#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k78 s ALA 26 N 0.00 3.26 -1.86 -0.43 0.00 -1.26 -4.49 121.76 116.99 2k78 s ALA 26 Ca 0.00 -2.01 0.00 0.00 0.00 0.00 0.00 51.96 49.95 2k78 s ALA 26 Cb 0.00 -2.60 0.00 0.00 0.00 0.00 0.00 23.12 20.52 2k78 s ALA 26 CO 0.00 -1.56 0.00 -1.71 0.00 0.00 0.00 175.76 172.49 2k78 n ASN 27 N 4.92 -5.32 -3.66 0.00 2.85 -1.26 -4.87 115.26 107.93 2k78 n ASN 27 Ca -0.11 0.30 -0.41 0.00 -0.11 0.00 0.00 54.58 54.25 2k78 n ASN 27 Cb 0.44 -4.43 -0.00 0.00 1.24 0.00 0.00 39.78 37.02 2k78 n ASN 27 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k78 n ALA 28 N 0.23 6.11 0.09 5.20 0.00 -1.26 -4.72 120.51 126.16 2k78 n ALA 28 Ca -0.20 -4.12 -0.05 0.00 0.00 0.00 0.00 53.44 49.08 2k78 n ALA 28 Cb 0.63 -3.00 -0.02 0.00 0.00 0.00 0.00 19.45 17.06 2k78 n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k78 h ALA 29 N 5.29 -0.36 -2.83 0.00 0.00 -1.96 -3.47 119.26 115.95 2k78 h ALA 29 Ca 0.57 -0.07 -0.35 0.00 0.00 0.00 0.00 54.91 55.06 2k78 h ALA 29 Cb 0.48 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.34 2k78 h ALA 29 CO 1.62 -0.34 -0.41 -0.25 0.00 0.00 0.00 179.25 179.87 2k78 n ASP 30 N -4.37 -4.94 -3.46 0.00 8.00 -1.26 -4.90 116.55 105.61 2k78 n ASP 30 Ca -0.04 0.16 -0.13 0.00 0.71 0.00 0.00 54.79 55.50 2k78 n ASP 30 Cb 0.12 -4.21 -0.03 0.00 -0.02 0.00 0.00 41.12 36.98 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 -2.14 -0.54 0.00 -2.24 1.04 -1.26 -0.17 113.70 108.39 2k78 s SER 31 Ca 0.00 0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.48 2k78 s SER 31 Cb 0.00 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.69 2k78 s SER 31 CO 0.00 -0.91 0.00 0.61 0.98 0.00 0.00 173.24 173.92 2k78 n GLY 32 N -0.19 0.66 3.53 7.32 0.00 -0.66 -4.97 105.19 110.89 2k78 n GLY 32 Ca -0.17 -0.98 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 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 4.57 0.21 2.61 -4.23 -1.26 -0.13 115.64 115.41 2k78 s THR 33 Ca 0.00 0.35 -0.04 0.00 -1.18 0.00 0.00 61.69 60.82 2k78 s THR 33 Cb 0.00 -4.39 -0.05 0.00 1.34 0.00 0.00 72.50 69.39 2k78 s THR 33 CO 0.00 -0.85 0.45 -0.22 -0.54 0.00 0.00 174.62 173.46 2k78 s LEU 34 N 3.48 4.19 0.24 4.79 0.20 0.12 -4.88 118.68 126.80 2k78 s LEU 34 Ca 0.30 0.61 -0.30 0.00 0.69 0.00 0.00 54.13 55.43 2k78 s LEU 34 Cb -0.12 -3.38 -0.09 0.00 -0.43 0.00 0.00 46.19 42.17 2k78 s LEU 34 CO 0.21 -0.06 0.98 0.20 -0.29 0.00 0.00 176.35 177.39 2k78 s ASN 35 N -2.83 7.56 0.02 3.68 0.02 -1.05 -2.31 114.94 120.04 2k78 s ASN 35 Ca 0.42 2.00 -0.28 0.00 -1.02 0.00 0.00 52.86 53.99 2k78 s ASN 35 Cb -0.11 -2.61 0.10 0.00 0.02 0.00 0.00 41.25 38.64 2k78 s ASN 35 CO 0.27 0.08 0.83 -0.72 0.02 0.00 0.00 177.10 177.58 2k78 s TYR 36 N -1.08 -0.39 0.06 2.20 1.13 -1.26 0.17 117.35 118.18 2k78 s TYR 36 Ca 0.42 0.28 -0.02 0.00 -1.41 0.00 0.00 57.07 56.34 2k78 s TYR 36 Cb -0.27 0.54 0.01 0.00 -1.10 0.00 0.00 41.96 41.13 2k78 s TYR 36 CO 0.34 -0.60 0.11 -1.91 -2.51 0.00 0.00 175.55 170.98 2k78 n GLU 37 N -0.20 0.16 -4.20 -3.49 2.13 0.56 -4.80 120.64 110.80 2k78 n GLU 37 Ca -0.11 -0.41 -0.13 0.00 0.66 0.00 0.00 57.16 57.17 2k78 n GLU 37 Cb 0.62 0.46 -0.09 0.00 0.27 0.00 0.00 31.44 32.70 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 -2.71 0.00 0.06 6.31 -7.23 -1.26 -0.40 120.40 115.18 2k78 s VAL 38 Ca 0.04 -1.96 -0.10 0.00 -1.81 0.00 0.00 61.98 58.15 2k78 s VAL 38 Cb -0.01 -2.49 0.00 0.00 0.56 0.00 0.00 36.38 34.45 2k78 s VAL 38 CO 0.03 0.00 0.22 -0.31 -0.31 0.00 0.00 175.10 174.72 2k78 s TYR 39 N -3.98 0.06 0.31 2.82 2.02 0.93 -4.08 117.35 115.43 2k78 s TYR 39 Ca 0.38 -0.37 -0.29 0.00 -0.37 0.00 0.00 57.07 56.43 2k78 s TYR 39 Cb 0.05 -0.01 -0.10 0.00 -0.40 0.00 0.00 41.96 41.50 2k78 s TYR 39 CO 0.15 -0.50 1.30 0.21 -1.57 0.00 0.00 175.55 175.14 2k78 s LYS 40 N -3.17 4.38 0.53 -0.62 2.47 -0.08 -1.23 119.74 122.02 2k78 s LYS 40 Ca -0.00 2.18 -0.21 0.00 -1.56 0.00 0.00 55.97 56.37 2k78 s LYS 40 Cb 0.02 -3.09 -0.05 0.00 -1.46 0.00 0.00 37.83 33.24 2k78 s LYS 40 CO -0.07 -0.17 1.28 -0.47 0.16 0.00 0.00 175.35 176.08 2k78 s TYR 41 N -0.99 2.44 0.00 4.03 5.04 -1.26 -1.94 117.35 124.67 2k78 s TYR 41 Ca 0.50 1.44 0.00 0.00 -2.44 0.00 0.00 57.07 56.57 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 0.50 -2.45 0.00 -1.71 -1.34 0.00 0.00 175.55 170.56 2k78 n ASN 42 N -1.00 -2.08 -3.48 4.32 5.15 -1.26 -4.94 115.26 111.97 2k78 n ASN 42 Ca 0.10 0.00 -0.21 0.00 -0.60 0.00 0.00 54.58 53.87 2k78 n ASN 42 Cb 0.47 -1.59 -0.08 0.00 -0.53 0.00 0.00 39.78 38.04 2k78 n ASN 42 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2k78 s THR 43 N -2.04 0.11 -0.34 -0.44 -4.23 -0.82 -5.06 115.64 102.83 2k78 s THR 43 Ca 0.00 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.60 2k78 s THR 43 Cb 0.00 -2.45 0.22 0.00 1.34 0.00 0.00 72.50 71.61 2k78 s THR 43 CO 0.00 0.00 1.17 0.59 -0.54 0.00 0.00 174.62 175.84 2k78 n ASN 44 N -1.57 2.62 -4.01 3.99 4.13 -1.26 -4.62 115.26 114.53 2k78 n ASN 44 Ca 0.05 -2.32 -0.15 0.00 1.68 0.00 0.00 54.58 53.84 2k78 n ASN 44 Cb 0.63 -0.22 -0.13 0.00 -1.54 0.00 0.00 39.78 38.51 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 -1.43 0.79 0.28 6.41 1.11 -1.26 -4.90 116.67 117.67 2k78 s ASP 45 Ca 0.18 -0.26 -0.29 0.00 0.18 0.00 0.00 52.55 52.36 2k78 s ASP 45 Cb 0.13 -0.04 -0.10 0.00 1.07 0.00 0.00 42.92 43.98 2k78 s ASP 45 CO 0.07 -0.01 1.12 -0.89 1.18 0.00 0.00 175.17 176.63 2k78 s THR 46 N -0.56 3.43 0.00 -1.27 2.01 -1.26 -0.90 115.64 117.10 2k78 s THR 46 Ca -0.02 1.43 0.00 0.00 0.31 0.00 0.00 61.69 63.42 2k78 s THR 46 Cb -0.05 -3.91 0.00 0.00 0.01 0.00 0.00 72.50 68.55 2k78 s THR 46 CO 0.00 0.34 0.00 -0.24 -0.69 0.00 0.00 174.62 174.03 2k78 n SER 47 N 1.23 2.10 0.00 3.53 2.88 -1.26 -4.76 113.62 117.34 2k78 n SER 47 Ca -0.01 -0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 2k78 n SER 47 Cb 0.45 0.54 0.00 0.00 -0.75 0.00 0.00 64.21 64.44 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 -0.75 0.00 -0.14 2.46 5.41 -1.26 -4.85 119.36 120.24 2k78 n ILE 48 Ca 0.00 0.00 0.28 0.00 1.00 0.00 0.00 62.75 64.03 2k78 n ILE 48 Cb 0.00 -0.10 0.61 0.00 -0.71 0.00 0.00 39.64 39.44 2k78 n ILE 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2k78 h ALA 49 N 0.00 2.72 0.00 -1.39 0.00 -1.96 0.41 119.26 119.04 2k78 h ALA 49 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2k78 h ALA 49 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2k78 h ALA 49 CO 0.00 -1.35 0.00 -2.95 0.00 0.00 0.00 179.25 174.95 2k78 h ASN 50 N 0.00 0.00 -0.58 0.00 7.08 -1.90 -0.61 115.58 119.57 2k78 h ASN 50 Ca 0.41 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.63 2k78 h ASN 50 Cb 2.21 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 38.45 2k78 h ASN 50 CO -0.00 0.00 0.00 0.47 -2.08 0.00 0.00 177.43 175.82 2k78 n ASP 51 N -2.58 4.67 0.00 6.14 8.00 0.14 -4.34 116.55 128.59 2k78 n ASP 51 Ca -0.02 -2.53 0.00 0.00 0.71 0.00 0.00 54.79 52.95 2k78 n ASP 51 Cb 0.05 -0.56 0.00 0.00 -0.02 0.00 0.00 41.12 40.59 2k78 n ASP 51 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2k78 n TYR 52 N 0.86 0.00 -3.97 1.24 4.02 -0.24 -5.02 117.16 114.04 2k78 n TYR 52 Ca 0.25 -0.13 -0.34 0.00 -0.01 0.00 0.00 57.90 57.67 2k78 n TYR 52 Cb 0.90 -0.01 -0.14 0.00 -0.02 0.00 0.00 39.34 40.06 2k78 n TYR 52 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 176.86 175.26 2k78 s PHE 53 N -0.26 3.07 -0.51 -0.72 -0.71 -1.21 -2.93 117.98 114.72 2k78 s PHE 53 Ca 0.00 -1.61 -0.28 0.00 -1.04 0.00 0.00 56.93 54.00 2k78 s PHE 53 Cb 0.00 -2.05 0.01 0.00 -1.21 0.00 0.00 43.02 39.77 2k78 s PHE 53 CO 0.00 -0.74 1.49 1.21 -1.34 0.00 0.00 175.22 175.83 2k78 s ASN 54 N 1.31 6.07 0.36 1.98 3.84 -1.25 -5.00 114.94 122.25 2k78 s ASN 54 Ca -0.00 0.50 0.01 0.00 0.21 0.00 0.00 52.86 53.57 2k78 s ASN 54 Cb -0.17 -2.54 -0.03 0.00 -0.55 0.00 0.00 41.25 37.96 2k78 s ASN 54 CO -0.05 -1.71 0.56 -1.59 -2.79 0.00 0.00 177.10 171.52 2k78 s LYS 55 N 5.53 3.45 0.53 0.43 -2.85 -1.26 -4.46 119.74 121.11 2k78 s LYS 55 Ca 0.58 -0.35 -0.09 0.00 -1.00 0.00 0.00 55.97 55.11 2k78 s LYS 55 Cb -0.13 -2.65 0.12 0.00 -2.06 0.00 0.00 37.83 33.11 2k78 s LYS 55 CO 0.27 0.11 0.72 -0.35 0.10 0.00 0.00 175.35 176.21 2k78 n PRO 56 N -1.81 -0.66 -3.58 1.78 -0.04 -1.26 -5.16 135.00 124.27 2k78 n PRO 56 Ca -0.04 -1.15 -0.20 0.00 -0.04 0.00 0.00 63.50 62.07 2k78 n PRO 56 Cb 0.56 -0.73 -0.01 0.00 -0.04 0.00 0.00 33.50 33.28 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 -3.93 4.12 -0.28 0.55 0.00 -0.98 -4.92 121.76 116.32 2k78 s ALA 57 Ca 0.41 -1.50 -0.09 0.00 0.00 0.00 0.00 51.96 50.78 2k78 s ALA 57 Cb -0.01 -1.54 -0.02 0.00 0.00 0.00 0.00 23.12 21.55 2k78 s ALA 57 CO 0.29 -0.01 0.12 0.21 0.00 0.00 0.00 175.76 176.36 2k78 s LYS 58 N -4.12 3.48 0.37 0.00 2.20 -1.14 0.10 119.74 120.63 2k78 s LYS 58 Ca 0.43 -0.61 0.05 0.00 -0.36 0.00 0.00 55.97 55.49 2k78 s LYS 58 Cb -0.08 -3.46 -0.00 0.00 -1.51 0.00 0.00 37.83 32.77 2k78 s LYS 58 CO 0.30 -0.31 0.53 1.52 -0.36 0.00 0.00 175.35 177.02 2k78 s TYR 59 N 1.61 3.10 -0.24 4.03 1.13 0.82 -0.85 117.35 126.95 2k78 s TYR 59 Ca 0.05 -0.14 -0.09 0.00 -1.41 0.00 0.00 57.07 55.48 2k78 s TYR 59 Cb -0.16 -2.11 0.10 0.00 -1.10 0.00 0.00 41.96 38.68 2k78 s TYR 59 CO 0.05 -0.14 0.52 -1.50 -2.51 0.00 0.00 175.55 171.97 2k78 s ILE 60 N -2.28 -0.60 -0.02 -3.49 2.07 -0.95 -1.65 121.20 114.28 2k78 s ILE 60 Ca 0.47 0.09 -0.00 0.00 -1.41 0.00 0.00 60.65 59.79 2k78 s ILE 60 Cb -0.10 -0.80 0.02 0.00 0.13 0.00 0.00 42.46 41.72 2k78 s ILE 60 CO 0.33 0.04 0.03 -0.54 -1.91 0.00 0.00 174.94 172.88 2k78 s LYS 61 N 2.43 -0.03 -0.79 3.50 1.02 0.76 0.13 119.74 126.77 2k78 s LYS 61 Ca -0.05 0.16 0.02 0.00 0.02 0.00 0.00 55.97 56.13 2k78 s LYS 61 Cb -0.11 -0.20 0.32 0.00 -0.52 0.00 0.00 37.83 37.32 2k78 s LYS 61 CO -0.16 -0.14 1.28 1.17 -0.92 0.00 0.00 175.35 176.58 2k78 n LYS 62 N 3.98 4.03 -2.75 1.68 4.81 -0.78 -4.28 118.16 124.85 2k78 n LYS 62 Ca -0.25 -4.75 -0.03 0.00 -0.87 0.00 0.00 58.31 52.41 2k78 n LYS 62 Cb 0.52 -2.35 -0.02 0.00 0.02 0.00 0.00 35.03 33.20 2k78 n LYS 62 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2k78 n ASN 63 N 0.08 -4.09 0.00 3.14 5.03 -1.26 -4.23 115.26 113.94 2k78 n ASN 63 Ca 0.36 1.20 0.00 0.00 0.87 0.00 0.00 54.58 57.01 2k78 n ASN 63 Cb 0.34 -3.40 0.00 0.00 -1.02 0.00 0.00 39.78 35.71 2k78 n ASN 63 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2k78 n GLY 64 N 2.11 2.94 3.10 7.41 0.00 -1.26 -5.03 105.19 114.46 2k78 n GLY 64 Ca -0.19 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.97 0.64 -0.19 1.61 0.00 -1.26 -5.15 119.74 114.42 2k78 s LYS 65 Ca 0.00 -1.21 -0.28 0.00 0.00 0.00 0.00 55.97 54.49 2k78 s LYS 65 Cb 0.00 0.22 0.09 0.00 0.00 0.00 0.00 37.83 38.14 2k78 s LYS 65 CO 0.00 -0.13 0.83 -0.48 0.00 0.00 0.00 175.35 175.58 2k78 s LEU 66 N -2.92 -0.58 0.00 2.77 -0.00 -1.26 -1.88 118.68 114.81 2k78 s LEU 66 Ca 0.07 0.91 0.00 0.00 -0.00 0.00 0.00 54.13 55.11 2k78 s LEU 66 Cb 0.08 2.24 0.00 0.00 -0.00 0.00 0.00 46.19 48.50 2k78 s LEU 66 CO -0.10 -0.35 0.00 -1.22 -0.00 0.00 0.00 176.35 174.69 2k78 n TYR 67 N 1.70 0.00 -3.62 3.48 4.02 0.36 -4.11 117.16 118.98 2k78 n TYR 67 Ca -0.14 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.71 2k78 n TYR 67 Cb 0.56 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.87 2k78 n TYR 67 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2k78 s VAL 68 N -1.02 0.00 -0.03 -0.72 0.11 -0.91 -2.24 120.40 115.59 2k78 s VAL 68 Ca 0.00 -0.27 -0.01 0.00 -2.93 0.00 0.00 61.98 58.77 2k78 s VAL 68 Cb 0.00 -1.53 0.02 0.00 -1.53 0.00 0.00 36.38 33.34 2k78 s VAL 68 CO 0.00 0.00 0.05 0.00 -3.33 0.00 0.00 175.10 171.82 2k78 s GLN 69 N -2.93 0.01 -0.06 1.54 -2.07 -0.03 -1.02 119.66 115.11 2k78 s GLN 69 Ca 0.10 0.17 0.02 0.00 -1.82 0.00 0.00 55.36 53.83 2k78 s GLN 69 Cb 0.00 -0.14 -0.03 0.00 -1.09 0.00 0.00 33.01 31.75 2k78 s GLN 69 CO -0.04 -0.11 -0.09 0.42 -1.32 0.00 0.00 175.29 174.15 2k78 s ILE 70 N 0.72 3.49 -0.02 3.63 1.09 -0.91 -2.91 121.20 126.30 2k78 s ILE 70 Ca -0.06 -0.58 -0.20 0.00 -1.10 0.00 0.00 60.65 58.71 2k78 s ILE 70 Cb -0.08 -2.42 -0.05 0.00 -1.06 0.00 0.00 42.46 38.85 2k78 s ILE 70 CO -0.02 0.58 0.59 -0.89 -0.10 0.00 0.00 174.94 175.09 2k78 s THR 71 N -0.80 4.96 -0.22 2.92 2.01 -1.26 -2.27 115.64 120.97 2k78 s THR 71 Ca 0.12 1.22 -0.09 0.00 0.31 0.00 0.00 61.69 63.26 2k78 s THR 71 Cb -0.11 -3.92 -0.04 0.00 0.01 0.00 0.00 72.50 68.43 2k78 s THR 71 CO 0.02 0.40 0.11 -0.69 -0.69 0.00 0.00 174.62 173.76 2k78 s VAL 72 N -0.02 5.01 -0.21 3.82 1.01 0.41 -3.84 120.40 126.58 2k78 s VAL 72 Ca 0.31 0.05 -0.11 0.00 0.00 0.00 0.00 61.98 62.24 2k78 s VAL 72 Cb -0.18 -3.31 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 2k78 s VAL 72 CO 0.16 0.39 0.16 0.20 0.00 0.00 0.00 175.10 176.02 2k78 s ASN 73 N 0.82 6.20 -0.62 3.32 -0.87 -1.15 -2.39 114.94 120.25 2k78 s ASN 73 Ca 0.06 0.22 -0.00 0.00 -1.57 0.00 0.00 52.86 51.56 2k78 s ASN 73 Cb -0.13 -2.11 -0.00 0.00 -0.02 0.00 0.00 41.25 38.99 2k78 s ASN 73 CO 0.02 0.12 0.59 1.57 -2.57 0.00 0.00 177.10 176.83 2k78 n HIS 74 N 3.86 -2.49 0.20 2.20 -0.00 -1.03 -4.72 115.22 113.23 2k78 n HIS 74 Ca -0.15 0.95 0.15 0.00 0.46 0.00 0.00 57.72 59.13 2k78 n HIS 74 Cb 0.52 -3.69 0.77 0.00 -0.12 0.00 0.00 29.99 27.47 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 0.38 0.00 -0.97 0.26 0.02 -1.81 -1.75 113.55 109.69 2k78 h SER 75 Ca -0.00 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 61.04 2k78 h SER 75 Cb 1.00 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.47 2k78 h SER 75 CO 0.25 0.00 0.62 -0.74 -1.14 0.00 0.00 176.83 175.82 2k78 h HIS 76 N 0.00 1.10 0.00 3.45 -0.00 -1.93 -3.06 115.15 114.72 2k78 h HIS 76 Ca 0.08 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.46 2k78 h HIS 76 Cb 0.37 -0.36 -0.00 0.00 -0.00 0.00 0.00 27.41 27.42 2k78 h HIS 76 CO 0.00 0.51 -0.13 -1.49 -0.00 0.00 0.00 177.93 176.82 2k78 h TRP 77 N 1.02 0.00 -3.41 5.26 4.06 -1.57 -3.42 115.95 117.89 2k78 h TRP 77 Ca 0.45 0.00 -0.59 0.00 2.06 0.00 0.00 58.89 60.80 2k78 h TRP 77 Cb 0.35 0.00 -0.09 0.00 -1.00 0.00 0.00 29.16 28.42 2k78 h TRP 77 CO -0.00 0.78 0.14 -1.50 -3.56 0.00 0.00 178.44 174.30 2k78 s ILE 78 N -2.08 5.01 0.00 1.49 2.07 -1.12 -3.10 121.20 123.47 2k78 s ILE 78 Ca -0.15 1.21 0.11 0.00 -1.41 0.00 0.00 60.65 60.41 2k78 s ILE 78 Cb -0.01 -3.96 -0.22 0.00 0.13 0.00 0.00 42.46 38.40 2k78 s ILE 78 CO 0.51 0.10 0.86 0.00 -1.91 0.00 0.00 174.94 174.49 2k78 h THR 79 N 5.20 1.09 -1.81 4.00 1.03 -1.55 -3.41 112.91 117.46 2k78 h THR 79 Ca -0.31 -2.88 0.33 0.00 -0.01 0.00 0.00 66.41 63.54 2k78 h THR 79 Cb 1.14 2.53 -0.09 0.00 -1.07 0.00 0.00 68.15 70.66 2k78 h THR 79 CO 0.78 0.62 0.86 -0.83 -0.01 0.00 0.00 175.52 176.94 2k78 s GLY 80 N -4.97 -0.25 -0.25 2.99 0.00 -1.18 -4.94 107.32 98.72 2k78 s GLY 80 Ca -0.03 0.34 -0.03 0.00 0.00 0.00 0.00 44.72 45.00 2k78 s GLY 80 CO 0.82 2.92 0.40 1.06 0.00 0.00 0.00 173.10 178.31 2k78 s MET 81 N -2.20 0.37 0.46 2.90 -1.94 -1.26 -2.69 119.30 114.94 2k78 s MET 81 Ca 0.22 0.61 -0.09 0.00 -1.71 0.00 0.00 55.69 54.73 2k78 s MET 81 Cb 0.02 -0.33 -0.05 0.00 2.01 0.00 0.00 34.83 36.48 2k78 s MET 81 CO -0.02 -0.62 0.81 -1.12 -0.01 0.00 0.00 175.02 174.05 2k78 s SER 82 N 2.58 6.40 -0.02 3.03 0.01 0.50 -4.24 113.70 121.96 2k78 s SER 82 Ca 0.13 1.09 -0.18 0.00 1.31 0.00 0.00 55.95 58.30 2k78 s SER 82 Cb -0.15 -2.31 0.03 0.00 0.21 0.00 0.00 66.02 63.80 2k78 s SER 82 CO -0.16 -0.52 0.37 -0.63 0.41 0.00 0.00 173.24 172.71 2k78 s ILE 83 N -2.60 0.05 -0.83 1.44 1.01 -0.65 -0.34 121.20 119.29 2k78 s ILE 83 Ca 0.50 -0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.76 2k78 s ILE 83 Cb -0.10 -0.68 0.00 0.00 0.01 0.00 0.00 42.46 41.69 2k78 s ILE 83 CO 0.39 -0.22 0.00 -0.62 0.00 0.00 0.00 174.94 174.49 2k78 n GLU 84 N 1.21 -1.62 -0.73 2.79 -0.58 -0.82 -1.49 120.64 119.39 2k78 n GLU 84 Ca -0.21 0.75 0.00 0.00 -0.42 0.00 0.00 57.16 57.28 2k78 n GLU 84 Cb 0.56 -5.09 0.00 0.00 -0.57 0.00 0.00 31.44 26.34 2k78 n GLU 84 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k78 n GLY 85 N 0.13 0.55 3.15 0.62 0.00 -1.26 -5.06 105.19 103.32 2k78 n GLY 85 Ca -0.08 -0.80 -0.10 0.00 0.00 0.00 0.00 46.02 45.05 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 0.82 1.05 1.61 -3.43 -0.56 -5.16 115.29 107.63 2k78 s HIS 86 Ca 0.00 -1.02 -0.16 0.00 -0.80 0.00 0.00 55.06 53.09 2k78 s HIS 86 Cb 0.00 -0.50 0.22 0.00 -1.43 0.00 0.00 32.58 30.87 2k78 s HIS 86 CO 0.00 -0.27 1.15 0.15 -2.00 0.00 0.00 174.74 173.76 2k78 s LYS 87 N -3.90 -0.03 0.39 -0.38 3.01 -1.26 -1.63 119.74 115.95 2k78 s LYS 87 Ca 0.13 0.07 0.06 0.00 -1.01 0.00 0.00 55.97 55.23 2k78 s LYS 87 Cb 0.06 -1.72 0.00 0.00 -1.01 0.00 0.00 37.83 35.16 2k78 s LYS 87 CO -0.04 -2.94 0.54 -1.83 0.51 0.00 0.00 175.35 171.59 2k78 s GLU 88 N -5.37 2.96 -0.07 1.68 -1.05 -1.26 -4.69 118.70 110.90 2k78 s GLU 88 Ca 0.69 -1.05 0.05 0.00 -0.15 0.00 0.00 54.97 54.50 2k78 s GLU 88 Cb -0.12 -2.76 -0.01 0.00 -0.44 0.00 0.00 34.13 30.80 2k78 s GLU 88 CO 0.55 -0.15 -0.22 1.21 0.95 0.00 0.00 175.26 177.61 2k78 s ASN 89 N -4.26 3.32 -0.57 0.83 3.84 -1.25 -4.98 114.94 111.87 2k78 s ASN 89 Ca 0.50 -0.45 -0.27 0.00 0.21 0.00 0.00 52.86 52.86 2k78 s ASN 89 Cb -0.10 -0.98 -0.03 0.00 -0.55 0.00 0.00 41.25 39.60 2k78 s ASN 89 CO 0.33 0.24 1.95 0.27 -2.79 0.00 0.00 177.10 177.10 2k78 s ILE 90 N -0.14 3.30 -0.13 -5.21 -4.36 -1.26 -3.22 121.20 110.18 2k78 s ILE 90 Ca -0.03 0.19 0.19 0.00 -0.26 0.00 0.00 60.65 60.73 2k78 s ILE 90 Cb -0.14 -3.77 -0.23 0.00 1.25 0.00 0.00 42.46 39.58 2k78 s ILE 90 CO 0.04 -0.73 0.46 0.00 0.24 0.00 0.00 174.94 174.95 2k78 n ILE 91 N 7.36 0.94 -3.07 8.37 3.06 -1.11 -4.87 119.36 130.03 2k78 n ILE 91 Ca 0.23 -0.70 0.03 0.00 -2.50 0.00 0.00 62.75 59.81 2k78 n ILE 91 Cb 0.52 -0.44 -0.00 0.00 0.54 0.00 0.00 39.64 40.26 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 -5.34 -0.98 0.02 9.51 0.01 -1.25 -4.97 113.70 110.71 2k78 s SER 92 Ca -0.07 -0.18 -0.08 0.00 1.31 0.00 0.00 55.95 56.93 2k78 s SER 92 Cb 0.09 1.43 -0.05 0.00 0.21 0.00 0.00 66.02 67.70 2k78 s SER 92 CO 0.84 -0.14 0.31 -0.75 0.41 0.00 0.00 173.24 173.91 2k78 s LYS 93 N 2.41 3.65 -0.33 12.44 2.20 -1.26 -1.89 119.74 136.96 2k78 s LYS 93 Ca 0.17 0.04 -0.00 0.00 -0.36 0.00 0.00 55.97 55.82 2k78 s LYS 93 Cb -0.03 -3.08 0.13 0.00 -1.51 0.00 0.00 37.83 33.35 2k78 s LYS 93 CO -0.18 0.64 0.24 1.21 -0.36 0.00 0.00 175.35 176.90 2k78 s ASN 94 N -1.62 2.50 0.28 1.43 3.04 0.04 -4.95 114.94 115.65 2k78 s ASN 94 Ca 0.28 -1.66 0.26 0.00 0.04 0.00 0.00 52.86 51.78 2k78 s ASN 94 Cb -0.14 -0.04 0.83 0.00 -1.54 0.00 0.00 41.25 40.36 2k78 s ASN 94 CO 0.16 -0.34 1.75 0.71 -3.04 0.00 0.00 177.10 176.34 2k78 h THR 95 N 5.50 0.00 0.00 -5.21 1.35 -1.96 -0.20 112.91 112.39 2k78 h THR 95 Ca -0.03 -0.49 -0.02 0.00 -0.55 0.00 0.00 66.41 65.32 2k78 h THR 95 Cb 1.01 1.42 -0.00 0.00 -1.73 0.00 0.00 68.15 68.85 2k78 h THR 95 CO 0.30 0.00 -0.11 0.00 -0.25 0.00 0.00 175.52 175.45 2k78 h ALA 96 N 2.35 1.61 0.00 6.62 0.00 -1.94 -3.17 119.26 124.74 2k78 h ALA 96 Ca 0.00 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 2k78 h ALA 96 Cb 0.66 -0.02 -0.18 0.00 0.00 0.00 0.00 17.79 18.26 2k78 h ALA 96 CO 0.00 0.14 -0.70 1.63 0.00 0.00 0.00 179.25 180.32 2k78 n LYS 97 N -4.12 0.27 -3.35 0.00 5.02 -1.20 -5.03 118.16 109.75 2k78 n LYS 97 Ca -0.02 -1.82 -0.11 0.00 -2.02 0.00 0.00 58.31 54.34 2k78 n LYS 97 Cb 0.20 -0.47 0.00 0.00 -0.02 0.00 0.00 35.03 34.74 2k78 n LYS 97 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2k78 n ASP 98 N -0.00 -6.61 -3.84 4.39 8.00 -0.98 -4.84 116.55 112.66 2k78 n ASP 98 Ca 0.06 -0.39 -0.09 0.00 0.71 0.00 0.00 54.79 55.08 2k78 n ASP 98 Cb 0.90 -3.81 -0.07 0.00 -0.02 0.00 0.00 41.12 38.12 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 -3.71 0.90 -0.00 -1.24 2.02 -0.12 -2.47 118.70 114.07 2k78 s GLU 99 Ca 0.03 -0.95 -0.29 0.00 0.02 0.00 0.00 54.97 53.77 2k78 s GLU 99 Cb -0.00 0.36 0.10 0.00 0.10 0.00 0.00 34.13 34.68 2k78 s GLU 99 CO 0.81 -0.30 0.98 0.50 0.02 0.00 0.00 175.26 177.28 2k78 s ARG 100 N -3.87 0.79 0.05 1.61 3.52 -1.01 -0.78 118.95 119.27 2k78 s ARG 100 Ca 0.06 -0.34 -0.03 0.00 -0.13 0.00 0.00 55.73 55.28 2k78 s ARG 100 Cb 0.04 0.33 -0.02 0.00 -1.56 0.00 0.00 34.95 33.74 2k78 s ARG 100 CO -0.10 -0.35 0.04 0.99 -0.81 0.00 0.00 175.30 175.06 2k78 s THR 101 N -3.00 0.18 -0.06 4.11 2.01 -0.79 0.16 115.64 118.25 2k78 s THR 101 Ca 0.08 -1.45 -0.04 0.00 0.31 0.00 0.00 61.69 60.59 2k78 s THR 101 Cb -0.01 -1.22 0.02 0.00 0.01 0.00 0.00 72.50 71.31 2k78 s THR 101 CO -0.06 -0.80 0.15 -0.94 -0.69 0.00 0.00 174.62 172.28 2k78 s SER 102 N -2.58 -0.14 -0.04 3.53 1.04 -0.96 -2.77 113.70 111.78 2k78 s SER 102 Ca 0.02 0.30 -0.16 0.00 0.48 0.00 0.00 55.95 56.58 2k78 s SER 102 Cb 0.04 0.27 -0.05 0.00 0.10 0.00 0.00 66.02 66.37 2k78 s SER 102 CO -0.08 -0.08 0.42 -0.70 0.98 0.00 0.00 173.24 173.78 2k78 s GLU 103 N 0.40 4.07 0.03 4.02 2.12 -1.20 -2.14 118.70 126.01 2k78 s GLU 103 Ca -0.03 0.41 0.05 0.00 0.36 0.00 0.00 54.97 55.76 2k78 s GLU 103 Cb -0.04 -3.30 -0.02 0.00 0.26 0.00 0.00 34.13 31.03 2k78 s GLU 103 CO -0.02 0.51 -0.14 -0.06 -0.54 0.00 0.00 175.26 175.01 2k78 s PHE 104 N -0.49 1.25 -0.21 5.30 0.08 -0.18 -3.86 117.98 119.86 2k78 s PHE 104 Ca 0.24 -0.33 -0.09 0.00 0.12 0.00 0.00 56.93 56.87 2k78 s PHE 104 Cb -0.16 -0.76 -0.05 0.00 -0.57 0.00 0.00 43.02 41.48 2k78 s PHE 104 CO 0.12 0.02 0.12 -2.00 -0.10 0.00 0.00 175.22 173.39 2k78 s GLU 105 N -0.95 4.08 0.14 0.44 2.12 -1.26 -2.15 118.70 121.11 2k78 s GLU 105 Ca 0.03 -0.28 -0.10 0.00 0.36 0.00 0.00 54.97 54.99 2k78 s GLU 105 Cb -0.07 -3.41 -0.00 0.00 0.26 0.00 0.00 34.13 30.91 2k78 s GLU 105 CO 0.01 0.20 0.26 0.14 -0.54 0.00 0.00 175.26 175.33 2k78 s VAL 106 N 0.64 0.09 -0.41 3.70 -7.23 -1.26 -4.84 120.40 111.10 2k78 s VAL 106 Ca 0.07 -1.24 -0.29 0.00 -1.81 0.00 0.00 61.98 58.71 2k78 s VAL 106 Cb -0.12 -1.61 0.00 0.00 0.56 0.00 0.00 36.38 35.21 2k78 s VAL 106 CO 0.01 -0.42 1.49 -0.44 -0.31 0.00 0.00 175.10 175.43 2k78 s SER 107 N -2.92 6.22 0.44 4.85 0.01 -1.26 -4.77 113.70 116.28 2k78 s SER 107 Ca 0.12 0.87 0.00 0.00 1.31 0.00 0.00 55.95 58.25 2k78 s SER 107 Cb 0.04 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2k78 s SER 107 CO -0.05 -1.52 0.00 0.29 0.41 0.00 0.00 173.24 172.37 2k78 n LYS 108 N 8.20 0.00 -2.95 12.44 4.76 -1.26 -4.59 118.16 134.76 2k78 n LYS 108 Ca 0.18 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.48 2k78 n LYS 108 Cb 0.48 0.00 0.03 0.00 -1.84 0.00 0.00 35.03 33.70 2k78 n LYS 108 CO 0.00 0.00 0.00 1.47 -1.37 0.00 0.00 177.40 177.50 2k78 n LEU 109 N 0.00 -0.90 -3.24 -0.35 -0.00 -1.26 -4.95 117.00 106.30 2k78 n LEU 109 Ca 0.00 -4.30 -0.20 0.00 -0.00 0.00 0.00 56.01 51.52 2k78 n LEU 109 Cb 0.00 0.83 -0.07 0.00 -0.00 0.00 0.00 43.42 44.18 2k78 n LEU 109 CO 0.00 2.17 -0.19 0.21 -0.00 0.00 0.00 177.39 179.58 2k78 s ASN 110 N -1.79 0.75 0.00 1.45 3.84 -1.26 -0.97 114.94 116.96 2k78 s ASN 110 Ca 0.31 -2.47 0.00 0.00 0.21 0.00 0.00 52.86 50.90 2k78 s ASN 110 Cb 0.31 0.29 0.00 0.00 -0.55 0.00 0.00 41.25 41.30 2k78 s ASN 110 CO -0.07 -0.16 0.00 0.61 -2.79 0.00 0.00 177.10 174.69 2k78 n GLY 111 N 3.14 2.03 3.81 1.21 0.00 -0.74 -4.97 105.19 109.67 2k78 n GLY 111 Ca 0.23 -1.23 -0.35 0.00 0.00 0.00 0.00 46.02 44.67 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 -1.99 4.35 0.02 1.61 -2.85 -1.26 -1.78 119.74 117.85 2k78 s LYS 112 Ca 0.00 1.07 0.00 0.00 -1.00 0.00 0.00 55.97 56.04 2k78 s LYS 112 Cb 0.00 -2.66 -0.02 0.00 -2.06 0.00 0.00 37.83 33.08 2k78 s LYS 112 CO 0.00 0.24 -0.04 0.42 0.10 0.00 0.00 175.35 176.07 2k78 s ILE 113 N -1.74 0.18 0.32 3.79 1.01 -0.58 -4.93 121.20 119.25 2k78 s ILE 113 Ca 0.51 -0.93 -0.27 0.00 0.00 0.00 0.00 60.65 59.96 2k78 s ILE 113 Cb -0.15 -0.31 -0.09 0.00 0.01 0.00 0.00 42.46 41.91 2k78 s ILE 113 CO 0.20 -0.48 1.03 -1.81 0.00 0.00 0.00 174.94 173.89 2k78 s ASP 114 N -1.46 7.18 -0.12 3.58 1.11 -1.26 -0.76 116.67 124.93 2k78 s ASP 114 Ca -0.15 2.07 -0.06 0.00 0.18 0.00 0.00 52.55 54.59 2k78 s ASP 114 Cb -0.10 -2.60 0.05 0.00 1.07 0.00 0.00 42.92 41.34 2k78 s ASP 114 CO -0.01 -0.19 0.29 -0.83 1.18 0.00 0.00 175.17 175.60 2k78 s GLY 115 N -1.27 -0.18 0.49 0.21 0.00 -1.06 -1.95 107.32 103.56 2k78 s GLY 115 Ca 0.49 1.11 0.02 0.00 0.00 0.00 0.00 44.72 46.34 2k78 s GLY 115 CO 0.32 1.51 0.70 0.54 0.00 0.00 0.00 173.10 176.17 2k78 s LYS 116 N 1.55 2.76 -0.26 2.90 1.02 0.54 -0.56 119.74 127.68 2k78 s LYS 116 Ca -0.07 -0.79 -0.18 0.00 0.02 0.00 0.00 55.97 54.95 2k78 s LYS 116 Cb -0.10 -2.57 0.07 0.00 -0.52 0.00 0.00 37.83 34.71 2k78 s LYS 116 CO -0.09 -0.48 0.66 -1.50 -0.92 0.00 0.00 175.35 173.02 2k78 s ILE 117 N -2.61 -0.00 0.31 2.17 2.07 0.22 0.19 121.20 123.54 2k78 s ILE 117 Ca 0.54 0.01 0.08 0.00 -1.41 0.00 0.00 60.65 59.86 2k78 s ILE 117 Cb -0.10 -0.95 -0.03 0.00 0.13 0.00 0.00 42.46 41.51 2k78 s ILE 117 CO 0.37 0.00 0.22 -1.81 -1.91 0.00 0.00 174.94 171.81 2k78 s ASP 118 N 1.11 5.20 0.02 4.50 1.01 -1.09 0.11 116.67 127.53 2k78 s ASP 118 Ca -0.06 -0.48 -0.06 0.00 0.71 0.00 0.00 52.55 52.65 2k78 s ASP 118 Cb -0.05 -1.04 -0.01 0.00 1.01 0.00 0.00 42.92 42.83 2k78 s ASP 118 CO -0.11 -0.23 0.11 -0.69 0.21 0.00 0.00 175.17 174.46 2k78 s VAL 119 N -2.28 0.11 -0.22 -1.27 1.01 -1.04 -1.96 120.40 114.75 2k78 s VAL 119 Ca 0.38 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.40 2k78 s VAL 119 Cb -0.06 -0.68 0.12 0.00 0.00 0.00 0.00 36.38 35.76 2k78 s VAL 119 CO 0.25 -0.50 0.38 -0.47 0.00 0.00 0.00 175.10 174.76 2k78 s TYR 120 N -2.07 -0.79 0.05 5.22 6.14 -1.18 -2.80 117.35 121.92 2k78 s TYR 120 Ca -0.09 1.05 0.01 0.00 0.64 0.00 0.00 57.07 58.67 2k78 s TYR 120 Cb -0.04 0.10 -0.03 0.00 0.42 0.00 0.00 41.96 42.41 2k78 s TYR 120 CO -0.02 -0.62 -0.05 0.42 0.64 0.00 0.00 175.55 175.92 2k78 s ILE 121 N 2.56 0.35 -0.32 3.14 1.09 0.60 -4.58 121.20 124.04 2k78 s ILE 121 Ca 0.08 -1.31 0.06 0.00 -1.10 0.00 0.00 60.65 58.37 2k78 s ILE 121 Cb -0.14 -0.86 0.19 0.00 -1.06 0.00 0.00 42.46 40.59 2k78 s ILE 121 CO -0.14 -0.63 0.57 1.51 -0.10 0.00 0.00 174.94 176.15 2k78 s ASP 122 N -2.06 -1.30 0.00 3.58 1.47 -1.26 0.17 116.67 117.28 2k78 s ASP 122 Ca -0.05 -0.19 -0.02 0.00 1.18 0.00 0.00 52.55 53.47 2k78 s ASP 122 Cb -0.04 1.87 0.01 0.00 -0.34 0.00 0.00 42.92 44.42 2k78 s ASP 122 CO -0.03 -0.27 0.08 -1.84 0.68 0.00 0.00 175.17 173.79 2k78 n GLU 123 N 5.10 0.02 -3.76 2.11 0.28 -1.07 -5.01 120.64 118.32 2k78 n GLU 123 Ca 0.06 -0.07 -0.38 0.00 -0.16 0.00 0.00 57.16 56.62 2k78 n GLU 123 Cb 0.54 0.11 -0.12 0.00 1.43 0.00 0.00 31.44 33.39 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 -2.00 2.76 -0.51 3.44 3.01 -1.26 -0.78 119.74 124.40 2k78 s LYS 124 Ca 0.02 -1.08 -0.28 0.00 -1.01 0.00 0.00 55.97 53.61 2k78 s LYS 124 Cb -0.00 -3.43 0.02 0.00 -1.01 0.00 0.00 37.83 33.41 2k78 s LYS 124 CO 0.00 -0.60 1.33 0.08 0.51 0.00 0.00 175.35 176.68 2k78 s VAL 125 N 1.43 3.93 -1.49 3.17 1.01 0.29 -3.78 120.40 124.96 2k78 s VAL 125 Ca -0.00 0.88 -0.14 0.00 0.00 0.00 0.00 61.98 62.72 2k78 s VAL 125 Cb -0.19 -4.44 0.11 0.00 0.00 0.00 0.00 36.38 31.86 2k78 s VAL 125 CO 0.03 -1.05 0.70 -3.20 0.00 0.00 0.00 175.10 171.58 2k78 n ASN 126 N 8.88 -3.83 -0.19 3.32 4.05 -1.26 -1.76 115.26 124.48 2k78 n ASN 126 Ca 0.13 -0.69 0.00 0.00 0.45 0.00 0.00 54.58 54.47 2k78 n ASN 126 Cb 0.49 -3.13 0.00 0.00 1.23 0.00 0.00 39.78 38.37 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 -1.36 1.02 2.64 8.20 0.00 -1.25 -5.06 105.19 109.38 2k78 n GLY 127 Ca 0.03 -0.29 -0.22 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.09 0.61 0.03 1.61 1.02 -0.72 -5.08 119.74 115.11 2k78 s LYS 128 Ca 0.00 -1.06 -0.30 0.00 0.02 0.00 0.00 55.97 54.63 2k78 s LYS 128 Cb 0.00 -0.95 -0.08 0.00 -0.52 0.00 0.00 37.83 36.28 2k78 s LYS 128 CO 0.00 -1.20 1.80 -1.25 -0.92 0.00 0.00 175.35 173.78 2k78 s PRO 129 N 1.27 4.16 0.17 -1.68 0.04 -1.26 -0.55 135.00 137.16 2k78 s PRO 129 Ca 0.17 2.44 -0.08 0.00 0.04 0.00 0.00 61.00 63.58 2k78 s PRO 129 Cb -0.18 -3.95 -0.02 0.00 0.04 0.00 0.00 34.50 30.39 2k78 s PRO 129 CO -0.01 -0.87 0.26 -0.59 0.04 0.00 0.00 177.00 175.83 2k78 s PHE 130 N 3.82 0.53 -0.10 0.56 -0.71 0.04 -4.95 117.98 117.17 2k78 s PHE 130 Ca 0.81 -0.88 -0.02 0.00 -1.04 0.00 0.00 56.93 55.80 2k78 s PHE 130 Cb -0.40 -0.13 0.04 0.00 -1.21 0.00 0.00 43.02 41.32 2k78 s PHE 130 CO 0.36 -0.72 0.02 0.15 -1.34 0.00 0.00 175.22 173.68 2k78 s LYS 131 N -4.00 0.57 -0.15 1.99 -0.14 -1.26 -2.60 119.74 114.15 2k78 s LYS 131 Ca 0.21 -0.01 -0.07 0.00 -1.36 0.00 0.00 55.97 54.74 2k78 s LYS 131 Cb 0.04 -1.26 -0.04 0.00 -1.68 0.00 0.00 37.83 34.89 2k78 s LYS 131 CO 0.03 -0.40 0.09 -0.47 -0.76 0.00 0.00 175.35 173.84 2k78 s TYR 132 N 1.96 3.37 -0.35 3.18 5.04 0.13 -4.91 117.35 125.77 2k78 s TYR 132 Ca 0.04 0.29 -0.06 0.00 -2.44 0.00 0.00 57.07 54.89 2k78 s TYR 132 Cb -0.13 -2.00 0.20 0.00 0.35 0.00 0.00 41.96 40.38 2k78 s TYR 132 CO -0.06 0.42 1.04 0.34 -1.34 0.00 0.00 175.55 175.96 2k78 s ASP 133 N -0.31 -0.42 0.00 4.32 2.15 -1.24 -0.29 116.67 120.88 2k78 s ASP 133 Ca 0.10 -0.39 0.00 0.00 0.43 0.00 0.00 52.55 52.69 2k78 s ASP 133 Cb -0.12 0.54 0.00 0.00 -0.30 0.00 0.00 42.92 43.04 2k78 s ASP 133 CO 0.01 -0.03 0.00 1.57 -0.17 0.00 0.00 175.17 176.56 2k78 n HIS 134 N 3.04 -0.16 -4.44 -5.34 -0.00 -1.12 -5.00 115.22 102.20 2k78 n HIS 134 Ca 0.10 0.00 -0.25 0.00 0.46 0.00 0.00 57.72 58.03 2k78 n HIS 134 Cb 0.63 0.00 -0.11 0.00 -0.12 0.00 0.00 29.99 30.40 2k78 n HIS 134 CO 0.00 0.00 0.00 -3.38 0.46 0.00 0.00 176.34 173.42 2k78 s HIS 135 N -3.43 2.27 0.35 1.57 -3.43 -1.26 -2.49 115.29 108.87 2k78 s HIS 135 Ca 0.00 -0.35 -0.09 0.00 -0.80 0.00 0.00 55.06 53.82 2k78 s HIS 135 Cb 0.00 -1.06 0.03 0.00 -1.43 0.00 0.00 32.58 30.13 2k78 s HIS 135 CO 0.00 0.60 0.61 0.66 -2.00 0.00 0.00 174.74 174.61 2k78 n TYR 136 N -0.16 -1.89 -3.89 0.38 4.01 0.30 -4.95 117.16 110.95 2k78 n TYR 136 Ca -0.09 -1.92 -0.09 0.00 -0.16 0.00 0.00 57.90 55.64 2k78 n TYR 136 Cb 0.58 0.71 -0.06 0.00 -0.31 0.00 0.00 39.34 40.26 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 -2.96 -0.08 0.13 7.72 4.22 -1.26 0.70 114.94 123.41 2k78 s ASN 137 Ca 0.20 -0.75 -0.19 0.00 -2.14 0.00 0.00 52.86 49.97 2k78 s ASN 137 Cb -0.03 0.50 0.05 0.00 1.28 0.00 0.00 41.25 43.05 2k78 s ASN 137 CO 0.15 -0.98 0.49 0.27 -2.04 0.00 0.00 177.10 174.99 2k78 s ILE 138 N -3.94 0.04 -0.26 0.54 -4.36 0.28 -4.57 121.20 108.92 2k78 s ILE 138 Ca 0.15 -0.32 -0.19 0.00 -0.26 0.00 0.00 60.65 60.04 2k78 s ILE 138 Cb 0.01 -1.08 -0.02 0.00 1.25 0.00 0.00 42.46 42.62 2k78 s ILE 138 CO 0.00 -0.17 0.55 -0.89 0.24 0.00 0.00 174.94 174.67 2k78 s THR 139 N -3.61 5.04 0.53 8.37 2.01 -0.37 -2.56 115.64 125.06 2k78 s THR 139 Ca 0.01 0.94 -0.02 0.00 0.31 0.00 0.00 61.69 62.93 2k78 s THR 139 Cb 0.00 -3.86 0.01 0.00 0.01 0.00 0.00 72.50 68.66 2k78 s THR 139 CO -0.11 0.06 0.79 -0.31 -0.69 0.00 0.00 174.62 174.36 2k78 s TYR 140 N 2.37 3.16 -0.29 4.92 2.02 0.06 -0.05 117.35 129.54 2k78 s TYR 140 Ca 0.23 0.35 0.02 0.00 -0.37 0.00 0.00 57.07 57.30 2k78 s TYR 140 Cb -0.16 -2.58 0.18 0.00 -0.40 0.00 0.00 41.96 39.01 2k78 s TYR 140 CO 0.09 -0.66 0.54 0.15 -1.57 0.00 0.00 175.55 174.10 2k78 s LYS 141 N -4.78 0.52 0.28 -0.62 -0.14 0.46 -1.53 119.74 113.94 2k78 s LYS 141 Ca 0.52 0.62 -0.05 0.00 -1.36 0.00 0.00 55.97 55.70 2k78 s LYS 141 Cb -0.10 0.18 -0.05 0.00 -1.68 0.00 0.00 37.83 36.18 2k78 s LYS 141 CO 0.41 -0.88 0.55 -0.06 -0.76 0.00 0.00 175.35 174.61 2k78 s PHE 142 N 2.77 3.47 -0.31 3.18 0.08 -0.73 -0.32 117.98 126.11 2k78 s PHE 142 Ca 0.13 0.66 -0.02 0.00 0.12 0.00 0.00 56.93 57.82 2k78 s PHE 142 Cb -0.12 -2.11 0.12 0.00 -0.57 0.00 0.00 43.02 40.33 2k78 s PHE 142 CO -0.24 0.18 0.19 -0.80 -0.10 0.00 0.00 175.22 174.45 2k78 s ASN 143 N -3.09 2.92 0.00 1.36 0.01 0.46 -1.80 114.94 114.80 2k78 s ASN 143 Ca 0.44 -1.44 0.00 0.00 -0.71 0.00 0.00 52.86 51.15 2k78 s ASN 143 Cb -0.11 -0.15 0.00 0.00 0.41 0.00 0.00 41.25 41.40 2k78 s ASN 143 CO 0.29 -0.39 0.00 0.61 -1.51 0.00 0.00 177.10 176.10 2k78 n GLY 144 N 4.90 4.27 3.24 0.66 0.00 -0.15 -2.52 105.19 115.59 2k78 n GLY 144 Ca 0.00 -0.82 -0.29 0.00 0.00 0.00 0.00 46.02 44.91 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 -4.32 0.19 1.61 -0.04 -1.26 -4.74 135.00 126.43 2k78 n PRO 145 Ca 0.00 -1.28 0.00 0.00 -0.04 0.00 0.00 63.50 62.18 2k78 n PRO 145 Cb 0.00 -1.92 0.00 0.00 -0.04 0.00 0.00 33.50 31.54 2k78 n PRO 145 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2k78 n THR 146 N -5.61 0.00 -0.04 0.52 -2.24 -1.26 -4.37 114.28 101.27 2k78 n THR 146 Ca 0.11 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.87 2k78 n THR 146 Cb 0.57 -0.27 -0.01 0.00 -2.10 0.00 0.00 70.33 68.52 2k78 n THR 146 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2k78 h ASP 147 N 0.00 0.00 -5.84 3.42 5.19 -2.04 -3.49 116.42 113.66 2k78 h ASP 147 Ca 0.00 0.00 -0.35 0.00 -0.62 0.00 0.00 57.03 56.06 2k78 h ASP 147 Cb 0.00 0.00 0.13 0.00 0.18 0.00 0.00 39.33 39.64 2k78 h ASP 147 CO 0.00 0.46 -0.86 0.52 -3.12 0.00 0.00 179.24 176.25 2k78 n VAL 148 N -3.89 -6.59 0.16 -1.35 0.31 -1.26 -4.89 118.33 100.82 2k78 n VAL 148 Ca -0.03 -0.89 0.07 0.00 -0.01 0.00 0.00 64.34 63.48 2k78 n VAL 148 Cb 0.12 -5.01 0.07 0.00 -0.91 0.00 0.00 33.84 28.11 2k78 n VAL 148 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k78 h ALA 149 N 0.55 0.79 0.00 3.52 0.00 -2.06 -3.52 119.26 118.54 2k78 h ALA 149 Ca -0.62 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.03 2k78 h ALA 149 Cb 1.34 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2k78 h ALA 149 CO 0.49 0.34 0.00 0.41 0.00 0.00 0.00 179.25 180.49