#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r78 n THR 6 N 0.00 0.00 0.84 2.61 -2.24 -1.26 -3.86 114.28 110.37 2r78 n THR 6 Ca 0.00 -0.22 0.10 0.00 -2.27 0.00 0.00 64.05 61.66 2r78 n THR 6 Cb 0.00 0.44 0.06 0.00 -2.10 0.00 0.00 70.33 68.72 2r78 n THR 6 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2r78 n GLU 7 N -0.04 1.69 -2.47 -0.78 0.28 -1.26 -4.68 120.64 113.39 2r78 n GLU 7 Ca 0.18 -1.44 -0.29 0.00 -0.16 0.00 0.00 57.16 55.45 2r78 n GLU 7 Cb 0.34 -1.38 -0.01 0.00 1.43 0.00 0.00 31.44 31.83 2r78 n GLU 7 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2r78 s ASN 8 N -1.83 6.32 0.25 -1.84 4.22 -1.25 -4.93 114.94 115.88 2r78 s ASN 8 Ca 0.21 1.12 -0.06 0.00 -2.14 0.00 0.00 52.86 52.00 2r78 s ASN 8 Cb 0.16 -2.33 0.28 0.00 1.28 0.00 0.00 41.25 40.64 2r78 s ASN 8 CO 0.33 -0.62 1.92 -0.07 -2.04 0.00 0.00 177.10 176.61 2r78 h LEU 9 N 0.31 1.11 -0.21 3.54 3.38 -1.94 -1.64 115.31 119.86 2r78 h LEU 9 Ca -0.46 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.42 2r78 h LEU 9 Cb 1.20 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.68 2r78 h LEU 9 CO 0.62 0.78 -0.13 1.88 0.09 0.00 0.00 178.44 181.68 2r78 h TYR 10 N 1.30 0.54 -0.34 1.13 0.05 -1.97 -0.87 116.97 116.81 2r78 h TYR 10 Ca 0.38 -0.14 0.07 0.00 0.05 0.00 0.00 58.73 59.08 2r78 h TYR 10 Cb -0.09 -0.12 -0.07 0.00 1.01 0.00 0.00 36.73 37.47 2r78 h TYR 10 CO -0.00 0.77 -0.11 0.35 -1.05 0.00 0.00 178.16 178.11 2r78 h PHE 11 N 0.15 -0.26 -0.84 4.88 3.57 -1.79 -0.08 116.94 122.58 2r78 h PHE 11 Ca 0.04 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 2r78 h PHE 11 Cb 0.65 0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.51 2r78 h PHE 11 CO 0.07 -0.18 0.40 1.96 -2.23 0.00 0.00 178.31 178.33 2r78 h GLN 12 N -0.04 1.21 -0.43 1.11 4.20 -1.11 0.50 115.11 120.55 2r78 h GLN 12 Ca 0.17 -0.18 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 2r78 h GLN 12 Cb 0.30 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 2r78 h GLN 12 CO -0.37 0.93 -0.00 0.66 -0.67 0.00 0.00 178.83 179.38 2r78 h SER 13 N 1.20 0.74 -0.51 1.46 4.64 -0.78 -0.01 113.55 120.29 2r78 h SER 13 Ca 0.29 -0.31 0.06 0.00 -0.47 0.00 0.00 61.79 61.36 2r78 h SER 13 Cb 0.12 -0.20 -0.05 0.00 -0.31 0.00 0.00 62.40 61.96 2r78 h SER 13 CO -0.04 0.87 0.21 0.78 -0.87 0.00 0.00 176.83 177.79 2r78 h ASN 14 N 0.60 0.26 -0.53 4.97 -0.26 -0.41 -2.26 115.58 117.94 2r78 h ASN 14 Ca 0.12 0.05 -0.07 0.00 -0.56 0.00 0.00 56.30 55.84 2r78 h ASN 14 Cb 0.49 0.01 -0.02 0.00 -1.06 0.00 0.00 38.32 37.74 2r78 h ASN 14 CO 0.02 0.18 0.07 0.00 -1.06 0.00 0.00 177.43 176.64 2r78 h ALA 15 N 1.32 1.04 -0.00 -0.83 0.00 -0.67 -2.09 119.26 118.02 2r78 h ALA 15 Ca 0.24 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.91 2r78 h ALA 15 Cb 0.22 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2r78 h ALA 15 CO -0.21 0.61 -0.10 -0.92 0.00 0.00 0.00 179.25 178.63 2r78 h TYR 16 N 0.88 -0.26 -0.52 0.00 3.20 -0.57 0.13 116.97 119.83 2r78 h TYR 16 Ca 0.18 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.02 2r78 h TYR 16 Cb 0.42 0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 2r78 h TYR 16 CO 0.03 -0.16 0.18 0.00 -1.64 0.00 0.00 178.16 176.57 2r78 h ARG 17 N -0.17 0.76 -0.16 1.82 3.08 -0.99 0.21 114.38 118.92 2r78 h ARG 17 Ca 0.04 -0.12 -0.09 0.00 0.07 0.00 0.00 59.98 59.87 2r78 h ARG 17 Cb 0.22 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 2r78 h ARG 17 CO -0.11 0.65 -0.26 0.00 -1.07 0.00 0.00 179.97 179.18 2r78 h ALA 18 N 1.45 0.25 -0.65 0.04 0.00 -1.11 -2.10 119.26 117.14 2r78 h ALA 18 Ca 0.17 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2r78 h ALA 18 Cb 0.19 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2r78 h ALA 18 CO -0.01 0.24 0.17 1.25 0.00 0.00 0.00 179.25 180.89 2r78 h LEU 19 N 0.10 0.99 0.06 0.00 5.85 -0.31 -0.09 115.31 121.90 2r78 h LEU 19 Ca 0.01 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.51 2r78 h LEU 19 Cb 0.83 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 2r78 h LEU 19 CO 0.06 0.96 -0.09 0.15 -0.34 0.00 0.00 178.44 179.17 2r78 h PHE 20 N 0.97 -0.23 -0.59 1.25 3.57 -0.61 0.10 116.94 121.39 2r78 h PHE 20 Ca 0.21 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 2r78 h PHE 20 Cb 0.35 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.16 2r78 h PHE 20 CO 0.03 -0.14 0.33 1.49 -2.23 0.00 0.00 178.31 177.79 2r78 h GLU 21 N -0.19 0.82 0.00 1.11 4.81 -1.09 -3.33 114.58 116.71 2r78 h GLU 21 Ca 0.02 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 2r78 h GLU 21 Cb 0.20 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.42 2r78 h GLU 21 CO -0.05 0.62 -0.98 0.72 -0.73 0.00 0.00 179.01 178.59 2r78 n HIS 22 N -4.59 0.00 -1.68 0.92 8.25 -0.07 -4.55 115.22 113.50 2r78 n HIS 22 Ca 0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.08 2r78 n HIS 22 Cb 0.08 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 31.19 2r78 n HIS 22 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2r78 n ALA 23 N -1.49 1.03 0.08 -1.41 0.00 0.32 -4.92 120.51 114.12 2r78 n ALA 23 Ca 0.04 0.29 -0.22 0.00 0.00 0.00 0.00 53.44 53.55 2r78 n ALA 23 Cb 0.32 -2.22 -0.12 0.00 0.00 0.00 0.00 19.45 17.43 2r78 n ALA 23 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2r78 h ILE 24 N 2.10 1.28 -4.21 0.00 5.03 -1.93 -3.42 117.51 116.37 2r78 h ILE 24 Ca -0.46 -2.43 -0.51 0.00 -0.12 0.00 0.00 64.86 61.34 2r78 h ILE 24 Cb 1.30 2.63 0.11 0.00 -3.03 0.00 0.00 36.82 37.83 2r78 h ILE 24 CO 0.60 0.74 0.37 -1.81 -0.68 0.00 0.00 178.15 177.37 2r78 s ASP 25 N -7.40 4.97 0.29 1.72 1.01 -1.26 -4.83 116.67 111.17 2r78 s ASP 25 Ca -0.09 2.01 -0.29 0.00 0.71 0.00 0.00 52.55 54.89 2r78 s ASP 25 Cb 0.06 -2.55 -0.10 0.00 1.01 0.00 0.00 42.92 41.34 2r78 s ASP 25 CO 0.93 -1.73 1.15 -0.83 0.21 0.00 0.00 175.17 174.90 2r78 s GLY 26 N -2.60 3.05 -0.04 0.21 0.00 -0.13 -4.73 107.32 103.08 2r78 s GLY 26 Ca 0.67 0.98 0.02 0.00 0.00 0.00 0.00 44.72 46.39 2r78 s GLY 26 CO 0.43 1.59 -0.07 -0.42 0.00 0.00 0.00 173.10 174.63 2r78 s ILE 27 N -1.16 0.69 0.05 0.90 1.01 -1.26 -0.78 121.20 120.65 2r78 s ILE 27 Ca 0.45 -0.25 0.03 0.00 0.00 0.00 0.00 60.65 60.88 2r78 s ILE 27 Cb -0.34 -0.66 -0.03 0.00 0.01 0.00 0.00 42.46 41.45 2r78 s ILE 27 CO 0.44 0.24 -0.09 0.72 0.00 0.00 0.00 174.94 176.25 2r78 s PHE 28 N 0.58 0.77 0.36 3.97 -0.12 -0.44 -1.45 117.98 121.65 2r78 s PHE 28 Ca -0.09 -0.53 0.07 0.00 -0.05 0.00 0.00 56.93 56.33 2r78 s PHE 28 Cb -0.12 -0.45 -0.07 0.00 -0.63 0.00 0.00 43.02 41.74 2r78 s PHE 28 CO 0.01 -0.07 -0.02 0.42 -0.05 0.00 0.00 175.22 175.51 2r78 s ILE 29 N -1.59 1.88 0.50 -4.49 -1.09 0.01 0.12 121.20 116.54 2r78 s ILE 29 Ca -0.07 -2.06 0.06 0.00 -2.23 0.00 0.00 60.65 56.35 2r78 s ILE 29 Cb -0.09 -2.81 0.02 0.00 -1.58 0.00 0.00 42.46 38.00 2r78 s ILE 29 CO 0.00 -0.09 0.39 1.51 -1.23 0.00 0.00 174.94 175.53 2r78 s ASP 31 N -3.62 4.73 0.33 3.58 1.47 -0.65 0.33 116.67 122.85 2r78 s ASP 31 Ca 0.34 -1.09 0.26 0.00 1.18 0.00 0.00 52.55 53.24 2r78 s ASP 31 Cb 0.07 0.08 1.07 0.00 -0.34 0.00 0.00 42.92 43.80 2r78 s ASP 31 CO 0.16 -0.95 1.78 0.00 0.68 0.00 0.00 175.17 176.85 2r78 h ALA 32 N 0.86 1.00 -0.01 2.11 0.00 -1.91 -1.53 119.26 119.78 2r78 h ALA 32 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2r78 h ALA 32 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2r78 h ALA 32 CO 0.58 0.00 -0.09 0.39 0.00 0.00 0.00 179.25 180.13 2r78 n GLU 33 N -2.46 1.37 -0.56 0.00 4.71 -1.26 -4.95 120.64 117.49 2r78 n GLU 33 Ca 0.02 -0.80 0.00 0.00 -0.01 0.00 0.00 57.16 56.37 2r78 n GLU 33 Cb 0.26 -1.48 0.00 0.00 -1.01 0.00 0.00 31.44 29.20 2r78 n GLU 33 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2r78 n GLY 34 N 1.24 0.71 3.68 0.62 0.00 -0.58 -4.91 105.19 105.94 2r78 n GLY 34 Ca 0.17 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 2r78 n GLY 34 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2r78 s HIS 35 N -2.00 3.30 0.13 1.61 3.76 -1.26 -0.49 115.29 120.33 2r78 s HIS 35 Ca 0.00 1.39 -0.31 0.00 -0.15 0.00 0.00 55.06 55.99 2r78 s HIS 35 Cb 0.00 -3.31 -0.10 0.00 1.11 0.00 0.00 32.58 30.28 2r78 s HIS 35 CO 0.00 -0.76 1.65 0.71 -0.85 0.00 0.00 174.74 175.49 2r78 s TYR 36 N 2.60 2.69 -0.15 1.40 2.02 -1.13 -1.63 117.35 123.15 2r78 s TYR 36 Ca 0.50 0.40 0.13 0.00 -0.37 0.00 0.00 57.07 57.72 2r78 s TYR 36 Cb -0.19 -4.00 -0.18 0.00 -0.40 0.00 0.00 41.96 37.19 2r78 s TYR 36 CO 0.15 -3.87 0.04 1.28 -1.57 0.00 0.00 175.55 171.58 2r78 n LEU 37 N 4.79 0.18 -3.53 -1.29 4.77 0.15 -4.68 117.00 117.39 2r78 n LEU 37 Ca 0.15 -0.01 -0.14 0.00 -0.03 0.00 0.00 56.01 55.99 2r78 n LEU 37 Cb 0.39 0.31 -0.05 0.00 -2.33 0.00 0.00 43.42 41.74 2r78 n LEU 37 CO 0.63 0.40 0.33 -0.62 -1.33 0.00 0.00 177.39 176.80 2r78 s ASP 38 N -4.91 -0.51 -0.08 -1.43 -1.08 -1.00 -4.98 116.67 102.68 2r78 s ASP 38 Ca -0.09 0.22 -0.11 0.00 -0.52 0.00 0.00 52.55 52.05 2r78 s ASP 38 Cb 0.05 0.53 0.03 0.00 -1.46 0.00 0.00 42.92 42.06 2r78 s ASP 38 CO 0.61 -0.76 0.29 0.68 0.52 0.00 0.00 175.17 176.50 2r78 s VAL 39 N -2.56 0.02 0.57 1.11 -7.23 -1.26 -0.81 120.40 110.24 2r78 s VAL 39 Ca -0.05 -0.19 -0.01 0.00 -1.81 0.00 0.00 61.98 59.93 2r78 s VAL 39 Cb -0.01 -0.48 0.03 0.00 0.56 0.00 0.00 36.38 36.49 2r78 s VAL 39 CO -0.03 -0.11 0.82 0.54 -0.31 0.00 0.00 175.10 176.02 2r78 s ASN 40 N -0.39 5.25 0.29 4.85 4.22 -0.53 -4.89 114.94 123.73 2r78 s ASN 40 Ca -0.05 0.14 0.01 0.00 -2.14 0.00 0.00 52.86 50.81 2r78 s ASN 40 Cb -0.03 -1.01 0.52 0.00 1.28 0.00 0.00 41.25 42.00 2r78 s ASN 40 CO 0.02 -1.19 1.87 -0.65 -2.04 0.00 0.00 177.10 175.11 2r78 h PRO 41 N -0.04 1.01 -0.48 3.55 0.11 -1.80 -2.33 132.00 132.02 2r78 h PRO 41 Ca -0.43 -0.06 0.07 0.00 0.11 0.00 0.00 66.00 65.69 2r78 h PRO 41 Cb 1.29 -0.23 -0.06 0.00 0.11 0.00 0.00 31.00 32.12 2r78 h PRO 41 CO 0.55 0.67 0.14 0.00 -0.21 0.00 0.00 178.00 179.14 2r78 h ALA 42 N 1.51 0.56 -0.27 -0.75 0.00 -1.85 -0.57 119.26 117.89 2r78 h ALA 42 Ca 0.44 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.37 2r78 h ALA 42 Cb 0.32 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2r78 h ALA 42 CO -0.20 -0.26 -0.07 0.82 0.00 0.00 0.00 179.25 179.53 2r78 h ILE 43 N 0.29 1.28 -0.30 0.00 2.04 -1.75 -1.52 117.51 117.55 2r78 h ILE 43 Ca 0.23 -1.10 0.03 0.00 1.00 0.00 0.00 64.86 65.02 2r78 h ILE 43 Cb 0.27 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.78 2r78 h ILE 43 CO -0.27 0.35 0.12 0.00 0.00 0.00 0.00 178.15 178.34 2r78 h SER 45 N 0.26 0.48 -0.36 0.00 0.02 -1.06 -1.54 113.55 111.35 2r78 h SER 45 Ca 0.13 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.06 2r78 h SER 45 Cb 0.09 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 2r78 h SER 45 CO -0.13 0.34 0.15 0.00 -1.14 0.00 0.00 176.83 176.06 2r78 h ALA 46 N 1.17 0.46 -0.02 3.77 0.00 -0.90 -3.29 119.26 120.46 2r78 h ALA 46 Ca 0.17 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2r78 h ALA 46 Cb -0.04 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2r78 h ALA 46 CO -0.05 0.05 -0.32 0.44 0.00 0.00 0.00 179.25 179.37 2r78 n ILE 47 N -4.70 0.00 -1.87 0.00 -5.35 -0.62 -4.99 119.36 101.83 2r78 n ILE 47 Ca -0.01 -0.34 -0.05 0.00 -0.27 0.00 0.00 62.75 62.08 2r78 n ILE 47 Cb 0.13 1.33 -0.01 0.00 -1.74 0.00 0.00 39.64 39.35 2r78 n ILE 47 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2r78 n GLY 48 N 1.37 0.30 3.57 3.28 0.00 -0.59 -1.47 105.19 111.66 2r78 n GLY 48 Ca 0.10 -0.70 -0.30 0.00 0.00 0.00 0.00 46.02 45.12 2r78 n GLY 48 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2r78 s TYR 49 N -2.25 2.75 0.74 1.61 1.51 -1.15 -4.62 117.35 115.93 2r78 s TYR 49 Ca 0.00 -0.15 -0.11 0.00 -1.01 0.00 0.00 57.07 55.80 2r78 s TYR 49 Cb 0.00 -1.45 0.03 0.00 -0.11 0.00 0.00 41.96 40.43 2r78 s TYR 49 CO 0.00 0.41 1.08 0.95 -1.11 0.00 0.00 175.55 176.88 2r78 s THR 50 N -1.18 3.54 0.20 -0.71 -4.23 -1.26 -4.50 115.64 107.49 2r78 s THR 50 Ca 0.21 0.50 -0.11 0.00 -1.18 0.00 0.00 61.69 61.11 2r78 s THR 50 Cb -0.11 -3.32 0.13 0.00 1.34 0.00 0.00 72.50 70.55 2r78 s THR 50 CO 0.13 -0.65 1.73 -0.09 -0.54 0.00 0.00 174.62 175.20 2r78 h ARG 51 N -0.84 0.33 -0.78 3.99 2.43 -1.96 -1.36 114.38 116.20 2r78 h ARG 51 Ca -0.45 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 58.68 2r78 h ARG 51 Cb 1.24 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.68 2r78 h ARG 51 CO 0.60 0.22 0.45 -0.44 -1.51 0.00 0.00 179.97 179.28 2r78 h ASP 52 N 0.34 0.96 -0.60 -3.80 5.19 -1.99 -0.87 116.42 115.66 2r78 h ASP 52 Ca 0.29 -0.08 -0.05 0.00 -0.62 0.00 0.00 57.03 56.56 2r78 h ASP 52 Cb 0.37 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 39.61 2r78 h ASP 52 CO -0.32 0.76 0.19 -0.33 -3.12 0.00 0.00 179.24 176.43 2r78 h GLU 53 N 1.07 0.97 -0.28 3.56 5.08 -1.83 -2.58 114.58 120.57 2r78 h GLU 53 Ca 0.28 -0.19 -0.10 0.00 -1.00 0.00 0.00 59.36 58.34 2r78 h GLU 53 Cb 0.00 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 2r78 h GLU 53 CO -0.05 0.84 -0.25 0.35 -1.00 0.00 0.00 179.01 178.90 2r78 h PHE 54 N 0.94 0.63 0.00 4.33 -0.00 -0.70 -2.54 116.94 119.60 2r78 h PHE 54 Ca 0.21 -0.14 0.00 0.00 -0.00 0.00 0.00 57.97 58.04 2r78 h PHE 54 Cb 0.28 -0.15 0.00 0.00 -0.00 0.00 0.00 35.95 36.08 2r78 h PHE 54 CO 0.02 0.76 0.00 1.28 -0.00 0.00 0.00 178.31 180.37 2r78 n LEU 55 N -4.11 0.00 -0.19 0.59 4.32 -0.38 -1.29 117.00 115.94 2r78 n LEU 55 Ca -0.00 0.29 0.12 0.00 -0.02 0.00 0.00 56.01 56.40 2r78 n LEU 55 Cb 0.42 -0.29 0.23 0.00 -1.62 0.00 0.00 43.42 42.16 2r78 n LEU 55 CO 0.43 -0.12 0.47 0.00 -1.22 0.00 0.00 177.39 176.94 2r78 n ALA 56 N -1.29 3.47 -2.34 -1.18 0.00 -0.96 -4.75 120.51 113.47 2r78 n ALA 56 Ca 0.08 -0.45 -0.30 0.00 0.00 0.00 0.00 53.44 52.77 2r78 n ALA 56 Cb 0.14 -1.04 -0.04 0.00 0.00 0.00 0.00 19.45 18.51 2r78 n ALA 56 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2r78 s LEU 57 N -2.69 3.99 0.15 0.00 1.43 -0.41 -5.03 118.68 116.10 2r78 s LEU 57 Ca 0.18 0.95 0.09 0.00 -1.03 0.00 0.00 54.13 54.32 2r78 s LEU 57 Cb 0.18 -3.79 -0.04 0.00 0.03 0.00 0.00 46.19 42.58 2r78 s LEU 57 CO 0.62 -0.26 -0.12 -1.81 0.23 0.00 0.00 176.35 175.01 2r78 s ASP 58 N -2.97 4.18 -0.14 2.29 1.01 -1.26 -2.82 116.67 116.97 2r78 s ASP 58 Ca 0.48 -0.54 -0.40 0.00 0.71 0.00 0.00 52.55 52.80 2r78 s ASP 58 Cb -0.11 -0.69 -0.18 0.00 1.01 0.00 0.00 42.92 42.95 2r78 s ASP 58 CO 0.28 0.14 1.42 1.87 0.21 0.00 0.00 175.17 179.09 2r78 n TRP 59 N 0.37 1.47 0.00 4.23 -0.00 0.35 -2.25 117.44 121.61 2r78 n TRP 59 Ca -0.13 0.82 0.00 0.00 -0.00 0.00 0.00 57.50 58.19 2r78 n TRP 59 Cb 0.54 -2.28 0.00 0.00 -0.00 0.00 0.00 31.31 29.57 2r78 n TRP 59 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2r78 n GLY 60 N 2.95 1.90 0.09 5.87 0.00 -1.26 -4.86 105.19 109.88 2r78 n GLY 60 Ca 0.23 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.13 2r78 n GLY 60 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2r78 h VAL 61 N 0.00 1.26 -0.64 1.61 2.07 -1.83 0.11 116.25 118.84 2r78 h VAL 61 Ca 0.00 -0.84 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 2r78 h VAL 61 Cb 0.00 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 2r78 h VAL 61 CO 0.00 0.24 0.32 -0.07 0.02 0.00 0.00 177.57 178.08 2r78 h LEU 62 N -0.12 0.81 -3.05 2.57 3.38 -1.91 -2.70 115.31 114.28 2r78 h LEU 62 Ca 0.03 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2r78 h LEU 62 Cb 0.37 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2r78 h LEU 62 CO 0.01 0.68 0.00 -1.54 0.09 0.00 0.00 178.44 177.67 2r78 n SER 63 N -4.36 4.68 -3.82 -0.43 3.41 -1.19 -1.49 113.62 110.41 2r78 n SER 63 Ca 0.06 -2.40 -0.29 0.00 -0.26 0.00 0.00 58.87 55.98 2r78 n SER 63 Cb 0.12 -0.57 0.01 0.00 -0.26 0.00 0.00 64.21 63.51 2r78 n SER 63 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2r78 n ARG 64 N 1.19 -2.26 -0.09 4.33 1.74 -0.76 -4.86 116.66 115.95 2r78 n ARG 64 Ca 0.26 0.42 0.05 0.00 -0.77 0.00 0.00 57.85 57.81 2r78 n ARG 64 Cb 0.86 -4.26 0.10 0.00 -1.02 0.00 0.00 32.46 28.14 2r78 n ARG 64 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2r78 n GLY 65 N -1.83 3.80 0.06 -0.13 0.00 0.32 -4.70 105.19 102.71 2r78 n GLY 65 Ca -0.20 -0.58 -0.08 0.00 0.00 0.00 0.00 46.02 45.16 2r78 n GLY 65 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2r78 h VAL 66 N 0.40 1.00 -0.58 1.61 2.07 -1.90 0.22 116.25 119.06 2r78 h VAL 66 Ca 0.00 -1.75 -0.00 0.00 0.82 0.00 0.00 66.70 65.77 2r78 h VAL 66 Cb 0.81 1.90 -0.03 0.00 -1.52 0.00 0.00 31.29 32.45 2r78 h VAL 66 CO 0.02 0.34 0.36 0.44 0.02 0.00 0.00 177.57 178.75 2r78 h ASP 67 N -1.00 0.69 0.29 0.57 3.32 -1.94 -1.77 116.42 116.58 2r78 h ASP 67 Ca -0.00 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.00 2r78 h ASP 67 Cb 0.56 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.94 2r78 h ASP 67 CO -0.00 0.53 0.00 0.77 -1.72 0.00 0.00 179.24 178.82 2r78 h SER 68 N 0.78 0.00 0.00 6.45 4.64 -1.84 -3.45 113.55 120.13 2r78 h SER 68 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2r78 h SER 68 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 2r78 h SER 68 CO -0.04 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.53 2r78 n GLY 69 N -0.79 1.16 0.32 -0.77 0.00 -0.67 -4.96 105.19 99.48 2r78 n GLY 69 Ca -0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.02 2r78 n GLY 69 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2r78 h TRP 70 N 0.00 0.96 0.11 1.61 7.01 -1.66 -1.60 115.95 122.39 2r78 h TRP 70 Ca 0.00 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.02 2r78 h TRP 70 Cb 0.00 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 26.75 2r78 h TRP 70 CO 0.00 0.48 -0.06 0.00 -2.79 0.00 0.00 178.44 176.07 2r78 h ALA 71 N 1.41 -0.15 -0.28 2.65 0.00 -0.87 0.39 119.26 122.40 2r78 h ALA 71 Ca 0.38 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2r78 h ALA 71 Cb 0.20 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2r78 h ALA 71 CO -0.18 -0.54 0.18 0.00 0.00 0.00 0.00 179.25 178.71 2r78 h ALA 72 N 0.62 0.36 -0.19 0.00 0.00 -1.78 -1.63 119.26 116.63 2r78 h ALA 72 Ca -0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2r78 h ALA 72 Cb 0.21 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2r78 h ALA 72 CO 0.03 -0.17 0.06 0.00 0.00 0.00 0.00 179.25 179.16 2r78 h ALA 73 N 1.10 0.25 -0.48 0.00 0.00 -1.15 -1.30 119.26 117.68 2r78 h ALA 73 Ca 0.10 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2r78 h ALA 73 Cb -0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2r78 h ALA 73 CO -0.02 -0.12 -0.02 0.66 0.00 0.00 0.00 179.25 179.74 2r78 h SER 74 N 0.13 0.85 -0.23 0.00 4.64 -0.88 -2.24 113.55 115.82 2r78 h SER 74 Ca 0.06 -0.32 0.04 0.00 -0.47 0.00 0.00 61.79 61.10 2r78 h SER 74 Cb 0.23 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 2r78 h SER 74 CO -0.00 0.97 0.01 0.25 -0.87 0.00 0.00 176.83 177.19 2r78 h LEU 75 N 0.72 -0.06 -0.69 5.97 5.85 -1.22 -1.36 115.31 124.53 2r78 h LEU 75 Ca 0.13 0.05 0.09 0.00 0.84 0.00 0.00 57.88 58.99 2r78 h LEU 75 Cb 0.54 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.58 2r78 h LEU 75 CO 0.03 -0.00 0.34 0.00 -0.34 0.00 0.00 178.44 178.47 2r78 h ALA 76 N 1.19 0.94 -0.21 1.25 0.00 -1.02 0.07 119.26 121.47 2r78 h ALA 76 Ca 0.11 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2r78 h ALA 76 Cb 0.13 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2r78 h ALA 76 CO -0.17 -0.05 0.13 0.00 0.00 0.00 0.00 179.25 179.16 2r78 h ARG 77 N 0.59 0.29 -0.02 0.00 3.08 -1.00 -0.28 114.38 117.03 2r78 h ARG 77 Ca 0.33 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.36 2r78 h ARG 77 Cb 0.34 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.33 2r78 h ARG 77 CO -0.26 0.22 0.01 0.82 -1.07 0.00 0.00 179.97 179.69 2r78 h ILE 78 N 0.27 1.00 -0.40 2.04 2.04 -0.63 -0.65 117.51 121.19 2r78 h ILE 78 Ca 0.08 -0.01 -0.04 0.00 1.00 0.00 0.00 64.86 65.89 2r78 h ILE 78 Cb -0.00 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 2r78 h ILE 78 CO -0.02 0.00 0.07 0.58 0.00 0.00 0.00 178.15 178.79 2r78 h VAL 79 N 0.02 1.19 0.00 1.67 2.07 -0.91 -0.97 116.25 119.32 2r78 h VAL 79 Ca 0.01 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 66.81 2r78 h VAL 79 Cb -0.00 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 2r78 h VAL 79 CO -0.00 0.26 0.00 0.61 0.02 0.00 0.00 177.57 178.45 2r78 n GLY 80 N -0.95 -0.91 0.00 2.17 0.00 -0.13 -4.89 105.19 100.47 2r78 n GLY 80 Ca 0.02 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2r78 n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r78 n GLY 81 N 0.41 1.10 3.23 -0.02 0.00 -0.37 -5.06 105.19 104.48 2r78 n GLY 81 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 2r78 n GLY 81 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2r78 s GLU 82 N -0.18 2.45 0.45 1.61 2.12 -0.29 -5.02 118.70 119.85 2r78 s GLU 82 Ca 0.00 -1.49 -0.25 0.00 0.36 0.00 0.00 54.97 53.59 2r78 s GLU 82 Cb 0.00 -3.64 -0.08 0.00 0.26 0.00 0.00 34.13 30.66 2r78 s GLU 82 CO 0.00 -0.92 1.37 -2.30 -0.54 0.00 0.00 175.26 172.87 2r78 n PRO 83 N 4.80 2.07 -3.08 4.30 -0.02 -1.26 -3.46 135.00 138.36 2r78 n PRO 83 Ca -0.09 0.74 -0.39 0.00 -2.02 0.00 0.00 63.50 61.74 2r78 n PRO 83 Cb 0.43 -2.54 -0.05 0.00 -0.02 0.00 0.00 33.50 31.31 2r78 n PRO 83 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2r78 s LEU 84 N -2.43 4.44 -0.24 2.45 0.20 -0.33 -4.92 118.68 117.86 2r78 s LEU 84 Ca 0.62 1.33 -0.03 0.00 0.69 0.00 0.00 54.13 56.75 2r78 s LEU 84 Cb -0.46 -3.10 0.12 0.00 -0.43 0.00 0.00 46.19 42.32 2r78 s LEU 84 CO 0.57 0.07 0.33 -0.60 -0.29 0.00 0.00 176.35 176.43 2r78 s ARG 85 N -0.20 0.31 -0.23 1.98 3.52 -1.26 -1.63 118.95 121.45 2r78 s ARG 85 Ca 0.35 0.40 -0.27 0.00 -0.13 0.00 0.00 55.73 56.08 2r78 s ARG 85 Cb -0.20 -0.69 0.11 0.00 -1.56 0.00 0.00 34.95 32.61 2r78 s ARG 85 CO 0.21 -0.67 0.93 -2.00 -0.81 0.00 0.00 175.30 172.95 2r78 s GLU 86 N 2.48 0.65 0.29 5.12 2.12 -0.51 -5.01 118.70 123.84 2r78 s GLU 86 Ca 0.11 0.55 -0.22 0.00 0.36 0.00 0.00 54.97 55.76 2r78 s GLU 86 Cb -0.15 0.31 -0.09 0.00 0.26 0.00 0.00 34.13 34.46 2r78 s GLU 86 CO -0.16 -0.12 0.84 -1.21 -0.54 0.00 0.00 175.26 174.06 2r78 s GLU 87 N -0.18 4.36 -0.01 4.30 2.02 -1.26 -0.07 118.70 127.86 2r78 s GLU 87 Ca -0.00 1.06 -0.01 0.00 0.02 0.00 0.00 54.97 56.04 2r78 s GLU 87 Cb -0.03 -2.73 0.00 0.00 0.10 0.00 0.00 34.13 31.46 2r78 s GLU 87 CO -0.01 0.28 0.03 1.03 0.02 0.00 0.00 175.26 176.61 2r78 s ARG 88 N -2.22 0.03 -0.06 1.61 1.81 -0.02 -4.91 118.95 115.19 2r78 s ARG 88 Ca 0.49 0.04 -0.27 0.00 -1.72 0.00 0.00 55.73 54.27 2r78 s ARG 88 Cb -0.16 0.00 -0.03 0.00 -0.45 0.00 0.00 34.95 34.32 2r78 s ARG 88 CO 0.21 -0.01 0.87 0.99 -0.68 0.00 0.00 175.30 176.68 2r78 s THR 89 N 0.06 4.92 0.11 0.02 2.01 -1.26 -1.43 115.64 120.07 2r78 s THR 89 Ca -0.00 1.80 0.08 0.00 0.31 0.00 0.00 61.69 63.87 2r78 s THR 89 Cb -0.01 -4.20 -0.04 0.00 0.01 0.00 0.00 72.50 68.26 2r78 s THR 89 CO -0.00 0.15 -0.14 0.68 -0.69 0.00 0.00 174.62 174.62 2r78 s VAL 90 N 1.24 3.14 -0.18 3.82 -7.23 0.66 -4.29 120.40 117.57 2r78 s VAL 90 Ca 0.45 -1.36 -0.04 0.00 -1.81 0.00 0.00 61.98 59.21 2r78 s VAL 90 Cb -0.19 -2.45 -0.03 0.00 0.56 0.00 0.00 36.38 34.27 2r78 s VAL 90 CO 0.21 0.11 -0.02 0.26 -0.31 0.00 0.00 175.10 175.35 2r78 s TRP 91 N -1.18 3.03 0.80 2.82 0.51 -0.56 -1.14 118.94 123.23 2r78 s TRP 91 Ca 0.20 -0.39 -0.12 0.00 -2.12 0.00 0.00 56.10 53.67 2r78 s TRP 91 Cb -0.11 -2.02 0.08 0.00 -0.81 0.00 0.00 33.47 30.61 2r78 s TRP 91 CO 0.12 -0.14 1.17 0.95 -0.51 0.00 0.00 176.95 178.53 2r78 s THR 92 N 0.68 2.02 0.31 2.01 -4.23 0.12 -4.90 115.64 111.65 2r78 s THR 92 Ca -0.01 -0.02 0.08 0.00 -1.18 0.00 0.00 61.69 60.55 2r78 s THR 92 Cb -0.14 -3.00 0.31 0.00 1.34 0.00 0.00 72.50 71.00 2r78 s THR 92 CO 0.02 0.00 1.71 -0.09 -0.54 0.00 0.00 174.62 175.72 2r78 h ARG 93 N -1.02 0.46 -0.17 3.99 9.65 -1.51 0.27 114.38 126.04 2r78 h ARG 93 Ca -0.46 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.39 2r78 h ARG 93 Cb 1.33 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.81 2r78 h ARG 93 CO 0.65 0.30 0.00 0.09 2.80 0.00 0.00 179.97 183.82 2r78 n ASN 94 N -4.98 1.75 0.00 -3.80 4.13 -1.26 -4.91 115.26 106.19 2r78 n ASN 94 Ca 0.26 -1.71 0.00 0.00 1.68 0.00 0.00 54.58 54.80 2r78 n ASN 94 Cb 0.74 -0.10 0.00 0.00 -1.54 0.00 0.00 39.78 38.88 2r78 n ASN 94 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2r78 n GLY 95 N 1.15 0.75 3.82 7.41 0.00 0.08 -5.07 105.19 113.34 2r78 n GLY 95 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 2r78 n GLY 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2r78 s ASP 96 N -2.51 6.00 -0.01 1.61 1.01 -1.26 -4.71 116.67 116.79 2r78 s ASP 96 Ca 0.00 1.68 -0.11 0.00 0.71 0.00 0.00 52.55 54.83 2r78 s ASP 96 Cb 0.00 -2.51 -0.05 0.00 1.01 0.00 0.00 42.92 41.36 2r78 s ASP 96 CO 0.00 -1.02 0.33 -1.10 0.21 0.00 0.00 175.17 173.58 2r78 s GLN 97 N -4.33 3.73 0.04 8.23 -0.21 -1.26 0.13 119.66 125.99 2r78 s GLN 97 Ca 0.61 0.18 0.07 0.00 0.02 0.00 0.00 55.36 56.24 2r78 s GLN 97 Cb -0.13 -3.16 -0.02 0.00 1.00 0.00 0.00 33.01 30.69 2r78 s GLN 97 CO 0.40 0.69 -0.20 -0.51 -2.12 0.00 0.00 175.29 173.54 2r78 s LEU 98 N -1.29 2.16 -0.15 2.90 1.02 -0.29 -4.95 118.68 118.07 2r78 s LEU 98 Ca 0.24 -0.51 -0.03 0.00 0.02 0.00 0.00 54.13 53.85 2r78 s LEU 98 Cb -0.15 -0.95 -0.02 0.00 0.02 0.00 0.00 46.19 45.09 2r78 s LEU 98 CO 0.12 0.15 -0.06 -0.89 0.02 0.00 0.00 176.35 175.70 2r78 s THR 99 N -0.79 3.63 0.14 5.49 2.01 -1.26 -0.24 115.64 124.62 2r78 s THR 99 Ca 0.07 -0.45 0.05 0.00 0.31 0.00 0.00 61.69 61.68 2r78 s THR 99 Cb -0.09 -2.58 -0.04 0.00 0.01 0.00 0.00 72.50 69.80 2r78 s THR 99 CO 0.02 0.49 -0.12 0.68 -0.69 0.00 0.00 174.62 175.00 2r78 s VAL 100 N 0.45 1.29 -0.23 3.82 -7.23 -0.51 -2.64 120.40 115.35 2r78 s VAL 100 Ca -0.05 -1.94 -0.12 0.00 -1.81 0.00 0.00 61.98 58.05 2r78 s VAL 100 Cb -0.15 -1.74 -0.05 0.00 0.56 0.00 0.00 36.38 35.01 2r78 s VAL 100 CO 0.03 -0.60 0.24 -0.70 -0.31 0.00 0.00 175.10 173.76 2r78 s GLU 101 N -3.31 4.09 -0.12 4.82 2.12 0.15 -0.84 118.70 125.61 2r78 s GLU 101 Ca 0.14 -0.12 -0.07 0.00 0.36 0.00 0.00 54.97 55.28 2r78 s GLU 101 Cb -0.01 -3.55 -0.04 0.00 0.26 0.00 0.00 34.13 30.79 2r78 s GLU 101 CO 0.02 0.00 0.13 -0.51 -0.54 0.00 0.00 175.26 174.37 2r78 s LEU 102 N 1.21 4.36 0.01 2.70 1.43 0.89 -0.82 118.68 128.46 2r78 s LEU 102 Ca 0.11 0.46 0.06 0.00 -1.03 0.00 0.00 54.13 53.73 2r78 s LEU 102 Cb -0.14 -2.06 -0.02 0.00 0.03 0.00 0.00 46.19 44.00 2r78 s LEU 102 CO 0.06 0.41 -0.18 -0.44 0.23 0.00 0.00 176.35 176.43 2r78 s SER 103 N -1.02 2.11 -0.08 2.29 0.01 -0.56 -1.42 113.70 115.03 2r78 s SER 103 Ca 0.15 -0.40 -0.06 0.00 1.31 0.00 0.00 55.95 56.95 2r78 s SER 103 Cb -0.12 -0.20 0.03 0.00 0.21 0.00 0.00 66.02 65.94 2r78 s SER 103 CO 0.04 0.17 0.20 0.00 0.41 0.00 0.00 173.24 174.05 2r78 s ALA 104 N -0.59 -0.46 -0.04 1.44 0.00 -0.64 -0.78 121.76 120.69 2r78 s ALA 104 Ca 0.06 0.66 0.02 0.00 0.00 0.00 0.00 51.96 52.70 2r78 s ALA 104 Cb -0.07 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.65 2r78 s ALA 104 CO 0.00 -0.12 -0.07 -1.01 0.00 0.00 0.00 175.76 174.56 2r78 s HIS 105 N 0.51 0.90 0.00 0.00 3.76 -0.23 -1.18 115.29 119.05 2r78 s HIS 105 Ca -0.03 -0.25 -0.30 0.00 -0.15 0.00 0.00 55.06 54.33 2r78 s HIS 105 Cb -0.05 -0.69 -0.04 0.00 1.11 0.00 0.00 32.58 32.91 2r78 s HIS 105 CO -0.03 -0.15 1.16 -1.17 -0.85 0.00 0.00 174.74 173.71 2r78 s LEU 106 N 0.49 4.33 0.40 0.89 2.96 -1.26 -1.10 118.68 125.40 2r78 s LEU 106 Ca -0.07 1.88 -0.03 0.00 -0.22 0.00 0.00 54.13 55.69 2r78 s LEU 106 Cb -0.11 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 2r78 s LEU 106 CO 0.01 -0.48 0.66 -0.76 -1.32 0.00 0.00 176.35 174.45 2r78 s LEU 107 N 1.52 3.84 0.55 -0.68 1.43 0.29 -4.97 118.68 120.66 2r78 s LEU 107 Ca 0.56 0.69 0.22 0.00 -1.03 0.00 0.00 54.13 54.58 2r78 s LEU 107 Cb -0.26 -3.59 1.46 0.00 0.03 0.00 0.00 46.19 43.83 2r78 s LEU 107 CO 0.26 -0.42 2.13 -0.65 0.23 0.00 0.00 176.35 177.91 2r78 h PRO 108 N 0.58 0.00 0.00 1.29 0.11 -1.96 -1.09 132.00 130.93 2r78 h PRO 108 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2r78 h PRO 108 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2r78 h PRO 108 CO 0.62 0.00 -0.10 -0.40 -0.21 0.00 0.00 178.00 177.91 2r78 n ASP 109 N -4.25 0.23 0.00 -2.05 5.75 -1.26 -4.93 116.55 110.04 2r78 n ASP 109 Ca 0.00 0.38 0.00 0.00 -0.01 0.00 0.00 54.79 55.17 2r78 n ASP 109 Cb 0.23 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 39.91 2r78 n ASP 109 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2r78 n GLY 110 N 1.46 0.53 3.93 6.12 0.00 -0.41 -5.09 105.19 111.73 2r78 n GLY 110 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 2r78 n GLY 110 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r78 s LYS 111 N -0.70 3.17 -0.15 1.61 1.02 -1.26 -4.27 119.74 119.17 2r78 s LYS 111 Ca 0.00 -0.15 -0.03 0.00 0.02 0.00 0.00 55.97 55.81 2r78 s LYS 111 Cb 0.00 -2.43 -0.02 0.00 -0.52 0.00 0.00 37.83 34.86 2r78 s LYS 111 CO 0.00 -0.36 -0.06 0.42 -0.92 0.00 0.00 175.35 174.44 2r78 s ILE 112 N -2.72 3.70 -0.26 2.17 1.01 -1.26 -0.55 121.20 123.30 2r78 s ILE 112 Ca 0.49 -0.43 -0.10 0.00 0.00 0.00 0.00 60.65 60.61 2r78 s ILE 112 Cb -0.10 -2.61 -0.05 0.00 0.01 0.00 0.00 42.46 39.71 2r78 s ILE 112 CO 0.42 0.50 0.16 -0.22 0.00 0.00 0.00 174.94 175.80 2r78 s LEU 113 N 0.34 3.99 0.10 2.97 2.96 -0.26 -4.29 118.68 124.49 2r78 s LEU 113 Ca -0.06 0.02 0.09 0.00 -0.22 0.00 0.00 54.13 53.97 2r78 s LEU 113 Cb -0.15 -2.09 -0.04 0.00 0.50 0.00 0.00 46.19 44.42 2r78 s LEU 113 CO 0.04 0.01 -0.20 -0.83 -1.32 0.00 0.00 176.35 174.04 2r78 s GLY 114 N 1.38 1.63 -0.02 7.98 0.00 0.12 -1.07 107.32 117.34 2r78 s GLY 114 Ca 0.07 -1.34 0.07 0.00 0.00 0.00 0.00 44.72 43.52 2r78 s GLY 114 CO 0.07 -1.30 -0.22 -0.42 0.00 0.00 0.00 173.10 171.24 2r78 s ILE 115 N -1.06 1.72 -0.13 0.90 1.01 0.04 -1.33 121.20 122.35 2r78 s ILE 115 Ca 0.16 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.88 2r78 s ILE 115 Cb -0.10 -1.43 0.02 0.00 0.01 0.00 0.00 42.46 40.95 2r78 s ILE 115 CO 0.08 0.48 -0.16 0.00 0.00 0.00 0.00 174.94 175.35 2r78 s ALA 116 N -0.52 1.84 -0.07 9.38 0.00 0.04 -1.50 121.76 130.93 2r78 s ALA 116 Ca 0.08 -0.86 0.05 0.00 0.00 0.00 0.00 51.96 51.24 2r78 s ALA 116 Cb -0.08 -0.96 -0.01 0.00 0.00 0.00 0.00 23.12 22.07 2r78 s ALA 116 CO -0.01 -0.21 -0.22 1.03 0.00 0.00 0.00 175.76 176.35 2r78 s ARG 117 N 1.20 2.70 0.59 0.00 0.52 -0.00 -0.95 118.95 123.01 2r78 s ARG 117 Ca -0.01 -0.85 -0.18 0.00 -0.52 0.00 0.00 55.73 54.17 2r78 s ARG 117 Cb -0.14 -2.26 -0.03 0.00 0.52 0.00 0.00 34.95 33.04 2r78 s ARG 117 CO -0.06 0.37 1.17 0.34 0.02 0.00 0.00 175.30 177.14 2r78 s ASP 118 N -0.12 5.28 0.00 0.23 -1.08 -1.26 0.32 116.67 120.04 2r78 s ASP 118 Ca -0.04 2.27 0.00 0.00 -0.52 0.00 0.00 52.55 54.26 2r78 s ASP 118 Cb -0.14 -2.59 0.00 0.00 -1.46 0.00 0.00 42.92 38.73 2r78 s ASP 118 CO 0.04 -1.52 0.00 1.33 0.52 0.00 0.00 175.17 175.54