#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ghz s VAL 17 N 0.00 3.52 -0.81 1.39 1.01 0.16 -3.92 120.40 121.75 1ghz s VAL 17 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.48 1ghz s VAL 17 Cb 0.00 -2.50 0.00 0.00 0.00 0.00 0.00 36.38 33.88 1ghz s VAL 17 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1ghz n GLY 18 N 3.35 0.26 0.00 4.51 0.00 -1.24 -1.56 105.19 110.51 1ghz n GLY 18 Ca -0.18 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1ghz n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ghz n GLY 19 N -1.23 3.24 3.22 -0.02 0.00 -1.26 -4.86 105.19 104.29 1ghz n GLY 19 Ca -0.10 -2.09 -0.12 0.00 0.00 0.00 0.00 46.02 43.71 1ghz n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ghz s TYR 20 N 1.14 1.12 -0.08 1.61 -0.85 0.42 -4.92 117.35 115.80 1ghz s TYR 20 Ca 0.00 -1.12 -0.30 0.00 -0.52 0.00 0.00 57.07 55.13 1ghz s TYR 20 Cb 0.00 -0.64 -0.04 0.00 0.38 0.00 0.00 41.96 41.66 1ghz s TYR 20 CO 0.00 -0.34 1.45 0.99 -1.52 0.00 0.00 175.55 176.13 1ghz s THR 21 N -3.82 3.86 0.12 -3.49 2.01 -1.26 -0.20 115.64 112.86 1ghz s THR 21 Ca 0.26 1.10 -0.23 0.00 0.31 0.00 0.00 61.69 63.13 1ghz s THR 21 Cb 0.07 -3.71 -0.07 0.00 0.01 0.00 0.00 72.50 68.80 1ghz s THR 21 CO 0.05 -0.07 1.68 0.00 -0.69 0.00 0.00 174.62 175.58 1ghz n GLY 23 N -1.26 3.37 3.67 0.00 0.00 -1.26 -4.85 105.19 104.85 1ghz n GLY 23 Ca -0.05 -1.69 -0.48 0.00 0.00 0.00 0.00 46.02 43.81 1ghz n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ghz n ALA 24 N -0.58 1.00 -3.67 4.61 0.00 -1.26 -2.71 120.51 117.90 1ghz n ALA 24 Ca 0.00 0.39 -0.28 0.00 0.00 0.00 0.00 53.44 53.55 1ghz n ALA 24 Cb 0.00 -2.39 -0.01 0.00 0.00 0.00 0.00 19.45 17.06 1ghz n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ghz n ASN 25 N 4.60 -3.69 -0.06 0.00 4.13 -1.26 -4.86 115.26 114.12 1ghz n ASN 25 Ca 0.19 -0.60 0.12 0.00 1.68 0.00 0.00 54.58 55.97 1ghz n ASN 25 Cb 0.28 -3.03 0.22 0.00 -1.54 0.00 0.00 39.78 35.71 1ghz n ASN 25 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1ghz n THR 26 N -4.13 0.00 -3.56 3.41 -2.24 -1.10 -4.19 114.28 102.48 1ghz n THR 26 Ca 0.02 -0.03 -0.27 0.00 -2.27 0.00 0.00 64.05 61.50 1ghz n THR 26 Cb 0.52 0.40 -0.09 0.00 -2.10 0.00 0.00 70.33 69.06 1ghz n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1ghz n VAL 27 N -1.30 1.56 0.32 2.28 0.31 -1.26 -4.97 118.33 115.27 1ghz n VAL 27 Ca 0.07 -4.86 0.15 0.00 -0.01 0.00 0.00 64.34 59.68 1ghz n VAL 27 Cb 0.34 -2.08 0.64 0.00 -0.91 0.00 0.00 33.84 31.83 1ghz n VAL 27 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1ghz h PRO 28 N 4.66 0.00 -0.01 5.55 0.13 -1.81 -2.32 132.00 138.20 1ghz h PRO 28 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1ghz h PRO 28 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1ghz h PRO 28 CO 0.73 0.00 -0.14 2.48 -0.23 0.00 0.00 178.00 180.84 1ghz n TYR 29 N -2.58 0.00 -2.60 1.56 0.18 -1.17 -2.28 117.16 110.27 1ghz n TYR 29 Ca 0.01 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.37 1ghz n TYR 29 Cb 0.21 -0.05 -0.04 0.00 -0.38 0.00 0.00 39.34 39.08 1ghz n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1ghz s GLN 30 N -2.24 4.61 0.19 -3.48 2.00 -0.88 -1.00 119.66 118.87 1ghz s GLN 30 Ca 0.30 1.60 0.08 0.00 -2.00 0.00 0.00 55.36 55.34 1ghz s GLN 30 Cb 0.20 -3.34 -0.05 0.00 0.80 0.00 0.00 33.01 30.63 1ghz s GLN 30 CO 0.42 0.08 -0.16 0.14 -0.50 0.00 0.00 175.29 175.28 1ghz s VAL 31 N 0.11 1.77 -0.10 1.34 -7.23 -0.30 -4.50 120.40 111.50 1ghz s VAL 31 Ca 0.50 -2.12 0.03 0.00 -1.81 0.00 0.00 61.98 58.57 1ghz s VAL 31 Cb -0.26 -1.98 -0.01 0.00 0.56 0.00 0.00 36.38 34.69 1ghz s VAL 31 CO 0.32 -0.51 -0.18 -0.55 -0.31 0.00 0.00 175.10 173.86 1ghz s SER 32 N -3.12 3.58 -0.19 4.85 0.15 -0.63 -1.98 113.70 116.36 1ghz s SER 32 Ca 0.20 -0.42 -0.10 0.00 0.70 0.00 0.00 55.95 56.34 1ghz s SER 32 Cb -0.02 -1.35 -0.05 0.00 -1.71 0.00 0.00 66.02 62.89 1ghz s SER 32 CO 0.07 0.19 0.14 -0.76 1.20 0.00 0.00 173.24 174.08 1ghz s LEU 33 N 0.16 4.23 -0.04 3.45 1.43 -0.02 -0.74 118.68 127.15 1ghz s LEU 33 Ca -0.10 0.27 0.03 0.00 -1.03 0.00 0.00 54.13 53.30 1ghz s LEU 33 Cb -0.16 -2.10 0.00 0.00 0.03 0.00 0.00 46.19 43.96 1ghz s LEU 33 CO 0.06 0.20 -0.14 0.21 0.23 0.00 0.00 176.35 176.91 1ghz s ASN 34 N 0.23 1.82 -0.34 2.29 3.84 -0.03 -1.96 114.94 120.78 1ghz s ASN 34 Ca 0.09 -0.30 0.13 0.00 0.21 0.00 0.00 52.86 52.99 1ghz s ASN 34 Cb -0.11 -0.58 0.46 0.00 -0.55 0.00 0.00 41.25 40.46 1ghz s ASN 34 CO -0.01 0.10 1.07 -1.54 -2.79 0.00 0.00 177.10 173.93 1ghz n SER 37 N 3.34 3.11 0.00 -4.21 3.41 -1.26 -1.55 113.62 116.46 1ghz n SER 37 Ca -0.19 -3.08 0.00 0.00 -0.26 0.00 0.00 58.87 55.33 1ghz n SER 37 Cb 0.53 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 1ghz n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ghz n GLY 38 N -0.41 0.44 3.55 5.00 0.00 -1.26 -5.00 105.19 107.50 1ghz n GLY 38 Ca 0.24 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.19 1ghz n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ghz s TYR 39 N -2.00 -0.27 0.05 1.61 1.13 -1.26 -5.14 117.35 111.47 1ghz s TYR 39 Ca 0.00 0.14 -0.30 0.00 -1.41 0.00 0.00 57.07 55.50 1ghz s TYR 39 Cb 0.00 0.54 -0.05 0.00 -1.10 0.00 0.00 41.96 41.35 1ghz s TYR 39 CO 0.00 -0.48 1.09 -1.58 -2.51 0.00 0.00 175.55 172.08 1ghz s HIS 40 N -2.95 3.56 0.00 -3.49 5.65 -1.26 -4.23 115.29 112.56 1ghz s HIS 40 Ca 0.07 1.51 0.00 0.00 0.25 0.00 0.00 55.06 56.89 1ghz s HIS 40 Cb -0.01 -3.27 0.00 0.00 -1.18 0.00 0.00 32.58 28.12 1ghz s HIS 40 CO -0.07 -0.66 0.00 1.97 -0.65 0.00 0.00 174.74 175.33 1ghz n PHE 41 N 3.68 0.00 -3.58 3.88 1.16 -0.83 -4.97 117.46 116.80 1ghz n PHE 41 Ca 0.07 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.56 1ghz n PHE 41 Cb 0.48 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.33 1ghz n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1ghz s GLY 43 N -2.76 1.94 0.14 0.00 0.00 0.21 -0.84 107.32 106.01 1ghz s GLY 43 Ca 0.05 -1.86 -0.25 0.00 0.00 0.00 0.00 44.72 42.66 1ghz s GLY 43 CO -0.06 -1.71 1.03 -0.32 0.00 0.00 0.00 173.10 172.04 1ghz s GLY 44 N -4.48 -0.13 -0.02 0.20 0.00 -0.84 -3.75 107.32 98.30 1ghz s GLY 44 Ca 0.54 0.03 0.04 0.00 0.00 0.00 0.00 44.72 45.32 1ghz s GLY 44 CO 0.33 0.92 -0.13 -0.56 0.00 0.00 0.00 173.10 173.66 1ghz s SER 45 N -3.12 1.65 -0.17 1.64 0.01 -0.28 -1.14 113.70 112.28 1ghz s SER 45 Ca 0.16 -0.26 -0.26 0.00 1.31 0.00 0.00 55.95 56.91 1ghz s SER 45 Cb -0.01 -0.33 -0.01 0.00 0.21 0.00 0.00 66.02 65.87 1ghz s SER 45 CO 0.03 0.13 0.85 -0.22 0.41 0.00 0.00 173.24 174.44 1ghz s LEU 46 N -0.07 4.18 -0.01 2.44 2.96 -0.17 -1.05 118.68 126.96 1ghz s LEU 46 Ca 0.00 1.20 0.16 0.00 -0.22 0.00 0.00 54.13 55.27 1ghz s LEU 46 Cb -0.08 -3.26 -0.21 0.00 0.50 0.00 0.00 46.19 43.15 1ghz s LEU 46 CO 0.00 -0.41 0.52 2.30 -1.32 0.00 0.00 176.35 177.44 1ghz n ILE 47 N 4.74 0.00 -3.69 6.68 -5.35 -0.56 -1.10 119.36 120.09 1ghz n ILE 47 Ca 0.05 -0.24 -0.01 0.00 -0.27 0.00 0.00 62.75 62.28 1ghz n ILE 47 Cb 0.49 0.60 -0.01 0.00 -1.74 0.00 0.00 39.64 38.97 1ghz n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1ghz s ASN 48 N -3.11 -0.12 0.61 7.28 6.03 -1.22 -4.54 114.94 119.87 1ghz s ASN 48 Ca 0.00 -0.27 0.29 0.00 -1.03 0.00 0.00 52.86 51.86 1ghz s ASN 48 Cb 0.11 0.32 1.53 0.00 -3.03 0.00 0.00 41.25 40.19 1ghz s ASN 48 CO 0.65 -0.60 1.93 0.77 -2.03 0.00 0.00 177.10 177.82 1ghz h SER 49 N 2.00 0.00 -0.01 3.54 4.64 -1.96 -2.86 113.55 118.91 1ghz h SER 49 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1ghz h SER 49 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1ghz h SER 49 CO 0.27 0.00 -0.22 0.00 -0.87 0.00 0.00 176.83 176.01 1ghz n GLN 50 N -3.52 2.15 -4.18 4.77 6.02 -1.26 -0.62 117.38 120.74 1ghz n GLN 50 Ca 0.05 -0.58 -0.16 0.00 -0.01 0.00 0.00 57.00 56.29 1ghz n GLN 50 Cb 0.55 -1.08 -0.12 0.00 1.02 0.00 0.00 30.24 30.61 1ghz n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1ghz s TRP 51 N -1.38 0.91 0.04 1.08 0.52 -1.08 -1.25 118.94 117.78 1ghz s TRP 51 Ca 0.08 -0.39 0.06 0.00 0.02 0.00 0.00 56.10 55.86 1ghz s TRP 51 Cb 0.08 -0.54 -0.02 0.00 -1.15 0.00 0.00 33.47 31.84 1ghz s TRP 51 CO 0.26 -0.01 -0.16 0.08 0.02 0.00 0.00 176.95 177.13 1ghz s VAL 52 N -1.04 1.29 -0.05 4.03 1.01 -0.27 -1.49 120.40 123.89 1ghz s VAL 52 Ca -0.03 -1.05 0.05 0.00 0.00 0.00 0.00 61.98 60.95 1ghz s VAL 52 Cb -0.08 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 35.13 1ghz s VAL 52 CO 0.01 0.08 -0.19 0.54 0.00 0.00 0.00 175.10 175.54 1ghz s VAL 53 N -0.81 2.62 0.00 2.92 0.11 -0.21 -0.80 120.40 124.22 1ghz s VAL 53 Ca 0.04 -0.88 0.00 0.00 -2.93 0.00 0.00 61.98 58.20 1ghz s VAL 53 Cb -0.08 -1.99 0.00 0.00 -1.53 0.00 0.00 36.38 32.78 1ghz s VAL 53 CO 0.01 0.58 0.00 -0.24 -3.33 0.00 0.00 175.10 172.12 1ghz n SER 54 N 2.50 0.00 -4.88 3.54 2.88 -0.20 -1.13 113.62 116.34 1ghz n SER 54 Ca -0.17 -0.60 -0.34 0.00 -1.33 0.00 0.00 58.87 56.43 1ghz n SER 54 Cb 0.52 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 1ghz n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ghz s ALA 55 N -1.65 3.82 0.40 -1.46 0.00 -1.26 -1.21 121.76 120.40 1ghz s ALA 55 Ca 0.00 -0.54 0.10 0.00 0.00 0.00 0.00 51.96 51.52 1ghz s ALA 55 Cb 0.00 -2.11 0.84 0.00 0.00 0.00 0.00 23.12 21.85 1ghz s ALA 55 CO 0.00 0.63 1.95 0.00 0.00 0.00 0.00 175.76 178.34 1ghz h ALA 56 N 3.87 1.57 0.00 0.00 0.00 -1.70 -1.45 119.26 121.55 1ghz h ALA 56 Ca -0.50 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1ghz h ALA 56 Cb 1.19 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1ghz h ALA 56 CO 0.67 0.31 0.00 -2.39 0.00 0.00 0.00 179.25 177.84 1ghz n HIS 57 N -4.32 0.00 0.82 0.00 1.44 -1.26 -1.40 115.22 110.50 1ghz n HIS 57 Ca -0.01 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.82 1ghz n HIS 57 Cb 0.23 -0.17 0.27 0.00 0.12 0.00 0.00 29.99 30.44 1ghz n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1ghz n TYR 59 N 1.01 2.87 -3.74 0.00 4.19 -0.50 -4.98 117.16 116.02 1ghz n TYR 59 Ca 0.17 0.18 -0.10 0.00 3.31 0.00 0.00 57.90 61.46 1ghz n TYR 59 Cb 0.50 -2.63 -0.04 0.00 0.49 0.00 0.00 39.34 37.67 1ghz n TYR 59 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 1ghz s LYS 60 N 0.00 1.37 0.05 2.98 1.02 -1.26 -5.14 119.74 118.76 1ghz s LYS 60 Ca 0.67 -0.86 0.01 0.00 0.02 0.00 0.00 55.97 55.81 1ghz s LYS 60 Cb -0.49 0.52 -0.04 0.00 -0.52 0.00 0.00 37.83 37.30 1ghz s LYS 60 CO 0.43 -0.58 0.14 -1.12 -0.92 0.00 0.00 175.35 173.31 1ghz s SER 61 N -2.87 5.97 -0.28 2.83 0.01 -1.26 -4.65 113.70 113.45 1ghz s SER 61 Ca 0.09 0.16 -0.01 0.00 1.31 0.00 0.00 55.95 57.50 1ghz s SER 61 Cb -0.01 -1.75 -0.01 0.00 0.21 0.00 0.00 66.02 64.46 1ghz s SER 61 CO -0.03 0.19 0.24 0.61 0.41 0.00 0.00 173.24 174.66 1ghz n GLY 62 N 0.51 0.32 3.72 3.44 0.00 -1.26 -5.05 105.19 106.86 1ghz n GLY 62 Ca -0.08 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.40 1ghz n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ghz s ILE 63 N -3.10 4.68 -0.09 -0.61 1.01 -1.26 -4.52 121.20 117.31 1ghz s ILE 63 Ca 0.06 -0.10 0.04 0.00 0.00 0.00 0.00 60.65 60.65 1ghz s ILE 63 Cb -0.01 -3.01 -0.01 0.00 0.01 0.00 0.00 42.46 39.45 1ghz s ILE 63 CO 0.19 0.59 -0.23 -1.58 0.00 0.00 0.00 174.94 173.90 1ghz s GLN 64 N -0.72 2.92 -0.14 2.79 0.74 -0.60 -2.07 119.66 122.57 1ghz s GLN 64 Ca 0.12 -0.87 -0.13 0.00 0.05 0.00 0.00 55.36 54.53 1ghz s GLN 64 Cb -0.12 -2.29 -0.05 0.00 1.10 0.00 0.00 33.01 31.66 1ghz s GLN 64 CO 0.02 0.25 0.27 0.08 -0.55 0.00 0.00 175.29 175.37 1ghz s VAL 65 N 0.16 5.31 -0.21 1.34 1.01 0.88 -0.86 120.40 128.03 1ghz s VAL 65 Ca -0.13 0.51 0.02 0.00 0.00 0.00 0.00 61.98 62.38 1ghz s VAL 65 Cb -0.16 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.65 1ghz s VAL 65 CO 0.07 0.44 -0.15 -0.13 0.00 0.00 0.00 175.10 175.32 1ghz s ARG 66 N 0.12 2.58 0.20 2.72 0.52 0.09 -0.64 118.95 124.54 1ghz s ARG 66 Ca 0.16 -0.99 0.06 0.00 -0.52 0.00 0.00 55.73 54.44 1ghz s ARG 66 Cb -0.13 -2.63 -0.04 0.00 0.52 0.00 0.00 34.95 32.67 1ghz s ARG 66 CO 0.04 -0.36 0.19 -0.51 0.02 0.00 0.00 175.30 174.68 1ghz s LEU 67 N 1.25 3.89 -1.33 2.53 1.02 0.18 -1.60 118.68 124.62 1ghz s LEU 67 Ca -0.00 -0.14 0.00 0.00 0.02 0.00 0.00 54.13 54.01 1ghz s LEU 67 Cb -0.16 -2.46 0.00 0.00 0.02 0.00 0.00 46.19 43.59 1ghz s LEU 67 CO -0.10 0.02 0.00 0.61 0.02 0.00 0.00 176.35 176.90 1ghz n GLY 69 N -0.76 0.30 3.87 -3.19 0.00 -1.26 -1.12 105.19 103.04 1ghz n GLY 69 Ca -0.08 -0.30 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 1ghz n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ghz s GLU 70 N -4.26 3.81 0.00 1.61 0.41 -1.26 -3.72 118.70 115.29 1ghz s GLU 70 Ca 0.00 0.32 0.00 0.00 -0.41 0.00 0.00 54.97 54.88 1ghz s GLU 70 Cb 0.00 -2.60 0.00 0.00 -1.78 0.00 0.00 34.13 29.75 1ghz s GLU 70 CO 0.00 0.27 0.00 -3.47 -0.49 0.00 0.00 175.26 171.57 1ghz n ASP 71 N -0.30 0.00 -4.65 -0.19 2.03 -1.26 -4.56 116.55 107.61 1ghz n ASP 71 Ca 0.01 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.89 1ghz n ASP 71 Cb 0.53 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.91 1ghz n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1ghz s ASN 72 N 1.00 7.00 0.00 1.67 3.84 -1.25 -3.48 114.94 123.72 1ghz s ASN 72 Ca 0.00 1.34 0.31 0.00 0.21 0.00 0.00 52.86 54.72 1ghz s ASN 72 Cb 0.00 -2.54 1.67 0.00 -0.55 0.00 0.00 41.25 39.83 1ghz s ASN 72 CO 0.00 -0.76 2.11 2.30 -2.79 0.00 0.00 177.10 177.96 1ghz n ILE 73 N 5.52 0.01 0.48 -5.21 -5.35 0.43 -3.19 119.36 112.04 1ghz n ILE 73 Ca 0.13 0.00 0.08 0.00 -0.27 0.00 0.00 62.75 62.68 1ghz n ILE 73 Cb 0.46 -0.51 0.09 0.00 -1.74 0.00 0.00 39.64 37.94 1ghz n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1ghz n ASN 74 N -1.17 2.44 -3.94 7.28 3.02 -1.26 -4.95 115.26 116.68 1ghz n ASN 74 Ca 0.18 -1.70 -0.20 0.00 -0.03 0.00 0.00 54.58 52.84 1ghz n ASN 74 Cb 0.19 -0.05 -0.16 0.00 -0.61 0.00 0.00 39.78 39.14 1ghz n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ghz s VAL 75 N -1.22 0.62 -0.49 2.41 1.01 -1.19 -5.09 120.40 116.45 1ghz s VAL 75 Ca 0.20 -0.22 -0.25 0.00 0.00 0.00 0.00 61.98 61.71 1ghz s VAL 75 Cb 0.13 -0.60 0.03 0.00 0.00 0.00 0.00 36.38 35.94 1ghz s VAL 75 CO 0.19 0.23 0.95 -0.69 0.00 0.00 0.00 175.10 175.78 1ghz s VAL 76 N 0.57 4.41 -1.60 2.92 1.01 -1.26 -4.69 120.40 121.76 1ghz s VAL 76 Ca -0.08 0.66 0.24 0.00 0.00 0.00 0.00 61.98 62.80 1ghz s VAL 76 Cb -0.12 -4.48 0.04 0.00 0.00 0.00 0.00 36.38 31.82 1ghz s VAL 76 CO 0.01 -0.94 1.25 -0.62 0.00 0.00 0.00 175.10 174.80 1ghz n GLU 77 N 7.34 0.69 0.00 2.72 1.02 -1.26 -4.98 120.64 126.16 1ghz n GLU 77 Ca 0.05 -0.50 0.00 0.00 -0.02 0.00 0.00 57.16 56.69 1ghz n GLU 77 Cb 0.48 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 1ghz n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ghz n GLY 78 N 1.42 2.43 0.95 0.62 0.00 -1.26 -4.97 105.19 104.38 1ghz n GLY 78 Ca 0.09 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.18 1ghz n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ghz n ASN 79 N 0.00 3.60 -4.88 1.61 5.03 -1.26 -5.02 115.26 114.35 1ghz n ASN 79 Ca 0.00 -2.31 -0.30 0.00 0.87 0.00 0.00 54.58 52.84 1ghz n ASN 79 Cb 0.00 -0.39 -0.03 0.00 -1.02 0.00 0.00 39.78 38.34 1ghz n ASN 79 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1ghz s GLU 80 N -1.57 3.76 -0.05 3.52 8.01 -1.24 -4.20 118.70 126.92 1ghz s GLU 80 Ca 0.35 0.50 -0.00 0.00 0.01 0.00 0.00 54.97 55.84 1ghz s GLU 80 Cb 0.22 -2.34 0.03 0.00 -4.31 0.00 0.00 34.13 27.73 1ghz s GLU 80 CO 0.18 -0.12 -0.01 -0.65 0.01 0.00 0.00 175.26 174.67 1ghz s GLN 81 N -4.07 0.54 -0.27 1.61 -0.21 -0.28 -4.95 119.66 112.02 1ghz s GLN 81 Ca 0.52 0.05 -0.02 0.00 0.02 0.00 0.00 55.36 55.93 1ghz s GLN 81 Cb -0.10 -0.75 0.03 0.00 1.00 0.00 0.00 33.01 33.19 1ghz s GLN 81 CO 0.34 -0.18 -0.03 -0.06 -2.12 0.00 0.00 175.29 173.24 1ghz s PHE 82 N 1.36 3.13 -0.03 0.91 2.99 -1.26 -0.65 117.98 124.43 1ghz s PHE 82 Ca -0.05 -1.59 0.03 0.00 0.00 0.00 0.00 56.93 55.32 1ghz s PHE 82 Cb -0.13 -2.09 0.00 0.00 0.00 0.00 0.00 43.02 40.80 1ghz s PHE 82 CO -0.02 -0.74 -0.13 0.42 -0.00 0.00 0.00 175.22 174.75 1ghz s ILE 83 N 1.32 1.10 0.53 0.64 1.01 0.19 -4.95 121.20 121.04 1ghz s ILE 83 Ca -0.01 -0.54 -0.16 0.00 0.00 0.00 0.00 60.65 59.94 1ghz s ILE 83 Cb -0.18 -0.96 -0.07 0.00 0.01 0.00 0.00 42.46 41.27 1ghz s ILE 83 CO -0.03 0.33 1.00 -0.44 0.00 0.00 0.00 174.94 175.80 1ghz s SER 84 N 0.11 6.41 0.23 3.58 0.01 -1.26 -0.09 113.70 122.70 1ghz s SER 84 Ca -0.03 1.64 -0.21 0.00 1.31 0.00 0.00 55.95 58.65 1ghz s SER 84 Cb -0.10 -2.52 -0.08 0.00 0.21 0.00 0.00 66.02 63.53 1ghz s SER 84 CO 0.01 -0.73 0.76 0.00 0.41 0.00 0.00 173.24 173.69 1ghz s ALA 85 N -2.57 3.39 -0.19 1.44 0.00 -0.88 -0.41 121.76 122.54 1ghz s ALA 85 Ca 0.60 0.24 0.18 0.00 0.00 0.00 0.00 51.96 52.99 1ghz s ALA 85 Cb -0.11 -2.89 -0.25 0.00 0.00 0.00 0.00 23.12 19.86 1ghz s ALA 85 CO 0.32 0.30 0.11 -1.13 0.00 0.00 0.00 175.76 175.37 1ghz n SER 86 N 0.84 0.03 -3.52 0.00 3.41 0.60 -4.68 113.62 110.30 1ghz n SER 86 Ca -0.02 0.01 -0.15 0.00 -0.26 0.00 0.00 58.87 58.45 1ghz n SER 86 Cb 0.51 1.02 -0.05 0.00 -0.26 0.00 0.00 64.21 65.42 1ghz n SER 86 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1ghz s LYS 87 N -2.55 1.09 0.02 4.33 2.20 -1.23 -5.01 119.74 118.59 1ghz s LYS 87 Ca -0.10 -0.04 0.05 0.00 -0.36 0.00 0.00 55.97 55.52 1ghz s LYS 87 Cb 0.06 0.51 -0.02 0.00 -1.51 0.00 0.00 37.83 36.87 1ghz s LYS 87 CO 0.83 -0.39 -0.15 -1.12 -0.36 0.00 0.00 175.35 174.17 1ghz s SER 88 N -1.73 1.72 -0.17 1.43 0.01 -1.26 -0.81 113.70 112.88 1ghz s SER 88 Ca -0.07 -0.37 -0.02 0.00 1.31 0.00 0.00 55.95 56.79 1ghz s SER 88 Cb -0.01 -0.15 0.05 0.00 0.21 0.00 0.00 66.02 66.13 1ghz s SER 88 CO 0.02 0.10 0.02 -0.63 0.41 0.00 0.00 173.24 173.16 1ghz s ILE 89 N -0.62 0.56 0.26 1.44 1.01 0.32 -4.99 121.20 119.18 1ghz s ILE 89 Ca 0.04 -0.46 -0.14 0.00 0.00 0.00 0.00 60.65 60.08 1ghz s ILE 89 Cb -0.07 -0.98 -0.08 0.00 0.01 0.00 0.00 42.46 41.34 1ghz s ILE 89 CO 0.01 -0.10 0.66 -0.69 0.00 0.00 0.00 174.94 174.82 1ghz s VAL 90 N 1.85 4.75 0.26 2.92 1.01 -1.26 -1.27 120.40 128.66 1ghz s VAL 90 Ca 0.00 0.87 -0.31 0.00 0.00 0.00 0.00 61.98 62.55 1ghz s VAL 90 Cb -0.16 -3.67 -0.13 0.00 0.00 0.00 0.00 36.38 32.42 1ghz s VAL 90 CO -0.07 -0.03 1.46 1.57 0.00 0.00 0.00 175.10 178.03 1ghz n HIS 91 N 0.05 2.37 -0.03 5.22 -0.00 -0.86 -4.85 115.22 117.12 1ghz n HIS 91 Ca 0.00 0.38 0.23 0.00 0.46 0.00 0.00 57.72 58.80 1ghz n HIS 91 Cb 0.52 -2.50 0.72 0.00 -0.12 0.00 0.00 29.99 28.62 1ghz n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1ghz h PRO 92 N 4.32 0.00 -0.34 1.57 0.13 -1.94 -2.01 132.00 133.74 1ghz h PRO 92 Ca -0.46 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.63 1ghz h PRO 92 Cb 1.26 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.36 1ghz h PRO 92 CO 0.76 0.00 0.02 0.43 -0.23 0.00 0.00 178.00 178.98 1ghz n SER 93 N -4.03 3.92 -4.76 1.44 7.64 -1.26 -5.01 113.62 111.57 1ghz n SER 93 Ca 0.12 -3.14 -0.41 0.00 1.01 0.00 0.00 58.87 56.45 1ghz n SER 93 Cb 0.76 -0.59 -0.02 0.00 -1.01 0.00 0.00 64.21 63.35 1ghz n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1ghz s TYR 94 N -2.90 2.95 -0.27 1.43 6.04 -0.76 -4.66 117.35 119.18 1ghz s TYR 94 Ca 0.45 1.12 0.03 0.00 0.04 0.00 0.00 57.07 58.70 1ghz s TYR 94 Cb 0.37 -3.83 0.07 0.00 -1.04 0.00 0.00 41.96 37.52 1ghz s TYR 94 CO 0.09 -2.59 -0.07 1.21 -1.54 0.00 0.00 175.55 172.65 1ghz s ASN 95 N 0.11 4.43 0.41 4.32 3.84 -0.82 -4.99 114.94 122.24 1ghz s ASN 95 Ca 0.56 -1.53 0.29 0.00 0.21 0.00 0.00 52.86 52.40 1ghz s ASN 95 Cb -0.42 -1.51 1.31 0.00 -0.55 0.00 0.00 41.25 40.07 1ghz s ASN 95 CO 0.48 -0.24 1.87 0.77 -2.79 0.00 0.00 177.10 177.19 1ghz h SER 96 N 7.77 0.00 0.12 -4.21 4.64 -1.94 0.66 113.55 120.59 1ghz h SER 96 Ca -0.16 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.95 1ghz h SER 96 Cb 1.04 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.15 1ghz h SER 96 CO 0.47 0.00 -0.92 0.78 -0.87 0.00 0.00 176.83 176.29 1ghz h ASN 97 N 0.00 0.60 0.00 4.97 -0.26 -1.97 -3.37 115.58 115.55 1ghz h ASN 97 Ca 0.00 -0.88 0.00 0.00 -0.56 0.00 0.00 56.30 54.86 1ghz h ASN 97 Cb 0.31 -0.19 0.00 0.00 -1.06 0.00 0.00 38.32 37.38 1ghz h ASN 97 CO 0.00 1.43 -1.26 0.35 -1.06 0.00 0.00 177.43 176.89 1ghz n THR 98 N -4.04 0.00 -1.83 2.81 -2.24 -1.16 -4.98 114.28 102.84 1ghz n THR 98 Ca -0.13 -0.19 -0.12 0.00 -2.27 0.00 0.00 64.05 61.34 1ghz n THR 98 Cb 0.85 0.66 -0.03 0.00 -2.10 0.00 0.00 70.33 69.72 1ghz n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ghz n LEU 99 N -1.71 -1.22 -4.75 3.22 4.77 0.22 -4.99 117.00 112.52 1ghz n LEU 99 Ca 0.01 0.12 -0.40 0.00 -0.03 0.00 0.00 56.01 55.71 1ghz n LEU 99 Cb 0.38 -1.83 -0.05 0.00 -2.33 0.00 0.00 43.42 39.59 1ghz n LEU 99 CO 0.40 -0.34 0.76 0.21 -1.33 0.00 0.00 177.39 177.10 1ghz s ASN 100 N -2.66 7.35 -0.99 -1.43 2.47 -1.21 -3.26 114.94 115.22 1ghz s ASN 100 Ca 0.00 2.16 -0.00 0.00 0.42 0.00 0.00 52.86 55.44 1ghz s ASN 100 Cb 0.00 -2.62 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 1ghz s ASN 100 CO 0.00 -0.10 0.82 0.59 -3.72 0.00 0.00 177.10 174.70 1ghz n ASN 101 N 1.51 -2.24 -4.25 -4.21 3.02 -1.26 -1.95 115.26 105.88 1ghz n ASN 101 Ca -0.01 -0.50 -0.43 0.00 -0.03 0.00 0.00 54.58 53.61 1ghz n ASN 101 Cb 0.46 -4.27 0.00 0.00 -0.61 0.00 0.00 39.78 35.35 1ghz n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1ghz n ASP 102 N -2.71 4.82 -3.76 6.41 2.03 -1.20 -4.29 116.55 117.85 1ghz n ASP 102 Ca -0.22 -2.95 -0.13 0.00 0.52 0.00 0.00 54.79 52.00 1ghz n ASP 102 Cb 0.63 -1.64 -0.09 0.00 -0.72 0.00 0.00 41.12 39.30 1ghz n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1ghz s ILE 103 N 2.64 0.04 0.03 5.18 2.07 -1.26 -3.86 121.20 126.04 1ghz s ILE 103 Ca 0.47 -0.35 -0.13 0.00 -1.41 0.00 0.00 60.65 59.23 1ghz s ILE 103 Cb 0.05 -0.57 0.02 0.00 0.13 0.00 0.00 42.46 42.09 1ghz s ILE 103 CO 0.01 -0.19 0.28 0.00 -1.91 0.00 0.00 174.94 173.13 1ghz s MET 104 N -0.91 0.75 -0.04 3.50 0.23 -0.35 -2.04 119.30 120.45 1ghz s MET 104 Ca -0.10 -0.46 0.05 0.00 -1.03 0.00 0.00 55.69 54.15 1ghz s MET 104 Cb -0.04 0.33 -0.03 0.00 -1.53 0.00 0.00 34.83 33.55 1ghz s MET 104 CO 0.03 -0.23 -0.16 -0.51 -2.03 0.00 0.00 175.02 172.12 1ghz s LEU 105 N -1.90 2.62 -0.09 0.18 1.43 -0.39 -1.03 118.68 119.50 1ghz s LEU 105 Ca -0.07 -0.26 0.02 0.00 -1.03 0.00 0.00 54.13 52.79 1ghz s LEU 105 Cb -0.02 -1.52 0.01 0.00 0.03 0.00 0.00 46.19 44.69 1ghz s LEU 105 CO -0.02 0.33 -0.14 -0.63 0.23 0.00 0.00 176.35 176.12 1ghz s ILE 106 N -0.73 1.37 -0.12 -0.59 1.01 0.02 -0.52 121.20 121.64 1ghz s ILE 106 Ca 0.12 -0.58 -0.06 0.00 0.00 0.00 0.00 60.65 60.12 1ghz s ILE 106 Cb -0.10 -1.26 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 1ghz s ILE 106 CO 0.01 0.41 0.12 -0.75 0.00 0.00 0.00 174.94 174.73 1ghz s LYS 107 N 0.88 3.40 0.28 2.79 2.20 0.01 -1.11 119.74 128.19 1ghz s LYS 107 Ca -0.09 -0.17 -0.16 0.00 -0.36 0.00 0.00 55.97 55.18 1ghz s LYS 107 Cb -0.15 -3.14 -0.09 0.00 -1.51 0.00 0.00 37.83 32.94 1ghz s LYS 107 CO 0.01 0.75 0.72 -0.51 -0.36 0.00 0.00 175.35 175.96 1ghz s LEU 108 N -0.95 4.16 0.35 5.43 1.43 -0.38 -0.29 118.68 128.43 1ghz s LEU 108 Ca 0.14 1.31 0.13 0.00 -1.03 0.00 0.00 54.13 54.68 1ghz s LEU 108 Cb -0.12 -3.89 0.66 0.00 0.03 0.00 0.00 46.19 42.87 1ghz s LEU 108 CO 0.04 -0.12 1.78 0.11 0.23 0.00 0.00 176.35 178.39 1ghz h LYS 109 N 2.67 0.00 -4.89 1.70 1.57 -1.01 -3.41 116.57 113.21 1ghz h LYS 109 Ca -0.48 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 57.99 1ghz h LYS 109 Cb 1.18 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.30 1ghz h LYS 109 CO 0.65 0.42 -0.74 0.45 -0.57 0.00 0.00 179.45 179.67 1ghz s SER 110 N -6.85 1.28 0.37 0.86 0.15 -1.26 -5.00 113.70 103.26 1ghz s SER 110 Ca -0.02 -0.70 -0.25 0.00 0.70 0.00 0.00 55.95 55.68 1ghz s SER 110 Cb 0.14 0.01 -0.09 0.00 -1.71 0.00 0.00 66.02 64.37 1ghz s SER 110 CO 0.73 -0.22 1.03 0.00 1.20 0.00 0.00 173.24 175.97 1ghz s ALA 111 N -1.96 3.15 0.66 5.45 0.00 -1.26 -4.86 121.76 122.93 1ghz s ALA 111 Ca -0.01 0.68 -0.11 0.00 0.00 0.00 0.00 51.96 52.52 1ghz s ALA 111 Cb -0.06 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 1ghz s ALA 111 CO 0.00 -0.11 1.06 0.00 0.00 0.00 0.00 175.76 176.71 1ghz s ALA 112 N -1.61 3.01 -0.31 0.00 0.00 0.21 -5.01 121.76 118.05 1ghz s ALA 112 Ca 0.55 -0.19 -0.11 0.00 0.00 0.00 0.00 51.96 52.21 1ghz s ALA 112 Cb -0.22 -3.06 -0.02 0.00 0.00 0.00 0.00 23.12 19.82 1ghz s ALA 112 CO 0.28 -0.88 0.19 -1.12 0.00 0.00 0.00 175.76 174.23 1ghz s SER 113 N -4.24 5.83 0.17 0.00 0.01 -1.26 -4.85 113.70 109.35 1ghz s SER 113 Ca 0.56 -0.37 -0.23 0.00 1.31 0.00 0.00 55.95 57.22 1ghz s SER 113 Cb -0.11 -2.08 -0.08 0.00 0.21 0.00 0.00 66.02 63.96 1ghz s SER 113 CO 0.53 -0.18 0.74 -0.76 0.41 0.00 0.00 173.24 173.98 1ghz s LEU 114 N 1.69 4.51 0.00 2.44 1.43 -1.26 -4.79 118.68 122.70 1ghz s LEU 114 Ca 0.06 1.54 0.00 0.00 -1.03 0.00 0.00 54.13 54.70 1ghz s LEU 114 Cb -0.17 -3.33 0.00 0.00 0.03 0.00 0.00 46.19 42.72 1ghz s LEU 114 CO 0.09 0.17 0.00 -0.46 0.23 0.00 0.00 176.35 176.37 1ghz n ASN 115 N 1.36 0.00 0.25 2.29 0.23 0.23 -4.96 115.26 114.65 1ghz n ASN 115 Ca -0.05 -0.87 0.08 0.00 -0.53 0.00 0.00 54.58 53.21 1ghz n ASN 115 Cb 0.50 0.00 0.61 0.00 -2.08 0.00 0.00 39.78 38.80 1ghz n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1ghz h SER 116 N 0.00 0.00 0.78 0.53 4.64 -2.00 -2.66 113.55 114.84 1ghz h SER 116 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ghz h SER 116 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ghz h SER 116 CO 0.00 0.11 -0.98 0.54 -0.87 0.00 0.00 176.83 175.62 1ghz n ARG 117 N -4.26 0.47 -3.83 4.77 1.74 -1.26 -4.74 116.66 109.55 1ghz n ARG 117 Ca -0.03 0.07 -0.28 0.00 -0.77 0.00 0.00 57.85 56.84 1ghz n ARG 117 Cb 0.19 -1.72 -0.16 0.00 -1.02 0.00 0.00 32.46 29.74 1ghz n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ghz s VAL 118 N -3.29 0.93 0.09 1.55 1.01 -1.00 -4.43 120.40 115.25 1ghz s VAL 118 Ca 0.01 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.23 1ghz s VAL 118 Cb 0.12 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 1ghz s VAL 118 CO 0.78 -0.11 0.01 0.00 0.00 0.00 0.00 175.10 175.79 1ghz s ALA 119 N 1.68 0.70 0.36 5.51 0.00 -0.97 -0.61 121.76 128.44 1ghz s ALA 119 Ca -0.02 -1.34 0.06 0.00 0.00 0.00 0.00 51.96 50.66 1ghz s ALA 119 Cb -0.17 0.55 -0.00 0.00 0.00 0.00 0.00 23.12 23.50 1ghz s ALA 119 CO -0.07 -0.42 0.51 -1.54 0.00 0.00 0.00 175.76 174.24 1ghz s SER 120 N -2.99 5.89 0.10 0.00 1.04 -1.26 -3.03 113.70 113.45 1ghz s SER 120 Ca 0.15 -0.17 0.08 0.00 0.48 0.00 0.00 55.95 56.50 1ghz s SER 120 Cb 0.08 -1.17 -0.04 0.00 0.10 0.00 0.00 66.02 64.99 1ghz s SER 120 CO -0.04 -0.53 -0.15 -0.51 0.98 0.00 0.00 173.24 172.99 1ghz s ILE 121 N -2.25 3.04 0.39 -1.02 1.10 -0.26 -4.87 121.20 117.34 1ghz s ILE 121 Ca 0.47 -1.36 -0.20 0.00 -0.51 0.00 0.00 60.65 59.05 1ghz s ILE 121 Cb -0.10 -2.39 -0.10 0.00 0.15 0.00 0.00 42.46 40.02 1ghz s ILE 121 CO 0.32 0.14 0.90 -0.44 -2.11 0.00 0.00 174.94 173.76 1ghz s SER 122 N -2.05 6.95 0.33 4.50 0.01 -1.26 -4.59 113.70 117.59 1ghz s SER 122 Ca 0.19 1.61 -0.10 0.00 1.31 0.00 0.00 55.95 58.96 1ghz s SER 122 Cb -0.11 -2.51 -0.07 0.00 0.21 0.00 0.00 66.02 63.55 1ghz s SER 122 CO 0.11 -0.29 0.67 -0.76 0.41 0.00 0.00 173.24 173.38 1ghz s LEU 123 N -3.01 4.00 0.61 2.44 1.43 -1.26 -0.86 118.68 122.03 1ghz s LEU 123 Ca 0.59 1.04 -0.14 0.00 -1.03 0.00 0.00 54.13 54.59 1ghz s LEU 123 Cb -0.10 -3.87 -0.03 0.00 0.03 0.00 0.00 46.19 42.22 1ghz s LEU 123 CO 0.15 -0.25 1.04 -2.16 0.23 0.00 0.00 176.35 175.37 1ghz s PRO 124 N -3.38 3.33 -0.08 1.29 0.04 -1.26 -4.79 135.00 130.14 1ghz s PRO 124 Ca 0.50 1.06 0.20 0.00 0.04 0.00 0.00 61.00 62.80 1ghz s PRO 124 Cb -0.11 -2.04 -0.30 0.00 0.04 0.00 0.00 34.50 32.09 1ghz s PRO 124 CO 0.26 -0.79 0.33 0.25 0.04 0.00 0.00 177.00 177.09 1ghz n THR 125 N -2.32 0.45 -3.99 1.26 -2.24 -1.26 -4.98 114.28 101.20 1ghz n THR 125 Ca 0.08 -0.60 -0.09 0.00 -2.27 0.00 0.00 64.05 61.16 1ghz n THR 125 Cb 0.53 -0.15 -0.05 0.00 -2.10 0.00 0.00 70.33 68.56 1ghz n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ghz s SER 127 N -4.78 -0.06 0.37 3.42 1.04 -1.26 -5.16 113.70 107.27 1ghz s SER 127 Ca -0.08 -0.93 -0.14 0.00 0.48 0.00 0.00 55.95 55.27 1ghz s SER 127 Cb 0.11 0.61 -0.08 0.00 0.10 0.00 0.00 66.02 66.76 1ghz s SER 127 CO 0.86 -1.17 0.77 0.00 0.98 0.00 0.00 173.24 174.68 1ghz s ALA 129 N -2.18 3.52 0.51 0.00 0.00 -1.26 -5.07 121.76 117.28 1ghz s ALA 129 Ca 0.54 -0.27 -0.17 0.00 0.00 0.00 0.00 51.96 52.06 1ghz s ALA 129 Cb -0.10 -2.49 -0.08 0.00 0.00 0.00 0.00 23.12 20.45 1ghz s ALA 129 CO 0.23 0.38 0.99 -1.12 0.00 0.00 0.00 175.76 176.24 1ghz s SER 130 N -2.58 6.58 0.47 0.00 0.01 -1.26 -5.01 113.70 111.91 1ghz s SER 130 Ca 0.48 1.62 -0.24 0.00 1.31 0.00 0.00 55.95 59.13 1ghz s SER 130 Cb -0.11 -2.52 -0.07 0.00 0.21 0.00 0.00 66.02 63.54 1ghz s SER 130 CO 0.23 -0.62 1.29 0.00 0.41 0.00 0.00 173.24 174.56 1ghz s ALA 132 N -2.53 3.02 0.00 1.44 0.00 -1.26 -1.98 121.76 120.46 1ghz s ALA 132 Ca 0.60 1.20 0.00 0.00 0.00 0.00 0.00 51.96 53.76 1ghz s ALA 132 Cb -0.11 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1ghz s ALA 132 CO 0.29 -1.00 0.00 0.41 0.00 0.00 0.00 175.76 175.46 1ghz n GLY 133 N 0.62 2.83 3.76 0.00 0.00 0.46 -4.94 105.19 107.91 1ghz n GLY 133 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1ghz n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ghz s THR 134 N -2.58 3.00 0.06 2.61 2.01 -0.84 -4.66 115.64 115.24 1ghz s THR 134 Ca 0.00 0.93 -0.17 0.00 0.31 0.00 0.00 61.69 62.76 1ghz s THR 134 Cb 0.00 -3.59 -0.06 0.00 0.01 0.00 0.00 72.50 68.85 1ghz s THR 134 CO 0.00 0.19 0.51 -1.10 -0.69 0.00 0.00 174.62 173.53 1ghz s GLN 135 N -1.13 4.06 0.30 4.92 -1.52 -1.26 -1.15 119.66 123.88 1ghz s GLN 135 Ca 0.51 0.58 0.03 0.00 -1.95 0.00 0.00 55.36 54.52 1ghz s GLN 135 Cb -0.38 -3.18 -0.06 0.00 -0.22 0.00 0.00 33.01 29.17 1ghz s GLN 135 CO 0.46 0.63 0.08 0.00 -0.25 0.00 0.00 175.29 176.21 1ghz s LEU 137 N -3.42 2.44 -0.08 0.00 2.96 0.48 -1.25 118.68 119.81 1ghz s LEU 137 Ca 0.37 -0.49 0.03 0.00 -0.22 0.00 0.00 54.13 53.82 1ghz s LEU 137 Cb 0.08 -1.55 -0.02 0.00 0.50 0.00 0.00 46.19 45.20 1ghz s LEU 137 CO 0.15 0.07 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.45 1ghz s ILE 138 N 0.89 2.73 0.04 6.68 1.01 0.33 -1.45 121.20 131.43 1ghz s ILE 138 Ca -0.04 -0.82 -0.01 0.00 0.00 0.00 0.00 60.65 59.78 1ghz s ILE 138 Cb -0.15 -2.07 -0.03 0.00 0.01 0.00 0.00 42.46 40.22 1ghz s ILE 138 CO -0.02 0.57 -0.03 -0.94 0.00 0.00 0.00 174.94 174.52 1ghz s SER 139 N -0.24 0.40 0.00 3.58 1.04 -1.22 -0.61 113.70 116.65 1ghz s SER 139 Ca 0.00 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.60 1ghz s SER 139 Cb -0.13 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.16 1ghz s SER 139 CO 0.03 -0.50 0.00 0.61 0.98 0.00 0.00 173.24 174.36 1ghz n GLY 140 N 0.62 0.92 1.71 7.32 0.00 -0.36 -4.49 105.19 110.91 1ghz n GLY 140 Ca -0.17 -1.01 -0.14 0.00 0.00 0.00 0.00 46.02 44.70 1ghz n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1ghz n TRP 141 N -0.54 2.10 -2.22 1.61 8.01 -1.26 -2.16 117.44 122.98 1ghz n TRP 141 Ca 0.00 -1.73 -0.27 0.00 -1.31 0.00 0.00 57.50 54.19 1ghz n TRP 141 Cb 0.00 -0.73 0.13 0.00 -2.01 0.00 0.00 31.31 28.71 1ghz n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1ghz s GLY 142 N -1.92 1.75 0.29 6.99 0.00 -1.25 -4.43 107.32 108.76 1ghz s GLY 142 Ca 0.51 -1.34 -0.28 0.00 0.00 0.00 0.00 44.72 43.61 1ghz s GLY 142 CO 0.05 -0.72 0.91 -2.01 0.00 0.00 0.00 173.10 171.33 1ghz n ASN 143 N -3.26 0.79 -0.65 1.64 5.15 -0.26 -2.50 115.26 116.16 1ghz n ASN 143 Ca 0.14 1.15 0.06 0.00 -0.60 0.00 0.00 54.58 55.33 1ghz n ASN 143 Cb 0.60 -1.23 0.14 0.00 -0.53 0.00 0.00 39.78 38.76 1ghz n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1ghz n THR 144 N 0.09 0.77 -5.20 -0.44 -2.24 -0.46 0.00 114.28 106.80 1ghz n THR 144 Ca 0.11 -0.89 -0.32 0.00 -2.27 0.00 0.00 64.05 60.69 1ghz n THR 144 Cb 0.32 0.67 -0.16 0.00 -2.10 0.00 0.00 70.33 69.06 1ghz n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ghz s LYS 145 N -1.00 2.39 0.03 -0.78 -0.14 -1.26 -4.47 119.74 114.50 1ghz s LYS 145 Ca 0.23 -0.87 -0.19 0.00 -1.36 0.00 0.00 55.97 53.78 1ghz s LYS 145 Cb 0.13 -2.17 -0.20 0.00 -1.68 0.00 0.00 37.83 33.91 1ghz s LYS 145 CO 0.17 0.49 1.18 0.77 -0.76 0.00 0.00 175.35 177.20 1ghz h SER 146 N 5.72 0.58 -3.76 2.83 0.02 -1.94 -3.38 113.55 113.63 1ghz h SER 146 Ca -0.39 -0.69 -0.63 0.00 -0.84 0.00 0.00 61.79 59.25 1ghz h SER 146 Cb 1.15 -0.17 -0.41 0.00 0.14 0.00 0.00 62.40 63.10 1ghz h SER 146 CO 0.48 1.18 -0.62 -0.44 -1.14 0.00 0.00 176.83 176.29 1ghz s SER 147 N -6.69 4.43 0.00 3.07 0.01 -1.26 -4.58 113.70 108.67 1ghz s SER 147 Ca -0.13 -3.35 0.00 0.00 1.31 0.00 0.00 55.95 53.78 1ghz s SER 147 Cb 0.05 -1.58 0.00 0.00 0.21 0.00 0.00 66.02 64.70 1ghz s SER 147 CO 0.82 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.91 1ghz n GLY 148 N 2.65 0.00 2.84 3.44 0.00 -1.26 -5.10 105.19 107.75 1ghz n GLY 148 Ca 0.12 -1.73 -0.23 0.00 0.00 0.00 0.00 46.02 44.18 1ghz n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ghz s THR 149 N -1.74 0.55 -0.24 2.61 2.01 -1.26 -4.57 115.64 113.00 1ghz s THR 149 Ca 0.00 -0.03 -0.04 0.00 0.31 0.00 0.00 61.69 61.93 1ghz s THR 149 Cb 0.00 -0.64 0.13 0.00 0.01 0.00 0.00 72.50 72.00 1ghz s THR 149 CO 0.00 0.27 0.42 -0.55 -0.69 0.00 0.00 174.62 174.07 1ghz s SER 150 N 1.58 -0.09 -0.22 3.53 0.15 -1.26 -4.98 113.70 112.41 1ghz s SER 150 Ca -0.00 0.54 -0.08 0.00 0.70 0.00 0.00 55.95 57.11 1ghz s SER 150 Cb -0.13 1.31 -0.04 0.00 -1.71 0.00 0.00 66.02 65.45 1ghz s SER 150 CO -0.04 -0.27 0.08 -0.31 1.20 0.00 0.00 173.24 173.90 1ghz s TYR 151 N 2.60 3.18 0.73 3.44 2.02 -1.26 -1.36 117.35 126.70 1ghz s TYR 151 Ca 0.09 -0.11 -0.11 0.00 -0.37 0.00 0.00 57.07 56.58 1ghz s TYR 151 Cb -0.14 -2.17 0.04 0.00 -0.40 0.00 0.00 41.96 39.28 1ghz s TYR 151 CO -0.15 -0.08 1.10 -1.25 -1.57 0.00 0.00 175.55 173.60 1ghz s PRO 152 N 1.00 2.54 -0.02 -1.71 0.04 -1.26 -5.00 135.00 130.59 1ghz s PRO 152 Ca 0.04 0.27 0.12 0.00 0.04 0.00 0.00 61.00 61.47 1ghz s PRO 152 Cb -0.14 -2.03 -0.19 0.00 0.04 0.00 0.00 34.50 32.18 1ghz s PRO 152 CO 0.03 -1.19 0.26 -0.25 0.04 0.00 0.00 177.00 175.88 1ghz n ASP 153 N -3.06 2.15 -4.75 6.66 8.00 -1.26 -4.91 116.55 119.37 1ghz n ASP 153 Ca 0.07 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.34 1ghz n ASP 153 Cb 0.59 1.51 -0.06 0.00 -0.02 0.00 0.00 41.12 43.14 1ghz n ASP 153 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1ghz s VAL 154 N -2.82 4.09 0.18 2.53 -7.23 -1.26 -0.43 120.40 115.45 1ghz s VAL 154 Ca -0.05 -1.54 -0.30 0.00 -1.81 0.00 0.00 61.98 58.28 1ghz s VAL 154 Cb 0.08 -3.18 -0.09 0.00 0.56 0.00 0.00 36.38 33.75 1ghz s VAL 154 CO 0.52 -0.32 1.37 -0.22 -0.31 0.00 0.00 175.10 176.13 1ghz s LEU 155 N -3.67 4.39 0.06 1.32 2.96 -1.23 -4.81 118.68 117.70 1ghz s LEU 155 Ca 0.32 2.42 0.05 0.00 -0.22 0.00 0.00 54.13 56.70 1ghz s LEU 155 Cb -0.08 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 1ghz s LEU 155 CO 0.23 -0.61 -0.07 -0.54 -1.32 0.00 0.00 176.35 174.04 1ghz s LYS 156 N 0.30 2.38 0.16 1.98 -0.14 -0.92 -1.49 119.74 122.01 1ghz s LYS 156 Ca 0.60 -0.86 0.09 0.00 -1.36 0.00 0.00 55.97 54.44 1ghz s LYS 156 Cb -0.38 -2.43 -0.04 0.00 -1.68 0.00 0.00 37.83 33.30 1ghz s LYS 156 CO 0.36 0.55 -0.19 0.00 -0.76 0.00 0.00 175.35 175.31 1ghz s LEU 158 N -2.55 -0.12 -0.17 0.00 2.96 0.22 -0.43 118.68 118.58 1ghz s LEU 158 Ca 0.15 0.89 -0.09 0.00 -0.22 0.00 0.00 54.13 54.86 1ghz s LEU 158 Cb -0.07 1.34 -0.05 0.00 0.50 0.00 0.00 46.19 47.92 1ghz s LEU 158 CO 0.07 -0.20 0.15 -0.54 -1.32 0.00 0.00 176.35 174.51 1ghz s LYS 159 N 1.48 3.94 -0.07 1.98 1.02 -1.26 -0.51 119.74 126.32 1ghz s LYS 159 Ca -0.09 -0.17 -0.17 0.00 0.02 0.00 0.00 55.97 55.56 1ghz s LYS 159 Cb -0.09 -3.34 0.04 0.00 -0.52 0.00 0.00 37.83 33.92 1ghz s LYS 159 CO -0.13 0.46 0.41 0.00 -0.92 0.00 0.00 175.35 175.17 1ghz s ALA 160 N -0.12 -1.03 0.36 5.17 0.00 -0.38 -4.95 121.76 120.82 1ghz s ALA 160 Ca 0.11 0.78 -0.04 0.00 0.00 0.00 0.00 51.96 52.80 1ghz s ALA 160 Cb -0.12 -0.20 -0.05 0.00 0.00 0.00 0.00 23.12 22.76 1ghz s ALA 160 CO 0.01 -0.26 0.63 -1.25 0.00 0.00 0.00 175.76 174.89 1ghz s PRO 161 N -0.77 3.60 0.23 0.00 0.04 -1.26 -0.42 135.00 136.41 1ghz s PRO 161 Ca -0.09 0.03 -0.30 0.00 0.04 0.00 0.00 61.00 60.69 1ghz s PRO 161 Cb -0.04 -2.56 -0.09 0.00 0.04 0.00 0.00 34.50 31.86 1ghz s PRO 161 CO 0.04 0.07 1.00 0.42 0.04 0.00 0.00 177.00 178.57 1ghz s ILE 162 N -2.32 3.97 0.34 0.56 1.01 -0.30 -1.75 121.20 122.71 1ghz s ILE 162 Ca 0.45 1.90 0.03 0.00 0.00 0.00 0.00 60.65 63.03 1ghz s ILE 162 Cb -0.10 -4.21 -0.02 0.00 0.01 0.00 0.00 42.46 38.14 1ghz s ILE 162 CO 0.35 0.42 0.51 -0.76 0.00 0.00 0.00 174.94 175.46 1ghz s LEU 163 N -1.01 3.99 0.61 2.97 1.43 -0.51 -0.41 118.68 125.75 1ghz s LEU 163 Ca 0.43 0.15 -0.17 0.00 -1.03 0.00 0.00 54.13 53.51 1ghz s LEU 163 Cb -0.27 -3.02 -0.03 0.00 0.03 0.00 0.00 46.19 42.90 1ghz s LEU 163 CO 0.34 -0.38 1.12 -0.94 0.23 0.00 0.00 176.35 176.72 1ghz s SER 164 N -4.10 5.39 0.37 2.29 1.04 -1.26 -4.67 113.70 112.76 1ghz s SER 164 Ca 0.42 2.07 0.10 0.00 0.48 0.00 0.00 55.95 59.01 1ghz s SER 164 Cb -0.10 -2.56 0.73 0.00 0.10 0.00 0.00 66.02 64.19 1ghz s SER 164 CO 0.33 -1.44 1.87 0.44 0.98 0.00 0.00 173.24 175.43 1ghz h ASP 165 N 0.54 0.19 -0.57 7.02 3.32 -1.97 -2.59 116.42 122.36 1ghz h ASP 165 Ca -0.48 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.52 1ghz h ASP 165 Cb 1.25 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.72 1ghz h ASP 165 CO 0.55 0.41 0.36 0.77 -1.72 0.00 0.00 179.24 179.62 1ghz h SER 166 N 0.18 0.66 0.40 6.45 4.64 -1.99 0.14 113.55 124.04 1ghz h SER 166 Ca 0.03 -0.04 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 1ghz h SER 166 Cb 0.48 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 1ghz h SER 166 CO 0.03 0.50 -0.51 0.77 -0.87 0.00 0.00 176.83 176.75 1ghz h SER 167 N 0.76 0.15 -0.07 4.97 4.64 -1.88 -0.79 113.55 121.33 1ghz h SER 167 Ca 0.21 -0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 61.43 1ghz h SER 167 Cb -0.06 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 61.99 1ghz h SER 167 CO -0.04 0.63 -0.03 0.00 -0.87 0.00 0.00 176.83 176.52 1ghz h LYS 169 N -0.21 0.11 0.00 0.00 1.57 -0.63 -2.19 116.57 115.22 1ghz h LYS 169 Ca 0.02 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.62 1ghz h LYS 169 Cb 0.45 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1ghz h LYS 169 CO 0.01 0.51 -0.59 0.77 -0.57 0.00 0.00 179.45 179.58 1ghz h SER 170 N 0.10 0.00 0.03 0.86 0.02 -1.12 -2.90 113.55 110.53 1ghz h SER 170 Ca 0.01 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.74 1ghz h SER 170 Cb 0.77 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.32 1ghz h SER 170 CO 0.06 0.59 -0.78 0.00 -1.14 0.00 0.00 176.83 175.55 1ghz h ALA 171 N 1.41 0.40 -2.42 3.77 0.00 -1.19 -3.38 119.26 117.85 1ghz h ALA 171 Ca -0.01 -0.61 -0.60 0.00 0.00 0.00 0.00 54.91 53.69 1ghz h ALA 171 Cb 1.04 -0.03 -0.41 0.00 0.00 0.00 0.00 17.79 18.39 1ghz h ALA 171 CO 0.08 0.72 -0.68 0.66 0.00 0.00 0.00 179.25 180.03 1ghz n TYR 172 N -3.89 2.73 -1.70 0.00 4.02 -0.85 -4.99 117.16 112.49 1ghz n TYR 172 Ca -0.06 -4.07 -0.44 0.00 -0.01 0.00 0.00 57.90 53.32 1ghz n TYR 172 Cb 0.74 -0.50 -0.04 0.00 -0.02 0.00 0.00 39.34 39.53 1ghz n TYR 172 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1ghz n PRO 173 N 1.35 2.49 -1.14 -0.72 -0.02 -1.11 -1.68 135.00 134.17 1ghz n PRO 173 Ca 0.26 0.90 -0.05 0.00 -2.02 0.00 0.00 63.50 62.59 1ghz n PRO 173 Cb 0.41 -2.71 -0.02 0.00 -0.02 0.00 0.00 33.50 31.16 1ghz n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ghz n GLY 174 N 3.71 0.61 0.00 -1.23 0.00 -1.26 -4.84 105.19 102.18 1ghz n GLY 174 Ca 0.16 -0.11 0.02 0.00 0.00 0.00 0.00 46.02 46.09 1ghz n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ghz n GLN 175 N -0.98 5.12 -3.54 1.61 6.02 -0.68 -5.01 117.38 119.92 1ghz n GLN 175 Ca -0.05 -0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.57 1ghz n GLN 175 Cb 0.40 -0.72 -0.07 0.00 1.02 0.00 0.00 30.24 30.87 1ghz n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1ghz s ILE 176 N -1.45 5.30 0.54 5.09 -1.09 -1.25 -5.03 121.20 123.32 1ghz s ILE 176 Ca 0.01 0.55 0.05 0.00 -2.23 0.00 0.00 60.65 59.03 1ghz s ILE 176 Cb 0.03 -3.63 0.03 0.00 -1.58 0.00 0.00 42.46 37.31 1ghz s ILE 176 CO 0.15 0.39 0.38 0.42 -1.23 0.00 0.00 174.94 175.05 1ghz s THR 177 N 0.44 1.66 -1.32 2.92 -4.23 -1.26 -4.99 115.64 108.85 1ghz s THR 177 Ca 0.17 -1.51 0.16 0.00 -1.18 0.00 0.00 61.69 59.32 1ghz s THR 177 Cb -0.13 -2.17 0.24 0.00 1.34 0.00 0.00 72.50 71.78 1ghz s THR 177 CO 0.04 0.00 1.46 -1.54 -0.54 0.00 0.00 174.62 174.03 1ghz n SER 178 N -1.73 0.00 -1.73 3.99 3.41 -1.26 -2.46 113.62 113.83 1ghz n SER 178 Ca -0.02 0.17 0.09 0.00 -0.26 0.00 0.00 58.87 58.85 1ghz n SER 178 Cb 0.64 -0.34 0.38 0.00 -0.26 0.00 0.00 64.21 64.64 1ghz n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1ghz n ASN 179 N -1.34 5.19 -4.13 4.04 3.02 -1.26 -4.91 115.26 115.87 1ghz n ASN 179 Ca 0.06 -2.64 -0.12 0.00 -0.03 0.00 0.00 54.58 51.86 1ghz n ASN 179 Cb 0.14 -0.63 -0.11 0.00 -0.61 0.00 0.00 39.78 38.58 1ghz n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1ghz s MET 180 N -2.21 0.73 0.08 3.52 -1.94 -1.03 -0.97 119.30 117.48 1ghz s MET 180 Ca 0.53 -1.13 -0.11 0.00 -1.71 0.00 0.00 55.69 53.27 1ghz s MET 180 Cb 0.37 -0.25 0.01 0.00 2.01 0.00 0.00 34.83 36.97 1ghz s MET 180 CO 0.22 0.01 0.25 -0.59 -0.01 0.00 0.00 175.02 174.90 1ghz s PHE 181 N -2.82 0.03 0.06 -0.03 -0.12 -0.71 -4.79 117.98 109.60 1ghz s PHE 181 Ca 0.04 -0.37 0.04 0.00 -0.05 0.00 0.00 56.93 56.59 1ghz s PHE 181 Cb -0.00 0.04 -0.04 0.00 -0.63 0.00 0.00 43.02 42.39 1ghz s PHE 181 CO -0.03 -0.56 -0.01 0.00 -0.05 0.00 0.00 175.22 174.57 1ghz s ALA 183 N -1.22 -0.32 0.00 0.00 0.00 -0.92 -1.42 121.76 117.88 1ghz s ALA 183 Ca 0.23 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.13 1ghz s ALA 183 Cb -0.12 0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.06 1ghz s ALA 183 CO 0.15 -0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.14 1ghz n GLY 184 N 1.69 0.70 2.84 0.00 0.00 -0.72 -2.97 105.19 106.74 1ghz n GLY 184 Ca -0.21 -1.67 -0.26 0.00 0.00 0.00 0.00 46.02 43.88 1ghz n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ghz s TYR 184 N -3.49 1.24 0.46 1.61 1.51 -1.26 -4.36 117.35 113.06 1ghz s TYR 184 Ca 0.00 -0.65 0.30 0.00 -1.01 0.00 0.00 57.07 55.71 1ghz s TYR 184 Cb 0.00 -1.10 1.63 0.00 -0.11 0.00 0.00 41.96 42.38 1ghz s TYR 184 CO 0.00 -0.49 2.14 -0.07 -1.11 0.00 0.00 175.55 176.02 1ghz h LEU 185 N 8.22 0.00 -1.48 -1.29 3.38 -1.95 -0.28 115.31 121.90 1ghz h LEU 185 Ca -0.24 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 1ghz h LEU 185 Cb 1.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1ghz h LEU 185 CO 0.35 0.07 -0.23 -0.33 0.09 0.00 0.00 178.44 178.40 1ghz h GLU 186 N 0.00 0.00 0.00 1.13 4.39 -1.95 0.25 114.58 118.40 1ghz h GLU 186 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1ghz h GLU 186 Cb 0.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1ghz h GLU 186 CO 0.01 0.23 0.00 0.41 -1.16 0.00 0.00 179.01 178.50 1ghz n GLY 187 N -0.35 -1.76 2.23 -3.84 0.00 -0.12 -4.30 105.19 97.05 1ghz n GLY 187 Ca -0.01 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.06 1ghz n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ghz n GLY 188 N 0.00 2.21 2.98 -0.02 0.00 0.14 -4.87 105.19 105.64 1ghz n GLY 188 Ca 0.00 -0.25 -0.25 0.00 0.00 0.00 0.00 46.02 45.52 1ghz n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ghz s LYS 188 N 0.00 1.61 0.04 1.61 1.02 -1.26 -3.71 119.74 119.05 1ghz s LYS 188 Ca 0.00 -0.35 -0.29 0.00 0.02 0.00 0.00 55.97 55.36 1ghz s LYS 188 Cb 0.00 -1.45 0.10 0.00 -0.52 0.00 0.00 37.83 35.97 1ghz s LYS 188 CO 0.00 -0.08 1.19 0.34 -0.92 0.00 0.00 175.35 175.88 1ghz s ASP 189 N 1.03 -0.08 0.77 2.83 3.68 -0.60 -4.29 116.67 120.00 1ghz s ASP 189 Ca -0.08 -0.23 -0.04 0.00 2.13 0.00 0.00 52.55 54.33 1ghz s ASP 189 Cb -0.15 0.26 0.14 0.00 -1.45 0.00 0.00 42.92 41.73 1ghz s ASP 189 CO -0.01 -0.49 1.06 -0.94 0.13 0.00 0.00 175.17 174.93 1ghz s SER 190 N -3.03 4.10 0.32 -0.34 1.04 -1.26 -0.67 113.70 113.87 1ghz s SER 190 Ca 0.15 -0.22 -0.15 0.00 0.48 0.00 0.00 55.95 56.20 1ghz s SER 190 Cb 0.03 -0.09 0.06 0.00 0.10 0.00 0.00 66.02 66.12 1ghz s SER 190 CO -0.02 -2.04 0.79 0.00 0.98 0.00 0.00 173.24 172.96 1ghz n GLN 192 N -0.54 2.01 0.00 0.00 7.27 -1.26 -1.02 117.38 123.84 1ghz n GLN 192 Ca -0.07 0.72 0.00 0.00 0.07 0.00 0.00 57.00 57.72 1ghz n GLN 192 Cb 0.55 -2.37 0.00 0.00 2.41 0.00 0.00 30.24 30.83 1ghz n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ghz n GLY 193 N 2.17 2.83 0.09 1.69 0.00 -1.26 -1.10 105.19 109.61 1ghz n GLY 193 Ca 0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.25 1ghz n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ghz n ASP 194 N 0.00 0.74 -4.47 1.61 10.43 -0.19 -3.89 116.55 120.79 1ghz n ASP 194 Ca 0.00 0.19 -0.52 0.00 2.57 0.00 0.00 54.79 57.04 1ghz n ASP 194 Cb 0.00 0.54 -0.05 0.00 1.84 0.00 0.00 41.12 43.45 1ghz n ASP 194 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1ghz n SER 195 N -2.44 -0.37 0.00 -2.24 7.64 -1.25 -1.54 113.62 113.42 1ghz n SER 195 Ca 0.01 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.03 1ghz n SER 195 Cb 0.51 -0.99 0.00 0.00 -1.01 0.00 0.00 64.21 62.72 1ghz n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ghz n GLY 196 N 1.80 2.34 3.80 0.23 0.00 -0.14 -0.62 105.19 112.61 1ghz n GLY 196 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1ghz n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ghz s GLY 197 N -1.91 1.61 0.40 -0.02 0.00 -0.59 -3.26 107.32 103.56 1ghz s GLY 197 Ca 0.00 -0.68 -0.17 0.00 0.00 0.00 0.00 44.72 43.87 1ghz s GLY 197 CO 0.00 -0.07 0.86 2.56 0.00 0.00 0.00 173.10 176.45 1ghz s PRO 198 N -5.42 4.06 -0.23 2.90 0.04 -1.26 -1.28 135.00 133.81 1ghz s PRO 198 Ca 0.66 0.87 -0.01 0.00 0.04 0.00 0.00 61.00 62.55 1ghz s PRO 198 Cb -0.12 -2.28 0.07 0.00 0.04 0.00 0.00 34.50 32.20 1ghz s PRO 198 CO 0.53 -0.00 0.02 0.08 0.04 0.00 0.00 177.00 177.66 1ghz s VAL 199 N -2.20 0.93 -0.15 -0.36 1.01 -0.80 -3.46 120.40 115.38 1ghz s VAL 199 Ca 0.58 -0.93 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 1ghz s VAL 199 Cb -0.10 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.86 1ghz s VAL 199 CO 0.19 -0.25 -0.11 -0.69 0.00 0.00 0.00 175.10 174.24 1ghz s VAL 200 N 1.65 3.13 -0.06 2.92 1.01 -0.53 -1.30 120.40 127.23 1ghz s VAL 200 Ca -0.01 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.38 1ghz s VAL 200 Cb -0.18 -2.34 0.01 0.00 0.00 0.00 0.00 36.38 33.87 1ghz s VAL 200 CO -0.10 0.50 -0.11 0.00 0.00 0.00 0.00 175.10 175.40 1ghz n SER 202 N 3.81 -2.01 -0.17 0.00 7.64 -1.26 -1.40 113.62 120.23 1ghz n SER 202 Ca -0.23 -1.04 -0.02 0.00 1.01 0.00 0.00 58.87 58.58 1ghz n SER 202 Cb 0.52 -2.69 -0.01 0.00 -1.01 0.00 0.00 64.21 61.02 1ghz n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ghz n GLY 203 N -1.66 0.53 3.25 0.23 0.00 -1.26 -5.02 105.19 101.25 1ghz n GLY 203 Ca -0.07 -0.25 -0.22 0.00 0.00 0.00 0.00 46.02 45.48 1ghz n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ghz s LYS 204 N -1.28 1.02 -0.52 1.61 -0.14 -0.49 -4.28 119.74 115.65 1ghz s LYS 204 Ca 0.00 -1.10 -0.29 0.00 -1.36 0.00 0.00 55.97 53.23 1ghz s LYS 204 Cb 0.00 -1.19 0.03 0.00 -1.68 0.00 0.00 37.83 34.99 1ghz s LYS 204 CO 0.00 0.27 1.16 -1.17 -0.76 0.00 0.00 175.35 174.85 1ghz s LEU 209 N -1.87 3.56 -0.03 3.17 2.96 -0.04 -1.35 118.68 125.07 1ghz s LEU 209 Ca 0.04 0.30 0.15 0.00 -0.22 0.00 0.00 54.13 54.40 1ghz s LEU 209 Cb -0.10 -3.37 -0.24 0.00 0.50 0.00 0.00 46.19 42.98 1ghz s LEU 209 CO 0.04 -1.36 0.32 0.00 -1.32 0.00 0.00 176.35 174.03 1ghz n GLN 210 N 8.11 0.58 -4.05 1.98 1.13 -0.42 -4.14 117.38 120.57 1ghz n GLN 210 Ca 0.10 -0.13 -0.10 0.00 -1.94 0.00 0.00 57.00 54.93 1ghz n GLN 210 Cb 0.49 -1.37 -0.07 0.00 0.11 0.00 0.00 30.24 29.39 1ghz n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1ghz s GLY 211 N -3.89 0.79 -0.04 1.08 0.00 -0.94 -1.77 107.32 102.54 1ghz s GLY 211 Ca -0.06 -1.13 0.02 0.00 0.00 0.00 0.00 44.72 43.54 1ghz s GLY 211 CO 0.65 -0.94 -0.08 -0.42 0.00 0.00 0.00 173.10 172.30 1ghz s ILE 212 N -4.04 0.77 -0.07 0.90 1.01 -1.12 -1.91 121.20 116.74 1ghz s ILE 212 Ca 0.25 -0.29 -0.29 0.00 0.00 0.00 0.00 60.65 60.32 1ghz s ILE 212 Cb 0.03 -0.73 -0.07 0.00 0.01 0.00 0.00 42.46 41.71 1ghz s ILE 212 CO 0.07 0.26 1.99 -0.69 0.00 0.00 0.00 174.94 176.56 1ghz s VAL 213 N 0.62 3.12 0.01 2.92 1.01 -0.41 -1.32 120.40 126.36 1ghz s VAL 213 Ca -0.10 0.14 -0.02 0.00 0.00 0.00 0.00 61.98 62.00 1ghz s VAL 213 Cb -0.13 -3.11 -0.01 0.00 0.00 0.00 0.00 36.38 33.13 1ghz s VAL 213 CO 0.01 -0.04 -0.04 -0.24 0.00 0.00 0.00 175.10 174.80 1ghz n SER 214 N 8.83 0.55 -1.68 3.32 2.88 -0.98 -0.96 113.62 125.57 1ghz n SER 214 Ca 0.22 0.08 -0.04 0.00 -1.33 0.00 0.00 58.87 57.80 1ghz n SER 214 Cb 0.43 -0.27 -0.00 0.00 -0.75 0.00 0.00 64.21 63.62 1ghz n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1ghz n TRP 215 N -3.01 -1.08 -0.88 0.66 4.27 -0.61 -4.92 117.44 111.86 1ghz n TRP 215 Ca -0.02 -0.76 0.00 0.00 -3.89 0.00 0.00 57.50 52.83 1ghz n TRP 215 Cb 0.06 0.25 0.00 0.00 -1.36 0.00 0.00 31.31 30.26 1ghz n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1ghz n GLY 216 N -0.20 -1.55 3.16 -1.67 0.00 -1.26 -0.68 105.19 103.00 1ghz n GLY 216 Ca -0.01 -1.06 -0.36 0.00 0.00 0.00 0.00 46.02 44.59 1ghz n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ghz s SER 217 N -1.07 5.13 0.77 1.61 0.15 -1.26 -4.98 113.70 114.04 1ghz s SER 217 Ca 0.00 -1.61 0.00 0.00 0.70 0.00 0.00 55.95 55.04 1ghz s SER 217 Cb 0.00 -1.79 0.00 0.00 -1.71 0.00 0.00 66.02 62.52 1ghz s SER 217 CO 0.00 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 174.65 1ghz n GLY 219 N 4.64 0.67 2.92 9.45 0.00 -1.26 -4.61 105.19 117.00 1ghz n GLY 219 Ca -0.08 -0.74 -0.13 0.00 0.00 0.00 0.00 46.02 45.07 1ghz n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ghz n ALA 221 N 3.75 -0.72 -1.98 0.00 0.00 -1.26 -4.56 120.51 115.74 1ghz n ALA 221 Ca -0.21 0.13 -0.31 0.00 0.00 0.00 0.00 53.44 53.05 1ghz n ALA 221 Cb 0.54 -1.89 -0.03 0.00 0.00 0.00 0.00 19.45 18.08 1ghz n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ghz s GLN 221 N -5.07 3.86 0.32 0.00 -1.52 -1.26 -0.68 119.66 115.31 1ghz s GLN 221 Ca 0.01 0.74 -0.29 0.00 -1.95 0.00 0.00 55.36 53.88 1ghz s GLN 221 Cb -0.01 -2.23 -0.10 0.00 -0.22 0.00 0.00 33.01 30.45 1ghz s GLN 221 CO 0.02 -0.20 1.24 0.21 -0.25 0.00 0.00 175.29 176.31 1ghz s LYS 222 N -4.07 4.40 -1.36 2.91 2.20 -1.26 -2.86 119.74 119.70 1ghz s LYS 222 Ca 0.56 2.08 0.00 0.00 -0.36 0.00 0.00 55.97 58.24 1ghz s LYS 222 Cb -0.10 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.15 1ghz s LYS 222 CO 0.33 -0.09 0.00 0.09 -0.36 0.00 0.00 175.35 175.32 1ghz n ASN 223 N 0.84 -4.33 -3.27 1.43 3.02 0.88 -4.90 115.26 108.93 1ghz n ASN 223 Ca 0.00 0.20 -0.25 0.00 -0.03 0.00 0.00 54.58 54.50 1ghz n ASN 223 Cb 0.43 -3.74 -0.08 0.00 -0.61 0.00 0.00 39.78 35.78 1ghz n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1ghz n LYS 224 N -2.60 1.03 -1.31 3.52 4.76 -1.14 -4.76 118.16 117.67 1ghz n LYS 224 Ca -0.17 -3.52 -0.29 0.00 -2.87 0.00 0.00 58.31 51.46 1ghz n LYS 224 Cb 0.59 -1.48 0.14 0.00 -1.84 0.00 0.00 35.03 32.44 1ghz n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1ghz s PRO 225 N -1.31 1.16 0.57 1.97 0.04 -1.26 -4.36 135.00 131.81 1ghz s PRO 225 Ca 0.35 0.62 -0.16 0.00 0.04 0.00 0.00 61.00 61.86 1ghz s PRO 225 Cb 0.15 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.82 1ghz s PRO 225 CO -0.10 -2.26 1.03 0.20 0.04 0.00 0.00 177.00 175.91 1ghz s GLY 226 N -3.61 2.08 -0.09 0.56 0.00 -1.16 -4.57 107.32 100.54 1ghz s GLY 226 Ca 0.63 0.30 0.03 0.00 0.00 0.00 0.00 44.72 45.68 1ghz s GLY 226 CO 0.56 0.60 -0.20 0.14 0.00 0.00 0.00 173.10 174.20 1ghz s VAL 227 N -2.55 2.47 0.05 1.40 1.01 0.15 -2.16 120.40 120.78 1ghz s VAL 227 Ca 0.62 -0.89 0.08 0.00 0.00 0.00 0.00 61.98 61.79 1ghz s VAL 227 Cb -0.14 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1ghz s VAL 227 CO 0.36 0.56 -0.24 -0.31 0.00 0.00 0.00 175.10 175.46 1ghz s TYR 228 N 0.09 2.07 0.22 5.22 2.02 0.26 -1.58 117.35 125.65 1ghz s TYR 228 Ca -0.09 -0.39 -0.30 0.00 -0.37 0.00 0.00 57.07 55.92 1ghz s TYR 228 Cb -0.15 -1.24 -0.09 0.00 -0.40 0.00 0.00 41.96 40.08 1ghz s TYR 228 CO 0.06 0.11 1.31 0.99 -1.57 0.00 0.00 175.55 176.45 1ghz s THR 229 N -0.81 3.13 -1.01 -0.71 2.01 -0.43 -1.74 115.64 116.09 1ghz s THR 229 Ca 0.10 0.95 -0.18 0.00 0.31 0.00 0.00 61.69 62.86 1ghz s THR 229 Cb -0.09 -3.61 0.13 0.00 0.01 0.00 0.00 72.50 68.94 1ghz s THR 229 CO 0.02 0.15 1.25 -0.75 -0.69 0.00 0.00 174.62 174.60 1ghz s LYS 230 N -0.31 3.70 0.45 4.92 2.20 -0.14 -2.80 119.74 127.76 1ghz s LYS 230 Ca 0.56 -1.84 0.19 0.00 -0.36 0.00 0.00 55.97 54.52 1ghz s LYS 230 Cb -0.37 -5.02 1.15 0.00 -1.51 0.00 0.00 37.83 32.08 1ghz s LYS 230 CO 0.40 -1.84 1.90 0.28 -0.36 0.00 0.00 175.35 175.72 1ghz h VAL 231 N 5.73 0.71 -0.00 4.02 2.07 -1.66 -2.36 116.25 124.76 1ghz h VAL 231 Ca 0.20 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1ghz h VAL 231 Cb 0.99 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1ghz h VAL 231 CO 1.19 0.06 0.06 0.00 0.02 0.00 0.00 177.57 178.90 1ghz n ASN 233 N -3.05 0.37 -0.43 0.00 3.02 -0.89 -4.04 115.26 110.25 1ghz n ASN 233 Ca -0.03 0.35 0.04 0.00 -0.03 0.00 0.00 54.58 54.91 1ghz n ASN 233 Cb 0.13 -0.37 0.10 0.00 -0.61 0.00 0.00 39.78 39.02 1ghz n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1ghz n TYR 234 N -1.77 0.28 -0.19 3.10 4.01 0.15 -4.76 117.16 117.99 1ghz n TYR 234 Ca 0.06 -0.44 -0.04 0.00 -0.16 0.00 0.00 57.90 57.32 1ghz n TYR 234 Cb 0.37 -0.03 0.06 0.00 -0.31 0.00 0.00 39.34 39.43 1ghz n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1ghz h VAL 235 N 1.41 1.02 -0.56 -0.72 2.07 -1.69 0.57 116.25 118.35 1ghz h VAL 235 Ca 0.00 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 1ghz h VAL 235 Cb 0.62 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 1ghz h VAL 235 CO 0.00 0.12 0.24 -1.28 0.02 0.00 0.00 177.57 176.67 1ghz h SER 236 N 0.63 0.76 -0.38 0.57 0.87 -1.89 -0.60 113.55 113.50 1ghz h SER 236 Ca 0.24 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.62 1ghz h SER 236 Cb 0.08 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 1ghz h SER 236 CO -0.13 0.71 0.17 -0.25 -0.53 0.00 0.00 176.83 176.80 1ghz h TRP 237 N 0.77 0.57 0.31 2.24 7.01 -1.78 -0.88 115.95 124.19 1ghz h TRP 237 Ca 0.19 -0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.14 1ghz h TRP 237 Cb 0.17 -0.17 0.00 0.00 -2.10 0.00 0.00 29.16 27.06 1ghz h TRP 237 CO 0.00 0.50 -0.15 0.82 -2.79 0.00 0.00 178.44 176.82 1ghz h ILE 238 N 0.48 0.70 -0.97 2.65 2.04 -0.58 -0.42 117.51 121.41 1ghz h ILE 238 Ca 0.13 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.03 1ghz h ILE 238 Cb 0.15 0.70 -0.06 0.00 -0.74 0.00 0.00 36.82 36.87 1ghz h ILE 238 CO -0.01 0.00 0.63 0.11 0.00 0.00 0.00 178.15 178.87 1ghz h LYS 239 N -0.41 1.17 -0.23 2.37 1.57 -1.02 0.10 116.57 120.11 1ghz h LYS 239 Ca -0.04 -0.07 -0.13 0.00 -1.87 0.00 0.00 60.65 58.53 1ghz h LYS 239 Cb 0.32 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 1ghz h LYS 239 CO 0.07 0.77 -0.37 1.96 -0.57 0.00 0.00 179.45 181.31 1ghz h GLN 240 N 1.20 0.67 -0.29 3.15 4.20 -1.04 -2.72 115.11 120.28 1ghz h GLN 240 Ca 0.39 -0.40 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 1ghz h GLN 240 Cb 0.03 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 1ghz h GLN 240 CO -0.13 1.02 0.02 1.15 -0.67 0.00 0.00 178.83 180.22 1ghz h THR 241 N 0.38 1.25 0.00 -0.54 2.02 -0.70 -2.57 112.91 112.74 1ghz h THR 241 Ca 0.02 -0.87 -0.10 0.00 0.77 0.00 0.00 66.41 66.23 1ghz h THR 241 Cb 0.97 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 68.61 1ghz h THR 241 CO 0.09 0.28 -0.46 0.16 0.37 0.00 0.00 175.52 175.96 1ghz h ILE 242 N 0.30 1.31 0.00 3.11 3.07 -1.04 -2.57 117.51 121.70 1ghz h ILE 242 Ca 0.09 -1.59 0.00 0.00 1.55 0.00 0.00 64.86 64.91 1ghz h ILE 242 Cb 0.39 1.86 0.00 0.00 -0.27 0.00 0.00 36.82 38.80 1ghz h ILE 242 CO 0.01 0.45 0.00 0.00 -1.05 0.00 0.00 178.15 177.56 1ghz h ALA 243 N 1.54 1.00 -0.51 0.16 0.00 -1.36 -3.06 119.26 117.03 1ghz h ALA 243 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ghz h ALA 243 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1ghz h ALA 243 CO 0.06 0.00 0.00 0.43 0.00 0.00 0.00 179.25 179.74 1ghz n SER 244 N -2.86 3.43 0.00 0.00 7.64 -0.98 -5.10 113.62 115.74 1ghz n SER 244 Ca 0.02 -1.97 0.00 0.00 1.01 0.00 0.00 58.87 57.93 1ghz n SER 244 Cb 0.38 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 1ghz n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62