#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cha s VAL 17 N 0.00 4.84 -1.33 1.39 1.01 -1.07 -2.95 120.40 122.29 2cha s VAL 17 Ca 0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 61.98 61.93 2cha s VAL 17 Cb 0.00 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.29 2cha s VAL 17 CO 0.00 0.59 0.06 0.59 0.00 0.00 0.00 175.10 176.34 2cha n ASN 18 N 2.31 -4.77 -1.25 3.32 3.02 -1.26 -5.04 115.26 111.60 2cha n ASN 18 Ca -0.19 -0.04 0.00 0.00 -0.03 0.00 0.00 54.58 54.32 2cha n ASN 18 Cb 0.54 -3.85 0.00 0.00 -0.61 0.00 0.00 39.78 35.86 2cha n ASN 18 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cha n GLY 19 N -1.06 0.99 3.14 7.41 0.00 -1.26 -5.15 105.19 109.26 2cha n GLY 19 Ca -0.17 -1.92 -0.09 0.00 0.00 0.00 0.00 46.02 43.84 2cha n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cha s GLU 20 N 0.95 0.66 -0.13 1.61 2.02 -1.26 -5.11 118.70 117.44 2cha s GLU 20 Ca 0.00 -0.87 -0.29 0.00 0.02 0.00 0.00 54.97 53.83 2cha s GLU 20 Cb 0.00 0.26 -0.07 0.00 0.10 0.00 0.00 34.13 34.42 2cha s GLU 20 CO 0.00 -0.18 2.14 -1.91 0.02 0.00 0.00 175.26 175.33 2cha n GLU 21 N 0.45 2.25 -0.56 1.61 2.13 -1.26 -4.94 120.64 120.32 2cha n GLU 21 Ca -0.17 0.71 -0.29 0.00 0.66 0.00 0.00 57.16 58.07 2cha n GLU 21 Cb 0.60 -3.13 0.26 0.00 0.27 0.00 0.00 31.44 29.43 2cha n GLU 21 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2cha s ALA 22 N 6.95 -0.52 0.12 4.31 0.00 -1.26 -5.02 121.76 126.34 2cha s ALA 22 Ca 0.97 -0.32 -0.31 0.00 0.00 0.00 0.00 51.96 52.30 2cha s ALA 22 Cb -0.39 -3.17 -0.08 0.00 0.00 0.00 0.00 23.12 19.48 2cha s ALA 22 CO 0.38 -3.98 1.41 0.08 0.00 0.00 0.00 175.76 173.65 2cha s VAL 23 N -2.47 3.23 0.27 0.00 1.01 -1.26 -4.93 120.40 116.25 2cha s VAL 23 Ca 0.68 0.88 -0.31 0.00 0.00 0.00 0.00 61.98 63.24 2cha s VAL 23 Cb -0.22 -3.57 -0.12 0.00 0.00 0.00 0.00 36.38 32.47 2cha s VAL 23 CO 0.63 0.07 1.65 -2.84 0.00 0.00 0.00 175.10 174.61 2cha s PRO 24 N 1.10 4.11 0.00 2.72 0.02 -1.26 -0.53 135.00 141.16 2cha s PRO 24 Ca 0.65 2.61 0.00 0.00 0.02 0.00 0.00 61.00 64.28 2cha s PRO 24 Cb -0.38 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.11 2cha s PRO 24 CO 0.30 -0.69 0.00 0.41 -0.33 0.00 0.00 177.00 176.70 2cha n GLY 25 N 2.73 0.33 0.27 0.52 0.00 -1.26 -4.78 105.19 102.99 2cha n GLY 25 Ca 0.11 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.23 2cha n GLY 25 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2cha h SER 26 N 0.00 0.00 -3.64 1.61 4.64 -1.14 -3.21 113.55 111.81 2cha h SER 26 Ca 0.00 0.00 -0.72 0.00 -0.47 0.00 0.00 61.79 60.60 2cha h SER 26 Cb 0.37 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.12 2cha h SER 26 CO 0.00 0.05 -0.09 0.26 -0.87 0.00 0.00 176.83 176.18 2cha s TRP 27 N -4.73 3.79 0.43 4.77 0.52 -1.26 -4.96 118.94 117.49 2cha s TRP 27 Ca -0.05 -2.80 0.14 0.00 0.02 0.00 0.00 56.10 53.41 2cha s TRP 27 Cb 0.16 -3.35 1.03 0.00 -1.15 0.00 0.00 33.47 30.15 2cha s TRP 27 CO 0.62 -0.81 1.96 -1.00 0.02 0.00 0.00 176.95 177.74 2cha h PRO 28 N 6.53 0.40 0.00 4.98 0.13 -1.71 -1.42 132.00 140.92 2cha h PRO 28 Ca 0.11 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 65.18 2cha h PRO 28 Cb 0.88 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 31.91 2cha h PRO 28 CO 0.82 0.27 -0.16 0.11 -0.23 0.00 0.00 178.00 178.81 2cha h TRP 29 N 0.42 0.00 -3.00 1.56 0.09 -0.87 -1.11 115.95 113.05 2cha h TRP 29 Ca 0.30 0.00 -0.53 0.00 0.09 0.00 0.00 58.89 58.75 2cha h TRP 29 Cb 0.62 0.00 0.01 0.00 0.08 0.00 0.00 29.16 29.88 2cha h TRP 29 CO -0.00 0.16 0.73 -1.14 0.09 0.00 0.00 178.44 178.28 2cha s GLN 30 N -3.41 4.32 0.33 0.12 2.00 -0.54 -1.27 119.66 121.22 2cha s GLN 30 Ca 0.03 2.01 0.08 0.00 -2.00 0.00 0.00 55.36 55.49 2cha s GLN 30 Cb 0.08 -3.35 -0.04 0.00 0.80 0.00 0.00 33.01 30.50 2cha s GLN 30 CO 0.64 -0.45 0.16 0.14 -0.50 0.00 0.00 175.29 175.28 2cha s VAL 31 N 1.43 3.14 0.05 1.34 -7.23 -0.84 -4.36 120.40 113.94 2cha s VAL 31 Ca 0.64 -1.66 0.09 0.00 -1.81 0.00 0.00 61.98 59.24 2cha s VAL 31 Cb -0.35 -3.01 -0.03 0.00 0.56 0.00 0.00 36.38 33.56 2cha s VAL 31 CO 0.29 -0.19 -0.25 -0.55 -0.31 0.00 0.00 175.10 174.09 2cha s SER 32 N -3.86 2.96 -0.28 4.85 0.15 -0.03 -3.06 113.70 114.44 2cha s SER 32 Ca 0.38 -0.58 -0.01 0.00 0.70 0.00 0.00 55.95 56.44 2cha s SER 32 Cb -0.03 -0.26 0.05 0.00 -1.71 0.00 0.00 66.02 64.07 2cha s SER 32 CO 0.23 0.22 -0.03 -0.76 1.20 0.00 0.00 173.24 174.10 2cha s LEU 33 N -1.28 3.69 0.09 3.45 1.43 0.00 -0.74 118.68 125.32 2cha s LEU 33 Ca 0.11 -1.24 -0.02 0.00 -1.03 0.00 0.00 54.13 51.94 2cha s LEU 33 Cb -0.10 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.41 2cha s LEU 33 CO 0.02 -0.23 0.28 -1.10 0.23 0.00 0.00 176.35 175.56 2cha s GLN 34 N 1.23 3.52 0.00 1.70 -0.21 0.24 0.06 119.66 126.21 2cha s GLN 34 Ca -0.05 -0.27 0.00 0.00 0.02 0.00 0.00 55.36 55.06 2cha s GLN 34 Cb -0.19 -2.96 0.00 0.00 1.00 0.00 0.00 33.01 30.85 2cha s GLN 34 CO -0.02 0.55 0.00 -0.40 -2.12 0.00 0.00 175.29 173.30 2cha n ASP 35 N 0.27 0.00 0.00 5.90 3.85 -0.44 -0.79 116.55 125.33 2cha n ASP 35 Ca -0.04 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.04 2cha n ASP 35 Cb 0.51 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.28 2cha n ASP 35 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 2cha n LYS 36 N 0.00 -0.26 0.00 0.11 4.76 -1.26 -4.00 118.16 117.50 2cha n LYS 36 Ca 0.00 -0.67 0.10 0.00 -2.87 0.00 0.00 58.31 54.87 2cha n LYS 36 Cb 0.00 -0.99 0.58 0.00 -1.84 0.00 0.00 35.03 32.78 2cha n LYS 36 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 2cha n THR 37 N -0.09 0.00 -2.99 -0.18 -2.24 -1.26 -4.92 114.28 102.61 2cha n THR 37 Ca 0.00 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.66 2cha n THR 37 Cb 0.05 -0.51 0.05 0.00 -2.10 0.00 0.00 70.33 67.82 2cha n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cha n GLY 38 N 0.48 0.08 3.19 3.38 0.00 -1.26 -5.09 105.19 105.98 2cha n GLY 38 Ca 0.15 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 2cha n GLY 38 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2cha s PHE 39 N -3.19 1.93 -0.11 1.61 5.36 -1.26 -4.88 117.98 117.45 2cha s PHE 39 Ca 0.20 -0.52 -0.29 0.00 -0.96 0.00 0.00 56.93 55.35 2cha s PHE 39 Cb -0.09 -1.28 -0.05 0.00 -0.34 0.00 0.00 43.02 41.26 2cha s PHE 39 CO 0.40 -0.15 1.68 -1.58 -1.46 0.00 0.00 175.22 174.11 2cha s HIS 40 N -0.12 1.95 -0.06 10.12 5.65 -1.23 -1.33 115.29 130.27 2cha s HIS 40 Ca -0.01 0.30 0.04 0.00 0.25 0.00 0.00 55.06 55.63 2cha s HIS 40 Cb -0.11 -3.94 -0.06 0.00 -1.18 0.00 0.00 32.58 27.28 2cha s HIS 40 CO 0.02 -3.63 -0.01 1.97 -0.65 0.00 0.00 174.74 172.44 2cha n PHE 41 N 7.77 0.00 -3.87 3.88 1.16 0.11 -4.95 117.46 121.56 2cha n PHE 41 Ca 0.18 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.67 2cha n PHE 41 Cb 0.44 -0.28 -0.08 0.00 -1.61 0.00 0.00 39.48 37.95 2cha n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2cha s GLY 43 N -2.46 1.65 0.02 0.00 0.00 -1.26 -0.82 107.32 104.45 2cha s GLY 43 Ca -0.00 -0.82 -0.29 0.00 0.00 0.00 0.00 44.72 43.61 2cha s GLY 43 CO -0.07 -0.50 1.03 -0.32 0.00 0.00 0.00 173.10 173.24 2cha s GLY 44 N -4.39 -0.35 -0.03 0.20 0.00 -1.17 -4.46 107.32 97.12 2cha s GLY 44 Ca 0.56 0.76 0.02 0.00 0.00 0.00 0.00 44.72 46.07 2cha s GLY 44 CO 0.44 0.22 -0.09 -0.56 0.00 0.00 0.00 173.10 173.11 2cha s SER 45 N -2.67 1.26 -0.20 1.64 0.01 0.71 -1.99 113.70 112.46 2cha s SER 45 Ca 0.10 -0.20 -0.28 0.00 1.31 0.00 0.00 55.95 56.88 2cha s SER 45 Cb -0.00 -0.38 0.00 0.00 0.21 0.00 0.00 66.02 65.85 2cha s SER 45 CO -0.04 0.06 0.97 -0.76 0.41 0.00 0.00 173.24 173.88 2cha s LEU 46 N 0.28 4.13 -0.24 2.44 1.43 -0.40 -1.10 118.68 125.22 2cha s LEU 46 Ca -0.05 1.32 0.03 0.00 -1.03 0.00 0.00 54.13 54.40 2cha s LEU 46 Cb -0.10 -3.45 -0.19 0.00 0.03 0.00 0.00 46.19 42.49 2cha s LEU 46 CO 0.01 -0.57 -0.12 2.30 0.23 0.00 0.00 176.35 178.19 2cha n ILE 47 N 5.11 1.51 -4.43 -0.59 -5.35 -1.23 -0.32 119.36 114.06 2cha n ILE 47 Ca 0.09 -0.61 -0.22 0.00 -0.27 0.00 0.00 62.75 61.74 2cha n ILE 47 Cb 0.47 -1.36 -0.09 0.00 -1.74 0.00 0.00 39.64 36.92 2cha n ILE 47 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 2cha s ASN 48 N -6.47 2.20 0.21 7.28 0.02 -1.19 -4.79 114.94 112.20 2cha s ASN 48 Ca -0.31 -1.54 -0.03 0.00 -1.02 0.00 0.00 52.86 49.96 2cha s ASN 48 Cb 0.08 0.29 0.19 0.00 0.02 0.00 0.00 41.25 41.84 2cha s ASN 48 CO 0.64 -0.82 1.60 -0.08 0.02 0.00 0.00 177.10 178.46 2cha h GLU 49 N 2.04 0.66 0.09 -0.60 4.81 -1.98 -3.34 114.58 116.27 2cha h GLU 49 Ca -0.37 -0.31 -0.21 0.00 -0.13 0.00 0.00 59.36 58.34 2cha h GLU 49 Cb 1.26 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.63 2cha h GLU 49 CO 0.59 0.91 -1.06 -0.91 -0.73 0.00 0.00 179.01 177.81 2cha h ASN 50 N 0.55 0.31 -1.83 1.04 2.35 -1.92 0.86 115.58 116.94 2cha h ASN 50 Ca 0.06 -0.86 -0.48 0.00 -0.55 0.00 0.00 56.30 54.47 2cha h ASN 50 Cb 0.85 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 39.09 2cha h ASN 50 CO 0.07 1.47 -0.41 0.26 -1.65 0.00 0.00 177.43 177.16 2cha s TRP 51 N -2.42 2.97 0.13 1.19 0.52 -1.25 -2.41 118.94 117.66 2cha s TRP 51 Ca -0.19 -0.28 -0.07 0.00 0.02 0.00 0.00 56.10 55.58 2cha s TRP 51 Cb 0.03 -1.86 -0.01 0.00 -1.15 0.00 0.00 33.47 30.47 2cha s TRP 51 CO 0.75 0.12 0.19 0.08 0.02 0.00 0.00 176.95 178.12 2cha s VAL 52 N -2.26 0.11 -0.01 4.03 1.01 -0.41 -3.20 120.40 119.67 2cha s VAL 52 Ca 0.42 -1.46 0.01 0.00 0.00 0.00 0.00 61.98 60.96 2cha s VAL 52 Cb -0.07 -1.72 -0.00 0.00 0.00 0.00 0.00 36.38 34.59 2cha s VAL 52 CO 0.28 -0.48 -0.05 0.54 0.00 0.00 0.00 175.10 175.40 2cha s VAL 53 N -3.95 0.36 0.00 2.92 0.11 -0.26 -0.88 120.40 118.71 2cha s VAL 53 Ca 0.14 -0.19 0.00 0.00 -2.93 0.00 0.00 61.98 59.00 2cha s VAL 53 Cb 0.05 -0.32 0.00 0.00 -1.53 0.00 0.00 36.38 34.58 2cha s VAL 53 CO -0.03 0.11 0.00 1.07 -3.33 0.00 0.00 175.10 172.91 2cha n THR 54 N 3.02 0.00 -3.85 5.04 5.66 0.24 -0.21 114.28 124.17 2cha n THR 54 Ca -0.13 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.55 2cha n THR 54 Cb 0.58 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.32 2cha n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2cha s ALA 55 N -1.60 3.94 0.10 1.79 0.00 -1.26 -1.29 121.76 123.45 2cha s ALA 55 Ca 0.00 -0.74 -0.06 0.00 0.00 0.00 0.00 51.96 51.16 2cha s ALA 55 Cb 0.00 -1.92 -0.18 0.00 0.00 0.00 0.00 23.12 21.02 2cha s ALA 55 CO 0.00 0.76 1.23 0.00 0.00 0.00 0.00 175.76 177.75 2cha h ALA 56 N 3.29 0.23 0.00 0.00 0.00 -1.73 -2.84 119.26 118.21 2cha h ALA 56 Ca -0.47 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 53.68 2cha h ALA 56 Cb 1.17 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2cha h ALA 56 CO 0.73 0.84 0.00 -2.39 0.00 0.00 0.00 179.25 178.43 2cha n HIS 57 N -3.69 0.00 0.36 0.00 1.44 -1.26 -2.07 115.22 110.00 2cha n HIS 57 Ca -0.08 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.77 2cha n HIS 57 Cb 0.91 -0.31 0.54 0.00 0.12 0.00 0.00 29.99 31.25 2cha n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2cha n GLY 59 N 0.21 -0.36 3.75 0.00 0.00 -0.88 -4.92 105.19 102.99 2cha n GLY 59 Ca 0.02 0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2cha n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cha s VAL 60 N -3.54 3.40 0.37 1.61 1.01 -1.26 -5.05 120.40 116.94 2cha s VAL 60 Ca 0.21 1.34 0.04 0.00 0.00 0.00 0.00 61.98 63.57 2cha s VAL 60 Cb -0.10 -3.85 -0.06 0.00 0.00 0.00 0.00 36.38 32.37 2cha s VAL 60 CO 0.81 0.29 0.05 0.42 0.00 0.00 0.00 175.10 176.67 2cha s THR 61 N -0.83 1.29 0.19 3.92 -4.23 -1.26 -4.94 115.64 109.78 2cha s THR 61 Ca 0.48 -2.00 0.32 0.00 -1.18 0.00 0.00 61.69 59.30 2cha s THR 61 Cb -0.33 -2.73 0.32 0.00 1.34 0.00 0.00 72.50 71.09 2cha s THR 61 CO 0.41 0.00 1.98 0.74 -0.54 0.00 0.00 174.62 177.21 2cha h THR 62 N 1.94 0.00 0.00 3.99 2.02 -1.88 -1.97 112.91 117.01 2cha h THR 62 Ca -0.41 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.77 2cha h THR 62 Cb 1.25 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 68.37 2cha h THR 62 CO 0.71 0.00 -0.60 -1.28 0.37 0.00 0.00 175.52 174.71 2cha h SER 63 N 0.00 0.00 -4.25 4.18 0.87 -1.95 -3.41 113.55 108.99 2cha h SER 63 Ca 0.00 -0.07 -0.49 0.00 -1.23 0.00 0.00 61.79 60.00 2cha h SER 63 Cb 0.01 0.00 0.07 0.00 -0.44 0.00 0.00 62.40 62.05 2cha h SER 63 CO 0.00 0.04 0.35 -1.81 -0.53 0.00 0.00 176.83 174.87 2cha s ASP 64 N -5.07 5.41 0.17 6.23 -0.00 -0.74 -4.45 116.67 118.22 2cha s ASP 64 Ca 0.04 0.98 0.10 0.00 -0.00 0.00 0.00 52.55 53.67 2cha s ASP 64 Cb 0.10 -1.81 -0.04 0.00 -0.00 0.00 0.00 42.92 41.17 2cha s ASP 64 CO 0.73 -1.31 -0.19 -0.69 -0.00 0.00 0.00 175.17 173.71 2cha s VAL 65 N -3.27 2.68 -0.14 -1.27 1.01 0.03 -4.14 120.40 115.30 2cha s VAL 65 Ca 0.57 -1.80 -0.03 0.00 0.00 0.00 0.00 61.98 60.72 2cha s VAL 65 Cb -0.11 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.96 2cha s VAL 65 CO 0.50 -0.06 -0.03 -0.69 0.00 0.00 0.00 175.10 174.83 2cha s VAL 66 N -1.53 4.02 -0.03 2.92 1.01 -0.68 -0.59 120.40 125.52 2cha s VAL 66 Ca 0.21 -0.32 0.07 0.00 0.00 0.00 0.00 61.98 61.94 2cha s VAL 66 Cb -0.09 -2.75 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 2cha s VAL 66 CO 0.11 0.51 -0.24 -0.69 0.00 0.00 0.00 175.10 174.79 2cha s VAL 67 N 0.10 2.20 0.05 2.92 1.01 0.08 0.12 120.40 126.88 2cha s VAL 67 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 61.98 60.94 2cha s VAL 67 Cb -0.13 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 2cha s VAL 67 CO 0.02 0.58 -0.05 0.00 0.00 0.00 0.00 175.10 175.66 2cha s ALA 68 N -0.50 0.52 -1.98 5.51 0.00 -0.43 -0.85 121.76 124.03 2cha s ALA 68 Ca 0.07 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 51.03 2cha s ALA 68 Cb -0.11 0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.18 2cha s ALA 68 CO 0.00 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 175.95 2cha n GLY 69 N 0.71 1.41 3.91 0.00 0.00 -1.26 -2.24 105.19 107.71 2cha n GLY 69 Ca -0.18 -0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 2cha n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2cha s GLU 70 N -3.92 3.20 0.00 1.61 2.12 -1.26 -4.63 118.70 115.81 2cha s GLU 70 Ca 0.00 0.08 0.00 0.00 0.36 0.00 0.00 54.97 55.41 2cha s GLU 70 Cb 0.00 -2.32 0.00 0.00 0.26 0.00 0.00 34.13 32.07 2cha s GLU 70 CO 0.00 -0.47 0.00 0.34 -0.54 0.00 0.00 175.26 174.59 2cha n PHE 71 N -2.43 0.00 -4.04 5.30 7.35 -1.26 -4.84 117.46 117.54 2cha n PHE 71 Ca 0.03 0.00 -0.26 0.00 -0.76 0.00 0.00 57.45 56.45 2cha n PHE 71 Cb 0.56 0.04 -0.05 0.00 0.35 0.00 0.00 39.48 40.39 2cha n PHE 71 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2cha s ASP 72 N -3.27 5.79 0.00 -2.13 3.68 -1.26 -5.04 116.67 114.45 2cha s ASP 72 Ca 0.00 -0.03 0.22 0.00 2.13 0.00 0.00 52.55 54.88 2cha s ASP 72 Cb 0.00 -1.60 0.02 0.00 -1.45 0.00 0.00 42.92 39.90 2cha s ASP 72 CO 0.00 0.07 1.08 0.00 0.13 0.00 0.00 175.17 176.45 2cha n GLN 73 N -0.38 0.36 0.10 4.34 6.02 -1.26 -3.96 117.38 122.61 2cha n GLN 73 Ca -0.08 -0.28 -0.01 0.00 -0.01 0.00 0.00 57.00 56.62 2cha n GLN 73 Cb 0.54 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 30.27 2cha n GLN 73 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2cha h GLY 74 N 4.96 0.00 -2.17 1.08 0.00 -2.02 -3.48 103.07 101.44 2cha h GLY 74 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.04 2cha h GLY 74 CO 0.00 0.00 -0.02 1.44 0.00 0.00 0.00 176.54 177.96 2cha n SER 75 N -3.26 -0.10 0.16 0.19 7.64 -1.25 -4.78 113.62 112.22 2cha n SER 75 Ca 0.01 0.43 0.04 0.00 1.01 0.00 0.00 58.87 60.36 2cha n SER 75 Cb 0.82 -0.35 0.12 0.00 -1.01 0.00 0.00 64.21 63.79 2cha n SER 75 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2cha h SER 76 N 0.96 0.00 0.00 6.43 0.02 -1.95 -3.44 113.55 115.57 2cha h SER 76 Ca -0.17 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 2cha h SER 76 Cb 0.54 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.08 2cha h SER 76 CO 0.24 0.42 0.00 -0.24 -1.14 0.00 0.00 176.83 176.11 2cha n SER 77 N -3.26 0.00 -4.87 3.07 2.88 -1.26 -5.19 113.62 104.99 2cha n SER 77 Ca 0.02 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.30 2cha n SER 77 Cb 0.66 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.10 2cha n SER 77 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2cha s GLU 78 N 0.00 2.27 -1.26 -1.46 2.02 -1.26 -5.05 118.70 113.96 2cha s GLU 78 Ca 0.00 -1.98 -0.15 0.00 0.02 0.00 0.00 54.97 52.86 2cha s GLU 78 Cb 0.00 -2.07 0.13 0.00 0.10 0.00 0.00 34.13 32.29 2cha s GLU 78 CO 0.00 -0.49 1.61 1.17 0.02 0.00 0.00 175.26 177.57 2cha n LYS 79 N -1.64 3.31 -1.37 1.61 4.81 -1.26 -4.96 118.16 118.66 2cha n LYS 79 Ca -0.02 -3.57 -0.05 0.00 -0.87 0.00 0.00 58.31 53.80 2cha n LYS 79 Cb 0.64 -3.20 0.02 0.00 0.02 0.00 0.00 35.03 32.51 2cha n LYS 79 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 2cha n ILE 80 N 5.15 0.00 -3.49 3.15 -5.35 -1.26 -4.61 119.36 112.95 2cha n ILE 80 Ca 0.42 -0.44 -0.26 0.00 -0.27 0.00 0.00 62.75 62.21 2cha n ILE 80 Cb 0.43 -0.98 -0.13 0.00 -1.74 0.00 0.00 39.64 37.22 2cha n ILE 80 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2cha s GLN 81 N -2.73 0.28 -0.63 6.28 -0.21 -0.95 -5.00 119.66 116.70 2cha s GLN 81 Ca 0.15 -0.54 -0.24 0.00 0.02 0.00 0.00 55.36 54.75 2cha s GLN 81 Cb -0.01 -1.03 0.05 0.00 1.00 0.00 0.00 33.01 33.02 2cha s GLN 81 CO 0.10 -1.05 1.01 0.15 -2.12 0.00 0.00 175.29 173.38 2cha s LYS 82 N 2.02 3.21 -0.19 2.91 1.02 -1.26 -1.31 119.74 126.15 2cha s LYS 82 Ca 0.10 -0.50 -0.05 0.00 0.02 0.00 0.00 55.97 55.54 2cha s LYS 82 Cb -0.16 -4.15 -0.03 0.00 -0.52 0.00 0.00 37.83 32.97 2cha s LYS 82 CO -0.30 -1.75 0.01 -0.51 -0.92 0.00 0.00 175.35 171.88 2cha s LEU 83 N 4.32 3.38 0.15 3.17 1.43 0.12 -5.02 118.68 126.23 2cha s LEU 83 Ca 0.28 -0.13 -0.30 0.00 -1.03 0.00 0.00 54.13 52.95 2cha s LEU 83 Cb -0.14 -1.85 -0.07 0.00 0.03 0.00 0.00 46.19 44.17 2cha s LEU 83 CO 0.15 0.11 0.99 -0.54 0.23 0.00 0.00 176.35 177.28 2cha s LYS 84 N 0.74 4.71 0.35 1.70 1.02 -1.26 -1.68 119.74 125.31 2cha s LYS 84 Ca 0.00 1.52 -0.24 0.00 0.02 0.00 0.00 55.97 57.28 2cha s LYS 84 Cb -0.14 -3.33 -0.10 0.00 -0.52 0.00 0.00 37.83 33.73 2cha s LYS 84 CO 0.02 0.25 0.92 0.42 -0.92 0.00 0.00 175.35 176.04 2cha s ILE 85 N -0.30 4.31 0.00 2.17 1.01 -1.26 -1.98 121.20 125.16 2cha s ILE 85 Ca 0.46 1.65 0.00 0.00 0.00 0.00 0.00 60.65 62.76 2cha s ILE 85 Cb -0.25 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.36 2cha s ILE 85 CO 0.31 -0.00 0.00 0.00 0.00 0.00 0.00 174.94 175.25 2cha n ALA 86 N 0.18 0.04 -3.58 9.38 0.00 -0.64 -4.76 120.51 121.14 2cha n ALA 86 Ca 0.03 -0.05 -0.23 0.00 0.00 0.00 0.00 53.44 53.19 2cha n ALA 86 Cb 0.51 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.80 2cha n ALA 86 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2cha s LYS 87 N -0.20 1.31 -0.04 0.00 2.20 -1.17 -4.85 119.74 117.00 2cha s LYS 87 Ca 0.00 -0.26 -0.30 0.00 -0.36 0.00 0.00 55.97 55.05 2cha s LYS 87 Cb 0.00 -1.19 -0.03 0.00 -1.51 0.00 0.00 37.83 35.09 2cha s LYS 87 CO 0.00 -0.06 1.16 0.08 -0.36 0.00 0.00 175.35 176.18 2cha s VAL 88 N 0.91 4.33 -0.84 4.02 1.01 -1.26 -2.95 120.40 125.63 2cha s VAL 88 Ca -0.11 1.65 0.01 0.00 0.00 0.00 0.00 61.98 63.54 2cha s VAL 88 Cb -0.15 -4.06 0.21 0.00 0.00 0.00 0.00 36.38 32.38 2cha s VAL 88 CO 0.01 0.02 0.72 0.49 0.00 0.00 0.00 175.10 176.34 2cha n PHE 89 N 4.93 3.87 -0.98 5.22 3.01 0.19 -5.00 117.46 128.70 2cha n PHE 89 Ca 0.10 -4.15 -0.30 0.00 1.01 0.00 0.00 57.45 54.11 2cha n PHE 89 Cb 0.47 -0.96 0.14 0.00 -0.01 0.00 0.00 39.48 39.12 2cha n PHE 89 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2cha s LYS 90 N -1.52 1.31 0.09 -1.08 1.02 -1.26 -0.08 119.74 118.22 2cha s LYS 90 Ca 0.28 1.20 -0.19 0.00 0.02 0.00 0.00 55.97 57.28 2cha s LYS 90 Cb -0.04 -1.79 -0.07 0.00 -0.52 0.00 0.00 37.83 35.41 2cha s LYS 90 CO -0.13 -2.31 0.58 1.21 -0.92 0.00 0.00 175.35 173.78 2cha s ASN 91 N -3.06 7.04 0.38 2.83 3.84 -1.18 -4.85 114.94 119.94 2cha s ASN 91 Ca 0.64 1.26 0.08 0.00 0.21 0.00 0.00 52.86 55.05 2cha s ASN 91 Cb -0.20 -2.36 0.74 0.00 -0.55 0.00 0.00 41.25 38.89 2cha s ASN 91 CO 0.58 0.24 1.92 0.28 -2.79 0.00 0.00 177.10 177.33 2cha h SER 92 N 4.36 0.34 -0.67 -4.21 0.02 -1.94 -2.85 113.55 108.60 2cha h SER 92 Ca -0.49 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.40 2cha h SER 92 Cb 1.21 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.66 2cha h SER 92 CO 0.64 0.43 0.00 0.29 -1.14 0.00 0.00 176.83 177.05 2cha n LYS 93 N -4.31 2.77 -1.66 3.45 4.76 -1.26 -4.97 118.16 116.94 2cha n LYS 93 Ca 0.00 -2.56 -0.42 0.00 -2.87 0.00 0.00 58.31 52.46 2cha n LYS 93 Cb 0.23 -1.52 -0.03 0.00 -1.84 0.00 0.00 35.03 31.87 2cha n LYS 93 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 2cha s TYR 94 N -1.01 1.26 -0.44 2.13 5.04 -1.08 -4.60 117.35 118.66 2cha s TYR 94 Ca 0.45 0.05 -0.14 0.00 -2.44 0.00 0.00 57.07 54.99 2cha s TYR 94 Cb 0.23 -4.09 0.06 0.00 0.35 0.00 0.00 41.96 38.51 2cha s TYR 94 CO 0.30 -4.77 0.32 1.21 -1.34 0.00 0.00 175.55 171.28 2cha s ASN 95 N 6.21 5.99 0.00 4.32 3.84 -0.96 -5.01 114.94 129.33 2cha s ASN 95 Ca 0.93 -1.22 0.03 0.00 0.21 0.00 0.00 52.86 52.80 2cha s ASN 95 Cb -0.37 -2.12 0.12 0.00 -0.55 0.00 0.00 41.25 38.33 2cha s ASN 95 CO 0.38 -0.55 0.99 -1.54 -2.79 0.00 0.00 177.10 173.59 2cha n SER 96 N 5.11 0.00 -0.03 -4.21 3.41 -1.26 0.74 113.62 117.37 2cha n SER 96 Ca -0.12 0.38 -0.04 0.00 -0.26 0.00 0.00 58.87 58.83 2cha n SER 96 Cb 0.45 -0.40 -0.04 0.00 -0.26 0.00 0.00 64.21 63.95 2cha n SER 96 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2cha n LEU 97 N -1.40 1.03 -0.04 1.04 4.77 -1.26 -4.80 117.00 116.34 2cha n LEU 97 Ca 0.01 -0.01 -0.12 0.00 -0.03 0.00 0.00 56.01 55.85 2cha n LEU 97 Cb 0.03 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.01 2cha n LEU 97 CO 0.02 0.32 0.42 0.74 -1.33 0.00 0.00 177.39 177.56 2cha h THR 98 N 0.00 1.47 -0.00 -5.08 2.02 -1.18 -3.48 112.91 106.65 2cha h THR 98 Ca -0.17 -1.84 -0.00 0.00 0.77 0.00 0.00 66.41 65.17 2cha h THR 98 Cb 1.34 2.65 -0.00 0.00 -1.74 0.00 0.00 68.15 70.40 2cha h THR 98 CO -0.00 0.45 -0.00 -0.38 0.37 0.00 0.00 175.52 175.96 2cha n ILE 99 N -4.71 0.00 -1.96 3.11 2.08 0.23 -5.04 119.36 113.05 2cha n ILE 99 Ca -0.09 0.00 -0.36 0.00 0.56 0.00 0.00 62.75 62.86 2cha n ILE 99 Cb 0.37 -0.20 0.04 0.00 -0.75 0.00 0.00 39.64 39.10 2cha n ILE 99 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 2cha s ASN 100 N -2.00 5.11 -1.31 4.38 2.47 -1.26 -3.11 114.94 119.22 2cha s ASN 100 Ca 0.00 2.44 -0.03 0.00 0.42 0.00 0.00 52.86 55.69 2cha s ASN 100 Cb 0.00 -2.60 0.01 0.00 -1.45 0.00 0.00 41.25 37.21 2cha s ASN 100 CO 0.00 -1.65 0.91 0.59 -3.72 0.00 0.00 177.10 173.23 2cha n ASN 101 N -1.60 -2.75 -4.23 -4.21 3.02 -1.26 -2.28 115.26 101.95 2cha n ASN 101 Ca 0.14 -0.71 -0.42 0.00 -0.03 0.00 0.00 54.58 53.56 2cha n ASN 101 Cb 0.49 -4.53 -0.01 0.00 -0.61 0.00 0.00 39.78 35.13 2cha n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2cha n ASP 102 N -3.04 4.36 -4.02 6.41 4.64 -1.18 -3.67 116.55 120.05 2cha n ASP 102 Ca -0.20 -2.87 -0.08 0.00 -1.38 0.00 0.00 54.79 50.26 2cha n ASP 102 Cb 0.64 -1.69 -0.10 0.00 -1.04 0.00 0.00 41.12 38.92 2cha n ASP 102 CO 0.00 0.00 0.00 -0.51 -0.82 0.00 0.00 177.20 175.87 2cha s ILE 103 N 4.22 0.16 0.05 5.18 2.07 -1.26 -4.14 121.20 127.49 2cha s ILE 103 Ca 0.52 -1.36 -0.23 0.00 -1.41 0.00 0.00 60.65 58.18 2cha s ILE 103 Cb 0.08 -0.98 0.06 0.00 0.13 0.00 0.00 42.46 41.75 2cha s ILE 103 CO 0.02 -0.75 0.54 -0.89 -1.91 0.00 0.00 174.94 171.95 2cha s THR 104 N -2.85 0.02 0.04 4.00 2.01 -0.41 -3.10 115.64 115.36 2cha s THR 104 Ca -0.03 -0.20 0.06 0.00 0.31 0.00 0.00 61.69 61.82 2cha s THR 104 Cb 0.00 -0.99 -0.02 0.00 0.01 0.00 0.00 72.50 71.50 2cha s THR 104 CO -0.06 -0.11 -0.16 -0.76 -0.69 0.00 0.00 174.62 172.84 2cha s LEU 105 N -2.03 2.18 -0.11 4.42 2.01 0.88 -0.59 118.68 125.44 2cha s LEU 105 Ca -0.05 -0.49 -0.01 0.00 0.01 0.00 0.00 54.13 53.59 2cha s LEU 105 Cb -0.01 -0.71 0.03 0.00 0.01 0.00 0.00 46.19 45.51 2cha s LEU 105 CO -0.02 0.06 -0.03 -0.76 1.01 0.00 0.00 176.35 176.61 2cha s LEU 106 N -1.21 1.03 -0.06 1.79 1.43 -0.06 -0.64 118.68 120.96 2cha s LEU 106 Ca 0.03 -0.33 -0.16 0.00 -1.03 0.00 0.00 54.13 52.65 2cha s LEU 106 Cb -0.08 -0.68 -0.05 0.00 0.03 0.00 0.00 46.19 45.41 2cha s LEU 106 CO 0.02 -0.18 0.42 -0.75 0.23 0.00 0.00 176.35 176.08 2cha s LYS 107 N 1.81 4.11 -0.07 1.70 2.20 -1.15 -1.29 119.74 127.05 2cha s LYS 107 Ca 0.04 0.38 -0.01 0.00 -0.36 0.00 0.00 55.97 56.02 2cha s LYS 107 Cb -0.13 -3.32 -0.03 0.00 -1.51 0.00 0.00 37.83 32.83 2cha s LYS 107 CO -0.07 0.45 0.01 -0.51 -0.36 0.00 0.00 175.35 174.88 2cha s LEU 108 N -0.31 3.63 0.19 5.43 1.43 -1.01 -1.62 118.68 126.42 2cha s LEU 108 Ca 0.23 0.13 -0.16 0.00 -1.03 0.00 0.00 54.13 53.31 2cha s LEU 108 Cb -0.16 -1.89 0.18 0.00 0.03 0.00 0.00 46.19 44.35 2cha s LEU 108 CO 0.11 0.36 1.62 -1.28 0.23 0.00 0.00 176.35 177.39 2cha h SER 109 N 4.94 -0.70 -3.63 2.29 0.87 -1.69 -3.36 113.55 112.26 2cha h SER 109 Ca -0.51 0.18 -0.64 0.00 -1.23 0.00 0.00 61.79 59.60 2cha h SER 109 Cb 1.19 0.41 -0.20 0.00 -0.44 0.00 0.00 62.40 63.36 2cha h SER 109 CO 0.55 -0.23 -0.84 -0.89 -0.53 0.00 0.00 176.83 174.90 2cha s THR 110 N -6.17 2.17 0.75 2.23 2.01 -1.26 -5.02 115.64 110.35 2cha s THR 110 Ca -0.14 -1.85 -0.11 0.00 0.31 0.00 0.00 61.69 59.90 2cha s THR 110 Cb 0.17 -1.97 0.04 0.00 0.01 0.00 0.00 72.50 70.76 2cha s THR 110 CO 0.72 -0.06 1.08 0.00 -0.69 0.00 0.00 174.62 175.68 2cha s ALA 111 N -1.42 2.38 0.17 7.40 0.00 -1.26 -4.85 121.76 124.19 2cha s ALA 111 Ca 0.16 0.24 -0.15 0.00 0.00 0.00 0.00 51.96 52.20 2cha s ALA 111 Cb -0.09 -3.25 -0.07 0.00 0.00 0.00 0.00 23.12 19.71 2cha s ALA 111 CO 0.07 -1.60 0.59 0.00 0.00 0.00 0.00 175.76 174.83 2cha s ALA 112 N -2.91 3.53 -0.17 0.00 0.00 0.30 -4.98 121.76 117.54 2cha s ALA 112 Ca 0.61 -0.07 -0.17 0.00 0.00 0.00 0.00 51.96 52.32 2cha s ALA 112 Cb -0.16 -2.59 -0.04 0.00 0.00 0.00 0.00 23.12 20.33 2cha s ALA 112 CO 0.55 0.43 0.44 -1.54 0.00 0.00 0.00 175.76 175.64 2cha s SER 113 N -1.77 6.56 -0.19 0.00 1.04 -1.26 -4.76 113.70 113.32 2cha s SER 113 Ca 0.40 0.66 -0.29 0.00 0.48 0.00 0.00 55.95 57.20 2cha s SER 113 Cb -0.15 -2.26 -0.01 0.00 0.10 0.00 0.00 66.02 63.70 2cha s SER 113 CO 0.20 -0.06 1.25 -0.36 0.98 0.00 0.00 173.24 175.25 2cha s PHE 114 N 1.06 2.86 0.00 5.02 0.08 -1.26 -4.78 117.98 120.96 2cha s PHE 114 Ca 0.22 1.02 0.00 0.00 0.12 0.00 0.00 56.93 58.30 2cha s PHE 114 Cb -0.15 -3.55 0.00 0.00 -0.57 0.00 0.00 43.02 38.75 2cha s PHE 114 CO 0.09 -1.60 0.00 -1.13 -0.10 0.00 0.00 175.22 172.47 2cha n SER 115 N 6.75 1.44 0.11 1.36 3.41 -0.28 -4.98 113.62 121.44 2cha n SER 115 Ca 0.14 -0.52 0.05 0.00 -0.26 0.00 0.00 58.87 58.28 2cha n SER 115 Cb 0.45 0.00 0.49 0.00 -0.26 0.00 0.00 64.21 64.89 2cha n SER 115 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2cha h GLN 116 N 0.00 0.30 0.01 4.33 7.50 -2.00 -3.37 115.11 121.88 2cha h GLN 116 Ca 0.00 -0.03 -0.40 0.00 0.50 0.00 0.00 58.65 58.72 2cha h GLN 116 Cb 0.00 -0.06 -0.06 0.00 0.05 0.00 0.00 27.48 27.41 2cha h GLN 116 CO 0.00 0.24 -2.34 0.25 -1.50 0.00 0.00 178.83 175.48 2cha n THR 117 N -4.46 1.54 -3.33 -0.54 -2.24 -1.26 -4.84 114.28 99.15 2cha n THR 117 Ca 0.00 -0.45 -0.38 0.00 -2.27 0.00 0.00 64.05 60.95 2cha n THR 117 Cb 0.11 -1.71 -0.06 0.00 -2.10 0.00 0.00 70.33 66.58 2cha n THR 117 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2cha s VAL 118 N -2.50 4.97 -0.02 2.28 1.01 -1.25 -4.14 120.40 120.74 2cha s VAL 118 Ca -0.35 1.05 -0.19 0.00 0.00 0.00 0.00 61.98 62.49 2cha s VAL 118 Cb 0.11 -3.83 0.06 0.00 0.00 0.00 0.00 36.38 32.72 2cha s VAL 118 CO 0.57 0.48 0.87 -1.20 0.00 0.00 0.00 175.10 175.81 2cha n SER 119 N 2.44 -0.81 -4.68 3.32 7.64 -0.42 -1.13 113.62 119.98 2cha n SER 119 Ca -0.10 -1.17 -0.31 0.00 1.01 0.00 0.00 58.87 58.30 2cha n SER 119 Cb 0.51 1.25 -0.08 0.00 -1.01 0.00 0.00 64.21 64.88 2cha n SER 119 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2cha s ALA 120 N -1.68 3.29 0.28 -0.43 0.00 -1.26 -0.23 121.76 121.72 2cha s ALA 120 Ca 0.20 -1.05 -0.29 0.00 0.00 0.00 0.00 51.96 50.83 2cha s ALA 120 Cb -0.01 -1.25 -0.09 0.00 0.00 0.00 0.00 23.12 21.77 2cha s ALA 120 CO -0.00 0.68 0.97 0.54 0.00 0.00 0.00 175.76 177.95 2cha s VAL 121 N -1.22 4.00 0.59 0.00 0.11 0.56 -4.90 120.40 119.54 2cha s VAL 121 Ca 0.23 1.89 -0.13 0.00 -2.93 0.00 0.00 61.98 61.04 2cha s VAL 121 Cb -0.12 -4.16 -0.05 0.00 -1.53 0.00 0.00 36.38 30.53 2cha s VAL 121 CO 0.15 0.36 1.02 0.00 -3.33 0.00 0.00 175.10 173.30 2cha s LEU 123 N -4.78 4.23 0.00 0.00 1.43 -1.26 -5.12 118.68 113.18 2cha s LEU 123 Ca 0.57 0.38 0.00 0.00 -1.03 0.00 0.00 54.13 54.05 2cha s LEU 123 Cb -0.11 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 44.08 2cha s LEU 123 CO 0.45 0.37 0.00 -0.81 0.23 0.00 0.00 176.35 176.59 2cha n PRO 124 N 2.25 0.27 -4.17 1.29 -0.04 -1.26 -5.11 135.00 128.23 2cha n PRO 124 Ca -0.19 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.13 2cha n PRO 124 Cb 0.54 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.90 2cha n PRO 124 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2cha s SER 125 N -1.40 1.37 0.22 3.54 0.01 -1.26 -5.00 113.70 111.17 2cha s SER 125 Ca 0.00 -0.85 0.18 0.00 1.31 0.00 0.00 55.95 56.59 2cha s SER 125 Cb 0.00 0.03 0.86 0.00 0.21 0.00 0.00 66.02 67.12 2cha s SER 125 CO 0.00 -0.30 1.54 0.00 0.41 0.00 0.00 173.24 174.89 2cha n ALA 126 N 0.45 1.27 -0.02 1.44 0.00 -1.26 -3.49 120.51 118.90 2cha n ALA 126 Ca -0.15 0.11 -0.16 0.00 0.00 0.00 0.00 53.44 53.23 2cha n ALA 126 Cb 0.58 -1.27 -0.06 0.00 0.00 0.00 0.00 19.45 18.70 2cha n ALA 126 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2cha h SER 127 N 0.00 0.90 -3.94 0.00 4.64 -2.05 -3.46 113.55 109.64 2cha h SER 127 Ca 0.00 -0.59 -0.47 0.00 -0.47 0.00 0.00 61.79 60.26 2cha h SER 127 Cb 0.13 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 2cha h SER 127 CO 0.00 1.38 0.25 1.51 -0.87 0.00 0.00 176.83 179.10 2cha s ASP 128 N -7.09 6.74 -0.14 4.97 3.84 -1.23 -5.10 116.67 118.66 2cha s ASP 128 Ca -0.10 1.45 -0.03 0.00 -0.00 0.00 0.00 52.55 53.88 2cha s ASP 128 Cb 0.09 -2.45 -0.03 0.00 -1.38 0.00 0.00 42.92 39.15 2cha s ASP 128 CO 0.90 -0.38 -0.06 -0.62 -0.00 0.00 0.00 175.17 175.01 2cha s ASP 129 N -2.60 4.66 -0.56 2.11 2.15 -1.26 -4.88 116.67 116.30 2cha s ASP 129 Ca 0.57 -0.14 0.01 0.00 0.43 0.00 0.00 52.55 53.43 2cha s ASP 129 Cb -0.10 -1.68 0.14 0.00 -0.30 0.00 0.00 42.92 40.99 2cha s ASP 129 CO 0.22 0.20 0.33 -0.36 -0.17 0.00 0.00 175.17 175.38 2cha s PHE 130 N 0.19 3.28 0.71 -5.34 0.40 -1.26 -5.09 117.98 110.86 2cha s PHE 130 Ca -0.03 -3.00 -0.15 0.00 -0.60 0.00 0.00 56.93 53.15 2cha s PHE 130 Cb -0.14 -2.97 0.03 0.00 0.51 0.00 0.00 43.02 40.45 2cha s PHE 130 CO 0.03 -0.78 1.16 0.00 0.70 0.00 0.00 175.22 176.33 2cha s ALA 131 N -0.19 2.25 0.68 5.36 0.00 -1.26 -5.04 121.76 123.57 2cha s ALA 131 Ca 0.17 0.70 -0.17 0.00 0.00 0.00 0.00 51.96 52.66 2cha s ALA 131 Cb -0.24 -3.40 0.01 0.00 0.00 0.00 0.00 23.12 19.50 2cha s ALA 131 CO -0.01 -1.64 1.25 0.00 0.00 0.00 0.00 175.76 175.36 2cha s ALA 132 N -2.19 2.27 0.00 0.00 0.00 -1.26 -2.57 121.76 118.01 2cha s ALA 132 Ca 0.70 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.73 2cha s ALA 132 Cb -0.25 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2cha s ALA 132 CO 0.44 -1.70 0.00 0.41 0.00 0.00 0.00 175.76 174.92 2cha n GLY 133 N 0.68 2.32 3.77 0.00 0.00 -1.26 -5.02 105.19 105.69 2cha n GLY 133 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 2cha n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cha s THR 134 N -2.44 2.18 -0.33 2.61 2.01 -1.06 -4.95 115.64 113.66 2cha s THR 134 Ca 0.00 0.17 -0.21 0.00 0.31 0.00 0.00 61.69 61.97 2cha s THR 134 Cb 0.00 -3.11 -0.00 0.00 0.01 0.00 0.00 72.50 69.40 2cha s THR 134 CO 0.00 0.04 0.65 -0.89 -0.69 0.00 0.00 174.62 173.73 2cha s THR 135 N -1.15 4.89 0.45 -0.82 2.01 -1.26 -5.05 115.64 114.72 2cha s THR 135 Ca 0.54 0.76 0.03 0.00 0.31 0.00 0.00 61.69 63.33 2cha s THR 135 Cb -0.45 -4.06 -0.03 0.00 0.01 0.00 0.00 72.50 67.98 2cha s THR 135 CO 0.60 -0.24 0.05 0.00 -0.69 0.00 0.00 174.62 174.33 2cha s VAL 137 N -2.99 1.82 -0.08 0.00 1.01 -1.26 -5.16 120.40 113.74 2cha s VAL 137 Ca 0.17 -2.20 -0.07 0.00 0.00 0.00 0.00 61.98 59.88 2cha s VAL 137 Cb 0.04 -2.27 0.02 0.00 0.00 0.00 0.00 36.38 34.17 2cha s VAL 137 CO 0.09 -0.44 0.20 0.28 0.00 0.00 0.00 175.10 175.24 2cha s THR 138 N -2.91 -0.01 0.33 3.92 -1.32 -1.26 -5.17 115.64 109.22 2cha s THR 138 Ca 0.27 0.02 0.05 0.00 -1.21 0.00 0.00 61.69 60.82 2cha s THR 138 Cb 0.01 -0.29 -0.07 0.00 -1.51 0.00 0.00 72.50 70.64 2cha s THR 138 CO 0.10 0.01 0.02 0.42 -2.21 0.00 0.00 174.62 172.96 2cha s THR 139 N 0.27 1.46 0.00 5.08 -4.23 -1.26 -5.08 115.64 111.88 2cha s THR 139 Ca -0.01 -2.03 0.00 0.00 -1.18 0.00 0.00 61.69 58.47 2cha s THR 139 Cb -0.03 -2.76 0.00 0.00 1.34 0.00 0.00 72.50 71.05 2cha s THR 139 CO -0.01 -0.07 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 2cha n GLY 140 N -0.72 2.47 1.55 3.99 0.00 -1.26 -4.95 105.19 106.27 2cha n GLY 140 Ca -0.04 -1.63 0.05 0.00 0.00 0.00 0.00 46.02 44.41 2cha n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2cha n TRP 141 N -1.77 1.73 -0.90 1.61 8.01 -1.26 -4.53 117.44 120.33 2cha n TRP 141 Ca 0.00 -0.87 -0.30 0.00 -1.31 0.00 0.00 57.50 55.02 2cha n TRP 141 Cb 0.00 -0.47 0.24 0.00 -2.01 0.00 0.00 31.31 29.06 2cha n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 2cha s GLY 142 N -1.27 1.54 0.01 6.99 0.00 -1.26 -4.82 107.32 108.51 2cha s GLY 142 Ca 0.50 -0.70 -0.30 0.00 0.00 0.00 0.00 44.72 44.22 2cha s GLY 142 CO 0.13 0.13 1.34 1.08 0.00 0.00 0.00 173.10 175.78 2cha s LEU 143 N -7.05 4.32 0.42 0.66 1.43 -1.26 -0.91 118.68 116.29 2cha s LEU 143 Ca 0.69 2.06 0.22 0.00 -1.03 0.00 0.00 54.13 56.07 2cha s LEU 143 Cb -0.14 -3.56 0.87 0.00 0.03 0.00 0.00 46.19 43.38 2cha s LEU 143 CO 0.58 -0.66 1.81 0.71 0.23 0.00 0.00 176.35 179.02 2cha h THR 144 N 4.83 0.68 -4.00 5.49 1.35 -1.90 -1.29 112.91 118.07 2cha h THR 144 Ca -0.38 -1.22 -0.37 0.00 -0.55 0.00 0.00 66.41 63.89 2cha h THR 144 Cb 1.18 1.79 -0.25 0.00 -1.73 0.00 0.00 68.15 69.14 2cha h THR 144 CO 0.88 0.26 -0.77 -0.13 -0.25 0.00 0.00 175.52 175.52 2cha s ARG 145 N -3.68 0.72 0.00 4.72 0.52 -1.26 -4.08 118.95 115.88 2cha s ARG 145 Ca 0.00 -0.60 0.00 0.00 -0.52 0.00 0.00 55.73 54.61 2cha s ARG 145 Cb 0.11 -0.66 0.00 0.00 0.52 0.00 0.00 34.95 34.92 2cha s ARG 145 CO 0.65 0.16 0.50 0.98 0.02 0.00 0.00 175.30 177.61