2k78 n ASN 110 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2k78 n GLY 111 N 0.24 0.56 3.81 8.20 0.00 -0.80 -4.97 105.19 112.23 2k78 n GLY 111 Ca 0.17 -0.92 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.00 4.31 -0.00 1.61 2.36 -1.26 -2.32 119.74 122.45 2k78 s LYS 112 Ca 0.00 1.09 0.02 0.00 -2.55 0.00 0.00 55.97 54.52 2k78 s LYS 112 Cb 0.00 -2.51 -0.01 0.00 -1.05 0.00 0.00 37.83 34.27 2k78 s LYS 112 CO 0.00 0.15 -0.05 0.42 1.55 0.00 0.00 175.35 177.42 2k78 s ILE 113 N -1.88 0.42 -0.37 5.43 1.01 -0.49 -4.94 121.20 120.37 2k78 s ILE 113 Ca 0.55 -0.29 -0.29 0.00 0.00 0.00 0.00 60.65 60.61 2k78 s ILE 113 Cb -0.13 -0.37 0.01 0.00 0.01 0.00 0.00 42.46 41.98 2k78 s ILE 113 CO 0.18 0.07 1.32 -1.81 0.00 0.00 0.00 174.94 174.70 2k78 s ASP 114 N -0.24 6.54 0.53 3.58 1.11 -1.26 -1.17 116.67 125.76 2k78 s ASP 114 Ca 0.01 0.94 0.05 0.00 0.18 0.00 0.00 52.55 53.73 2k78 s ASP 114 Cb -0.03 -2.54 0.03 0.00 1.07 0.00 0.00 42.92 41.45 2k78 s ASP 114 CO -0.00 -1.24 0.35 -0.83 1.18 0.00 0.00 175.17 174.62 2k78 s GLY 115 N 3.17 2.46 0.10 0.21 0.00 -1.02 -2.82 107.32 109.41 2k78 s GLY 115 Ca 0.57 -1.17 -0.06 0.00 0.00 0.00 0.00 44.72 44.06 2k78 s GLY 115 CO 0.28 -1.97 0.15 0.54 0.00 0.00 0.00 173.10 172.10 2k78 s LYS 116 N -4.22 0.87 -0.21 2.90 1.02 0.37 -2.98 119.74 117.48 2k78 s LYS 116 Ca 0.31 -1.10 -0.22 0.00 0.02 0.00 0.00 55.97 54.98 2k78 s LYS 116 Cb -0.02 0.31 0.06 0.00 -0.52 0.00 0.00 37.83 37.67 2k78 s LYS 116 CO 0.19 -0.27 0.61 -1.50 -0.92 0.00 0.00 175.35 173.46 2k78 s ILE 117 N -3.91 0.00 0.12 2.17 -1.16 0.27 0.16 121.20 118.86 2k78 s ILE 117 Ca 0.10 -0.01 0.04 0.00 -0.51 0.00 0.00 60.65 60.26 2k78 s ILE 117 Cb 0.05 -0.86 -0.04 0.00 0.61 0.00 0.00 42.46 42.23 2k78 s ILE 117 CO -0.07 -0.01 0.12 -0.62 -2.81 0.00 0.00 174.94 171.54 2k78 s ASP 118 N 0.17 5.57 0.10 4.50 -1.08 -1.09 -0.27 116.67 124.58 2k78 s ASP 118 Ca -0.01 -0.05 0.06 0.00 -0.52 0.00 0.00 52.55 52.03 2k78 s ASP 118 Cb -0.04 -1.49 -0.03 0.00 -1.46 0.00 0.00 42.92 39.90 2k78 s ASP 118 CO 0.02 0.12 -0.16 -0.69 0.52 0.00 0.00 175.17 174.98 2k78 s VAL 119 N -1.57 1.34 -0.29 1.11 1.01 -0.62 -2.32 120.40 119.06 2k78 s VAL 119 Ca 0.30 -1.53 0.01 0.00 0.00 0.00 0.00 61.98 60.77 2k78 s VAL 119 Cb -0.11 -1.37 0.16 0.00 0.00 0.00 0.00 36.38 35.06 2k78 s VAL 119 CO 0.23 -0.26 0.39 -0.47 0.00 0.00 0.00 175.10 174.99 2k78 s TYR 120 N -1.60 -0.92 0.12 5.22 5.04 -1.19 -2.72 117.35 121.30 2k78 s TYR 120 Ca 0.04 0.28 0.07 0.00 -2.44 0.00 0.00 57.07 55.02 2k78 s TYR 120 Cb -0.08 -0.19 -0.04 0.00 0.35 0.00 0.00 41.96 42.00 2k78 s TYR 120 CO 0.03 -0.96 -0.17 0.42 -1.34 0.00 0.00 175.55 173.53 2k78 s ILE 121 N 2.52 1.52 -0.30 3.14 1.01 0.41 -4.64 121.20 124.85 2k78 s ILE 121 Ca 0.10 -1.66 0.06 0.00 0.00 0.00 0.00 60.65 59.15 2k78 s ILE 121 Cb -0.13 -1.55 0.20 0.00 0.01 0.00 0.00 42.46 40.99 2k78 s ILE 121 CO -0.30 -0.27 0.59 1.51 0.00 0.00 0.00 174.94 176.47 2k78 s ASP 122 N -2.26 -1.55 0.00 3.58 -4.77 -1.26 -1.58 116.67 108.83 2k78 s ASP 122 Ca 0.08 0.05 0.00 0.00 -3.30 0.00 0.00 52.55 49.38 2k78 s ASP 122 Cb -0.07 2.00 0.00 0.00 -1.09 0.00 0.00 42.92 43.75 2k78 s ASP 122 CO 0.04 -0.29 0.00 -1.84 0.70 0.00 0.00 175.17 173.79 2k78 n GLU 123 N 5.29 0.00 -3.42 2.11 0.28 -1.12 -5.00 120.64 118.78 2k78 n GLU 123 Ca 0.06 0.00 -0.19 0.00 -0.16 0.00 0.00 57.16 56.87 2k78 n GLU 123 Cb 0.54 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.40 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 1.71 2.90 -0.28 3.44 1.02 -1.26 0.11 119.74 127.37 2k78 s LYS 124 Ca 0.00 -1.19 -0.05 0.00 0.02 0.00 0.00 55.97 54.75 2k78 s LYS 124 Cb 0.00 -2.69 0.15 0.00 -0.52 0.00 0.00 37.83 34.77 2k78 s LYS 124 CO 0.00 -0.05 0.57 0.08 -0.92 0.00 0.00 175.35 175.03 2k78 s VAL 125 N -2.28 -0.91 -1.61 3.17 1.01 0.19 -4.76 120.40 115.22 2k78 s VAL 125 Ca 0.47 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.46 2k78 s VAL 125 Cb -0.08 -0.94 0.00 0.00 0.00 0.00 0.00 36.38 35.36 2k78 s VAL 125 CO 0.30 -0.01 0.00 -3.20 0.00 0.00 0.00 175.10 172.20 2k78 n ASN 126 N 5.42 -4.81 -0.26 3.32 4.05 -1.26 -1.40 115.26 120.33 2k78 n ASN 126 Ca -0.06 0.22 0.00 0.00 0.45 0.00 0.00 54.58 55.19 2k78 n ASN 126 Cb 0.50 -4.15 0.00 0.00 1.23 0.00 0.00 39.78 37.36 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 -0.68 0.94 3.22 8.20 0.00 -1.26 -5.08 105.19 110.53 2k78 n GLY 127 Ca -0.19 -0.51 -0.13 0.00 0.00 0.00 0.00 46.02 45.19 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 -3.38 0.53 0.14 1.61 1.02 -0.49 -5.13 119.74 114.04 2k78 s LYS 128 Ca 0.00 0.05 -0.31 0.00 0.02 0.00 0.00 55.97 55.73 2k78 s LYS 128 Cb 0.00 0.24 -0.09 0.00 -0.52 0.00 0.00 37.83 37.46 2k78 s LYS 128 CO 0.00 -0.12 1.47 -1.25 -0.92 0.00 0.00 175.35 174.53 2k78 s PRO 129 N -0.72 4.27 -0.04 -1.68 0.04 -1.26 0.57 135.00 136.19 2k78 s PRO 129 Ca -0.08 2.21 0.05 0.00 0.04 0.00 0.00 61.00 63.22 2k78 s PRO 129 Cb -0.04 -3.20 -0.02 0.00 0.04 0.00 0.00 34.50 31.28 2k78 s PRO 129 CO 0.02 -0.51 -0.19 0.12 0.04 0.00 0.00 177.00 176.49 2k78 s PHE 130 N 1.05 2.56 -0.24 0.56 5.36 0.31 -4.85 117.98 122.72 2k78 s PHE 130 Ca 0.67 -0.26 -0.03 0.00 -0.96 0.00 0.00 56.93 56.34 2k78 s PHE 130 Cb -0.40 -1.58 0.08 0.00 -0.34 0.00 0.00 43.02 40.78 2k78 s PHE 130 CO 0.31 0.11 0.08 0.21 -1.46 0.00 0.00 175.22 174.47 2k78 s LYS 131 N -0.71 0.49 -0.11 10.12 2.20 -1.26 -2.81 119.74 127.66 2k78 s LYS 131 Ca 0.11 -0.58 0.03 0.00 -0.36 0.00 0.00 55.97 55.17 2k78 s LYS 131 Cb -0.10 -1.82 0.00 0.00 -1.51 0.00 0.00 37.83 34.40 2k78 s LYS 131 CO 0.00 -0.83 -0.22 -0.47 -0.36 0.00 0.00 175.35 173.47 2k78 s TYR 132 N 1.88 2.50 -0.36 4.03 5.04 -0.61 -4.98 117.35 124.85 2k78 s TYR 132 Ca 0.05 -1.09 -0.04 0.00 -2.44 0.00 0.00 57.07 53.55 2k78 s TYR 132 Cb -0.17 -1.69 0.19 0.00 0.35 0.00 0.00 41.96 40.64 2k78 s TYR 132 CO -0.20 -0.46 0.93 0.34 -1.34 0.00 0.00 175.55 174.82 2k78 s ASP 133 N 0.50 -0.70 0.19 4.32 2.15 -1.25 -0.45 116.67 121.44 2k78 s ASP 133 Ca -0.15 -0.43 -0.04 0.00 0.43 0.00 0.00 52.55 52.36 2k78 s ASP 133 Cb -0.17 0.90 0.02 0.00 -0.30 0.00 0.00 42.92 43.36 2k78 s ASP 133 CO 0.06 -0.07 0.32 1.57 -0.17 0.00 0.00 175.17 176.87 2k78 n HIS 134 N 3.73 -1.28 -3.91 -5.34 -0.00 -1.10 -4.99 115.22 102.33 2k78 n HIS 134 Ca 0.08 -1.11 -0.29 0.00 0.46 0.00 0.00 57.72 56.86 2k78 n HIS 134 Cb 0.61 0.37 -0.13 0.00 -0.12 0.00 0.00 29.99 30.72 2k78 n HIS 134 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2k78 s HIS 135 N -4.60 3.39 0.77 1.57 2.46 -1.26 -1.60 115.29 116.03 2k78 s HIS 135 Ca 0.12 -3.24 -0.08 0.00 0.47 0.00 0.00 55.06 52.34 2k78 s HIS 135 Cb -0.01 -2.79 0.17 0.00 -0.13 0.00 0.00 32.58 29.81 2k78 s HIS 135 CO 0.09 -0.65 1.05 0.66 -2.47 0.00 0.00 174.74 173.42 2k78 n TYR 136 N 2.57 -3.49 -4.02 3.88 4.01 0.63 -4.81 117.16 115.93 2k78 n TYR 136 Ca 0.12 -1.33 -0.13 0.00 -0.16 0.00 0.00 57.90 56.40 2k78 n TYR 136 Cb 0.34 -0.79 -0.03 0.00 -0.31 0.00 0.00 39.34 38.55 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 -5.04 0.70 0.25 7.72 2.20 -1.26 0.98 114.94 120.49 2k78 s ASN 137 Ca 0.64 -1.40 -0.18 0.00 -0.94 0.00 0.00 52.86 50.98 2k78 s ASN 137 Cb -0.03 0.71 0.01 0.00 -2.00 0.00 0.00 41.25 39.95 2k78 s ASN 137 CO 0.44 -1.39 0.61 0.27 -2.94 0.00 0.00 177.10 174.09 2k78 s ILE 138 N -2.90 0.00 -0.27 0.54 -4.36 -1.16 -4.45 121.20 108.61 2k78 s ILE 138 Ca 0.27 -1.07 -0.18 0.00 -0.26 0.00 0.00 60.65 59.41 2k78 s ILE 138 Cb -0.02 -1.97 -0.02 0.00 1.25 0.00 0.00 42.46 41.70 2k78 s ILE 138 CO 0.18 -0.02 0.53 -0.89 0.24 0.00 0.00 174.94 174.99 2k78 s THR 139 N -3.94 5.05 0.47 8.37 2.01 -0.80 -2.45 115.64 124.35 2k78 s THR 139 Ca 0.14 0.88 -0.02 0.00 0.31 0.00 0.00 61.69 63.00 2k78 s THR 139 Cb -0.03 -3.86 -0.01 0.00 0.01 0.00 0.00 72.50 68.61 2k78 s THR 139 CO 0.06 0.05 0.72 -0.31 -0.69 0.00 0.00 174.62 174.44 2k78 s TYR 140 N 2.35 3.34 -0.29 4.92 1.51 -0.32 -1.27 117.35 127.60 2k78 s TYR 140 Ca 0.22 0.45 0.04 0.00 -1.01 0.00 0.00 57.07 56.76 2k78 s TYR 140 Cb -0.16 -2.32 0.17 0.00 -0.11 0.00 0.00 41.96 39.55 2k78 s TYR 140 CO 0.09 -0.35 0.48 0.15 -1.11 0.00 0.00 175.55 174.81 2k78 s LYS 141 N -4.63 0.47 0.23 -0.62 1.02 -0.76 -1.40 119.74 114.05 2k78 s LYS 141 Ca 0.48 0.27 -0.08 0.00 0.02 0.00 0.00 55.97 56.66 2k78 s LYS 141 Cb -0.10 -0.10 -0.06 0.00 -0.52 0.00 0.00 37.83 37.04 2k78 s LYS 141 CO 0.40 -1.04 0.52 -0.06 -0.92 0.00 0.00 175.35 174.25 2k78 s PHE 142 N 2.64 3.44 -0.24 3.18 0.08 -0.98 -2.28 117.98 123.82 2k78 s PHE 142 Ca 0.10 0.77 -0.04 0.00 0.12 0.00 0.00 56.93 57.88 2k78 s PHE 142 Cb -0.11 -2.18 0.09 0.00 -0.57 0.00 0.00 43.02 40.24 2k78 s PHE 142 CO -0.28 0.28 0.15 -0.80 -0.10 0.00 0.00 175.22 174.46 2k78 s ASN 143 N -2.54 2.61 0.00 1.36 0.01 0.99 -1.90 114.94 115.47 2k78 s ASN 143 Ca 0.46 -0.86 0.00 0.00 -0.71 0.00 0.00 52.86 51.75 2k78 s ASN 143 Cb -0.11 -0.10 0.00 0.00 0.41 0.00 0.00 41.25 41.45 2k78 s ASN 143 CO 0.24 -0.39 0.00 0.61 -1.51 0.00 0.00 177.10 176.05 2k78 n GLY 144 N 5.28 3.77 0.72 0.66 0.00 0.10 -2.70 105.19 113.02 2k78 n GLY 144 Ca -0.06 -0.45 -0.07 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.42 0.17 1.61 -0.04 -1.26 -4.75 135.00 128.31 2k78 n PRO 145 Ca 0.00 -0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.15 2k78 n PRO 145 Cb 0.00 -0.42 0.00 0.00 -0.04 0.00 0.00 33.50 33.04 2k78 n PRO 145 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2k78 n THR 146 N -3.57 0.00 0.10 0.52 -2.24 -1.26 -4.38 114.28 103.44 2k78 n THR 146 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2k78 n THR 146 Cb 0.13 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 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 -3.35 -1.75 -3.66 3.42 2.03 -1.26 -4.95 116.55 107.03 2k78 n ASP 147 Ca 0.00 0.53 -0.23 0.00 0.52 0.00 0.00 54.79 55.61 2k78 n ASP 147 Cb 0.00 1.86 0.05 0.00 -0.72 0.00 0.00 41.12 42.31 2k78 n ASP 147 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 2k78 n VAL 148 N -2.91 -4.07 -2.71 5.18 0.31 -1.26 -4.91 118.33 107.96 2k78 n VAL 148 Ca 0.00 -0.30 -0.43 0.00 -0.01 0.00 0.00 64.34 63.60 2k78 n VAL 148 Cb 0.00 -3.93 -0.03 0.00 -0.91 0.00 0.00 33.84 28.97 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 -3.45 3.41 0.00 3.52 0.00 -1.26 -5.32 121.76 118.66 2k78 s ALA 149 Ca 0.25 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 51.92 2k78 s ALA 149 Cb -0.12 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2k78 s ALA 149 CO 0.78 -1.64 0.00 0.41 0.00 0.00 0.00 175.76 175.31