#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2lis s TYR 5 N 0.00 2.94 -0.17 4.41 2.02 -1.26 -5.05 117.35 120.24 2lis s TYR 5 Ca 0.00 1.57 -0.05 0.00 -0.37 0.00 0.00 57.07 58.22 2lis s TYR 5 Cb 0.00 -3.10 -0.03 0.00 -0.40 0.00 0.00 41.96 38.42 2lis s TYR 5 CO 0.00 -0.95 0.01 0.08 -1.57 0.00 0.00 175.55 173.11 2lis s VAL 6 N -1.95 4.27 -0.21 0.71 1.01 -1.26 -5.08 120.40 117.90 2lis s VAL 6 Ca 0.68 -0.22 -0.28 0.00 0.00 0.00 0.00 61.98 62.16 2lis s VAL 6 Cb -0.18 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.30 2lis s VAL 6 CO 0.21 0.47 0.99 -1.61 0.00 0.00 0.00 175.10 175.16 2lis s GLU 7 N 0.45 4.28 0.60 2.72 0.41 -1.26 -5.02 118.70 120.88 2lis s GLU 7 Ca -0.01 1.29 -0.17 0.00 -0.41 0.00 0.00 54.97 55.67 2lis s GLU 7 Cb -0.14 -3.62 -0.03 0.00 -1.78 0.00 0.00 34.13 28.56 2lis s GLU 7 CO 0.02 -0.55 1.10 -1.25 -0.49 0.00 0.00 175.26 174.09 2lis s PRO 8 N 2.90 3.14 0.23 0.39 0.04 -1.26 -5.04 135.00 135.40 2lis s PRO 8 Ca 0.43 1.44 -0.06 0.00 0.04 0.00 0.00 61.00 62.84 2lis s PRO 8 Cb -0.16 -1.99 -0.06 0.00 0.04 0.00 0.00 34.50 32.33 2lis s PRO 8 CO 0.08 -0.99 0.50 0.15 0.04 0.00 0.00 177.00 176.79 2lis s LYS 9 N -3.76 3.68 0.10 4.56 1.02 -1.26 -5.00 119.74 119.08 2lis s LYS 9 Ca 0.68 0.06 0.27 0.00 0.02 0.00 0.00 55.97 57.00 2lis s LYS 9 Cb -0.21 -2.70 0.88 0.00 -0.52 0.00 0.00 37.83 35.28 2lis s LYS 9 CO 0.34 0.32 1.74 1.19 -0.92 0.00 0.00 175.35 178.02 2lis n PHE 10 N -0.40 0.44 -3.72 3.18 3.72 -1.26 -4.75 117.46 114.67 2lis n PHE 10 Ca -0.01 0.13 -0.13 0.00 -0.05 0.00 0.00 57.45 57.39 2lis n PHE 10 Cb 0.53 -0.67 -0.10 0.00 -0.94 0.00 0.00 39.48 38.30 2lis n PHE 10 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 2lis s LEU 11 N -3.75 0.28 0.28 4.37 2.96 -1.26 -5.14 118.68 116.41 2lis s LEU 11 Ca 0.11 0.88 -0.30 0.00 -0.22 0.00 0.00 54.13 54.61 2lis s LEU 11 Cb 0.16 1.48 -0.13 0.00 0.50 0.00 0.00 46.19 48.19 2lis s LEU 11 CO 0.60 -0.16 1.26 0.59 -1.32 0.00 0.00 176.35 177.32 2lis n ASN 12 N 3.04 2.31 -0.27 3.68 3.02 -1.26 -4.76 115.26 121.02 2lis n ASN 12 Ca -0.15 1.17 0.03 0.00 -0.03 0.00 0.00 54.58 55.61 2lis n ASN 12 Cb 0.57 -1.40 0.16 0.00 -0.61 0.00 0.00 39.78 38.51 2lis n ASN 12 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2lis h LYS 13 N 3.13 0.62 -0.15 3.52 1.63 -1.99 -0.96 116.57 122.37 2lis h LYS 13 Ca -0.44 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.28 2lis h LYS 13 Cb 1.30 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 32.78 2lis h LYS 13 CO 0.68 0.41 -0.09 0.00 -3.45 0.00 0.00 179.45 176.99 2lis h ALA 14 N 1.47 1.57 -0.14 5.00 0.00 -1.99 -0.01 119.26 125.16 2lis h ALA 14 Ca 0.39 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 55.05 2lis h ALA 14 Cb 0.44 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2lis h ALA 14 CO -0.29 0.31 -0.22 0.74 0.00 0.00 0.00 179.25 179.79 2lis h PHE 15 N 0.22 0.48 -0.45 0.00 0.04 -1.57 -1.62 116.94 114.03 2lis h PHE 15 Ca 0.05 -0.16 0.07 0.00 2.80 0.00 0.00 57.97 60.72 2lis h PHE 15 Cb 0.31 -0.09 -0.06 0.00 2.20 0.00 0.00 35.95 38.31 2lis h PHE 15 CO 0.00 0.83 0.13 1.49 -0.60 0.00 0.00 178.31 180.17 2lis h GLU 16 N -0.01 0.28 -0.43 1.51 4.81 -0.96 -2.00 114.58 117.78 2lis h GLU 16 Ca 0.01 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2lis h GLU 16 Cb 0.79 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.09 2lis h GLU 16 CO 0.05 0.18 0.24 0.28 -0.73 0.00 0.00 179.01 179.04 2lis h VAL 17 N 0.29 1.15 -0.61 0.32 2.07 -0.99 -1.38 116.25 117.10 2lis h VAL 17 Ca 0.22 -0.36 0.04 0.00 0.82 0.00 0.00 66.70 67.41 2lis h VAL 17 Cb 0.25 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 2lis h VAL 17 CO -0.25 0.15 0.36 0.00 0.02 0.00 0.00 177.57 177.85 2lis h ALA 18 N 1.10 0.79 -0.10 1.67 0.00 -1.07 -0.03 119.26 121.62 2lis h ALA 18 Ca 0.15 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2lis h ALA 18 Cb 0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2lis h ALA 18 CO -0.03 0.07 0.00 -0.07 0.00 0.00 0.00 179.25 179.23 2lis h LEU 19 N 0.69 -0.03 -0.46 0.00 3.38 -0.97 -1.71 115.31 116.21 2lis h LEU 19 Ca 0.25 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.14 2lis h LEU 19 Cb 0.07 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2lis h LEU 19 CO -0.12 0.00 -0.11 0.11 0.09 0.00 0.00 178.44 178.41 2lis h LYS 20 N 0.04 0.89 -0.31 1.13 1.57 -0.84 0.20 116.57 119.24 2lis h LYS 20 Ca 0.05 -0.34 0.01 0.00 -1.87 0.00 0.00 60.65 58.50 2lis h LYS 20 Cb 0.05 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2lis h LYS 20 CO -0.07 0.99 0.18 0.28 -0.57 0.00 0.00 179.45 180.25 2lis h VAL 21 N 0.73 1.03 -0.04 0.50 2.07 -0.99 -1.47 116.25 118.07 2lis h VAL 21 Ca 0.12 -0.12 -0.22 0.00 0.82 0.00 0.00 66.70 67.29 2lis h VAL 21 Cb 0.66 0.63 0.01 0.00 -1.52 0.00 0.00 31.29 31.07 2lis h VAL 21 CO 0.05 0.07 -0.89 1.56 0.02 0.00 0.00 177.57 178.37 2lis h GLN 22 N 0.36 0.52 0.01 1.57 1.08 -1.07 -0.93 115.11 116.66 2lis h GLN 22 Ca 0.12 -0.51 -0.00 0.00 -1.45 0.00 0.00 58.65 56.81 2lis h GLN 22 Cb 0.00 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 2lis h GLN 22 CO -0.06 1.14 -0.01 0.82 -0.95 0.00 0.00 178.83 179.78 2lis h ILE 23 N 0.32 1.22 -0.72 2.54 2.04 -0.88 -1.13 117.51 120.91 2lis h ILE 23 Ca -0.07 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 2lis h ILE 23 Cb 1.52 1.69 -0.03 0.00 -0.74 0.00 0.00 36.82 39.25 2lis h ILE 23 CO 0.16 0.18 0.42 0.40 0.00 0.00 0.00 178.15 179.31 2lis h ILE 24 N -0.32 1.21 -0.80 -0.67 2.04 -1.31 -0.57 117.51 117.09 2lis h ILE 24 Ca -0.00 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 2lis h ILE 24 Cb 0.31 0.23 -0.04 0.00 -0.74 0.00 0.00 36.82 36.58 2lis h ILE 24 CO 0.00 0.22 0.44 0.00 0.00 0.00 0.00 178.15 178.82 2lis h ALA 25 N 1.22 1.02 -0.35 1.87 0.00 -1.05 -0.22 119.26 121.75 2lis h ALA 25 Ca 0.26 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 2lis h ALA 25 Cb -0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 2lis h ALA 25 CO -0.05 0.52 -0.32 0.78 0.00 0.00 0.00 179.25 180.18 2lis h GLY 26 N 1.10 0.91 0.98 0.00 0.00 -0.77 -1.07 103.07 104.23 2lis h GLY 26 Ca 0.28 -0.92 -0.01 0.00 0.00 0.00 0.00 47.33 46.69 2lis h GLY 26 CO -0.05 0.83 0.29 0.74 0.00 0.00 0.00 176.54 178.35 2lis h PHE 27 N 0.62 0.70 -0.75 5.60 -1.00 -0.87 -2.68 116.94 118.56 2lis h PHE 27 Ca 0.06 -0.01 -0.06 0.00 2.81 0.00 0.00 57.97 60.76 2lis h PHE 27 Cb 0.90 -0.23 -0.03 0.00 3.61 0.00 0.00 35.95 40.21 2lis h PHE 27 CO 0.07 0.52 0.23 -0.44 -1.61 0.00 0.00 178.31 177.07 2lis h ASP 28 N 0.69 1.08 -0.95 2.17 3.32 -0.94 -1.65 116.42 120.15 2lis h ASP 28 Ca 0.18 -0.20 0.03 0.00 0.02 0.00 0.00 57.03 57.06 2lis h ASP 28 Cb 0.04 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.25 2lis h ASP 28 CO -0.03 1.00 0.62 0.03 -1.72 0.00 0.00 179.24 179.15 2lis h ARG 29 N 1.11 1.18 -0.23 3.56 3.08 -0.88 -0.47 114.38 121.73 2lis h ARG 29 Ca 0.24 -0.07 -0.14 0.00 0.07 0.00 0.00 59.98 60.08 2lis h ARG 29 Cb 0.31 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 2lis h ARG 29 CO -0.01 0.78 -0.45 0.78 -1.07 0.00 0.00 179.97 180.00 2lis h GLY 30 N 1.21 0.63 1.01 0.04 0.00 -1.16 -2.43 103.07 102.37 2lis h GLY 30 Ca 0.37 -0.66 -0.02 0.00 0.00 0.00 0.00 47.33 47.02 2lis h GLY 30 CO -0.11 0.60 0.37 -2.00 0.00 0.00 0.00 176.54 175.40 2lis h LEU 31 N 0.47 0.88 -0.48 3.11 5.85 -0.62 -1.21 115.31 123.31 2lis h LEU 31 Ca 0.03 -0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.68 2lis h LEU 31 Cb 0.97 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.74 2lis h LEU 31 CO 0.09 0.73 0.26 0.58 -0.34 0.00 0.00 178.44 179.76 2lis h VAL 32 N 0.96 0.99 -0.50 1.05 2.07 -0.87 0.20 116.25 120.16 2lis h VAL 32 Ca 0.24 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.54 2lis h VAL 32 Cb 0.06 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 2lis h VAL 32 CO -0.04 0.09 0.10 0.11 0.02 0.00 0.00 177.57 177.85 2lis h LYS 33 N 0.51 0.77 -0.31 1.57 1.57 -1.09 -0.98 116.57 118.60 2lis h LYS 33 Ca 0.20 -0.16 -0.18 0.00 -1.87 0.00 0.00 60.65 58.64 2lis h LYS 33 Cb 0.08 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 2lis h LYS 33 CO -0.13 0.71 -0.51 2.35 -0.57 0.00 0.00 179.45 181.31 2lis h TRP 34 N 0.74 1.12 0.00 -1.35 7.01 -0.70 -3.05 115.95 119.72 2lis h TRP 34 Ca 0.16 -0.38 -0.06 0.00 2.11 0.00 0.00 58.89 60.72 2lis h TRP 34 Cb 0.31 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.15 2lis h TRP 34 CO 0.02 1.22 -0.26 -0.07 -2.79 0.00 0.00 178.44 176.55 2lis h LEU 35 N 0.70 0.00 -1.51 0.65 3.38 -0.35 -1.42 115.31 116.75 2lis h LEU 35 Ca 0.02 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.11 2lis h LEU 35 Cb 1.12 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.82 2lis h LEU 35 CO 0.12 0.26 0.48 -0.09 0.09 0.00 0.00 178.44 179.30 2lis h ARG 36 N 0.00 0.50 0.08 1.13 9.65 -1.06 0.18 114.38 124.86 2lis h ARG 36 Ca -0.00 -0.03 -0.20 0.00 -1.10 0.00 0.00 59.98 58.64 2lis h ARG 36 Cb 0.68 -0.11 -0.00 0.00 -1.39 0.00 0.00 29.97 29.14 2lis h ARG 36 CO 0.03 0.33 -1.02 0.28 2.80 0.00 0.00 179.97 182.40 2lis h VAL 37 N 0.52 1.24 -0.00 0.20 2.07 -1.45 -3.43 116.25 115.41 2lis h VAL 37 Ca 0.35 -2.38 0.00 0.00 0.82 0.00 0.00 66.70 65.48 2lis h VAL 37 Cb 0.64 2.86 0.00 0.00 -1.52 0.00 0.00 31.29 33.27 2lis h VAL 37 CO -0.12 0.63 -0.57 1.41 0.02 0.00 0.00 177.57 178.94 2lis n HIS 38 N -4.16 0.00 0.12 1.57 8.25 -0.61 -4.68 115.22 115.71 2lis n HIS 38 Ca -0.21 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.39 2lis n HIS 38 Cb 0.78 0.00 0.66 0.00 1.12 0.00 0.00 29.99 32.55 2lis n HIS 38 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2lis h GLY 39 N 2.94 0.01 2.00 -1.41 0.00 -0.85 -0.95 103.07 104.80 2lis h GLY 39 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2lis h GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.08 2lis n ARG 40 N -4.46 0.16 -0.00 4.80 1.74 -1.26 -2.58 116.66 115.06 2lis n ARG 40 Ca 0.04 0.30 0.12 0.00 -0.77 0.00 0.00 57.85 57.54 2lis n ARG 40 Cb 0.35 -1.75 0.19 0.00 -1.02 0.00 0.00 32.46 30.24 2lis n ARG 40 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2lis n THR 41 N -2.04 0.01 -4.66 0.55 -2.24 -0.36 -4.94 114.28 100.60 2lis n THR 41 Ca 0.04 -0.45 -0.30 0.00 -2.27 0.00 0.00 64.05 61.07 2lis n THR 41 Cb 0.28 1.27 -0.13 0.00 -2.10 0.00 0.00 70.33 69.65 2lis n THR 41 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2lis s LEU 42 N -1.99 2.44 0.81 3.22 1.43 -1.06 -5.13 118.68 118.40 2lis s LEU 42 Ca 0.30 -0.54 -0.12 0.00 -1.03 0.00 0.00 54.13 52.75 2lis s LEU 42 Cb 0.20 -1.41 0.08 0.00 0.03 0.00 0.00 46.19 45.09 2lis s LEU 42 CO 0.31 0.24 1.12 -0.94 0.23 0.00 0.00 176.35 177.30 2lis s SER 43 N -1.54 4.38 0.23 2.29 1.04 -1.26 -4.87 113.70 113.97 2lis s SER 43 Ca 0.14 1.11 -0.07 0.00 0.48 0.00 0.00 55.95 57.62 2lis s SER 43 Cb -0.10 -1.78 0.31 0.00 0.10 0.00 0.00 66.02 64.55 2lis s SER 43 CO 0.05 -2.02 1.81 0.74 0.98 0.00 0.00 173.24 174.80 2lis h THR 44 N -1.12 0.94 -0.11 2.02 2.02 -2.00 -1.33 112.91 113.33 2lis h THR 44 Ca -0.47 -0.25 -0.14 0.00 0.77 0.00 0.00 66.41 66.31 2lis h THR 44 Cb 1.29 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 2lis h THR 44 CO 0.62 0.14 -0.54 -0.37 0.37 0.00 0.00 175.52 175.73 2lis h VAL 45 N 0.74 1.35 -0.67 3.16 -1.51 -2.00 -2.32 116.25 115.02 2lis h VAL 45 Ca 0.35 -1.82 -0.06 0.00 -1.23 0.00 0.00 66.70 63.94 2lis h VAL 45 Cb 0.27 1.86 -0.03 0.00 -2.13 0.00 0.00 31.29 31.26 2lis h VAL 45 CO -0.21 0.55 0.20 1.56 -1.23 0.00 0.00 177.57 178.43 2lis h GLN 46 N 0.25 1.04 -0.68 5.19 4.20 -1.73 -0.72 115.11 122.66 2lis h GLN 46 Ca 0.00 -0.23 -0.06 0.00 0.06 0.00 0.00 58.65 58.43 2lis h GLN 46 Cb 1.03 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.63 2lis h GLN 46 CO 0.09 0.91 0.21 0.87 -0.67 0.00 0.00 178.83 180.24 2lis h LYS 47 N 0.97 1.06 -0.75 1.46 1.57 -1.05 -1.79 116.57 118.04 2lis h LYS 47 Ca 0.21 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 2lis h LYS 47 Cb 0.31 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 2lis h LYS 47 CO -0.01 0.92 0.29 0.87 -0.57 0.00 0.00 179.45 180.95 2lis h LYS 48 N 1.00 1.13 -1.00 3.15 1.57 -1.18 -2.06 116.57 119.18 2lis h LYS 48 Ca 0.22 -0.21 0.03 0.00 -1.87 0.00 0.00 60.65 58.82 2lis h LYS 48 Cb 0.30 -0.18 -0.06 0.00 0.08 0.00 0.00 32.23 32.38 2lis h LYS 48 CO -0.01 0.92 0.66 0.00 -0.57 0.00 0.00 179.45 180.45 2lis h ALA 49 N 1.21 1.33 -0.39 3.86 0.00 -0.60 -1.11 119.26 123.57 2lis h ALA 49 Ca 0.25 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 2lis h ALA 49 Cb 0.22 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2lis h ALA 49 CO -0.02 0.58 -0.15 -0.07 0.00 0.00 0.00 179.25 179.59 2lis h LEU 50 N 1.28 0.71 -0.96 0.00 3.38 -0.78 0.01 115.31 118.95 2lis h LEU 50 Ca 0.39 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2lis h LEU 50 Cb -0.04 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.47 2lis h LEU 50 CO -0.11 0.87 0.61 1.88 0.09 0.00 0.00 178.44 181.78 2lis h TYR 51 N 0.64 1.25 -0.41 1.13 0.05 -0.83 -2.12 116.97 116.68 2lis h TYR 51 Ca 0.10 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.88 2lis h TYR 51 Cb 0.62 -0.41 -0.02 0.00 1.01 0.00 0.00 36.73 37.93 2lis h TYR 51 CO 0.03 0.81 0.22 0.35 -1.05 0.00 0.00 178.16 178.51 2lis h PHE 52 N 1.32 0.57 -0.88 4.88 3.57 -0.73 -2.81 116.94 122.86 2lis h PHE 52 Ca 0.35 -0.02 0.14 0.00 3.53 0.00 0.00 57.97 61.97 2lis h PHE 52 Cb -0.10 -0.18 -0.09 0.00 2.79 0.00 0.00 35.95 38.37 2lis h PHE 52 CO 0.00 0.45 0.48 0.28 -2.23 0.00 0.00 178.31 177.29 2lis h VAL 53 N 0.53 0.77 -0.38 1.41 2.07 -0.50 -0.09 116.25 120.05 2lis h VAL 53 Ca 0.14 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.48 2lis h VAL 53 Cb 0.07 0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 29.81 2lis h VAL 53 CO -0.02 0.13 0.11 0.78 0.02 0.00 0.00 177.57 178.58 2lis h ASN 54 N 0.69 0.08 -0.26 0.57 2.35 -1.14 0.44 115.58 118.31 2lis h ASN 54 Ca 0.47 0.05 -0.07 0.00 -0.55 0.00 0.00 56.30 56.20 2lis h ASN 54 Cb 0.63 0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.05 2lis h ASN 54 CO -0.34 0.08 -0.13 0.03 -1.65 0.00 0.00 177.43 175.42 2lis h ARG 55 N 0.25 0.55 -0.12 0.81 3.08 -1.10 -2.40 114.38 115.44 2lis h ARG 55 Ca 0.18 -0.24 -0.09 0.00 0.07 0.00 0.00 59.98 59.89 2lis h ARG 55 Cb 0.18 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 2lis h ARG 55 CO -0.21 0.80 -0.35 -0.09 -1.07 0.00 0.00 179.97 179.06 2lis h ARG 56 N 0.28 0.24 -0.31 0.04 9.65 -0.95 -1.40 114.38 121.92 2lis h ARG 56 Ca 0.06 -0.10 -0.01 0.00 -1.10 0.00 0.00 59.98 58.83 2lis h ARG 56 Cb 0.64 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.20 2lis h ARG 56 CO 0.04 0.56 0.15 -0.92 2.80 0.00 0.00 179.97 182.60 2lis h TYR 57 N 0.20 0.45 -0.54 2.20 5.03 -0.82 -0.38 116.97 123.12 2lis h TYR 57 Ca 0.02 -0.02 0.04 0.00 2.58 0.00 0.00 58.73 61.35 2lis h TYR 57 Cb 0.72 -0.14 -0.04 0.00 1.55 0.00 0.00 36.73 38.82 2lis h TYR 57 CO 0.01 0.40 0.30 1.98 -1.32 0.00 0.00 178.16 179.53 2lis h MET 58 N 0.37 0.57 -0.50 1.82 4.05 -1.08 -1.48 114.93 118.68 2lis h MET 58 Ca 0.11 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 2lis h MET 58 Cb 0.12 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 30.77 2lis h MET 58 CO -0.01 0.38 0.32 1.96 0.23 0.00 0.00 176.91 179.78 2lis h GLN 59 N 0.59 0.67 0.00 0.39 4.20 -0.59 -0.24 115.11 120.14 2lis h GLN 59 Ca 0.23 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2lis h GLN 59 Cb 0.08 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.72 2lis h GLN 59 CO -0.13 0.47 -0.08 1.79 -0.67 0.00 0.00 178.83 180.21 2lis h THR 60 N 0.68 0.00 -0.22 -0.54 1.35 -0.92 -3.09 112.91 110.16 2lis h THR 60 Ca 0.18 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 2lis h THR 60 Cb -0.04 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 2lis h THR 60 CO -0.04 0.00 0.00 1.41 -0.25 0.00 0.00 175.52 176.64 2lis n HIS 61 N -2.32 0.27 -0.07 4.73 8.25 -0.57 -4.65 115.22 120.87 2lis n HIS 61 Ca 0.05 -0.15 -0.07 0.00 -0.26 0.00 0.00 57.72 57.29 2lis n HIS 61 Cb 0.44 -0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.54 2lis n HIS 61 CO 0.00 0.00 0.00 2.35 0.64 0.00 0.00 176.34 179.33 2lis h TRP 62 N 4.21 -0.36 -0.65 4.41 2.91 -0.96 -0.53 115.95 124.97 2lis h TRP 62 Ca 0.00 0.03 -0.03 0.00 1.13 0.00 0.00 58.89 60.02 2lis h TRP 62 Cb 0.93 0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 29.75 2lis h TRP 62 CO 0.14 -0.22 0.27 0.00 -1.03 0.00 0.00 178.44 177.60 2lis h ALA 63 N 1.10 1.25 -0.72 2.65 0.00 -1.82 0.89 119.26 122.62 2lis h ALA 63 Ca 0.15 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2lis h ALA 63 Cb 0.34 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2lis h ALA 63 CO -0.35 0.55 0.32 -0.91 0.00 0.00 0.00 179.25 178.86 2lis h ASN 64 N 0.93 0.96 -0.51 0.00 4.21 -1.63 -2.17 115.58 117.38 2lis h ASN 64 Ca 0.22 -0.15 -0.07 0.00 1.21 0.00 0.00 56.30 57.51 2lis h ASN 64 Cb 0.16 -0.25 -0.02 0.00 -1.12 0.00 0.00 38.32 37.10 2lis h ASN 64 CO -0.02 0.85 0.04 1.88 -1.29 0.00 0.00 177.43 178.89 2lis h TYR 65 N 1.01 0.93 -0.60 1.19 0.05 -0.44 -2.79 116.97 116.33 2lis h TYR 65 Ca 0.24 -0.15 0.04 0.00 0.05 0.00 0.00 58.73 58.91 2lis h TYR 65 Cb 0.16 -0.25 -0.03 0.00 1.01 0.00 0.00 36.73 37.62 2lis h TYR 65 CO 0.01 0.86 0.39 0.52 -1.05 0.00 0.00 178.16 178.90 2lis h MET 66 N 0.74 0.66 -0.39 4.88 2.86 -0.55 0.12 114.93 123.24 2lis h MET 66 Ca 0.15 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.76 2lis h MET 66 Cb 0.46 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 2lis h MET 66 CO 0.02 0.43 0.24 -0.07 1.06 0.00 0.00 176.91 178.59 2lis h LEU 67 N 0.68 0.40 -0.21 1.22 3.38 -1.12 -0.57 115.31 119.08 2lis h LEU 67 Ca 0.24 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 2lis h LEU 67 Cb 0.12 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2lis h LEU 67 CO -0.07 0.29 -0.16 -0.25 0.09 0.00 0.00 178.44 178.34 2lis h TRP 68 N 0.49 0.56 -0.65 1.13 7.01 -1.27 -2.93 115.95 120.29 2lis h TRP 68 Ca 0.15 -0.16 0.06 0.00 2.11 0.00 0.00 58.89 61.05 2lis h TRP 68 Cb -0.02 -0.12 -0.05 0.00 -2.10 0.00 0.00 29.16 26.87 2lis h TRP 68 CO -0.06 0.80 0.36 0.82 -2.79 0.00 0.00 178.44 177.56 2lis h ILE 69 N 0.16 0.97 -0.20 2.65 2.04 -0.67 -2.35 117.51 120.11 2lis h ILE 69 Ca 0.04 -0.23 -0.08 0.00 1.00 0.00 0.00 64.86 65.59 2lis h ILE 69 Cb 0.68 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 2lis h ILE 69 CO 0.04 0.12 -0.23 0.78 0.00 0.00 0.00 178.15 178.87 2lis h ASN 70 N 0.67 0.35 -0.42 1.72 2.35 -1.07 0.77 115.58 119.95 2lis h ASN 70 Ca 0.29 -0.10 -0.11 0.00 -0.55 0.00 0.00 56.30 55.82 2lis h ASN 70 Cb 0.17 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 2lis h ASN 70 CO -0.18 0.58 -0.15 0.11 -1.65 0.00 0.00 177.43 176.15 2lis h LYS 71 N 0.32 0.90 -0.45 0.81 1.79 -1.25 -0.88 116.57 117.82 2lis h LYS 71 Ca 0.05 -0.34 -0.08 0.00 -2.18 0.00 0.00 60.65 58.10 2lis h LYS 71 Cb 0.58 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.16 2lis h LYS 71 CO 0.04 0.99 -0.03 0.87 -1.08 0.00 0.00 179.45 180.24 2lis h LYS 72 N 0.80 0.81 -0.62 3.15 1.79 -0.87 -2.46 116.57 119.17 2lis h LYS 72 Ca 0.12 -0.27 -0.04 0.00 -2.18 0.00 0.00 60.65 58.28 2lis h LYS 72 Cb 0.69 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 31.24 2lis h LYS 72 CO 0.05 0.88 0.23 0.82 -1.08 0.00 0.00 179.45 180.35 2lis h ILE 73 N 0.65 1.24 0.00 1.86 1.08 -0.71 -2.03 117.51 119.59 2lis h ILE 73 Ca 0.12 -0.77 -0.02 0.00 -0.39 0.00 0.00 64.86 63.80 2lis h ILE 73 Cb 0.54 0.58 -0.00 0.00 -3.07 0.00 0.00 36.82 34.87 2lis h ILE 73 CO 0.03 0.30 -0.12 0.44 -0.69 0.00 0.00 178.15 178.11 2lis h ASP 74 N 0.87 0.00 0.25 1.72 3.32 -0.98 -2.31 116.42 119.29 2lis h ASP 74 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2lis h ASP 74 Cb 0.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2lis h ASP 74 CO -0.01 0.12 -0.03 0.00 -1.72 0.00 0.00 179.24 177.59 2lis n ALA 75 N -2.35 2.65 0.14 3.45 0.00 -0.77 -4.32 120.51 119.31 2lis n ALA 75 Ca -0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 53.44 53.19 2lis n ALA 75 Cb 0.21 -1.43 0.21 0.00 0.00 0.00 0.00 19.45 18.45 2lis n ALA 75 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2lis h LEU 76 N 0.37 0.02 0.11 0.00 3.38 -1.34 -3.47 115.31 114.38 2lis h LEU 76 Ca 0.00 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2lis h LEU 76 Cb 0.22 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2lis h LEU 76 CO 0.00 0.57 -0.04 0.61 0.09 0.00 0.00 178.44 179.67 2lis n GLY 77 N 0.07 0.51 3.62 0.83 0.00 -1.26 -5.02 105.19 103.95 2lis n GLY 77 Ca -0.01 -0.98 -0.06 0.00 0.00 0.00 0.00 46.02 44.97 2lis n GLY 77 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2lis s ARG 78 N -2.32 0.95 0.20 1.61 1.70 -1.26 -5.14 118.95 114.69 2lis s ARG 78 Ca 0.00 -0.45 -0.32 0.00 -0.47 0.00 0.00 55.73 54.49 2lis s ARG 78 Cb 0.00 0.37 -0.14 0.00 -0.57 0.00 0.00 34.95 34.61 2lis s ARG 78 CO 0.00 -0.43 1.39 2.41 -1.08 0.00 0.00 175.30 177.59 2lis n THR 79 N -0.35 0.68 -2.16 4.99 -1.04 -1.26 -4.96 114.28 110.18 2lis n THR 79 Ca -0.07 -0.17 -0.32 0.00 -2.04 0.00 0.00 64.05 61.45 2lis n THR 79 Cb 0.61 -1.32 -0.01 0.00 -1.82 0.00 0.00 70.33 67.80 2lis n THR 79 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2lis s PRO 80 N -0.08 3.64 0.32 -2.82 0.04 -1.26 -5.08 135.00 129.76 2lis s PRO 80 Ca 0.72 0.99 0.03 0.00 0.04 0.00 0.00 61.00 62.79 2lis s PRO 80 Cb -0.72 -2.09 -0.05 0.00 0.04 0.00 0.00 34.50 31.68 2lis s PRO 80 CO 0.48 -0.53 0.09 0.14 0.04 0.00 0.00 177.00 177.21 2lis s VAL 81 N -2.69 0.86 0.36 -0.36 -7.23 -1.26 -5.06 120.40 105.02 2lis s VAL 81 Ca 0.60 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.81 2lis s VAL 81 Cb -0.12 -2.66 0.28 0.00 0.56 0.00 0.00 36.38 34.44 2lis s VAL 81 CO 0.38 0.00 1.97 1.62 -0.31 0.00 0.00 175.10 178.76 2lis h VAL 82 N 2.14 1.06 -0.10 1.32 3.04 -1.98 -1.13 116.25 120.61 2lis h VAL 82 Ca -0.39 -0.27 0.03 0.00 -1.01 0.00 0.00 66.70 65.06 2lis h VAL 82 Cb 1.25 0.21 -0.00 0.00 -2.01 0.00 0.00 31.29 30.73 2lis h VAL 82 CO 0.64 0.14 0.08 1.23 -1.01 0.00 0.00 177.57 178.65 2lis h GLY 83 N 0.79 0.00 0.94 3.17 0.00 -1.98 -0.82 103.07 105.17 2lis h GLY 83 Ca 0.29 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.56 2lis h GLY 83 CO -0.09 0.00 0.02 -0.55 0.00 0.00 0.00 176.54 175.92 2lis h ASP 84 N 0.00 0.67 0.09 0.19 3.32 -1.62 -1.77 116.42 117.31 2lis h ASP 84 Ca 0.05 -0.29 -0.17 0.00 0.02 0.00 0.00 57.03 56.64 2lis h ASP 84 Cb 0.21 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 2lis h ASP 84 CO -0.00 0.80 -0.59 1.88 -1.72 0.00 0.00 179.24 179.61 2lis h TYR 85 N 0.53 0.65 -0.24 4.55 0.05 -1.27 -1.70 116.97 119.54 2lis h TYR 85 Ca 0.12 -0.24 0.03 0.00 0.05 0.00 0.00 58.73 58.68 2lis h TYR 85 Cb 0.44 -0.12 -0.03 0.00 1.01 0.00 0.00 36.73 38.03 2lis h TYR 85 CO 0.03 0.98 0.04 1.15 -1.05 0.00 0.00 178.16 179.31 2lis h THR 86 N 0.39 0.88 -0.30 -2.88 2.02 -1.11 0.13 112.91 112.03 2lis h THR 86 Ca -0.00 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 2lis h THR 86 Cb 1.14 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 68.27 2lis h THR 86 CO 0.11 0.02 0.11 -0.09 0.37 0.00 0.00 175.52 176.05 2lis h ARG 87 N 0.13 0.46 -0.47 6.66 2.43 -1.19 -0.90 114.38 121.50 2lis h ARG 87 Ca 0.11 -0.09 -0.11 0.00 -0.81 0.00 0.00 59.98 59.08 2lis h ARG 87 Cb 0.12 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 2lis h ARG 87 CO -0.15 0.48 -0.14 -0.07 -1.51 0.00 0.00 179.97 178.58 2lis h LEU 88 N 0.34 0.94 -0.84 3.80 3.38 -1.18 -1.43 115.31 120.32 2lis h LEU 88 Ca 0.10 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.64 2lis h LEU 88 Cb 0.20 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 2lis h LEU 88 CO -0.01 1.09 0.20 1.23 0.09 0.00 0.00 178.44 181.05 2lis h GLY 89 N 0.77 1.14 1.35 0.83 0.00 -0.67 -1.65 103.07 104.84 2lis h GLY 89 Ca 0.12 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.72 2lis h GLY 89 CO 0.05 0.63 0.10 0.00 0.00 0.00 0.00 176.54 177.32 2lis h ALA 90 N 1.19 1.21 -0.24 3.60 0.00 -0.94 -0.23 119.26 123.85 2lis h ALA 90 Ca 0.22 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2lis h ALA 90 Cb 0.31 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2lis h ALA 90 CO -0.01 0.54 0.09 1.49 0.00 0.00 0.00 179.25 181.37 2lis h GLU 91 N 0.77 0.36 -0.43 0.00 4.81 -0.84 -1.40 114.58 117.84 2lis h GLU 91 Ca 0.17 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.35 2lis h GLU 91 Cb 0.32 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 2lis h GLU 91 CO 0.00 0.41 0.25 0.82 -0.73 0.00 0.00 179.01 179.76 2lis h ILE 92 N 0.23 1.04 -0.59 2.32 2.04 -1.15 -0.92 117.51 120.47 2lis h ILE 92 Ca 0.08 -0.17 0.13 0.00 1.00 0.00 0.00 64.86 65.90 2lis h ILE 92 Cb 0.18 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 2lis h ILE 92 CO -0.01 0.09 0.41 1.23 0.00 0.00 0.00 178.15 179.88 2lis h GLY 93 N 0.51 0.34 0.78 5.37 0.00 -0.72 -2.45 103.07 106.90 2lis h GLY 93 Ca 0.17 -0.09 -0.33 0.00 0.00 0.00 0.00 47.33 47.08 2lis h GLY 93 CO -0.08 0.04 -1.87 -2.13 0.00 0.00 0.00 176.54 172.50 2lis n ARG 94 N -4.43 0.69 0.11 4.80 0.63 -0.56 -3.20 116.66 114.71 2lis n ARG 94 Ca 0.11 0.27 0.02 0.00 -0.92 0.00 0.00 57.85 57.33 2lis n ARG 94 Cb 0.51 -1.75 -0.01 0.00 0.45 0.00 0.00 32.46 31.67 2lis n ARG 94 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2lis h ARG 95 N 0.03 0.00 -6.17 -0.14 3.08 -0.73 -3.43 114.38 107.02 2lis h ARG 95 Ca -0.36 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.12 2lis h ARG 95 Cb 2.03 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 32.02 2lis h ARG 95 CO 0.08 0.46 0.86 0.42 -1.07 0.00 0.00 179.97 180.72 2lis s ILE 96 N -2.95 4.48 -1.24 2.04 -1.09 -0.96 -4.91 121.20 116.57 2lis s ILE 96 Ca 0.02 1.76 -0.12 0.00 -2.23 0.00 0.00 60.65 60.08 2lis s ILE 96 Cb 0.08 -4.23 0.17 0.00 -1.58 0.00 0.00 42.46 36.90 2lis s ILE 96 CO 0.76 -0.26 1.59 -0.67 -1.23 0.00 0.00 174.94 175.14 2lis n ASP 97 N 6.64 5.17 0.27 3.58 2.03 -1.26 -4.79 116.55 128.19 2lis n ASP 97 Ca 0.13 -3.02 0.12 0.00 0.52 0.00 0.00 54.79 52.54 2lis n ASP 97 Cb 0.46 -1.55 0.77 0.00 -0.72 0.00 0.00 41.12 40.08 2lis n ASP 97 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 2lis h MET 98 N 6.69 0.00 -0.35 -0.67 2.86 -1.94 -1.63 114.93 119.89 2lis h MET 98 Ca 0.35 0.00 0.10 0.00 -2.06 0.00 0.00 59.70 58.09 2lis h MET 98 Cb 0.79 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.44 2lis h MET 98 CO 1.38 0.06 0.26 0.00 1.06 0.00 0.00 176.91 179.67 2lis h ALA 99 N 1.94 2.27 -0.95 6.32 0.00 -1.90 0.16 119.26 127.10 2lis h ALA 99 Ca -0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2lis h ALA 99 Cb 0.14 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 2lis h ALA 99 CO 0.01 -0.44 0.62 -0.92 0.00 0.00 0.00 179.25 178.52 2lis h TYR 100 N 0.00 1.18 -0.11 0.00 3.20 -1.71 0.41 116.97 119.93 2lis h TYR 100 Ca 0.16 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.90 2lis h TYR 100 Cb 0.69 -0.40 0.01 0.00 1.54 0.00 0.00 36.73 38.57 2lis h TYR 100 CO 0.00 0.72 -0.55 0.35 -1.64 0.00 0.00 178.16 177.05 2lis h PHE 101 N 1.25 0.77 -0.80 -3.82 3.57 -0.93 -2.91 116.94 114.06 2lis h PHE 101 Ca 0.36 -0.34 0.06 0.00 3.53 0.00 0.00 57.97 61.58 2lis h PHE 101 Cb -0.10 -0.12 -0.06 0.00 2.79 0.00 0.00 35.95 38.46 2lis h PHE 101 CO -0.00 1.12 0.48 1.88 -2.23 0.00 0.00 178.31 179.56 2lis h TYR 102 N 0.19 0.89 -0.54 0.41 0.05 -0.93 -0.41 116.97 116.63 2lis h TYR 102 Ca -0.04 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.77 2lis h TYR 102 Cb 1.19 -0.28 -0.03 0.00 1.01 0.00 0.00 36.73 38.62 2lis h TYR 102 CO 0.11 0.43 0.35 -0.44 -1.05 0.00 0.00 178.16 177.56 2lis h ASP 103 N 0.87 0.63 0.06 3.88 3.32 -0.95 -0.23 116.42 124.01 2lis h ASP 103 Ca 0.36 -0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.39 2lis h ASP 103 Cb 0.20 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 2lis h ASP 103 CO -0.18 0.47 -0.13 0.15 -1.72 0.00 0.00 179.24 177.83 2lis h PHE 104 N 0.73 -0.32 -0.82 4.55 3.57 -1.21 0.15 116.94 123.59 2lis h PHE 104 Ca 0.20 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.72 2lis h PHE 104 Cb -0.07 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 2lis h PHE 104 CO -0.03 -0.19 0.54 -0.07 -2.23 0.00 0.00 178.31 176.33 2lis h LEU 105 N -0.24 0.94 0.09 0.59 3.38 -0.74 -0.17 115.31 119.15 2lis h LEU 105 Ca 0.03 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2lis h LEU 105 Cb 0.27 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2lis h LEU 105 CO -0.08 0.67 -0.04 0.50 0.09 0.00 0.00 178.44 179.58 2lis h LYS 106 N 1.11 -0.11 -0.10 1.13 3.64 -0.92 0.91 116.57 122.22 2lis h LYS 106 Ca 0.30 0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.59 2lis h LYS 106 Cb -0.11 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 2lis h LYS 106 CO -0.07 0.36 -0.41 -0.44 -2.27 0.00 0.00 179.45 176.61 2lis h ASP 107 N -0.64 0.23 -0.39 4.20 3.32 -0.56 -2.55 116.42 120.02 2lis h ASP 107 Ca -0.01 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.94 2lis h ASP 107 Cb 0.52 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.01 2lis h ASP 107 CO 0.02 0.62 0.00 0.29 -1.72 0.00 0.00 179.24 178.45 2lis n LYS 108 N -4.03 2.22 -3.50 3.56 4.01 -0.09 -4.96 118.16 115.38 2lis n LYS 108 Ca -0.01 -1.86 -0.18 0.00 -0.51 0.00 0.00 58.31 55.74 2lis n LYS 108 Cb 0.47 -1.45 0.08 0.00 -0.51 0.00 0.00 35.03 33.62 2lis n LYS 108 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2lis n ASN 109 N 1.05 -2.02 -0.02 4.39 5.03 -0.96 -4.93 115.26 117.80 2lis n ASN 109 Ca 0.18 -0.66 0.03 0.00 0.87 0.00 0.00 54.58 55.00 2lis n ASN 109 Cb 0.48 -4.89 0.04 0.00 -1.02 0.00 0.00 39.78 34.39 2lis n ASN 109 CO 0.00 0.00 0.00 0.23 -1.83 0.00 0.00 177.26 175.66 2lis n MET 110 N -4.19 2.43 -1.86 3.52 2.81 0.28 -5.03 117.12 115.08 2lis n MET 110 Ca -0.28 -1.75 -0.42 0.00 -1.81 0.00 0.00 57.70 53.44 2lis n MET 110 Cb 0.67 -1.11 -0.03 0.00 -0.71 0.00 0.00 33.22 32.04 2lis n MET 110 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2lis s ILE 111 N -1.45 2.56 0.47 2.02 1.01 -1.17 -4.88 121.20 119.76 2lis s ILE 111 Ca 0.08 0.31 -0.24 0.00 0.00 0.00 0.00 60.65 60.80 2lis s ILE 111 Cb 0.07 -3.20 -0.08 0.00 0.01 0.00 0.00 42.46 39.27 2lis s ILE 111 CO 0.01 0.02 1.31 -2.65 0.00 0.00 0.00 174.94 173.62 2lis n PRO 112 N 4.53 1.87 -1.69 2.79 -0.02 -1.26 -4.93 135.00 136.29 2lis n PRO 112 Ca 0.15 0.67 -0.44 0.00 -2.02 0.00 0.00 63.50 61.86 2lis n PRO 112 Cb 0.38 -2.48 -0.03 0.00 -0.02 0.00 0.00 33.50 31.35 2lis n PRO 112 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2lis n LYS 113 N -0.36 2.40 -2.91 -0.52 4.76 -1.26 -4.86 118.16 115.42 2lis n LYS 113 Ca 0.08 0.87 -0.41 0.00 -2.87 0.00 0.00 58.31 55.97 2lis n LYS 113 Cb 0.42 -2.66 -0.04 0.00 -1.84 0.00 0.00 35.03 30.91 2lis n LYS 113 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 2lis s TYR 114 N 0.87 3.55 0.26 2.13 5.04 -1.26 -5.04 117.35 122.90 2lis s TYR 114 Ca 0.76 1.38 0.11 0.00 -2.44 0.00 0.00 57.07 56.87 2lis s TYR 114 Cb -0.60 -2.96 -0.05 0.00 0.35 0.00 0.00 41.96 38.70 2lis s TYR 114 CO 0.37 -0.04 -0.18 -0.51 -1.34 0.00 0.00 175.55 173.86 2lis s LEU 115 N 1.27 2.58 0.28 6.97 1.43 -1.26 -5.05 118.68 124.90 2lis s LEU 115 Ca 0.42 -1.04 0.02 0.00 -1.03 0.00 0.00 54.13 52.50 2lis s LEU 115 Cb -0.18 -0.96 0.65 0.00 0.03 0.00 0.00 46.19 45.73 2lis s LEU 115 CO 0.19 -0.04 1.74 -0.65 0.23 0.00 0.00 176.35 177.81 2lis h PRO 116 N 2.34 0.54 -0.16 1.29 0.11 -2.00 -1.34 132.00 132.78 2lis h PRO 116 Ca -0.40 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.64 2lis h PRO 116 Cb 1.25 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2lis h PRO 116 CO 0.61 0.35 -0.10 0.10 -0.21 0.00 0.00 178.00 178.76 2lis h TYR 117 N 0.55 0.26 -0.24 0.65 -0.00 -1.99 -0.72 116.97 115.48 2lis h TYR 117 Ca 0.52 -0.03 -0.07 0.00 0.00 0.00 0.00 58.73 59.16 2lis h TYR 117 Cb 0.87 -0.08 -0.01 0.00 0.00 0.00 0.00 36.73 37.52 2lis h TYR 117 CO -0.09 0.36 -0.13 0.52 -0.00 0.00 0.00 178.16 178.82 2lis h MET 118 N 0.24 0.51 -0.74 0.10 2.86 -1.67 -2.20 114.93 114.03 2lis h MET 118 Ca 0.05 -0.23 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 2lis h MET 118 Cb 0.34 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.95 2lis h MET 118 CO 0.02 0.78 0.41 1.49 1.06 0.00 0.00 176.91 180.67 2lis h GLU 119 N 0.23 1.03 -0.53 1.72 4.57 -1.06 -0.65 114.58 119.88 2lis h GLU 119 Ca 0.05 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2lis h GLU 119 Cb 0.64 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 29.00 2lis h GLU 119 CO 0.04 0.75 0.34 1.49 -1.18 0.00 0.00 179.01 180.45 2lis h GLU 120 N 1.03 0.71 -0.65 1.92 4.81 -1.00 -0.65 114.58 120.77 2lis h GLU 120 Ca 0.26 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.38 2lis h GLU 120 Cb 0.02 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 2lis h GLU 120 CO -0.04 0.49 0.16 0.82 -0.73 0.00 0.00 179.01 179.71 2lis h ILE 121 N 0.72 1.26 -0.16 2.32 2.04 -1.06 -2.54 117.51 120.08 2lis h ILE 121 Ca 0.19 -0.92 -0.05 0.00 1.00 0.00 0.00 64.86 65.08 2lis h ILE 121 Cb -0.05 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 2lis h ILE 121 CO -0.04 0.35 -0.12 0.78 0.00 0.00 0.00 178.15 179.12 2lis h ASN 122 N 0.95 0.24 1.74 1.72 2.35 -0.65 -2.94 115.58 119.00 2lis h ASN 122 Ca 0.20 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2lis h ASN 122 Cb 0.35 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.66 2lis h ASN 122 CO 0.00 0.40 -0.14 0.03 -1.65 0.00 0.00 177.43 176.07 2lis h ARG 123 N 0.25 0.00 -7.11 0.81 2.47 -0.81 -3.46 114.38 106.53 2lis h ARG 123 Ca 0.05 0.00 -0.56 0.00 -1.26 0.00 0.00 59.98 58.21 2lis h ARG 123 Cb 0.38 0.00 0.16 0.00 -1.65 0.00 0.00 29.97 28.85 2lis h ARG 123 CO 0.02 0.00 0.51 -1.64 0.56 0.00 0.00 179.97 179.42 2lis s MET 124 N -3.20 2.54 0.34 0.04 -1.94 -0.98 -4.99 119.30 111.11 2lis s MET 124 Ca 0.07 2.05 -0.29 0.00 -1.71 0.00 0.00 55.69 55.81 2lis s MET 124 Cb 0.07 -1.85 -0.11 0.00 2.01 0.00 0.00 34.83 34.96 2lis s MET 124 CO 0.67 -1.60 1.49 1.03 -0.01 0.00 0.00 175.02 176.60 2lis s ARG 125 N -3.40 4.16 0.34 2.03 0.52 -1.26 -4.89 118.95 116.44 2lis s ARG 125 Ca 0.82 2.50 0.13 0.00 -0.52 0.00 0.00 55.73 58.67 2lis s ARG 125 Cb -0.37 -3.01 1.03 0.00 0.52 0.00 0.00 34.95 33.12 2lis s ARG 125 CO 0.40 -0.50 1.69 -1.35 0.02 0.00 0.00 175.30 175.55 2lis h PRO 126 N 3.68 0.40 -0.43 3.54 0.11 -1.94 0.88 132.00 138.23 2lis h PRO 126 Ca -0.49 -0.02 0.13 0.00 0.11 0.00 0.00 66.00 65.72 2lis h PRO 126 Cb 1.23 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 2lis h PRO 126 CO 0.69 0.26 0.33 0.00 -0.21 0.00 0.00 178.00 179.07 2lis h ALA 127 N 1.80 2.36 -0.03 -0.75 0.00 -1.90 -2.49 119.26 118.26 2lis h ALA 127 Ca 0.71 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.60 2lis h ALA 127 Cb 1.54 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2lis h ALA 127 CO -0.56 -0.55 -0.09 -0.25 0.00 0.00 0.00 179.25 177.81 2lis n ASP 128 N -4.30 2.70 -4.70 0.00 8.00 0.29 -4.80 116.55 113.73 2lis n ASP 128 Ca 0.07 -1.86 -0.42 0.00 0.71 0.00 0.00 54.79 53.29 2lis n ASP 128 Cb 0.52 0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.68 2lis n ASP 128 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2lis s VAL 129 N -2.09 2.97 0.23 2.53 1.01 -0.94 -4.91 120.40 119.20 2lis s VAL 129 Ca 0.27 0.56 -0.30 0.00 0.00 0.00 0.00 61.98 62.51 2lis s VAL 129 Cb 0.20 -3.36 -0.09 0.00 0.00 0.00 0.00 36.38 33.13 2lis s VAL 129 CO 0.35 0.02 1.13 -2.16 0.00 0.00 0.00 175.10 174.44 2lis s PRO 130 N 1.96 4.58 0.11 2.72 0.04 -1.26 -5.04 135.00 138.12 2lis s PRO 130 Ca 0.71 1.81 0.06 0.00 0.04 0.00 0.00 61.00 63.62 2lis s PRO 130 Cb -0.40 -3.22 -0.04 0.00 0.04 0.00 0.00 34.50 30.88 2lis s PRO 130 CO 0.31 0.09 -0.15 0.14 0.04 0.00 0.00 177.00 177.43 2lis s VAL 131 N -0.64 1.37 -0.09 -0.36 -7.23 -1.26 -4.88 120.40 107.31 2lis s VAL 131 Ca 0.48 -1.61 0.04 0.00 -1.81 0.00 0.00 61.98 59.08 2lis s VAL 131 Cb -0.32 -1.45 0.00 0.00 0.56 0.00 0.00 36.38 35.17 2lis s VAL 131 CO 0.39 -0.31 -0.22 -0.75 -0.31 0.00 0.00 175.10 173.90 2lis s LYS 132 N -2.35 2.68 0.02 4.82 2.20 -1.26 -5.13 119.74 120.73 2lis s LYS 132 Ca 0.06 -0.78 -0.21 0.00 -0.36 0.00 0.00 55.97 54.68 2lis s LYS 132 Cb -0.07 -2.08 -0.06 0.00 -1.51 0.00 0.00 37.83 34.11 2lis s LYS 132 CO 0.03 0.18 0.61 0.71 -0.36 0.00 0.00 175.35 176.52 2lis s TYR 133 N 0.33 3.72 0.00 4.03 1.51 -1.26 -4.61 117.35 121.07 2lis s TYR 133 Ca -0.16 1.25 0.00 0.00 -1.01 0.00 0.00 57.07 57.15 2lis s TYR 133 Cb -0.17 -2.60 0.00 0.00 -0.11 0.00 0.00 41.96 39.08 2lis s TYR 133 CO 0.07 0.41 0.06 -1.33 -1.11 0.00 0.00 175.55 173.65