#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5lym s VAL 2 N 0.00 3.76 0.50 3.15 1.01 -1.26 -0.53 120.40 127.03 5lym s VAL 2 Ca 0.00 -0.52 -0.18 0.00 0.00 0.00 0.00 61.98 61.27 5lym s VAL 2 Cb 0.00 -2.82 -0.08 0.00 0.00 0.00 0.00 36.38 33.48 5lym s VAL 2 CO 0.00 0.27 1.00 -0.36 0.00 0.00 0.00 175.10 176.01 5lym s PHE 3 N 1.51 3.22 0.43 5.22 0.40 -0.57 -5.00 117.98 123.18 5lym s PHE 3 Ca 0.04 1.54 -0.08 0.00 -0.60 0.00 0.00 56.93 57.83 5lym s PHE 3 Cb -0.16 -2.91 -0.05 0.00 0.51 0.00 0.00 43.02 40.41 5lym s PHE 3 CO 0.00 -0.55 0.76 0.20 0.70 0.00 0.00 175.22 176.34 5lym s GLY 4 N -2.52 1.78 0.16 4.36 0.00 -1.26 -4.85 107.32 105.00 5lym s GLY 4 Ca 0.63 -0.33 -0.18 0.00 0.00 0.00 0.00 44.72 44.83 5lym s GLY 4 CO 0.25 -0.15 1.65 -0.09 0.00 0.00 0.00 173.10 174.75 5lym h ARG 5 N 0.90 -0.08 0.00 2.90 2.43 -1.98 -0.47 114.38 118.08 5lym h ARG 5 Ca -0.47 0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 58.57 5lym h ARG 5 Cb 1.19 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.74 5lym h ARG 5 CO 0.63 -0.05 -0.67 0.00 -1.51 0.00 0.00 179.97 178.37 5lym h GLU 7 N 0.00 0.44 -0.29 0.00 4.81 -1.85 -0.48 114.58 117.21 5lym h GLU 7 Ca -0.01 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.13 5lym h GLU 7 Cb 1.50 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.78 5lym h GLU 7 CO 0.08 0.38 0.03 1.25 -0.73 0.00 0.00 179.01 180.02 5lym h LEU 8 N 0.39 0.47 -0.78 1.64 6.46 -1.02 -2.09 115.31 120.39 5lym h LEU 8 Ca 0.11 -0.28 0.13 0.00 -0.12 0.00 0.00 57.88 57.73 5lym h LEU 8 Cb 0.06 -0.13 -0.09 0.00 -0.73 0.00 0.00 40.66 39.78 5lym h LEU 8 CO -0.02 0.63 0.36 0.00 -0.62 0.00 0.00 178.44 178.79 5lym h ALA 9 N 0.86 1.12 -0.33 1.25 0.00 -1.17 -0.45 119.26 120.55 5lym h ALA 9 Ca 0.09 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 5lym h ALA 9 Cb 0.37 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 5lym h ALA 9 CO 0.01 -0.13 -0.16 0.00 0.00 0.00 0.00 179.25 178.97 5lym h ALA 10 N 1.52 0.46 -0.47 0.00 0.00 -0.87 -0.88 119.26 119.02 5lym h ALA 10 Ca 0.42 -0.34 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 5lym h ALA 10 Cb 0.58 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 5lym h ALA 10 CO -0.36 0.37 -0.15 0.00 0.00 0.00 0.00 179.25 179.11 5lym h ALA 11 N 0.77 0.84 -0.64 0.00 0.00 -1.09 -0.27 119.26 118.86 5lym h ALA 11 Ca 0.07 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 5lym h ALA 11 Cb 0.69 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 5lym h ALA 11 CO 0.05 0.65 0.13 0.52 0.00 0.00 0.00 179.25 180.60 5lym h MET 12 N 0.80 1.03 -0.27 0.00 2.86 -0.99 -2.06 114.93 116.30 5lym h MET 12 Ca 0.12 -0.25 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 5lym h MET 12 Cb 0.69 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 5lym h MET 12 CO 0.05 0.93 0.15 -0.22 1.06 0.00 0.00 176.91 178.88 5lym h LYS 13 N 0.97 0.38 -0.88 1.72 3.64 -0.92 -1.32 116.57 120.17 5lym h LYS 13 Ca 0.20 -0.05 0.16 0.00 -1.27 0.00 0.00 60.65 59.70 5lym h LYS 13 Cb 0.38 -0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 32.06 5lym h LYS 13 CO 0.01 0.34 0.57 0.00 -2.27 0.00 0.00 179.45 178.09 5lym h ARG 14 N 0.32 0.57 -0.40 1.90 3.08 -0.82 -1.49 114.38 117.54 5lym h ARG 14 Ca 0.10 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.11 5lym h ARG 14 Cb 0.07 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.99 5lym h ARG 14 CO -0.02 0.38 0.00 0.72 -1.07 0.00 0.00 179.97 179.98 5lym n HIS 15 N -4.55 0.53 -1.09 3.04 8.25 -0.79 -4.93 115.22 115.68 5lym n HIS 15 Ca 0.18 -0.26 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 5lym n HIS 15 Cb 0.53 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.63 5lym n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 5lym n GLY 16 N 1.08 0.62 0.09 -1.41 0.00 -0.56 -4.97 105.19 100.03 5lym n GLY 16 Ca 0.13 -0.78 0.12 0.00 0.00 0.00 0.00 46.02 45.49 5lym n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 5lym h LEU 17 N 0.00 0.00 -9.10 0.99 4.07 -1.43 -3.41 115.31 106.43 5lym h LEU 17 Ca 0.00 -0.11 -0.56 0.00 0.08 0.00 0.00 57.88 57.28 5lym h LEU 17 Cb 0.32 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.03 5lym h LEU 17 CO 0.00 0.06 1.05 -0.62 -1.08 0.00 0.00 178.44 177.85 5lym s ASP 18 N -4.46 6.60 -1.11 -0.43 2.15 -1.26 -2.04 116.67 116.13 5lym s ASP 18 Ca 0.08 1.72 0.00 0.00 0.43 0.00 0.00 52.55 54.78 5lym s ASP 18 Cb 0.13 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 5lym s ASP 18 CO 0.67 -1.05 0.00 0.59 -0.17 0.00 0.00 175.17 175.21 5lym n ASN 19 N 7.65 -4.53 -4.68 -0.34 3.02 -0.11 -4.92 115.26 111.36 5lym n ASN 19 Ca 0.17 0.26 -0.42 0.00 -0.03 0.00 0.00 54.58 54.56 5lym n ASN 19 Cb 0.45 -2.95 -0.03 0.00 -0.61 0.00 0.00 39.78 36.64 5lym n ASN 19 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 5lym s TYR 20 N -2.30 2.18 -1.71 3.10 5.04 -0.87 -1.59 117.35 121.20 5lym s TYR 20 Ca 0.00 0.19 0.00 0.00 -2.44 0.00 0.00 57.07 54.82 5lym s TYR 20 Cb 0.00 -3.99 0.00 0.00 0.35 0.00 0.00 41.96 38.32 5lym s TYR 20 CO 0.00 -4.10 0.00 -2.13 -1.34 0.00 0.00 175.55 167.98 5lym n ARG 21 N 6.18 -1.71 -0.79 4.97 3.00 -1.26 -1.70 116.66 125.34 5lym n ARG 21 Ca 0.17 0.96 0.00 0.00 -0.00 0.00 0.00 57.85 58.98 5lym n ARG 21 Cb 0.41 -5.53 0.00 0.00 0.00 0.00 0.00 32.46 27.34 5lym n ARG 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 5lym n GLY 22 N -0.79 0.71 3.52 5.14 0.00 -0.62 -5.02 105.19 108.13 5lym n GLY 22 Ca -0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 5lym n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 5lym s TYR 23 N -2.56 3.13 0.78 1.61 2.02 -0.69 -4.90 117.35 116.74 5lym s TYR 23 Ca 0.00 -0.05 -0.13 0.00 -0.37 0.00 0.00 57.07 56.52 5lym s TYR 23 Cb 0.00 -3.09 0.07 0.00 -0.40 0.00 0.00 41.96 38.53 5lym s TYR 23 CO 0.00 -0.72 1.16 -1.54 -1.57 0.00 0.00 175.55 172.88 5lym s SER 24 N 1.87 4.04 0.45 2.29 1.04 -1.26 -0.94 113.70 121.19 5lym s SER 24 Ca 0.19 2.16 0.21 0.00 0.48 0.00 0.00 55.95 59.00 5lym s SER 24 Cb -0.15 -2.57 1.19 0.00 0.10 0.00 0.00 66.02 64.59 5lym s SER 24 CO 0.16 -2.36 1.85 0.25 0.98 0.00 0.00 173.24 174.12 5lym h LEU 25 N -0.82 0.31 -1.50 2.42 6.46 -1.91 0.02 115.31 120.28 5lym h LEU 25 Ca -0.46 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.33 5lym h LEU 25 Cb 1.27 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 41.16 5lym h LEU 25 CO 0.48 0.11 0.21 1.23 -0.62 0.00 0.00 178.44 179.86 5lym h GLY 26 N 0.30 0.59 0.87 3.75 0.00 -1.91 -1.73 103.07 104.93 5lym h GLY 26 Ca 0.48 -0.25 0.03 0.00 0.00 0.00 0.00 47.33 47.59 5lym h GLY 26 CO -0.15 0.24 0.42 3.43 0.00 0.00 0.00 176.54 180.48 5lym h ASN 27 N 0.56 0.68 0.17 0.19 2.35 -1.21 -0.97 115.58 117.34 5lym h ASN 27 Ca 0.14 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.66 5lym h ASN 27 Cb 0.03 -0.15 0.01 0.00 0.05 0.00 0.00 38.32 38.26 5lym h ASN 27 CO -0.02 0.47 -0.94 -0.50 -1.65 0.00 0.00 177.43 174.79 5lym h TRP 28 N 0.82 0.80 -0.43 1.19 4.06 -1.40 0.02 115.95 121.00 5lym h TRP 28 Ca 0.27 -0.42 -0.13 0.00 2.06 0.00 0.00 58.89 60.67 5lym h TRP 28 Cb 0.02 -0.10 -0.01 0.00 -1.00 0.00 0.00 29.16 28.07 5lym h TRP 28 CO -0.05 1.24 -0.23 0.28 -3.56 0.00 0.00 178.44 176.13 5lym h VAL 29 N 0.32 1.27 -0.42 1.49 2.07 -1.41 -1.61 116.25 117.97 5lym h VAL 29 Ca -0.09 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.03 5lym h VAL 29 Cb 1.58 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 32.57 5lym h VAL 29 CO 0.17 0.47 0.20 0.00 0.02 0.00 0.00 177.57 178.44 5lym h ALA 31 N 1.05 0.08 -0.31 0.00 0.00 -0.87 -2.35 119.26 116.87 5lym h ALA 31 Ca 0.14 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 5lym h ALA 31 Cb 0.11 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 5lym h ALA 31 CO -0.02 -0.50 0.01 0.00 0.00 0.00 0.00 179.25 178.75 5lym h ALA 32 N 1.12 1.45 0.40 0.00 0.00 -1.01 0.09 119.26 121.31 5lym h ALA 32 Ca 0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 5lym h ALA 32 Cb 0.15 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 5lym h ALA 32 CO -0.17 0.39 -0.22 -0.22 0.00 0.00 0.00 179.25 179.03 5lym h LYS 33 N 0.45 -0.55 0.00 0.00 1.63 -0.50 -1.70 116.57 115.89 5lym h LYS 33 Ca 0.10 0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.89 5lym h LYS 33 Cb 0.28 0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 32.03 5lym h LYS 33 CO 0.01 -0.37 -0.63 0.74 -3.45 0.00 0.00 179.45 175.74 5lym h PHE 34 N -0.58 0.00 -0.10 1.91 0.04 -1.22 0.14 116.94 117.13 5lym h PHE 34 Ca -0.05 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.69 5lym h PHE 34 Cb 0.46 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.61 5lym h PHE 34 CO -0.07 0.21 -0.07 0.93 -0.60 0.00 0.00 178.31 178.71 5lym h GLU 35 N 0.00 0.23 0.00 1.51 4.39 -0.99 -3.42 114.58 116.30 5lym h GLU 35 Ca -0.03 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.56 5lym h GLU 35 Cb 1.19 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 5lym h GLU 35 CO 0.02 0.62 0.00 -1.13 -1.16 0.00 0.00 179.01 177.36 5lym n SER 36 N -4.68 0.34 -3.89 1.42 3.41 -0.66 -4.87 113.62 104.69 5lym n SER 36 Ca -0.07 -1.07 -0.29 0.00 -0.26 0.00 0.00 58.87 57.18 5lym n SER 36 Cb 0.30 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.28 5lym n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 5lym n ASN 37 N -0.04 -4.70 -0.95 4.04 4.05 0.48 -2.27 115.26 115.89 5lym n ASN 37 Ca 0.00 -0.77 -0.12 0.00 0.45 0.00 0.00 54.58 54.14 5lym n ASN 37 Cb 0.25 -3.96 -0.05 0.00 1.23 0.00 0.00 39.78 37.25 5lym n ASN 37 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 5lym n PHE 38 N -4.69 0.00 -3.79 1.20 3.72 -1.13 -4.86 117.46 107.91 5lym n PHE 38 Ca 0.02 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.06 5lym n PHE 38 Cb 0.54 -2.47 -0.13 0.00 -0.94 0.00 0.00 39.48 36.48 5lym n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 5lym s ASN 39 N -2.66 4.91 0.10 4.37 3.04 -0.96 -1.52 114.94 122.22 5lym s ASN 39 Ca 0.00 -0.31 0.08 0.00 0.04 0.00 0.00 52.86 52.67 5lym s ASN 39 Cb 0.00 -1.87 0.42 0.00 -1.54 0.00 0.00 41.25 38.26 5lym s ASN 39 CO 0.00 -0.05 1.25 0.35 -3.04 0.00 0.00 177.10 175.61 5lym n THR 40 N 4.89 1.62 0.25 -5.21 -2.24 0.32 -2.58 114.28 111.31 5lym n THR 40 Ca -0.17 0.55 0.08 0.00 -2.27 0.00 0.00 64.05 62.24 5lym n THR 40 Cb 0.51 -1.53 0.13 0.00 -2.10 0.00 0.00 70.33 67.34 5lym n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 5lym n GLN 41 N -1.75 1.87 -1.75 -0.78 1.13 -1.26 -4.20 117.38 110.64 5lym n GLN 41 Ca -0.00 -1.78 -0.42 0.00 -1.94 0.00 0.00 57.00 52.86 5lym n GLN 41 Cb 0.03 -1.33 -0.01 0.00 0.11 0.00 0.00 30.24 29.04 5lym n GLN 41 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 5lym n ALA 42 N 0.87 2.54 -3.25 -1.58 0.00 -1.07 -4.78 120.51 113.25 5lym n ALA 42 Ca 0.12 0.36 -0.15 0.00 0.00 0.00 0.00 53.44 53.78 5lym n ALA 42 Cb 0.43 -2.46 -0.15 0.00 0.00 0.00 0.00 19.45 17.27 5lym n ALA 42 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 5lym s THR 43 N -0.25 0.15 -0.25 0.00 2.01 -1.26 -0.04 115.64 116.00 5lym s THR 43 Ca 0.61 0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.62 5lym s THR 43 Cb -0.49 -0.18 0.07 0.00 0.01 0.00 0.00 72.50 71.91 5lym s THR 43 CO 0.52 0.09 -0.01 0.21 -0.69 0.00 0.00 174.62 174.73 5lym s ASN 44 N 0.46 3.81 0.05 3.53 3.04 0.32 -4.93 114.94 121.22 5lym s ASN 44 Ca -0.04 -1.26 -0.31 0.00 0.04 0.00 0.00 52.86 51.29 5lym s ASN 44 Cb -0.07 -1.09 -0.07 0.00 -1.54 0.00 0.00 41.25 38.49 5lym s ASN 44 CO -0.01 -0.28 1.42 -0.13 -3.04 0.00 0.00 177.10 175.06 5lym s ARG 45 N 1.45 4.29 -0.08 0.43 1.81 -1.26 -0.58 118.95 125.01 5lym s ARG 45 Ca -0.02 2.04 -0.01 0.00 -1.72 0.00 0.00 55.73 56.02 5lym s ARG 45 Cb -0.18 -3.46 -0.03 0.00 -0.45 0.00 0.00 34.95 30.82 5lym s ARG 45 CO -0.09 -0.54 -0.02 -0.80 -0.68 0.00 0.00 175.30 173.17 5lym s ASN 46 N 1.67 5.05 0.00 0.23 0.01 0.85 -4.99 114.94 117.77 5lym s ASN 46 Ca 0.65 0.09 0.00 0.00 -0.71 0.00 0.00 52.86 52.89 5lym s ASN 46 Cb -0.34 -1.39 0.00 0.00 0.41 0.00 0.00 41.25 39.93 5lym s ASN 46 CO 0.28 0.37 0.00 0.41 -1.51 0.00 0.00 177.10 176.65 5lym n THR 47 N 2.21 0.00 0.55 1.60 -1.04 -1.26 -1.28 114.28 115.06 5lym n THR 47 Ca -0.18 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 61.85 5lym n THR 47 Cb 0.53 0.00 0.11 0.00 -1.82 0.00 0.00 70.33 69.15 5lym n THR 47 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 5lym n ASP 48 N -2.43 2.19 -0.20 8.00 5.75 -1.26 -4.87 116.55 123.73 5lym n ASP 48 Ca 0.00 -2.23 -0.03 0.00 -0.01 0.00 0.00 54.79 52.52 5lym n ASP 48 Cb 0.00 -0.53 -0.01 0.00 -1.03 0.00 0.00 41.12 39.55 5lym n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 5lym n GLY 49 N 0.20 0.59 3.72 6.12 0.00 -0.40 -4.76 105.19 110.65 5lym n GLY 49 Ca 0.07 -0.61 -0.24 0.00 0.00 0.00 0.00 46.02 45.24 5lym n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 5lym s SER 50 N -2.65 4.99 0.05 1.61 1.04 -1.20 -4.34 113.70 113.19 5lym s SER 50 Ca 0.00 -0.42 0.06 0.00 0.48 0.00 0.00 55.95 56.07 5lym s SER 50 Cb 0.00 -1.11 -0.03 0.00 0.10 0.00 0.00 66.02 64.98 5lym s SER 50 CO 0.00 0.02 -0.16 -0.89 0.98 0.00 0.00 173.24 173.19 5lym s THR 51 N -2.07 1.24 -0.13 2.02 2.01 -1.26 -0.10 115.64 117.35 5lym s THR 51 Ca 0.31 -1.16 -0.14 0.00 0.31 0.00 0.00 61.69 61.01 5lym s THR 51 Cb -0.08 -1.13 -0.05 0.00 0.01 0.00 0.00 72.50 71.25 5lym s THR 51 CO 0.21 -0.04 0.33 -1.81 -0.69 0.00 0.00 174.62 172.63 5lym s ASP 52 N -1.37 6.53 -0.09 3.53 1.01 0.26 -1.12 116.67 125.41 5lym s ASP 52 Ca 0.02 0.62 0.04 0.00 0.71 0.00 0.00 52.55 53.94 5lym s ASP 52 Cb -0.09 -2.20 0.00 0.00 1.01 0.00 0.00 42.92 41.64 5lym s ASP 52 CO 0.02 0.13 -0.21 -0.31 0.21 0.00 0.00 175.17 175.01 5lym s TYR 53 N 0.18 2.28 0.00 4.23 1.51 -0.20 -0.52 117.35 124.83 5lym s TYR 53 Ca 0.19 -0.91 0.00 0.00 -1.01 0.00 0.00 57.07 55.34 5lym s TYR 53 Cb -0.14 -1.54 0.00 0.00 -0.11 0.00 0.00 41.96 40.17 5lym s TYR 53 CO 0.06 -0.37 0.00 0.41 -1.11 0.00 0.00 175.55 174.54 5lym n GLY 54 N 3.56 -1.79 0.21 0.71 0.00 0.94 -1.72 105.19 107.10 5lym n GLY 54 Ca -0.20 -1.67 0.03 0.00 0.00 0.00 0.00 46.02 44.18 5lym n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 5lym h ILE 55 N 0.00 1.21 -0.48 -0.61 2.10 -1.73 -1.75 117.51 116.24 5lym h ILE 55 Ca 0.00 -1.00 0.00 0.00 1.08 0.00 0.00 64.86 64.94 5lym h ILE 55 Cb 0.00 1.47 0.00 0.00 -1.09 0.00 0.00 36.82 37.20 5lym h ILE 55 CO 0.00 0.29 0.00 0.18 -1.08 0.00 0.00 178.15 177.54 5lym n LEU 56 N -4.20 3.81 -3.91 2.19 7.99 -1.26 -4.11 117.00 117.51 5lym n LEU 56 Ca -0.02 -2.32 -0.40 0.00 -0.01 0.00 0.00 56.01 53.27 5lym n LEU 56 Cb 0.33 -0.43 0.03 0.00 -0.11 0.00 0.00 43.42 43.24 5lym n LEU 56 CO 0.38 0.78 -0.13 0.00 -1.51 0.00 0.00 177.39 176.92 5lym n GLN 57 N 0.68 -0.65 -3.03 3.23 1.13 -0.66 -4.91 117.38 113.18 5lym n GLN 57 Ca 0.19 0.25 -0.40 0.00 -1.94 0.00 0.00 57.00 55.11 5lym n GLN 57 Cb 0.68 -3.13 -0.05 0.00 0.11 0.00 0.00 30.24 27.85 5lym n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 5lym s ILE 58 N -3.48 4.90 -0.01 5.09 1.01 -0.70 -4.52 121.20 123.50 5lym s ILE 58 Ca 0.47 1.52 -0.20 0.00 0.00 0.00 0.00 60.65 62.44 5lym s ILE 58 Cb -0.22 -4.07 -0.05 0.00 0.01 0.00 0.00 42.46 38.13 5lym s ILE 58 CO 0.93 0.31 0.57 0.21 0.00 0.00 0.00 174.94 176.95 5lym s ASN 59 N 0.35 6.94 0.24 3.58 3.84 -1.26 -1.03 114.94 127.60 5lym s ASN 59 Ca 0.38 1.12 0.23 0.00 0.21 0.00 0.00 52.86 54.80 5lym s ASN 59 Cb -0.19 -2.35 0.96 0.00 -0.55 0.00 0.00 41.25 39.12 5lym s ASN 59 CO 0.20 0.13 1.69 -1.54 -2.79 0.00 0.00 177.10 174.79 5lym n SER 60 N 2.63 0.61 -0.19 -4.21 3.41 -0.28 -2.18 113.62 113.42 5lym n SER 60 Ca -0.08 0.66 -0.07 0.00 -0.26 0.00 0.00 58.87 59.12 5lym n SER 60 Cb 0.51 -0.78 0.02 0.00 -0.26 0.00 0.00 64.21 63.70 5lym n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 5lym h ARG 61 N 0.00 0.74 0.00 4.33 9.65 -1.84 -3.38 114.38 123.88 5lym h ARG 61 Ca 0.00 -0.08 -0.16 0.00 -1.10 0.00 0.00 59.98 58.64 5lym h ARG 61 Cb 0.34 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 28.74 5lym h ARG 61 CO 0.00 0.56 -1.60 0.91 2.80 0.00 0.00 179.97 182.64 5lym n TRP 62 N -4.64 0.00 -0.04 2.20 7.02 -1.21 -2.09 117.44 118.68 5lym n TRP 62 Ca 0.03 0.00 -0.01 0.00 -1.02 0.00 0.00 57.50 56.49 5lym n TRP 62 Cb 0.07 -0.43 -0.08 0.00 -2.42 0.00 0.00 31.31 28.45 5lym n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 5lym n TRP 63 N -2.32 0.00 -4.04 -5.99 7.02 -0.93 -0.74 117.44 110.44 5lym n TRP 63 Ca -0.14 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.25 5lym n TRP 63 Cb 0.78 -0.42 -0.09 0.00 -2.42 0.00 0.00 31.31 29.16 5lym n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 5lym s ASN 65 N -2.95 6.08 0.00 0.00 2.47 -0.61 -4.64 114.94 115.28 5lym s ASN 65 Ca 0.13 0.06 0.09 0.00 0.42 0.00 0.00 52.86 53.57 5lym s ASN 65 Cb 0.07 -2.14 0.23 0.00 -1.45 0.00 0.00 41.25 37.95 5lym s ASN 65 CO -0.05 -0.08 1.14 -0.90 -3.72 0.00 0.00 177.10 173.49 5lym n ASP 66 N 5.11 2.61 0.00 -4.21 5.68 -1.26 -1.07 116.55 123.41 5lym n ASP 66 Ca -0.13 -1.88 0.00 0.00 -0.50 0.00 0.00 54.79 52.28 5lym n ASP 66 Cb 0.52 -0.16 0.00 0.00 -1.14 0.00 0.00 41.12 40.33 5lym n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 5lym n GLY 67 N 0.43 0.99 0.02 6.12 0.00 -1.26 -4.71 105.19 106.78 5lym n GLY 67 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 5lym n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 5lym n ARG 68 N -2.00 0.68 -3.70 1.61 1.85 -1.26 -5.06 116.66 108.78 5lym n ARG 68 Ca 0.00 -0.77 -0.35 0.00 -1.00 0.00 0.00 57.85 55.72 5lym n ARG 68 Cb 0.00 -0.62 -0.08 0.00 -1.05 0.00 0.00 32.46 30.71 5lym n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 5lym s THR 69 N -0.26 5.40 0.10 8.89 2.01 -1.26 -4.92 115.64 125.58 5lym s THR 69 Ca 0.00 0.25 -0.35 0.00 0.31 0.00 0.00 61.69 61.91 5lym s THR 69 Cb 0.00 -3.50 -0.14 0.00 0.01 0.00 0.00 72.50 68.88 5lym s THR 69 CO 0.00 0.44 1.57 -0.81 -0.69 0.00 0.00 174.62 175.13 5lym n PRO 70 N 3.45 1.88 -3.17 4.92 -0.04 -1.26 -2.33 135.00 138.45 5lym n PRO 70 Ca -0.15 0.68 -0.23 0.00 -0.04 0.00 0.00 63.50 63.76 5lym n PRO 70 Cb 0.52 -2.43 0.04 0.00 -0.04 0.00 0.00 33.50 31.60 5lym n PRO 70 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 5lym n GLY 71 N 3.36 -0.53 3.61 0.55 0.00 -1.26 -4.79 105.19 106.13 5lym n GLY 71 Ca 0.18 0.16 -0.43 0.00 0.00 0.00 0.00 46.02 45.93 5lym n GLY 71 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 5lym s SER 72 N -2.84 5.94 0.74 1.61 0.15 -0.98 -4.87 113.70 113.44 5lym s SER 72 Ca 0.37 1.43 -0.11 0.00 0.70 0.00 0.00 55.95 58.34 5lym s SER 72 Cb -0.17 -2.53 0.04 0.00 -1.71 0.00 0.00 66.02 61.65 5lym s SER 72 CO 0.46 -1.65 1.09 -0.13 1.20 0.00 0.00 173.24 174.22 5lym s ARG 73 N 5.54 2.55 -0.39 5.44 1.81 -0.89 -5.03 118.95 127.99 5lym s ARG 73 Ca 0.81 0.56 0.09 0.00 -1.72 0.00 0.00 55.73 55.46 5lym s ARG 73 Cb -0.24 -1.98 0.27 0.00 -0.45 0.00 0.00 34.95 32.55 5lym s ARG 73 CO 0.33 -1.27 0.57 -1.71 -0.68 0.00 0.00 175.30 172.55 5lym n ASN 74 N -3.18 0.16 0.21 0.23 4.05 -1.22 -3.99 115.26 111.52 5lym n ASN 74 Ca 0.07 -2.77 0.06 0.00 0.45 0.00 0.00 54.58 52.38 5lym n ASN 74 Cb 0.57 -0.54 0.48 0.00 1.23 0.00 0.00 39.78 41.52 5lym n ASN 74 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 5lym h LEU 75 N 3.82 0.00 0.00 1.20 3.38 -0.91 -1.37 115.31 121.43 5lym h LEU 75 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 5lym h LEU 75 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 5lym h LEU 75 CO 0.46 0.27 -0.23 0.00 0.09 0.00 0.00 178.44 179.02 5lym n ASN 77 N -1.59 -3.80 -3.77 0.00 5.15 -0.52 -4.97 115.26 105.77 5lym n ASN 77 Ca 0.06 -0.57 -0.13 0.00 -0.60 0.00 0.00 54.58 53.34 5lym n ASN 77 Cb 0.35 -4.57 -0.08 0.00 -0.53 0.00 0.00 39.78 34.95 5lym n ASN 77 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 5lym s ILE 78 N -3.33 0.06 0.41 -1.44 -4.36 -1.26 -5.07 121.20 106.22 5lym s ILE 78 Ca 0.18 -0.53 -0.26 0.00 -0.26 0.00 0.00 60.65 59.78 5lym s ILE 78 Cb -0.02 -0.66 -0.09 0.00 1.25 0.00 0.00 42.46 42.94 5lym s ILE 78 CO 0.64 -0.29 1.31 -2.16 0.24 0.00 0.00 174.94 174.68 5lym s PRO 79 N -1.54 3.93 0.54 0.37 0.04 -1.26 -1.58 135.00 135.50 5lym s PRO 79 Ca -0.12 2.16 0.25 0.00 0.04 0.00 0.00 61.00 63.32 5lym s PRO 79 Cb -0.05 -2.73 1.52 0.00 0.04 0.00 0.00 34.50 33.28 5lym s PRO 79 CO 0.03 -0.53 2.15 0.00 0.04 0.00 0.00 177.00 178.70 5lym h SER 81 N 0.00 0.03 0.60 0.00 4.64 -1.92 -1.09 113.55 115.82 5lym h SER 81 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 5lym h SER 81 Cb 0.13 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 5lym h SER 81 CO 0.01 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.99 5lym h ALA 82 N 1.87 1.00 -0.01 5.18 0.00 -1.78 -0.86 119.26 124.67 5lym h ALA 82 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 5lym h ALA 82 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 5lym h ALA 82 CO -0.01 0.00 -0.09 1.28 0.00 0.00 0.00 179.25 180.43 5lym n LEU 83 N -2.92 0.93 -1.12 0.00 4.77 -0.41 -3.44 117.00 114.81 5lym n LEU 83 Ca -0.00 -0.25 0.09 0.00 -0.03 0.00 0.00 56.01 55.82 5lym n LEU 83 Cb 0.20 -0.08 0.27 0.00 -2.33 0.00 0.00 43.42 41.48 5lym n LEU 83 CO 0.23 0.16 0.73 0.18 -1.33 0.00 0.00 177.39 177.36 5lym n LEU 84 N -0.46 3.75 -4.87 2.23 4.77 -0.33 -4.00 117.00 118.08 5lym n LEU 84 Ca 0.17 -2.15 -0.31 0.00 -0.03 0.00 0.00 56.01 53.69 5lym n LEU 84 Cb 0.30 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 5lym n LEU 84 CO 0.21 0.85 0.67 -0.55 -1.33 0.00 0.00 177.39 177.23 5lym s SER 85 N -1.04 6.28 0.04 -1.43 0.15 -1.22 -4.56 113.70 111.91 5lym s SER 85 Ca 0.40 1.36 0.25 0.00 0.70 0.00 0.00 55.95 58.65 5lym s SER 85 Cb 0.23 -2.44 1.02 0.00 -1.71 0.00 0.00 66.02 63.12 5lym s SER 85 CO 0.24 -0.79 1.78 -1.54 1.20 0.00 0.00 173.24 174.13 5lym n SER 86 N -2.53 0.12 -4.63 5.45 3.41 -1.26 -4.57 113.62 109.62 5lym n SER 86 Ca 0.05 0.52 -0.42 0.00 -0.26 0.00 0.00 58.87 58.76 5lym n SER 86 Cb 0.54 -0.55 -0.05 0.00 -0.26 0.00 0.00 64.21 63.89 5lym n SER 86 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 5lym s ASP 87 N -3.23 6.73 0.00 4.04 2.15 -1.26 -4.96 116.67 120.14 5lym s ASP 87 Ca 0.11 0.86 0.16 0.00 0.43 0.00 0.00 52.55 54.11 5lym s ASP 87 Cb 0.15 -2.41 0.68 0.00 -0.30 0.00 0.00 42.92 41.04 5lym s ASP 87 CO 0.46 -0.51 1.47 2.30 -0.17 0.00 0.00 175.17 178.72 5lym n ILE 88 N 5.33 0.18 -0.10 4.11 -5.35 -1.26 -4.42 119.36 117.85 5lym n ILE 88 Ca 0.04 -0.24 -0.06 0.00 -0.27 0.00 0.00 62.75 62.21 5lym n ILE 88 Cb 0.48 0.14 0.01 0.00 -1.74 0.00 0.00 39.64 38.53 5lym n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 5lym h THR 89 N 1.38 0.81 -0.27 7.28 2.02 -1.94 0.48 112.91 122.67 5lym h THR 89 Ca 0.00 -0.06 -0.06 0.00 0.77 0.00 0.00 66.41 67.06 5lym h THR 89 Cb 0.31 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 5lym h THR 89 CO 0.00 0.03 -0.08 0.00 0.37 0.00 0.00 175.52 175.84 5lym h ALA 90 N 1.26 0.38 -0.54 6.16 0.00 -1.85 0.15 119.26 124.82 5lym h ALA 90 Ca 0.16 -0.28 0.05 0.00 0.00 0.00 0.00 54.91 54.84 5lym h ALA 90 Cb 0.19 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 5lym h ALA 90 CO -0.22 0.20 0.27 0.77 0.00 0.00 0.00 179.25 180.27 5lym h SER 91 N 0.29 0.39 -0.39 0.00 0.02 -1.76 -1.40 113.55 110.70 5lym h SER 91 Ca 0.07 0.03 -0.12 0.00 -0.84 0.00 0.00 61.79 60.93 5lym h SER 91 Cb 0.56 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 5lym h SER 91 CO 0.03 0.27 -0.23 0.58 -1.14 0.00 0.00 176.83 176.34 5lym h VAL 92 N 0.53 1.28 -0.70 2.27 2.07 -0.47 -1.20 116.25 120.04 5lym h VAL 92 Ca 0.24 -1.37 -0.06 0.00 0.82 0.00 0.00 66.70 66.32 5lym h VAL 92 Cb 0.15 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 5lym h VAL 92 CO -0.17 0.46 0.19 0.78 0.02 0.00 0.00 177.57 178.85 5lym h ASN 93 N 0.64 1.04 -0.20 0.57 -0.26 -0.89 -1.67 115.58 114.82 5lym h ASN 93 Ca 0.08 -0.22 -0.11 0.00 -0.56 0.00 0.00 56.30 55.49 5lym h ASN 93 Cb 0.79 -0.27 -0.00 0.00 -1.06 0.00 0.00 38.32 37.78 5lym h ASN 93 CO 0.06 0.99 -0.29 0.00 -1.06 0.00 0.00 177.43 177.13 5lym h ALA 95 N 0.62 1.93 -0.47 0.00 0.00 -1.03 0.29 119.26 120.60 5lym h ALA 95 Ca 0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 5lym h ALA 95 Cb 0.87 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 5lym h ALA 95 CO 0.07 0.01 0.12 0.87 0.00 0.00 0.00 179.25 180.32 5lym h LYS 96 N 0.00 0.70 -0.15 0.00 1.57 -1.12 -0.80 116.57 116.78 5lym h LYS 96 Ca -0.00 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.61 5lym h LYS 96 Cb 0.02 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 5lym h LYS 96 CO 0.00 0.63 -0.10 0.87 -0.57 0.00 0.00 179.45 180.28 5lym h LYS 97 N 0.68 0.33 -0.10 3.15 1.57 -0.37 -3.07 116.57 118.76 5lym h LYS 97 Ca 0.16 -0.15 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 5lym h LYS 97 Cb 0.24 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 5lym h LYS 97 CO -0.00 0.68 -0.03 0.82 -0.57 0.00 0.00 179.45 180.35 5lym h ILE 98 N -0.02 0.90 0.00 1.86 2.04 -0.83 -2.54 117.51 118.91 5lym h ILE 98 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.89 5lym h ILE 98 Cb 0.59 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 5lym h ILE 98 CO 0.03 0.00 0.00 1.62 0.00 0.00 0.00 178.15 179.80 5lym h VAL 99 N -0.00 0.00 -0.01 1.67 3.04 -1.20 -1.56 116.25 118.18 5lym h VAL 99 Ca 0.05 -0.36 0.00 0.00 -1.01 0.00 0.00 66.70 65.37 5lym h VAL 99 Cb 0.08 1.23 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 5lym h VAL 99 CO -0.10 0.00 -0.01 -1.20 -1.01 0.00 0.00 177.57 175.24 5lym n SER 100 N -2.65 1.14 -0.64 3.17 7.64 -0.97 -3.81 113.62 117.50 5lym n SER 100 Ca 0.01 -1.34 0.07 0.00 1.01 0.00 0.00 58.87 58.62 5lym n SER 100 Cb 0.27 0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.67 5lym n SER 100 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 5lym n ASP 101 N -0.14 1.88 0.00 6.43 2.03 -0.59 -4.89 116.55 121.27 5lym n ASP 101 Ca 0.20 -1.94 0.00 0.00 0.52 0.00 0.00 54.79 53.56 5lym n ASP 101 Cb 0.30 -0.21 0.00 0.00 -0.72 0.00 0.00 41.12 40.49 5lym n ASP 101 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 5lym n GLY 102 N 1.08 0.98 0.00 0.27 0.00 -1.26 -4.94 105.19 101.32 5lym n GLY 102 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 5lym n GLY 102 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 5lym n ASN 103 N 0.00 1.78 0.00 1.61 5.15 -1.26 -5.10 115.26 117.44 5lym n ASN 103 Ca 0.00 -1.86 0.00 0.00 -0.60 0.00 0.00 54.58 52.12 5lym n ASN 103 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 5lym n ASN 103 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 5lym n GLY 104 N -0.43 2.52 0.08 8.20 0.00 -1.25 -1.78 105.19 112.53 5lym n GLY 104 Ca 0.00 -0.17 0.15 0.00 0.00 0.00 0.00 46.02 46.00 5lym n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 5lym n MET 105 N 14.00 0.95 0.00 1.61 2.81 -1.26 -3.27 117.12 131.95 5lym n MET 105 Ca 0.00 -0.16 0.04 0.00 -1.81 0.00 0.00 57.70 55.78 5lym n MET 105 Cb 0.00 -1.50 0.19 0.00 -0.71 0.00 0.00 33.22 31.20 5lym n MET 105 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 5lym n ASN 106 N -0.89 0.00 0.28 7.83 3.02 -0.74 -1.47 115.26 123.30 5lym n ASN 106 Ca 0.20 0.46 0.19 0.00 -0.03 0.00 0.00 54.58 55.40 5lym n ASN 106 Cb 0.19 -0.47 0.84 0.00 -0.61 0.00 0.00 39.78 39.72 5lym n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 5lym h ALA 107 N 2.31 1.00 -2.79 5.41 0.00 -1.70 -3.40 119.26 120.09 5lym h ALA 107 Ca 0.00 0.00 -0.70 0.00 0.00 0.00 0.00 54.91 54.21 5lym h ALA 107 Cb 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 17.70 5lym h ALA 107 CO 0.00 0.00 -0.52 -1.58 0.00 0.00 0.00 179.25 177.15 5lym s TRP 108 N -3.79 3.22 0.14 0.00 0.51 -0.54 -4.98 118.94 113.49 5lym s TRP 108 Ca -0.01 -0.75 -0.16 0.00 -2.12 0.00 0.00 56.10 53.06 5lym s TRP 108 Cb 0.10 -2.43 -0.01 0.00 -0.81 0.00 0.00 33.47 30.33 5lym s TRP 108 CO 0.48 -0.56 1.72 0.28 -0.51 0.00 0.00 176.95 178.35 5lym h VAL 109 N 5.76 1.16 -0.36 4.03 2.07 -1.85 -1.99 116.25 125.07 5lym h VAL 109 Ca -0.28 -0.46 -0.00 0.00 0.82 0.00 0.00 66.70 66.78 5lym h VAL 109 Cb 1.12 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 5lym h VAL 109 CO 0.65 0.17 0.22 0.00 0.02 0.00 0.00 177.57 178.64 5lym h ALA 110 N 1.04 1.71 -0.09 1.67 0.00 -1.93 -1.37 119.26 120.29 5lym h ALA 110 Ca 0.13 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 5lym h ALA 110 Cb 0.11 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 5lym h ALA 110 CO -0.02 0.26 0.05 2.35 0.00 0.00 0.00 179.25 181.88 5lym h TRP 111 N 0.49 0.14 -0.99 0.00 7.01 -1.72 -0.60 115.95 120.28 5lym h TRP 111 Ca 0.13 -0.01 0.10 0.00 2.11 0.00 0.00 58.89 61.22 5lym h TRP 111 Cb -0.03 -0.04 -0.08 0.00 -2.10 0.00 0.00 29.16 26.91 5lym h TRP 111 CO 0.00 0.20 0.62 0.00 -2.79 0.00 0.00 178.44 176.48 5lym h ARG 112 N 0.03 1.02 0.00 2.65 3.08 -0.75 0.61 114.38 121.02 5lym h ARG 112 Ca 0.03 -0.06 -0.24 0.00 0.07 0.00 0.00 59.98 59.79 5lym h ARG 112 Cb 0.12 -0.23 -0.04 0.00 0.08 0.00 0.00 29.97 29.90 5lym h ARG 112 CO -0.00 0.67 -1.55 -0.91 -1.07 0.00 0.00 179.97 177.11 5lym h ASN 113 N 1.05 0.00 0.00 7.04 2.35 -1.13 -3.37 115.58 121.51 5lym h ASN 113 Ca 0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.21 5lym h ASN 113 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 5lym h ASN 113 CO -0.23 0.82 -0.76 0.54 -1.65 0.00 0.00 177.43 176.15 5lym n ARG 114 N -2.99 1.61 -0.05 0.81 5.12 -0.24 -4.85 116.66 116.07 5lym n ARG 114 Ca -0.13 0.00 -0.07 0.00 -1.93 0.00 0.00 57.85 55.72 5lym n ARG 114 Cb 0.96 -0.88 -0.05 0.00 -1.16 0.00 0.00 32.46 31.32 5lym n ARG 114 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 5lym n LYS 116 N -2.72 2.17 -0.94 0.00 4.81 -0.18 -1.95 118.16 119.34 5lym n LYS 116 Ca -0.18 0.78 0.00 0.00 -0.87 0.00 0.00 58.31 58.04 5lym n LYS 116 Cb 0.72 -2.53 0.00 0.00 0.02 0.00 0.00 35.03 33.24 5lym n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 5lym n GLY 117 N 3.12 0.87 3.94 3.14 0.00 -1.26 -4.96 105.19 110.03 5lym n GLY 117 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 5lym n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 5lym s THR 118 N -3.44 1.77 -1.19 2.61 -4.23 -0.82 -5.01 115.64 105.33 5lym s THR 118 Ca 0.00 -1.37 -0.15 0.00 -1.18 0.00 0.00 61.69 58.99 5lym s THR 118 Cb 0.00 -2.14 0.14 0.00 1.34 0.00 0.00 72.50 71.84 5lym s THR 118 CO 0.00 0.00 1.46 -0.62 -0.54 0.00 0.00 174.62 174.92 5lym s ASP 119 N -4.38 6.97 0.39 3.99 2.15 -1.26 -4.78 116.67 119.74 5lym s ASP 119 Ca 0.41 -2.75 0.28 0.00 0.43 0.00 0.00 52.55 50.92 5lym s ASP 119 Cb -0.03 -2.44 1.09 0.00 -0.30 0.00 0.00 42.92 41.24 5lym s ASP 119 CO 0.26 -0.88 1.82 1.62 -0.17 0.00 0.00 175.17 177.82 5lym h VAL 120 N 5.02 0.00 0.00 1.11 3.04 -1.92 -1.61 116.25 121.88 5lym h VAL 120 Ca 0.32 -0.41 0.00 0.00 -1.01 0.00 0.00 66.70 65.61 5lym h VAL 120 Cb 0.89 1.28 0.00 0.00 -2.01 0.00 0.00 31.29 31.45 5lym h VAL 120 CO 1.28 0.00 0.00 1.56 -1.01 0.00 0.00 177.57 179.40 5lym h GLN 121 N 0.00 0.00 -0.33 4.17 7.50 -1.88 -1.65 115.11 122.91 5lym h GLN 121 Ca 0.00 0.00 0.10 0.00 0.50 0.00 0.00 58.65 59.25 5lym h GLN 121 Cb 0.49 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.00 5lym h GLN 121 CO 0.00 0.00 0.28 0.00 -1.50 0.00 0.00 178.83 177.61 5lym h ALA 122 N 2.01 2.16 0.00 3.87 0.00 -1.69 -2.45 119.26 123.15 5lym h ALA 122 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 5lym h ALA 122 Cb 0.05 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 5lym h ALA 122 CO 0.00 -0.46 0.00 -1.49 0.00 0.00 0.00 179.25 177.30 5lym h TRP 123 N 0.00 0.00 -0.46 0.00 4.06 -1.53 -1.89 115.95 116.13 5lym h TRP 123 Ca 0.16 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.11 5lym h TRP 123 Cb 0.73 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.89 5lym h TRP 123 CO 0.00 0.00 0.00 -0.89 -3.56 0.00 0.00 178.44 173.99 5lym n ILE 124 N -2.59 0.79 -2.02 1.49 2.08 -0.93 -4.83 119.36 113.36 5lym n ILE 124 Ca 0.02 -0.90 -0.42 0.00 0.56 0.00 0.00 62.75 62.01 5lym n ILE 124 Cb 0.27 0.68 -0.03 0.00 -0.75 0.00 0.00 39.64 39.81 5lym n ILE 124 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 5lym s ARG 125 N -1.11 4.23 0.00 0.38 3.52 -0.71 -1.93 118.95 123.33 5lym s ARG 125 Ca 0.35 2.24 0.00 0.00 -0.13 0.00 0.00 55.73 58.18 5lym s ARG 125 Cb 0.19 -3.44 0.00 0.00 -1.56 0.00 0.00 34.95 30.14 5lym s ARG 125 CO 0.25 -0.63 0.00 0.41 -0.81 0.00 0.00 175.30 174.52 5lym n GLY 126 N 3.80 1.93 3.81 8.12 0.00 -1.26 -5.01 105.19 116.58 5lym n GLY 126 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 5lym n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5lym s ARG 128 N -3.59 0.86 0.00 0.00 1.81 -1.26 -5.06 118.95 111.71 5lym s ARG 128 Ca 0.64 -0.03 0.00 0.00 -1.72 0.00 0.00 55.73 54.62 5lym s ARG 128 Cb -0.14 -1.05 0.00 0.00 -0.45 0.00 0.00 34.95 33.31 5lym s ARG 128 CO 0.25 -0.22 0.19 1.28 -0.68 0.00 0.00 175.30 176.11