#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 -2.15 -1.66 -0.43 0.00 -1.26 -4.93 120.51 110.09 2k78 n ALA 26 Ca 0.00 -0.95 -0.19 0.00 0.00 0.00 0.00 53.44 52.31 2k78 n ALA 26 Cb 0.00 -2.12 -0.07 0.00 0.00 0.00 0.00 19.45 17.26 2k78 n ALA 26 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2k78 n ASN 27 N 1.09 -5.28 -4.74 0.00 3.02 -1.26 -4.93 115.26 103.16 2k78 n ASN 27 Ca 0.03 0.40 -0.41 0.00 -0.03 0.00 0.00 54.58 54.57 2k78 n ASN 27 Cb 0.69 -4.42 -0.03 0.00 -0.61 0.00 0.00 39.78 35.41 2k78 n ASN 27 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k78 s ALA 28 N -2.73 3.51 0.00 5.41 0.00 -1.26 -4.81 121.76 121.88 2k78 s ALA 28 Ca 0.00 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.07 2k78 s ALA 28 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2k78 s ALA 28 CO 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 175.76 175.24 2k78 n ALA 29 N 2.29 0.00 -2.62 0.00 0.00 -1.26 -4.75 120.51 114.17 2k78 n ALA 29 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.32 2k78 n ALA 29 Cb 0.43 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 -3.81 -4.71 -3.84 0.00 8.00 -1.26 -4.89 116.55 106.03 2k78 n ASP 30 Ca 0.00 0.01 -0.07 0.00 0.71 0.00 0.00 54.79 55.44 2k78 n ASP 30 Cb 0.00 -3.93 -0.02 0.00 -0.02 0.00 0.00 41.12 37.15 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 -2.21 -0.26 0.00 -2.24 0.15 -1.26 -0.62 113.70 107.26 2k78 s SER 31 Ca 0.09 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.16 2k78 s SER 31 Cb -0.04 0.71 0.00 0.00 -1.71 0.00 0.00 66.02 64.98 2k78 s SER 31 CO 0.11 -1.31 0.00 0.61 1.20 0.00 0.00 173.24 173.85 2k78 n GLY 32 N -0.46 1.62 3.50 9.45 0.00 -0.79 -4.95 105.19 113.57 2k78 n GLY 32 Ca -0.05 -1.17 -0.43 0.00 0.00 0.00 0.00 46.02 44.37 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 -1.99 4.46 0.28 2.61 -4.23 -1.26 -0.62 115.64 114.88 2k78 s THR 33 Ca 0.00 0.10 -0.02 0.00 -1.18 0.00 0.00 61.69 60.59 2k78 s THR 33 Cb 0.00 -4.52 -0.04 0.00 1.34 0.00 0.00 72.50 69.28 2k78 s THR 33 CO 0.00 -1.10 0.50 -0.22 -0.54 0.00 0.00 174.62 173.26 2k78 s LEU 34 N 3.76 4.10 0.26 4.79 2.96 0.13 -4.89 118.68 129.78 2k78 s LEU 34 Ca 0.27 0.55 -0.29 0.00 -0.22 0.00 0.00 54.13 54.44 2k78 s LEU 34 Cb -0.14 -3.36 -0.09 0.00 0.50 0.00 0.00 46.19 43.10 2k78 s LEU 34 CO 0.17 -0.18 0.94 0.20 -1.32 0.00 0.00 176.35 176.17 2k78 s ASN 35 N -3.40 7.58 -0.00 3.68 0.01 -1.05 -2.15 114.94 119.62 2k78 s ASN 35 Ca 0.41 1.94 -0.28 0.00 -0.71 0.00 0.00 52.86 54.22 2k78 s ASN 35 Cb -0.10 -2.60 0.10 0.00 0.41 0.00 0.00 41.25 39.05 2k78 s ASN 35 CO 0.31 0.11 0.85 -0.72 -1.51 0.00 0.00 177.10 176.14 2k78 s TYR 36 N -1.26 -0.40 0.00 2.20 1.13 -1.26 0.17 117.35 117.93 2k78 s TYR 36 Ca 0.43 0.33 0.00 0.00 -1.41 0.00 0.00 57.07 56.42 2k78 s TYR 36 Cb -0.25 0.52 0.00 0.00 -1.10 0.00 0.00 41.96 41.14 2k78 s TYR 36 CO 0.31 -0.57 0.00 -1.91 -2.51 0.00 0.00 175.55 170.87 2k78 n GLU 37 N -0.08 0.00 -4.23 -3.49 2.13 -1.05 -4.78 120.64 109.14 2k78 n GLU 37 Ca -0.11 0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.56 2k78 n GLU 37 Cb 0.61 0.00 -0.09 0.00 0.27 0.00 0.00 31.44 32.23 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 -2.74 0.00 0.06 6.31 -7.23 -1.26 0.40 120.40 115.93 2k78 s VAL 38 Ca 0.00 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.06 2k78 s VAL 38 Cb 0.00 -2.50 0.01 0.00 0.56 0.00 0.00 36.38 34.45 2k78 s VAL 38 CO 0.00 0.00 0.24 -0.31 -0.31 0.00 0.00 175.10 174.72 2k78 s TYR 39 N -3.85 0.01 0.10 2.82 2.02 -0.63 -4.07 117.35 113.76 2k78 s TYR 39 Ca 0.40 -0.27 -0.31 0.00 -0.37 0.00 0.00 57.07 56.52 2k78 s TYR 39 Cb 0.05 0.02 -0.08 0.00 -0.40 0.00 0.00 41.96 41.55 2k78 s TYR 39 CO 0.19 -0.50 1.45 0.21 -1.57 0.00 0.00 175.55 175.33 2k78 s LYS 40 N -2.97 4.29 0.59 -0.62 2.47 -1.19 -1.85 119.74 120.45 2k78 s LYS 40 Ca -0.02 2.14 -0.20 0.00 -1.56 0.00 0.00 55.97 56.33 2k78 s LYS 40 Cb 0.01 -3.30 -0.04 0.00 -1.46 0.00 0.00 37.83 33.03 2k78 s LYS 40 CO -0.06 -0.51 1.21 0.66 0.16 0.00 0.00 175.35 176.81 2k78 n TYR 41 N 4.29 1.72 -0.83 4.03 4.02 -1.26 -1.50 117.16 127.62 2k78 n TYR 41 Ca 0.12 0.43 0.00 0.00 -0.01 0.00 0.00 57.90 58.45 2k78 n TYR 41 Cb 0.42 -2.26 0.00 0.00 -0.02 0.00 0.00 39.34 37.47 2k78 n TYR 41 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2k78 n ASN 42 N -1.15 -1.06 -0.63 7.72 3.02 -1.26 -4.93 115.26 116.97 2k78 n ASN 42 Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 2k78 n ASN 42 Cb 0.46 -1.29 0.00 0.00 -0.61 0.00 0.00 39.78 38.34 2k78 n ASN 42 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2k78 n THR 43 N -2.14 0.00 -1.32 3.41 -2.24 -0.56 -5.07 114.28 106.36 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 0.05 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.31 2k78 n THR 43 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2k78 n ASN 44 N -1.48 0.68 -3.75 3.42 5.15 -1.26 -4.73 115.26 113.29 2k78 n ASN 44 Ca 0.00 -1.94 -0.23 0.00 -0.60 0.00 0.00 54.58 51.81 2k78 n ASN 44 Cb 0.00 -0.17 -0.17 0.00 -0.53 0.00 0.00 39.78 38.91 2k78 n ASN 44 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2k78 s ASP 45 N -1.09 1.74 0.08 1.20 -1.08 -1.26 -4.91 116.67 111.35 2k78 s ASP 45 Ca 0.06 -0.18 -0.36 0.00 -0.52 0.00 0.00 52.55 51.55 2k78 s ASP 45 Cb 0.05 -0.42 -0.15 0.00 -1.46 0.00 0.00 42.92 40.94 2k78 s ASP 45 CO 0.01 -0.22 1.50 0.41 0.52 0.00 0.00 175.17 177.38 2k78 n THR 46 N 5.16 0.06 0.00 1.71 -1.04 -1.26 -3.19 114.28 115.72 2k78 n THR 46 Ca -0.07 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 2k78 n THR 46 Cb 0.50 -1.19 0.00 0.00 -1.82 0.00 0.00 70.33 67.81 2k78 n THR 46 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2k78 n SER 47 N 3.35 1.61 0.07 8.00 7.64 -1.26 -4.79 113.62 128.24 2k78 n SER 47 Ca 0.19 -0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.97 2k78 n SER 47 Cb 0.23 0.53 0.00 0.00 -1.01 0.00 0.00 64.21 63.96 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 -0.69 0.13 0.25 0.44 5.41 -1.26 -4.82 119.36 118.82 2k78 n ILE 48 Ca 0.00 0.04 0.16 0.00 1.00 0.00 0.00 62.75 63.96 2k78 n ILE 48 Cb 0.00 -0.48 0.75 0.00 -0.71 0.00 0.00 39.64 39.20 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 1.64 0.00 -1.39 0.00 -1.94 0.15 119.26 117.72 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 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2k78 h ALA 49 CO 0.00 -0.49 0.00 -1.71 0.00 0.00 0.00 179.25 177.05 2k78 n ASN 50 N -3.13 0.00 -1.17 0.00 5.15 -1.26 -2.14 115.26 112.71 2k78 n ASN 50 Ca 0.01 0.40 0.11 0.00 -0.60 0.00 0.00 54.58 54.51 2k78 n ASN 50 Cb 0.50 -0.45 0.28 0.00 -0.53 0.00 0.00 39.78 39.58 2k78 n ASN 50 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2k78 n ASP 51 N -1.45 3.42 -0.36 1.20 9.92 0.53 -4.24 116.55 125.58 2k78 n ASP 51 Ca 0.04 -1.98 0.00 0.00 -0.53 0.00 0.00 54.79 52.31 2k78 n ASP 51 Cb 0.14 -0.38 0.00 0.00 -0.64 0.00 0.00 41.12 40.24 2k78 n ASP 51 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 2k78 n TYR 52 N 1.39 0.00 -4.04 1.24 4.01 -0.91 -5.04 117.16 113.82 2k78 n TYR 52 Ca 0.21 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.63 2k78 n TYR 52 Cb 0.56 -0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.43 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 0.00 3.40 0.62 -0.72 0.40 -1.19 -2.99 117.98 117.51 2k78 s PHE 53 Ca 0.00 -2.47 -0.15 0.00 -0.60 0.00 0.00 56.93 53.70 2k78 s PHE 53 Cb 0.00 -2.23 -0.02 0.00 0.51 0.00 0.00 43.02 41.28 2k78 s PHE 53 CO 0.00 -0.89 1.07 1.21 0.70 0.00 0.00 175.22 177.31 2k78 s ASN 54 N 1.07 5.55 0.19 1.36 2.47 -1.26 -5.00 114.94 119.33 2k78 s ASN 54 Ca -0.03 1.86 -0.08 0.00 0.42 0.00 0.00 52.86 55.03 2k78 s ASN 54 Cb -0.20 -2.54 -0.02 0.00 -1.45 0.00 0.00 41.25 37.05 2k78 s ASN 54 CO -0.05 -1.33 0.29 -1.59 -3.72 0.00 0.00 177.10 170.69 2k78 s LYS 55 N -4.14 1.24 0.57 0.43 -2.85 -1.26 -4.63 119.74 109.11 2k78 s LYS 55 Ca 0.64 -1.29 -0.10 0.00 -1.00 0.00 0.00 55.97 54.22 2k78 s LYS 55 Cb -0.17 0.37 0.13 0.00 -2.06 0.00 0.00 37.83 36.10 2k78 s LYS 55 CO 0.39 -0.46 0.68 -0.35 0.10 0.00 0.00 175.35 175.72 2k78 n PRO 56 N -0.26 -1.13 -3.75 1.78 -0.04 -1.26 -5.15 135.00 125.19 2k78 n PRO 56 Ca -0.04 -1.07 -0.20 0.00 -0.04 0.00 0.00 63.50 62.15 2k78 n PRO 56 Cb 0.63 -0.78 -0.01 0.00 -0.04 0.00 0.00 33.50 33.29 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 -3.70 4.05 -0.31 0.55 0.00 -0.91 -4.92 121.76 116.53 2k78 s ALA 57 Ca 0.40 -1.35 -0.11 0.00 0.00 0.00 0.00 51.96 50.90 2k78 s ALA 57 Cb -0.02 -1.67 -0.02 0.00 0.00 0.00 0.00 23.12 21.40 2k78 s ALA 57 CO 0.29 0.12 0.18 0.21 0.00 0.00 0.00 175.76 176.56 2k78 s LYS 58 N -4.06 3.57 0.30 0.00 2.20 -1.16 0.21 119.74 120.80 2k78 s LYS 58 Ca 0.39 -0.58 0.03 0.00 -0.36 0.00 0.00 55.97 55.46 2k78 s LYS 58 Cb -0.09 -3.64 -0.03 0.00 -1.51 0.00 0.00 37.83 32.56 2k78 s LYS 58 CO 0.30 -0.35 0.46 1.52 -0.36 0.00 0.00 175.35 176.92 2k78 s TYR 59 N 1.68 3.41 -0.22 4.03 1.13 0.20 -0.08 117.35 127.51 2k78 s TYR 59 Ca 0.06 0.11 -0.11 0.00 -1.41 0.00 0.00 57.07 55.71 2k78 s TYR 59 Cb -0.17 -1.79 0.08 0.00 -1.10 0.00 0.00 41.96 38.98 2k78 s TYR 59 CO 0.08 0.21 0.53 -1.50 -2.51 0.00 0.00 175.55 172.37 2k78 s ILE 60 N -2.17 -0.22 -0.07 -3.49 2.07 -0.88 -1.88 121.20 114.57 2k78 s ILE 60 Ca 0.38 0.06 -0.02 0.00 -1.41 0.00 0.00 60.65 59.67 2k78 s ILE 60 Cb -0.09 -0.79 0.03 0.00 0.13 0.00 0.00 42.46 41.74 2k78 s ILE 60 CO 0.32 0.03 0.02 -0.54 -1.91 0.00 0.00 174.94 172.86 2k78 s LYS 61 N 1.83 0.44 -1.15 3.50 1.02 0.21 0.72 119.74 126.30 2k78 s LYS 61 Ca -0.08 0.14 -0.03 0.00 0.02 0.00 0.00 55.97 56.02 2k78 s LYS 61 Cb -0.08 -0.93 0.24 0.00 -0.52 0.00 0.00 37.83 36.54 2k78 s LYS 61 CO -0.16 -0.33 1.97 1.63 -0.92 0.00 0.00 175.35 177.54 2k78 n LYS 62 N 5.18 4.92 -2.93 1.68 5.02 -1.00 -4.44 118.16 126.59 2k78 n LYS 62 Ca -0.06 -4.17 -0.02 0.00 -2.02 0.00 0.00 58.31 52.03 2k78 n LYS 62 Cb 0.50 -2.56 -0.02 0.00 -0.02 0.00 0.00 35.03 32.93 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 0.99 -5.34 0.00 4.39 5.15 -1.26 -4.35 115.26 114.84 2k78 n ASN 63 Ca 0.49 1.06 0.00 0.00 -0.60 0.00 0.00 54.58 55.53 2k78 n ASN 63 Cb 0.27 -2.79 0.00 0.00 -0.53 0.00 0.00 39.78 36.73 2k78 n ASN 63 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k78 n GLY 64 N 2.17 0.77 3.49 8.20 0.00 -1.26 -5.06 105.19 113.51 2k78 n GLY 64 Ca -0.13 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.96 0.91 -0.04 1.61 0.00 -1.26 -5.17 119.74 114.83 2k78 s LYS 65 Ca 0.00 -0.28 -0.23 0.00 0.00 0.00 0.00 55.97 55.45 2k78 s LYS 65 Cb 0.00 0.42 0.05 0.00 0.00 0.00 0.00 37.83 38.30 2k78 s LYS 65 CO 0.00 -0.39 0.51 -0.48 0.00 0.00 0.00 175.35 174.99 2k78 s LEU 66 N -2.39 0.04 0.00 2.77 -0.00 -1.26 -2.36 118.68 115.48 2k78 s LEU 66 Ca 0.03 0.44 0.00 0.00 -0.00 0.00 0.00 54.13 54.60 2k78 s LEU 66 Cb -0.01 1.94 0.00 0.00 -0.00 0.00 0.00 46.19 48.13 2k78 s LEU 66 CO -0.08 -0.53 0.00 -1.22 -0.00 0.00 0.00 176.35 174.52 2k78 n TYR 67 N 1.11 -0.06 -3.64 3.48 4.02 0.22 -3.90 117.16 118.39 2k78 n TYR 67 Ca -0.20 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.65 2k78 n TYR 67 Cb 0.57 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.82 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 -1.68 0.00 -0.13 -0.72 1.01 -0.98 -2.07 120.40 115.82 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 0.84 3.98 -0.07 2.72 1.03 0.89 -1.47 119.66 127.58 2k78 s GLN 69 Ca -0.04 0.01 0.02 0.00 0.04 0.00 0.00 55.36 55.40 2k78 s GLN 69 Cb -0.04 -3.33 -0.03 0.00 0.03 0.00 0.00 33.01 29.64 2k78 s GLN 69 CO -0.12 0.46 -0.11 0.42 -2.54 0.00 0.00 175.29 173.40 2k78 s ILE 70 N -0.18 3.29 0.00 3.63 1.09 -0.64 -2.99 121.20 125.40 2k78 s ILE 70 Ca 0.15 -0.62 -0.21 0.00 -1.10 0.00 0.00 60.65 58.87 2k78 s ILE 70 Cb -0.13 -2.33 -0.05 0.00 -1.06 0.00 0.00 42.46 38.89 2k78 s ILE 70 CO 0.04 0.58 0.60 -0.89 -0.10 0.00 0.00 174.94 175.17 2k78 s THR 71 N -0.50 4.89 -0.24 2.92 2.01 -1.26 -2.16 115.64 121.30 2k78 s THR 71 Ca 0.07 1.27 -0.09 0.00 0.31 0.00 0.00 61.69 63.25 2k78 s THR 71 Cb -0.12 -3.94 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 2k78 s THR 71 CO 0.02 0.42 0.12 -0.69 -0.69 0.00 0.00 174.62 173.80 2k78 s VAL 72 N -0.22 4.96 -0.21 3.82 1.01 0.44 -4.01 120.40 126.18 2k78 s VAL 72 Ca 0.31 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 62.22 2k78 s VAL 72 Cb -0.18 -3.31 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 2k78 s VAL 72 CO 0.18 0.35 0.22 0.20 0.00 0.00 0.00 175.10 176.05 2k78 s ASN 73 N 1.17 6.25 -0.17 3.32 -0.87 -1.16 -2.16 114.94 121.31 2k78 s ASN 73 Ca 0.06 0.27 -0.11 0.00 -1.57 0.00 0.00 52.86 51.51 2k78 s ASN 73 Cb -0.14 -2.14 0.04 0.00 -0.02 0.00 0.00 41.25 38.99 2k78 s ASN 73 CO 0.05 0.07 0.22 1.57 -2.57 0.00 0.00 177.10 176.44 2k78 n HIS 74 N 4.06 -4.03 0.09 2.20 -0.00 -0.87 -4.57 115.22 112.10 2k78 n HIS 74 Ca -0.13 2.34 -0.05 0.00 0.46 0.00 0.00 57.72 60.33 2k78 n HIS 74 Cb 0.52 -3.68 0.10 0.00 -0.12 0.00 0.00 29.99 26.81 2k78 n HIS 74 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2k78 h SER 75 N 3.63 0.25 -0.85 0.26 4.64 -1.80 -2.85 113.55 116.83 2k78 h SER 75 Ca -0.51 -0.15 0.03 0.00 -0.47 0.00 0.00 61.79 60.68 2k78 h SER 75 Cb 1.15 -0.07 -0.05 0.00 -0.31 0.00 0.00 62.40 63.12 2k78 h SER 75 CO 0.01 0.83 0.55 0.45 -0.87 0.00 0.00 176.83 177.80 2k78 h HIS 76 N 0.16 1.04 0.34 4.77 3.86 -1.90 -3.20 115.15 120.22 2k78 h HIS 76 Ca -0.01 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 2k78 h HIS 76 Cb 1.17 -0.35 0.00 0.00 1.06 0.00 0.00 27.41 29.29 2k78 h HIS 76 CO 0.02 0.61 -0.16 -1.49 0.86 0.00 0.00 177.93 177.77 2k78 h TRP 77 N 1.09 -0.43 -3.44 2.45 4.06 -1.77 -3.38 115.95 114.54 2k78 h TRP 77 Ca 0.33 -0.01 -0.60 0.00 2.06 0.00 0.00 58.89 60.68 2k78 h TRP 77 Cb -0.02 0.14 -0.10 0.00 -1.00 0.00 0.00 29.16 28.18 2k78 h TRP 77 CO -0.02 -0.27 0.14 -1.50 -3.56 0.00 0.00 178.44 173.24 2k78 s ILE 78 N -3.11 5.00 -0.20 1.49 2.07 -1.08 -3.07 121.20 122.30 2k78 s ILE 78 Ca -0.07 1.17 0.19 0.00 -1.41 0.00 0.00 60.65 60.53 2k78 s ILE 78 Cb 0.01 -3.94 -0.01 0.00 0.13 0.00 0.00 42.46 38.65 2k78 s ILE 78 CO 0.20 0.08 1.09 0.00 -1.91 0.00 0.00 174.94 174.40 2k78 h THR 79 N 5.27 0.36 -2.08 4.00 1.03 -1.50 -3.41 112.91 116.58 2k78 h THR 79 Ca -0.30 -1.62 0.38 0.00 -0.01 0.00 0.00 66.41 64.87 2k78 h THR 79 Cb 1.13 1.94 -0.07 0.00 -1.07 0.00 0.00 68.15 70.08 2k78 h THR 79 CO 0.77 0.20 0.97 -0.83 -0.01 0.00 0.00 175.52 176.63 2k78 s GLY 80 N -4.54 -0.17 0.26 2.99 0.00 -1.13 -4.93 107.32 99.80 2k78 s GLY 80 Ca 0.00 0.09 -0.13 0.00 0.00 0.00 0.00 44.72 44.68 2k78 s GLY 80 CO 0.78 6.52 0.51 1.06 0.00 0.00 0.00 173.10 181.96 2k78 s MET 81 N -2.01 1.63 0.19 2.90 1.00 -1.26 -2.71 119.30 119.04 2k78 s MET 81 Ca 0.32 -1.28 -0.17 0.00 0.00 0.00 0.00 55.69 54.55 2k78 s MET 81 Cb -0.00 0.49 0.03 0.00 0.00 0.00 0.00 34.83 35.34 2k78 s MET 81 CO -0.02 -0.69 0.51 0.45 0.00 0.00 0.00 175.02 175.27 2k78 s SER 82 N -3.03 -0.25 -0.22 3.03 0.15 0.43 -3.56 113.70 110.25 2k78 s SER 82 Ca 0.22 -0.49 -0.16 0.00 0.70 0.00 0.00 55.95 56.22 2k78 s SER 82 Cb -0.01 0.57 0.06 0.00 -1.71 0.00 0.00 66.02 64.93 2k78 s SER 82 CO 0.10 -1.04 0.55 -0.63 1.20 0.00 0.00 173.24 173.43 2k78 s ILE 83 N -3.87 -0.01 0.00 6.45 1.01 -1.02 -2.42 121.20 121.34 2k78 s ILE 83 Ca 0.09 0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.76 2k78 s ILE 83 Cb -0.01 -0.79 0.00 0.00 0.01 0.00 0.00 42.46 41.67 2k78 s ILE 83 CO -0.03 0.01 0.00 1.21 0.00 0.00 0.00 174.94 176.13 2k78 n GLU 84 N 3.45 -0.36 0.00 2.79 0.00 -1.21 -2.72 120.64 122.60 2k78 n GLU 84 Ca -0.17 0.09 0.00 0.00 0.00 0.00 0.00 57.16 57.08 2k78 n GLU 84 Cb 0.57 -3.72 0.00 0.00 0.00 0.00 0.00 31.44 28.29 2k78 n GLU 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2k78 n GLY 85 N -1.62 1.18 3.14 8.31 0.00 -1.26 -5.08 105.19 109.85 2k78 n GLY 85 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2k78 n GLY 85 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k78 s HIS 86 N -2.00 0.77 1.10 1.61 -3.43 -1.10 -5.15 115.29 107.08 2k78 s HIS 86 Ca 0.00 -0.91 -0.18 0.00 -0.80 0.00 0.00 55.06 53.16 2k78 s HIS 86 Cb 0.00 -0.47 0.27 0.00 -1.43 0.00 0.00 32.58 30.95 2k78 s HIS 86 CO 0.00 -0.20 1.03 1.63 -2.00 0.00 0.00 174.74 175.20 2k78 n LYS 87 N 0.14 -2.75 -3.68 -0.38 5.02 -1.26 -2.44 118.16 112.81 2k78 n LYS 87 Ca -0.14 -1.64 -0.21 0.00 -2.02 0.00 0.00 58.31 54.31 2k78 n LYS 87 Cb 0.60 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 34.11 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 -5.32 2.62 -0.15 1.97 -1.05 -1.23 -4.68 118.70 110.85 2k78 s GLU 88 Ca 0.66 -1.42 -0.03 0.00 -0.15 0.00 0.00 54.97 54.02 2k78 s GLU 88 Cb -0.06 -2.42 -0.02 0.00 -0.44 0.00 0.00 34.13 31.19 2k78 s GLU 88 CO 0.50 -0.05 -0.06 1.21 0.95 0.00 0.00 175.26 177.80 2k78 s ASN 89 N -4.06 4.60 -0.55 0.83 2.47 -1.24 -4.96 114.94 112.03 2k78 s ASN 89 Ca 0.45 -0.18 -0.27 0.00 0.42 0.00 0.00 52.86 53.28 2k78 s ASN 89 Cb -0.04 -1.74 -0.03 0.00 -1.45 0.00 0.00 41.25 37.99 2k78 s ASN 89 CO 0.27 0.17 1.92 0.27 -3.72 0.00 0.00 177.10 176.01 2k78 s ILE 90 N 0.37 3.33 -0.12 -5.21 -5.25 -1.26 -3.13 121.20 109.93 2k78 s ILE 90 Ca -0.06 0.23 0.16 0.00 -0.99 0.00 0.00 60.65 59.99 2k78 s ILE 90 Cb -0.15 -3.77 -0.23 0.00 2.95 0.00 0.00 42.46 41.26 2k78 s ILE 90 CO 0.04 -0.71 0.40 0.00 -1.79 0.00 0.00 174.94 172.87 2k78 n ILE 91 N 7.35 1.36 -3.15 8.37 3.06 -1.05 -4.91 119.36 130.38 2k78 n ILE 91 Ca 0.23 -0.79 0.05 0.00 -2.50 0.00 0.00 62.75 59.73 2k78 n ILE 91 Cb 0.52 -0.67 -0.01 0.00 0.54 0.00 0.00 39.64 40.01 2k78 n ILE 91 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 2k78 s SER 92 N -5.68 -0.92 -0.42 9.51 1.04 -1.24 -4.99 113.70 111.00 2k78 s SER 92 Ca -0.07 0.44 -0.18 0.00 0.48 0.00 0.00 55.95 56.62 2k78 s SER 92 Cb 0.07 1.72 0.02 0.00 0.10 0.00 0.00 66.02 67.94 2k78 s SER 92 CO 0.83 -0.17 0.49 -0.75 0.98 0.00 0.00 173.24 174.62 2k78 s LYS 93 N 2.91 3.17 -1.11 4.02 2.20 -1.26 -1.81 119.74 127.86 2k78 s LYS 93 Ca 0.11 -0.63 -0.11 0.00 -0.36 0.00 0.00 55.97 54.98 2k78 s LYS 93 Cb -0.11 -3.95 0.24 0.00 -1.51 0.00 0.00 37.83 32.50 2k78 s LYS 93 CO -0.18 -0.88 1.17 1.21 -0.36 0.00 0.00 175.35 176.32 2k78 s ASN 94 N 1.85 7.19 0.41 1.43 2.47 -0.49 -4.81 114.94 122.99 2k78 s ASN 94 Ca 0.15 -3.32 0.20 0.00 0.42 0.00 0.00 52.86 50.31 2k78 s ASN 94 Cb -0.16 -2.27 0.86 0.00 -1.45 0.00 0.00 41.25 38.23 2k78 s ASN 94 CO 0.15 -0.46 1.83 0.71 -3.72 0.00 0.00 177.10 175.61 2k78 h THR 95 N 4.09 0.88 0.21 -5.21 1.35 -1.95 0.50 112.91 112.78 2k78 h THR 95 Ca 0.21 -1.24 -0.01 0.00 -0.55 0.00 0.00 66.41 64.82 2k78 h THR 95 Cb 0.89 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 69.06 2k78 h THR 95 CO 1.06 0.31 -0.10 0.00 -0.25 0.00 0.00 175.52 176.54 2k78 h ALA 96 N 1.69 -0.28 -0.46 6.62 0.00 -1.93 -2.84 119.26 122.06 2k78 h ALA 96 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2k78 h ALA 96 Cb 0.72 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2k78 h ALA 96 CO 0.04 -0.59 0.00 1.63 0.00 0.00 0.00 179.25 180.33 2k78 n LYS 97 N -5.15 4.10 -3.57 0.00 4.01 -1.20 -4.94 118.16 111.42 2k78 n LYS 97 Ca -0.09 -2.51 -0.24 0.00 -0.51 0.00 0.00 58.31 54.96 2k78 n LYS 97 Cb 0.18 -2.11 0.03 0.00 -0.51 0.00 0.00 35.03 32.62 2k78 n LYS 97 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 2k78 n ASP 98 N 0.50 -5.77 -2.68 4.39 9.92 -0.65 -4.84 116.55 117.42 2k78 n ASP 98 Ca 0.22 -0.82 -0.13 0.00 -0.53 0.00 0.00 54.79 53.53 2k78 n ASP 98 Cb 1.00 -3.49 -0.03 0.00 -0.64 0.00 0.00 41.12 37.97 2k78 n ASP 98 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2k78 n GLU 99 N -3.41 0.56 -3.61 -1.24 1.02 0.17 -2.05 120.64 112.07 2k78 n GLU 99 Ca -0.12 -2.38 -0.01 0.00 -0.02 0.00 0.00 57.16 54.64 2k78 n GLU 99 Cb 0.59 2.24 -0.01 0.00 -0.02 0.00 0.00 31.44 34.24 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 -2.72 0.28 0.04 3.49 3.52 -0.92 -1.40 118.95 121.25 2k78 s ARG 100 Ca 0.25 -0.13 -0.04 0.00 -0.13 0.00 0.00 55.73 55.68 2k78 s ARG 100 Cb -0.01 0.11 -0.02 0.00 -1.56 0.00 0.00 34.95 33.48 2k78 s ARG 100 CO 0.18 -0.13 0.06 0.99 -0.81 0.00 0.00 175.30 175.59 2k78 s THR 101 N -2.34 0.14 -0.04 4.11 2.01 -0.75 0.17 115.64 118.94 2k78 s THR 101 Ca 0.12 -1.17 -0.08 0.00 0.31 0.00 0.00 61.69 60.87 2k78 s THR 101 Cb 0.02 -0.89 0.01 0.00 0.01 0.00 0.00 72.50 71.66 2k78 s THR 101 CO -0.04 -0.65 0.19 -0.94 -0.69 0.00 0.00 174.62 172.49 2k78 s SER 102 N -2.14 -0.12 0.02 3.53 1.04 -0.92 -2.53 113.70 112.58 2k78 s SER 102 Ca -0.05 0.16 -0.15 0.00 0.48 0.00 0.00 55.95 56.39 2k78 s SER 102 Cb -0.01 0.33 -0.06 0.00 0.10 0.00 0.00 66.02 66.38 2k78 s SER 102 CO -0.05 -0.20 0.43 -0.70 0.98 0.00 0.00 173.24 173.70 2k78 s GLU 103 N -0.53 3.95 0.09 4.02 -6.30 -1.18 -1.62 118.70 117.13 2k78 s GLU 103 Ca -0.06 0.45 0.07 0.00 -2.50 0.00 0.00 54.97 52.93 2k78 s GLU 103 Cb -0.04 -3.21 -0.03 0.00 0.00 0.00 0.00 34.13 30.85 2k78 s GLU 103 CO 0.01 0.67 -0.19 -0.06 0.02 0.00 0.00 175.26 175.71 2k78 s PHE 104 N -1.11 1.63 -0.13 5.30 0.08 -0.54 -3.73 117.98 119.48 2k78 s PHE 104 Ca 0.25 -0.42 0.03 0.00 0.12 0.00 0.00 56.93 56.91 2k78 s PHE 104 Cb -0.17 -0.91 0.01 0.00 -0.57 0.00 0.00 43.02 41.38 2k78 s PHE 104 CO 0.15 0.16 -0.22 -2.00 -0.10 0.00 0.00 175.22 173.20 2k78 s GLU 105 N -1.81 3.04 0.00 0.44 2.12 -1.26 -2.32 118.70 118.92 2k78 s GLU 105 Ca 0.04 -0.85 0.00 0.00 0.36 0.00 0.00 54.97 54.52 2k78 s GLU 105 Cb -0.10 -2.41 0.00 0.00 0.26 0.00 0.00 34.13 31.88 2k78 s GLU 105 CO 0.04 0.04 0.00 1.33 -0.54 0.00 0.00 175.26 176.12 2k78 n VAL 106 N 3.92 0.00 -3.42 3.70 0.24 -1.25 -4.84 118.33 116.68 2k78 n VAL 106 Ca -0.20 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.68 2k78 n VAL 106 Cb 0.52 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.79 2k78 n VAL 106 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2k78 s SER 107 N 0.33 6.14 0.31 -1.34 0.15 -1.26 -4.71 113.70 113.33 2k78 s SER 107 Ca 0.00 -0.62 0.00 0.00 0.70 0.00 0.00 55.95 56.03 2k78 s SER 107 Cb 0.00 -2.18 0.00 0.00 -1.71 0.00 0.00 66.02 62.13 2k78 s SER 107 CO 0.00 -0.43 0.00 0.29 1.20 0.00 0.00 173.24 174.30 2k78 n LYS 108 N 5.33 0.00 -2.92 5.44 4.76 -1.26 -4.68 118.16 124.83 2k78 n LYS 108 Ca -0.10 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.22 2k78 n LYS 108 Cb 0.48 0.00 0.04 0.00 -1.84 0.00 0.00 35.03 33.71 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 -1.08 -3.20 -0.35 -0.00 -1.26 -4.98 117.00 106.14 2k78 n LEU 109 Ca 0.00 -4.23 -0.20 0.00 -0.00 0.00 0.00 56.01 51.58 2k78 n LEU 109 Cb 0.00 0.85 -0.07 0.00 -0.00 0.00 0.00 43.42 44.20 2k78 n LEU 109 CO 0.00 2.16 -0.18 0.21 -0.00 0.00 0.00 177.39 179.58 2k78 s ASN 110 N -1.73 0.54 0.00 1.45 3.04 -1.26 -1.16 114.94 115.82 2k78 s ASN 110 Ca 0.29 -2.60 0.00 0.00 0.04 0.00 0.00 52.86 50.59 2k78 s ASN 110 Cb 0.31 0.31 0.00 0.00 -1.54 0.00 0.00 41.25 40.33 2k78 s ASN 110 CO -0.06 -0.14 0.00 0.61 -3.04 0.00 0.00 177.10 174.47 2k78 n GLY 111 N 2.94 -0.59 3.49 1.21 0.00 -0.51 -4.92 105.19 106.81 2k78 n GLY 111 Ca 0.25 0.28 -0.15 0.00 0.00 0.00 0.00 46.02 46.41 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 0.86 0.02 1.61 2.20 -1.26 -2.66 119.74 120.51 2k78 s LYS 112 Ca 0.00 0.49 0.01 0.00 -0.36 0.00 0.00 55.97 56.12 2k78 s LYS 112 Cb 0.00 0.41 -0.01 0.00 -1.51 0.00 0.00 37.83 36.71 2k78 s LYS 112 CO 0.00 -0.20 -0.05 0.42 -0.36 0.00 0.00 175.35 175.16 2k78 s ILE 113 N -0.49 0.34 -0.47 5.43 1.01 0.30 -4.98 121.20 122.35 2k78 s ILE 113 Ca -0.06 -0.67 -0.29 0.00 0.00 0.00 0.00 60.65 59.63 2k78 s ILE 113 Cb -0.03 -0.38 0.02 0.00 0.01 0.00 0.00 42.46 42.08 2k78 s ILE 113 CO 0.05 -0.22 1.33 -1.81 0.00 0.00 0.00 174.94 174.28 2k78 s ASP 114 N -0.96 6.38 0.53 3.58 1.01 -1.26 -1.00 116.67 124.95 2k78 s ASP 114 Ca -0.07 0.59 0.05 0.00 0.71 0.00 0.00 52.55 53.83 2k78 s ASP 114 Cb -0.07 -2.54 0.03 0.00 1.01 0.00 0.00 42.92 41.35 2k78 s ASP 114 CO -0.00 -1.44 0.34 -0.83 0.21 0.00 0.00 175.17 173.44 2k78 s GLY 115 N 3.59 2.46 0.10 0.21 0.00 -0.93 -3.31 107.32 109.44 2k78 s GLY 115 Ca 0.55 -1.18 -0.07 0.00 0.00 0.00 0.00 44.72 44.02 2k78 s GLY 115 CO 0.31 -1.97 0.16 0.54 0.00 0.00 0.00 173.10 172.14 2k78 s LYS 116 N -4.20 0.86 -0.10 2.90 1.02 -1.02 -2.76 119.74 116.44 2k78 s LYS 116 Ca 0.30 -1.07 -0.26 0.00 0.02 0.00 0.00 55.97 54.96 2k78 s LYS 116 Cb -0.01 0.32 0.06 0.00 -0.52 0.00 0.00 37.83 37.68 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 -3.90 0.01 0.24 2.17 -1.16 0.01 0.16 121.20 118.73 2k78 s ILE 117 Ca 0.09 -0.07 0.07 0.00 -0.51 0.00 0.00 60.65 60.22 2k78 s ILE 117 Cb 0.05 -0.91 -0.04 0.00 0.61 0.00 0.00 42.46 42.18 2k78 s ILE 117 CO -0.08 -0.04 0.17 -1.81 -2.81 0.00 0.00 174.94 170.37 2k78 s ASP 118 N -0.78 5.44 0.01 4.50 1.01 -1.10 -2.25 116.67 123.51 2k78 s ASP 118 Ca -0.08 -0.27 -0.01 0.00 0.71 0.00 0.00 52.55 52.90 2k78 s ASP 118 Cb -0.02 -1.36 -0.01 0.00 1.01 0.00 0.00 42.92 42.53 2k78 s ASP 118 CO 0.07 -0.02 0.01 -0.69 0.21 0.00 0.00 175.17 174.75 2k78 s VAL 119 N -2.10 0.08 -0.24 -1.27 1.01 -1.18 -1.84 120.40 114.86 2k78 s VAL 119 Ca 0.32 -0.63 -0.04 0.00 0.00 0.00 0.00 61.98 61.63 2k78 s VAL 119 Cb -0.08 -0.23 0.13 0.00 0.00 0.00 0.00 36.38 36.20 2k78 s VAL 119 CO 0.24 -0.35 0.44 -0.47 0.00 0.00 0.00 175.10 174.96 2k78 s TYR 120 N -1.05 -0.96 0.05 5.22 6.14 -1.18 -2.67 117.35 122.90 2k78 s TYR 120 Ca -0.12 1.28 0.01 0.00 0.64 0.00 0.00 57.07 58.88 2k78 s TYR 120 Cb -0.07 0.24 -0.03 0.00 0.42 0.00 0.00 41.96 42.52 2k78 s TYR 120 CO -0.00 -0.66 -0.06 0.42 0.64 0.00 0.00 175.55 175.89 2k78 s ILE 121 N 2.63 0.39 -0.34 3.14 1.01 0.27 -4.48 121.20 123.82 2k78 s ILE 121 Ca 0.08 -1.26 0.07 0.00 0.00 0.00 0.00 60.65 59.53 2k78 s ILE 121 Cb -0.14 -0.80 0.19 0.00 0.01 0.00 0.00 42.46 41.72 2k78 s ILE 121 CO -0.16 -0.58 0.61 1.51 0.00 0.00 0.00 174.94 176.32 2k78 s ASP 122 N -1.96 -1.59 0.02 3.58 1.47 -1.26 -1.36 116.67 115.57 2k78 s ASP 122 Ca -0.06 -0.25 -0.10 0.00 1.18 0.00 0.00 52.55 53.32 2k78 s ASP 122 Cb -0.05 2.00 0.03 0.00 -0.34 0.00 0.00 42.92 44.57 2k78 s ASP 122 CO -0.02 -0.24 0.47 -1.84 0.68 0.00 0.00 175.17 174.22 2k78 n GLU 123 N 4.96 0.14 -3.76 2.11 0.28 -1.16 -5.01 120.64 118.20 2k78 n GLU 123 Ca 0.08 -0.41 -0.37 0.00 -0.16 0.00 0.00 57.16 56.30 2k78 n GLU 123 Cb 0.55 0.62 -0.12 0.00 1.43 0.00 0.00 31.44 33.92 2k78 n GLU 123 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2k78 s LYS 124 N -2.01 3.76 -0.83 3.44 1.02 -1.26 0.17 119.74 124.02 2k78 s LYS 124 Ca 0.11 -0.42 -0.25 0.00 0.02 0.00 0.00 55.97 55.42 2k78 s LYS 124 Cb -0.01 -3.38 0.01 0.00 -0.52 0.00 0.00 37.83 33.93 2k78 s LYS 124 CO 0.01 -0.12 1.56 0.08 -0.92 0.00 0.00 175.35 175.95 2k78 s VAL 125 N 1.48 3.67 -1.49 3.17 1.01 0.42 -3.87 120.40 124.78 2k78 s VAL 125 Ca 0.06 -0.14 -0.12 0.00 0.00 0.00 0.00 61.98 61.78 2k78 s VAL 125 Cb -0.15 -4.62 0.07 0.00 0.00 0.00 0.00 36.38 31.68 2k78 s VAL 125 CO 0.05 -1.55 0.91 0.59 0.00 0.00 0.00 175.10 175.11 2k78 n ASN 126 N 10.67 -4.99 -0.01 3.32 5.03 -1.26 -2.31 115.26 125.70 2k78 n ASN 126 Ca 0.22 -0.66 0.00 0.00 0.87 0.00 0.00 54.58 55.01 2k78 n ASN 126 Cb 0.50 -3.99 0.00 0.00 -1.02 0.00 0.00 39.78 35.26 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 -1.65 1.61 2.70 7.41 0.00 -1.25 -5.07 105.19 108.94 2k78 n GLY 127 Ca 0.02 -0.15 -0.20 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.44 0.29 0.16 1.61 1.02 -0.98 -5.08 119.74 115.32 2k78 s LYS 128 Ca 0.00 -0.22 -0.34 0.00 0.02 0.00 0.00 55.97 55.43 2k78 s LYS 128 Cb 0.00 -0.80 -0.15 0.00 -0.52 0.00 0.00 37.83 36.36 2k78 s LYS 128 CO 0.00 -1.01 1.30 -2.30 -0.92 0.00 0.00 175.35 172.42 2k78 n PRO 129 N 5.30 1.44 -3.79 -1.68 -0.02 -1.26 0.16 135.00 135.15 2k78 n PRO 129 Ca -0.03 0.52 -0.17 0.00 -2.02 0.00 0.00 63.50 61.80 2k78 n PRO 129 Cb 0.45 -2.11 -0.16 0.00 -0.02 0.00 0.00 33.50 31.66 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 0.14 0.12 -0.12 6.00 5.36 0.13 -4.79 117.98 124.81 2k78 s PHE 130 Ca 0.76 0.12 -0.04 0.00 -0.96 0.00 0.00 56.93 56.80 2k78 s PHE 130 Cb -0.82 -0.34 -0.04 0.00 -0.34 0.00 0.00 43.02 41.49 2k78 s PHE 130 CO 0.49 -0.12 0.04 0.21 -1.46 0.00 0.00 175.22 174.37 2k78 s LYS 131 N 1.30 3.33 -0.20 10.12 2.47 -1.26 -2.99 119.74 132.51 2k78 s LYS 131 Ca -0.06 -0.35 -0.09 0.00 -1.56 0.00 0.00 55.97 53.91 2k78 s LYS 131 Cb -0.13 -2.96 0.08 0.00 -1.46 0.00 0.00 37.83 33.36 2k78 s LYS 131 CO -0.03 0.59 0.46 -0.47 0.16 0.00 0.00 175.35 176.05 2k78 s TYR 132 N -0.54 -0.80 -0.32 4.03 5.04 -0.47 -4.95 117.35 119.34 2k78 s TYR 132 Ca 0.10 1.57 -0.10 0.00 -2.44 0.00 0.00 57.07 56.20 2k78 s TYR 132 Cb -0.12 0.36 0.20 0.00 0.35 0.00 0.00 41.96 42.75 2k78 s TYR 132 CO 0.02 -0.46 1.10 0.16 -1.34 0.00 0.00 175.55 175.03 2k78 s ASP 133 N 2.18 -0.22 0.00 4.32 1.47 -1.26 0.96 116.67 124.12 2k78 s ASP 133 Ca -0.05 -0.17 0.00 0.00 1.18 0.00 0.00 52.55 53.51 2k78 s ASP 133 Cb -0.10 0.28 0.00 0.00 -0.34 0.00 0.00 42.92 42.76 2k78 s ASP 133 CO -0.14 -0.02 0.00 1.41 0.68 0.00 0.00 175.17 177.10 2k78 n HIS 134 N 3.22 -0.35 -5.25 2.11 8.25 -1.09 -5.01 115.22 117.09 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 31.60 2k78 n HIS 134 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2k78 s HIS 135 N -4.58 2.37 0.35 4.41 5.65 -1.26 -3.12 115.29 119.12 2k78 s HIS 135 Ca 0.00 -0.41 -0.08 0.00 0.25 0.00 0.00 55.06 54.82 2k78 s HIS 135 Cb 0.00 -1.51 0.03 0.00 -1.18 0.00 0.00 32.58 29.92 2k78 s HIS 135 CO 0.00 -0.01 0.61 0.66 -0.65 0.00 0.00 174.74 175.35 2k78 n TYR 136 N 2.41 -1.86 -4.02 3.88 4.01 -0.95 -5.01 117.16 115.61 2k78 n TYR 136 Ca -0.16 -1.97 -0.12 0.00 -0.16 0.00 0.00 57.90 55.48 2k78 n TYR 136 Cb 0.51 0.70 -0.03 0.00 -0.31 0.00 0.00 39.34 40.21 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 -2.99 0.52 0.29 7.72 2.20 -1.26 -0.81 114.94 120.60 2k78 s ASN 137 Ca 0.21 -1.30 -0.16 0.00 -0.94 0.00 0.00 52.86 50.67 2k78 s ASN 137 Cb -0.03 0.68 0.02 0.00 -2.00 0.00 0.00 41.25 39.92 2k78 s ASN 137 CO 0.15 -1.34 0.63 0.27 -2.94 0.00 0.00 177.10 173.88 2k78 s ILE 138 N -3.13 0.00 -0.29 0.54 -4.36 -1.11 -4.51 121.20 108.33 2k78 s ILE 138 Ca 0.26 -1.18 -0.19 0.00 -0.26 0.00 0.00 60.65 59.28 2k78 s ILE 138 Cb -0.01 -2.23 -0.02 0.00 1.25 0.00 0.00 42.46 41.45 2k78 s ILE 138 CO 0.16 0.00 0.56 -0.89 0.24 0.00 0.00 174.94 175.01 2k78 s THR 139 N -3.68 5.01 -0.48 8.37 2.01 -0.77 -2.20 115.64 123.90 2k78 s THR 139 Ca 0.17 0.78 -0.22 0.00 0.31 0.00 0.00 61.69 62.72 2k78 s THR 139 Cb -0.04 -3.92 0.04 0.00 0.01 0.00 0.00 72.50 68.59 2k78 s THR 139 CO 0.09 -0.06 0.77 -0.31 -0.69 0.00 0.00 174.62 174.42 2k78 s TYR 140 N 2.45 2.97 0.32 4.92 1.51 -0.17 -1.61 117.35 127.73 2k78 s TYR 140 Ca 0.22 -0.06 0.03 0.00 -1.01 0.00 0.00 57.07 56.26 2k78 s TYR 140 Cb -0.15 -3.68 -0.02 0.00 -0.11 0.00 0.00 41.96 38.00 2k78 s TYR 140 CO 0.11 -1.06 0.48 0.15 -1.11 0.00 0.00 175.55 174.11 2k78 s LYS 141 N 3.24 3.34 0.02 -0.62 1.02 0.16 -0.54 119.74 126.36 2k78 s LYS 141 Ca 0.26 -0.65 -0.12 0.00 0.02 0.00 0.00 55.97 55.48 2k78 s LYS 141 Cb -0.14 -2.77 0.01 0.00 -0.52 0.00 0.00 37.83 34.42 2k78 s LYS 141 CO 0.19 0.18 0.25 -0.06 -0.92 0.00 0.00 175.35 174.99 2k78 s PHE 142 N -2.19 -0.05 -0.27 3.18 0.08 -1.09 -2.52 117.98 115.11 2k78 s PHE 142 Ca 0.40 -0.05 -0.04 0.00 0.12 0.00 0.00 56.93 57.36 2k78 s PHE 142 Cb -0.09 0.04 0.09 0.00 -0.57 0.00 0.00 43.02 42.48 2k78 s PHE 142 CO 0.33 -0.42 0.12 -0.80 -0.10 0.00 0.00 175.22 174.34 2k78 s ASN 143 N -1.81 3.41 0.00 1.36 0.01 0.45 -1.42 114.94 116.94 2k78 s ASN 143 Ca -0.08 -1.22 0.00 0.00 -0.71 0.00 0.00 52.86 50.85 2k78 s ASN 143 Cb -0.03 -0.41 0.00 0.00 0.41 0.00 0.00 41.25 41.22 2k78 s ASN 143 CO -0.01 -0.42 0.00 0.61 -1.51 0.00 0.00 177.10 175.77 2k78 n GLY 144 N 5.19 3.27 1.92 0.66 0.00 -0.31 -2.52 105.19 113.41 2k78 n GLY 144 Ca -0.06 -0.61 -0.17 0.00 0.00 0.00 0.00 46.02 45.17 2k78 n GLY 144 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k78 n PRO 145 N 0.00 -3.04 0.17 1.61 -0.04 -1.26 -4.64 135.00 127.79 2k78 n PRO 145 Ca 0.00 -0.92 0.00 0.00 -0.04 0.00 0.00 63.50 62.54 2k78 n PRO 145 Cb 0.00 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 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 -4.30 0.00 0.00 0.52 -2.24 -1.26 -4.17 114.28 102.83 2k78 n THR 146 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 2k78 n THR 146 Cb 0.34 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 2k78 n THR 146 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2k78 n ASP 147 N -3.35 0.00 -3.73 3.42 9.92 -1.26 -4.95 116.55 116.60 2k78 n ASP 147 Ca 0.00 0.04 -0.25 0.00 -0.53 0.00 0.00 54.79 54.04 2k78 n ASP 147 Cb 0.00 -0.42 0.05 0.00 -0.64 0.00 0.00 41.12 40.11 2k78 n ASP 147 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2k78 n VAL 148 N -2.29 -3.17 -2.63 2.53 0.31 -1.26 -4.86 118.33 106.95 2k78 n VAL 148 Ca 0.00 -0.14 -0.42 0.00 -0.01 0.00 0.00 64.34 63.77 2k78 n VAL 148 Cb 0.00 -3.59 -0.02 0.00 -0.91 0.00 0.00 33.84 29.32 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 -3.38 3.03 0.00 3.52 0.00 -1.26 -5.16 121.76 118.51 2k78 s ALA 149 Ca 0.46 -2.56 0.00 0.00 0.00 0.00 0.00 51.96 49.85 2k78 s ALA 149 Cb -0.22 -4.48 0.00 0.00 0.00 0.00 0.00 23.12 18.42 2k78 s ALA 149 CO 0.79 -3.41 0.00 0.41 0.00 0.00 0.00 175.76 173.55