#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 2.63 -1.87 -0.43 0.00 -1.26 -4.94 120.51 114.64 2k78 n ALA 26 Ca 0.00 -2.72 -0.20 0.00 0.00 0.00 0.00 53.44 50.51 2k78 n ALA 26 Cb 0.00 -0.84 -0.06 0.00 0.00 0.00 0.00 19.45 18.55 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 -0.44 -5.58 -4.71 0.00 3.02 -1.26 -4.89 115.26 101.40 2k78 n ASN 27 Ca 0.08 0.32 -0.42 0.00 -0.03 0.00 0.00 54.58 54.53 2k78 n ASN 27 Cb 0.86 -4.78 -0.03 0.00 -0.61 0.00 0.00 39.78 35.22 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 -2.85 3.84 0.00 5.41 0.00 -1.26 -4.74 121.76 122.15 2k78 s ALA 28 Ca 0.00 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.45 2k78 s ALA 28 Cb 0.00 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.40 2k78 s ALA 28 CO 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 175.76 174.72 2k78 n ALA 29 N 4.76 0.00 -2.19 0.00 0.00 -1.26 -4.73 120.51 117.09 2k78 n ALA 29 Ca 0.16 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.44 2k78 n ALA 29 Cb 0.37 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.80 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 -3.83 -4.71 -3.62 0.00 8.00 -1.26 -4.84 116.55 106.28 2k78 n ASP 30 Ca 0.00 0.17 -0.14 0.00 0.71 0.00 0.00 54.79 55.53 2k78 n ASP 30 Cb 0.00 -4.03 -0.07 0.00 -0.02 0.00 0.00 41.12 37.00 2k78 n ASP 30 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2k78 s SER 31 N -2.12 -0.71 0.00 -2.24 1.04 -1.26 0.88 113.70 109.29 2k78 s SER 31 Ca 0.00 1.30 0.00 0.00 0.48 0.00 0.00 55.95 57.73 2k78 s SER 31 Cb 0.00 1.30 0.00 0.00 0.10 0.00 0.00 66.02 67.42 2k78 s SER 31 CO 0.00 -0.29 0.00 0.61 0.98 0.00 0.00 173.24 174.54 2k78 n GLY 32 N 2.42 -1.78 3.52 7.32 0.00 -0.63 -4.99 105.19 111.04 2k78 n GLY 32 Ca -0.14 -1.12 -0.43 0.00 0.00 0.00 0.00 46.02 44.33 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 -2.20 4.51 0.27 2.61 -4.23 -1.26 -0.44 115.64 114.90 2k78 s THR 33 Ca 0.00 0.27 -0.01 0.00 -1.18 0.00 0.00 61.69 60.77 2k78 s THR 33 Cb 0.00 -4.45 -0.04 0.00 1.34 0.00 0.00 72.50 69.35 2k78 s THR 33 CO 0.00 -0.96 0.49 -0.22 -0.54 0.00 0.00 174.62 173.39 2k78 s LEU 34 N 3.63 4.11 0.21 4.79 2.96 0.22 -4.87 118.68 129.72 2k78 s LEU 34 Ca 0.29 0.49 -0.30 0.00 -0.22 0.00 0.00 54.13 54.39 2k78 s LEU 34 Cb -0.13 -3.31 -0.08 0.00 0.50 0.00 0.00 46.19 43.17 2k78 s LEU 34 CO 0.20 -0.17 0.95 0.20 -1.32 0.00 0.00 176.35 176.21 2k78 s ASN 35 N -3.47 7.61 -0.10 3.68 0.01 -1.00 -2.23 114.94 119.44 2k78 s ASN 35 Ca 0.40 1.92 -0.30 0.00 -0.71 0.00 0.00 52.86 54.17 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 0.10 0.85 -0.72 -1.51 0.00 0.00 177.10 176.14 2k78 s TYR 36 N -0.88 -0.49 0.07 2.20 1.13 -1.26 0.10 117.35 118.22 2k78 s TYR 36 Ca 0.43 0.81 -0.20 0.00 -1.41 0.00 0.00 57.07 56.70 2k78 s TYR 36 Cb -0.25 0.44 0.04 0.00 -1.10 0.00 0.00 41.96 41.09 2k78 s TYR 36 CO 0.32 -0.47 0.46 -2.00 -2.51 0.00 0.00 175.55 171.35 2k78 s GLU 37 N -1.31 1.03 0.50 -3.49 2.12 0.31 -4.78 118.70 113.08 2k78 s GLU 37 Ca -0.05 -0.41 0.09 0.00 0.36 0.00 0.00 54.97 54.96 2k78 s GLU 37 Cb -0.00 0.46 0.05 0.00 0.26 0.00 0.00 34.13 34.90 2k78 s GLU 37 CO 0.04 -0.38 0.66 0.14 -0.54 0.00 0.00 175.26 175.18 2k78 s VAL 38 N -2.90 2.47 0.06 3.70 -7.23 -1.26 0.16 120.40 115.40 2k78 s VAL 38 Ca -0.03 -1.05 -0.11 0.00 -1.81 0.00 0.00 61.98 58.98 2k78 s VAL 38 Cb -0.00 -2.53 0.01 0.00 0.56 0.00 0.00 36.38 34.42 2k78 s VAL 38 CO -0.05 0.00 0.24 -0.31 -0.31 0.00 0.00 175.10 174.66 2k78 s TYR 39 N -2.54 0.01 0.20 2.82 2.02 0.04 -4.08 117.35 115.82 2k78 s TYR 39 Ca 0.57 -0.26 -0.30 0.00 -0.37 0.00 0.00 57.07 56.71 2k78 s TYR 39 Cb -0.07 0.02 -0.09 0.00 -0.40 0.00 0.00 41.96 41.42 2k78 s TYR 39 CO 0.35 -0.49 1.39 0.21 -1.57 0.00 0.00 175.55 175.44 2k78 s LYS 40 N -2.90 4.32 0.54 -0.62 2.47 -1.16 -2.36 119.74 120.04 2k78 s LYS 40 Ca -0.03 2.17 -0.21 0.00 -1.56 0.00 0.00 55.97 56.34 2k78 s LYS 40 Cb 0.00 -3.17 -0.05 0.00 -1.46 0.00 0.00 37.83 33.15 2k78 s LYS 40 CO -0.06 -0.37 1.28 -0.47 0.16 0.00 0.00 175.35 175.90 2k78 s TYR 41 N 0.31 2.44 0.00 4.03 5.04 -1.26 -1.93 117.35 125.98 2k78 s TYR 41 Ca 0.60 1.44 0.00 0.00 -2.44 0.00 0.00 57.07 56.67 2k78 s TYR 41 Cb -0.39 -3.64 0.00 0.00 0.35 0.00 0.00 41.96 38.28 2k78 s TYR 41 CO 0.38 -2.43 0.00 -1.71 -1.34 0.00 0.00 175.55 170.45 2k78 n ASN 42 N -1.02 -2.21 -0.82 4.32 5.15 -1.26 -4.93 115.26 114.49 2k78 n ASN 42 Ca 0.10 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.08 2k78 n ASN 42 Cb 0.47 -1.62 0.00 0.00 -0.53 0.00 0.00 39.78 38.10 2k78 n ASN 42 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 2k78 n THR 43 N -2.24 0.00 -0.98 -0.44 -2.24 -0.81 -5.07 114.28 102.49 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 0.12 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.38 2k78 n THR 43 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2k78 n ASN 44 N -1.99 1.02 -3.76 3.42 5.03 -1.26 -4.73 115.26 112.98 2k78 n ASN 44 Ca 0.00 -1.92 -0.25 0.00 0.87 0.00 0.00 54.58 53.28 2k78 n ASN 44 Cb 0.00 -0.13 -0.17 0.00 -1.02 0.00 0.00 39.78 38.45 2k78 n ASN 44 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2k78 s ASP 45 N -1.09 2.02 0.23 6.41 2.15 -1.26 -4.90 116.67 120.24 2k78 s ASP 45 Ca 0.07 -0.32 -0.31 0.00 0.43 0.00 0.00 52.55 52.41 2k78 s ASP 45 Cb 0.06 -0.50 -0.13 0.00 -0.30 0.00 0.00 42.92 42.04 2k78 s ASP 45 CO 0.01 -0.23 1.41 1.07 -0.17 0.00 0.00 175.17 177.26 2k78 n THR 46 N 5.11 0.88 0.00 1.71 5.66 -1.26 -2.96 114.28 123.42 2k78 n THR 46 Ca -0.08 -0.22 0.00 0.00 -3.05 0.00 0.00 64.05 60.70 2k78 n THR 46 Cb 0.49 -1.47 0.00 0.00 -1.55 0.00 0.00 70.33 67.81 2k78 n THR 46 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2k78 n SER 47 N 2.23 1.97 0.08 1.09 2.88 -1.26 -4.74 113.62 115.87 2k78 n SER 47 Ca 0.12 -0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.60 2k78 n SER 47 Cb 0.31 0.51 0.00 0.00 -0.75 0.00 0.00 64.21 64.28 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 -0.71 0.08 -0.29 2.46 5.41 -1.26 -4.84 119.36 120.20 2k78 n ILE 48 Ca 0.00 0.03 0.34 0.00 1.00 0.00 0.00 62.75 64.12 2k78 n ILE 48 Cb 0.00 -0.40 0.69 0.00 -0.71 0.00 0.00 39.64 39.21 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 3.05 0.00 -1.39 0.00 -1.94 0.96 119.26 119.94 2k78 h ALA 49 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2k78 h ALA 49 Cb 0.00 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2k78 h ALA 49 CO 0.00 -1.59 0.00 -1.71 0.00 0.00 0.00 179.25 175.95 2k78 n ASN 50 N -3.79 0.54 -0.95 0.00 4.05 -1.26 -2.63 115.26 111.22 2k78 n ASN 50 Ca 0.25 0.62 0.05 0.00 0.45 0.00 0.00 54.58 55.95 2k78 n ASN 50 Cb 1.36 -0.74 0.19 0.00 1.23 0.00 0.00 39.78 41.82 2k78 n ASN 50 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 2k78 n ASP 51 N -2.08 2.70 -0.08 1.20 9.92 0.33 -3.91 116.55 124.64 2k78 n ASP 51 Ca 0.03 -2.23 0.00 0.00 -0.53 0.00 0.00 54.79 52.06 2k78 n ASP 51 Cb 0.25 -0.42 0.00 0.00 -0.64 0.00 0.00 41.12 40.31 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 0.46 0.00 -3.86 1.24 4.01 -1.08 -5.05 117.16 112.88 2k78 n TYR 52 Ca 0.13 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.59 2k78 n TYR 52 Cb 0.52 0.02 -0.16 0.00 -0.31 0.00 0.00 39.34 39.41 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 1.66 0.85 -0.72 0.08 -1.24 -2.87 117.98 115.74 2k78 s PHE 53 Ca 0.00 -1.13 -0.11 0.00 0.12 0.00 0.00 56.93 55.80 2k78 s PHE 53 Cb 0.00 -1.29 0.10 0.00 -0.57 0.00 0.00 43.02 41.26 2k78 s PHE 53 CO 0.00 -0.63 1.09 1.21 -0.10 0.00 0.00 175.22 176.79 2k78 s ASN 54 N 1.65 3.95 0.15 1.36 2.47 -1.26 -4.97 114.94 118.28 2k78 s ASN 54 Ca -0.01 1.40 -0.08 0.00 0.42 0.00 0.00 52.86 54.59 2k78 s ASN 54 Cb -0.16 -2.11 -0.01 0.00 -1.45 0.00 0.00 41.25 37.52 2k78 s ASN 54 CO -0.07 -2.33 0.24 -1.59 -3.72 0.00 0.00 177.10 169.63 2k78 s LYS 55 N -5.04 1.07 0.57 0.43 -2.85 -1.26 -4.61 119.74 108.06 2k78 s LYS 55 Ca 0.62 -1.16 -0.10 0.00 -1.00 0.00 0.00 55.97 54.34 2k78 s LYS 55 Cb -0.16 0.36 0.13 0.00 -2.06 0.00 0.00 37.83 36.10 2k78 s LYS 55 CO 0.56 -0.38 0.76 -0.35 0.10 0.00 0.00 175.35 176.04 2k78 n PRO 56 N -0.17 -0.82 -3.28 1.78 -0.04 -1.26 -5.16 135.00 126.05 2k78 n PRO 56 Ca -0.09 -1.18 -0.18 0.00 -0.04 0.00 0.00 63.50 62.01 2k78 n PRO 56 Cb 0.63 -0.80 -0.00 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 -3.94 4.34 -0.37 0.55 0.00 -0.94 -4.90 121.76 116.51 2k78 s ALA 57 Ca 0.43 -1.61 -0.11 0.00 0.00 0.00 0.00 51.96 50.67 2k78 s ALA 57 Cb -0.01 -1.56 0.02 0.00 0.00 0.00 0.00 23.12 21.56 2k78 s ALA 57 CO 0.31 -0.17 0.21 0.21 0.00 0.00 0.00 175.76 176.32 2k78 s LYS 58 N -4.24 2.97 0.36 0.00 2.20 -1.17 0.71 119.74 120.57 2k78 s LYS 58 Ca 0.50 -0.99 0.03 0.00 -0.36 0.00 0.00 55.97 55.15 2k78 s LYS 58 Cb -0.09 -3.74 -0.02 0.00 -1.51 0.00 0.00 37.83 32.47 2k78 s LYS 58 CO 0.31 -0.65 0.54 1.52 -0.36 0.00 0.00 175.35 176.72 2k78 s TYR 59 N 1.59 3.30 0.06 4.03 1.13 0.41 0.07 117.35 127.95 2k78 s TYR 59 Ca 0.03 0.10 -0.19 0.00 -1.41 0.00 0.00 57.07 55.60 2k78 s TYR 59 Cb -0.19 -2.01 0.04 0.00 -1.10 0.00 0.00 41.96 38.70 2k78 s TYR 59 CO 0.07 -0.02 0.44 -1.50 -2.51 0.00 0.00 175.55 172.03 2k78 s ILE 60 N -2.31 0.05 0.24 -3.49 2.07 0.31 -1.61 121.20 116.47 2k78 s ILE 60 Ca 0.43 -0.41 0.01 0.00 -1.41 0.00 0.00 60.65 59.27 2k78 s ILE 60 Cb -0.10 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.45 2k78 s ILE 60 CO 0.34 -0.23 0.15 -0.54 -1.91 0.00 0.00 174.94 172.75 2k78 s LYS 61 N -2.77 1.35 -0.45 3.50 1.02 0.25 0.34 119.74 123.00 2k78 s LYS 61 Ca -0.03 -1.74 0.06 0.00 0.02 0.00 0.00 55.97 54.28 2k78 s LYS 61 Cb -0.00 0.15 0.31 0.00 -0.52 0.00 0.00 37.83 37.77 2k78 s LYS 61 CO -0.04 -0.42 1.12 1.63 -0.92 0.00 0.00 175.35 176.72 2k78 n LYS 62 N -0.38 0.88 -2.65 1.68 5.02 -0.27 -4.72 118.16 117.72 2k78 n LYS 62 Ca 0.02 -1.76 -0.01 0.00 -2.02 0.00 0.00 58.31 54.55 2k78 n LYS 62 Cb 0.65 -0.99 -0.01 0.00 -0.02 0.00 0.00 35.03 34.67 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 0.58 -6.54 -0.59 4.39 2.85 -1.26 -4.32 115.26 110.37 2k78 n ASN 63 Ca 0.05 1.37 -0.05 0.00 -0.11 0.00 0.00 54.58 55.84 2k78 n ASN 63 Cb 0.70 -5.16 -0.00 0.00 1.24 0.00 0.00 39.78 36.55 2k78 n ASN 63 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2k78 n GLY 64 N 0.84 0.22 3.58 8.20 0.00 -1.26 -5.01 105.19 111.77 2k78 n GLY 64 Ca -0.07 -0.68 -0.05 0.00 0.00 0.00 0.00 46.02 45.22 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 -4.06 0.67 -0.21 1.61 -2.85 -1.26 -5.10 119.74 108.54 2k78 s LYS 65 Ca 0.00 -0.29 -0.29 0.00 -1.00 0.00 0.00 55.97 54.39 2k78 s LYS 65 Cb 0.00 0.28 0.15 0.00 -2.06 0.00 0.00 37.83 36.20 2k78 s LYS 65 CO 0.00 -0.30 1.13 -0.48 0.10 0.00 0.00 175.35 175.81 2k78 s LEU 66 N -2.52 -0.25 0.25 2.77 2.34 -1.26 -1.12 118.68 118.90 2k78 s LEU 66 Ca 0.09 0.28 0.01 0.00 0.06 0.00 0.00 54.13 54.57 2k78 s LEU 66 Cb -0.00 1.57 -0.04 0.00 -0.56 0.00 0.00 46.19 47.16 2k78 s LEU 66 CO -0.05 -0.22 0.15 -0.31 -1.06 0.00 0.00 176.35 174.86 2k78 s TYR 67 N -1.00 1.41 -0.03 3.48 1.51 0.15 -3.50 117.35 119.37 2k78 s TYR 67 Ca 0.02 -1.38 -0.04 0.00 -1.01 0.00 0.00 57.07 54.67 2k78 s TYR 67 Cb -0.01 -0.71 0.01 0.00 -0.11 0.00 0.00 41.96 41.14 2k78 s TYR 67 CO -0.02 -0.59 0.09 0.08 -1.11 0.00 0.00 175.55 174.00 2k78 s VAL 68 N -3.87 0.02 -0.14 0.71 1.01 -0.12 0.11 120.40 118.13 2k78 s VAL 68 Ca 0.38 -0.16 -0.12 0.00 0.00 0.00 0.00 61.98 62.08 2k78 s VAL 68 Cb 0.06 -0.19 -0.05 0.00 0.00 0.00 0.00 36.38 36.20 2k78 s VAL 68 CO 0.16 -0.09 0.24 0.00 0.00 0.00 0.00 175.10 175.41 2k78 s GLN 69 N -0.26 4.03 -0.07 2.72 -2.07 0.11 0.95 119.66 125.07 2k78 s GLN 69 Ca -0.03 0.03 0.01 0.00 -1.82 0.00 0.00 55.36 53.55 2k78 s GLN 69 Cb -0.02 -3.35 -0.03 0.00 -1.09 0.00 0.00 33.01 28.52 2k78 s GLN 69 CO 0.00 0.43 -0.10 0.42 -1.32 0.00 0.00 175.29 174.72 2k78 s ILE 70 N -0.08 3.43 -0.09 3.63 1.09 0.17 -3.01 121.20 126.34 2k78 s ILE 70 Ca 0.15 -0.57 -0.22 0.00 -1.10 0.00 0.00 60.65 58.91 2k78 s ILE 70 Cb -0.13 -2.39 -0.04 0.00 -1.06 0.00 0.00 42.46 38.84 2k78 s ILE 70 CO 0.04 0.58 0.63 -0.89 -0.10 0.00 0.00 174.94 175.20 2k78 s THR 71 N -0.61 5.09 -0.21 2.92 2.01 -1.26 -1.63 115.64 121.95 2k78 s THR 71 Ca 0.09 1.28 -0.08 0.00 0.31 0.00 0.00 61.69 63.29 2k78 s THR 71 Cb -0.11 -3.97 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 2k78 s THR 71 CO 0.02 0.26 0.09 -0.69 -0.69 0.00 0.00 174.62 173.61 2k78 s VAL 72 N 0.84 4.89 -0.17 3.82 1.01 0.41 -4.21 120.40 126.98 2k78 s VAL 72 Ca 0.33 0.01 -0.10 0.00 0.00 0.00 0.00 61.98 62.22 2k78 s VAL 72 Cb -0.17 -3.24 -0.05 0.00 0.00 0.00 0.00 36.38 32.93 2k78 s VAL 72 CO 0.15 0.41 0.16 0.21 0.00 0.00 0.00 175.10 176.03 2k78 s ASN 73 N 0.73 6.30 -0.15 3.32 3.84 -1.14 -2.04 114.94 125.81 2k78 s ASN 73 Ca 0.05 0.35 -0.08 0.00 0.21 0.00 0.00 52.86 53.38 2k78 s ASN 73 Cb -0.13 -2.10 0.03 0.00 -0.55 0.00 0.00 41.25 38.50 2k78 s ASN 73 CO 0.02 0.24 0.17 1.41 -2.79 0.00 0.00 177.10 176.15 2k78 n HIS 74 N 3.02 -3.34 0.26 0.43 8.25 -1.08 -4.52 115.22 118.24 2k78 n HIS 74 Ca -0.17 1.90 0.12 0.00 -0.26 0.00 0.00 57.72 59.31 2k78 n HIS 74 Cb 0.53 -3.20 0.70 0.00 1.12 0.00 0.00 29.99 29.14 2k78 n HIS 74 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2k78 h SER 75 N 4.24 0.00 0.51 0.41 4.64 -1.82 -3.05 113.55 118.48 2k78 h SER 75 Ca -0.38 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.91 2k78 h SER 75 Cb 0.90 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.99 2k78 h SER 75 CO 0.02 0.12 -0.25 0.45 -0.87 0.00 0.00 176.83 176.30 2k78 h HIS 76 N 0.00 -0.64 0.06 4.77 3.86 -1.86 -3.32 115.15 118.02 2k78 h HIS 76 Ca -0.00 -0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.20 2k78 h HIS 76 Cb 0.30 0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.96 2k78 h HIS 76 CO 0.00 -0.31 -0.26 -1.49 0.86 0.00 0.00 177.93 176.73 2k78 h TRP 77 N -0.96 -0.76 -3.45 2.45 6.55 -1.73 -3.35 115.95 114.70 2k78 h TRP 77 Ca -0.07 0.02 -0.60 0.00 0.95 0.00 0.00 58.89 59.19 2k78 h TRP 77 Cb 0.61 0.32 -0.11 0.00 -0.86 0.00 0.00 29.16 29.13 2k78 h TRP 77 CO 0.01 -0.29 0.17 -1.50 -1.05 0.00 0.00 178.44 175.77 2k78 s ILE 78 N -4.36 4.98 -0.20 1.49 2.07 -1.19 -3.08 121.20 120.92 2k78 s ILE 78 Ca -0.08 1.17 0.19 0.00 -1.41 0.00 0.00 60.65 60.52 2k78 s ILE 78 Cb 0.03 -3.95 0.00 0.00 0.13 0.00 0.00 42.46 38.68 2k78 s ILE 78 CO 0.30 0.04 1.11 0.00 -1.91 0.00 0.00 174.94 174.48 2k78 h THR 79 N 5.36 0.35 -1.94 4.00 1.03 -1.50 -3.42 112.91 116.79 2k78 h THR 79 Ca -0.28 -1.60 0.39 0.00 -0.01 0.00 0.00 66.41 64.92 2k78 h THR 79 Cb 1.13 1.93 -0.07 0.00 -1.07 0.00 0.00 68.15 70.06 2k78 h THR 79 CO 0.78 0.20 0.96 0.61 -0.01 0.00 0.00 175.52 178.06 2k78 n GLY 80 N 1.26 0.09 3.61 2.99 0.00 -1.11 -4.94 105.19 107.09 2k78 n GLY 80 Ca -0.03 -1.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.90 2k78 n GLY 80 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2k78 s MET 81 N -2.00 1.62 0.29 1.61 -1.94 -1.26 -2.67 119.30 114.94 2k78 s MET 81 Ca 0.31 -1.29 -0.15 0.00 -1.71 0.00 0.00 55.69 52.85 2k78 s MET 81 Cb -0.00 0.48 0.01 0.00 2.01 0.00 0.00 34.83 37.34 2k78 s MET 81 CO -0.03 -0.68 0.60 0.45 -0.01 0.00 0.00 175.02 175.35 2k78 s SER 82 N -3.03 -0.03 -0.28 3.03 0.15 0.43 -1.79 113.70 112.17 2k78 s SER 82 Ca 0.22 -0.91 -0.25 0.00 0.70 0.00 0.00 55.95 55.71 2k78 s SER 82 Cb -0.01 0.68 0.12 0.00 -1.71 0.00 0.00 66.02 65.10 2k78 s SER 82 CO 0.10 -1.30 1.03 -0.63 1.20 0.00 0.00 173.24 173.64 2k78 s ILE 83 N -3.66 0.00 -0.05 6.45 1.01 0.35 -2.77 121.20 122.53 2k78 s ILE 83 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.84 2k78 s ILE 83 Cb -0.03 -1.00 0.00 0.00 0.01 0.00 0.00 42.46 41.44 2k78 s ILE 83 CO 0.10 0.00 0.00 -0.62 0.00 0.00 0.00 174.94 174.42 2k78 n GLU 84 N 2.21 -1.79 0.00 2.79 1.02 -1.19 -1.73 120.64 121.94 2k78 n GLU 84 Ca -0.12 0.47 0.00 0.00 -0.02 0.00 0.00 57.16 57.48 2k78 n GLU 84 Cb 0.56 -4.82 0.00 0.00 -0.02 0.00 0.00 31.44 27.16 2k78 n GLU 84 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k78 n GLY 85 N 0.58 0.77 3.18 0.62 0.00 -1.26 -5.10 105.19 103.98 2k78 n GLY 85 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 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 1.09 0.00 1.61 -3.43 -0.71 -5.15 115.29 106.71 2k78 s HIS 86 Ca 0.00 -0.62 0.00 0.00 -0.80 0.00 0.00 55.06 53.64 2k78 s HIS 86 Cb 0.00 -0.60 0.00 0.00 -1.43 0.00 0.00 32.58 30.55 2k78 s HIS 86 CO 0.00 0.02 0.00 1.17 -2.00 0.00 0.00 174.74 173.93 2k78 n LYS 87 N 0.66 0.51 -3.66 -0.38 4.81 -1.26 0.13 118.16 118.97 2k78 n LYS 87 Ca -0.17 0.00 -0.21 0.00 -0.87 0.00 0.00 58.31 57.06 2k78 n LYS 87 Cb 0.57 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.58 2k78 n LYS 87 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 2k78 s GLU 88 N -0.72 2.52 -0.19 1.64 -1.05 -0.74 -4.35 118.70 115.81 2k78 s GLU 88 Ca 0.00 -1.54 -0.06 0.00 -0.15 0.00 0.00 54.97 53.22 2k78 s GLU 88 Cb 0.00 -2.34 -0.03 0.00 -0.44 0.00 0.00 34.13 31.31 2k78 s GLU 88 CO 0.00 -0.14 0.03 1.21 0.95 0.00 0.00 175.26 177.31 2k78 s ASN 89 N -4.08 5.24 -0.52 0.83 3.04 -1.19 -4.95 114.94 113.31 2k78 s ASN 89 Ca 0.46 -0.06 -0.27 0.00 0.04 0.00 0.00 52.86 53.03 2k78 s ASN 89 Cb -0.03 -1.90 -0.03 0.00 -1.54 0.00 0.00 41.25 37.76 2k78 s ASN 89 CO 0.27 0.12 1.93 0.27 -3.04 0.00 0.00 177.10 176.65 2k78 s ILE 90 N 0.69 3.33 -0.12 -5.21 -4.36 -1.26 -3.05 121.20 111.22 2k78 s ILE 90 Ca 0.02 0.24 0.14 0.00 -0.26 0.00 0.00 60.65 60.79 2k78 s ILE 90 Cb -0.14 -3.71 -0.24 0.00 1.25 0.00 0.00 42.46 39.62 2k78 s ILE 90 CO 0.02 -0.64 0.37 0.00 0.24 0.00 0.00 174.94 174.93 2k78 n ILE 91 N 7.39 1.52 -3.15 8.37 3.06 -0.87 -4.91 119.36 130.77 2k78 n ILE 91 Ca 0.24 -0.81 0.05 0.00 -2.50 0.00 0.00 62.75 59.72 2k78 n ILE 91 Cb 0.51 -0.82 -0.01 0.00 0.54 0.00 0.00 39.64 39.87 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 -5.87 -0.99 -0.39 9.51 1.04 -1.23 -4.99 113.70 110.78 2k78 s SER 92 Ca -0.08 0.29 -0.18 0.00 0.48 0.00 0.00 55.95 56.46 2k78 s SER 92 Cb 0.07 1.70 0.01 0.00 0.10 0.00 0.00 66.02 67.90 2k78 s SER 92 CO 0.82 -0.18 0.49 -0.75 0.98 0.00 0.00 173.24 174.59 2k78 s LYS 93 N 2.90 3.34 -1.15 4.02 2.20 -1.26 -2.23 119.74 127.56 2k78 s LYS 93 Ca 0.15 -0.48 -0.05 0.00 -0.36 0.00 0.00 55.97 55.23 2k78 s LYS 93 Cb -0.09 -3.90 0.26 0.00 -1.51 0.00 0.00 37.83 32.60 2k78 s LYS 93 CO -0.21 -0.78 1.67 -1.71 -0.36 0.00 0.00 175.35 173.96 2k78 n ASN 94 N 5.73 6.17 0.05 1.43 4.05 0.27 -4.79 115.26 128.18 2k78 n ASN 94 Ca -0.06 -3.33 0.19 0.00 0.45 0.00 0.00 54.58 51.83 2k78 n ASN 94 Cb 0.48 -1.33 0.71 0.00 1.23 0.00 0.00 39.78 40.87 2k78 n ASN 94 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 2k78 h THR 95 N 3.39 0.69 0.18 -0.44 1.35 -1.94 0.14 112.91 116.28 2k78 h THR 95 Ca 0.30 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 66.15 2k78 h THR 95 Cb 0.58 0.76 0.00 0.00 -1.73 0.00 0.00 68.15 67.76 2k78 h THR 95 CO 1.42 0.00 -0.09 0.00 -0.25 0.00 0.00 175.52 176.60 2k78 h ALA 96 N 1.73 -0.25 -0.46 6.62 0.00 -1.93 -2.95 119.26 122.04 2k78 h ALA 96 Ca 0.21 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2k78 h ALA 96 Cb 0.88 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2k78 h ALA 96 CO -0.00 -0.55 0.00 1.17 0.00 0.00 0.00 179.25 179.87 2k78 n LYS 97 N -5.12 3.77 -3.60 0.00 4.81 -0.79 -4.94 118.16 112.29 2k78 n LYS 97 Ca -0.09 -2.37 -0.27 0.00 -0.87 0.00 0.00 58.31 54.71 2k78 n LYS 97 Cb 0.18 -2.00 0.04 0.00 0.02 0.00 0.00 35.03 33.27 2k78 n LYS 97 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2k78 n ASP 98 N 0.58 -5.63 -4.08 3.14 8.00 -0.07 -4.90 116.55 113.58 2k78 n ASP 98 Ca 0.21 -0.92 -0.10 0.00 0.71 0.00 0.00 54.79 54.69 2k78 n ASP 98 Cb 0.91 -3.59 -0.07 0.00 -0.02 0.00 0.00 41.12 38.35 2k78 n ASP 98 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2k78 s GLU 99 N -5.55 1.40 0.03 -1.24 2.02 -0.55 -2.63 118.70 112.20 2k78 s GLU 99 Ca 0.42 -1.40 -0.27 0.00 0.02 0.00 0.00 54.97 53.73 2k78 s GLU 99 Cb -0.14 0.39 0.09 0.00 0.10 0.00 0.00 34.13 34.58 2k78 s GLU 99 CO 0.84 -0.54 0.84 0.50 0.02 0.00 0.00 175.26 176.92 2k78 s ARG 100 N -4.07 0.93 0.01 1.61 3.52 -0.86 -0.56 118.95 119.52 2k78 s ARG 100 Ca 0.29 -0.35 -0.02 0.00 -0.13 0.00 0.00 55.73 55.51 2k78 s ARG 100 Cb 0.02 0.42 -0.01 0.00 -1.56 0.00 0.00 34.95 33.83 2k78 s ARG 100 CO 0.10 -0.41 0.02 0.99 -0.81 0.00 0.00 175.30 175.20 2k78 s THR 101 N -3.25 0.07 -0.06 4.11 2.01 -0.94 0.16 115.64 117.73 2k78 s THR 101 Ca 0.05 -0.61 -0.07 0.00 0.31 0.00 0.00 61.69 61.36 2k78 s THR 101 Cb -0.01 -0.24 0.02 0.00 0.01 0.00 0.00 72.50 72.27 2k78 s THR 101 CO -0.09 -0.34 0.19 -0.94 -0.69 0.00 0.00 174.62 172.75 2k78 s SER 102 N -1.04 -0.17 0.12 3.53 1.04 -0.64 -2.05 113.70 114.48 2k78 s SER 102 Ca -0.11 0.30 -0.11 0.00 0.48 0.00 0.00 55.95 56.50 2k78 s SER 102 Cb -0.07 0.37 -0.06 0.00 0.10 0.00 0.00 66.02 66.36 2k78 s SER 102 CO -0.00 -0.13 0.47 -0.70 0.98 0.00 0.00 173.24 173.86 2k78 s GLU 103 N -0.16 3.84 0.00 4.02 2.12 -1.17 0.43 118.70 127.78 2k78 s GLU 103 Ca -0.03 0.30 0.06 0.00 0.36 0.00 0.00 54.97 55.66 2k78 s GLU 103 Cb -0.02 -2.95 -0.02 0.00 0.26 0.00 0.00 34.13 31.40 2k78 s GLU 103 CO 0.01 0.51 -0.18 -0.06 -0.54 0.00 0.00 175.26 175.00 2k78 s PHE 104 N -1.46 1.59 -0.23 5.30 0.08 0.27 -3.20 117.98 120.33 2k78 s PHE 104 Ca 0.36 -0.32 -0.09 0.00 0.12 0.00 0.00 56.93 57.00 2k78 s PHE 104 Cb -0.14 -1.00 -0.04 0.00 -0.57 0.00 0.00 43.02 41.27 2k78 s PHE 104 CO 0.19 0.00 0.11 -2.00 -0.10 0.00 0.00 175.22 173.42 2k78 s GLU 105 N -0.62 3.93 -0.13 0.44 2.12 -1.26 -0.94 118.70 122.24 2k78 s GLU 105 Ca 0.06 -0.35 -0.11 0.00 0.36 0.00 0.00 54.97 54.94 2k78 s GLU 105 Cb -0.07 -3.41 0.04 0.00 0.26 0.00 0.00 34.13 30.94 2k78 s GLU 105 CO -0.00 0.04 0.34 0.14 -0.54 0.00 0.00 175.26 175.24 2k78 s VAL 106 N 1.07 -0.01 -0.50 3.70 -7.23 -1.23 -4.80 120.40 111.41 2k78 s VAL 106 Ca 0.06 0.02 -0.27 0.00 -1.81 0.00 0.00 61.98 59.98 2k78 s VAL 106 Cb -0.14 -0.48 -0.08 0.00 0.56 0.00 0.00 36.38 36.23 2k78 s VAL 106 CO 0.04 0.01 2.42 -1.20 -0.31 0.00 0.00 175.10 176.06 2k78 n SER 107 N 3.16 2.22 -1.06 4.85 7.64 -1.26 -4.62 113.62 124.55 2k78 n SER 107 Ca -0.15 -0.33 0.13 0.00 1.01 0.00 0.00 58.87 59.53 2k78 n SER 107 Cb 0.57 -1.51 -0.04 0.00 -1.01 0.00 0.00 64.21 62.22 2k78 n SER 107 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2k78 n LYS 108 N 8.90 -2.08 -3.15 1.43 4.76 -1.26 -4.83 118.16 121.93 2k78 n LYS 108 Ca 0.39 1.44 -0.15 0.00 -2.87 0.00 0.00 58.31 57.12 2k78 n LYS 108 Cb 0.47 -2.57 -0.05 0.00 -1.84 0.00 0.00 35.03 31.04 2k78 n LYS 108 CO 0.00 0.00 0.00 -0.48 -1.37 0.00 0.00 177.40 175.55 2k78 s LEU 109 N -5.50 -0.14 -0.43 -0.35 0.05 -1.26 -5.04 118.68 106.02 2k78 s LEU 109 Ca 0.00 -2.09 0.06 0.00 0.05 0.00 0.00 54.13 52.15 2k78 s LEU 109 Cb 0.00 0.77 0.21 0.00 -2.05 0.00 0.00 46.19 45.12 2k78 s LEU 109 CO 0.00 -0.15 0.51 -3.20 -0.55 0.00 0.00 176.35 172.96 2k78 n ASN 110 N 3.32 -0.90 0.00 1.48 2.85 -1.26 -0.51 115.26 120.25 2k78 n ASN 110 Ca 0.20 -2.65 0.00 0.00 -0.11 0.00 0.00 54.58 52.02 2k78 n ASN 110 Cb 0.50 -0.03 0.00 0.00 1.24 0.00 0.00 39.78 41.50 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 2.22 -0.25 3.45 8.20 0.00 0.12 -4.94 105.19 114.00 2k78 n GLY 111 Ca 0.23 0.02 -0.16 0.00 0.00 0.00 0.00 46.02 46.10 2k78 n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k78 s LYS 112 N 0.00 0.99 0.03 1.61 0.00 -1.26 -1.38 119.74 119.72 2k78 s LYS 112 Ca 0.00 0.09 0.02 0.00 0.00 0.00 0.00 55.97 56.08 2k78 s LYS 112 Cb 0.00 0.46 -0.02 0.00 0.00 0.00 0.00 37.83 38.27 2k78 s LYS 112 CO 0.00 -0.32 -0.07 0.42 0.00 0.00 0.00 175.35 175.39 2k78 s ILE 113 N -1.45 0.49 -0.32 3.79 -1.09 -0.53 -4.93 121.20 117.16 2k78 s ILE 113 Ca -0.10 -0.82 -0.29 0.00 -2.23 0.00 0.00 60.65 57.21 2k78 s ILE 113 Cb -0.01 -0.52 0.00 0.00 -1.58 0.00 0.00 42.46 40.35 2k78 s ILE 113 CO 0.07 -0.24 1.31 -1.81 -1.23 0.00 0.00 174.94 173.04 2k78 s ASP 114 N -1.14 6.63 0.52 3.58 1.01 -1.26 -2.33 116.67 123.68 2k78 s ASP 114 Ca -0.07 1.14 0.01 0.00 0.71 0.00 0.00 52.55 54.34 2k78 s ASP 114 Cb -0.08 -2.54 -0.01 0.00 1.01 0.00 0.00 42.92 41.31 2k78 s ASP 114 CO 0.00 -1.13 0.00 -0.83 0.21 0.00 0.00 175.17 173.43 2k78 s GLY 115 N 2.93 3.08 0.08 0.21 0.00 -1.14 -3.18 107.32 109.30 2k78 s GLY 115 Ca 0.57 -0.19 -0.05 0.00 0.00 0.00 0.00 44.72 45.04 2k78 s GLY 115 CO 0.24 -2.21 0.11 0.54 0.00 0.00 0.00 173.10 171.78 2k78 s LYS 116 N -3.90 0.79 -0.11 2.90 1.02 -1.11 -3.09 119.74 116.23 2k78 s LYS 116 Ca 0.03 -1.10 -0.25 0.00 0.02 0.00 0.00 55.97 54.67 2k78 s LYS 116 Cb 0.01 0.29 0.06 0.00 -0.52 0.00 0.00 37.83 37.67 2k78 s LYS 116 CO 0.02 -0.22 0.60 -1.50 -0.92 0.00 0.00 175.35 173.32 2k78 s ILE 117 N -3.90 0.01 0.19 2.17 -1.16 -0.46 0.16 121.20 118.20 2k78 s ILE 117 Ca 0.08 -0.08 0.06 0.00 -0.51 0.00 0.00 60.65 60.19 2k78 s ILE 117 Cb 0.06 -0.89 -0.04 0.00 0.61 0.00 0.00 42.46 42.21 2k78 s ILE 117 CO -0.09 -0.04 0.16 -1.81 -2.81 0.00 0.00 174.94 170.34 2k78 s ASP 118 N -0.68 5.54 0.04 4.50 1.11 -1.09 -2.04 116.67 124.05 2k78 s ASP 118 Ca -0.08 -0.15 0.04 0.00 0.18 0.00 0.00 52.55 52.54 2k78 s ASP 118 Cb -0.02 -1.44 -0.02 0.00 1.07 0.00 0.00 42.92 42.50 2k78 s ASP 118 CO 0.06 0.04 -0.12 -0.69 1.18 0.00 0.00 175.17 175.64 2k78 s VAL 119 N -1.85 0.91 -0.25 -1.27 1.01 -1.17 -1.79 120.40 115.99 2k78 s VAL 119 Ca 0.32 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.34 2k78 s VAL 119 Cb -0.09 -0.85 0.14 0.00 0.00 0.00 0.00 36.38 35.57 2k78 s VAL 119 CO 0.24 -0.06 0.39 -0.47 0.00 0.00 0.00 175.10 175.19 2k78 s TYR 120 N -0.88 -0.86 0.07 5.22 5.04 -1.18 -2.73 117.35 122.04 2k78 s TYR 120 Ca -0.01 0.83 0.03 0.00 -2.44 0.00 0.00 57.07 55.48 2k78 s TYR 120 Cb -0.08 0.02 -0.03 0.00 0.35 0.00 0.00 41.96 42.23 2k78 s TYR 120 CO 0.01 -0.74 -0.10 0.42 -1.34 0.00 0.00 175.55 173.80 2k78 s ILE 121 N 2.56 0.81 -0.35 3.14 1.01 0.33 -4.35 121.20 124.35 2k78 s ILE 121 Ca 0.13 -1.41 0.06 0.00 0.00 0.00 0.00 60.65 59.44 2k78 s ILE 121 Cb -0.15 -1.07 0.19 0.00 0.01 0.00 0.00 42.46 41.44 2k78 s ILE 121 CO -0.17 -0.46 0.62 1.51 0.00 0.00 0.00 174.94 176.44 2k78 s ASP 122 N -2.06 -1.56 0.03 3.58 -4.77 -1.26 -1.39 116.67 109.25 2k78 s ASP 122 Ca -0.01 -0.26 -0.17 0.00 -3.30 0.00 0.00 52.55 48.81 2k78 s ASP 122 Cb -0.06 1.97 0.06 0.00 -1.09 0.00 0.00 42.92 43.80 2k78 s ASP 122 CO 0.00 -0.23 0.78 -1.84 0.70 0.00 0.00 175.17 174.58 2k78 n GLU 123 N 4.93 0.21 -3.16 2.11 0.28 -1.16 -4.99 120.64 118.87 2k78 n GLU 123 Ca 0.08 -0.65 -0.44 0.00 -0.16 0.00 0.00 57.16 55.99 2k78 n GLU 123 Cb 0.56 0.98 -0.06 0.00 1.43 0.00 0.00 31.44 34.35 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 -2.02 3.08 -0.52 3.44 1.02 -1.26 0.93 119.74 124.40 2k78 s LYS 124 Ca 0.18 -1.12 -0.28 0.00 0.02 0.00 0.00 55.97 54.77 2k78 s LYS 124 Cb -0.01 -4.18 0.01 0.00 -0.52 0.00 0.00 37.83 33.14 2k78 s LYS 124 CO 0.01 -1.34 1.39 0.08 -0.92 0.00 0.00 175.35 174.56 2k78 s VAL 125 N 2.55 3.85 -1.55 3.17 1.01 0.27 -3.35 120.40 126.34 2k78 s VAL 125 Ca 0.12 0.77 0.00 0.00 0.00 0.00 0.00 61.98 62.88 2k78 s VAL 125 Cb -0.22 -4.41 0.00 0.00 0.00 0.00 0.00 36.38 31.75 2k78 s VAL 125 CO 0.09 -1.08 0.00 -3.20 0.00 0.00 0.00 175.10 170.91 2k78 n ASN 126 N 9.25 -5.20 -0.08 3.32 4.05 -1.26 -2.34 115.26 123.00 2k78 n ASN 126 Ca 0.13 0.02 0.00 0.00 0.45 0.00 0.00 54.58 55.18 2k78 n ASN 126 Cb 0.49 -4.27 0.00 0.00 1.23 0.00 0.00 39.78 37.23 2k78 n ASN 126 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2k78 n GLY 127 N -1.00 1.07 2.85 8.20 0.00 -1.21 -5.07 105.19 110.02 2k78 n GLY 127 Ca -0.21 -0.46 -0.16 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 -2.68 0.14 -0.22 1.61 1.02 -0.99 -5.06 119.74 113.57 2k78 s LYS 128 Ca 0.00 0.45 -0.36 0.00 0.02 0.00 0.00 55.97 56.08 2k78 s LYS 128 Cb 0.00 -0.65 -0.12 0.00 -0.52 0.00 0.00 37.83 36.54 2k78 s LYS 128 CO 0.00 -0.47 1.96 -2.30 -0.92 0.00 0.00 175.35 173.62 2k78 n PRO 129 N 5.33 1.60 -4.24 -1.68 -0.02 -1.26 0.95 135.00 135.68 2k78 n PRO 129 Ca -0.05 0.55 -0.34 0.00 -2.02 0.00 0.00 63.50 61.64 2k78 n PRO 129 Cb 0.50 -2.50 -0.15 0.00 -0.02 0.00 0.00 33.50 31.33 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 5.15 2.83 -0.24 6.00 5.36 0.26 -4.85 117.98 132.50 2k78 s PHE 130 Ca 1.00 -1.16 -0.08 0.00 -0.96 0.00 0.00 56.93 55.72 2k78 s PHE 130 Cb -0.81 -1.96 -0.03 0.00 -0.34 0.00 0.00 43.02 39.88 2k78 s PHE 130 CO 0.53 -0.58 0.08 0.21 -1.46 0.00 0.00 175.22 174.01 2k78 s LYS 131 N 1.12 3.76 -0.05 10.12 2.20 -1.26 -2.96 119.74 132.66 2k78 s LYS 131 Ca 0.01 -0.43 -0.02 0.00 -0.36 0.00 0.00 55.97 55.17 2k78 s LYS 131 Cb -0.14 -3.35 0.03 0.00 -1.51 0.00 0.00 37.83 32.86 2k78 s LYS 131 CO -0.04 -0.09 0.04 -0.47 -0.36 0.00 0.00 175.35 174.43 2k78 s TYR 132 N 1.39 0.24 -0.39 4.03 5.04 -0.49 -4.96 117.35 122.20 2k78 s TYR 132 Ca 0.06 0.12 -0.01 0.00 -2.44 0.00 0.00 57.07 54.80 2k78 s TYR 132 Cb -0.15 -0.58 0.19 0.00 0.35 0.00 0.00 41.96 41.78 2k78 s TYR 132 CO 0.04 -0.24 0.89 0.16 -1.34 0.00 0.00 175.55 175.06 2k78 s ASP 133 N 2.11 -0.86 0.00 4.32 -4.77 -1.25 0.12 116.67 116.34 2k78 s ASP 133 Ca 0.05 -0.70 0.00 0.00 -3.30 0.00 0.00 52.55 48.60 2k78 s ASP 133 Cb -0.12 1.11 0.00 0.00 -1.09 0.00 0.00 42.92 42.82 2k78 s ASP 133 CO -0.04 -0.07 0.00 1.57 0.70 0.00 0.00 175.17 177.34 2k78 n HIS 134 N 3.45 -0.04 -4.60 2.11 -0.00 -1.10 -5.02 115.22 110.01 2k78 n HIS 134 Ca 0.11 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 58.00 2k78 n HIS 134 Cb 0.61 0.00 -0.14 0.00 -0.12 0.00 0.00 29.99 30.34 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 -2.57 2.31 0.33 1.57 5.65 -1.26 -3.05 115.29 118.27 2k78 s HIS 135 Ca 0.00 -0.39 -0.09 0.00 0.25 0.00 0.00 55.06 54.83 2k78 s HIS 135 Cb 0.00 -1.30 0.04 0.00 -1.18 0.00 0.00 32.58 30.13 2k78 s HIS 135 CO 0.00 0.25 0.60 0.66 -0.65 0.00 0.00 174.74 175.60 2k78 n TYR 136 N 1.27 -1.88 -4.01 3.88 4.01 -0.87 -4.98 117.16 114.58 2k78 n TYR 136 Ca -0.18 -1.81 -0.10 0.00 -0.16 0.00 0.00 57.90 55.66 2k78 n TYR 136 Cb 0.53 0.69 -0.06 0.00 -0.31 0.00 0.00 39.34 40.19 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 -2.86 -0.05 0.17 7.72 2.20 -1.26 -1.36 114.94 119.50 2k78 s ASN 137 Ca 0.19 -0.97 -0.18 0.00 -0.94 0.00 0.00 52.86 50.96 2k78 s ASN 137 Cb -0.03 0.54 0.04 0.00 -2.00 0.00 0.00 41.25 39.80 2k78 s ASN 137 CO 0.14 -1.06 0.51 0.27 -2.94 0.00 0.00 177.10 174.01 2k78 s ILE 138 N -4.03 0.03 -0.29 0.54 -4.36 -1.18 -4.59 121.20 107.33 2k78 s ILE 138 Ca 0.24 -0.57 -0.19 0.00 -0.26 0.00 0.00 60.65 59.87 2k78 s ILE 138 Cb 0.01 -1.36 -0.02 0.00 1.25 0.00 0.00 42.46 42.34 2k78 s ILE 138 CO 0.08 -0.14 0.55 -0.89 0.24 0.00 0.00 174.94 174.78 2k78 s THR 139 N -3.83 5.01 -0.60 8.37 2.01 -0.99 -2.87 115.64 122.74 2k78 s THR 139 Ca 0.06 0.78 -0.21 0.00 0.31 0.00 0.00 61.69 62.63 2k78 s THR 139 Cb -0.00 -3.91 0.08 0.00 0.01 0.00 0.00 72.50 68.67 2k78 s THR 139 CO -0.07 -0.05 0.83 -0.31 -0.69 0.00 0.00 174.62 174.33 2k78 s TYR 140 N 2.43 2.84 -0.59 4.92 2.02 -0.98 -0.78 117.35 127.21 2k78 s TYR 140 Ca 0.22 -0.62 -0.23 0.00 -0.37 0.00 0.00 57.07 56.07 2k78 s TYR 140 Cb -0.15 -4.07 0.05 0.00 -0.40 0.00 0.00 41.96 37.39 2k78 s TYR 140 CO 0.11 -1.42 0.92 0.21 -1.57 0.00 0.00 175.55 173.80 2k78 s LYS 141 N 3.41 3.22 0.26 -0.62 2.20 0.42 -1.45 119.74 127.18 2k78 s LYS 141 Ca 0.19 -0.54 -0.05 0.00 -0.36 0.00 0.00 55.97 55.20 2k78 s LYS 141 Cb -0.19 -4.13 -0.06 0.00 -1.51 0.00 0.00 37.83 31.95 2k78 s LYS 141 CO 0.10 -1.59 0.52 -0.06 -0.36 0.00 0.00 175.35 173.96 2k78 s PHE 142 N 3.88 3.47 -0.25 4.03 0.08 -0.48 0.11 117.98 128.81 2k78 s PHE 142 Ca 0.26 0.65 -0.04 0.00 0.12 0.00 0.00 56.93 57.92 2k78 s PHE 142 Cb -0.15 -2.10 0.10 0.00 -0.57 0.00 0.00 43.02 40.29 2k78 s PHE 142 CO 0.15 0.23 0.15 -0.80 -0.10 0.00 0.00 175.22 174.86 2k78 s ASN 143 N -2.93 2.80 0.00 1.36 0.01 0.29 0.13 114.94 116.59 2k78 s ASN 143 Ca 0.44 -0.96 0.00 0.00 -0.71 0.00 0.00 52.86 51.63 2k78 s ASN 143 Cb -0.11 -0.13 0.00 0.00 0.41 0.00 0.00 41.25 41.42 2k78 s ASN 143 CO 0.28 -0.40 0.00 0.61 -1.51 0.00 0.00 177.10 176.07 2k78 n GLY 144 N 5.27 3.76 0.15 0.66 0.00 0.34 -2.38 105.19 112.98 2k78 n GLY 144 Ca -0.06 -0.57 -0.01 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.84 0.00 1.61 -0.04 -1.26 -4.69 135.00 128.77 2k78 n PRO 145 Ca 0.00 -0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 2k78 n PRO 145 Cb 0.00 -0.08 0.00 0.00 -0.04 0.00 0.00 33.50 33.38 2k78 n PRO 145 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2k78 n THR 146 N -2.98 0.00 0.06 0.52 -2.24 -1.26 -4.23 114.28 104.14 2k78 n THR 146 Ca 0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 2k78 n THR 146 Cb 0.03 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 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 -1.76 -0.44 -3.55 3.42 2.03 -1.26 -4.95 116.55 110.05 2k78 n ASP 147 Ca 0.00 0.22 -0.20 0.00 0.52 0.00 0.00 54.79 55.34 2k78 n ASP 147 Cb 0.00 0.55 0.06 0.00 -0.72 0.00 0.00 41.12 41.01 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 -2.86 -5.66 -2.66 5.18 0.31 -1.26 -4.89 118.33 106.49 2k78 n VAL 148 Ca 0.00 -0.63 -0.43 0.00 -0.01 0.00 0.00 64.34 63.28 2k78 n VAL 148 Cb 0.00 -4.57 -0.03 0.00 -0.91 0.00 0.00 33.84 28.33 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 -3.52 3.09 0.00 3.52 0.00 -1.26 -5.23 121.76 118.36 2k78 s ALA 149 Ca 0.08 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.23 2k78 s ALA 149 Cb -0.02 -3.91 0.00 0.00 0.00 0.00 0.00 23.12 19.19 2k78 s ALA 149 CO 0.78 -2.46 0.00 0.41 0.00 0.00 0.00 175.76 174.49