#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4cln n ASP 2 N 0.00 0.43 0.00 0.00 5.75 -1.26 -4.96 116.55 116.50 4cln n ASP 2 Ca 0.00 0.75 0.00 0.00 -0.01 0.00 0.00 54.79 55.53 4cln n ASP 2 Cb 0.00 -1.37 0.00 0.00 -1.03 0.00 0.00 41.12 38.72 4cln n ASP 2 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 4cln n GLN 3 N -1.17 0.00 0.00 0.11 1.13 -1.26 -5.12 117.38 111.07 4cln n GLN 3 Ca 0.13 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.19 4cln n GLN 3 Cb 0.48 -0.74 0.00 0.00 0.11 0.00 0.00 30.24 30.09 4cln n GLN 3 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 4cln n LEU 4 N -2.08 0.00 0.00 1.08 4.32 -1.26 -4.97 117.00 114.09 4cln n LEU 4 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 4cln n LEU 4 Cb 0.27 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.07 4cln n LEU 4 CO 0.00 0.00 0.00 0.35 -1.22 0.00 0.00 177.39 176.52 4cln n THR 5 N 0.00 0.00 0.39 -5.08 -2.24 -1.26 -4.89 114.28 101.20 4cln n THR 5 Ca 0.00 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.89 4cln n THR 5 Cb 0.00 -1.84 0.01 0.00 -2.10 0.00 0.00 70.33 66.41 4cln n THR 5 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 4cln n GLU 6 N -1.05 0.41 0.07 -0.78 0.00 -1.26 -1.94 120.64 116.09 4cln n GLU 6 Ca 0.00 0.02 -0.13 0.00 0.00 0.00 0.00 57.16 57.05 4cln n GLU 6 Cb 0.00 -1.65 -0.05 0.00 0.00 0.00 0.00 31.44 29.74 4cln n GLU 6 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 4cln h GLU 7 N 0.00 0.35 -0.06 3.44 5.08 -1.99 -2.39 114.58 119.01 4cln h GLU 7 Ca 0.00 -0.40 -0.02 0.00 -1.00 0.00 0.00 59.36 57.94 4cln h GLU 7 Cb 0.83 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 4cln h GLU 7 CO 0.00 1.09 -0.04 1.96 -1.00 0.00 0.00 179.01 181.02 4cln h GLN 8 N 0.19 0.14 0.00 2.33 4.20 -1.94 -3.08 115.11 116.95 4cln h GLN 8 Ca -0.08 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.57 4cln h GLN 8 Cb 1.60 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.38 4cln h GLN 8 CO 0.16 0.54 0.00 0.82 -0.67 0.00 0.00 178.83 179.68 4cln h ILE 9 N -0.26 0.00 0.00 2.54 1.08 -1.44 -3.18 117.51 116.24 4cln h ILE 9 Ca 0.01 -0.49 -0.15 0.00 -0.39 0.00 0.00 64.86 63.84 4cln h ILE 9 Cb 0.51 1.47 -0.02 0.00 -3.07 0.00 0.00 36.82 35.70 4cln h ILE 9 CO 0.01 0.00 -1.14 0.00 -0.69 0.00 0.00 178.15 176.34 4cln h ALA 10 N 2.02 0.65 0.00 1.87 0.00 -1.35 -2.35 119.26 120.09 4cln h ALA 10 Ca 0.00 -0.73 -0.05 0.00 0.00 0.00 0.00 54.91 54.12 4cln h ALA 10 Cb 0.50 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 4cln h ALA 10 CO 0.00 0.85 -0.24 0.93 0.00 0.00 0.00 179.25 180.78 4cln h GLU 11 N 0.00 0.00 -0.08 0.00 5.08 -1.54 -2.37 114.58 115.68 4cln h GLU 11 Ca -0.11 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.04 4cln h GLU 11 Cb 1.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.79 4cln h GLU 11 CO 0.05 0.24 -0.80 0.74 -1.00 0.00 0.00 179.01 178.25 4cln h PHE 12 N 0.00 0.71 0.00 4.33 0.04 -1.52 -1.82 116.94 118.68 4cln h PHE 12 Ca -0.00 -0.33 -0.14 0.00 2.80 0.00 0.00 57.97 60.29 4cln h PHE 12 Cb 1.02 -0.10 0.01 0.00 2.20 0.00 0.00 35.95 39.08 4cln h PHE 12 CO 0.00 1.12 -0.57 1.57 -0.60 0.00 0.00 178.31 179.84 4cln h LYS 13 N 0.34 0.38 -0.79 1.51 5.09 -0.93 0.58 116.57 122.75 4cln h LYS 13 Ca -0.05 -0.41 0.19 0.00 0.09 0.00 0.00 60.65 60.47 4cln h LYS 13 Cb 1.41 0.12 -0.13 0.00 0.10 0.00 0.00 32.23 33.73 4cln h LYS 13 CO 0.15 1.09 0.13 0.93 -2.09 0.00 0.00 179.45 179.66 4cln h GLU 14 N -0.16 0.19 0.07 0.07 4.39 -1.47 1.56 114.58 119.23 4cln h GLU 14 Ca -0.07 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.61 4cln h GLU 14 Cb 1.29 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 4cln h GLU 14 CO 0.11 0.12 -0.03 0.00 -1.16 0.00 0.00 179.01 178.05 4cln h ALA 15 N 1.70 -1.02 0.00 3.43 0.00 -1.32 -0.77 119.26 121.28 4cln h ALA 15 Ca 0.46 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.35 4cln h ALA 15 Cb 0.84 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.67 4cln h ALA 15 CO -0.61 -1.01 0.31 0.34 0.00 0.00 0.00 179.25 178.27 4cln n PHE 16 N -2.26 0.16 -0.03 0.00 -0.00 0.19 -0.79 117.46 114.73 4cln n PHE 16 Ca -0.01 0.08 -0.18 0.00 -0.00 0.00 0.00 57.45 57.34 4cln n PHE 16 Cb 0.04 -0.38 -0.13 0.00 -0.00 0.00 0.00 39.48 39.00 4cln n PHE 16 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.76 177.53 4cln h SER 17 N 0.00 0.19 -0.02 -2.13 0.02 0.37 -3.14 113.55 108.84 4cln h SER 17 Ca 0.00 -0.86 0.00 0.00 -0.84 0.00 0.00 61.79 60.09 4cln h SER 17 Cb 0.61 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.09 4cln h SER 17 CO 0.00 1.31 0.28 -0.07 -1.14 0.00 0.00 176.83 177.21 4cln h LEU 18 N -0.71 0.00 0.10 5.07 3.38 -0.61 -1.18 115.31 121.36 4cln h LEU 18 Ca -0.16 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.46 4cln h LEU 18 Cb 1.36 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.09 4cln h LEU 18 CO 0.01 0.00 -1.86 -0.26 0.09 0.00 0.00 178.44 176.42 4cln h PHE 19 N 0.00 0.40 -0.97 1.13 0.04 -1.67 -3.41 116.94 112.47 4cln h PHE 19 Ca 0.01 -0.29 -0.59 0.00 2.80 0.00 0.00 57.97 59.90 4cln h PHE 19 Cb 0.56 -0.02 -0.14 0.00 2.20 0.00 0.00 35.95 38.56 4cln h PHE 19 CO 0.00 1.56 1.35 -3.47 -0.60 0.00 0.00 178.31 177.15 4cln n ASP 20 N -3.39 7.16 -0.38 2.17 2.03 -0.44 -4.54 116.55 119.15 4cln n ASP 20 Ca -0.26 -3.09 0.37 0.00 0.52 0.00 0.00 54.79 52.33 4cln n ASP 20 Cb 1.05 -1.32 0.62 0.00 -0.72 0.00 0.00 41.12 40.75 4cln n ASP 20 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 4cln h LYS 21 N 3.77 0.00 -0.01 -0.67 1.79 -1.80 0.51 116.57 120.16 4cln h LYS 21 Ca 0.53 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.00 4cln h LYS 21 Cb 0.58 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 4cln h LYS 21 CO 1.12 0.00 -0.53 -0.40 -1.08 0.00 0.00 179.45 178.56 4cln n ASP 22 N -3.58 1.06 -0.99 0.86 5.75 -1.26 -4.94 116.55 113.45 4cln n ASP 22 Ca 0.30 -0.84 -0.10 0.00 -0.01 0.00 0.00 54.79 54.14 4cln n ASP 22 Cb 1.63 0.42 -0.02 0.00 -1.03 0.00 0.00 41.12 42.13 4cln n ASP 22 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 4cln n GLY 23 N 1.44 0.31 0.08 6.12 0.00 0.18 -4.94 105.19 108.38 4cln n GLY 23 Ca 0.08 -0.52 -0.05 0.00 0.00 0.00 0.00 46.02 45.53 4cln n GLY 23 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 4cln h ASP 24 N 0.00 0.00 0.00 1.61 2.03 -1.92 -3.48 116.42 114.66 4cln h ASP 24 Ca -0.22 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.08 4cln h ASP 24 Cb 1.01 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.51 4cln h ASP 24 CO 0.27 0.88 0.00 0.61 -1.03 0.00 0.00 179.24 179.98 4cln n GLY 25 N 1.36 1.64 3.40 7.15 0.00 -1.26 -5.12 105.19 112.36 4cln n GLY 25 Ca -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 4cln n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4cln s THR 26 N -2.00 0.04 -0.11 2.61 -4.23 -1.26 -3.93 115.64 106.77 4cln s THR 26 Ca 0.00 -1.33 0.02 0.00 -1.18 0.00 0.00 61.69 59.19 4cln s THR 26 Cb 0.00 -1.90 0.01 0.00 1.34 0.00 0.00 72.50 71.95 4cln s THR 26 CO 0.00 -0.20 -0.15 -0.63 -0.54 0.00 0.00 174.62 173.09 4cln s ILE 27 N -3.97 1.48 0.34 2.99 1.01 0.21 -4.66 121.20 118.60 4cln s ILE 27 Ca 0.18 -0.63 -0.01 0.00 0.00 0.00 0.00 60.65 60.19 4cln s ILE 27 Cb 0.02 -1.35 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 4cln s ILE 27 CO 0.02 0.44 0.56 -0.89 0.00 0.00 0.00 174.94 175.07 4cln s THR 28 N 0.97 5.08 0.45 2.92 2.01 -1.26 -3.32 115.64 122.49 4cln s THR 28 Ca -0.07 -0.31 0.11 0.00 0.31 0.00 0.00 61.69 61.74 4cln s THR 28 Cb -0.15 -3.83 0.28 0.00 0.01 0.00 0.00 72.50 68.80 4cln s THR 28 CO -0.01 -0.53 2.08 0.71 -0.69 0.00 0.00 174.62 176.18 4cln h THR 29 N 0.84 1.03 -0.07 -0.82 1.35 -1.94 0.39 112.91 113.69 4cln h THR 29 Ca -0.49 -0.11 -0.19 0.00 -0.55 0.00 0.00 66.41 65.07 4cln h THR 29 Cb 1.21 0.67 -0.00 0.00 -1.73 0.00 0.00 68.15 68.30 4cln h THR 29 CO 0.62 0.06 -0.74 0.11 -0.25 0.00 0.00 175.52 175.32 4cln h LYS 30 N 0.33 0.40 0.01 4.72 6.56 -1.97 0.59 116.57 127.21 4cln h LYS 30 Ca 0.12 -0.33 -0.24 0.00 -1.06 0.00 0.00 60.65 59.13 4cln h LYS 30 Cb 0.06 0.07 0.01 0.00 -0.57 0.00 0.00 32.23 31.80 4cln h LYS 30 CO -0.03 0.98 -0.99 0.93 -2.06 0.00 0.00 179.45 178.28 4cln h GLU 31 N 0.27 0.52 0.36 3.15 5.08 -1.58 -2.26 114.58 120.12 4cln h GLU 31 Ca -0.03 -0.56 -0.02 0.00 -1.00 0.00 0.00 59.36 57.75 4cln h GLU 31 Cb 1.32 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.74 4cln h GLU 31 CO 0.13 1.19 -0.17 1.25 -1.00 0.00 0.00 179.01 180.41 4cln h LEU 32 N 0.29 -0.41 0.00 1.33 5.85 -0.99 -2.65 115.31 118.72 4cln h LEU 32 Ca -0.10 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.51 4cln h LEU 32 Cb 1.63 0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.77 4cln h LEU 32 CO 0.18 -0.13 0.00 0.61 -0.34 0.00 0.00 178.44 178.77 4cln n GLY 33 N -0.69 -0.00 0.38 3.75 0.00 0.21 -0.38 105.19 108.46 4cln n GLY 33 Ca -0.10 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.07 4cln n GLY 33 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 4cln h THR 34 N 0.00 0.76 -0.03 2.61 2.02 -1.46 -2.61 112.91 114.20 4cln h THR 34 Ca 0.00 -0.20 -0.03 0.00 0.77 0.00 0.00 66.41 66.95 4cln h THR 34 Cb 0.00 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.53 4cln h THR 34 CO 0.00 0.11 -0.10 0.58 0.37 0.00 0.00 175.52 176.48 4cln h VAL 35 N 0.59 1.46 -0.33 3.16 2.07 -0.33 -2.17 116.25 120.69 4cln h VAL 35 Ca 0.47 -1.50 0.10 0.00 0.82 0.00 0.00 66.70 66.58 4cln h VAL 35 Cb 0.91 2.37 -0.01 0.00 -1.52 0.00 0.00 31.29 33.03 4cln h VAL 35 CO -0.21 0.41 0.30 0.24 0.02 0.00 0.00 177.57 178.32 4cln h MET 36 N -0.43 0.00 -0.00 1.57 2.86 -1.01 -0.88 114.93 117.03 4cln h MET 36 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 4cln h MET 36 Cb 0.71 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.37 4cln h MET 36 CO 0.02 0.00 -0.45 2.89 1.06 0.00 0.00 176.91 180.43 4cln n ARG 37 N -4.02 0.18 0.00 1.72 1.85 -1.01 -2.04 116.66 113.34 4cln n ARG 37 Ca 0.05 -0.10 0.00 0.00 -1.00 0.00 0.00 57.85 56.80 4cln n ARG 37 Cb 0.46 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.37 4cln n ARG 37 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 4cln n SER 38 N -1.32 0.00 -0.81 2.89 7.64 -0.34 -3.49 113.62 118.20 4cln n SER 38 Ca 0.07 0.72 0.00 0.00 1.01 0.00 0.00 58.87 60.67 4cln n SER 38 Cb 0.34 -0.42 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 4cln n SER 38 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 4cln n LEU 39 N -1.75 0.00 -3.43 -3.43 4.32 -1.21 -4.67 117.00 106.82 4cln n LEU 39 Ca 0.00 0.00 -0.34 0.00 -0.02 0.00 0.00 56.01 55.65 4cln n LEU 39 Cb 0.00 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 41.83 4cln n LEU 39 CO 0.00 0.00 -0.27 0.61 -1.22 0.00 0.00 177.39 176.51 4cln n GLY 40 N 0.39 0.01 3.15 -0.72 0.00 -1.23 -4.99 105.19 101.80 4cln n GLY 40 Ca 0.00 1.09 0.05 0.00 0.00 0.00 0.00 46.02 47.16 4cln n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 4cln s GLN 41 N -2.35 0.34 -0.74 1.61 -0.21 -0.86 -5.01 119.66 112.44 4cln s GLN 41 Ca 0.35 0.38 -0.15 0.00 0.02 0.00 0.00 55.36 55.96 4cln s GLN 41 Cb -0.04 0.18 0.19 0.00 1.00 0.00 0.00 33.01 34.34 4cln s GLN 41 CO 0.81 -0.60 0.68 -0.80 -2.12 0.00 0.00 175.29 173.27 4cln s ASN 42 N 2.90 6.58 0.75 5.90 0.02 -1.26 -2.70 114.94 127.13 4cln s ASN 42 Ca 0.18 -2.42 -0.03 0.00 -1.02 0.00 0.00 52.86 49.56 4cln s ASN 42 Cb -0.07 -2.21 0.13 0.00 0.02 0.00 0.00 41.25 39.12 4cln s ASN 42 CO -0.23 -0.66 0.85 -0.81 0.02 0.00 0.00 177.10 176.27 4cln n PRO 43 N 4.36 -0.23 -4.43 -0.60 -0.04 -1.26 -5.12 135.00 127.68 4cln n PRO 43 Ca 0.05 -2.00 -0.26 0.00 -0.04 0.00 0.00 63.50 61.25 4cln n PRO 43 Cb 0.45 -0.66 -0.11 0.00 -0.04 0.00 0.00 33.50 33.13 4cln n PRO 43 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 4cln s THR 44 N -2.61 2.40 0.23 0.52 -4.23 -1.26 -5.04 115.64 105.65 4cln s THR 44 Ca 0.54 -2.08 -0.18 0.00 -1.18 0.00 0.00 61.69 58.79 4cln s THR 44 Cb -0.03 -2.17 0.23 0.00 1.34 0.00 0.00 72.50 71.87 4cln s THR 44 CO 0.36 -0.16 1.54 -0.62 -0.54 0.00 0.00 174.62 175.20 4cln n GLU 45 N 0.11 -0.24 -0.27 3.99 -0.58 -1.26 -0.44 120.64 121.95 4cln n GLU 45 Ca -0.11 1.53 0.04 0.00 -0.42 0.00 0.00 57.16 58.19 4cln n GLU 45 Cb 0.57 -2.26 0.18 0.00 -0.57 0.00 0.00 31.44 29.35 4cln n GLU 45 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 4cln h ALA 46 N 1.34 1.10 -0.16 0.62 0.00 -1.97 0.66 119.26 120.85 4cln h ALA 46 Ca 0.34 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.30 4cln h ALA 46 Cb 0.59 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 4cln h ALA 46 CO -0.98 -0.09 0.01 0.93 0.00 0.00 0.00 179.25 179.12 4cln h GLU 47 N 0.58 0.27 0.68 0.00 5.08 -1.17 1.24 114.58 121.25 4cln h GLU 47 Ca 0.40 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.66 4cln h GLU 47 Cb 0.52 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 4cln h GLU 47 CO -0.33 0.47 -0.48 -0.07 -1.00 0.00 0.00 179.01 177.60 4cln h LEU 48 N 0.03 -1.25 -0.51 1.33 3.38 -1.05 1.68 115.31 118.91 4cln h LEU 48 Ca 0.05 0.08 0.10 0.00 0.09 0.00 0.00 57.88 58.20 4cln h LEU 48 Cb 0.34 0.38 -0.09 0.00 0.09 0.00 0.00 40.66 41.39 4cln h LEU 48 CO 0.01 -0.71 -0.04 -0.61 0.09 0.00 0.00 178.44 177.18 4cln h GLN 49 N -1.11 0.07 -0.60 1.13 5.75 0.40 0.60 115.11 121.36 4cln h GLN 49 Ca -0.09 -0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.36 4cln h GLN 49 Cb 0.91 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 29.42 4cln h GLN 49 CO 0.04 0.05 0.17 -0.44 -2.65 0.00 0.00 178.83 176.01 4cln h ASP 50 N 0.07 0.84 0.16 -0.69 3.32 0.21 -0.85 116.42 119.48 4cln h ASP 50 Ca 0.26 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 57.09 4cln h ASP 50 Cb 0.40 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 4cln h ASP 50 CO -0.46 0.80 -0.27 0.24 -1.72 0.00 0.00 179.24 177.83 4cln h MET 51 N 0.88 0.19 0.17 3.56 2.86 0.55 -3.04 114.93 120.10 4cln h MET 51 Ca 0.20 -0.06 -0.27 0.00 -2.06 0.00 0.00 59.70 57.50 4cln h MET 51 Cb 0.27 -0.02 0.03 0.00 0.06 0.00 0.00 31.60 31.94 4cln h MET 51 CO -0.01 0.45 -1.16 0.82 1.06 0.00 0.00 176.91 178.07 4cln h ILE 52 N 0.18 1.35 -0.95 -1.22 2.04 0.60 -3.30 117.51 116.21 4cln h ILE 52 Ca 0.03 -2.53 0.28 0.00 1.00 0.00 0.00 64.86 63.64 4cln h ILE 52 Cb 0.57 2.95 -0.17 0.00 -0.74 0.00 0.00 36.82 39.43 4cln h ILE 52 CO 0.04 0.75 0.21 0.78 0.00 0.00 0.00 178.15 179.93 4cln h ASN 53 N 0.03 -0.13 -0.27 1.72 4.21 -1.06 0.27 115.58 120.35 4cln h ASN 53 Ca -0.19 0.24 0.07 0.00 1.21 0.00 0.00 56.30 57.63 4cln h ASN 53 Cb 1.89 0.36 -0.08 0.00 -1.12 0.00 0.00 38.32 39.37 4cln h ASN 53 CO 0.22 -0.29 -0.29 -0.08 -1.29 0.00 0.00 177.43 175.70 4cln h GLU 54 N 0.09 -0.27 0.00 0.81 4.22 -1.67 -3.14 114.58 114.63 4cln h GLU 54 Ca 0.63 0.02 -0.20 0.00 0.08 0.00 0.00 59.36 59.89 4cln h GLU 54 Cb 1.38 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.66 4cln h GLU 54 CO -0.79 -0.18 -1.59 0.28 -2.18 0.00 0.00 179.01 174.55 4cln n VAL 55 N -5.40 1.21 -2.31 0.32 0.31 -0.65 -4.80 118.33 107.02 4cln n VAL 55 Ca -0.01 -0.71 -0.35 0.00 -0.01 0.00 0.00 64.34 63.26 4cln n VAL 55 Cb 0.32 -0.72 -0.04 0.00 -0.91 0.00 0.00 33.84 32.49 4cln n VAL 55 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 4cln s ASP 56 N -5.73 5.82 0.05 4.52 2.15 0.87 -4.73 116.67 119.61 4cln s ASP 56 Ca -0.04 -0.97 -0.21 0.00 0.43 0.00 0.00 52.55 51.76 4cln s ASP 56 Cb 0.09 -2.56 -0.13 0.00 -0.30 0.00 0.00 42.92 40.01 4cln s ASP 56 CO 0.82 -2.12 1.45 0.00 -0.17 0.00 0.00 175.17 175.16 4cln h ALA 57 N 10.73 0.18 -0.31 3.66 0.00 -1.87 -3.31 119.26 128.34 4cln h ALA 57 Ca 0.11 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.81 4cln h ALA 57 Cb 1.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.76 4cln h ALA 57 CO 1.31 -0.10 0.00 -0.40 0.00 0.00 0.00 179.25 180.07 4cln n ASP 58 N -4.75 3.34 -2.15 0.00 5.75 -1.26 -5.04 116.55 112.45 4cln n ASP 58 Ca -0.06 -1.98 -0.21 0.00 -0.01 0.00 0.00 54.79 52.53 4cln n ASP 58 Cb 0.23 -0.20 -0.03 0.00 -1.03 0.00 0.00 41.12 40.09 4cln n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 4cln n GLY 59 N 1.44 0.28 0.10 6.12 0.00 -1.25 -4.88 105.19 107.00 4cln n GLY 59 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 4cln n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 4cln n ASN 60 N -1.80 0.22 0.00 1.61 6.94 -1.26 -4.84 115.26 116.13 4cln n ASN 60 Ca -0.23 -2.00 0.00 0.00 -0.02 0.00 0.00 54.58 52.32 4cln n ASN 60 Cb 0.68 -0.08 0.00 0.00 -2.36 0.00 0.00 39.78 38.03 4cln n ASN 60 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 4cln n GLY 61 N 0.46 2.97 3.70 4.83 0.00 -1.26 -4.98 105.19 110.91 4cln n GLY 61 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 4cln n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4cln s THR 62 N -1.75 2.62 -0.22 2.61 -4.23 -1.26 -4.77 115.64 108.64 4cln s THR 62 Ca 0.00 -1.79 0.02 0.00 -1.18 0.00 0.00 61.69 58.74 4cln s THR 62 Cb 0.00 -2.93 0.04 0.00 1.34 0.00 0.00 72.50 70.95 4cln s THR 62 CO 0.00 -0.12 -0.15 -0.51 -0.54 0.00 0.00 174.62 173.30 4cln s ILE 63 N -2.52 2.17 0.44 2.99 1.10 -1.21 -4.73 121.20 119.43 4cln s ILE 63 Ca 0.38 -1.28 -0.01 0.00 -0.51 0.00 0.00 60.65 59.23 4cln s ILE 63 Cb 0.01 -2.10 0.09 0.00 0.15 0.00 0.00 42.46 40.61 4cln s ILE 63 CO 0.21 0.25 0.60 -0.90 -2.11 0.00 0.00 174.94 172.99 4cln n ASP 64 N 4.53 0.75 0.02 4.50 5.68 -1.26 -0.62 116.55 130.16 4cln n ASP 64 Ca -0.17 -1.65 -0.10 0.00 -0.50 0.00 0.00 54.79 52.37 4cln n ASP 64 Cb 0.46 -0.39 -0.03 0.00 -1.14 0.00 0.00 41.12 40.01 4cln n ASP 64 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 4cln h PHE 65 N -0.57 -0.55 -0.13 2.11 3.57 -1.99 -3.22 116.94 116.15 4cln h PHE 65 Ca -0.20 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.31 4cln h PHE 65 Cb 0.72 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 4cln h PHE 65 CO 0.00 -0.29 0.01 -1.35 -2.23 0.00 0.00 178.31 174.45 4cln h PRO 66 N -0.29 0.19 0.00 6.41 0.11 -1.95 -1.89 132.00 134.58 4cln h PRO 66 Ca 0.09 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.02 4cln h PRO 66 Cb 0.41 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.46 4cln h PRO 66 CO -0.25 0.20 -0.72 0.93 -0.21 0.00 0.00 178.00 177.95 4cln h GLU 67 N 0.19 0.00 0.18 1.05 5.08 -1.88 -2.73 114.58 116.47 4cln h GLU 67 Ca 0.05 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.10 4cln h GLU 67 Cb 0.12 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.40 4cln h GLU 67 CO 0.00 0.72 -1.35 0.35 -1.00 0.00 0.00 179.01 177.73 4cln h PHE 68 N 0.00 0.83 -0.00 4.33 3.57 -1.55 -3.10 116.94 121.01 4cln h PHE 68 Ca -0.01 -0.58 -0.16 0.00 3.53 0.00 0.00 57.97 60.75 4cln h PHE 68 Cb 1.41 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 40.09 4cln h PHE 68 CO 0.00 1.44 -0.78 1.25 -2.23 0.00 0.00 178.31 178.00 4cln h LEU 69 N 0.15 0.01 0.00 0.59 6.46 -1.37 -0.60 115.31 120.54 4cln h LEU 69 Ca -0.20 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.55 4cln h LEU 69 Cb 2.04 -0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.97 4cln h LEU 69 CO 0.24 0.78 0.00 0.41 -0.62 0.00 0.00 178.44 179.25 4cln n THR 70 N -3.62 0.00 -0.10 1.05 -1.04 -1.03 -2.23 114.28 107.31 4cln n THR 70 Ca -0.01 1.29 -0.03 0.00 -2.04 0.00 0.00 64.05 63.26 4cln n THR 70 Cb 0.75 -2.27 -0.03 0.00 -1.82 0.00 0.00 70.33 66.96 4cln n THR 70 CO 0.00 0.00 0.00 -0.03 -0.64 0.00 0.00 175.07 174.40 4cln h MET 71 N 0.00 -0.01 -1.02 -2.82 1.85 -1.64 0.48 114.93 111.78 4cln h MET 71 Ca 0.00 0.00 0.41 0.00 -0.61 0.00 0.00 59.70 59.50 4cln h MET 71 Cb 0.00 0.00 -0.16 0.00 0.43 0.00 0.00 31.60 31.87 4cln h MET 71 CO 0.00 -0.01 0.57 -0.12 -0.40 0.00 0.00 176.91 176.95 4cln n MET 72 N -3.56 -0.05 -0.08 0.39 0.00 -0.23 0.47 117.12 114.05 4cln n MET 72 Ca 0.00 1.29 -0.17 0.00 0.00 0.00 0.00 57.70 58.83 4cln n MET 72 Cb 0.07 -2.36 -0.12 0.00 0.00 0.00 0.00 33.22 30.80 4cln n MET 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 4cln h ALA 73 N 1.84 0.10 -0.59 -5.12 0.00 -0.72 -3.17 119.26 111.61 4cln h ALA 73 Ca 0.81 -0.79 0.11 0.00 0.00 0.00 0.00 54.91 55.05 4cln h ALA 73 Cb 2.24 0.29 -0.08 0.00 0.00 0.00 0.00 17.79 20.24 4cln h ALA 73 CO -0.68 0.29 0.12 -0.09 0.00 0.00 0.00 179.25 178.88 4cln h ARG 74 N -0.99 0.25 -0.49 0.00 9.65 0.28 0.55 114.38 123.63 4cln h ARG 74 Ca -0.14 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.72 4cln h ARG 74 Cb 1.13 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 29.66 4cln h ARG 74 CO -0.08 0.16 0.00 1.63 2.80 0.00 0.00 179.97 184.48 4cln n LYS 75 N -5.13 1.49 -0.11 0.20 4.76 0.18 -2.83 118.16 116.71 4cln n LYS 75 Ca 0.09 -0.52 -0.21 0.00 -2.87 0.00 0.00 58.31 54.80 4cln n LYS 75 Cb 0.32 -1.34 -0.07 0.00 -1.84 0.00 0.00 35.03 32.09 4cln n LYS 75 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 4cln n MET 76 N -0.01 0.53 -0.04 1.97 2.81 0.18 -3.85 117.12 118.71 4cln n MET 76 Ca 0.05 0.23 -0.12 0.00 -1.81 0.00 0.00 57.70 56.04 4cln n MET 76 Cb 0.25 -1.41 -0.06 0.00 -0.71 0.00 0.00 33.22 31.29 4cln n MET 76 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 4cln h LYS 77 N -0.94 -0.43 -0.80 0.03 1.57 -1.00 -1.39 116.57 113.60 4cln h LYS 77 Ca -0.42 0.03 0.19 0.00 -1.87 0.00 0.00 60.65 58.58 4cln h LYS 77 Cb 1.34 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 33.70 4cln h LYS 77 CO -0.25 -0.29 0.54 -0.44 -0.57 0.00 0.00 179.45 178.44 4cln h ASP 78 N -0.45 0.30 1.59 0.86 5.19 -1.77 0.37 116.42 122.50 4cln h ASP 78 Ca 0.09 0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.52 4cln h ASP 78 Cb 0.62 -0.03 -0.00 0.00 0.18 0.00 0.00 39.33 40.10 4cln h ASP 78 CO -0.46 0.14 -0.01 0.74 -3.12 0.00 0.00 179.24 176.53 4cln h THR 79 N 0.31 0.01 0.00 0.35 2.02 -1.36 -1.70 112.91 112.54 4cln h THR 79 Ca 0.40 -0.81 0.00 0.00 0.77 0.00 0.00 66.41 66.77 4cln h THR 79 Cb 1.11 1.80 0.00 0.00 -1.74 0.00 0.00 68.15 69.32 4cln h THR 79 CO -0.11 0.01 -0.05 0.44 0.37 0.00 0.00 175.52 176.17 4cln h ASP 80 N 0.00 0.00 -0.89 4.18 3.32 -0.30 -3.21 116.42 119.51 4cln h ASP 80 Ca -0.00 0.00 0.26 0.00 0.02 0.00 0.00 57.03 57.31 4cln h ASP 80 Cb 0.80 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.32 4cln h ASP 80 CO 0.00 0.23 0.91 0.28 -1.72 0.00 0.00 179.24 178.94 4cln h SER 81 N -0.41 0.00 0.00 6.45 0.02 -0.52 0.40 113.55 119.49 4cln h SER 81 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 4cln h SER 81 Cb 0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.59 4cln h SER 81 CO 0.00 0.00 0.00 1.21 -1.14 0.00 0.00 176.83 176.90 4cln n GLU 82 N -3.57 0.00 -0.55 3.45 4.07 -0.64 -2.40 120.64 121.00 4cln n GLU 82 Ca 0.19 0.05 0.44 0.00 -0.06 0.00 0.00 57.16 57.78 4cln n GLU 82 Cb 1.20 -0.85 0.70 0.00 -0.06 0.00 0.00 31.44 32.44 4cln n GLU 82 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 4cln n GLU 83 N -0.40 -0.02 0.20 5.31 -0.58 -0.52 0.23 120.64 124.86 4cln n GLU 83 Ca 0.00 1.11 -0.15 0.00 -0.42 0.00 0.00 57.16 57.70 4cln n GLU 83 Cb 0.00 -2.34 -0.08 0.00 -0.57 0.00 0.00 31.44 28.44 4cln n GLU 83 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 4cln h GLU 84 N 0.00 -0.76 -0.67 3.49 3.07 -0.06 0.23 114.58 119.87 4cln h GLU 84 Ca 0.86 0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.77 4cln h GLU 84 Cb 3.09 0.17 0.00 0.00 -0.84 0.00 0.00 28.75 31.17 4cln h GLU 84 CO -0.24 -0.51 0.00 0.44 -1.40 0.00 0.00 179.01 177.30 4cln n ILE 85 N -5.06 0.05 -0.10 3.13 -0.00 0.14 -2.46 119.36 115.07 4cln n ILE 85 Ca -0.09 -0.03 -0.12 0.00 -0.00 0.00 0.00 62.75 62.50 4cln n ILE 85 Cb 0.38 -0.33 -0.11 0.00 -0.00 0.00 0.00 39.64 39.58 4cln n ILE 85 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.55 175.41 4cln n ARG 86 N -0.14 0.81 -0.09 6.28 3.00 -0.61 -3.88 116.66 122.02 4cln n ARG 86 Ca 0.01 0.07 -0.08 0.00 -0.00 0.00 0.00 57.85 57.85 4cln n ARG 86 Cb 0.19 -1.44 0.09 0.00 0.00 0.00 0.00 32.46 31.30 4cln n ARG 86 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 4cln h GLU 87 N 0.00 0.79 0.09 -0.14 5.08 -0.26 -2.84 114.58 117.30 4cln h GLU 87 Ca -0.48 -0.31 0.02 0.00 -1.00 0.00 0.00 59.36 57.59 4cln h GLU 87 Cb 1.87 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 31.05 4cln h GLU 87 CO -0.04 0.93 -0.21 0.00 -1.00 0.00 0.00 179.01 178.69 4cln h ALA 88 N 1.08 -0.34 0.00 3.43 0.00 -1.77 0.16 119.26 121.83 4cln h ALA 88 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 4cln h ALA 88 Cb 0.71 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.84 4cln h ALA 88 CO 0.05 -0.73 0.00 0.35 0.00 0.00 0.00 179.25 178.92 4cln h PHE 89 N -0.38 0.00 0.01 0.00 3.57 -1.66 -2.36 116.94 116.12 4cln h PHE 89 Ca 0.03 0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.33 4cln h PHE 89 Cb 0.42 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 4cln h PHE 89 CO -0.21 0.00 -0.92 0.00 -2.23 0.00 0.00 178.31 174.95 4cln h ARG 90 N 0.00 0.20 0.14 1.11 3.08 -0.43 -1.28 114.38 117.20 4cln h ARG 90 Ca 0.00 -0.24 -0.26 0.00 0.07 0.00 0.00 59.98 59.55 4cln h ARG 90 Cb 0.20 0.07 0.01 0.00 0.08 0.00 0.00 29.97 30.33 4cln h ARG 90 CO 0.00 0.99 -1.29 -0.39 -1.07 0.00 0.00 179.97 178.21 4cln h VAL 91 N 0.10 1.17 -0.70 2.04 -1.51 -1.17 -3.27 116.25 112.91 4cln h VAL 91 Ca -0.05 -2.47 0.18 0.00 -1.23 0.00 0.00 66.70 63.13 4cln h VAL 91 Cb 1.57 2.87 -0.03 0.00 -2.13 0.00 0.00 31.29 33.57 4cln h VAL 91 CO 0.14 0.73 0.49 -0.26 -1.23 0.00 0.00 177.57 177.44 4cln h PHE 92 N -0.25 0.14 -1.17 5.19 0.04 -1.50 -1.77 116.94 117.61 4cln h PHE 92 Ca -0.26 0.00 -0.64 0.00 2.80 0.00 0.00 57.97 59.87 4cln h PHE 92 Cb 1.79 -0.04 -0.26 0.00 2.20 0.00 0.00 35.95 39.64 4cln h PHE 92 CO 0.14 0.05 0.82 -3.47 -0.60 0.00 0.00 178.31 175.25 4cln n ASP 93 N -4.38 7.41 -0.01 2.17 2.03 -0.48 -4.65 116.55 118.64 4cln n ASP 93 Ca 0.14 -3.66 0.00 0.00 0.52 0.00 0.00 54.79 51.80 4cln n ASP 93 Cb 0.69 -1.03 0.01 0.00 -0.72 0.00 0.00 41.12 40.07 4cln n ASP 93 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 4cln n LYS 94 N -0.51 -0.00 -0.01 -0.67 4.81 -0.67 0.73 118.16 121.84 4cln n LYS 94 Ca 0.55 0.01 0.09 0.00 -0.87 0.00 0.00 58.31 58.09 4cln n LYS 94 Cb 0.54 -0.03 -0.14 0.00 0.02 0.00 0.00 35.03 35.42 4cln n LYS 94 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 4cln n ASP 95 N -2.33 0.82 -3.65 3.14 5.75 -1.26 -4.99 116.55 114.02 4cln n ASP 95 Ca 0.00 -0.04 -0.28 0.00 -0.01 0.00 0.00 54.79 54.46 4cln n ASP 95 Cb 0.02 1.80 0.01 0.00 -1.03 0.00 0.00 41.12 41.92 4cln n ASP 95 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 4cln n GLY 96 N 1.46 -0.80 0.03 6.12 0.00 3.59 -4.79 105.19 110.80 4cln n GLY 96 Ca -0.03 0.81 0.04 0.00 0.00 0.00 0.00 46.02 46.84 4cln n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 4cln n ASN 97 N -1.71 0.77 0.00 1.61 6.94 -1.26 -4.99 115.26 116.62 4cln n ASN 97 Ca -0.22 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.34 4cln n ASN 97 Cb 0.68 1.58 0.00 0.00 -2.36 0.00 0.00 39.78 39.68 4cln n ASN 97 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 4cln n GLY 98 N 1.59 4.03 3.67 4.83 0.00 -1.26 -5.12 105.19 112.93 4cln n GLY 98 Ca -0.10 -0.69 -0.29 0.00 0.00 0.00 0.00 46.02 44.94 4cln n GLY 98 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 4cln s PHE 99 N 0.00 2.92 -0.35 1.61 0.08 -1.26 -4.54 117.98 116.44 4cln s PHE 99 Ca 0.00 -0.08 -0.15 0.00 0.12 0.00 0.00 56.93 56.82 4cln s PHE 99 Cb 0.00 -1.48 -0.01 0.00 -0.57 0.00 0.00 43.02 40.97 4cln s PHE 99 CO 0.00 0.49 0.37 -1.50 -0.10 0.00 0.00 175.22 174.48 4cln s ILE 100 N -1.44 5.16 1.21 0.64 1.10 -0.23 -4.81 121.20 122.83 4cln s ILE 100 Ca 0.26 -0.01 -0.20 0.00 -0.51 0.00 0.00 60.65 60.18 4cln s ILE 100 Cb -0.11 -3.86 0.30 0.00 0.15 0.00 0.00 42.46 38.95 4cln s ILE 100 CO 0.18 -0.14 1.11 -1.54 -2.11 0.00 0.00 174.94 172.44 4cln n SER 101 N 5.41 -1.94 0.06 4.50 3.41 -1.26 -1.64 113.62 122.16 4cln n SER 101 Ca -0.09 -1.19 -0.13 0.00 -0.26 0.00 0.00 58.87 57.20 4cln n SER 101 Cb 0.49 -1.01 -0.14 0.00 -0.26 0.00 0.00 64.21 63.30 4cln n SER 101 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 4cln h ALA 102 N -2.67 0.32 -0.04 7.33 0.00 -1.95 -3.24 119.26 119.01 4cln h ALA 102 Ca -0.41 -1.06 -0.13 0.00 0.00 0.00 0.00 54.91 53.31 4cln h ALA 102 Cb 1.25 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 4cln h ALA 102 CO 0.27 1.20 -0.56 0.00 0.00 0.00 0.00 179.25 180.16 4cln h ALA 103 N 0.72 0.98 0.14 0.00 0.00 -1.98 -2.72 119.26 116.40 4cln h ALA 103 Ca -0.16 -0.51 -0.30 0.00 0.00 0.00 0.00 54.91 53.94 4cln h ALA 103 Cb 1.94 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 19.67 4cln h ALA 103 CO 0.15 0.70 -1.25 0.93 0.00 0.00 0.00 179.25 179.78 4cln h GLU 104 N 0.10 0.60 -0.44 0.00 5.08 -1.91 -0.32 114.58 117.69 4cln h GLU 104 Ca -0.00 -0.83 -0.02 0.00 -1.00 0.00 0.00 59.36 57.51 4cln h GLU 104 Cb 1.02 0.28 -0.02 0.00 0.50 0.00 0.00 28.75 30.53 4cln h GLU 104 CO 0.08 1.38 0.20 1.25 -1.00 0.00 0.00 179.01 180.92 4cln h LEU 105 N 0.21 0.59 0.18 1.33 7.12 -1.57 0.04 115.31 123.21 4cln h LEU 105 Ca -0.20 -0.14 -0.01 0.00 0.13 0.00 0.00 57.88 57.66 4cln h LEU 105 Cb 1.93 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 41.91 4cln h LEU 105 CO 0.24 0.57 -0.09 -0.09 -0.13 0.00 0.00 178.44 178.93 4cln h ARG 106 N 0.57 -0.24 -0.21 1.25 2.43 -1.55 0.31 114.38 116.93 4cln h ARG 106 Ca 0.15 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.39 4cln h ARG 106 Cb 0.14 0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 29.68 4cln h ARG 106 CO -0.02 -0.02 -0.36 1.25 -1.51 0.00 0.00 179.97 179.31 4cln h HIS 107 N -0.43 -1.02 0.21 2.20 2.76 -0.81 -1.45 115.15 116.61 4cln h HIS 107 Ca -0.03 0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 4cln h HIS 107 Cb 0.33 0.48 -0.00 0.00 1.55 0.00 0.00 27.41 29.76 4cln h HIS 107 CO -0.01 -0.42 -0.16 0.28 -1.30 0.00 0.00 177.93 176.31 4cln h VAL 108 N -0.39 0.00 -1.68 5.26 2.07 -0.82 0.52 116.25 121.21 4cln h VAL 108 Ca 0.11 0.00 0.51 0.00 0.82 0.00 0.00 66.70 68.14 4cln h VAL 108 Cb 0.57 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.25 4cln h VAL 108 CO -0.43 0.00 1.18 0.23 0.02 0.00 0.00 177.57 178.58 4cln n MET 109 N -3.27 -0.01 0.00 1.57 2.00 0.11 0.49 117.12 118.02 4cln n MET 109 Ca -0.04 1.04 0.09 0.00 0.00 0.00 0.00 57.70 58.79 4cln n MET 109 Cb 0.16 -2.31 -0.07 0.00 0.00 0.00 0.00 33.22 31.00 4cln n MET 109 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 4cln n THR 110 N -3.99 0.00 0.19 2.03 -1.04 -0.57 -0.09 114.28 110.81 4cln n THR 110 Ca 0.40 -0.16 0.10 0.00 -2.04 0.00 0.00 64.05 62.36 4cln n THR 110 Cb 1.76 1.07 0.12 0.00 -1.82 0.00 0.00 70.33 71.45 4cln n THR 110 CO 0.00 0.00 0.00 -1.13 -0.64 0.00 0.00 175.07 173.30 4cln h ASN 111 N 0.64 0.00 0.00 8.00 -1.24 1.67 -3.38 115.58 121.27 4cln h ASN 111 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 4cln h ASN 111 Cb 0.48 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.53 4cln h ASN 111 CO 0.00 0.08 -0.70 0.18 -1.29 0.00 0.00 177.43 175.70 4cln n LEU 112 N -3.05 1.42 0.00 0.34 7.99 0.34 -5.05 117.00 118.99 4cln n LEU 112 Ca 0.03 0.27 0.00 0.00 -0.01 0.00 0.00 56.01 56.30 4cln n LEU 112 Cb 0.57 -0.69 0.00 0.00 -0.11 0.00 0.00 43.42 43.19 4cln n LEU 112 CO 0.36 -0.34 0.00 0.61 -1.51 0.00 0.00 177.39 176.50 4cln n GLY 113 N 1.49 0.00 3.52 -0.72 0.00 -0.26 -5.10 105.19 104.13 4cln n GLY 113 Ca -0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 4cln n GLY 113 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4cln s GLU 114 N 0.00 1.89 -0.29 1.61 8.01 0.87 -4.96 118.70 125.83 4cln s GLU 114 Ca 0.00 -1.28 0.02 0.00 0.01 0.00 0.00 54.97 53.73 4cln s GLU 114 Cb 0.00 -2.10 0.08 0.00 -4.31 0.00 0.00 34.13 27.80 4cln s GLU 114 CO 0.00 0.44 -0.01 0.15 0.01 0.00 0.00 175.26 175.86 4cln s LYS 115 N -2.58 1.62 -0.02 1.61 -0.14 -1.26 -3.00 119.74 115.97 4cln s LYS 115 Ca 0.22 -1.46 -0.01 0.00 -1.36 0.00 0.00 55.97 53.36 4cln s LYS 115 Cb -0.09 -2.86 -0.04 0.00 -1.68 0.00 0.00 37.83 33.16 4cln s LYS 115 CO 0.13 -0.78 0.08 -0.51 -0.76 0.00 0.00 175.35 173.51 4cln s LEU 116 N 1.14 3.90 0.79 3.17 1.02 -1.26 -5.11 118.68 122.33 4cln s LEU 116 Ca 0.02 0.16 -0.11 0.00 0.02 0.00 0.00 54.13 54.22 4cln s LEU 116 Cb -0.19 -2.23 0.07 0.00 0.02 0.00 0.00 46.19 43.86 4cln s LEU 116 CO -0.09 0.29 1.09 -0.89 0.02 0.00 0.00 176.35 176.77 4cln s THR 117 N -1.16 3.13 0.17 5.49 2.01 -1.26 -4.91 115.64 119.10 4cln s THR 117 Ca 0.22 0.37 -0.15 0.00 0.31 0.00 0.00 61.69 62.44 4cln s THR 117 Cb -0.12 -3.11 0.06 0.00 0.01 0.00 0.00 72.50 69.33 4cln s THR 117 CO 0.13 -0.48 1.74 0.44 -0.69 0.00 0.00 174.62 175.76 4cln h ASP 118 N -1.06 0.11 -0.90 3.53 5.19 -1.99 -2.96 116.42 118.34 4cln h ASP 118 Ca -0.47 0.05 0.18 0.00 -0.62 0.00 0.00 57.03 56.17 4cln h ASP 118 Cb 1.26 0.05 -0.17 0.00 0.18 0.00 0.00 39.33 40.66 4cln h ASP 118 CO 0.59 0.10 -0.24 -0.08 -3.12 0.00 0.00 179.24 176.48 4cln h GLU 119 N 0.28 -0.01 0.00 3.56 4.81 -1.98 0.52 114.58 121.76 4cln h GLU 119 Ca 0.20 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.43 4cln h GLU 119 Cb 0.20 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 4cln h GLU 119 CO -0.22 -0.00 -0.00 0.93 -0.73 0.00 0.00 179.01 178.98 4cln h GLU 120 N -0.01 0.00 0.07 1.92 5.08 -1.90 -1.40 114.58 118.35 4cln h GLU 120 Ca 0.42 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.43 4cln h GLU 120 Cb 0.65 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 4cln h GLU 120 CO -0.93 0.00 -1.95 0.28 -1.00 0.00 0.00 179.01 175.42 4cln n VAL 121 N -3.10 1.66 0.21 3.13 0.31 0.18 -3.33 118.33 117.40 4cln n VAL 121 Ca 0.02 -0.48 0.07 0.00 -0.01 0.00 0.00 64.34 63.94 4cln n VAL 121 Cb 0.39 -1.77 0.58 0.00 -0.91 0.00 0.00 33.84 32.13 4cln n VAL 121 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 4cln h ASP 122 N -0.26 0.08 1.70 4.52 3.32 0.03 0.26 116.42 126.07 4cln h ASP 122 Ca -0.45 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 4cln h ASP 122 Cb 1.82 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 41.35 4cln h ASP 122 CO -0.05 0.08 0.00 -0.08 -1.72 0.00 0.00 179.24 177.48 4cln h GLU 123 N 0.10 0.00 0.04 3.56 4.81 -1.40 -1.88 114.58 119.81 4cln h GLU 123 Ca 0.03 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 4cln h GLU 123 Cb 0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.42 4cln h GLU 123 CO -0.00 0.00 -0.24 1.98 -0.73 0.00 0.00 179.01 180.02 4cln h MET 124 N 0.00 0.07 0.16 1.92 4.05 -0.59 -3.30 114.93 117.24 4cln h MET 124 Ca 0.00 -0.13 -0.01 0.00 -0.28 0.00 0.00 59.70 59.29 4cln h MET 124 Cb 0.85 0.05 -0.00 0.00 -0.80 0.00 0.00 31.60 31.70 4cln h MET 124 CO 0.00 1.06 -0.10 0.82 0.23 0.00 0.00 176.91 178.92 4cln h ILE 125 N -0.84 0.00 -0.87 1.77 5.03 -0.85 -3.19 117.51 118.56 4cln h ILE 125 Ca -0.04 0.00 0.16 0.00 -0.12 0.00 0.00 64.86 64.85 4cln h ILE 125 Cb 1.17 0.00 -0.16 0.00 -3.03 0.00 0.00 36.82 34.80 4cln h ILE 125 CO 0.03 0.00 -0.30 0.03 -0.68 0.00 0.00 178.15 177.23 4cln h ARG 126 N -0.25 -0.03 -0.53 2.37 3.08 -1.52 1.09 114.38 118.60 4cln h ARG 126 Ca -0.02 0.00 0.15 0.00 0.07 0.00 0.00 59.98 60.18 4cln h ARG 126 Cb 0.20 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 4cln h ARG 126 CO 0.02 -0.02 0.45 0.93 -1.07 0.00 0.00 179.97 180.27 4cln h GLU 127 N -0.03 0.00 -0.01 0.04 5.08 -1.63 -1.72 114.58 116.30 4cln h GLU 127 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 4cln h GLU 127 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 4cln h GLU 127 CO -0.90 0.00 -0.12 0.00 -1.00 0.00 0.00 179.01 177.00 4cln n ALA 128 N -2.52 2.70 -2.57 3.43 0.00 0.34 -4.88 120.51 117.01 4cln n ALA 128 Ca 0.10 -0.55 -0.43 0.00 0.00 0.00 0.00 53.44 52.56 4cln n ALA 128 Cb 0.66 -0.44 -0.08 0.00 0.00 0.00 0.00 19.45 19.59 4cln n ALA 128 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 4cln s ASP 129 N -1.32 6.22 -0.19 0.00 2.15 0.97 -4.67 116.67 119.83 4cln s ASP 129 Ca 0.13 -0.72 0.18 0.00 0.43 0.00 0.00 52.55 52.57 4cln s ASP 129 Cb 0.11 -2.25 -0.26 0.00 -0.30 0.00 0.00 42.92 40.22 4cln s ASP 129 CO 0.23 -0.68 0.10 -0.38 -0.17 0.00 0.00 175.17 174.28 4cln n ILE 130 N 5.52 1.30 1.00 4.11 5.41 -1.26 -4.10 119.36 131.33 4cln n ILE 130 Ca -0.07 -0.84 0.10 0.00 1.00 0.00 0.00 62.75 62.95 4cln n ILE 130 Cb 0.47 -0.43 0.32 0.00 -0.71 0.00 0.00 39.64 39.28 4cln n ILE 130 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 4cln n ASP 131 N -2.72 2.08 -4.05 4.38 5.75 -1.26 -4.93 116.55 115.80 4cln n ASP 131 Ca -0.31 -1.80 -0.44 0.00 -0.01 0.00 0.00 54.79 52.24 4cln n ASP 131 Cb 1.12 -0.15 0.02 0.00 -1.03 0.00 0.00 41.12 41.08 4cln n ASP 131 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 4cln n GLY 132 N 1.21 -0.81 0.08 6.12 0.00 -1.26 -4.83 105.19 105.70 4cln n GLY 132 Ca 0.16 0.33 0.05 0.00 0.00 0.00 0.00 46.02 46.56 4cln n GLY 132 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 4cln n ASP 133 N -1.96 0.71 0.00 1.61 5.75 -1.26 -5.00 116.55 116.40 4cln n ASP 133 Ca -0.12 -0.86 0.00 0.00 -0.01 0.00 0.00 54.79 53.81 4cln n ASP 133 Cb 0.53 0.83 0.00 0.00 -1.03 0.00 0.00 41.12 41.45 4cln n ASP 133 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 4cln n GLY 134 N 1.13 2.81 3.43 6.12 0.00 -1.26 -5.03 105.19 112.39 4cln n GLY 134 Ca 0.03 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 4cln n GLY 134 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 4cln n GLN 135 N -2.00 0.68 -3.70 1.61 7.27 -1.26 -4.75 117.38 115.22 4cln n GLN 135 Ca 0.00 -2.83 -0.25 0.00 0.07 0.00 0.00 57.00 53.99 4cln n GLN 135 Cb 0.00 -0.07 -0.17 0.00 2.41 0.00 0.00 30.24 32.40 4cln n GLN 135 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 4cln s VAL 136 N -2.24 0.26 0.38 1.69 0.11 -0.65 -4.70 120.40 115.24 4cln s VAL 136 Ca 0.47 -0.18 -0.09 0.00 -2.93 0.00 0.00 61.98 59.25 4cln s VAL 136 Cb -0.04 -0.69 -0.06 0.00 -1.53 0.00 0.00 36.38 34.06 4cln s VAL 136 CO 0.30 -0.07 0.72 0.54 -3.33 0.00 0.00 175.10 173.26 4cln s ASN 137 N 1.99 6.50 0.22 3.54 6.03 -1.26 -1.06 114.94 130.90 4cln s ASN 137 Ca 0.02 1.04 -0.13 0.00 -1.03 0.00 0.00 52.86 52.76 4cln s ASN 137 Cb -0.15 -2.28 0.27 0.00 -3.03 0.00 0.00 41.25 36.06 4cln s ASN 137 CO -0.07 -0.36 1.37 0.00 -2.03 0.00 0.00 177.10 176.01 4cln n TYR 138 N -1.24 0.12 -0.00 1.54 9.36 -1.26 0.22 117.16 125.90 4cln n TYR 138 Ca 0.01 1.08 -0.00 0.00 3.32 0.00 0.00 57.90 62.31 4cln n TYR 138 Cb 0.54 -0.89 -0.00 0.00 -0.63 0.00 0.00 39.34 38.36 4cln n TYR 138 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 4cln h GLU 139 N 0.00 -0.01 -0.70 2.98 5.08 -1.97 1.24 114.58 121.19 4cln h GLU 139 Ca 0.34 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.72 4cln h GLU 139 Cb 0.56 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 4cln h GLU 139 CO -0.88 -0.01 0.45 0.93 -1.00 0.00 0.00 179.01 178.50 4cln h GLU 140 N -0.01 0.88 0.00 2.33 5.08 -1.32 0.42 114.58 121.95 4cln h GLU 140 Ca 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 4cln h GLU 140 Cb 0.02 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.07 4cln h GLU 140 CO -0.02 0.58 0.00 0.34 -1.00 0.00 0.00 179.01 178.92 4cln n PHE 141 N -4.63 0.00 -0.14 4.33 -0.00 0.61 -0.61 117.46 117.01 4cln n PHE 141 Ca 0.07 0.00 0.18 0.00 -0.00 0.00 0.00 57.45 57.69 4cln n PHE 141 Cb 0.05 -0.14 0.55 0.00 -0.00 0.00 0.00 39.48 39.95 4cln n PHE 141 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.76 176.52 4cln h VAL 142 N 0.00 0.75 -0.83 -2.13 3.04 0.17 2.13 116.25 119.38 4cln h VAL 142 Ca 0.00 -0.11 0.12 0.00 -1.01 0.00 0.00 66.70 65.70 4cln h VAL 142 Cb 0.00 0.42 -0.08 0.00 -2.01 0.00 0.00 31.29 29.62 4cln h VAL 142 CO 0.00 0.06 0.46 0.74 -1.01 0.00 0.00 177.57 177.81 4cln h THR 143 N 0.31 0.84 0.00 3.17 2.02 0.57 -3.34 112.91 116.48 4cln h THR 143 Ca 0.36 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 67.30 4cln h THR 143 Cb 0.98 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 4cln h THR 143 CO -0.10 0.13 0.00 0.80 0.37 0.00 0.00 175.52 176.73 4cln n MET 144 N -4.79 0.00 -1.79 6.66 0.00 0.61 -4.27 117.12 113.54 4cln n MET 144 Ca 0.15 0.00 -0.30 0.00 -0.00 0.00 0.00 57.70 57.54 4cln n MET 144 Cb 0.34 -0.42 -0.07 0.00 0.00 0.00 0.00 33.22 33.07 4cln n MET 144 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 175.97 175.85 4cln n MET 145 N -0.34 1.39 0.06 2.12 0.00 0.46 0.21 117.12 121.03 4cln n MET 145 Ca 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 57.70 55.47 4cln n MET 145 Cb 0.00 -3.55 0.00 0.00 0.00 0.00 0.00 33.22 29.67 4cln n MET 145 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 4cln n THR 146 N 7.55 0.00 -0.02 1.12 -1.04 -1.25 -4.54 114.28 116.10 4cln n THR 146 Ca 0.46 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 62.37 4cln n THR 146 Cb 0.45 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.92 4cln n THR 146 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 4cln h SER 147 N 0.00 0.00 0.00 8.00 0.02 -1.47 -3.53 113.55 116.57 4cln h SER 147 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 4cln h SER 147 Cb 0.00 0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.57 4cln h SER 147 CO 0.00 0.02 0.00 1.17 -1.14 0.00 0.00 176.83 176.88