#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lse s VAL 2 N 0.00 5.21 0.41 3.15 1.01 -1.26 -1.59 120.40 127.33 1lse s VAL 2 Ca 0.00 -0.25 -0.22 0.00 0.00 0.00 0.00 61.98 61.51 1lse s VAL 2 Cb 0.00 -3.85 -0.10 0.00 0.00 0.00 0.00 36.38 32.43 1lse s VAL 2 CO 0.00 -0.17 0.97 -0.36 0.00 0.00 0.00 175.10 175.54 1lse s PHE 3 N 1.88 3.34 0.50 5.22 0.40 -0.03 -4.99 117.98 124.30 1lse s PHE 3 Ca 0.09 1.64 -0.18 0.00 -0.60 0.00 0.00 56.93 57.88 1lse s PHE 3 Cb -0.17 -2.91 -0.08 0.00 0.51 0.00 0.00 43.02 40.37 1lse s PHE 3 CO 0.11 -0.17 0.99 0.20 0.70 0.00 0.00 175.22 177.05 1lse s GLY 4 N -2.01 2.16 0.10 4.36 0.00 -1.26 -4.84 107.32 105.83 1lse s GLY 4 Ca 0.60 0.27 -0.29 0.00 0.00 0.00 0.00 44.72 45.30 1lse s GLY 4 CO 0.17 0.55 1.47 -0.09 0.00 0.00 0.00 173.10 175.20 1lse h ARG 5 N 1.11 -0.51 -0.05 2.90 2.43 -1.97 -1.09 114.38 117.20 1lse h ARG 5 Ca -0.47 0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 58.60 1lse h ARG 5 Cb 1.19 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.84 1lse h ARG 5 CO 0.61 -0.34 -0.58 0.00 -1.51 0.00 0.00 179.97 178.15 1lse h GLU 7 N 0.12 0.45 -0.23 0.00 4.81 -1.93 -1.67 114.58 116.14 1lse h GLU 7 Ca -0.00 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.10 1lse h GLU 7 Cb 1.06 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.33 1lse h GLU 7 CO 0.09 0.30 -0.24 1.25 -0.73 0.00 0.00 179.01 179.67 1lse h LEU 8 N 0.47 0.62 -0.72 1.64 5.85 -0.99 -2.21 115.31 119.96 1lse h LEU 8 Ca 0.28 -0.48 0.16 0.00 0.84 0.00 0.00 57.88 58.68 1lse h LEU 8 Cb 0.28 -0.17 -0.12 0.00 0.37 0.00 0.00 40.66 41.02 1lse h LEU 8 CO -0.25 0.97 0.02 0.00 -0.34 0.00 0.00 178.44 178.84 1lse h ALA 9 N 0.66 0.76 -0.38 1.25 0.00 -1.23 -0.17 119.26 120.14 1lse h ALA 9 Ca 0.03 0.22 -0.14 0.00 0.00 0.00 0.00 54.91 55.03 1lse h ALA 9 Cb 0.80 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1lse h ALA 9 CO 0.06 -0.41 -0.30 0.00 0.00 0.00 0.00 179.25 178.60 1lse h ALA 10 N 1.67 0.55 -0.70 0.00 0.00 -1.30 -1.22 119.26 118.25 1lse h ALA 10 Ca 0.39 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1lse h ALA 10 Cb 0.68 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1lse h ALA 10 CO -0.62 0.58 0.23 0.00 0.00 0.00 0.00 179.25 179.44 1lse h ALA 11 N 0.78 1.08 -0.49 0.00 0.00 -0.74 -1.53 119.26 118.35 1lse h ALA 11 Ca 0.07 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.64 1lse h ALA 11 Cb 0.88 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1lse h ALA 11 CO 0.08 0.63 -0.19 0.52 0.00 0.00 0.00 179.25 180.29 1lse h MET 12 N 1.04 1.00 -0.16 0.00 2.86 -0.92 -1.52 114.93 117.23 1lse h MET 12 Ca 0.23 -0.42 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 1lse h MET 12 Cb 0.28 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1lse h MET 12 CO -0.01 1.10 0.05 -0.22 1.06 0.00 0.00 176.91 178.89 1lse h LYS 13 N 0.86 0.25 -0.94 1.72 3.64 -1.16 -0.11 116.57 120.83 1lse h LYS 13 Ca 0.12 -0.06 0.21 0.00 -1.27 0.00 0.00 60.65 59.65 1lse h LYS 13 Cb 0.77 -0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.48 1lse h LYS 13 CO 0.06 0.38 0.61 -0.09 -2.27 0.00 0.00 179.45 178.14 1lse h ARG 14 N 0.08 0.43 -0.64 1.90 2.43 -1.21 0.01 114.38 117.39 1lse h ARG 14 Ca 0.05 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1lse h ARG 14 Cb 0.23 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1lse h ARG 14 CO -0.00 0.28 0.00 0.72 -1.51 0.00 0.00 179.97 179.46 1lse n HIS 15 N -4.55 1.10 -0.73 2.20 8.25 -0.58 -4.94 115.22 115.97 1lse n HIS 15 Ca 0.21 -0.42 0.00 0.00 -0.26 0.00 0.00 57.72 57.25 1lse n HIS 15 Cb 0.72 -0.23 0.00 0.00 1.12 0.00 0.00 29.99 31.60 1lse n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lse n GLY 16 N 0.73 0.60 0.16 -1.41 0.00 -0.01 -4.98 105.19 100.29 1lse n GLY 16 Ca 0.17 -0.29 0.10 0.00 0.00 0.00 0.00 46.02 46.00 1lse n GLY 16 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1lse h LEU 17 N 0.00 0.00 -9.45 0.99 5.85 -1.16 -3.40 115.31 108.14 1lse h LEU 17 Ca 0.00 0.00 -0.53 0.00 0.84 0.00 0.00 57.88 58.19 1lse h LEU 17 Cb 0.00 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.06 1lse h LEU 17 CO 0.00 0.07 1.14 -0.62 -0.34 0.00 0.00 178.44 178.69 1lse s ASP 18 N -5.81 6.45 -1.64 1.25 2.15 -1.26 -1.07 116.67 116.74 1lse s ASP 18 Ca 0.03 2.70 0.00 0.00 0.43 0.00 0.00 52.55 55.70 1lse s ASP 18 Cb 0.07 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.14 1lse s ASP 18 CO 0.74 -1.01 0.00 0.59 -0.17 0.00 0.00 175.17 175.32 1lse n ASN 19 N 6.31 -4.58 -4.68 -0.34 3.02 -0.11 -4.88 115.26 109.99 1lse n ASN 19 Ca 0.18 0.29 -0.42 0.00 -0.03 0.00 0.00 54.58 54.60 1lse n ASN 19 Cb 0.39 -4.03 -0.03 0.00 -0.61 0.00 0.00 39.78 35.50 1lse n ASN 19 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1lse s TYR 20 N -2.57 2.39 -1.68 3.10 5.04 -0.23 -1.36 117.35 122.04 1lse s TYR 20 Ca 0.00 0.38 -0.16 0.00 -2.44 0.00 0.00 57.07 54.84 1lse s TYR 20 Cb 0.00 -3.90 0.14 0.00 0.35 0.00 0.00 41.96 38.55 1lse s TYR 20 CO 0.00 -3.62 0.72 -2.13 -1.34 0.00 0.00 175.55 169.18 1lse n ARG 21 N 5.91 -2.99 -0.79 4.97 0.63 -1.26 -1.70 116.66 121.43 1lse n ARG 21 Ca 0.16 0.36 0.00 0.00 -0.92 0.00 0.00 57.85 57.44 1lse n ARG 21 Cb 0.42 -4.98 0.00 0.00 0.45 0.00 0.00 32.46 28.35 1lse n ARG 21 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1lse n GLY 22 N -1.48 0.85 3.46 5.14 0.00 -0.46 -5.01 105.19 107.70 1lse n GLY 22 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1lse n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1lse s TYR 23 N -3.35 3.22 0.91 1.61 1.51 -0.69 -4.89 117.35 115.67 1lse s TYR 23 Ca 0.00 -0.56 -0.13 0.00 -1.01 0.00 0.00 57.07 55.38 1lse s TYR 23 Cb 0.00 -2.74 0.05 0.00 -0.11 0.00 0.00 41.96 39.17 1lse s TYR 23 CO 0.00 -0.64 0.63 -1.13 -1.11 0.00 0.00 175.55 173.29 1lse n SER 24 N 5.30 -1.28 -4.78 2.29 3.41 -1.26 -0.93 113.62 116.37 1lse n SER 24 Ca -0.10 0.39 -0.34 0.00 -0.26 0.00 0.00 58.87 58.56 1lse n SER 24 Cb 0.47 -1.29 0.01 0.00 -0.26 0.00 0.00 64.21 63.14 1lse n SER 24 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1lse s LEU 25 N -2.45 3.63 0.00 1.04 2.96 -1.26 -1.88 118.68 120.72 1lse s LEU 25 Ca 0.61 2.04 0.00 0.00 -0.22 0.00 0.00 54.13 56.55 1lse s LEU 25 Cb -0.23 -4.56 0.00 0.00 0.50 0.00 0.00 46.19 41.89 1lse s LEU 25 CO 0.63 -1.25 0.00 0.61 -1.32 0.00 0.00 176.35 175.03 1lse n GLY 26 N -0.26 2.82 0.11 7.98 0.00 -1.26 -4.72 105.19 109.86 1lse n GLY 26 Ca 0.10 -0.74 -0.11 0.00 0.00 0.00 0.00 46.02 45.27 1lse n GLY 26 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1lse h ASN 27 N 0.00 0.26 -0.51 1.61 2.35 -1.59 -0.21 115.58 117.49 1lse h ASN 27 Ca 0.00 -0.20 -0.09 0.00 -0.55 0.00 0.00 56.30 55.46 1lse h ASN 27 Cb 0.00 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 1lse h ASN 27 CO 0.00 0.39 -0.01 -0.50 -1.65 0.00 0.00 177.43 175.66 1lse h TRP 28 N 0.12 1.02 -0.09 1.19 4.06 -1.88 0.17 115.95 120.54 1lse h TRP 28 Ca 0.06 -0.16 -0.17 0.00 2.06 0.00 0.00 58.89 60.67 1lse h TRP 28 Cb 0.22 -0.27 0.01 0.00 -1.00 0.00 0.00 29.16 28.12 1lse h TRP 28 CO -0.00 0.92 -0.62 0.28 -3.56 0.00 0.00 178.44 175.45 1lse h VAL 29 N 0.87 1.35 -0.66 1.49 2.07 -1.87 -1.37 116.25 118.12 1lse h VAL 29 Ca 0.16 -1.93 0.02 0.00 0.82 0.00 0.00 66.70 65.76 1lse h VAL 29 Cb 0.52 2.23 -0.04 0.00 -1.52 0.00 0.00 31.29 32.48 1lse h VAL 29 CO 0.03 0.59 0.43 0.00 0.02 0.00 0.00 177.57 178.63 1lse h ALA 31 N 1.26 -0.30 -0.68 0.00 0.00 -0.90 -2.32 119.26 116.33 1lse h ALA 31 Ca 0.25 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.18 1lse h ALA 31 Cb -0.04 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1lse h ALA 31 CO -0.08 -0.72 0.42 0.00 0.00 0.00 0.00 179.25 178.88 1lse h ALA 32 N 0.49 0.88 -0.26 0.00 0.00 -1.13 -0.63 119.26 118.62 1lse h ALA 32 Ca 0.05 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.97 1lse h ALA 32 Cb 0.41 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 1lse h ALA 32 CO -0.16 0.19 -0.50 -0.22 0.00 0.00 0.00 179.25 178.56 1lse h LYS 33 N 0.83 -0.42 0.00 0.00 1.63 -1.19 -1.45 116.57 115.97 1lse h LYS 33 Ca 0.27 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.10 1lse h LYS 33 Cb 0.02 0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.74 1lse h LYS 33 CO -0.11 -0.28 0.00 0.74 -3.45 0.00 0.00 179.45 176.36 1lse h PHE 34 N -0.43 0.00 0.10 1.91 0.04 -1.33 0.63 116.94 117.86 1lse h PHE 34 Ca 0.05 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.62 1lse h PHE 34 Cb 0.57 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.74 1lse h PHE 34 CO -0.65 0.00 -0.84 0.93 -0.60 0.00 0.00 178.31 177.15 1lse h GLU 35 N 0.00 0.39 0.00 1.51 4.39 -0.98 -3.43 114.58 116.45 1lse h GLU 35 Ca 0.00 -0.55 0.00 0.00 0.34 0.00 0.00 59.36 59.15 1lse h GLU 35 Cb 0.94 0.19 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 1lse h GLU 35 CO 0.00 1.23 0.00 -1.13 -1.16 0.00 0.00 179.01 177.95 1lse n SER 36 N -4.09 0.04 -2.74 1.42 3.41 -0.61 -4.85 113.62 106.20 1lse n SER 36 Ca -0.13 -0.41 -0.18 0.00 -0.26 0.00 0.00 58.87 57.89 1lse n SER 36 Cb 0.81 0.07 0.05 0.00 -0.26 0.00 0.00 64.21 64.89 1lse n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1lse n ASN 37 N -0.07 -5.36 -1.32 4.04 4.05 0.21 -2.47 115.26 114.34 1lse n ASN 37 Ca 0.00 -0.35 -0.17 0.00 0.45 0.00 0.00 54.58 54.51 1lse n ASN 37 Cb 0.08 -4.05 -0.07 0.00 1.23 0.00 0.00 39.78 36.97 1lse n ASN 37 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 1lse n PHE 38 N -4.39 -0.02 -3.73 1.20 3.72 -1.14 -4.83 117.46 108.27 1lse n PHE 38 Ca -0.03 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.00 1lse n PHE 38 Cb 0.57 -2.94 -0.12 0.00 -0.94 0.00 0.00 39.48 36.05 1lse n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1lse s ASN 39 N -2.81 5.22 0.55 4.37 2.47 -1.03 -0.85 114.94 122.86 1lse s ASN 39 Ca 0.00 -0.53 0.37 0.00 0.42 0.00 0.00 52.86 53.12 1lse s ASN 39 Cb 0.00 -1.92 1.87 0.00 -1.45 0.00 0.00 41.25 39.75 1lse s ASN 39 CO 0.00 -0.15 2.12 0.71 -3.72 0.00 0.00 177.10 176.06 1lse h THR 40 N 5.72 0.00 -0.39 -5.21 1.35 -1.62 -2.73 112.91 110.04 1lse h THR 40 Ca -0.34 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1lse h THR 40 Cb 1.14 1.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 1lse h THR 40 CO 0.60 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.87 1lse n GLN 41 N -2.89 2.36 -2.21 4.72 6.02 -1.26 -4.03 117.38 120.09 1lse n GLN 41 Ca -0.01 -2.06 -0.41 0.00 -0.01 0.00 0.00 57.00 54.50 1lse n GLN 41 Cb 0.13 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.88 1lse n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1lse s ALA 42 N -1.49 3.52 0.02 -1.58 0.00 -1.03 -4.78 121.76 116.42 1lse s ALA 42 Ca 0.38 1.12 0.05 0.00 0.00 0.00 0.00 51.96 53.51 1lse s ALA 42 Cb 0.22 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.84 1lse s ALA 42 CO 0.30 -0.54 -0.14 0.95 0.00 0.00 0.00 175.76 176.33 1lse s THR 43 N -0.04 1.13 -0.03 0.00 -4.23 -1.26 -0.95 115.64 110.27 1lse s THR 43 Ca 0.56 -0.85 -0.00 0.00 -1.18 0.00 0.00 61.69 60.21 1lse s THR 43 Cb -0.37 -0.99 0.03 0.00 1.34 0.00 0.00 72.50 72.51 1lse s THR 43 CO 0.40 0.13 0.02 0.20 -0.54 0.00 0.00 174.62 174.83 1lse s ASN 44 N -0.83 0.34 0.01 3.99 0.01 -0.22 -4.96 114.94 113.28 1lse s ASN 44 Ca 0.03 0.01 -0.23 0.00 -0.71 0.00 0.00 52.86 51.97 1lse s ASN 44 Cb -0.07 -0.15 -0.05 0.00 0.41 0.00 0.00 41.25 41.39 1lse s ASN 44 CO 0.01 -0.13 0.68 -0.60 -1.51 0.00 0.00 177.10 175.55 1lse s ARG 45 N 1.17 4.41 0.50 -0.60 6.06 -1.26 -0.12 118.95 129.11 1lse s ARG 45 Ca -0.08 0.90 -0.02 0.00 -2.50 0.00 0.00 55.73 54.03 1lse s ARG 45 Cb -0.13 -3.37 -0.00 0.00 0.06 0.00 0.00 34.95 31.51 1lse s ARG 45 CO -0.03 0.29 0.76 -0.80 -2.50 0.00 0.00 175.30 173.02 1lse s ASN 46 N 0.01 5.82 0.34 -2.12 0.02 0.14 -4.98 114.94 114.17 1lse s ASN 46 Ca 0.35 0.51 0.14 0.00 -1.02 0.00 0.00 52.86 52.84 1lse s ASN 46 Cb -0.19 -1.69 0.60 0.00 0.02 0.00 0.00 41.25 39.98 1lse s ASN 46 CO 0.20 -0.79 1.73 0.00 0.02 0.00 0.00 177.10 178.26 1lse h THR 47 N 0.20 1.23 0.00 1.60 1.03 -1.98 -2.73 112.91 112.26 1lse h THR 47 Ca -0.46 -1.63 0.00 0.00 -0.01 0.00 0.00 66.41 64.31 1lse h THR 47 Cb 1.25 1.91 0.00 0.00 -1.07 0.00 0.00 68.15 70.23 1lse h THR 47 CO 0.59 0.45 0.00 -0.90 -0.01 0.00 0.00 175.52 175.65 1lse n ASP 48 N -3.84 0.00 0.00 0.00 5.68 -1.26 -4.87 116.55 112.26 1lse n ASP 48 Ca -0.01 -0.82 0.00 0.00 -0.50 0.00 0.00 54.79 53.46 1lse n ASP 48 Cb 0.50 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 1lse n ASP 48 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1lse n GLY 49 N 0.14 3.28 3.77 6.12 0.00 -1.03 -5.04 105.19 112.43 1lse n GLY 49 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1lse n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lse s SER 50 N -0.45 3.32 0.01 1.61 1.04 -1.26 -4.77 113.70 113.20 1lse s SER 50 Ca 0.00 0.98 0.03 0.00 0.48 0.00 0.00 55.95 57.45 1lse s SER 50 Cb 0.00 -1.56 -0.01 0.00 0.10 0.00 0.00 66.02 64.54 1lse s SER 50 CO 0.00 -2.67 -0.11 -0.89 0.98 0.00 0.00 173.24 170.55 1lse s THR 51 N -3.23 0.84 -0.14 2.02 2.01 -1.26 -0.68 115.64 115.19 1lse s THR 51 Ca 0.64 -0.69 -0.08 0.00 0.31 0.00 0.00 61.69 61.87 1lse s THR 51 Cb -0.15 -0.75 -0.04 0.00 0.01 0.00 0.00 72.50 71.57 1lse s THR 51 CO 0.54 0.07 0.15 -1.81 -0.69 0.00 0.00 174.62 172.88 1lse s ASP 52 N -0.70 6.36 -0.09 3.53 1.01 0.83 -1.36 116.67 126.26 1lse s ASP 52 Ca 0.01 0.43 0.03 0.00 0.71 0.00 0.00 52.55 53.73 1lse s ASP 52 Cb -0.06 -2.09 0.01 0.00 1.01 0.00 0.00 42.92 41.79 1lse s ASP 52 CO 0.00 0.33 -0.19 -0.31 0.21 0.00 0.00 175.17 175.22 1lse s TYR 53 N -0.61 2.09 0.00 4.23 2.02 -0.10 -1.06 117.35 123.92 1lse s TYR 53 Ca 0.14 -0.83 0.00 0.00 -0.37 0.00 0.00 57.07 56.00 1lse s TYR 53 Cb -0.12 -1.44 0.00 0.00 -0.40 0.00 0.00 41.96 40.00 1lse s TYR 53 CO 0.03 -0.36 0.00 0.41 -1.57 0.00 0.00 175.55 174.06 1lse n GLY 54 N 3.66 -2.14 0.36 0.71 0.00 -0.12 -1.87 105.19 105.78 1lse n GLY 54 Ca -0.21 -1.55 0.17 0.00 0.00 0.00 0.00 46.02 44.43 1lse n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1lse h ILE 55 N 0.00 0.58 -0.39 -0.61 6.09 -1.70 -1.19 117.51 120.29 1lse h ILE 55 Ca 0.00 -0.20 0.00 0.00 -1.37 0.00 0.00 64.86 63.29 1lse h ILE 55 Cb 0.00 -0.07 0.00 0.00 0.47 0.00 0.00 36.82 37.22 1lse h ILE 55 CO 0.00 0.11 0.00 0.18 -3.07 0.00 0.00 178.15 175.37 1lse n LEU 56 N -4.81 3.22 -3.80 2.19 4.77 -1.26 -4.10 117.00 113.20 1lse n LEU 56 Ca 0.26 -2.14 -0.27 0.00 -0.03 0.00 0.00 56.01 53.83 1lse n LEU 56 Cb 0.72 -0.31 0.01 0.00 -2.33 0.00 0.00 43.42 41.52 1lse n LEU 56 CO 0.19 0.75 -0.14 0.00 -1.33 0.00 0.00 177.39 176.86 1lse n GLN 57 N 0.52 -2.83 -2.60 3.23 1.13 -0.45 -4.89 117.38 111.48 1lse n GLN 57 Ca 0.15 0.47 -0.42 0.00 -1.94 0.00 0.00 57.00 55.25 1lse n GLN 57 Cb 0.52 -4.51 -0.03 0.00 0.11 0.00 0.00 30.24 26.33 1lse n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1lse s ILE 58 N -3.72 4.56 0.09 5.09 1.01 -0.78 -4.31 121.20 123.14 1lse s ILE 58 Ca 0.18 1.84 -0.29 0.00 0.00 0.00 0.00 60.65 62.37 1lse s ILE 58 Cb -0.06 -4.18 -0.05 0.00 0.01 0.00 0.00 42.46 38.17 1lse s ILE 58 CO 0.86 0.14 0.94 0.21 0.00 0.00 0.00 174.94 177.08 1lse s ASN 59 N 1.04 7.45 0.21 3.58 3.84 -1.26 -0.92 114.94 128.87 1lse s ASN 59 Ca 0.54 1.73 0.24 0.00 0.21 0.00 0.00 52.86 55.59 1lse s ASN 59 Cb -0.24 -2.57 0.91 0.00 -0.55 0.00 0.00 41.25 38.80 1lse s ASN 59 CO 0.28 -0.07 1.73 -1.54 -2.79 0.00 0.00 177.10 174.71 1lse n SER 60 N 2.89 0.64 -0.06 -4.21 3.41 -0.46 -1.15 113.62 114.69 1lse n SER 60 Ca 0.02 0.61 -0.06 0.00 -0.26 0.00 0.00 58.87 59.18 1lse n SER 60 Cb 0.49 -0.77 0.13 0.00 -0.26 0.00 0.00 64.21 63.81 1lse n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1lse h ARG 61 N 0.00 0.69 0.00 4.33 9.65 -1.84 -3.39 114.38 123.82 1lse h ARG 61 Ca 0.00 -0.26 -0.15 0.00 -1.10 0.00 0.00 59.98 58.46 1lse h ARG 61 Cb 0.51 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.02 1lse h ARG 61 CO 0.00 0.85 -1.57 0.91 2.80 0.00 0.00 179.97 182.95 1lse n TRP 62 N -4.12 0.00 -0.05 2.20 8.01 -1.21 -0.66 117.44 121.60 1lse n TRP 62 Ca 0.00 0.00 -0.05 0.00 -1.31 0.00 0.00 57.50 56.14 1lse n TRP 62 Cb 0.41 -0.41 -0.09 0.00 -2.01 0.00 0.00 31.31 29.21 1lse n TRP 62 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.69 177.59 1lse n TRP 63 N -2.46 0.00 -4.12 -5.99 7.02 -0.30 -0.76 117.44 110.84 1lse n TRP 63 Ca -0.15 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.25 1lse n TRP 63 Cb 0.75 -0.57 -0.10 0.00 -2.42 0.00 0.00 31.31 28.97 1lse n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1lse s ASN 65 N -2.97 6.24 0.00 0.00 3.04 -0.13 -4.44 114.94 116.69 1lse s ASN 65 Ca 0.09 0.22 0.07 0.00 0.04 0.00 0.00 52.86 53.28 1lse s ASN 65 Cb 0.07 -2.21 0.16 0.00 -1.54 0.00 0.00 41.25 37.74 1lse s ASN 65 CO -0.08 -0.21 1.04 -0.90 -3.04 0.00 0.00 177.10 173.92 1lse n ASP 66 N 5.35 2.33 0.00 -4.21 5.68 -1.26 -0.61 116.55 123.83 1lse n ASP 66 Ca -0.08 -1.79 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 1lse n ASP 66 Cb 0.51 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.38 1lse n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1lse n GLY 67 N 0.26 1.09 0.42 6.12 0.00 -1.26 -4.74 105.19 107.08 1lse n GLY 67 Ca 0.07 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.16 1lse n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1lse n ARG 68 N -2.00 1.29 -3.95 1.61 1.85 -1.26 -4.92 116.66 109.28 1lse n ARG 68 Ca 0.00 -2.81 -0.30 0.00 -1.00 0.00 0.00 57.85 53.74 1lse n ARG 68 Cb 0.00 -1.42 -0.14 0.00 -1.05 0.00 0.00 32.46 29.85 1lse n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1lse s THR 69 N -2.74 2.33 0.43 8.89 2.01 -1.26 -4.87 115.64 120.43 1lse s THR 69 Ca 0.33 -2.87 -0.26 0.00 0.31 0.00 0.00 61.69 59.20 1lse s THR 69 Cb 0.31 -2.66 -0.09 0.00 0.01 0.00 0.00 72.50 70.08 1lse s THR 69 CO -0.03 -0.74 1.45 -2.84 -0.69 0.00 0.00 174.62 171.77 1lse s PRO 70 N 0.22 3.82 0.00 4.92 0.02 -1.26 -2.16 135.00 140.56 1lse s PRO 70 Ca 0.15 2.48 0.00 0.00 0.02 0.00 0.00 61.00 63.65 1lse s PRO 70 Cb -0.23 -2.76 0.00 0.00 0.02 0.00 0.00 34.50 31.53 1lse s PRO 70 CO -0.04 -0.73 0.00 0.41 -0.33 0.00 0.00 177.00 176.31 1lse n GLY 71 N 0.54 2.97 3.59 0.52 0.00 -1.26 -5.00 105.19 106.55 1lse n GLY 71 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.62 1lse n GLY 71 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1lse n SER 72 N 0.00 1.32 -0.05 1.61 2.88 -0.92 -4.99 113.62 113.48 1lse n SER 72 Ca 0.00 1.16 0.12 0.00 -1.33 0.00 0.00 58.87 58.82 1lse n SER 72 Cb 0.00 -1.30 0.20 0.00 -0.75 0.00 0.00 64.21 62.36 1lse n SER 72 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1lse n ARG 73 N 0.65 0.15 -4.24 -1.46 1.74 0.17 -4.98 116.66 108.68 1lse n ARG 73 Ca 0.09 -0.09 -0.30 0.00 -0.77 0.00 0.00 57.85 56.78 1lse n ARG 73 Cb 0.33 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.18 1lse n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1lse n ASN 74 N -1.34 0.89 0.22 0.55 5.15 -1.08 -4.88 115.26 114.77 1lse n ASN 74 Ca 0.06 -1.23 0.07 0.00 -0.60 0.00 0.00 54.58 52.89 1lse n ASN 74 Cb 0.34 -1.52 0.52 0.00 -0.53 0.00 0.00 39.78 38.59 1lse n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1lse h LEU 75 N -1.68 0.00 -0.22 1.20 3.38 -0.90 -1.07 115.31 116.02 1lse h LEU 75 Ca -0.63 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.34 1lse h LEU 75 Cb 1.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1lse h LEU 75 CO 0.68 0.23 0.00 0.00 0.09 0.00 0.00 178.44 179.44 1lse n ASN 77 N -0.61 -3.91 -3.71 0.00 5.15 -0.41 -4.98 115.26 106.78 1lse n ASN 77 Ca 0.17 -1.15 -0.14 0.00 -0.60 0.00 0.00 54.58 52.86 1lse n ASN 77 Cb 0.13 -2.55 -0.09 0.00 -0.53 0.00 0.00 39.78 36.74 1lse n ASN 77 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 1lse s ILE 78 N -3.60 0.02 0.26 -1.44 2.07 -1.26 -5.06 121.20 112.18 1lse s ILE 78 Ca 0.40 -0.16 -0.30 0.00 -1.41 0.00 0.00 60.65 59.18 1lse s ILE 78 Cb -0.18 -0.67 -0.10 0.00 0.13 0.00 0.00 42.46 41.64 1lse s ILE 78 CO 0.92 -0.09 1.39 -2.16 -1.91 0.00 0.00 174.94 173.09 1lse s PRO 79 N -0.48 4.31 0.54 3.50 0.04 -1.26 -0.96 135.00 140.70 1lse s PRO 79 Ca -0.06 2.23 0.30 0.00 0.04 0.00 0.00 61.00 63.51 1lse s PRO 79 Cb -0.03 -3.12 1.46 0.00 0.04 0.00 0.00 34.50 32.85 1lse s PRO 79 CO 0.03 -0.34 1.91 0.00 0.04 0.00 0.00 177.00 178.64 1lse h SER 81 N 0.00 0.00 0.12 0.00 4.64 -1.91 -1.23 113.55 115.17 1lse h SER 81 Ca 0.36 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.66 1lse h SER 81 Cb 1.50 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.58 1lse h SER 81 CO -0.00 0.05 -0.09 0.00 -0.87 0.00 0.00 176.83 175.92 1lse h ALA 82 N 1.95 1.68 0.00 5.18 0.00 -1.54 -2.23 119.26 124.30 1lse h ALA 82 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1lse h ALA 82 Cb 0.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1lse h ALA 82 CO 0.01 0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.64 1lse n LEU 83 N -4.18 0.65 -0.72 0.00 4.32 -0.46 -3.16 117.00 113.45 1lse n LEU 83 Ca -0.03 0.67 0.13 0.00 -0.02 0.00 0.00 56.01 56.76 1lse n LEU 83 Cb 0.17 -0.59 0.24 0.00 -1.62 0.00 0.00 43.42 41.62 1lse n LEU 83 CO 0.33 -0.58 0.68 0.18 -1.22 0.00 0.00 177.39 176.78 1lse n LEU 84 N -2.22 2.30 -4.71 2.23 4.77 -0.84 -4.23 117.00 114.30 1lse n LEU 84 Ca 0.02 -0.77 -0.34 0.00 -0.03 0.00 0.00 56.01 54.89 1lse n LEU 84 Cb 0.22 -0.01 0.11 0.00 -2.33 0.00 0.00 43.42 41.41 1lse n LEU 84 CO 0.19 0.39 0.79 -0.55 -1.33 0.00 0.00 177.39 176.88 1lse s SER 85 N -2.08 3.90 0.25 -1.43 0.15 -1.19 -4.18 113.70 109.13 1lse s SER 85 Ca 0.30 2.37 0.25 0.00 0.70 0.00 0.00 55.95 59.57 1lse s SER 85 Cb 0.20 -2.59 0.93 0.00 -1.71 0.00 0.00 66.02 62.85 1lse s SER 85 CO 0.35 -2.46 1.74 -1.54 1.20 0.00 0.00 173.24 172.53 1lse n SER 86 N -2.99 0.74 -4.60 5.45 3.41 -1.26 -4.45 113.62 109.92 1lse n SER 86 Ca 0.14 0.64 -0.42 0.00 -0.26 0.00 0.00 58.87 58.97 1lse n SER 86 Cb 0.50 -0.81 -0.06 0.00 -0.26 0.00 0.00 64.21 63.58 1lse n SER 86 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1lse s ASP 87 N -4.38 6.55 0.00 4.04 2.15 -1.26 -4.97 116.67 118.80 1lse s ASP 87 Ca 0.06 0.44 0.24 0.00 0.43 0.00 0.00 52.55 53.72 1lse s ASP 87 Cb 0.10 -2.37 1.44 0.00 -0.30 0.00 0.00 42.92 41.79 1lse s ASP 87 CO 0.47 -0.60 1.84 2.30 -0.17 0.00 0.00 175.17 179.01 1lse n ILE 88 N 5.56 0.00 -0.20 4.11 -5.35 -1.26 -4.39 119.36 117.83 1lse n ILE 88 Ca 0.01 0.00 -0.05 0.00 -0.27 0.00 0.00 62.75 62.44 1lse n ILE 88 Cb 0.48 -0.52 0.01 0.00 -1.74 0.00 0.00 39.64 37.87 1lse n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1lse h THR 89 N 0.00 0.19 -0.79 7.28 2.02 -1.94 -0.03 112.91 119.64 1lse h THR 89 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1lse h THR 89 Cb 0.00 0.19 -0.04 0.00 -1.74 0.00 0.00 68.15 66.56 1lse h THR 89 CO 0.00 0.00 0.40 0.00 0.37 0.00 0.00 175.52 176.29 1lse h ALA 90 N 1.04 1.02 -0.73 6.16 0.00 -1.87 0.11 119.26 124.98 1lse h ALA 90 Ca 0.24 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1lse h ALA 90 Cb 0.54 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1lse h ALA 90 CO -0.67 0.56 0.21 0.77 0.00 0.00 0.00 179.25 180.12 1lse h SER 91 N 1.11 1.09 -0.28 0.00 0.02 -1.49 -1.52 113.55 112.48 1lse h SER 91 Ca 0.27 -0.22 -0.16 0.00 -0.84 0.00 0.00 61.79 60.85 1lse h SER 91 Cb 0.09 -0.29 -0.00 0.00 0.14 0.00 0.00 62.40 62.34 1lse h SER 91 CO -0.04 1.02 -0.44 0.58 -1.14 0.00 0.00 176.83 176.82 1lse h VAL 92 N 1.10 1.29 -0.25 2.27 2.07 -0.55 -1.21 116.25 120.98 1lse h VAL 92 Ca 0.23 -1.63 -0.08 0.00 0.82 0.00 0.00 66.70 66.05 1lse h VAL 92 Cb 0.34 1.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 1lse h VAL 92 CO -0.00 0.52 -0.19 0.78 0.02 0.00 0.00 177.57 178.70 1lse h ASN 93 N 0.54 0.44 -0.38 0.57 4.21 -0.93 -1.22 115.58 118.79 1lse h ASN 93 Ca 0.02 -0.13 -0.16 0.00 1.21 0.00 0.00 56.30 57.25 1lse h ASN 93 Cb 1.04 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 38.11 1lse h ASN 93 CO 0.10 0.64 -0.37 0.00 -1.29 0.00 0.00 177.43 176.51 1lse h ALA 95 N 0.77 1.34 -0.88 0.00 0.00 -0.86 -0.90 119.26 118.74 1lse h ALA 95 Ca 0.06 -0.09 0.08 0.00 0.00 0.00 0.00 54.91 54.96 1lse h ALA 95 Cb 0.97 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 1lse h ALA 95 CO 0.09 0.56 0.57 0.87 0.00 0.00 0.00 179.25 181.34 1lse h LYS 96 N 1.08 0.89 -0.19 0.00 1.57 -1.26 0.14 116.57 118.79 1lse h LYS 96 Ca 0.28 -0.05 -0.18 0.00 -1.87 0.00 0.00 60.65 58.82 1lse h LYS 96 Cb -0.03 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 32.09 1lse h LYS 96 CO -0.05 0.59 -0.60 0.87 -0.57 0.00 0.00 179.45 179.69 1lse h LYS 97 N 0.91 0.74 0.10 3.15 1.57 -1.18 -3.08 116.57 118.77 1lse h LYS 97 Ca 0.39 -0.54 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1lse h LYS 97 Cb 0.33 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1lse h LYS 97 CO -0.16 1.16 -0.05 0.82 -0.57 0.00 0.00 179.45 180.66 1lse h ILE 98 N 0.45 1.03 -0.16 1.86 2.04 -0.83 -3.03 117.51 118.87 1lse h ILE 98 Ca -0.02 -0.49 0.05 0.00 1.00 0.00 0.00 64.86 65.39 1lse h ILE 98 Cb 1.22 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 38.64 1lse h ILE 98 CO 0.13 0.12 0.14 -0.37 0.00 0.00 0.00 178.15 178.17 1lse h VAL 99 N -0.36 0.73 0.00 1.67 -1.51 -0.83 -1.64 116.25 114.31 1lse h VAL 99 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.46 1lse h VAL 99 Cb 0.30 0.90 0.00 0.00 -2.13 0.00 0.00 31.29 30.36 1lse h VAL 99 CO 0.02 0.00 0.00 -1.20 -1.23 0.00 0.00 177.57 175.16 1lse n SER 100 N -4.21 0.00 0.00 4.19 7.64 -1.15 -3.17 113.62 116.92 1lse n SER 100 Ca 0.01 0.31 0.03 0.00 1.01 0.00 0.00 58.87 60.23 1lse n SER 100 Cb 0.26 -0.43 0.15 0.00 -1.01 0.00 0.00 64.21 63.19 1lse n SER 100 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1lse n ASP 101 N -1.43 0.00 0.00 6.43 2.03 -0.62 -4.82 116.55 118.15 1lse n ASP 101 Ca 0.08 -0.84 0.00 0.00 0.52 0.00 0.00 54.79 54.55 1lse n ASP 101 Cb 0.26 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.66 1lse n ASP 101 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1lse n GLY 102 N -0.00 3.10 1.46 0.27 0.00 -1.26 -4.90 105.19 103.86 1lse n GLY 102 Ca 0.04 -0.97 0.10 0.00 0.00 0.00 0.00 46.02 45.19 1lse n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1lse n ASN 103 N 0.66 4.29 0.00 1.61 4.13 -1.26 -5.07 115.26 119.61 1lse n ASN 103 Ca 0.00 -2.22 0.00 0.00 1.68 0.00 0.00 54.58 54.04 1lse n ASN 103 Cb 0.00 -0.53 0.00 0.00 -1.54 0.00 0.00 39.78 37.71 1lse n ASN 103 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1lse n GLY 104 N 1.39 2.77 0.08 7.41 0.00 -1.19 -2.66 105.19 113.00 1lse n GLY 104 Ca 0.25 -0.32 0.16 0.00 0.00 0.00 0.00 46.02 46.11 1lse n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1lse n MET 105 N 14.00 1.07 0.24 1.61 2.81 -1.26 -3.10 117.12 132.49 1lse n MET 105 Ca 0.00 -0.16 0.16 0.00 -1.81 0.00 0.00 57.70 55.89 1lse n MET 105 Cb 0.00 -1.50 0.78 0.00 -0.71 0.00 0.00 33.22 31.80 1lse n MET 105 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1lse h ASN 106 N 0.39 0.00 0.04 7.83 4.21 -1.93 -1.50 115.58 124.63 1lse h ASN 106 Ca 0.00 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.51 1lse h ASN 106 Cb 0.10 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.30 1lse h ASN 106 CO 0.00 0.00 -0.01 0.00 -1.29 0.00 0.00 177.43 176.13 1lse h ALA 107 N 2.06 1.32 -2.70 -0.83 0.00 -1.71 -3.38 119.26 114.01 1lse h ALA 107 Ca 0.00 -0.01 -0.70 0.00 0.00 0.00 0.00 54.91 54.20 1lse h ALA 107 Cb 0.20 -0.00 -0.22 0.00 0.00 0.00 0.00 17.79 17.77 1lse h ALA 107 CO 0.00 0.01 -0.49 -1.58 0.00 0.00 0.00 179.25 177.19 1lse s TRP 108 N -4.42 3.23 0.20 0.00 0.51 -0.56 -4.97 118.94 112.92 1lse s TRP 108 Ca -0.05 -0.69 -0.09 0.00 -2.12 0.00 0.00 56.10 53.15 1lse s TRP 108 Cb 0.14 -2.48 0.12 0.00 -0.81 0.00 0.00 33.47 30.44 1lse s TRP 108 CO 0.50 -0.57 1.74 0.28 -0.51 0.00 0.00 176.95 178.40 1lse h VAL 109 N 5.72 1.26 -0.21 4.03 2.07 -1.84 -2.07 116.25 125.20 1lse h VAL 109 Ca -0.28 -0.85 -0.08 0.00 0.82 0.00 0.00 66.70 66.31 1lse h VAL 109 Cb 1.12 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1lse h VAL 109 CO 0.68 0.34 -0.24 0.00 0.02 0.00 0.00 177.57 178.37 1lse h ALA 110 N 1.12 1.20 -0.05 1.67 0.00 -1.93 -0.25 119.26 121.02 1lse h ALA 110 Ca 0.23 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1lse h ALA 110 Cb 0.27 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1lse h ALA 110 CO -0.01 0.52 -0.09 2.35 0.00 0.00 0.00 179.25 182.02 1lse h TRP 111 N 0.35 -0.21 0.00 0.00 7.01 -1.73 -0.00 115.95 121.36 1lse h TRP 111 Ca 0.06 0.01 -0.12 0.00 2.11 0.00 0.00 58.89 60.95 1lse h TRP 111 Cb 0.61 0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 27.76 1lse h TRP 111 CO 0.02 -0.13 -0.57 0.07 -2.79 0.00 0.00 178.44 175.03 1lse h ARG 112 N -0.13 0.00 0.00 2.65 0.11 -1.08 0.45 114.38 116.38 1lse h ARG 112 Ca 0.05 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.08 1lse h ARG 112 Cb 0.20 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.27 1lse h ARG 112 CO -0.12 0.57 -0.37 -0.91 0.10 0.00 0.00 179.97 179.24 1lse h ASN 113 N 0.00 0.00 0.00 0.08 -0.26 -0.99 -3.37 115.58 111.04 1lse h ASN 113 Ca -0.01 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.73 1lse h ASN 113 Cb 1.09 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.35 1lse h ASN 113 CO 0.07 0.23 -0.65 0.54 -1.06 0.00 0.00 177.43 176.56 1lse n ARG 114 N -3.10 1.99 -0.06 0.81 1.74 -0.02 -4.89 116.66 113.13 1lse n ARG 114 Ca 0.02 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.01 1lse n ARG 114 Cb 0.63 -0.81 -0.05 0.00 -1.02 0.00 0.00 32.46 31.20 1lse n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1lse n LYS 116 N -3.01 1.72 -1.62 0.00 4.81 0.14 -1.88 118.16 118.32 1lse n LYS 116 Ca -0.21 0.62 -0.14 0.00 -0.87 0.00 0.00 58.31 57.71 1lse n LYS 116 Cb 0.71 -2.36 -0.05 0.00 0.02 0.00 0.00 35.03 33.34 1lse n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1lse n GLY 117 N 3.58 1.08 3.87 3.14 0.00 -1.26 -4.96 105.19 110.64 1lse n GLY 117 Ca 0.20 -0.34 -0.23 0.00 0.00 0.00 0.00 46.02 45.66 1lse n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1lse s THR 118 N -2.57 2.24 -1.25 2.61 -4.23 -0.78 -5.03 115.64 106.63 1lse s THR 118 Ca 0.00 -1.43 -0.19 0.00 -1.18 0.00 0.00 61.69 58.88 1lse s THR 118 Cb 0.00 -2.68 0.05 0.00 1.34 0.00 0.00 72.50 71.21 1lse s THR 118 CO 0.00 0.00 1.73 -0.62 -0.54 0.00 0.00 174.62 175.19 1lse s ASP 119 N -4.17 6.57 0.25 3.99 2.15 -1.26 -4.76 116.67 119.44 1lse s ASP 119 Ca 0.43 -2.22 0.22 0.00 0.43 0.00 0.00 52.55 51.41 1lse s ASP 119 Cb -0.02 -2.58 0.97 0.00 -0.30 0.00 0.00 42.92 40.99 1lse s ASP 119 CO 0.25 -1.45 1.67 1.33 -0.17 0.00 0.00 175.17 176.80 1lse n VAL 120 N 6.64 0.90 0.25 1.11 0.24 -1.26 -1.80 118.33 124.42 1lse n VAL 120 Ca 0.47 0.33 0.08 0.00 -2.04 0.00 0.00 64.34 63.17 1lse n VAL 120 Cb 0.47 -1.26 0.63 0.00 -1.47 0.00 0.00 33.84 32.21 1lse n VAL 120 CO 0.00 0.00 0.00 -0.61 -2.14 0.00 0.00 176.83 174.08 1lse h GLN 121 N 0.00 0.00 -0.24 7.34 4.15 -1.85 -2.41 115.11 122.09 1lse h GLN 121 Ca 0.00 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.44 1lse h GLN 121 Cb 0.28 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.96 1lse h GLN 121 CO 0.00 0.04 0.16 0.00 -1.93 0.00 0.00 178.83 177.11 1lse h ALA 122 N 1.96 1.95 0.00 3.38 0.00 -1.76 -2.48 119.26 122.31 1lse h ALA 122 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1lse h ALA 122 Cb 0.07 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1lse h ALA 122 CO 0.01 0.02 -0.09 -1.49 0.00 0.00 0.00 179.25 177.70 1lse h TRP 123 N 0.23 0.00 -0.24 0.00 4.06 -1.64 -2.36 115.95 115.99 1lse h TRP 123 Ca 0.10 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.05 1lse h TRP 123 Cb 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.28 1lse h TRP 123 CO -0.00 0.09 0.00 0.44 -3.56 0.00 0.00 178.44 175.41 1lse n ILE 124 N -3.55 0.49 -0.29 1.49 -5.35 -0.96 -4.78 119.36 106.41 1lse n ILE 124 Ca -0.02 -0.74 0.06 0.00 -0.27 0.00 0.00 62.75 61.78 1lse n ILE 124 Cb 0.21 0.92 0.17 0.00 -1.74 0.00 0.00 39.64 39.20 1lse n ILE 124 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 1lse h ARG 125 N 2.90 0.05 -0.53 6.28 2.43 -1.14 -2.75 114.38 121.62 1lse h ARG 125 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1lse h ARG 125 Cb 0.73 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 1lse h ARG 125 CO 0.00 0.03 0.00 0.41 -1.51 0.00 0.00 179.97 178.90 1lse n GLY 126 N -1.48 2.19 3.76 2.80 0.00 -1.26 -5.02 105.19 106.18 1lse n GLY 126 Ca 0.15 -0.69 -0.39 0.00 0.00 0.00 0.00 46.02 45.08 1lse n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lse s ARG 128 N -1.43 3.60 0.00 0.00 0.52 -1.26 -5.13 118.95 115.26 1lse s ARG 128 Ca 0.44 0.35 0.00 0.00 -0.52 0.00 0.00 55.73 56.00 1lse s ARG 128 Cb -0.26 -3.95 0.00 0.00 0.52 0.00 0.00 34.95 31.26 1lse s ARG 128 CO 0.32 -1.44 0.41 1.28 0.02 0.00 0.00 175.30 175.89