#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 0.87 0.18 2.61 -2.24 -1.26 -4.64 114.28 109.80 2r78 n THR 6 Ca 0.00 -0.93 0.10 0.00 -2.27 0.00 0.00 64.05 60.95 2r78 n THR 6 Cb 0.00 0.57 -0.15 0.00 -2.10 0.00 0.00 70.33 68.65 2r78 n THR 6 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2r78 n GLU 7 N -0.25 0.59 -1.57 -0.78 -0.58 -1.26 -4.69 120.64 112.11 2r78 n GLU 7 Ca 0.02 -0.15 -0.30 0.00 -0.42 0.00 0.00 57.16 56.31 2r78 n GLU 7 Cb 0.25 -1.47 0.07 0.00 -0.57 0.00 0.00 31.44 29.72 2r78 n GLU 7 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2r78 s ASN 8 N -4.04 4.91 0.23 1.62 2.20 -1.26 -4.80 114.94 113.80 2r78 s ASN 8 Ca -0.04 1.45 -0.07 0.00 -0.94 0.00 0.00 52.86 53.25 2r78 s ASN 8 Cb 0.13 -2.25 0.36 0.00 -2.00 0.00 0.00 41.25 37.49 2r78 s ASN 8 CO 0.84 -1.72 1.74 0.25 -2.94 0.00 0.00 177.10 175.28 2r78 h LEU 9 N -0.91 0.28 -0.16 3.54 5.85 -1.98 -0.72 115.31 121.21 2r78 h LEU 9 Ca -0.45 0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.27 2r78 h LEU 9 Cb 1.24 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.33 2r78 h LEU 9 CO 0.58 0.14 -0.23 1.88 -0.34 0.00 0.00 178.44 180.47 2r78 h TYR 10 N 0.45 0.54 0.02 1.25 0.05 -1.98 -1.89 116.97 115.41 2r78 h TYR 10 Ca 0.36 -0.18 0.01 0.00 0.05 0.00 0.00 58.73 58.97 2r78 h TYR 10 Cb 0.47 -0.11 -0.02 0.00 1.01 0.00 0.00 36.73 38.08 2r78 h TYR 10 CO -0.16 0.86 -0.11 0.35 -1.05 0.00 0.00 178.16 178.05 2r78 h PHE 11 N 0.06 -0.27 -0.50 4.88 3.57 -1.81 -0.52 116.94 122.34 2r78 h PHE 11 Ca 0.02 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.41 2r78 h PHE 11 Cb 0.80 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.64 2r78 h PHE 11 CO 0.09 -0.16 -0.13 1.96 -2.23 0.00 0.00 178.31 177.84 2r78 h GLN 12 N -0.19 0.96 -0.39 1.11 4.20 -1.14 0.10 115.11 119.77 2r78 h GLN 12 Ca 0.03 -0.36 -0.15 0.00 0.06 0.00 0.00 58.65 58.23 2r78 h GLN 12 Cb 0.23 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 2r78 h GLN 12 CO -0.09 1.03 -0.33 0.66 -0.67 0.00 0.00 178.83 179.43 2r78 h SER 13 N 0.85 0.97 -0.46 1.46 4.64 -1.33 0.37 113.55 120.05 2r78 h SER 13 Ca 0.13 -0.45 0.09 0.00 -0.47 0.00 0.00 61.79 61.08 2r78 h SER 13 Cb 0.69 -0.27 -0.07 0.00 -0.31 0.00 0.00 62.40 62.43 2r78 h SER 13 CO 0.05 1.22 0.00 0.78 -0.87 0.00 0.00 176.83 178.01 2r78 h ASN 14 N 0.73 -0.19 -0.37 4.97 2.35 -0.75 -2.16 115.58 120.17 2r78 h ASN 14 Ca 0.07 0.11 -0.09 0.00 -0.55 0.00 0.00 56.30 55.84 2r78 h ASN 14 Cb 0.92 0.19 -0.02 0.00 0.05 0.00 0.00 38.32 39.46 2r78 h ASN 14 CO 0.09 -0.06 -0.07 0.00 -1.65 0.00 0.00 177.43 175.74 2r78 h ALA 15 N 1.40 1.03 -0.10 -0.83 0.00 -0.43 -2.24 119.26 118.09 2r78 h ALA 15 Ca 0.23 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2r78 h ALA 15 Cb 0.33 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2r78 h ALA 15 CO -0.38 0.59 0.06 -0.92 0.00 0.00 0.00 179.25 178.60 2r78 h TYR 16 N 0.72 0.10 -0.48 0.00 3.20 -0.64 0.15 116.97 120.02 2r78 h TYR 16 Ca 0.13 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 2r78 h TYR 16 Cb 0.54 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.75 2r78 h TYR 16 CO 0.03 0.06 0.06 0.00 -1.64 0.00 0.00 178.16 176.67 2r78 h ARG 17 N 0.12 0.75 -0.09 1.82 3.08 -1.03 0.17 114.38 119.21 2r78 h ARG 17 Ca 0.04 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 2r78 h ARG 17 Cb -0.00 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 29.94 2r78 h ARG 17 CO -0.02 0.73 -0.01 0.00 -1.07 0.00 0.00 179.97 179.60 2r78 h ALA 18 N 1.34 0.12 -0.57 0.04 0.00 -1.15 -2.16 119.26 116.88 2r78 h ALA 18 Ca 0.15 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 2r78 h ALA 18 Cb 0.36 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2r78 h ALA 18 CO 0.01 -0.18 0.10 1.25 0.00 0.00 0.00 179.25 180.42 2r78 h LEU 19 N -0.13 0.91 0.03 0.00 5.85 -0.13 0.78 115.31 122.62 2r78 h LEU 19 Ca 0.02 -0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.50 2r78 h LEU 19 Cb 0.37 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2r78 h LEU 19 CO 0.01 0.94 -0.09 0.15 -0.34 0.00 0.00 178.44 179.10 2r78 h PHE 20 N 0.84 -0.23 -0.49 1.25 3.57 -0.71 0.12 116.94 121.29 2r78 h PHE 20 Ca 0.17 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.70 2r78 h PHE 20 Cb 0.41 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 2r78 h PHE 20 CO 0.03 -0.14 0.30 1.49 -2.23 0.00 0.00 178.31 177.76 2r78 h GLU 21 N -0.17 0.58 -0.01 1.11 4.81 -1.14 -3.34 114.58 116.42 2r78 h GLU 21 Ca 0.03 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2r78 h GLU 21 Cb 0.20 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.45 2r78 h GLU 21 CO -0.07 0.38 -0.81 0.72 -0.73 0.00 0.00 179.01 178.50 2r78 n HIS 22 N -4.80 0.00 -1.76 0.92 8.25 0.25 -4.58 115.22 113.49 2r78 n HIS 22 Ca 0.03 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.08 2r78 n HIS 22 Cb 0.07 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.18 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 -0.97 2.14 0.10 -1.41 0.00 0.39 -4.91 120.51 115.86 2r78 n ALA 23 Ca 0.06 0.31 -0.16 0.00 0.00 0.00 0.00 53.44 53.65 2r78 n ALA 23 Cb 0.38 -2.39 -0.13 0.00 0.00 0.00 0.00 19.45 17.31 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 2.69 1.48 -4.11 0.00 5.03 -1.93 -3.42 117.51 117.25 2r78 h ILE 24 Ca -0.50 -2.97 -0.51 0.00 -0.12 0.00 0.00 64.86 60.75 2r78 h ILE 24 Cb 1.26 2.89 0.09 0.00 -3.03 0.00 0.00 36.82 38.02 2r78 h ILE 24 CO 0.63 0.87 0.43 -1.81 -0.68 0.00 0.00 178.15 177.59 2r78 s ASP 25 N -7.17 5.48 0.33 1.72 1.01 -1.26 -4.84 116.67 111.93 2r78 s ASP 25 Ca -0.04 2.20 -0.28 0.00 0.71 0.00 0.00 52.55 55.13 2r78 s ASP 25 Cb 0.07 -2.58 -0.10 0.00 1.01 0.00 0.00 42.92 41.32 2r78 s ASP 25 CO 0.89 -1.39 1.20 -0.83 0.21 0.00 0.00 175.17 175.25 2r78 s GLY 26 N -1.86 3.00 -0.03 0.21 0.00 -0.31 -4.74 107.32 103.58 2r78 s GLY 26 Ca 0.73 1.07 0.02 0.00 0.00 0.00 0.00 44.72 46.54 2r78 s GLY 26 CO 0.31 1.68 -0.06 -0.42 0.00 0.00 0.00 173.10 174.61 2r78 s ILE 27 N -1.20 0.59 0.07 0.90 1.01 -1.26 -1.00 121.20 120.30 2r78 s ILE 27 Ca 0.49 -0.21 0.03 0.00 0.00 0.00 0.00 60.65 60.96 2r78 s ILE 27 Cb -0.35 -0.57 -0.03 0.00 0.01 0.00 0.00 42.46 41.52 2r78 s ILE 27 CO 0.46 0.21 -0.09 0.72 0.00 0.00 0.00 174.94 176.24 2r78 s PHE 28 N 0.53 0.89 0.46 3.97 -0.12 -0.20 -1.35 117.98 122.17 2r78 s PHE 28 Ca -0.07 -0.58 0.04 0.00 -0.05 0.00 0.00 56.93 56.28 2r78 s PHE 28 Cb -0.11 -0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 41.73 2r78 s PHE 28 CO 0.00 -0.05 0.04 0.42 -0.05 0.00 0.00 175.22 175.59 2r78 s ILE 29 N -1.87 1.66 0.50 -4.49 -1.09 0.01 -0.18 121.20 115.74 2r78 s ILE 29 Ca -0.02 -1.95 0.06 0.00 -2.23 0.00 0.00 60.65 56.51 2r78 s ILE 29 Cb -0.07 -2.61 0.01 0.00 -1.58 0.00 0.00 42.46 38.22 2r78 s ILE 29 CO 0.00 0.00 0.37 1.51 -1.23 0.00 0.00 174.94 175.59 2r78 s ASP 31 N -3.83 4.70 0.49 3.58 1.47 -0.42 -0.62 116.67 122.04 2r78 s ASP 31 Ca 0.23 -1.11 0.33 0.00 1.18 0.00 0.00 52.55 53.19 2r78 s ASP 31 Cb 0.05 0.07 1.57 0.00 -0.34 0.00 0.00 42.92 44.26 2r78 s ASP 31 CO 0.12 -0.93 1.99 0.00 0.68 0.00 0.00 175.17 177.04 2r78 h ALA 32 N 0.90 1.00 -0.13 2.11 0.00 -1.91 -1.84 119.26 119.38 2r78 h ALA 32 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.52 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 0.59 0.00 0.00 0.39 0.00 0.00 0.00 179.25 180.23 2r78 n GLU 33 N -2.79 1.87 -0.52 0.00 1.02 -1.26 -4.95 120.64 114.02 2r78 n GLU 33 Ca -0.00 -1.29 0.00 0.00 -0.02 0.00 0.00 57.16 55.84 2r78 n GLU 33 Cb 0.18 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 2r78 n GLU 33 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2r78 n GLY 34 N 1.22 0.74 3.68 0.62 0.00 -0.69 -4.90 105.19 105.86 2r78 n GLY 34 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.04 3.49 0.11 1.61 3.76 -1.26 -0.55 115.29 120.42 2r78 s HIS 35 Ca 0.00 1.53 -0.31 0.00 -0.15 0.00 0.00 55.06 56.13 2r78 s HIS 35 Cb 0.00 -3.16 -0.08 0.00 1.11 0.00 0.00 32.58 30.45 2r78 s HIS 35 CO 0.00 -0.23 1.48 0.71 -0.85 0.00 0.00 174.74 175.85 2r78 s TYR 36 N 2.05 3.06 -0.13 1.40 2.02 -1.12 -1.30 117.35 123.32 2r78 s TYR 36 Ca 0.46 0.77 0.07 0.00 -0.37 0.00 0.00 57.07 58.00 2r78 s TYR 36 Cb -0.18 -3.79 -0.13 0.00 -0.40 0.00 0.00 41.96 37.46 2r78 s TYR 36 CO 0.17 -2.88 -0.03 1.28 -1.57 0.00 0.00 175.55 172.51 2r78 n LEU 37 N 4.28 1.17 -3.58 -1.29 4.77 0.21 -4.76 117.00 117.80 2r78 n LEU 37 Ca 0.13 -0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.96 2r78 n LEU 37 Cb 0.41 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.42 2r78 n LEU 37 CO 0.60 0.48 0.23 -0.62 -1.33 0.00 0.00 177.39 176.75 2r78 s ASP 38 N -4.88 -0.35 -0.14 -1.43 -1.08 -1.05 -4.98 116.67 102.76 2r78 s ASP 38 Ca -0.12 -0.10 -0.13 0.00 -0.52 0.00 0.00 52.55 51.68 2r78 s ASP 38 Cb 0.04 0.50 0.04 0.00 -1.46 0.00 0.00 42.92 42.04 2r78 s ASP 38 CO 0.44 -0.82 0.37 0.68 0.52 0.00 0.00 175.17 176.36 2r78 s VAL 39 N -3.32 -0.00 0.63 1.11 -7.23 -1.26 -0.81 120.40 109.52 2r78 s VAL 39 Ca -0.00 0.00 -0.05 0.00 -1.81 0.00 0.00 61.98 60.12 2r78 s VAL 39 Cb 0.00 -0.52 0.04 0.00 0.56 0.00 0.00 36.38 36.47 2r78 s VAL 39 CO -0.09 0.00 0.92 0.54 -0.31 0.00 0.00 175.10 176.17 2r78 s ASN 40 N 0.23 5.15 0.36 4.85 4.22 -0.45 -4.91 114.94 124.39 2r78 s ASN 40 Ca -0.00 0.42 0.06 0.00 -2.14 0.00 0.00 52.86 51.20 2r78 s ASN 40 Cb -0.03 -1.23 0.75 0.00 1.28 0.00 0.00 41.25 42.01 2r78 s ASN 40 CO 0.00 -1.33 1.95 -0.65 -2.04 0.00 0.00 177.10 175.03 2r78 h PRO 41 N -0.31 0.73 -0.79 3.55 0.11 -1.81 -2.39 132.00 131.09 2r78 h PRO 41 Ca -0.44 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 65.66 2r78 h PRO 41 Cb 1.29 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 32.19 2r78 h PRO 41 CO 0.59 0.48 0.50 0.00 -0.21 0.00 0.00 178.00 179.36 2r78 h ALA 42 N 1.60 1.05 -0.23 -0.75 0.00 -1.85 -0.16 119.26 118.93 2r78 h ALA 42 Ca 0.33 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 2r78 h ALA 42 Cb 0.32 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2r78 h ALA 42 CO -0.12 0.29 0.00 0.82 0.00 0.00 0.00 179.25 180.25 2r78 h ILE 43 N 0.96 1.25 -0.52 0.00 2.04 -1.73 -0.91 117.51 118.60 2r78 h ILE 43 Ca 0.33 -0.87 0.04 0.00 1.00 0.00 0.00 64.86 65.35 2r78 h ILE 43 Cb 0.05 1.38 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 2r78 h ILE 43 CO -0.13 0.27 0.28 0.00 0.00 0.00 0.00 178.15 178.57 2r78 h SER 45 N 0.54 0.19 -0.65 0.00 0.02 -1.01 0.25 113.55 112.89 2r78 h SER 45 Ca 0.22 -0.30 0.13 0.00 -0.84 0.00 0.00 61.79 61.01 2r78 h SER 45 Cb 0.10 -0.05 -0.12 0.00 0.14 0.00 0.00 62.40 62.47 2r78 h SER 45 CO -0.14 0.44 -0.10 0.00 -1.14 0.00 0.00 176.83 175.89 2r78 h ALA 46 N 0.75 0.51 -0.33 3.77 0.00 -0.92 -1.73 119.26 121.31 2r78 h ALA 46 Ca 0.03 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2r78 h ALA 46 Cb 0.34 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2r78 h ALA 46 CO 0.00 -0.42 0.00 0.44 0.00 0.00 0.00 179.25 179.28 2r78 n ILE 47 N -5.39 0.45 -2.99 0.00 -5.35 -0.99 -4.98 119.36 100.10 2r78 n ILE 47 Ca 0.09 -0.72 -0.22 0.00 -0.27 0.00 0.00 62.75 61.62 2r78 n ILE 47 Cb 0.35 1.04 0.02 0.00 -1.74 0.00 0.00 39.64 39.31 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 1.39 -0.52 3.92 3.28 0.00 0.71 -4.97 105.19 109.00 2r78 n GLY 48 Ca 0.18 0.11 -0.27 0.00 0.00 0.00 0.00 46.02 46.03 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 -3.11 3.45 0.55 1.61 1.51 -0.17 -5.00 117.35 116.18 2r78 s TYR 49 Ca 0.28 0.13 -0.08 0.00 -1.01 0.00 0.00 57.07 56.39 2r78 s TYR 49 Cb -0.13 -1.67 -0.04 0.00 -0.11 0.00 0.00 41.96 40.02 2r78 s TYR 49 CO 0.34 0.53 0.90 0.95 -1.11 0.00 0.00 175.55 177.16 2r78 s THR 50 N -1.68 4.78 0.24 -0.71 -4.23 -1.26 -4.44 115.64 108.34 2r78 s THR 50 Ca 0.34 0.50 -0.04 0.00 -1.18 0.00 0.00 61.69 61.30 2r78 s THR 50 Cb -0.11 -3.85 0.21 0.00 1.34 0.00 0.00 72.50 70.08 2r78 s THR 50 CO 0.28 -0.97 1.78 -0.09 -0.54 0.00 0.00 174.62 175.07 2r78 h ARG 51 N -0.03 0.61 -0.27 3.99 2.43 -1.95 -1.40 114.38 117.76 2r78 h ARG 51 Ca -0.46 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 58.60 2r78 h ARG 51 Cb 1.20 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.60 2r78 h ARG 51 CO 0.62 0.41 -0.17 -0.44 -1.51 0.00 0.00 179.97 178.87 2r78 h ASP 52 N 0.63 0.47 -0.20 -3.80 3.32 -1.98 -1.30 116.42 113.57 2r78 h ASP 52 Ca 0.40 -0.13 -0.15 0.00 0.02 0.00 0.00 57.03 57.16 2r78 h ASP 52 Cb 0.47 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2r78 h ASP 52 CO -0.30 0.66 -0.46 -0.33 -1.72 0.00 0.00 179.24 177.09 2r78 h GLU 53 N 0.44 0.67 -0.73 3.56 5.08 -1.85 -3.01 114.58 118.73 2r78 h GLU 53 Ca 0.08 -0.45 -0.02 0.00 -1.00 0.00 0.00 59.36 57.97 2r78 h GLU 53 Cb 0.55 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 2r78 h GLU 53 CO 0.04 1.07 0.39 0.35 -1.00 0.00 0.00 179.01 179.85 2r78 h PHE 54 N 0.37 1.01 0.00 4.33 3.57 -1.10 -2.56 116.94 122.56 2r78 h PHE 54 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2r78 h PHE 54 Cb 1.07 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.48 2r78 h PHE 54 CO 0.09 0.71 0.00 1.28 -2.23 0.00 0.00 178.31 178.16 2r78 n LEU 55 N -4.35 0.00 -0.26 0.59 4.77 -0.50 -1.13 117.00 116.11 2r78 n LEU 55 Ca 0.07 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.18 2r78 n LEU 55 Cb 0.11 0.00 0.29 0.00 -2.33 0.00 0.00 43.42 41.49 2r78 n LEU 55 CO 0.38 0.00 0.56 0.00 -1.33 0.00 0.00 177.39 177.00 2r78 n ALA 56 N -0.96 3.24 -2.31 -1.18 0.00 -0.96 -4.75 120.51 113.58 2r78 n ALA 56 Ca 0.17 -0.44 -0.31 0.00 0.00 0.00 0.00 53.44 52.85 2r78 n ALA 56 Cb 0.08 -1.07 -0.04 0.00 0.00 0.00 0.00 19.45 18.42 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 -2.55 4.02 0.17 0.00 1.43 -0.29 -5.03 118.68 116.43 2r78 s LEU 57 Ca 0.22 1.02 0.09 0.00 -1.03 0.00 0.00 54.13 54.43 2r78 s LEU 57 Cb 0.19 -3.84 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 2r78 s LEU 57 CO 0.55 -0.22 -0.14 -1.81 0.23 0.00 0.00 176.35 174.96 2r78 s ASP 58 N -2.74 4.05 -0.06 2.29 1.01 -1.26 -2.79 116.67 117.17 2r78 s ASP 58 Ca 0.49 -0.61 -0.37 0.00 0.71 0.00 0.00 52.55 52.77 2r78 s ASP 58 Cb -0.11 -0.61 -0.15 0.00 1.01 0.00 0.00 42.92 43.06 2r78 s ASP 58 CO 0.25 0.13 1.58 1.87 0.21 0.00 0.00 175.17 179.20 2r78 n TRP 59 N 0.27 1.89 0.00 4.23 -0.00 0.29 -2.29 117.44 121.83 2r78 n TRP 59 Ca -0.12 0.49 0.00 0.00 -0.00 0.00 0.00 57.50 57.87 2r78 n TRP 59 Cb 0.55 -2.44 0.00 0.00 -0.00 0.00 0.00 31.31 29.42 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 3.46 2.71 0.10 5.87 0.00 -1.26 -4.88 105.19 111.19 2r78 n GLY 60 Ca 0.22 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.12 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 1.25 -0.71 1.61 2.07 -1.84 0.14 116.25 118.77 2r78 h VAL 61 Ca 0.00 -0.79 -0.06 0.00 0.82 0.00 0.00 66.70 66.67 2r78 h VAL 61 Cb 0.00 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 2r78 h VAL 61 CO 0.00 0.23 0.22 -0.07 0.02 0.00 0.00 177.57 177.97 2r78 h LEU 62 N -0.05 1.03 -2.44 2.57 3.38 -1.86 -2.65 115.31 115.28 2r78 h LEU 62 Ca 0.03 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2r78 h LEU 62 Cb 0.35 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2r78 h LEU 62 CO 0.01 0.96 0.00 -1.54 0.09 0.00 0.00 178.44 177.95 2r78 n SER 63 N -4.25 3.69 -3.72 -0.43 3.41 -1.17 -1.15 113.62 109.99 2r78 n SER 63 Ca 0.06 -2.28 -0.23 0.00 -0.26 0.00 0.00 58.87 56.16 2r78 n SER 63 Cb 0.23 -0.48 0.03 0.00 -0.26 0.00 0.00 64.21 63.72 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 0.91 -4.14 -0.21 4.33 1.74 -0.55 -4.84 116.66 113.89 2r78 n ARG 64 Ca 0.20 0.57 0.06 0.00 -0.77 0.00 0.00 57.85 57.91 2r78 n ARG 64 Cb 0.68 -4.98 0.16 0.00 -1.02 0.00 0.00 32.46 27.30 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 -1.64 3.00 0.11 -0.13 0.00 0.37 -4.73 105.19 102.16 2r78 n GLY 65 Ca -0.27 -0.46 -0.03 0.00 0.00 0.00 0.00 46.02 45.25 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 1.86 0.00 -0.90 1.61 2.07 -1.91 0.59 116.25 119.57 2r78 h VAL 66 Ca 0.00 -0.66 0.06 0.00 0.82 0.00 0.00 66.70 66.92 2r78 h VAL 66 Cb 0.83 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 2r78 h VAL 66 CO 0.04 0.00 0.58 0.44 0.02 0.00 0.00 177.57 178.65 2r78 h ASP 67 N -0.85 0.90 1.07 0.57 3.32 -1.95 -1.60 116.42 117.90 2r78 h ASP 67 Ca -0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2r78 h ASP 67 Cb 0.14 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.50 2r78 h ASP 67 CO 0.03 0.59 0.00 0.77 -1.72 0.00 0.00 179.24 178.91 2r78 h SER 68 N 1.03 0.00 0.00 6.45 4.64 -1.85 -3.46 113.55 120.36 2r78 h SER 68 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 2r78 h SER 68 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 2r78 h SER 68 CO -0.14 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.43 2r78 n GLY 69 N 0.14 0.97 0.27 -0.77 0.00 -0.60 -4.96 105.19 100.24 2r78 n GLY 69 Ca 0.01 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.98 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 0.85 -0.11 1.61 7.01 -1.69 -1.29 115.95 122.33 2r78 h TRP 70 Ca 0.00 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.02 2r78 h TRP 70 Cb 0.00 -0.29 -0.01 0.00 -2.10 0.00 0.00 29.16 26.77 2r78 h TRP 70 CO 0.00 0.54 0.07 0.00 -2.79 0.00 0.00 178.44 176.26 2r78 h ALA 71 N 1.25 0.13 -0.28 2.65 0.00 -1.18 -0.29 119.26 121.53 2r78 h ALA 71 Ca 0.25 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.99 2r78 h ALA 71 Cb -0.10 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2r78 h ALA 71 CO -0.05 -0.37 -0.42 0.00 0.00 0.00 0.00 179.25 178.41 2r78 h ALA 72 N 1.02 0.43 -0.44 0.00 0.00 -1.78 -1.61 119.26 116.88 2r78 h ALA 72 Ca 0.04 -0.46 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 2r78 h ALA 72 Cb 0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2r78 h ALA 72 CO -0.01 0.55 0.03 0.00 0.00 0.00 0.00 179.25 179.82 2r78 h ALA 73 N 0.68 0.58 -0.44 0.00 0.00 -1.14 -1.32 119.26 117.62 2r78 h ALA 73 Ca 0.03 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 2r78 h ALA 73 Cb 1.02 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2r78 h ALA 73 CO 0.10 0.35 -0.00 0.66 0.00 0.00 0.00 179.25 180.35 2r78 h SER 74 N 0.60 0.76 -0.35 0.00 4.64 -1.03 -1.88 113.55 116.30 2r78 h SER 74 Ca 0.13 -0.31 0.02 0.00 -0.47 0.00 0.00 61.79 61.16 2r78 h SER 74 Cb 0.45 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 2r78 h SER 74 CO 0.02 0.89 0.19 0.25 -0.87 0.00 0.00 176.83 177.31 2r78 h LEU 75 N 0.62 0.30 -0.95 5.97 5.85 -1.23 -1.56 115.31 124.31 2r78 h LEU 75 Ca 0.12 0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.95 2r78 h LEU 75 Cb 0.50 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.40 2r78 h LEU 75 CO 0.02 0.22 0.59 0.00 -0.34 0.00 0.00 178.44 178.93 2r78 h ALA 76 N 1.16 1.39 -0.54 1.25 0.00 -1.02 -0.72 119.26 120.78 2r78 h ALA 76 Ca 0.14 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 2r78 h ALA 76 Cb 0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2r78 h ALA 76 CO -0.08 0.24 -0.11 0.00 0.00 0.00 0.00 179.25 179.30 2r78 h ARG 77 N 0.98 1.03 0.02 0.00 3.08 -0.68 -0.43 114.38 118.38 2r78 h ARG 77 Ca 0.45 -0.39 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 2r78 h ARG 77 Cb 0.38 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2r78 h ARG 77 CO -0.24 1.08 -0.01 0.82 -1.07 0.00 0.00 179.97 180.55 2r78 h ILE 78 N 0.91 1.18 -0.35 2.04 2.04 -0.57 -1.39 117.51 121.37 2r78 h ILE 78 Ca 0.14 -0.61 0.03 0.00 1.00 0.00 0.00 64.86 65.42 2r78 h ILE 78 Cb 0.69 1.59 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 2r78 h ILE 78 CO 0.05 0.16 0.23 0.58 0.00 0.00 0.00 178.15 179.17 2r78 h VAL 79 N -0.29 1.02 0.00 1.67 2.07 -1.09 -1.01 116.25 118.62 2r78 h VAL 79 Ca -0.00 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.40 2r78 h VAL 79 Cb 0.28 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2r78 h VAL 79 CO 0.00 0.06 0.00 0.61 0.02 0.00 0.00 177.57 178.27 2r78 n GLY 80 N -1.51 -0.91 0.08 2.17 0.00 -0.18 -4.89 105.19 99.96 2r78 n GLY 80 Ca 0.03 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 0.63 0.98 3.26 -0.02 0.00 -0.38 -5.05 105.19 104.61 2r78 n GLY 81 Ca 0.15 -0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.36 2.59 0.44 1.61 2.12 -0.55 -5.03 118.70 119.52 2r78 s GLU 82 Ca 0.00 -1.23 -0.26 0.00 0.36 0.00 0.00 54.97 53.84 2r78 s GLU 82 Cb 0.00 -3.49 -0.09 0.00 0.26 0.00 0.00 34.13 30.82 2r78 s GLU 82 CO 0.00 -0.70 1.43 -2.14 -0.54 0.00 0.00 175.26 173.30 2r78 s PRO 83 N 1.39 3.76 0.05 4.30 0.02 -1.26 -3.64 135.00 139.62 2r78 s PRO 83 Ca -0.01 2.43 -0.21 0.00 0.02 0.00 0.00 61.00 63.23 2r78 s PRO 83 Cb -0.20 -2.70 -0.06 0.00 0.02 0.00 0.00 34.50 31.56 2r78 s PRO 83 CO 0.02 -0.76 0.62 -1.17 -0.33 0.00 0.00 177.00 175.38 2r78 s LEU 84 N -2.62 4.49 -0.29 -5.54 0.20 -0.54 -4.93 118.68 109.44 2r78 s LEU 84 Ca 0.60 1.29 0.00 0.00 0.69 0.00 0.00 54.13 56.71 2r78 s LEU 84 Cb -0.44 -2.99 0.15 0.00 -0.43 0.00 0.00 46.19 42.48 2r78 s LEU 84 CO 0.57 0.18 0.34 -0.60 -0.29 0.00 0.00 176.35 176.55 2r78 s ARG 85 N -0.67 0.36 0.17 1.98 6.06 -1.25 -1.38 118.95 124.22 2r78 s ARG 85 Ca 0.31 -0.02 -0.23 0.00 -2.50 0.00 0.00 55.73 53.30 2r78 s ARG 85 Cb -0.20 -0.52 0.06 0.00 0.06 0.00 0.00 34.95 34.36 2r78 s ARG 85 CO 0.20 -1.02 0.67 -1.83 -2.50 0.00 0.00 175.30 170.81 2r78 s GLU 86 N 2.44 1.33 0.16 5.12 -1.05 -0.64 -5.00 118.70 121.06 2r78 s GLU 86 Ca 0.10 -0.56 -0.15 0.00 -0.15 0.00 0.00 54.97 54.21 2r78 s GLU 86 Cb -0.13 0.57 -0.07 0.00 -0.44 0.00 0.00 34.13 34.05 2r78 s GLU 86 CO -0.31 -0.59 0.58 -1.21 0.95 0.00 0.00 175.26 174.68 2r78 s GLU 87 N -3.70 4.02 -0.01 -4.83 2.02 -1.26 -0.09 118.70 114.86 2r78 s GLU 87 Ca 0.04 0.55 0.01 0.00 0.02 0.00 0.00 54.97 55.59 2r78 s GLU 87 Cb -0.02 -2.91 0.00 0.00 0.10 0.00 0.00 34.13 31.30 2r78 s GLU 87 CO -0.08 0.46 -0.02 1.03 0.02 0.00 0.00 175.26 176.67 2r78 s ARG 88 N -1.99 0.20 0.09 1.61 1.81 0.14 -4.93 118.95 115.88 2r78 s ARG 88 Ca 0.39 -0.05 -0.27 0.00 -1.72 0.00 0.00 55.73 54.08 2r78 s ARG 88 Cb -0.15 -0.22 -0.06 0.00 -0.45 0.00 0.00 34.95 34.06 2r78 s ARG 88 CO 0.19 0.02 0.84 0.99 -0.68 0.00 0.00 175.30 176.66 2r78 s THR 89 N 0.12 4.58 -0.07 0.02 2.01 -1.26 -1.33 115.64 119.70 2r78 s THR 89 Ca -0.01 1.80 0.03 0.00 0.31 0.00 0.00 61.69 63.82 2r78 s THR 89 Cb -0.03 -4.19 -0.02 0.00 0.01 0.00 0.00 72.50 68.26 2r78 s THR 89 CO -0.00 0.38 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.47 2r78 s VAL 90 N -0.24 3.01 -0.23 3.82 1.01 0.11 -4.18 120.40 123.71 2r78 s VAL 90 Ca 0.41 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.69 2r78 s VAL 90 Cb -0.22 -2.20 0.05 0.00 0.00 0.00 0.00 36.38 34.01 2r78 s VAL 90 CO 0.26 0.57 -0.12 0.26 0.00 0.00 0.00 175.10 176.07 2r78 s TRP 91 N -0.39 2.96 0.65 5.22 0.51 -0.30 -1.40 118.94 126.20 2r78 s TRP 91 Ca 0.04 -2.03 -0.07 0.00 -2.12 0.00 0.00 56.10 51.92 2r78 s TRP 91 Cb -0.12 -1.85 0.03 0.00 -0.81 0.00 0.00 33.47 30.72 2r78 s TRP 91 CO 0.02 -0.83 0.97 0.95 -0.51 0.00 0.00 176.95 177.55 2r78 s THR 92 N 1.21 3.01 -0.14 2.01 -4.23 -0.40 -4.76 115.64 112.33 2r78 s THR 92 Ca -0.05 -0.07 0.30 0.00 -1.18 0.00 0.00 61.69 60.69 2r78 s THR 92 Cb -0.18 -3.25 0.34 0.00 1.34 0.00 0.00 72.50 70.75 2r78 s THR 92 CO -0.07 -0.27 1.87 0.08 -0.54 0.00 0.00 174.62 175.69 2r78 h ARG 93 N -0.42 0.00 -0.35 3.99 0.11 -1.93 -1.84 114.38 113.94 2r78 h ARG 93 Ca -0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.63 2r78 h ARG 93 Cb 1.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.36 2r78 h ARG 93 CO 0.61 0.00 0.00 0.27 0.10 0.00 0.00 179.97 180.95 2r78 n ASN 94 N -2.75 2.63 0.00 0.08 2.04 -1.26 -4.94 115.26 111.06 2r78 n ASN 94 Ca 0.01 -1.90 0.00 0.00 -0.44 0.00 0.00 54.58 52.25 2r78 n ASN 94 Cb 0.28 -0.23 0.00 0.00 -2.53 0.00 0.00 39.78 37.30 2r78 n ASN 94 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2r78 n GLY 95 N 1.32 0.42 3.83 4.83 0.00 -0.69 -5.08 105.19 109.82 2r78 n GLY 95 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.84 5.97 -0.03 1.61 1.01 -1.26 -4.83 116.67 116.30 2r78 s ASP 96 Ca 0.00 1.64 0.01 0.00 0.71 0.00 0.00 52.55 54.91 2r78 s ASP 96 Cb 0.00 -2.51 0.02 0.00 1.01 0.00 0.00 42.92 41.44 2r78 s ASP 96 CO 0.00 -1.04 -0.03 -1.58 0.21 0.00 0.00 175.17 172.73 2r78 s GLN 97 N -4.50 0.62 0.04 8.23 0.74 -1.26 -1.28 119.66 122.26 2r78 s GLN 97 Ca 0.60 -0.06 -0.05 0.00 0.05 0.00 0.00 55.36 55.90 2r78 s GLN 97 Cb -0.13 -0.67 -0.02 0.00 1.10 0.00 0.00 33.01 33.29 2r78 s GLN 97 CO 0.43 -0.07 0.07 -0.48 -0.55 0.00 0.00 175.29 174.69 2r78 s LEU 98 N 0.81 1.92 -0.14 3.68 2.34 -0.49 -4.98 118.68 121.81 2r78 s LEU 98 Ca -0.10 -0.63 -0.01 0.00 0.06 0.00 0.00 54.13 53.45 2r78 s LEU 98 Cb -0.13 0.54 -0.01 0.00 -0.56 0.00 0.00 46.19 46.03 2r78 s LEU 98 CO -0.00 -0.54 -0.11 -0.89 -1.06 0.00 0.00 176.35 173.75 2r78 s THR 99 N -2.93 3.17 0.13 5.48 2.01 -1.26 0.10 115.64 122.34 2r78 s THR 99 Ca -0.02 -0.61 0.07 0.00 0.31 0.00 0.00 61.69 61.44 2r78 s THR 99 Cb 0.01 -2.35 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 2r78 s THR 99 CO -0.06 0.51 -0.17 0.68 -0.69 0.00 0.00 174.62 174.89 2r78 s VAL 100 N 0.50 1.56 -0.23 3.82 -7.23 -0.45 -3.51 120.40 114.86 2r78 s VAL 100 Ca -0.08 -1.74 -0.14 0.00 -1.81 0.00 0.00 61.98 58.21 2r78 s VAL 100 Cb -0.15 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.11 2r78 s VAL 100 CO 0.04 -0.31 0.31 -0.70 -0.31 0.00 0.00 175.10 174.12 2r78 s GLU 101 N -2.55 4.11 -0.10 4.82 2.12 0.50 -0.69 118.70 126.90 2r78 s GLU 101 Ca 0.10 -0.00 -0.05 0.00 0.36 0.00 0.00 54.97 55.39 2r78 s GLU 101 Cb -0.06 -3.56 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 2r78 s GLU 101 CO 0.05 -0.04 0.08 -0.51 -0.54 0.00 0.00 175.26 174.29 2r78 s LEU 102 N 1.35 4.03 -0.02 2.70 1.43 0.87 -1.13 118.68 127.91 2r78 s LEU 102 Ca 0.14 0.32 0.07 0.00 -1.03 0.00 0.00 54.13 53.63 2r78 s LEU 102 Cb -0.14 -1.97 -0.02 0.00 0.03 0.00 0.00 46.19 44.09 2r78 s LEU 102 CO 0.07 0.39 -0.22 -0.44 0.23 0.00 0.00 176.35 176.38 2r78 s SER 103 N -0.98 2.58 -0.04 2.29 0.01 -0.19 -1.61 113.70 115.75 2r78 s SER 103 Ca 0.14 -0.40 -0.02 0.00 1.31 0.00 0.00 55.95 56.99 2r78 s SER 103 Cb -0.12 -0.29 0.02 0.00 0.21 0.00 0.00 66.02 65.85 2r78 s SER 103 CO 0.04 0.27 0.08 0.00 0.41 0.00 0.00 173.24 174.04 2r78 s ALA 104 N -0.52 -0.13 -0.05 1.44 0.00 -0.48 -0.69 121.76 121.33 2r78 s ALA 104 Ca 0.08 0.37 0.02 0.00 0.00 0.00 0.00 51.96 52.43 2r78 s ALA 104 Cb -0.08 -0.25 0.02 0.00 0.00 0.00 0.00 23.12 22.80 2r78 s ALA 104 CO -0.01 -0.09 -0.07 -1.01 0.00 0.00 0.00 175.76 174.58 2r78 s HIS 105 N 0.65 0.98 0.12 0.00 3.76 -0.06 -1.47 115.29 119.26 2r78 s HIS 105 Ca -0.05 -0.30 -0.31 0.00 -0.15 0.00 0.00 55.06 54.25 2r78 s HIS 105 Cb -0.07 -0.77 -0.08 0.00 1.11 0.00 0.00 32.58 32.77 2r78 s HIS 105 CO -0.03 -0.19 1.43 -1.17 -0.85 0.00 0.00 174.74 173.93 2r78 s LEU 106 N 0.69 4.37 0.37 0.89 2.96 -1.26 -1.09 118.68 125.60 2r78 s LEU 106 Ca -0.11 2.37 0.01 0.00 -0.22 0.00 0.00 54.13 56.18 2r78 s LEU 106 Cb -0.14 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 2r78 s LEU 106 CO 0.01 -0.69 0.57 -0.76 -1.32 0.00 0.00 176.35 174.16 2r78 s LEU 107 N 1.19 3.94 0.51 -0.68 1.43 0.12 -4.92 118.68 120.27 2r78 s LEU 107 Ca 0.66 0.41 0.23 0.00 -1.03 0.00 0.00 54.13 54.40 2r78 s LEU 107 Cb -0.38 -3.28 1.33 0.00 0.03 0.00 0.00 46.19 43.89 2r78 s LEU 107 CO 0.30 -0.37 2.00 -0.65 0.23 0.00 0.00 176.35 177.86 2r78 h PRO 108 N 0.69 0.07 -0.66 1.29 0.11 -1.96 -1.54 132.00 129.99 2r78 h PRO 108 Ca -0.49 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2r78 h PRO 108 Cb 1.23 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2r78 h PRO 108 CO 0.60 0.05 0.00 -0.40 -0.21 0.00 0.00 178.00 178.04 2r78 n ASP 109 N -4.40 3.37 0.00 -2.05 5.75 -1.26 -4.90 116.55 113.06 2r78 n ASP 109 Ca 0.10 -2.39 0.00 0.00 -0.01 0.00 0.00 54.79 52.49 2r78 n ASP 109 Cb 0.56 -0.52 0.00 0.00 -1.03 0.00 0.00 41.12 40.13 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 0.61 2.62 3.78 6.12 0.00 -0.58 -5.03 105.19 112.71 2r78 n GLY 110 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.47 1.23 -0.09 1.61 1.02 -1.26 -3.92 119.74 117.86 2r78 s LYS 111 Ca 0.00 0.37 0.03 0.00 0.02 0.00 0.00 55.97 56.39 2r78 s LYS 111 Cb 0.00 -1.84 0.01 0.00 -0.52 0.00 0.00 37.83 35.48 2r78 s LYS 111 CO 0.00 -2.15 -0.18 0.42 -0.92 0.00 0.00 175.35 172.52 2r78 s ILE 112 N -3.23 1.61 -0.21 2.17 1.01 -1.26 0.14 121.20 121.43 2r78 s ILE 112 Ca 0.63 -0.74 -0.16 0.00 0.00 0.00 0.00 60.65 60.38 2r78 s ILE 112 Cb -0.15 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 40.85 2r78 s ILE 112 CO 0.54 0.46 0.40 -0.22 0.00 0.00 0.00 174.94 176.12 2r78 s LEU 113 N 0.62 4.14 0.08 2.97 2.96 -0.25 -4.30 118.68 124.90 2r78 s LEU 113 Ca -0.14 0.51 0.08 0.00 -0.22 0.00 0.00 54.13 54.35 2r78 s LEU 113 Cb -0.16 -2.52 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 2r78 s LEU 113 CO 0.04 -0.10 -0.16 -0.83 -1.32 0.00 0.00 176.35 173.99 2r78 s GLY 114 N 1.11 1.68 -0.04 7.98 0.00 0.74 -0.89 107.32 117.91 2r78 s GLY 114 Ca 0.19 -1.26 0.05 0.00 0.00 0.00 0.00 44.72 43.70 2r78 s GLY 114 CO 0.08 -1.21 -0.17 -0.42 0.00 0.00 0.00 173.10 171.38 2r78 s ILE 115 N -1.08 1.42 -0.11 0.90 1.01 0.13 -1.03 121.20 122.43 2r78 s ILE 115 Ca 0.18 -0.73 0.03 0.00 0.00 0.00 0.00 60.65 60.13 2r78 s ILE 115 Cb -0.11 -1.21 0.01 0.00 0.01 0.00 0.00 42.46 41.16 2r78 s ILE 115 CO 0.09 0.41 -0.20 0.00 0.00 0.00 0.00 174.94 175.24 2r78 s ALA 116 N -0.08 1.97 0.08 9.38 0.00 -0.17 -1.03 121.76 131.90 2r78 s ALA 116 Ca -0.01 -0.88 0.09 0.00 0.00 0.00 0.00 51.96 51.15 2r78 s ALA 116 Cb -0.10 -0.85 -0.03 0.00 0.00 0.00 0.00 23.12 22.14 2r78 s ALA 116 CO 0.01 0.07 -0.24 1.03 0.00 0.00 0.00 175.76 176.64 2r78 s ARG 117 N 0.70 1.45 0.59 0.00 0.52 -0.29 -1.17 118.95 120.75 2r78 s ARG 117 Ca -0.11 -1.13 -0.20 0.00 -0.52 0.00 0.00 55.73 53.77 2r78 s ARG 117 Cb -0.16 -1.70 -0.03 0.00 0.52 0.00 0.00 34.95 33.57 2r78 s ARG 117 CO 0.02 0.42 1.31 -0.51 0.02 0.00 0.00 175.30 176.56 2r78 s ASP 118 N -1.54 5.05 0.00 0.23 1.01 -1.26 -0.37 116.67 119.79 2r78 s ASP 118 Ca 0.10 2.64 0.00 0.00 0.71 0.00 0.00 52.55 56.00 2r78 s ASP 118 Cb -0.10 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.21 2r78 s ASP 118 CO 0.03 -1.71 0.00 1.33 0.21 0.00 0.00 175.17 175.04