#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ved s VAL 2 N 0.00 3.02 0.50 3.15 1.01 -1.26 -0.86 120.40 125.96 1ved s VAL 2 Ca 0.00 -1.15 -0.18 0.00 0.00 0.00 0.00 61.98 60.65 1ved s VAL 2 Cb 0.00 -2.62 -0.08 0.00 0.00 0.00 0.00 36.38 33.67 1ved s VAL 2 CO 0.00 0.06 1.00 -0.36 0.00 0.00 0.00 175.10 175.80 1ved s PHE 3 N 1.31 3.23 0.42 5.22 0.40 -0.28 -5.01 117.98 123.27 1ved s PHE 3 Ca -0.02 1.54 -0.07 0.00 -0.60 0.00 0.00 56.93 57.77 1ved s PHE 3 Cb -0.18 -2.90 -0.05 0.00 0.51 0.00 0.00 43.02 40.39 1ved s PHE 3 CO -0.02 -0.53 0.74 0.20 0.70 0.00 0.00 175.22 176.31 1ved s GLY 4 N -2.55 1.74 0.14 4.36 0.00 -1.26 -4.84 107.32 104.91 1ved s GLY 4 Ca 0.62 -0.39 -0.26 0.00 0.00 0.00 0.00 44.72 44.69 1ved s GLY 4 CO 0.25 -0.23 1.61 -0.09 0.00 0.00 0.00 173.10 174.64 1ved h ARG 5 N 0.90 -0.39 -0.20 2.90 2.43 -1.97 -1.25 114.38 116.80 1ved h ARG 5 Ca -0.47 0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 58.62 1ved h ARG 5 Cb 1.20 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.82 1ved h ARG 5 CO 0.63 -0.26 -0.34 0.00 -1.51 0.00 0.00 179.97 178.49 1ved h GLU 7 N 0.36 1.17 -0.28 0.00 4.81 -1.88 -1.76 114.58 117.00 1ved h GLU 7 Ca 0.04 -0.20 -0.18 0.00 -0.13 0.00 0.00 59.36 58.89 1ved h GLU 7 Cb 0.77 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.96 1ved h GLU 7 CO 0.06 0.94 -0.53 1.25 -0.73 0.00 0.00 179.01 180.00 1ved h LEU 8 N 1.13 0.92 -0.75 1.64 5.85 -1.03 -1.91 115.31 121.16 1ved h LEU 8 Ca 0.26 -0.48 0.04 0.00 0.84 0.00 0.00 57.88 58.54 1ved h LEU 8 Cb 0.20 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 40.91 1ved h LEU 8 CO -0.02 1.27 0.46 0.00 -0.34 0.00 0.00 178.44 179.81 1ved h ALA 9 N 0.75 0.99 -0.55 1.25 0.00 -1.14 0.11 119.26 120.68 1ved h ALA 9 Ca 0.02 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1ved h ALA 9 Cb 1.12 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1ved h ALA 9 CO 0.12 0.23 -0.04 0.00 0.00 0.00 0.00 179.25 179.56 1ved h ALA 10 N 1.33 0.75 -0.40 0.00 0.00 -1.23 -1.27 119.26 118.44 1ved h ALA 10 Ca 0.31 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1ved h ALA 10 Cb 0.07 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1ved h ALA 10 CO -0.13 0.61 0.12 0.00 0.00 0.00 0.00 179.25 179.84 1ved h ALA 11 N 0.95 0.52 -0.38 0.00 0.00 -0.63 -1.77 119.26 117.95 1ved h ALA 11 Ca 0.15 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1ved h ALA 11 Cb 0.59 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1ved h ALA 11 CO 0.04 0.18 -0.17 0.52 0.00 0.00 0.00 179.25 179.81 1ved h MET 12 N 0.50 0.71 -0.75 0.00 2.86 -0.69 -2.27 114.93 115.28 1ved h MET 12 Ca 0.13 -0.26 -0.06 0.00 -2.06 0.00 0.00 59.70 57.46 1ved h MET 12 Cb 0.28 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 1ved h MET 12 CO -0.00 0.84 0.24 -0.22 1.06 0.00 0.00 176.91 178.83 1ved h LYS 13 N 0.63 1.15 -0.17 1.72 3.64 -1.08 -2.01 116.57 120.46 1ved h LYS 13 Ca 0.10 -0.24 -0.04 0.00 -1.27 0.00 0.00 60.65 59.20 1ved h LYS 13 Cb 0.65 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1ved h LYS 13 CO 0.05 0.98 -0.06 -0.09 -2.27 0.00 0.00 179.45 178.05 1ved h ARG 14 N 1.11 0.25 -0.64 1.90 2.43 -1.02 -1.99 114.38 116.41 1ved h ARG 14 Ca 0.24 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.37 1ved h ARG 14 Cb 0.30 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1ved h ARG 14 CO -0.01 0.33 0.00 0.72 -1.51 0.00 0.00 179.97 179.50 1ved n HIS 15 N -4.33 0.95 -2.57 2.20 8.25 -0.81 -4.94 115.22 113.97 1ved n HIS 15 Ca -0.00 -0.36 -0.15 0.00 -0.26 0.00 0.00 57.72 56.95 1ved n HIS 15 Cb 0.22 -0.21 0.01 0.00 1.12 0.00 0.00 29.99 31.13 1ved n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ved n GLY 16 N 0.64 -0.16 0.09 -1.41 0.00 -0.75 -4.94 105.19 98.66 1ved n GLY 16 Ca 0.15 -0.22 0.12 0.00 0.00 0.00 0.00 46.02 46.07 1ved n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ved h LEU 17 N -0.57 0.00 -9.07 0.99 3.38 -1.61 -3.41 115.31 105.02 1ved h LEU 17 Ca -0.35 -0.14 -0.57 0.00 0.09 0.00 0.00 57.88 56.92 1ved h LEU 17 Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 1ved h LEU 17 CO 0.39 0.07 1.24 -0.62 0.09 0.00 0.00 178.44 179.61 1ved s ASP 18 N -4.72 6.14 -0.27 -0.43 2.15 -1.26 -1.95 116.67 116.33 1ved s ASP 18 Ca 0.03 1.85 0.00 0.00 0.43 0.00 0.00 52.55 54.87 1ved s ASP 18 Cb 0.12 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 1ved s ASP 18 CO 0.75 -1.41 0.00 0.59 -0.17 0.00 0.00 175.17 174.93 1ved n ASN 19 N 9.16 -3.99 -4.70 -0.34 3.02 0.40 -4.84 115.26 113.97 1ved n ASN 19 Ca 0.22 0.06 -0.42 0.00 -0.03 0.00 0.00 54.58 54.41 1ved n ASN 19 Cb 0.44 -1.72 -0.03 0.00 -0.61 0.00 0.00 39.78 37.87 1ved n ASN 19 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1ved s TYR 20 N -1.87 2.56 -1.39 3.10 5.04 -0.82 -2.08 117.35 121.88 1ved s TYR 20 Ca 0.00 0.39 0.00 0.00 -2.44 0.00 0.00 57.07 55.02 1ved s TYR 20 Cb 0.00 -3.95 0.00 0.00 0.35 0.00 0.00 41.96 38.36 1ved s TYR 20 CO 0.00 -3.76 0.00 0.54 -1.34 0.00 0.00 175.55 170.99 1ved n ARG 21 N 5.25 -1.88 -0.58 4.97 5.12 -1.26 -1.61 116.66 126.67 1ved n ARG 21 Ca 0.15 0.79 0.00 0.00 -1.93 0.00 0.00 57.85 56.86 1ved n ARG 21 Cb 0.40 -5.34 0.00 0.00 -1.16 0.00 0.00 32.46 26.37 1ved n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ved n GLY 22 N -0.75 0.69 3.22 -0.13 0.00 -0.89 -5.05 105.19 102.28 1ved n GLY 22 Ca -0.18 -0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1ved n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ved s TYR 23 N -2.00 3.14 0.80 1.61 2.02 -0.63 -4.96 117.35 117.33 1ved s TYR 23 Ca 0.00 -1.56 -0.13 0.00 -0.37 0.00 0.00 57.07 55.01 1ved s TYR 23 Cb 0.00 -2.11 0.08 0.00 -0.40 0.00 0.00 41.96 39.53 1ved s TYR 23 CO 0.00 -0.73 1.18 -1.54 -1.57 0.00 0.00 175.55 172.89 1ved s SER 24 N 1.33 3.76 0.28 2.29 1.04 -1.26 -0.45 113.70 120.69 1ved s SER 24 Ca -0.01 2.28 0.02 0.00 0.48 0.00 0.00 55.95 58.72 1ved s SER 24 Cb -0.18 -2.58 0.68 0.00 0.10 0.00 0.00 66.02 64.04 1ved s SER 24 CO -0.02 -2.55 1.70 0.25 0.98 0.00 0.00 173.24 173.59 1ved h LEU 25 N -0.89 0.28 -1.77 2.42 5.85 -1.89 -1.10 115.31 118.21 1ved h LEU 25 Ca -0.46 0.15 0.14 0.00 0.84 0.00 0.00 57.88 58.55 1ved h LEU 25 Cb 1.28 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.42 1ved h LEU 25 CO 0.47 0.00 0.42 1.23 -0.34 0.00 0.00 178.44 180.22 1ved h GLY 26 N 0.39 0.38 0.96 3.75 0.00 -1.91 -1.42 103.07 105.21 1ved h GLY 26 Ca 0.53 -0.10 -0.03 0.00 0.00 0.00 0.00 47.33 47.74 1ved h GLY 26 CO -0.52 0.04 0.19 3.43 0.00 0.00 0.00 176.54 179.68 1ved h ASN 27 N 0.24 0.63 -0.41 0.19 2.35 -1.44 -0.82 115.58 116.32 1ved h ASN 27 Ca 0.29 -0.17 -0.12 0.00 -0.55 0.00 0.00 56.30 55.75 1ved h ASN 27 Cb 0.82 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 39.02 1ved h ASN 27 CO -0.06 0.62 -0.21 -0.50 -1.65 0.00 0.00 177.43 175.64 1ved h TRP 28 N 0.60 1.04 -0.38 1.19 4.06 -1.35 -0.86 115.95 120.25 1ved h TRP 28 Ca 0.15 -0.24 -0.15 0.00 2.06 0.00 0.00 58.89 60.71 1ved h TRP 28 Cb 0.19 -0.25 -0.01 0.00 -1.00 0.00 0.00 29.16 28.09 1ved h TRP 28 CO 0.00 1.03 -0.36 0.28 -3.56 0.00 0.00 178.44 175.84 1ved h VAL 29 N 0.79 1.27 -0.53 1.49 2.07 -1.35 -2.03 116.25 117.97 1ved h VAL 29 Ca 0.11 -1.53 -0.04 0.00 0.82 0.00 0.00 66.70 66.06 1ved h VAL 29 Cb 0.76 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 1ved h VAL 29 CO 0.06 0.51 0.17 0.00 0.02 0.00 0.00 177.57 178.33 1ved h ALA 31 N 1.03 0.69 -0.39 0.00 0.00 -0.99 -2.56 119.26 117.03 1ved h ALA 31 Ca 0.17 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1ved h ALA 31 Cb 0.27 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1ved h ALA 31 CO -0.01 0.17 0.01 0.00 0.00 0.00 0.00 179.25 179.42 1ved h ALA 32 N 1.16 1.28 0.09 0.00 0.00 -1.18 -0.80 119.26 119.80 1ved h ALA 32 Ca 0.19 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ved h ALA 32 Cb -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1ved h ALA 32 CO -0.04 0.49 -0.04 -0.22 0.00 0.00 0.00 179.25 179.44 1ved h LYS 33 N 0.59 -0.12 0.00 0.00 1.63 -0.97 -1.23 116.57 116.48 1ved h LYS 33 Ca 0.12 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.93 1ved h LYS 33 Cb 0.37 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.02 1ved h LYS 33 CO 0.01 -0.01 -0.28 1.19 -3.45 0.00 0.00 179.45 176.90 1ved n PHE 34 N -5.11 0.12 -0.02 1.91 3.72 -1.03 -0.93 117.46 116.12 1ved n PHE 34 Ca -0.08 0.04 -0.22 0.00 -0.05 0.00 0.00 57.45 57.14 1ved n PHE 34 Cb 0.10 -0.44 -0.13 0.00 -0.94 0.00 0.00 39.48 38.07 1ved n PHE 34 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1ved n GLU 35 N -1.61 0.71 0.00 -1.08 -0.58 -0.31 -4.73 120.64 113.03 1ved n GLU 35 Ca 0.06 0.34 0.00 0.00 -0.42 0.00 0.00 57.16 57.14 1ved n GLU 35 Cb 0.35 -1.72 0.00 0.00 -0.57 0.00 0.00 31.44 29.51 1ved n GLU 35 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1ved n SER 36 N -3.73 0.25 -3.52 1.62 3.41 -0.52 -4.84 113.62 106.30 1ved n SER 36 Ca -0.32 -1.03 -0.25 0.00 -0.26 0.00 0.00 58.87 57.01 1ved n SER 36 Cb 0.96 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.95 1ved n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1ved n ASN 37 N -0.02 -5.66 -1.50 4.04 5.15 -0.11 -1.84 115.26 115.33 1ved n ASN 37 Ca 0.00 -0.53 -0.18 0.00 -0.60 0.00 0.00 54.58 53.27 1ved n ASN 37 Cb 0.23 -4.51 -0.07 0.00 -0.53 0.00 0.00 39.78 34.90 1ved n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1ved n PHE 38 N -4.70 -0.13 -3.61 1.20 3.72 -1.16 -4.86 117.46 107.92 1ved n PHE 38 Ca -0.01 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.01 1ved n PHE 38 Cb 0.56 -3.17 -0.11 0.00 -0.94 0.00 0.00 39.48 35.82 1ved n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1ved s ASN 39 N -2.71 5.89 0.20 4.37 3.84 -0.77 -1.13 114.94 124.64 1ved s ASN 39 Ca 0.00 -0.11 0.21 0.00 0.21 0.00 0.00 52.86 53.17 1ved s ASN 39 Cb 0.00 -2.09 0.89 0.00 -0.55 0.00 0.00 41.25 39.49 1ved s ASN 39 CO 0.00 -0.08 1.63 0.35 -2.79 0.00 0.00 177.10 176.21 1ved n THR 40 N 5.05 0.93 -0.42 -5.21 -2.24 -0.04 -2.80 114.28 109.55 1ved n THR 40 Ca -0.14 0.29 0.08 0.00 -2.27 0.00 0.00 64.05 62.01 1ved n THR 40 Cb 0.52 -1.20 0.24 0.00 -2.10 0.00 0.00 70.33 67.79 1ved n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ved n GLN 41 N -2.06 3.02 -2.06 -0.78 6.02 -1.26 -3.96 117.38 116.30 1ved n GLN 41 Ca 0.02 -2.44 -0.41 0.00 -0.01 0.00 0.00 57.00 54.17 1ved n GLN 41 Cb 0.19 -1.53 -0.02 0.00 1.02 0.00 0.00 30.24 29.91 1ved n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ved s ALA 42 N -1.43 3.52 -0.02 -1.58 0.00 -1.12 -4.81 121.76 116.30 1ved s ALA 42 Ca 0.36 1.31 -0.04 0.00 0.00 0.00 0.00 51.96 53.58 1ved s ALA 42 Cb 0.22 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.84 1ved s ALA 42 CO 0.19 -0.71 0.10 0.95 0.00 0.00 0.00 175.76 176.30 1ved s THR 43 N -1.04 0.03 -0.04 0.00 -4.23 -1.26 -1.50 115.64 107.60 1ved s THR 43 Ca 0.50 -0.28 -0.01 0.00 -1.18 0.00 0.00 61.69 60.72 1ved s THR 43 Cb -0.41 -0.24 0.03 0.00 1.34 0.00 0.00 72.50 73.23 1ved s THR 43 CO 0.54 -0.16 0.07 0.21 -0.54 0.00 0.00 174.62 174.74 1ved s ASN 44 N -0.48 0.31 0.12 3.99 2.47 -0.77 -4.96 114.94 115.62 1ved s ASN 44 Ca -0.06 0.12 -0.16 0.00 0.42 0.00 0.00 52.86 53.19 1ved s ASN 44 Cb -0.04 -0.00 -0.07 0.00 -1.45 0.00 0.00 41.25 39.69 1ved s ASN 44 CO 0.00 -0.17 0.56 -0.60 -3.72 0.00 0.00 177.10 173.18 1ved s ARG 45 N 1.42 4.06 0.39 0.43 3.52 -1.26 -0.22 118.95 127.30 1ved s ARG 45 Ca -0.05 0.59 0.08 0.00 -0.13 0.00 0.00 55.73 56.22 1ved s ARG 45 Cb -0.12 -3.04 -0.05 0.00 -1.56 0.00 0.00 34.95 30.18 1ved s ARG 45 CO -0.04 0.53 0.14 -0.80 -0.81 0.00 0.00 175.30 174.32 1ved s ASN 46 N -1.49 4.39 0.41 -2.12 -0.87 0.51 -4.97 114.94 110.80 1ved s ASN 46 Ca 0.35 -1.04 0.13 0.00 -1.57 0.00 0.00 52.86 50.73 1ved s ASN 46 Cb -0.17 -0.52 0.88 0.00 -0.02 0.00 0.00 41.25 41.43 1ved s ASN 46 CO 0.19 -0.46 1.93 0.71 -2.57 0.00 0.00 177.10 176.90 1ved h THR 47 N 1.52 1.18 0.00 1.60 1.35 -1.99 -2.45 112.91 114.13 1ved h THR 47 Ca -0.43 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 64.58 1ved h THR 47 Cb 1.25 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 69.10 1ved h THR 47 CO 0.69 0.25 0.00 -0.90 -0.25 0.00 0.00 175.52 175.31 1ved n ASP 48 N -4.24 0.00 0.00 5.36 5.75 -1.26 -4.84 116.55 117.31 1ved n ASP 48 Ca -0.02 -1.74 0.00 0.00 -0.01 0.00 0.00 54.79 53.02 1ved n ASP 48 Cb 0.30 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.39 1ved n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ved n GLY 49 N 0.62 1.05 3.93 6.12 0.00 -0.92 -4.77 105.19 111.21 1ved n GLY 49 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 1ved n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ved s SER 50 N -3.05 5.50 0.02 1.61 1.04 -1.26 -4.61 113.70 112.96 1ved s SER 50 Ca 0.00 0.56 0.03 0.00 0.48 0.00 0.00 55.95 57.02 1ved s SER 50 Cb 0.00 -1.54 -0.02 0.00 0.10 0.00 0.00 66.02 64.57 1ved s SER 50 CO 0.00 -1.09 -0.09 -0.89 0.98 0.00 0.00 173.24 172.16 1ved s THR 51 N -2.94 0.65 -0.18 2.02 2.01 -1.26 -0.36 115.64 115.57 1ved s THR 51 Ca 0.54 -0.73 -0.10 0.00 0.31 0.00 0.00 61.69 61.71 1ved s THR 51 Cb -0.10 -0.62 -0.05 0.00 0.01 0.00 0.00 72.50 71.74 1ved s THR 51 CO 0.43 -0.08 0.15 -1.81 -0.69 0.00 0.00 174.62 172.62 1ved s ASP 52 N -0.90 6.26 -0.02 3.53 1.01 0.69 -1.12 116.67 126.13 1ved s ASP 52 Ca -0.02 0.30 0.08 0.00 0.71 0.00 0.00 52.55 53.61 1ved s ASP 52 Cb -0.06 -2.10 -0.02 0.00 1.01 0.00 0.00 42.92 41.75 1ved s ASP 52 CO 0.00 0.21 -0.25 -0.31 0.21 0.00 0.00 175.17 175.03 1ved s TYR 53 N 0.16 2.37 0.02 4.23 2.02 0.01 -1.85 117.35 124.30 1ved s TYR 53 Ca 0.10 -0.41 0.00 0.00 -0.37 0.00 0.00 57.07 56.39 1ved s TYR 53 Cb -0.11 -1.51 0.00 0.00 -0.40 0.00 0.00 41.96 39.94 1ved s TYR 53 CO -0.00 -0.00 0.00 0.41 -1.57 0.00 0.00 175.55 174.38 1ved n GLY 54 N 2.37 -2.15 0.32 0.71 0.00 -0.56 -1.08 105.19 104.81 1ved n GLY 54 Ca -0.16 -1.46 0.16 0.00 0.00 0.00 0.00 46.02 44.56 1ved n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ved h ILE 55 N -0.08 0.58 -0.34 -0.61 2.10 -1.68 -0.44 117.51 117.03 1ved h ILE 55 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1ved h ILE 55 Cb 0.08 0.88 0.00 0.00 -1.09 0.00 0.00 36.82 36.69 1ved h ILE 55 CO 0.00 0.00 0.00 0.18 -1.08 0.00 0.00 178.15 177.25 1ved n LEU 56 N -3.97 3.13 -3.88 2.19 4.77 -1.26 -4.12 117.00 113.86 1ved n LEU 56 Ca 0.01 -2.17 -0.36 0.00 -0.03 0.00 0.00 56.01 53.46 1ved n LEU 56 Cb 0.28 -0.29 0.02 0.00 -2.33 0.00 0.00 43.42 41.10 1ved n LEU 56 CO 0.29 0.73 -0.14 0.00 -1.33 0.00 0.00 177.39 176.94 1ved n GLN 57 N 0.37 -0.81 -2.81 3.23 1.13 -0.18 -4.90 117.38 113.42 1ved n GLN 57 Ca 0.14 0.39 -0.41 0.00 -1.94 0.00 0.00 57.00 55.17 1ved n GLN 57 Cb 0.51 -2.93 -0.03 0.00 0.11 0.00 0.00 30.24 27.90 1ved n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1ved s ILE 58 N -3.35 4.92 0.15 5.09 1.01 -0.24 -4.46 121.20 124.31 1ved s ILE 58 Ca 0.35 1.88 -0.30 0.00 0.00 0.00 0.00 60.65 62.58 1ved s ILE 58 Cb -0.17 -4.24 -0.07 0.00 0.01 0.00 0.00 42.46 37.99 1ved s ILE 58 CO 0.92 0.18 1.06 0.21 0.00 0.00 0.00 174.94 177.32 1ved s ASN 59 N 0.95 7.33 0.00 3.58 3.84 -1.26 -0.81 114.94 128.56 1ved s ASN 59 Ca 0.48 1.99 0.25 0.00 0.21 0.00 0.00 52.86 55.78 1ved s ASN 59 Cb -0.20 -2.60 1.24 0.00 -0.55 0.00 0.00 41.25 39.14 1ved s ASN 59 CO 0.25 -0.19 1.82 -1.54 -2.79 0.00 0.00 177.10 174.65 1ved n SER 60 N 2.63 0.00 0.09 -4.21 3.41 -0.28 -1.87 113.62 113.40 1ved n SER 60 Ca 0.03 -0.04 -0.19 0.00 -0.26 0.00 0.00 58.87 58.41 1ved n SER 60 Cb 0.47 -0.29 -0.15 0.00 -0.26 0.00 0.00 64.21 63.98 1ved n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1ved h ARG 61 N 0.00 0.35 0.00 4.33 2.43 -1.84 -3.41 114.38 116.23 1ved h ARG 61 Ca 0.00 -0.59 -0.19 0.00 -0.81 0.00 0.00 59.98 58.39 1ved h ARG 61 Cb 0.24 0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 29.97 1ved h ARG 61 CO 0.00 1.25 -1.73 0.91 -1.51 0.00 0.00 179.97 178.89 1ved n TRP 62 N -3.55 0.00 -0.12 2.20 7.02 -1.22 -1.19 117.44 120.57 1ved n TRP 62 Ca -0.16 0.00 -0.18 0.00 -1.02 0.00 0.00 57.50 56.14 1ved n TRP 62 Cb 1.06 -0.51 -0.11 0.00 -2.42 0.00 0.00 31.31 29.33 1ved n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1ved n TRP 63 N -2.65 0.00 -4.32 -5.99 7.02 -0.78 -0.73 117.44 109.98 1ved n TRP 63 Ca -0.20 0.00 -0.17 0.00 -1.02 0.00 0.00 57.50 56.11 1ved n TRP 63 Cb 0.79 -0.93 -0.10 0.00 -2.42 0.00 0.00 31.31 28.65 1ved n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1ved s ASN 65 N -3.28 5.51 0.00 0.00 3.84 -0.50 -4.47 114.94 116.04 1ved s ASN 65 Ca 0.22 -0.01 0.02 0.00 0.21 0.00 0.00 52.86 53.30 1ved s ASN 65 Cb 0.02 -1.96 0.06 0.00 -0.55 0.00 0.00 41.25 38.81 1ved s ASN 65 CO 0.06 0.09 0.95 -0.90 -2.79 0.00 0.00 177.10 174.51 1ved n ASP 66 N 4.06 1.98 0.00 -4.21 5.68 -1.26 -1.12 116.55 121.68 1ved n ASP 66 Ca -0.16 -1.80 0.00 0.00 -0.50 0.00 0.00 54.79 52.33 1ved n ASP 66 Cb 0.52 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 1ved n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ved n GLY 67 N -0.18 0.49 0.18 6.12 0.00 -1.26 -4.76 105.19 105.77 1ved n GLY 67 Ca 0.02 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.08 1ved n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1ved n ARG 68 N -2.00 1.00 -3.96 1.61 1.85 -1.26 -5.03 116.66 108.88 1ved n ARG 68 Ca 0.00 -1.58 -0.35 0.00 -1.00 0.00 0.00 57.85 54.92 1ved n ARG 68 Cb 0.00 -0.95 -0.14 0.00 -1.05 0.00 0.00 32.46 30.32 1ved n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1ved s THR 69 N -1.22 3.06 0.25 8.89 2.01 -1.26 -4.92 115.64 122.44 1ved s THR 69 Ca 0.12 -0.61 -0.30 0.00 0.31 0.00 0.00 61.69 61.21 1ved s THR 69 Cb 0.10 -2.38 -0.09 0.00 0.01 0.00 0.00 72.50 70.14 1ved s THR 69 CO 0.01 0.44 1.28 -2.16 -0.69 0.00 0.00 174.62 173.51 1ved s PRO 70 N 1.43 4.41 -0.73 4.92 0.04 -1.26 -3.21 135.00 140.60 1ved s PRO 70 Ca 0.05 2.07 0.00 0.00 0.04 0.00 0.00 61.00 63.17 1ved s PRO 70 Cb -0.14 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1ved s PRO 70 CO -0.06 -0.18 0.00 0.41 0.04 0.00 0.00 177.00 177.22 1ved n GLY 71 N 1.79 0.78 3.77 0.56 0.00 -1.26 -4.97 105.19 105.85 1ved n GLY 71 Ca 0.04 -0.71 -0.40 0.00 0.00 0.00 0.00 46.02 44.95 1ved n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ved s SER 72 N -2.88 6.79 -0.01 1.61 1.04 -1.20 -4.84 113.70 114.21 1ved s SER 72 Ca 0.00 2.60 0.11 0.00 0.48 0.00 0.00 55.95 59.14 1ved s SER 72 Cb 0.00 -2.64 -0.16 0.00 0.10 0.00 0.00 66.02 63.32 1ved s SER 72 CO 0.00 -0.51 0.31 0.54 0.98 0.00 0.00 173.24 174.56 1ved n ARG 73 N 0.74 1.28 -3.97 4.02 1.74 -0.33 -5.00 116.66 115.13 1ved n ARG 73 Ca 0.00 -0.07 -0.37 0.00 -0.77 0.00 0.00 57.85 56.64 1ved n ARG 73 Cb 0.43 -1.19 0.01 0.00 -1.02 0.00 0.00 32.46 30.68 1ved n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1ved n ASN 74 N -1.70 -3.22 0.15 0.55 4.05 -1.09 -4.85 115.26 109.16 1ved n ASN 74 Ca -0.01 -1.17 0.13 0.00 0.45 0.00 0.00 54.58 53.98 1ved n ASN 74 Cb 0.25 -2.38 0.51 0.00 1.23 0.00 0.00 39.78 39.39 1ved n ASN 74 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1ved h LEU 75 N -2.19 0.00 -0.85 1.20 3.38 -0.84 -2.09 115.31 113.93 1ved h LEU 75 Ca -0.68 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.29 1ved h LEU 75 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1ved h LEU 75 CO 0.55 0.00 -0.30 0.00 0.09 0.00 0.00 178.44 178.78 1ved n ASN 77 N -0.17 -3.23 -3.70 0.00 5.15 -0.79 -4.99 115.26 107.52 1ved n ASN 77 Ca 0.12 -0.93 -0.14 0.00 -0.60 0.00 0.00 54.58 53.03 1ved n ASN 77 Cb 0.41 -3.66 -0.08 0.00 -0.53 0.00 0.00 39.78 35.93 1ved n ASN 77 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1ved s ILE 78 N -3.62 0.05 0.37 -1.44 -4.36 -1.26 -5.08 121.20 105.87 1ved s ILE 78 Ca 0.24 -0.41 -0.25 0.00 -0.26 0.00 0.00 60.65 59.97 1ved s ILE 78 Cb -0.08 -0.77 -0.09 0.00 1.25 0.00 0.00 42.46 42.78 1ved s ILE 78 CO 0.84 -0.23 1.08 -2.16 0.24 0.00 0.00 174.94 174.72 1ved s PRO 79 N -1.62 4.25 0.51 0.37 0.04 -1.26 -1.41 135.00 135.87 1ved s PRO 79 Ca -0.11 1.63 0.23 0.00 0.04 0.00 0.00 61.00 62.79 1ved s PRO 79 Cb -0.03 -2.71 1.37 0.00 0.04 0.00 0.00 34.50 33.17 1ved s PRO 79 CO 0.03 -0.10 2.09 0.00 0.04 0.00 0.00 177.00 179.07 1ved h SER 81 N 0.00 0.00 0.77 0.00 4.64 -1.91 -0.39 113.55 116.66 1ved h SER 81 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ved h SER 81 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1ved h SER 81 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 1ved h ALA 82 N 1.93 1.00 -0.00 5.18 0.00 -1.79 -2.31 119.26 123.27 1ved h ALA 82 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ved h ALA 82 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ved h ALA 82 CO -0.00 0.00 -0.06 1.28 0.00 0.00 0.00 179.25 180.47 1ved n LEU 83 N -3.02 0.48 -1.34 0.00 4.77 -0.15 -3.44 117.00 114.30 1ved n LEU 83 Ca -0.00 -0.05 0.09 0.00 -0.03 0.00 0.00 56.01 56.02 1ved n LEU 83 Cb 0.24 -0.12 0.31 0.00 -2.33 0.00 0.00 43.42 41.53 1ved n LEU 83 CO 0.25 0.08 0.77 0.18 -1.33 0.00 0.00 177.39 177.35 1ved n LEU 84 N -0.82 4.32 -4.84 2.23 4.77 -0.87 -4.00 117.00 117.79 1ved n LEU 84 Ca 0.17 -2.41 -0.31 0.00 -0.03 0.00 0.00 56.01 53.43 1ved n LEU 84 Cb 0.25 -0.51 0.03 0.00 -2.33 0.00 0.00 43.42 40.85 1ved n LEU 84 CO 0.21 0.80 0.71 -0.55 -1.33 0.00 0.00 177.39 177.24 1ved s SER 85 N -1.06 5.79 0.37 -1.43 0.15 -1.22 -4.59 113.70 111.71 1ved s SER 85 Ca 0.46 1.52 0.19 0.00 0.70 0.00 0.00 55.95 58.82 1ved s SER 85 Cb 0.29 -2.48 0.62 0.00 -1.71 0.00 0.00 66.02 62.74 1ved s SER 85 CO 0.22 -1.17 1.70 0.28 1.20 0.00 0.00 173.24 175.47 1ved h SER 86 N -0.52 0.00 -3.48 5.45 0.02 -1.93 -3.41 113.55 109.68 1ved h SER 86 Ca -0.44 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 59.91 1ved h SER 86 Cb 1.20 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.63 1ved h SER 86 CO 0.59 0.36 0.10 -0.62 -1.14 0.00 0.00 176.83 176.13 1ved s ASP 87 N -6.39 6.57 0.00 3.07 2.15 -1.26 -4.96 116.67 115.86 1ved s ASP 87 Ca 0.01 0.70 0.22 0.00 0.43 0.00 0.00 52.55 53.91 1ved s ASP 87 Cb 0.10 -2.33 1.32 0.00 -0.30 0.00 0.00 42.92 41.71 1ved s ASP 87 CO 0.69 -0.32 1.75 2.30 -0.17 0.00 0.00 175.17 179.42 1ved n ILE 88 N 5.02 0.00 -0.14 4.11 -5.35 -1.26 -4.32 119.36 117.42 1ved n ILE 88 Ca -0.02 0.00 -0.07 0.00 -0.27 0.00 0.00 62.75 62.39 1ved n ILE 88 Cb 0.49 -0.49 -0.01 0.00 -1.74 0.00 0.00 39.64 37.89 1ved n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1ved h THR 89 N 0.00 0.21 -0.56 7.28 2.02 -1.95 0.70 112.91 120.62 1ved h THR 89 Ca 0.00 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.23 1ved h THR 89 Cb 0.00 0.21 -0.05 0.00 -1.74 0.00 0.00 68.15 66.57 1ved h THR 89 CO 0.00 0.00 0.29 0.00 0.37 0.00 0.00 175.52 176.18 1ved h ALA 90 N 0.81 0.72 -0.53 6.16 0.00 -1.86 0.19 119.26 124.75 1ved h ALA 90 Ca 0.19 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1ved h ALA 90 Cb 0.54 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1ved h ALA 90 CO -0.58 -0.04 0.16 0.77 0.00 0.00 0.00 179.25 179.56 1ved h SER 91 N 0.56 0.78 -0.15 0.00 0.02 -1.65 -2.10 113.55 111.01 1ved h SER 91 Ca 0.24 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 1ved h SER 91 Cb 0.14 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 1ved h SER 91 CO -0.16 0.79 0.05 0.58 -1.14 0.00 0.00 176.83 176.95 1ved h VAL 92 N 0.74 1.17 -0.94 2.27 2.07 -0.41 -0.16 116.25 120.99 1ved h VAL 92 Ca 0.17 -0.52 0.04 0.00 0.82 0.00 0.00 66.70 67.21 1ved h VAL 92 Cb 0.29 1.24 -0.06 0.00 -1.52 0.00 0.00 31.29 31.24 1ved h VAL 92 CO -0.00 0.16 0.61 0.78 0.02 0.00 0.00 177.57 179.14 1ved h ASN 93 N 0.07 1.01 -0.17 0.57 2.35 -0.91 -0.91 115.58 117.60 1ved h ASN 93 Ca 0.05 -0.01 -0.21 0.00 -0.55 0.00 0.00 56.30 55.58 1ved h ASN 93 Cb 0.20 -0.23 0.01 0.00 0.05 0.00 0.00 38.32 38.35 1ved h ASN 93 CO -0.00 0.68 -0.70 0.00 -1.65 0.00 0.00 177.43 175.76 1ved h ALA 95 N 0.63 1.55 -0.34 0.00 0.00 -0.33 -0.84 119.26 119.93 1ved h ALA 95 Ca -0.03 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1ved h ALA 95 Cb 1.32 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1ved h ALA 95 CO 0.15 0.39 0.02 0.87 0.00 0.00 0.00 179.25 180.67 1ved h LYS 96 N 0.90 0.52 -0.06 0.00 1.57 -1.12 -0.35 116.57 118.04 1ved h LYS 96 Ca 0.28 -0.10 -0.21 0.00 -1.87 0.00 0.00 60.65 58.74 1ved h LYS 96 Cb -0.00 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1ved h LYS 96 CO -0.07 0.53 -0.83 0.87 -0.57 0.00 0.00 179.45 179.38 1ved h LYS 97 N 0.50 0.48 -0.09 3.15 1.57 -1.15 -2.87 116.57 118.17 1ved h LYS 97 Ca 0.11 -0.44 -0.01 0.00 -1.87 0.00 0.00 60.65 58.44 1ved h LYS 97 Cb 0.30 0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 1ved h LYS 97 CO 0.01 1.08 0.00 0.82 -0.57 0.00 0.00 179.45 180.79 1ved h ILE 98 N 0.31 1.25 0.00 1.86 2.04 -0.71 -2.90 117.51 119.35 1ved h ILE 98 Ca -0.06 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 1ved h ILE 98 Cb 1.44 1.60 -0.00 0.00 -0.74 0.00 0.00 36.82 39.12 1ved h ILE 98 CO 0.15 0.22 -0.03 1.62 0.00 0.00 0.00 178.15 180.11 1ved h VAL 99 N -0.13 0.12 -0.01 1.67 3.04 -1.14 -0.16 116.25 119.64 1ved h VAL 99 Ca 0.02 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 65.34 1ved h VAL 99 Cb 0.34 1.33 0.00 0.00 -2.01 0.00 0.00 31.29 30.95 1ved h VAL 99 CO 0.00 0.03 -0.00 -1.20 -1.01 0.00 0.00 177.57 175.39 1ved n SER 100 N -3.19 1.22 -0.11 3.17 7.64 -1.08 -3.79 113.62 117.47 1ved n SER 100 Ca -0.01 -1.40 0.02 0.00 1.01 0.00 0.00 58.87 58.49 1ved n SER 100 Cb 0.22 0.00 0.32 0.00 -1.01 0.00 0.00 64.21 63.75 1ved n SER 100 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1ved h ASP 101 N 1.92 0.68 0.00 6.43 1.82 -0.82 -3.46 116.42 122.99 1ved h ASP 101 Ca 0.00 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.62 1ved h ASP 101 Cb 0.41 -0.17 0.00 0.00 0.68 0.00 0.00 39.33 40.25 1ved h ASP 101 CO 0.00 0.50 0.00 0.61 -1.61 0.00 0.00 179.24 178.74 1ved n GLY 102 N -1.41 0.24 0.55 -0.78 0.00 -1.26 -5.00 105.19 97.53 1ved n GLY 102 Ca 0.06 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.12 1ved n GLY 102 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ved n ASN 103 N 0.00 1.14 0.00 1.61 5.15 -1.26 -5.12 115.26 116.78 1ved n ASN 103 Ca 0.00 -2.61 0.00 0.00 -0.60 0.00 0.00 54.58 51.37 1ved n ASN 103 Cb 0.00 -0.33 0.00 0.00 -0.53 0.00 0.00 39.78 38.92 1ved n ASN 103 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ved n GLY 104 N -0.52 1.90 0.55 8.20 0.00 -1.25 -2.03 105.19 112.05 1ved n GLY 104 Ca 0.09 -0.39 0.04 0.00 0.00 0.00 0.00 46.02 45.76 1ved n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ved n MET 105 N 10.86 1.71 0.00 1.61 2.81 -1.26 -3.89 117.12 128.95 1ved n MET 105 Ca 0.00 -0.97 0.07 0.00 -1.81 0.00 0.00 57.70 54.99 1ved n MET 105 Cb 0.00 -1.28 0.34 0.00 -0.71 0.00 0.00 33.22 31.57 1ved n MET 105 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1ved n ASN 106 N 0.27 0.00 0.28 7.83 3.02 -0.86 -1.76 115.26 124.03 1ved n ASN 106 Ca 0.09 0.24 0.18 0.00 -0.03 0.00 0.00 54.58 55.06 1ved n ASN 106 Cb 0.27 -0.37 0.79 0.00 -0.61 0.00 0.00 39.78 39.86 1ved n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ved h ALA 107 N 2.61 1.00 -2.71 5.41 0.00 -1.75 -3.38 119.26 120.44 1ved h ALA 107 Ca 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 54.91 54.19 1ved h ALA 107 Cb 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 17.71 1ved h ALA 107 CO 0.00 0.00 -0.46 -1.58 0.00 0.00 0.00 179.25 177.21 1ved s TRP 108 N -3.75 3.28 0.16 0.00 0.51 -0.72 -4.98 118.94 113.44 1ved s TRP 108 Ca -0.00 -1.17 -0.18 0.00 -2.12 0.00 0.00 56.10 52.63 1ved s TRP 108 Cb 0.10 -2.76 0.06 0.00 -0.81 0.00 0.00 33.47 30.06 1ved s TRP 108 CO 0.50 -0.75 1.67 0.28 -0.51 0.00 0.00 176.95 178.14 1ved h VAL 109 N 5.93 0.64 -0.47 4.03 2.07 -1.85 -1.75 116.25 124.84 1ved h VAL 109 Ca -0.25 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.30 1ved h VAL 109 Cb 1.10 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 1ved h VAL 109 CO 0.74 0.00 0.32 0.00 0.02 0.00 0.00 177.57 178.64 1ved h ALA 110 N 1.31 1.78 -0.14 1.67 0.00 -1.93 -0.45 119.26 121.50 1ved h ALA 110 Ca 0.16 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1ved h ALA 110 Cb 0.27 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1ved h ALA 110 CO -0.36 0.17 -0.08 2.35 0.00 0.00 0.00 179.25 181.33 1ved h TRP 111 N 0.53 0.34 -0.35 0.00 7.01 -1.65 0.47 115.95 122.30 1ved h TRP 111 Ca 0.19 -0.09 0.02 0.00 2.11 0.00 0.00 58.89 61.12 1ved h TRP 111 Cb 0.10 -0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.05 1ved h TRP 111 CO -0.00 0.64 0.18 0.00 -2.79 0.00 0.00 178.44 176.47 1ved h ARG 112 N -0.05 0.36 0.02 2.65 3.08 -0.66 0.47 114.38 120.26 1ved h ARG 112 Ca 0.03 -0.02 -0.22 0.00 0.07 0.00 0.00 59.98 59.84 1ved h ARG 112 Cb 0.56 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 1ved h ARG 112 CO 0.02 0.24 -0.95 -0.91 -1.07 0.00 0.00 179.97 177.30 1ved h ASN 113 N 0.38 0.34 0.00 7.04 -0.26 -1.10 -3.38 115.58 118.59 1ved h ASN 113 Ca 0.15 -0.29 0.00 0.00 -0.56 0.00 0.00 56.30 55.60 1ved h ASN 113 Cb 0.05 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.20 1ved h ASN 113 CO -0.09 1.11 0.00 0.54 -1.06 0.00 0.00 177.43 177.93 1ved n ARG 114 N -3.65 1.98 -0.02 0.81 1.74 0.15 -4.87 116.66 112.80 1ved n ARG 114 Ca -0.05 -0.26 -0.05 0.00 -0.77 0.00 0.00 57.85 56.72 1ved n ARG 114 Cb 0.85 -0.74 -0.02 0.00 -1.02 0.00 0.00 32.46 31.53 1ved n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ved n LYS 116 N -3.12 1.36 -0.76 0.00 4.81 -0.11 -1.11 118.16 119.22 1ved n LYS 116 Ca -0.09 0.49 0.00 0.00 -0.87 0.00 0.00 58.31 57.84 1ved n LYS 116 Cb 0.57 -2.17 0.00 0.00 0.02 0.00 0.00 35.03 33.45 1ved n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ved n GLY 117 N 3.08 1.08 4.02 3.14 0.00 -1.26 -4.97 105.19 110.28 1ved n GLY 117 Ca 0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.02 1ved n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ved s THR 118 N -3.61 2.16 -1.06 2.61 -4.23 -0.27 -5.01 115.64 106.23 1ved s THR 118 Ca 0.00 -1.06 -0.19 0.00 -1.18 0.00 0.00 61.69 59.26 1ved s THR 118 Cb 0.00 -2.21 0.10 0.00 1.34 0.00 0.00 72.50 71.73 1ved s THR 118 CO 0.00 0.00 1.37 -0.62 -0.54 0.00 0.00 174.62 174.83 1ved s ASP 119 N -4.60 6.70 0.20 3.99 2.15 -1.26 -4.79 116.67 119.06 1ved s ASP 119 Ca 0.58 -2.09 0.22 0.00 0.43 0.00 0.00 52.55 51.70 1ved s ASP 119 Cb -0.06 -2.48 0.91 0.00 -0.30 0.00 0.00 42.92 40.99 1ved s ASP 119 CO 0.37 -1.16 1.68 1.33 -0.17 0.00 0.00 175.17 177.22 1ved n VAL 120 N 5.90 0.81 0.26 1.11 0.24 -1.26 -2.28 118.33 123.11 1ved n VAL 120 Ca 0.33 0.17 0.11 0.00 -2.04 0.00 0.00 64.34 62.91 1ved n VAL 120 Cb 0.48 -1.05 0.69 0.00 -1.47 0.00 0.00 33.84 32.49 1ved n VAL 120 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1ved h GLN 121 N 0.00 0.00 -0.43 7.34 1.08 -1.90 -1.76 115.11 119.45 1ved h GLN 121 Ca 0.00 0.00 0.11 0.00 -1.45 0.00 0.00 58.65 57.31 1ved h GLN 121 Cb 0.39 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.80 1ved h GLN 121 CO 0.00 0.11 0.30 0.00 -0.95 0.00 0.00 178.83 178.30 1ved h ALA 122 N 1.89 2.29 0.00 3.87 0.00 -1.86 -1.08 119.26 124.37 1ved h ALA 122 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ved h ALA 122 Cb 0.26 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1ved h ALA 122 CO 0.01 -0.41 0.00 -1.49 0.00 0.00 0.00 179.25 177.37 1ved h TRP 123 N 0.08 0.00 -0.00 0.00 4.06 -1.53 -3.19 115.95 115.37 1ved h TRP 123 Ca 0.20 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.15 1ved h TRP 123 Cb 0.70 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.86 1ved h TRP 123 CO -0.00 0.00 -0.31 0.44 -3.56 0.00 0.00 178.44 175.01 1ved n ILE 124 N -2.77 0.00 -2.06 1.49 -5.35 -0.46 -4.82 119.36 105.40 1ved n ILE 124 Ca 0.02 -0.35 -0.38 0.00 -0.27 0.00 0.00 62.75 61.77 1ved n ILE 124 Cb 0.30 1.03 0.01 0.00 -1.74 0.00 0.00 39.64 39.24 1ved n ILE 124 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1ved s ARG 125 N -1.57 3.63 0.00 6.28 0.52 -0.90 -2.21 118.95 124.70 1ved s ARG 125 Ca 0.04 2.02 0.00 0.00 -0.52 0.00 0.00 55.73 57.27 1ved s ARG 125 Cb 0.06 -2.46 0.00 0.00 0.52 0.00 0.00 34.95 33.07 1ved s ARG 125 CO 0.28 -0.73 0.00 0.41 0.02 0.00 0.00 175.30 175.29 1ved n GLY 126 N 0.59 1.36 3.92 -3.53 0.00 -1.26 -5.03 105.19 101.24 1ved n GLY 126 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 1ved n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ved s ARG 128 N -2.87 3.45 0.00 0.00 1.81 -1.26 -5.12 118.95 114.96 1ved s ARG 128 Ca 0.38 -2.06 0.10 0.00 -1.72 0.00 0.00 55.73 52.43 1ved s ARG 128 Cb -0.12 -4.49 0.08 0.00 -0.45 0.00 0.00 34.95 29.96 1ved s ARG 128 CO 0.27 -1.44 0.81 1.28 -0.68 0.00 0.00 175.30 175.54