#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5cha s VAL 17 N 0.00 5.17 -0.71 1.39 1.01 -1.25 -4.04 120.40 121.97 5cha s VAL 17 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 61.98 62.99 5cha s VAL 17 Cb 0.00 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.54 5cha s VAL 17 CO 0.00 0.31 0.00 0.59 0.00 0.00 0.00 175.10 176.00 5cha n ASN 18 N 3.73 -3.43 -1.14 3.32 3.02 -1.26 -5.03 115.26 114.47 5cha n ASN 18 Ca -0.06 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 5cha n ASN 18 Cb 0.52 -2.02 0.00 0.00 -0.61 0.00 0.00 39.78 37.67 5cha n ASN 18 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 5cha n GLY 19 N -1.69 1.54 3.30 7.41 0.00 -1.26 -5.16 105.19 109.34 5cha n GLY 19 Ca -0.08 -2.02 -0.09 0.00 0.00 0.00 0.00 46.02 43.83 5cha n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 5cha s GLU 20 N 0.42 1.06 0.26 1.61 4.04 -1.26 -5.14 118.70 119.69 5cha s GLU 20 Ca 0.00 -1.05 -0.30 0.00 0.04 0.00 0.00 54.97 53.67 5cha s GLU 20 Cb 0.00 0.38 -0.10 0.00 0.02 0.00 0.00 34.13 34.43 5cha s GLU 20 CO 0.00 -0.38 1.42 -2.00 -1.84 0.00 0.00 175.26 172.46 5cha s GLU 21 N -3.91 4.27 0.63 -4.83 2.12 -1.26 -5.03 118.70 110.69 5cha s GLU 21 Ca 0.11 2.29 -0.10 0.00 0.36 0.00 0.00 54.97 57.64 5cha s GLU 21 Cb 0.03 -3.10 -0.01 0.00 0.26 0.00 0.00 34.13 31.31 5cha s GLU 21 CO -0.05 -0.40 1.01 0.00 -0.54 0.00 0.00 175.26 175.29 5cha s ALA 22 N -0.15 3.08 0.02 6.30 0.00 -1.26 -5.03 121.76 124.73 5cha s ALA 22 Ca 0.58 -0.30 -0.30 0.00 0.00 0.00 0.00 51.96 51.93 5cha s ALA 22 Cb -0.42 -2.95 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 5cha s ALA 22 CO 0.45 -0.83 1.16 0.08 0.00 0.00 0.00 175.76 176.61 5cha s VAL 23 N -3.18 4.23 0.46 0.00 1.01 -1.26 -4.95 120.40 116.71 5cha s VAL 23 Ca 0.55 1.60 -0.25 0.00 0.00 0.00 0.00 61.98 63.88 5cha s VAL 23 Cb -0.11 -4.02 -0.08 0.00 0.00 0.00 0.00 36.38 32.17 5cha s VAL 23 CO 0.51 0.10 1.42 -2.84 0.00 0.00 0.00 175.10 174.29 5cha s PRO 24 N 1.31 3.63 0.00 2.72 0.02 -1.26 -2.51 135.00 138.91 5cha s PRO 24 Ca 0.57 2.40 0.00 0.00 0.02 0.00 0.00 61.00 63.99 5cha s PRO 24 Cb -0.27 -2.61 0.00 0.00 0.02 0.00 0.00 34.50 31.64 5cha s PRO 24 CO 0.27 -0.86 0.00 0.41 -0.33 0.00 0.00 177.00 176.49 5cha n GLY 25 N 0.59 2.66 0.08 0.52 0.00 -1.26 -4.91 105.19 102.87 5cha n GLY 25 Ca 0.06 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 5cha n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 5cha n SER 26 N 0.00 0.46 -3.32 1.61 3.41 -1.04 -3.66 113.62 111.07 5cha n SER 26 Ca 0.00 0.59 -0.25 0.00 -0.26 0.00 0.00 58.87 58.95 5cha n SER 26 Cb 0.00 -0.70 -0.08 0.00 -0.26 0.00 0.00 64.21 63.17 5cha n SER 26 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 5cha n TRP 27 N -1.99 0.99 0.46 7.33 7.02 -1.26 -4.98 117.44 125.01 5cha n TRP 27 Ca 0.04 -3.76 0.09 0.00 -1.02 0.00 0.00 57.50 52.85 5cha n TRP 27 Cb 0.26 -0.36 0.38 0.00 -2.42 0.00 0.00 31.31 29.17 5cha n TRP 27 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 5cha n PRO 28 N 1.43 0.08 0.06 -0.99 -0.04 -1.24 -2.04 135.00 132.25 5cha n PRO 28 Ca 0.25 0.31 0.12 0.00 -0.04 0.00 0.00 63.50 64.14 5cha n PRO 28 Cb 0.48 -1.64 0.18 0.00 -0.04 0.00 0.00 33.50 32.47 5cha n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 5cha n TRP 29 N -1.79 0.52 -1.98 0.54 2.14 -1.15 -2.50 117.44 113.22 5cha n TRP 29 Ca 0.03 0.15 -0.42 0.00 2.07 0.00 0.00 57.50 59.33 5cha n TRP 29 Cb 0.20 -0.63 -0.03 0.00 -0.81 0.00 0.00 31.31 30.03 5cha n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 5cha s GLN 30 N -3.16 4.22 0.27 -2.67 2.00 -0.87 -0.76 119.66 118.70 5cha s GLN 30 Ca 0.06 2.27 0.11 0.00 -2.00 0.00 0.00 55.36 55.81 5cha s GLN 30 Cb 0.14 -3.46 -0.05 0.00 0.80 0.00 0.00 33.01 30.43 5cha s GLN 30 CO 0.72 -0.66 -0.18 0.14 -0.50 0.00 0.00 175.29 174.81 5cha s VAL 31 N 2.13 2.34 -0.09 1.34 -7.23 -0.64 -4.62 120.40 113.63 5cha s VAL 31 Ca 0.71 -2.36 0.04 0.00 -1.81 0.00 0.00 61.98 58.56 5cha s VAL 31 Cb -0.39 -2.29 -0.01 0.00 0.56 0.00 0.00 36.38 34.25 5cha s VAL 31 CO 0.31 -0.41 -0.21 -0.55 -0.31 0.00 0.00 175.10 173.93 5cha s SER 32 N -3.49 3.39 -0.21 4.85 0.15 -0.90 -1.68 113.70 115.82 5cha s SER 32 Ca 0.29 -0.45 -0.11 0.00 0.70 0.00 0.00 55.95 56.38 5cha s SER 32 Cb -0.04 -1.19 -0.05 0.00 -1.71 0.00 0.00 66.02 63.03 5cha s SER 32 CO 0.14 0.21 0.17 -0.76 1.20 0.00 0.00 173.24 174.20 5cha s LEU 33 N 0.05 4.19 -0.06 3.45 1.43 -0.58 -0.16 118.68 126.99 5cha s LEU 33 Ca -0.08 0.25 0.05 0.00 -1.03 0.00 0.00 54.13 53.31 5cha s LEU 33 Cb -0.15 -2.15 -0.01 0.00 0.03 0.00 0.00 46.19 43.91 5cha s LEU 33 CO 0.05 0.13 -0.22 -1.10 0.23 0.00 0.00 176.35 175.44 5cha s GLN 34 N 0.61 2.62 0.33 1.70 -0.21 -0.49 -0.73 119.66 123.49 5cha s GLN 34 Ca 0.09 -0.86 -0.06 0.00 0.02 0.00 0.00 55.36 54.56 5cha s GLN 34 Cb -0.12 -2.23 0.08 0.00 1.00 0.00 0.00 33.01 31.73 5cha s GLN 34 CO 0.01 0.40 0.45 -0.40 -2.12 0.00 0.00 175.29 173.63 5cha n ASP 35 N 2.91 0.04 -0.07 5.90 3.85 -0.97 -0.51 116.55 127.69 5cha n ASP 35 Ca -0.17 -1.17 -0.14 0.00 -0.71 0.00 0.00 54.79 52.59 5cha n ASP 35 Cb 0.52 -0.34 -0.05 0.00 -1.35 0.00 0.00 41.12 39.89 5cha n ASP 35 CO 0.00 0.00 0.00 0.11 -1.01 0.00 0.00 177.20 176.30 5cha h LYS 36 N 0.00 0.71 -0.89 0.11 1.79 -1.91 -1.50 116.57 114.88 5cha h LYS 36 Ca -0.15 -0.44 0.24 0.00 -2.18 0.00 0.00 60.65 58.13 5cha h LYS 36 Cb 0.40 0.05 -0.15 0.00 -1.58 0.00 0.00 32.23 30.95 5cha h LYS 36 CO 0.10 1.06 0.21 1.79 -1.08 0.00 0.00 179.45 181.54 5cha h THR 37 N 0.44 0.27 0.00 -0.16 1.35 -1.97 -3.44 112.91 109.40 5cha h THR 37 Ca 0.02 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 5cha h THR 37 Cb 1.01 0.08 0.00 0.00 -1.73 0.00 0.00 68.15 67.51 5cha h THR 37 CO 0.09 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 176.01 5cha n GLY 38 N -1.39 1.45 3.09 5.82 0.00 -0.57 -5.15 105.19 108.45 5cha n GLY 38 Ca 0.22 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.17 5cha n GLY 38 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 5cha s PHE 39 N -2.00 0.51 -0.31 1.61 5.36 -1.25 -4.79 117.98 117.10 5cha s PHE 39 Ca 0.00 -1.05 -0.42 0.00 -0.96 0.00 0.00 56.93 54.51 5cha s PHE 39 Cb 0.00 -0.38 -0.17 0.00 -0.34 0.00 0.00 43.02 42.13 5cha s PHE 39 CO 0.00 -0.37 1.70 1.58 -1.46 0.00 0.00 175.22 176.67 5cha n HIS 40 N 0.17 1.97 0.00 10.12 -0.00 -1.26 -2.30 115.22 123.92 5cha n HIS 40 Ca -0.14 0.67 0.00 0.00 -0.00 0.00 0.00 57.72 58.25 5cha n HIS 40 Cb 0.61 -2.41 0.00 0.00 -0.00 0.00 0.00 29.99 28.19 5cha n HIS 40 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 176.34 178.31 5cha n PHE 41 N 4.99 0.00 -3.63 1.57 1.16 0.09 -4.97 117.46 116.68 5cha n PHE 41 Ca 0.27 0.00 -0.05 0.00 -1.87 0.00 0.00 57.45 55.80 5cha n PHE 41 Cb 0.09 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 37.95 5cha n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 5cha n GLY 43 N -0.36 2.49 3.87 0.00 0.00 -1.26 -1.53 105.19 108.41 5cha n GLY 43 Ca -0.07 -2.24 -0.05 0.00 0.00 0.00 0.00 46.02 43.67 5cha n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 5cha s GLY 44 N -3.56 0.20 0.00 -0.02 0.00 -0.67 -4.67 107.32 98.59 5cha s GLY 44 Ca 0.30 -0.47 0.01 0.00 0.00 0.00 0.00 44.72 44.56 5cha s GLY 44 CO 0.19 1.89 -0.04 -0.56 0.00 0.00 0.00 173.10 174.58 5cha s SER 45 N -3.35 0.49 0.01 1.64 0.01 0.50 -1.61 113.70 111.40 5cha s SER 45 Ca 0.21 -0.13 -0.29 0.00 1.31 0.00 0.00 55.95 57.05 5cha s SER 45 Cb -0.03 -0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.12 5cha s SER 45 CO 0.07 0.01 0.93 -0.76 0.41 0.00 0.00 173.24 173.91 5cha s LEU 46 N -0.28 4.39 -0.02 2.44 1.43 0.06 -0.84 118.68 125.87 5cha s LEU 46 Ca -0.00 1.62 0.13 0.00 -1.03 0.00 0.00 54.13 54.84 5cha s LEU 46 Cb -0.03 -3.50 -0.19 0.00 0.03 0.00 0.00 46.19 42.50 5cha s LEU 46 CO -0.00 -0.20 0.31 2.30 0.23 0.00 0.00 176.35 178.99 5cha n ILE 47 N 3.64 0.00 -3.98 -0.59 -5.35 -0.62 -1.59 119.36 110.86 5cha n ILE 47 Ca 0.04 -0.28 -0.11 0.00 -0.27 0.00 0.00 62.75 62.13 5cha n ILE 47 Cb 0.51 0.30 -0.03 0.00 -1.74 0.00 0.00 39.64 38.67 5cha n ILE 47 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 5cha s ASN 48 N -3.33 0.24 0.00 7.28 0.02 -1.21 -4.70 114.94 113.24 5cha s ASN 48 Ca -0.04 -1.13 0.23 0.00 -1.02 0.00 0.00 52.86 50.90 5cha s ASN 48 Cb 0.08 0.67 1.20 0.00 0.02 0.00 0.00 41.25 43.23 5cha s ASN 48 CO 0.53 -1.31 1.76 -0.62 0.02 0.00 0.00 177.10 177.48 5cha n GLU 49 N -0.47 0.40 0.00 -0.60 1.02 -1.26 -3.39 120.64 116.33 5cha n GLU 49 Ca -0.02 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 5cha n GLU 49 Cb 0.61 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.53 5cha n GLU 49 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 5cha n ASN 50 N -1.24 0.23 -3.89 1.62 3.02 -1.26 0.50 115.26 114.25 5cha n ASN 50 Ca 0.12 -0.58 -0.11 0.00 -0.03 0.00 0.00 54.58 53.98 5cha n ASN 50 Cb 0.17 0.61 -0.11 0.00 -0.61 0.00 0.00 39.78 39.83 5cha n ASN 50 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 5cha s TRP 51 N -0.61 0.05 -0.04 3.10 0.52 -1.22 -0.47 118.94 120.27 5cha s TRP 51 Ca 0.00 -0.09 0.04 0.00 0.02 0.00 0.00 56.10 56.06 5cha s TRP 51 Cb 0.00 -0.05 -0.00 0.00 -1.15 0.00 0.00 33.47 32.26 5cha s TRP 51 CO 0.00 -0.17 -0.15 0.08 0.02 0.00 0.00 176.95 176.73 5cha s VAL 52 N -0.86 1.25 -0.12 4.03 1.01 0.65 -1.59 120.40 124.77 5cha s VAL 52 Ca -0.09 -0.62 -0.07 0.00 0.00 0.00 0.00 61.98 61.20 5cha s VAL 52 Cb -0.06 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 5cha s VAL 52 CO 0.00 0.37 0.12 0.54 0.00 0.00 0.00 175.10 176.13 5cha s VAL 53 N 0.10 5.31 0.25 2.92 0.11 -0.02 -1.36 120.40 127.70 5cha s VAL 53 Ca -0.04 0.14 -0.01 0.00 -2.93 0.00 0.00 61.98 59.14 5cha s VAL 53 Cb -0.11 -3.31 0.00 0.00 -1.53 0.00 0.00 36.38 31.43 5cha s VAL 53 CO 0.02 0.60 0.33 1.07 -3.33 0.00 0.00 175.10 173.79 5cha n THR 54 N 2.19 0.00 -3.04 5.04 5.66 0.64 -0.37 114.28 124.41 5cha n THR 54 Ca -0.19 -1.29 -0.35 0.00 -3.05 0.00 0.00 64.05 59.16 5cha n THR 54 Cb 0.54 0.78 -0.06 0.00 -1.55 0.00 0.00 70.33 70.04 5cha n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 5cha s ALA 55 N -2.47 3.34 0.16 1.79 0.00 -1.26 -0.39 121.76 122.94 5cha s ALA 55 Ca 0.21 0.22 -0.13 0.00 0.00 0.00 0.00 51.96 52.26 5cha s ALA 55 Cb -0.01 -2.89 0.05 0.00 0.00 0.00 0.00 23.12 20.28 5cha s ALA 55 CO 0.15 0.29 1.71 0.00 0.00 0.00 0.00 175.76 177.91 5cha h ALA 56 N 3.07 0.71 0.00 0.00 0.00 -1.68 -3.01 119.26 118.35 5cha h ALA 56 Ca -0.48 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.26 5cha h ALA 56 Cb 1.19 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.77 5cha h ALA 56 CO 0.65 0.34 0.06 1.12 0.00 0.00 0.00 179.25 181.42 5cha h HIS 57 N 0.75 0.00 0.00 0.00 2.07 -1.93 -1.72 115.15 114.32 5cha h HIS 57 Ca 0.18 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.70 5cha h HIS 57 Cb 0.23 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.21 5cha h HIS 57 CO 0.01 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.87 5cha n GLY 59 N -0.83 -0.53 3.77 0.00 0.00 -0.65 -4.94 105.19 102.00 5cha n GLY 59 Ca -0.00 0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 5cha n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 5cha s VAL 60 N -3.22 2.22 0.40 1.61 1.01 -1.26 -5.02 120.40 116.14 5cha s VAL 60 Ca 0.37 0.21 0.04 0.00 0.00 0.00 0.00 61.98 62.59 5cha s VAL 60 Cb -0.16 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.05 5cha s VAL 60 CO 0.45 0.04 0.07 0.42 0.00 0.00 0.00 175.10 176.09 5cha s THR 61 N -0.68 1.00 -1.18 3.92 -4.23 -1.26 -4.95 115.64 108.26 5cha s THR 61 Ca 0.56 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.21 5cha s THR 61 Cb -0.45 -2.52 0.17 0.00 1.34 0.00 0.00 72.50 71.03 5cha s THR 61 CO 0.55 0.00 1.41 0.41 -0.54 0.00 0.00 174.62 176.45 5cha n THR 62 N -0.89 0.89 0.93 3.99 -1.04 -1.26 -1.80 114.28 115.10 5cha n THR 62 Ca -0.07 0.22 0.11 0.00 -2.04 0.00 0.00 64.05 62.27 5cha n THR 62 Cb 0.66 -0.99 -0.02 0.00 -1.82 0.00 0.00 70.33 68.16 5cha n THR 62 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 5cha n SER 63 N -1.41 0.81 -4.75 8.00 7.64 -1.26 -4.53 113.62 118.11 5cha n SER 63 Ca 0.05 -0.71 -0.31 0.00 1.01 0.00 0.00 58.87 58.91 5cha n SER 63 Cb 0.14 0.83 0.11 0.00 -1.01 0.00 0.00 64.21 64.27 5cha n SER 63 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 5cha s ASP 64 N -3.12 4.16 0.06 6.43 -0.00 -0.74 -4.49 116.67 118.97 5cha s ASP 64 Ca 0.08 1.73 0.08 0.00 -0.00 0.00 0.00 52.55 54.44 5cha s ASP 64 Cb 0.16 -2.42 -0.03 0.00 -0.00 0.00 0.00 42.92 40.63 5cha s ASP 64 CO 0.82 -2.24 -0.21 0.54 -0.00 0.00 0.00 175.17 174.09 5cha s VAL 65 N -2.91 1.68 -0.17 -1.27 0.11 0.33 -4.39 120.40 113.77 5cha s VAL 65 Ca 0.62 -1.30 -0.11 0.00 -2.93 0.00 0.00 61.98 58.27 5cha s VAL 65 Cb -0.17 -1.48 -0.05 0.00 -1.53 0.00 0.00 36.38 33.15 5cha s VAL 65 CO 0.56 0.13 0.17 -0.69 -3.33 0.00 0.00 175.10 171.95 5cha s VAL 66 N -0.90 5.39 -0.23 2.04 1.01 0.09 -1.40 120.40 126.40 5cha s VAL 66 Ca 0.07 0.29 -0.04 0.00 0.00 0.00 0.00 61.98 62.30 5cha s VAL 66 Cb -0.09 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.79 5cha s VAL 66 CO 0.02 0.46 -0.04 -0.69 0.00 0.00 0.00 175.10 174.85 5cha s VAL 67 N 0.15 3.29 0.08 2.92 1.01 0.78 -0.10 120.40 128.53 5cha s VAL 67 Ca 0.11 -0.63 0.08 0.00 0.00 0.00 0.00 61.98 61.54 5cha s VAL 67 Cb -0.12 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 5cha s VAL 67 CO 0.01 0.35 -0.16 0.00 0.00 0.00 0.00 175.10 175.30 5cha s ALA 68 N 1.45 2.73 0.00 5.51 0.00 0.07 -2.12 121.76 129.40 5cha s ALA 68 Ca 0.04 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 50.75 5cha s ALA 68 Cb -0.15 -0.76 0.00 0.00 0.00 0.00 0.00 23.12 22.22 5cha s ALA 68 CO -0.03 0.60 0.00 0.41 0.00 0.00 0.00 175.76 176.73 5cha n GLY 69 N 1.07 0.71 3.73 0.00 0.00 -1.26 -0.42 105.19 109.02 5cha n GLY 69 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 5cha n GLY 69 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 5cha s GLU 70 N -0.35 4.55 -0.04 1.61 4.04 -1.26 -4.76 118.70 122.50 5cha s GLU 70 Ca 0.00 1.20 -0.08 0.00 0.04 0.00 0.00 54.97 56.14 5cha s GLU 70 Cb 0.00 -3.40 -0.03 0.00 0.02 0.00 0.00 34.13 30.73 5cha s GLU 70 CO 0.00 0.18 -0.15 0.34 -1.84 0.00 0.00 175.26 173.78 5cha n PHE 71 N 3.13 0.00 -4.09 4.83 7.35 -1.26 -4.93 117.46 122.49 5cha n PHE 71 Ca 0.00 0.00 -0.35 0.00 -0.76 0.00 0.00 57.45 56.34 5cha n PHE 71 Cb 0.50 -0.25 -0.07 0.00 0.35 0.00 0.00 39.48 40.01 5cha n PHE 71 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 5cha s ASP 72 N -5.98 5.88 0.00 -2.13 3.68 -1.26 -5.05 116.67 111.81 5cha s ASP 72 Ca -0.13 0.30 0.24 0.00 2.13 0.00 0.00 52.55 55.09 5cha s ASP 72 Cb 0.02 -1.79 0.54 0.00 -1.45 0.00 0.00 42.92 40.24 5cha s ASP 72 CO 0.19 0.37 1.45 0.00 0.13 0.00 0.00 175.17 177.31 5cha n GLN 73 N 1.86 2.13 -0.11 4.34 6.02 -1.26 -4.35 117.38 126.00 5cha n GLN 73 Ca -0.18 -1.66 0.05 0.00 -0.01 0.00 0.00 57.00 55.19 5cha n GLN 73 Cb 0.54 -1.47 0.11 0.00 1.02 0.00 0.00 30.24 30.44 5cha n GLN 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 5cha n GLY 74 N 1.31 2.07 3.74 1.08 0.00 -1.26 -5.03 105.19 107.10 5cha n GLY 74 Ca 0.17 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 5cha n GLY 74 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 5cha s SER 75 N -0.95 6.66 0.59 1.61 0.01 -1.26 -4.86 113.70 115.50 5cha s SER 75 Ca 0.17 2.63 0.28 0.00 1.31 0.00 0.00 55.95 60.34 5cha s SER 75 Cb 0.09 -2.61 1.59 0.00 0.21 0.00 0.00 66.02 65.30 5cha s SER 75 CO 0.13 -0.72 2.03 0.28 0.41 0.00 0.00 173.24 175.37 5cha h SER 76 N 5.50 0.00 0.00 2.44 0.02 -1.98 -3.41 113.55 116.12 5cha h SER 76 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 5cha h SER 76 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 5cha h SER 76 CO 0.81 0.00 0.00 -0.24 -1.14 0.00 0.00 176.83 176.26 5cha n SER 77 N -3.79 0.00 -4.26 3.07 2.88 -1.26 -5.19 113.62 105.06 5cha n SER 77 Ca 0.04 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.43 5cha n SER 77 Cb 0.44 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.80 5cha n SER 77 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 5cha s GLU 78 N -0.55 1.28 -0.67 -1.46 2.12 -1.26 -5.11 118.70 113.04 5cha s GLU 78 Ca 0.00 -1.67 -0.20 0.00 0.36 0.00 0.00 54.97 53.46 5cha s GLU 78 Cb 0.00 -0.10 0.10 0.00 0.26 0.00 0.00 34.13 34.39 5cha s GLU 78 CO 0.00 -0.29 0.87 0.21 -0.54 0.00 0.00 175.26 175.51 5cha s LYS 79 N -4.05 3.17 0.04 4.30 2.20 -1.26 -4.98 119.74 119.16 5cha s LYS 79 Ca 0.35 -1.24 0.01 0.00 -0.36 0.00 0.00 55.97 54.73 5cha s LYS 79 Cb 0.07 -4.35 -0.00 0.00 -1.51 0.00 0.00 37.83 32.04 5cha s LYS 79 CO 0.11 -1.68 0.04 0.44 -0.36 0.00 0.00 175.35 173.90 5cha n ILE 80 N 5.63 0.00 -3.86 5.43 -0.00 -1.26 -4.78 119.36 120.52 5cha n ILE 80 Ca -0.02 -0.31 -0.29 0.00 -0.00 0.00 0.00 62.75 62.13 5cha n ILE 80 Cb 0.45 0.15 -0.16 0.00 -0.00 0.00 0.00 39.64 40.08 5cha n ILE 80 CO 0.00 0.00 0.00 -1.10 -0.00 0.00 0.00 176.55 175.45 5cha s GLN 81 N -2.17 1.25 -0.59 6.28 -0.21 0.45 -5.01 119.66 119.66 5cha s GLN 81 Ca 0.05 -0.70 -0.19 0.00 0.02 0.00 0.00 55.36 54.54 5cha s GLN 81 Cb 0.00 -2.31 0.10 0.00 1.00 0.00 0.00 33.01 31.81 5cha s GLN 81 CO 0.04 -0.58 0.71 0.15 -2.12 0.00 0.00 175.29 173.49 5cha s LYS 82 N 1.60 3.05 -0.17 2.91 1.02 -1.26 -0.75 119.74 126.15 5cha s LYS 82 Ca -0.03 -1.27 -0.12 0.00 0.02 0.00 0.00 55.97 54.57 5cha s LYS 82 Cb -0.18 -4.25 -0.05 0.00 -0.52 0.00 0.00 37.83 32.83 5cha s LYS 82 CO -0.07 -1.53 0.24 -0.51 -0.92 0.00 0.00 175.35 172.55 5cha s LEU 83 N 2.75 4.24 0.51 3.17 1.43 0.86 -4.90 118.68 126.75 5cha s LEU 83 Ca 0.12 0.43 -0.19 0.00 -1.03 0.00 0.00 54.13 53.46 5cha s LEU 83 Cb -0.24 -2.28 -0.07 0.00 0.03 0.00 0.00 46.19 43.64 5cha s LEU 83 CO 0.07 0.14 1.03 -0.54 0.23 0.00 0.00 176.35 177.28 5cha s LYS 84 N 0.33 3.71 -0.20 1.70 1.02 -1.26 -0.73 119.74 124.30 5cha s LYS 84 Ca 0.14 1.27 -0.13 0.00 0.02 0.00 0.00 55.97 57.26 5cha s LYS 84 Cb -0.12 -2.09 -0.04 0.00 -0.52 0.00 0.00 37.83 35.06 5cha s LYS 84 CO 0.02 -0.50 0.28 0.42 -0.92 0.00 0.00 175.35 174.65 5cha s ILE 85 N -2.18 5.29 -0.19 2.17 1.01 -1.26 -1.46 121.20 124.58 5cha s ILE 85 Ca 0.65 0.47 -0.08 0.00 0.00 0.00 0.00 60.65 61.70 5cha s ILE 85 Cb -0.15 -3.62 -0.21 0.00 0.01 0.00 0.00 42.46 38.49 5cha s ILE 85 CO 0.25 0.33 0.11 0.00 0.00 0.00 0.00 174.94 175.63 5cha n ALA 86 N 4.12 1.04 -3.40 9.38 0.00 0.16 -4.72 120.51 127.10 5cha n ALA 86 Ca -0.12 -0.76 -0.15 0.00 0.00 0.00 0.00 53.44 52.41 5cha n ALA 86 Cb 0.52 -0.43 -0.07 0.00 0.00 0.00 0.00 19.45 19.46 5cha n ALA 86 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 5cha s LYS 87 N -2.51 0.83 -0.11 0.00 2.20 -1.06 -5.01 119.74 114.08 5cha s LYS 87 Ca -0.28 0.18 -0.04 0.00 -0.36 0.00 0.00 55.97 55.47 5cha s LYS 87 Cb 0.08 0.39 -0.03 0.00 -1.51 0.00 0.00 37.83 36.75 5cha s LYS 87 CO 0.67 -0.23 0.02 0.08 -0.36 0.00 0.00 175.35 175.53 5cha s VAL 88 N -0.96 4.47 -0.43 4.02 1.01 -1.26 -1.64 120.40 125.61 5cha s VAL 88 Ca -0.10 -0.18 0.04 0.00 0.00 0.00 0.00 61.98 61.74 5cha s VAL 88 Cb -0.03 -2.92 0.12 0.00 0.00 0.00 0.00 36.38 33.55 5cha s VAL 88 CO 0.06 0.57 0.16 -0.36 0.00 0.00 0.00 175.10 175.54 5cha s PHE 89 N -0.55 3.26 0.36 5.22 0.40 0.35 -4.96 117.98 122.06 5cha s PHE 89 Ca 0.10 -2.98 -0.20 0.00 -0.60 0.00 0.00 56.93 53.24 5cha s PHE 89 Cb -0.12 -2.74 -0.10 0.00 0.51 0.00 0.00 43.02 40.57 5cha s PHE 89 CO 0.02 -0.84 0.87 0.15 0.70 0.00 0.00 175.22 176.13 5cha s LYS 90 N 0.34 4.25 0.05 0.44 3.01 -1.26 -1.28 119.74 125.29 5cha s LYS 90 Ca 0.14 1.02 -0.31 0.00 -1.01 0.00 0.00 55.97 55.82 5cha s LYS 90 Cb -0.23 -2.45 -0.07 0.00 -1.01 0.00 0.00 37.83 34.07 5cha s LYS 90 CO -0.05 0.13 1.53 1.21 0.51 0.00 0.00 175.35 178.69 5cha s ASN 91 N -2.03 6.71 0.66 2.83 3.84 -1.07 -4.87 114.94 121.01 5cha s ASN 91 Ca 0.56 2.35 0.41 0.00 0.21 0.00 0.00 52.86 56.38 5cha s ASN 91 Cb -0.12 -2.57 2.26 0.00 -0.55 0.00 0.00 41.25 40.27 5cha s ASN 91 CO 0.17 -0.80 2.30 0.28 -2.79 0.00 0.00 177.10 176.26 5cha h SER 92 N 7.92 0.00 1.27 -4.21 0.02 -1.93 -1.71 113.55 114.91 5cha h SER 92 Ca -0.41 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 5cha h SER 92 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 5cha h SER 92 CO 0.91 0.00 0.00 0.29 -1.14 0.00 0.00 176.83 176.89 5cha n LYS 93 N -3.16 0.23 -1.60 3.45 4.76 -1.26 -4.91 118.16 115.67 5cha n LYS 93 Ca -0.03 0.25 -0.50 0.00 -2.87 0.00 0.00 58.31 55.16 5cha n LYS 93 Cb 0.12 -1.80 -0.05 0.00 -1.84 0.00 0.00 35.03 31.46 5cha n LYS 93 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 5cha n TYR 94 N -2.21 1.55 -4.04 2.13 9.36 -0.64 -4.72 117.16 118.59 5cha n TYR 94 Ca 0.05 0.60 -0.33 0.00 3.32 0.00 0.00 57.90 61.54 5cha n TYR 94 Cb 0.38 -2.34 -0.15 0.00 -0.63 0.00 0.00 39.34 36.60 5cha n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 5cha s ASN 95 N 0.35 4.44 0.00 2.98 3.84 -0.81 -5.01 114.94 120.74 5cha s ASN 95 Ca 0.79 -1.30 0.13 0.00 0.21 0.00 0.00 52.86 52.69 5cha s ASN 95 Cb -0.88 -1.58 0.66 0.00 -0.55 0.00 0.00 41.25 38.90 5cha s ASN 95 CO 0.48 -0.19 1.35 -1.54 -2.79 0.00 0.00 177.10 174.41 5cha n SER 96 N 4.49 0.00 -0.07 -4.21 3.41 -1.26 -1.03 113.62 114.95 5cha n SER 96 Ca -0.14 0.15 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 5cha n SER 96 Cb 0.43 -0.31 -0.15 0.00 -0.26 0.00 0.00 64.21 63.92 5cha n SER 96 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 5cha n LEU 97 N -1.31 1.07 0.00 1.04 4.77 -1.26 -4.44 117.00 116.87 5cha n LEU 97 Ca 0.06 0.11 0.10 0.00 -0.03 0.00 0.00 56.01 56.25 5cha n LEU 97 Cb 0.11 -0.03 -0.14 0.00 -2.33 0.00 0.00 43.42 41.03 5cha n LEU 97 CO 0.10 0.59 -0.65 0.41 -1.33 0.00 0.00 177.39 176.52 5cha n THR 98 N -3.00 0.17 -1.49 -5.08 -1.04 -1.22 -4.97 114.28 97.65 5cha n THR 98 Ca -0.31 -0.53 -0.17 0.00 -2.04 0.00 0.00 64.05 61.00 5cha n THR 98 Cb 1.09 -0.08 -0.07 0.00 -1.82 0.00 0.00 70.33 69.44 5cha n THR 98 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 5cha n ILE 99 N -2.36 0.00 -2.67 12.58 2.08 -0.20 -4.97 119.36 123.83 5cha n ILE 99 Ca -0.05 0.00 -0.33 0.00 0.56 0.00 0.00 62.75 62.93 5cha n ILE 99 Cb 0.60 -1.78 -0.05 0.00 -0.75 0.00 0.00 39.64 37.65 5cha n ILE 99 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 5cha s ASN 100 N -2.66 6.69 -1.06 4.38 2.47 -1.23 -3.96 114.94 119.57 5cha s ASN 100 Ca 0.00 1.76 -0.03 0.00 0.42 0.00 0.00 52.86 55.01 5cha s ASN 100 Cb 0.00 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.26 5cha s ASN 100 CO 0.00 -0.54 0.90 0.59 -3.72 0.00 0.00 177.10 174.33 5cha n ASN 101 N -0.87 -3.31 -3.51 -4.21 3.02 -1.26 -1.92 115.26 103.19 5cha n ASN 101 Ca 0.08 -0.50 -0.40 0.00 -0.03 0.00 0.00 54.58 53.73 5cha n ASN 101 Cb 0.53 -4.38 -0.02 0.00 -0.61 0.00 0.00 39.78 35.31 5cha n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 5cha n ASP 102 N -2.63 5.97 -4.04 6.41 4.64 -1.25 -4.04 116.55 121.60 5cha n ASP 102 Ca -0.16 -2.69 -0.09 0.00 -1.38 0.00 0.00 54.79 50.47 5cha n ASP 102 Cb 0.61 -1.55 -0.11 0.00 -1.04 0.00 0.00 41.12 39.03 5cha n ASP 102 CO 0.00 0.00 0.00 -0.51 -0.82 0.00 0.00 177.20 175.87 5cha s ILE 103 N 2.87 0.26 -0.11 5.18 -1.16 -1.26 -3.20 121.20 123.78 5cha s ILE 103 Ca 0.57 -1.28 -0.10 0.00 -0.51 0.00 0.00 60.65 59.33 5cha s ILE 103 Cb 0.16 -0.79 0.03 0.00 0.61 0.00 0.00 42.46 42.46 5cha s ILE 103 CO -0.06 -0.65 0.29 -0.89 -2.81 0.00 0.00 174.94 170.82 5cha s THR 104 N -2.32 -0.00 -0.09 4.00 2.01 0.48 -2.58 115.64 117.14 5cha s THR 104 Ca -0.06 0.01 -0.02 0.00 0.31 0.00 0.00 61.69 61.92 5cha s THR 104 Cb -0.04 -0.41 -0.03 0.00 0.01 0.00 0.00 72.50 72.03 5cha s THR 104 CO -0.04 0.00 0.01 -0.76 -0.69 0.00 0.00 174.62 173.15 5cha s LEU 105 N 0.22 3.63 -0.18 4.42 1.43 -0.40 -0.26 118.68 127.54 5cha s LEU 105 Ca -0.01 0.16 0.01 0.00 -1.03 0.00 0.00 54.13 53.27 5cha s LEU 105 Cb -0.02 -1.84 0.03 0.00 0.03 0.00 0.00 46.19 44.39 5cha s LEU 105 CO -0.00 0.38 -0.17 -0.76 0.23 0.00 0.00 176.35 176.03 5cha s LEU 106 N -0.90 2.08 -0.35 1.79 1.43 -0.47 0.13 118.68 122.40 5cha s LEU 106 Ca 0.13 -0.67 -0.14 0.00 -1.03 0.00 0.00 54.13 52.43 5cha s LEU 106 Cb -0.11 -1.37 -0.01 0.00 0.03 0.00 0.00 46.19 44.73 5cha s LEU 106 CO 0.02 -0.04 0.27 -0.75 0.23 0.00 0.00 176.35 176.09 5cha s LYS 107 N 1.35 3.47 0.39 1.70 2.47 -0.65 -0.26 119.74 128.21 5cha s LYS 107 Ca 0.04 -0.62 -0.25 0.00 -1.56 0.00 0.00 55.97 53.58 5cha s LYS 107 Cb -0.14 -3.82 -0.09 0.00 -1.46 0.00 0.00 37.83 32.32 5cha s LYS 107 CO -0.11 -0.49 1.05 -0.51 0.16 0.00 0.00 175.35 175.45 5cha s LEU 108 N 1.79 4.18 0.00 5.43 1.43 0.38 -0.66 118.68 131.23 5cha s LEU 108 Ca 0.07 2.06 0.27 0.00 -1.03 0.00 0.00 54.13 55.49 5cha s LEU 108 Cb -0.17 -4.13 0.75 0.00 0.03 0.00 0.00 46.19 42.66 5cha s LEU 108 CO 0.11 -0.45 1.57 -1.54 0.23 0.00 0.00 176.35 176.27 5cha n SER 109 N 0.06 1.89 -3.28 2.29 3.41 -0.54 -4.60 113.62 112.85 5cha n SER 109 Ca 0.04 -1.58 -0.05 0.00 -0.26 0.00 0.00 58.87 57.03 5cha n SER 109 Cb 0.49 0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.42 5cha n SER 109 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 5cha s THR 110 N -2.07 -0.74 0.66 6.66 2.01 -1.26 -5.02 115.64 115.88 5cha s THR 110 Ca 0.33 -0.08 -0.17 0.00 0.31 0.00 0.00 61.69 62.08 5cha s THR 110 Cb 0.20 -0.90 -0.04 0.00 0.01 0.00 0.00 72.50 71.77 5cha s THR 110 CO 0.35 -0.11 0.75 0.00 -0.69 0.00 0.00 174.62 174.93 5cha n ALA 111 N 5.38 -0.66 -1.50 7.40 0.00 -1.26 -4.82 120.51 125.06 5cha n ALA 111 Ca -0.02 -0.12 -0.31 0.00 0.00 0.00 0.00 53.44 53.00 5cha n ALA 111 Cb 0.50 -1.98 0.07 0.00 0.00 0.00 0.00 19.45 18.05 5cha n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 5cha s ALA 112 N -1.74 2.41 -0.59 0.00 0.00 0.18 -4.99 121.76 117.04 5cha s ALA 112 Ca 0.71 -0.00 0.01 0.00 0.00 0.00 0.00 51.96 52.68 5cha s ALA 112 Cb -0.39 -3.16 0.15 0.00 0.00 0.00 0.00 23.12 19.72 5cha s ALA 112 CO 0.52 -1.53 0.37 0.45 0.00 0.00 0.00 175.76 175.57 5cha s SER 113 N -3.76 4.79 0.77 0.00 0.15 -1.26 -4.86 113.70 109.53 5cha s SER 113 Ca 0.60 -3.01 -0.15 0.00 0.70 0.00 0.00 55.95 54.08 5cha s SER 113 Cb -0.15 -1.74 0.00 0.00 -1.71 0.00 0.00 66.02 62.42 5cha s SER 113 CO 0.55 -0.28 0.72 0.49 1.20 0.00 0.00 173.24 175.92 5cha n PHE 114 N 3.18 -0.20 -2.64 3.44 3.01 -1.26 -4.80 117.46 118.19 5cha n PHE 114 Ca 0.08 0.35 0.00 0.00 1.01 0.00 0.00 57.45 58.89 5cha n PHE 114 Cb 0.35 -1.97 0.00 0.00 -0.01 0.00 0.00 39.48 37.85 5cha n PHE 114 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 5cha n SER 115 N -1.22 0.00 0.25 4.37 3.41 0.34 -4.89 113.62 115.87 5cha n SER 115 Ca 0.11 -0.04 0.15 0.00 -0.26 0.00 0.00 58.87 58.82 5cha n SER 115 Cb 0.50 0.00 0.42 0.00 -0.26 0.00 0.00 64.21 64.87 5cha n SER 115 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 5cha h GLN 116 N 0.00 0.00 0.00 4.33 7.50 -1.97 -3.27 115.11 121.70 5cha h GLN 116 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 5cha h GLN 116 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.53 5cha h GLN 116 CO 0.00 0.00 -1.31 0.25 -1.50 0.00 0.00 178.83 176.27 5cha n THR 117 N -3.09 0.00 -4.02 -0.54 -2.24 -1.26 -4.89 114.28 98.24 5cha n THR 117 Ca 0.02 -0.26 -0.29 0.00 -2.27 0.00 0.00 64.05 61.24 5cha n THR 117 Cb 0.42 0.51 -0.17 0.00 -2.10 0.00 0.00 70.33 69.00 5cha n THR 117 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 5cha s VAL 118 N -2.87 1.48 0.30 2.28 1.01 -1.23 -4.32 120.40 117.04 5cha s VAL 118 Ca -0.01 -0.58 -0.18 0.00 0.00 0.00 0.00 61.98 61.21 5cha s VAL 118 Cb 0.11 -1.40 0.07 0.00 0.00 0.00 0.00 36.38 35.16 5cha s VAL 118 CO 0.68 0.44 0.91 -0.94 0.00 0.00 0.00 175.10 176.20 5cha s SER 119 N 1.50 0.02 0.03 3.32 1.04 -1.04 -0.50 113.70 118.08 5cha s SER 119 Ca 0.05 -0.96 -0.02 0.00 0.48 0.00 0.00 55.95 55.50 5cha s SER 119 Cb -0.13 0.69 -0.04 0.00 0.10 0.00 0.00 66.02 66.64 5cha s SER 119 CO -0.10 -1.38 0.22 0.00 0.98 0.00 0.00 173.24 172.96 5cha s ALA 120 N -2.13 3.96 0.46 5.32 0.00 -1.26 -2.94 121.76 125.17 5cha s ALA 120 Ca 0.19 -0.77 -0.06 0.00 0.00 0.00 0.00 51.96 51.32 5cha s ALA 120 Cb -0.04 -1.89 -0.04 0.00 0.00 0.00 0.00 23.12 21.15 5cha s ALA 120 CO 0.09 0.77 0.78 0.54 0.00 0.00 0.00 175.76 177.94 5cha s VAL 121 N -1.43 4.89 0.39 0.00 0.11 -0.62 -4.89 120.40 118.85 5cha s VAL 121 Ca 0.32 0.28 -0.11 0.00 -2.93 0.00 0.00 61.98 59.53 5cha s VAL 121 Cb -0.13 -3.84 -0.07 0.00 -1.53 0.00 0.00 36.38 30.82 5cha s VAL 121 CO 0.23 -0.78 0.77 0.00 -3.33 0.00 0.00 175.10 171.99 5cha s LEU 123 N -3.68 4.03 0.95 0.00 2.96 -1.26 -5.11 118.68 116.58 5cha s LEU 123 Ca 0.52 0.19 -0.14 0.00 -0.22 0.00 0.00 54.13 54.48 5cha s LEU 123 Cb -0.10 -2.40 0.20 0.00 0.50 0.00 0.00 46.19 44.39 5cha s LEU 123 CO 0.28 0.26 1.30 -2.16 -1.32 0.00 0.00 176.35 174.71 5cha s PRO 124 N -1.87 0.62 0.27 0.98 0.04 -1.26 -5.10 135.00 128.68 5cha s PRO 124 Ca 0.25 -0.56 0.04 0.00 0.04 0.00 0.00 61.00 60.77 5cha s PRO 124 Cb -0.12 -1.90 -0.03 0.00 0.04 0.00 0.00 34.50 32.49 5cha s PRO 124 CO 0.16 -2.39 0.41 -1.12 0.04 0.00 0.00 177.00 174.10 5cha s SER 125 N -4.91 6.31 0.46 6.66 0.01 -1.26 -5.01 113.70 115.96 5cha s SER 125 Ca 0.74 0.17 0.24 0.00 1.31 0.00 0.00 55.95 58.41 5cha s SER 125 Cb -0.03 -1.91 1.08 0.00 0.21 0.00 0.00 66.02 65.37 5cha s SER 125 CO 0.52 -0.13 1.91 0.00 0.41 0.00 0.00 173.24 175.95 5cha h ALA 126 N 1.08 1.13 -0.09 1.44 0.00 -2.06 -2.67 119.26 118.09 5cha h ALA 126 Ca -0.51 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.20 5cha h ALA 126 Cb 1.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.98 5cha h ALA 126 CO 0.61 0.27 0.00 -1.13 0.00 0.00 0.00 179.25 179.00 5cha n SER 127 N -3.55 1.95 -4.79 0.00 3.41 -1.26 -4.93 113.62 104.45 5cha n SER 127 Ca -0.01 -1.68 -0.34 0.00 -0.26 0.00 0.00 58.87 56.58 5cha n SER 127 Cb 0.37 -0.05 -0.01 0.00 -0.26 0.00 0.00 64.21 64.25 5cha n SER 127 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 5cha s ASP 128 N -1.84 6.01 -0.12 4.04 1.47 -1.01 -5.02 116.67 120.19 5cha s ASP 128 Ca 0.35 2.05 -0.02 0.00 1.18 0.00 0.00 52.55 56.11 5cha s ASP 128 Cb 0.20 -2.57 -0.03 0.00 -0.34 0.00 0.00 42.92 40.18 5cha s ASP 128 CO 0.31 -1.02 -0.04 -0.62 0.68 0.00 0.00 175.17 174.48 5cha s ASP 129 N -1.90 4.82 -0.30 2.11 2.15 -1.26 -5.00 116.67 117.30 5cha s ASP 129 Ca 0.70 -0.06 -0.00 0.00 0.43 0.00 0.00 52.55 53.62 5cha s ASP 129 Cb -0.20 -1.57 0.09 0.00 -0.30 0.00 0.00 42.92 40.95 5cha s ASP 129 CO 0.24 0.26 0.08 -0.36 -0.17 0.00 0.00 175.17 175.21 5cha s PHE 130 N -0.16 1.88 0.32 -5.34 0.40 -1.26 -5.11 117.98 108.70 5cha s PHE 130 Ca 0.03 -1.77 -0.29 0.00 -0.60 0.00 0.00 56.93 54.31 5cha s PHE 130 Cb -0.13 -1.75 -0.10 0.00 0.51 0.00 0.00 43.02 41.56 5cha s PHE 130 CO 0.02 -0.85 1.20 0.00 0.70 0.00 0.00 175.22 176.30 5cha s ALA 131 N 1.56 3.41 0.06 5.36 0.00 -1.26 -4.97 121.76 125.93 5cha s ALA 131 Ca 0.08 1.07 -0.37 0.00 0.00 0.00 0.00 51.96 52.75 5cha s ALA 131 Cb -0.17 -3.40 -0.16 0.00 0.00 0.00 0.00 23.12 19.38 5cha s ALA 131 CO -0.21 -0.43 1.42 0.00 0.00 0.00 0.00 175.76 176.54 5cha n ALA 132 N 0.86 -0.54 0.00 0.00 0.00 -1.26 -0.65 120.51 118.92 5cha n ALA 132 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.93 5cha n ALA 132 Cb 0.44 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.75 5cha n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5cha n GLY 133 N 2.83 2.57 3.78 0.00 0.00 -1.26 -5.08 105.19 108.02 5cha n GLY 133 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 5cha n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 5cha s THR 134 N -2.46 2.12 -0.47 2.61 2.01 0.18 -4.94 115.64 114.69 5cha s THR 134 Ca 0.00 0.11 -0.23 0.00 0.31 0.00 0.00 61.69 61.89 5cha s THR 134 Cb 0.00 -3.07 0.03 0.00 0.01 0.00 0.00 72.50 69.47 5cha s THR 134 CO 0.00 0.03 0.77 -0.89 -0.69 0.00 0.00 174.62 173.84 5cha s THR 135 N -1.00 4.66 0.12 -0.82 2.01 -1.26 -5.04 115.64 114.30 5cha s THR 135 Ca 0.53 0.28 0.01 0.00 0.31 0.00 0.00 61.69 62.82 5cha s THR 135 Cb -0.46 -4.33 0.01 0.00 0.01 0.00 0.00 72.50 67.72 5cha s THR 135 CO 0.61 -0.76 0.05 0.00 -0.69 0.00 0.00 174.62 173.83 5cha s VAL 137 N -0.93 0.22 0.04 0.00 1.01 -1.26 -5.15 120.40 114.33 5cha s VAL 137 Ca 0.04 -0.60 0.04 0.00 0.00 0.00 0.00 61.98 61.46 5cha s VAL 137 Cb -0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 36.07 5cha s VAL 137 CO 0.03 -0.25 -0.12 0.28 0.00 0.00 0.00 175.10 175.04 5cha s THR 138 N -0.86 0.92 0.07 3.92 -1.32 -1.26 -5.16 115.64 111.95 5cha s THR 138 Ca -0.08 -0.97 0.01 0.00 -1.21 0.00 0.00 61.69 59.44 5cha s THR 138 Cb -0.06 -0.86 -0.03 0.00 -1.51 0.00 0.00 72.50 70.03 5cha s THR 138 CO -0.00 -0.10 -0.06 0.42 -2.21 0.00 0.00 174.62 172.67 5cha s THR 139 N -0.94 0.56 0.00 5.08 -4.23 -1.26 -5.09 115.64 109.76 5cha s THR 139 Ca -0.01 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 58.91 5cha s THR 139 Cb -0.08 -1.24 0.00 0.00 1.34 0.00 0.00 72.50 72.52 5cha s THR 139 CO 0.01 -0.71 0.00 0.61 -0.54 0.00 0.00 174.62 173.99 5cha n GLY 140 N 0.55 -0.44 1.05 3.99 0.00 -1.26 -4.97 105.19 104.11 5cha n GLY 140 Ca -0.16 -1.12 0.07 0.00 0.00 0.00 0.00 46.02 44.81 5cha n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 5cha n TRP 141 N -0.51 1.13 -1.24 1.61 8.01 -1.26 -4.68 117.44 120.50 5cha n TRP 141 Ca 0.00 -0.93 -0.29 0.00 -1.31 0.00 0.00 57.50 54.97 5cha n TRP 141 Cb 0.00 -0.36 0.18 0.00 -2.01 0.00 0.00 31.31 29.12 5cha n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 5cha s GLY 142 N -1.84 1.57 0.46 6.99 0.00 -1.26 -4.91 107.32 108.34 5cha s GLY 142 Ca 0.44 -0.54 -0.23 0.00 0.00 0.00 0.00 44.72 44.39 5cha s GLY 142 CO 0.09 0.12 0.94 1.04 0.00 0.00 0.00 173.10 175.30 5cha n LEU 143 N -4.21 2.53 -0.18 0.66 4.77 -1.26 -3.03 117.00 116.27 5cha n LEU 143 Ca 0.07 0.97 0.12 0.00 -0.03 0.00 0.00 56.01 57.14 5cha n LEU 143 Cb 0.58 -1.33 0.26 0.00 -2.33 0.00 0.00 43.42 40.60 5cha n LEU 143 CO 0.55 -1.73 0.51 0.35 -1.33 0.00 0.00 177.39 175.74 5cha n THR 144 N -0.80 0.00 -3.64 -5.08 -2.24 -1.26 -1.83 114.28 99.42 5cha n THR 144 Ca 0.10 -0.09 -0.14 0.00 -2.27 0.00 0.00 64.05 61.65 5cha n THR 144 Cb 0.41 0.49 -0.08 0.00 -2.10 0.00 0.00 70.33 69.05 5cha n THR 144 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 5cha s ARG 145 N -2.68 0.79 0.00 -0.78 0.52 -1.26 -4.07 118.95 111.47 5cha s ARG 145 Ca 0.19 0.77 0.00 0.00 -0.52 0.00 0.00 55.73 56.16 5cha s ARG 145 Cb 0.18 0.38 0.00 0.00 0.52 0.00 0.00 34.95 36.03 5cha s ARG 145 CO 0.60 -0.13 0.37 0.98 0.02 0.00 0.00 175.30 177.15