#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2by5 s VAL 17 N 0.00 5.38 -0.78 1.39 1.01 0.57 -4.01 120.40 123.97 2by5 s VAL 17 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.30 2by5 s VAL 17 Cb 0.00 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.87 2by5 s VAL 17 CO 0.00 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.17 2by5 n GLY 18 N 3.16 0.79 0.00 4.51 0.00 -1.24 -1.40 105.19 111.02 2by5 n GLY 18 Ca -0.15 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2by5 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2by5 n GLY 19 N -1.85 1.70 3.08 -0.02 0.00 -1.26 -4.85 105.19 101.99 2by5 n GLY 19 Ca -0.08 -1.92 -0.07 0.00 0.00 0.00 0.00 46.02 43.94 2by5 n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2by5 s TYR 20 N 2.22 0.45 -0.07 1.61 1.13 0.26 -4.94 117.35 117.99 2by5 s TYR 20 Ca 0.00 -0.94 -0.30 0.00 -1.41 0.00 0.00 57.07 54.42 2by5 s TYR 20 Cb 0.00 -0.33 -0.04 0.00 -1.10 0.00 0.00 41.96 40.48 2by5 s TYR 20 CO 0.00 -0.36 1.52 0.99 -2.51 0.00 0.00 175.55 175.19 2by5 s THR 21 N -3.53 3.77 0.14 -3.49 2.01 -1.26 -0.48 115.64 112.78 2by5 s THR 21 Ca 0.03 0.96 -0.17 0.00 0.31 0.00 0.00 61.69 62.82 2by5 s THR 21 Cb 0.05 -3.62 -0.02 0.00 0.01 0.00 0.00 72.50 68.92 2by5 s THR 21 CO -0.09 -0.07 1.78 0.00 -0.69 0.00 0.00 174.62 175.54 2by5 n GLY 23 N -1.10 2.58 3.71 0.00 0.00 -1.26 -4.85 105.19 104.27 2by5 n GLY 23 Ca -0.01 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.02 2by5 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2by5 s ALA 24 N -1.06 3.85 -1.91 4.61 0.00 -1.26 -2.39 121.76 123.60 2by5 s ALA 24 Ca 0.00 1.52 0.00 0.00 0.00 0.00 0.00 51.96 53.48 2by5 s ALA 24 Cb 0.00 -3.73 0.00 0.00 0.00 0.00 0.00 23.12 19.39 2by5 s ALA 24 CO 0.00 -1.08 0.00 0.09 0.00 0.00 0.00 175.76 174.77 2by5 n ASN 25 N 4.86 -5.61 -0.08 0.00 3.02 -1.26 -4.86 115.26 111.33 2by5 n ASN 25 Ca 0.17 0.21 0.13 0.00 -0.03 0.00 0.00 54.58 55.06 2by5 n ASN 25 Cb 0.37 -4.74 0.42 0.00 -0.61 0.00 0.00 39.78 35.21 2by5 n ASN 25 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2by5 n THR 26 N -3.31 0.00 -3.58 3.41 -2.24 -1.01 -4.25 114.28 103.31 2by5 n THR 26 Ca -0.22 -0.04 -0.27 0.00 -2.27 0.00 0.00 64.05 61.25 2by5 n THR 26 Cb 0.67 0.08 -0.10 0.00 -2.10 0.00 0.00 70.33 68.89 2by5 n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2by5 n VAL 27 N -1.21 0.89 0.62 2.28 0.31 -1.26 -4.99 118.33 114.97 2by5 n VAL 27 Ca 0.09 -4.53 0.11 0.00 -0.01 0.00 0.00 64.34 60.00 2by5 n VAL 27 Cb 0.33 -2.02 0.45 0.00 -0.91 0.00 0.00 33.84 31.68 2by5 n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2by5 n PRO 28 N 1.80 0.09 0.00 5.55 -0.04 -1.26 -1.59 135.00 139.54 2by5 n PRO 28 Ca 0.25 0.23 0.12 0.00 -0.04 0.00 0.00 63.50 64.05 2by5 n PRO 28 Cb 0.42 -1.64 0.20 0.00 -0.04 0.00 0.00 33.50 32.44 2by5 n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2by5 n TYR 29 N -1.80 0.00 -2.34 0.54 0.18 -1.14 -2.12 117.16 110.48 2by5 n TYR 29 Ca 0.04 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.40 2by5 n TYR 29 Cb 0.27 -0.17 -0.03 0.00 -0.38 0.00 0.00 39.34 39.03 2by5 n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 2by5 s GLN 30 N -2.87 4.37 0.24 -3.48 2.00 -0.62 -1.01 119.66 118.29 2by5 s GLN 30 Ca 0.14 1.85 0.11 0.00 -2.00 0.00 0.00 55.36 55.46 2by5 s GLN 30 Cb 0.18 -3.39 -0.05 0.00 0.80 0.00 0.00 33.01 30.55 2by5 s GLN 30 CO 0.69 -0.37 -0.19 0.14 -0.50 0.00 0.00 175.29 175.06 2by5 s VAL 31 N 1.42 2.57 -0.16 1.34 -7.23 -0.20 -4.47 120.40 113.67 2by5 s VAL 31 Ca 0.60 -2.17 -0.04 0.00 -1.81 0.00 0.00 61.98 58.56 2by5 s VAL 31 Cb -0.31 -2.30 -0.03 0.00 0.56 0.00 0.00 36.38 34.30 2by5 s VAL 31 CO 0.28 -0.27 -0.03 -0.55 -0.31 0.00 0.00 175.10 174.22 2by5 s SER 32 N -3.16 4.84 -0.17 4.85 0.15 -0.52 -2.24 113.70 117.44 2by5 s SER 32 Ca 0.26 -0.12 -0.18 0.00 0.70 0.00 0.00 55.95 56.61 2by5 s SER 32 Cb -0.06 -1.79 -0.04 0.00 -1.71 0.00 0.00 66.02 62.42 2by5 s SER 32 CO 0.14 0.17 0.51 -0.76 1.20 0.00 0.00 173.24 174.49 2by5 s LEU 33 N 0.34 4.20 -0.06 3.45 1.43 0.13 -0.72 118.68 127.45 2by5 s LEU 33 Ca -0.04 0.73 0.04 0.00 -1.03 0.00 0.00 54.13 53.83 2by5 s LEU 33 Cb -0.14 -2.71 0.00 0.00 0.03 0.00 0.00 46.19 43.37 2by5 s LEU 33 CO 0.03 -0.11 -0.17 0.21 0.23 0.00 0.00 176.35 176.54 2by5 s ASN 34 N 0.95 2.25 -0.36 2.29 2.47 -0.09 -1.20 114.94 121.26 2by5 s ASN 34 Ca 0.25 -0.38 0.12 0.00 0.42 0.00 0.00 52.86 53.27 2by5 s ASN 34 Cb -0.15 -0.87 0.45 0.00 -1.45 0.00 0.00 41.25 39.22 2by5 s ASN 34 CO 0.10 0.11 1.07 -1.54 -3.72 0.00 0.00 177.10 173.12 2by5 n SER 37 N 3.48 3.23 0.00 -4.21 3.41 -1.26 -0.82 113.62 117.45 2by5 n SER 37 Ca -0.20 -3.17 0.00 0.00 -0.26 0.00 0.00 58.87 55.24 2by5 n SER 37 Cb 0.52 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 2by5 n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2by5 n GLY 38 N -0.38 0.30 3.59 5.00 0.00 -1.26 -5.02 105.19 107.42 2by5 n GLY 38 Ca 0.25 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.20 2by5 n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2by5 s TYR 39 N -2.00 -0.24 0.25 1.61 -0.85 -1.26 -5.14 117.35 109.71 2by5 s TYR 39 Ca 0.00 0.34 -0.31 0.00 -0.52 0.00 0.00 57.07 56.58 2by5 s TYR 39 Cb 0.00 0.48 -0.11 0.00 0.38 0.00 0.00 41.96 42.71 2by5 s TYR 39 CO 0.00 -0.27 1.61 -1.58 -1.52 0.00 0.00 175.55 173.79 2by5 s HIS 40 N -1.59 2.87 0.00 -3.49 5.65 -1.26 -4.19 115.29 113.28 2by5 s HIS 40 Ca 0.04 0.67 0.00 0.00 0.25 0.00 0.00 55.06 56.02 2by5 s HIS 40 Cb -0.01 -4.04 0.00 0.00 -1.18 0.00 0.00 32.58 27.35 2by5 s HIS 40 CO -0.03 -3.65 0.00 1.97 -0.65 0.00 0.00 174.74 172.38 2by5 n PHE 41 N 2.93 0.00 -3.52 3.88 -1.74 -0.34 -4.96 117.46 113.72 2by5 n PHE 41 Ca 0.11 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.90 2by5 n PHE 41 Cb 0.37 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.34 2by5 n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2by5 s GLY 43 N -2.04 1.76 0.13 0.00 0.00 0.48 -0.69 107.32 106.97 2by5 s GLY 43 Ca 0.01 -1.57 -0.25 0.00 0.00 0.00 0.00 44.72 42.92 2by5 s GLY 43 CO -0.05 -0.95 1.08 -0.32 0.00 0.00 0.00 173.10 172.85 2by5 s GLY 44 N -4.77 -0.07 -0.08 0.20 0.00 -0.95 -3.72 107.32 97.93 2by5 s GLY 44 Ca 0.68 -0.04 0.01 0.00 0.00 0.00 0.00 44.72 45.37 2by5 s GLY 44 CO 0.47 1.80 -0.09 -0.56 0.00 0.00 0.00 173.10 174.71 2by5 s SER 45 N -3.27 1.77 -0.12 1.64 0.01 -0.25 -1.03 113.70 112.45 2by5 s SER 45 Ca 0.19 -0.27 -0.30 0.00 1.31 0.00 0.00 55.95 56.89 2by5 s SER 45 Cb -0.01 -0.77 -0.02 0.00 0.21 0.00 0.00 66.02 65.43 2by5 s SER 45 CO 0.03 -0.03 1.16 -0.22 0.41 0.00 0.00 173.24 174.59 2by5 s LEU 46 N 1.04 4.22 -0.00 2.44 2.96 -0.18 -0.86 118.68 128.30 2by5 s LEU 46 Ca -0.08 1.67 0.09 0.00 -0.22 0.00 0.00 54.13 55.59 2by5 s LEU 46 Cb -0.15 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 42.90 2by5 s LEU 46 CO -0.01 -0.62 0.35 2.30 -1.32 0.00 0.00 176.35 177.05 2by5 n ILE 47 N 4.92 0.00 -3.68 6.68 -5.35 -0.30 -0.87 119.36 120.75 2by5 n ILE 47 Ca 0.12 -0.28 -0.05 0.00 -0.27 0.00 0.00 62.75 62.27 2by5 n ILE 47 Cb 0.46 0.91 0.02 0.00 -1.74 0.00 0.00 39.64 39.29 2by5 n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 2by5 n ASN 48 N -1.28 -1.52 0.24 7.28 0.23 -1.19 -4.63 115.26 114.40 2by5 n ASN 48 Ca 0.01 -1.95 0.17 0.00 -0.53 0.00 0.00 54.58 52.28 2by5 n ASN 48 Cb 0.15 2.50 0.80 0.00 -2.08 0.00 0.00 39.78 41.15 2by5 n ASN 48 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2by5 h SER 49 N 1.47 0.00 0.00 0.53 4.64 -1.96 -3.14 113.55 115.09 2by5 h SER 49 Ca -0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 2by5 h SER 49 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 2by5 h SER 49 CO 0.30 0.00 -0.01 1.67 -0.87 0.00 0.00 176.83 177.91 2by5 n GLN 50 N -2.73 1.62 -4.11 4.77 7.27 -1.26 -0.03 117.38 122.91 2by5 n GLN 50 Ca -0.01 -1.10 -0.16 0.00 0.07 0.00 0.00 57.00 55.80 2by5 n GLN 50 Cb 0.15 -0.79 -0.15 0.00 2.41 0.00 0.00 30.24 31.86 2by5 n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 2by5 s TRP 51 N -0.61 0.43 -0.01 3.69 0.52 -1.19 -0.99 118.94 120.78 2by5 s TRP 51 Ca 0.01 -0.08 0.07 0.00 0.02 0.00 0.00 56.10 56.12 2by5 s TRP 51 Cb 0.01 -0.32 -0.02 0.00 -1.15 0.00 0.00 33.47 31.99 2by5 s TRP 51 CO 0.00 -0.04 -0.24 0.08 0.02 0.00 0.00 176.95 176.78 2by5 s VAL 52 N 0.10 2.26 -0.09 4.03 1.01 0.08 -1.15 120.40 126.64 2by5 s VAL 52 Ca -0.01 -1.10 0.01 0.00 0.00 0.00 0.00 61.98 60.89 2by5 s VAL 52 Cb -0.04 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.49 2by5 s VAL 52 CO -0.00 0.54 -0.11 0.54 0.00 0.00 0.00 175.10 176.06 2by5 s VAL 53 N -0.68 3.29 0.02 2.92 0.11 -0.04 -0.71 120.40 125.30 2by5 s VAL 53 Ca 0.11 -0.61 0.00 0.00 -2.93 0.00 0.00 61.98 58.55 2by5 s VAL 53 Cb -0.10 -2.34 -0.00 0.00 -1.53 0.00 0.00 36.38 32.41 2by5 s VAL 53 CO 0.00 0.57 0.01 -0.24 -3.33 0.00 0.00 175.10 172.11 2by5 n SER 54 N 2.74 -0.04 -4.82 3.54 2.88 -0.62 -1.09 113.62 116.21 2by5 n SER 54 Ca -0.18 -1.10 -0.36 0.00 -1.33 0.00 0.00 58.87 55.91 2by5 n SER 54 Cb 0.53 0.08 -0.06 0.00 -0.75 0.00 0.00 64.21 64.01 2by5 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2by5 s ALA 55 N -1.97 3.48 0.46 -1.46 0.00 -1.26 -1.13 121.76 119.88 2by5 s ALA 55 Ca 0.02 0.06 0.11 0.00 0.00 0.00 0.00 51.96 52.15 2by5 s ALA 55 Cb 0.00 -2.71 1.04 0.00 0.00 0.00 0.00 23.12 21.45 2by5 s ALA 55 CO 0.01 0.38 2.09 0.00 0.00 0.00 0.00 175.76 178.24 2by5 h ALA 56 N 3.58 1.83 0.00 0.00 0.00 -1.68 -1.35 119.26 121.63 2by5 h ALA 56 Ca -0.48 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2by5 h ALA 56 Cb 1.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2by5 h ALA 56 CO 0.65 0.16 0.00 -2.39 0.00 0.00 0.00 179.25 177.67 2by5 n HIS 57 N -4.49 0.00 1.44 0.00 1.44 -1.26 -1.22 115.22 111.13 2by5 n HIS 57 Ca 0.00 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.84 2by5 n HIS 57 Cb 0.08 -0.37 0.50 0.00 0.12 0.00 0.00 29.99 30.32 2by5 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2by5 n TYR 59 N 0.15 2.75 -3.59 0.00 9.36 -0.36 -4.99 117.16 120.48 2by5 n TYR 59 Ca 0.18 0.25 -0.09 0.00 3.32 0.00 0.00 57.90 61.56 2by5 n TYR 59 Cb 0.33 -2.59 -0.02 0.00 -0.63 0.00 0.00 39.34 36.43 2by5 n TYR 59 CO 0.00 0.00 0.00 -1.59 0.22 0.00 0.00 176.86 175.49 2by5 s LYS 60 N -0.24 1.31 0.59 2.98 -2.85 -1.26 -5.14 119.74 115.12 2by5 s LYS 60 Ca 0.66 -0.59 -0.09 0.00 -1.00 0.00 0.00 55.97 54.95 2by5 s LYS 60 Cb -0.52 0.53 -0.02 0.00 -2.06 0.00 0.00 37.83 35.76 2by5 s LYS 60 CO 0.46 -0.58 0.95 -1.54 0.10 0.00 0.00 175.35 174.74 2by5 s SER 61 N -2.77 5.96 -0.59 0.03 1.04 -1.26 -4.46 113.70 111.65 2by5 s SER 61 Ca 0.06 1.09 -0.03 0.00 0.48 0.00 0.00 55.95 57.55 2by5 s SER 61 Cb -0.02 -2.15 0.00 0.00 0.10 0.00 0.00 66.02 63.95 2by5 s SER 61 CO -0.05 -0.92 0.34 0.61 0.98 0.00 0.00 173.24 174.20 2by5 n GLY 62 N -2.64 0.27 3.73 7.32 0.00 -1.26 -5.00 105.19 107.61 2by5 n GLY 62 Ca 0.04 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.28 2by5 n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2by5 s ILE 63 N -2.93 4.64 -0.17 -0.61 1.01 -1.26 -4.58 121.20 117.30 2by5 s ILE 63 Ca 0.17 1.98 -0.05 0.00 0.00 0.00 0.00 60.65 62.75 2by5 s ILE 63 Cb -0.07 -4.28 -0.03 0.00 0.01 0.00 0.00 42.46 38.08 2by5 s ILE 63 CO 0.21 0.28 0.00 -1.58 0.00 0.00 0.00 174.94 173.86 2by5 s GLN 64 N 0.26 3.78 -0.13 2.79 0.74 -0.00 -1.17 119.66 125.93 2by5 s GLN 64 Ca 0.47 -0.45 -0.17 0.00 0.05 0.00 0.00 55.36 55.25 2by5 s GLN 64 Cb -0.22 -3.05 -0.04 0.00 1.10 0.00 0.00 33.01 30.80 2by5 s GLN 64 CO 0.28 0.22 0.43 0.08 -0.55 0.00 0.00 175.29 175.76 2by5 s VAL 65 N 0.45 5.22 -0.28 1.34 1.01 0.29 -0.91 120.40 127.51 2by5 s VAL 65 Ca -0.01 0.86 -0.02 0.00 0.00 0.00 0.00 61.98 62.81 2by5 s VAL 65 Cb -0.14 -3.77 0.04 0.00 0.00 0.00 0.00 36.38 32.51 2by5 s VAL 65 CO 0.02 0.34 -0.02 -0.13 0.00 0.00 0.00 175.10 175.30 2by5 s ARG 66 N 0.61 2.56 0.29 2.72 0.52 0.10 -0.96 118.95 124.79 2by5 s ARG 66 Ca 0.24 -1.17 0.06 0.00 -0.52 0.00 0.00 55.73 54.34 2by5 s ARG 66 Cb -0.15 -3.11 -0.02 0.00 0.52 0.00 0.00 34.95 32.20 2by5 s ARG 66 CO 0.09 -0.54 0.41 -0.51 0.02 0.00 0.00 175.30 174.77 2by5 s LEU 67 N 1.27 4.12 -1.22 2.53 2.01 0.43 -1.44 118.68 126.38 2by5 s LEU 67 Ca -0.04 -0.08 0.00 0.00 0.01 0.00 0.00 54.13 54.03 2by5 s LEU 67 Cb -0.19 -2.79 0.00 0.00 0.01 0.00 0.00 46.19 43.22 2by5 s LEU 67 CO -0.02 -0.26 0.00 0.61 1.01 0.00 0.00 176.35 177.69 2by5 n GLY 69 N -1.52 1.24 3.79 -3.19 0.00 -1.26 -0.47 105.19 103.78 2by5 n GLY 69 Ca -0.04 -0.36 -0.38 0.00 0.00 0.00 0.00 46.02 45.24 2by5 n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2by5 s GLU 70 N -2.88 4.42 0.00 1.61 0.41 -1.26 -3.78 118.70 117.22 2by5 s GLU 70 Ca 0.00 1.02 0.00 0.00 -0.41 0.00 0.00 54.97 55.58 2by5 s GLU 70 Cb 0.00 -3.12 0.00 0.00 -1.78 0.00 0.00 34.13 29.23 2by5 s GLU 70 CO 0.00 0.51 0.00 -3.47 -0.49 0.00 0.00 175.26 171.81 2by5 n ASP 71 N 1.29 0.00 -4.63 -0.19 2.03 -1.26 -4.56 116.55 109.23 2by5 n ASP 71 Ca -0.05 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.83 2by5 n ASP 71 Cb 0.50 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.87 2by5 n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2by5 s ASN 72 N 0.80 6.58 0.00 1.67 3.84 -1.25 -3.62 114.94 122.96 2by5 s ASN 72 Ca 0.00 1.20 0.27 0.00 0.21 0.00 0.00 52.86 54.54 2by5 s ASN 72 Cb 0.00 -2.54 1.47 0.00 -0.55 0.00 0.00 41.25 39.63 2by5 s ASN 72 CO 0.00 -1.16 1.94 2.30 -2.79 0.00 0.00 177.10 177.40 2by5 n ILE 73 N 6.37 0.09 0.30 -5.21 -5.35 -0.35 -2.94 119.36 112.26 2by5 n ILE 73 Ca 0.16 0.02 0.06 0.00 -0.27 0.00 0.00 62.75 62.72 2by5 n ILE 73 Cb 0.47 -0.58 0.09 0.00 -1.74 0.00 0.00 39.64 37.87 2by5 n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2by5 n ASN 74 N -1.18 2.35 -3.90 7.28 3.02 -1.26 -4.97 115.26 116.60 2by5 n ASN 74 Ca 0.16 -1.67 -0.17 0.00 -0.03 0.00 0.00 54.58 52.87 2by5 n ASN 74 Cb 0.17 -0.08 -0.15 0.00 -0.61 0.00 0.00 39.78 39.10 2by5 n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2by5 s VAL 75 N -1.02 0.38 -0.35 2.41 1.01 -1.15 -5.11 120.40 116.56 2by5 s VAL 75 Ca 0.18 -0.11 -0.27 0.00 0.00 0.00 0.00 61.98 61.79 2by5 s VAL 75 Cb 0.11 -0.38 0.01 0.00 0.00 0.00 0.00 36.38 36.12 2by5 s VAL 75 CO 0.16 0.15 0.96 -0.69 0.00 0.00 0.00 175.10 175.69 2by5 s VAL 76 N 0.49 4.57 -0.48 2.92 1.01 -1.26 -4.69 120.40 122.96 2by5 s VAL 76 Ca -0.06 1.36 0.12 0.00 0.00 0.00 0.00 61.98 63.40 2by5 s VAL 76 Cb -0.09 -4.35 -0.14 0.00 0.00 0.00 0.00 36.38 31.81 2by5 s VAL 76 CO -0.00 -0.50 0.47 -0.62 0.00 0.00 0.00 175.10 174.44 2by5 n GLU 77 N 6.77 2.75 0.00 2.72 1.02 -1.26 -5.02 120.64 127.62 2by5 n GLU 77 Ca 0.08 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 2by5 n GLU 77 Cb 0.48 -1.09 0.00 0.00 -0.02 0.00 0.00 31.44 30.81 2by5 n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2by5 n GLY 78 N 1.35 1.43 0.22 0.62 0.00 -1.26 -4.98 105.19 102.56 2by5 n GLY 78 Ca 0.02 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.06 2by5 n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2by5 n ASN 79 N 0.00 2.34 -4.78 1.61 3.02 -1.26 -5.06 115.26 111.13 2by5 n ASN 79 Ca 0.00 -2.07 -0.36 0.00 -0.03 0.00 0.00 54.58 52.12 2by5 n ASN 79 Cb 0.00 -0.10 -0.03 0.00 -0.61 0.00 0.00 39.78 39.04 2by5 n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2by5 s GLU 80 N -1.13 3.84 -0.10 3.52 8.01 -1.25 -4.28 118.70 127.31 2by5 s GLU 80 Ca 0.09 1.54 0.01 0.00 0.01 0.00 0.00 54.97 56.62 2by5 s GLU 80 Cb 0.06 -2.29 0.02 0.00 -4.31 0.00 0.00 34.13 27.61 2by5 s GLU 80 CO 0.05 -0.43 -0.10 -0.65 0.01 0.00 0.00 175.26 174.14 2by5 s GLN 81 N -2.90 1.63 -0.27 1.61 -0.21 0.38 -4.96 119.66 114.95 2by5 s GLN 81 Ca 0.64 -0.33 -0.07 0.00 0.02 0.00 0.00 55.36 55.63 2by5 s GLN 81 Cb -0.22 -1.53 -0.01 0.00 1.00 0.00 0.00 33.01 32.25 2by5 s GLN 81 CO 0.26 -0.14 0.06 -0.06 -2.12 0.00 0.00 175.29 173.29 2by5 s PHE 82 N 1.26 3.09 -0.06 0.91 0.08 -1.26 -0.43 117.98 121.58 2by5 s PHE 82 Ca -0.03 -0.77 -0.00 0.00 0.12 0.00 0.00 56.93 56.24 2by5 s PHE 82 Cb -0.14 -2.23 0.03 0.00 -0.57 0.00 0.00 43.02 40.11 2by5 s PHE 82 CO -0.03 -0.50 -0.01 0.42 -0.10 0.00 0.00 175.22 175.00 2by5 s ILE 83 N 1.54 0.40 0.51 0.64 1.01 -0.13 -4.98 121.20 120.17 2by5 s ILE 83 Ca 0.04 0.05 -0.22 0.00 0.00 0.00 0.00 60.65 60.53 2by5 s ILE 83 Cb -0.16 -0.51 -0.06 0.00 0.01 0.00 0.00 42.46 41.74 2by5 s ILE 83 CO 0.02 0.24 1.23 -0.44 0.00 0.00 0.00 174.94 175.98 2by5 s SER 84 N 1.58 5.75 0.27 3.58 0.01 -1.26 -0.55 113.70 123.08 2by5 s SER 84 Ca -0.01 2.44 -0.29 0.00 1.31 0.00 0.00 55.95 59.40 2by5 s SER 84 Cb -0.13 -2.61 -0.09 0.00 0.21 0.00 0.00 66.02 63.40 2by5 s SER 84 CO -0.03 -1.21 1.11 0.00 0.41 0.00 0.00 173.24 173.51 2by5 s ALA 85 N -1.49 3.41 -0.15 1.44 0.00 -0.32 -0.84 121.76 123.81 2by5 s ALA 85 Ca 0.68 0.90 0.20 0.00 0.00 0.00 0.00 51.96 53.75 2by5 s ALA 85 Cb -0.32 -3.33 -0.15 0.00 0.00 0.00 0.00 23.12 19.32 2by5 s ALA 85 CO 0.38 -0.18 0.76 -1.13 0.00 0.00 0.00 175.76 175.58 2by5 n SER 86 N 1.28 0.57 -3.51 0.00 3.41 0.29 -4.74 113.62 110.91 2by5 n SER 86 Ca -0.01 0.23 -0.16 0.00 -0.26 0.00 0.00 58.87 58.67 2by5 n SER 86 Cb 0.45 0.80 -0.05 0.00 -0.26 0.00 0.00 64.21 65.14 2by5 n SER 86 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2by5 s LYS 87 N -3.20 1.02 0.09 4.33 2.20 -1.23 -5.01 119.74 117.93 2by5 s LYS 87 Ca -0.04 0.14 0.01 0.00 -0.36 0.00 0.00 55.97 55.73 2by5 s LYS 87 Cb 0.10 0.48 -0.04 0.00 -1.51 0.00 0.00 37.83 36.86 2by5 s LYS 87 CO 0.83 -0.34 -0.06 -1.54 -0.36 0.00 0.00 175.35 173.88 2by5 s SER 88 N -1.40 1.01 -0.26 1.43 1.04 -1.26 -1.30 113.70 112.96 2by5 s SER 88 Ca -0.08 -1.00 -0.03 0.00 0.48 0.00 0.00 55.95 55.32 2by5 s SER 88 Cb -0.00 0.12 0.10 0.00 0.10 0.00 0.00 66.02 66.34 2by5 s SER 88 CO 0.06 -0.49 0.19 -0.63 0.98 0.00 0.00 173.24 173.35 2by5 s ILE 89 N -3.65 -0.21 0.36 -1.02 1.01 0.61 -4.99 121.20 113.31 2by5 s ILE 89 Ca 0.10 -0.50 -0.26 0.00 0.00 0.00 0.00 60.65 60.00 2by5 s ILE 89 Cb 0.06 -0.88 -0.09 0.00 0.01 0.00 0.00 42.46 41.56 2by5 s ILE 89 CO -0.06 -0.51 1.11 -0.69 0.00 0.00 0.00 174.94 174.80 2by5 s VAL 90 N 2.22 3.42 0.31 2.92 1.01 -1.26 -0.91 120.40 128.11 2by5 s VAL 90 Ca 0.08 1.23 -0.28 0.00 0.00 0.00 0.00 61.98 63.01 2by5 s VAL 90 Cb -0.15 -3.70 -0.13 0.00 0.00 0.00 0.00 36.38 32.39 2by5 s VAL 90 CO -0.28 0.14 1.13 1.57 0.00 0.00 0.00 175.10 177.66 2by5 n HIS 91 N 0.37 1.69 0.14 5.22 -0.00 -0.62 -4.83 115.22 117.19 2by5 n HIS 91 Ca 0.03 0.64 0.15 0.00 0.46 0.00 0.00 57.72 59.00 2by5 n HIS 91 Cb 0.47 -2.32 0.69 0.00 -0.12 0.00 0.00 29.99 28.71 2by5 n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2by5 h PRO 92 N 2.21 0.00 -0.34 1.57 0.13 -1.93 -2.14 132.00 131.49 2by5 h PRO 92 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2by5 h PRO 92 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2by5 h PRO 92 CO 0.61 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.81 2by5 n SER 93 N -4.36 3.87 -4.70 1.44 7.64 -1.26 -5.01 113.62 111.25 2by5 n SER 93 Ca 0.03 -2.71 -0.44 0.00 1.01 0.00 0.00 58.87 56.77 2by5 n SER 93 Cb 0.35 -0.48 -0.03 0.00 -1.01 0.00 0.00 64.21 63.04 2by5 n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2by5 n TYR 94 N -0.02 2.56 -4.02 1.43 9.36 -0.81 -4.67 117.16 121.00 2by5 n TYR 94 Ca 0.20 0.16 -0.34 0.00 3.32 0.00 0.00 57.90 61.24 2by5 n TYR 94 Cb 0.80 -2.61 -0.15 0.00 -0.63 0.00 0.00 39.34 36.75 2by5 n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 2by5 s ASN 95 N 0.98 4.10 0.27 2.98 3.84 -0.70 -5.00 114.94 121.41 2by5 s ASN 95 Ca 0.75 -0.94 0.26 0.00 0.21 0.00 0.00 52.86 53.14 2by5 s ASN 95 Cb -0.58 -1.60 0.88 0.00 -0.55 0.00 0.00 41.25 39.40 2by5 s ASN 95 CO 0.36 -0.11 1.76 0.77 -2.79 0.00 0.00 177.10 177.08 2by5 h SER 96 N 7.95 0.00 0.04 -4.21 4.64 -1.93 0.27 113.55 120.29 2by5 h SER 96 Ca -0.32 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.86 2by5 h SER 96 Cb 1.10 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.20 2by5 h SER 96 CO 0.56 0.00 -0.56 0.78 -0.87 0.00 0.00 176.83 176.74 2by5 h ASN 97 N 0.00 0.43 0.36 4.97 2.35 -1.97 -3.36 115.58 118.36 2by5 h ASN 97 Ca 0.00 -0.82 0.00 0.00 -0.55 0.00 0.00 56.30 54.93 2by5 h ASN 97 Cb 0.60 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.84 2by5 h ASN 97 CO 0.00 1.21 -1.13 0.35 -1.65 0.00 0.00 177.43 176.21 2by5 n THR 98 N -4.27 0.14 -1.49 2.81 -2.24 -1.18 -4.96 114.28 103.10 2by5 n THR 98 Ca -0.11 -0.25 -0.17 0.00 -2.27 0.00 0.00 64.05 61.25 2by5 n THR 98 Cb 0.67 0.25 -0.07 0.00 -2.10 0.00 0.00 70.33 69.08 2by5 n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2by5 n LEU 99 N -1.96 -1.16 -4.75 3.22 4.77 0.93 -4.99 117.00 113.07 2by5 n LEU 99 Ca 0.01 0.42 -0.41 0.00 -0.03 0.00 0.00 56.01 56.00 2by5 n LEU 99 Cb 0.44 -2.58 -0.02 0.00 -2.33 0.00 0.00 43.42 38.93 2by5 n LEU 99 CO 0.41 -0.97 1.05 0.21 -1.33 0.00 0.00 177.39 176.76 2by5 s ASN 100 N -2.73 6.75 -0.88 -1.43 2.47 -1.20 -2.99 114.94 114.92 2by5 s ASN 100 Ca 0.00 2.58 -0.02 0.00 0.42 0.00 0.00 52.86 55.85 2by5 s ASN 100 Cb 0.00 -2.62 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 2by5 s ASN 100 CO 0.00 -0.62 0.75 0.59 -3.72 0.00 0.00 177.10 174.10 2by5 n ASN 101 N 2.20 -2.94 -4.11 -4.21 3.02 -1.26 -1.72 115.26 106.23 2by5 n ASN 101 Ca 0.06 -0.42 -0.43 0.00 -0.03 0.00 0.00 54.58 53.75 2by5 n ASN 101 Cb 0.41 -3.76 0.00 0.00 -0.61 0.00 0.00 39.78 35.82 2by5 n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2by5 n ASP 102 N -2.27 4.70 -3.78 6.41 2.03 -1.16 -4.24 116.55 118.24 2by5 n ASP 102 Ca -0.14 -2.96 -0.13 0.00 0.52 0.00 0.00 54.79 52.08 2by5 n ASP 102 Cb 0.60 -1.62 -0.11 0.00 -0.72 0.00 0.00 41.12 39.27 2by5 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2by5 s ILE 103 N 2.43 0.01 0.13 5.18 2.07 -1.26 -3.82 121.20 125.94 2by5 s ILE 103 Ca 0.46 -0.12 -0.04 0.00 -1.41 0.00 0.00 60.65 59.54 2by5 s ILE 103 Cb 0.07 -0.43 -0.03 0.00 0.13 0.00 0.00 42.46 42.20 2by5 s ILE 103 CO -0.01 -0.07 0.14 0.00 -1.91 0.00 0.00 174.94 173.09 2by5 s MET 104 N -0.18 0.98 0.01 3.50 0.23 -0.28 -1.59 119.30 121.98 2by5 s MET 104 Ca -0.03 -1.31 0.08 0.00 -1.03 0.00 0.00 55.69 53.40 2by5 s MET 104 Cb -0.03 0.29 -0.03 0.00 -1.53 0.00 0.00 34.83 33.54 2by5 s MET 104 CO 0.01 -0.31 -0.22 -0.51 -2.03 0.00 0.00 175.02 171.96 2by5 s LEU 105 N -3.00 2.34 -0.10 0.18 1.43 -0.09 -1.59 118.68 117.85 2by5 s LEU 105 Ca 0.19 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.84 2by5 s LEU 105 Cb 0.06 -1.40 0.02 0.00 0.03 0.00 0.00 46.19 44.90 2by5 s LEU 105 CO -0.00 0.29 -0.11 -0.63 0.23 0.00 0.00 176.35 176.12 2by5 s ILE 106 N -0.78 1.19 -0.08 -0.59 1.01 0.11 -0.29 121.20 121.77 2by5 s ILE 106 Ca 0.12 -0.45 -0.12 0.00 0.00 0.00 0.00 60.65 60.20 2by5 s ILE 106 Cb -0.10 -1.13 -0.05 0.00 0.01 0.00 0.00 42.46 41.19 2by5 s ILE 106 CO 0.02 0.38 0.30 -0.75 0.00 0.00 0.00 174.94 174.89 2by5 s LYS 107 N 1.17 3.89 0.17 2.79 2.20 -0.42 -0.74 119.74 128.80 2by5 s LYS 107 Ca -0.04 0.16 -0.25 0.00 -0.36 0.00 0.00 55.97 55.48 2by5 s LYS 107 Cb -0.14 -3.28 -0.08 0.00 -1.51 0.00 0.00 37.83 32.82 2by5 s LYS 107 CO -0.03 0.57 0.78 -0.51 -0.36 0.00 0.00 175.35 175.80 2by5 s LEU 108 N -0.57 4.57 0.52 5.43 1.43 -0.16 -0.55 118.68 129.35 2by5 s LEU 108 Ca 0.19 1.64 0.22 0.00 -1.03 0.00 0.00 54.13 55.14 2by5 s LEU 108 Cb -0.14 -3.33 1.38 0.00 0.03 0.00 0.00 46.19 44.13 2by5 s LEU 108 CO 0.08 0.19 2.12 0.11 0.23 0.00 0.00 176.35 179.08 2by5 h LYS 109 N 4.24 0.00 -4.39 1.70 1.57 -1.28 -3.43 116.57 114.98 2by5 h LYS 109 Ca -0.47 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.12 2by5 h LYS 109 Cb 1.20 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.35 2by5 h LYS 109 CO 0.66 0.08 -0.70 -1.54 -0.57 0.00 0.00 179.45 177.38 2by5 s SER 110 N -6.62 0.72 0.18 0.86 1.04 -1.26 -5.01 113.70 103.62 2by5 s SER 110 Ca -0.04 -0.85 -0.30 0.00 0.48 0.00 0.00 55.95 55.24 2by5 s SER 110 Cb 0.15 0.12 -0.08 0.00 0.10 0.00 0.00 66.02 66.32 2by5 s SER 110 CO 0.63 -0.44 1.18 0.00 0.98 0.00 0.00 173.24 175.58 2by5 s ALA 111 N -3.03 3.43 0.55 5.32 0.00 -1.26 -4.83 121.76 121.93 2by5 s ALA 111 Ca 0.02 0.93 -0.20 0.00 0.00 0.00 0.00 51.96 52.71 2by5 s ALA 111 Cb 0.01 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.68 2by5 s ALA 111 CO -0.05 -0.35 1.20 0.00 0.00 0.00 0.00 175.76 176.56 2by5 s ALA 112 N -0.10 2.70 -0.39 0.00 0.00 0.96 -4.99 121.76 119.95 2by5 s ALA 112 Ca 0.52 0.99 -0.23 0.00 0.00 0.00 0.00 51.96 53.24 2by5 s ALA 112 Cb -0.32 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.38 2by5 s ALA 112 CO 0.36 -0.99 0.80 -1.12 0.00 0.00 0.00 175.76 174.81 2by5 s SER 113 N -1.50 6.52 -0.07 0.00 0.01 -1.26 -4.85 113.70 112.55 2by5 s SER 113 Ca 0.73 0.23 -0.15 0.00 1.31 0.00 0.00 55.95 58.07 2by5 s SER 113 Cb -0.30 -2.40 -0.05 0.00 0.21 0.00 0.00 66.02 63.48 2by5 s SER 113 CO 0.34 -0.81 0.39 -0.76 0.41 0.00 0.00 173.24 172.82 2by5 s LEU 114 N 3.21 4.37 0.00 2.44 1.43 -1.26 -4.80 118.68 124.07 2by5 s LEU 114 Ca 0.32 0.81 -0.08 0.00 -1.03 0.00 0.00 54.13 54.15 2by5 s LEU 114 Cb -0.13 -2.55 0.03 0.00 0.03 0.00 0.00 46.19 43.57 2by5 s LEU 114 CO 0.19 0.20 0.42 -0.46 0.23 0.00 0.00 176.35 176.92 2by5 n ASN 115 N 2.68 -1.02 -0.22 2.29 0.23 -0.82 -5.03 115.26 113.36 2by5 n ASN 115 Ca -0.12 -1.66 0.01 0.00 -0.53 0.00 0.00 54.58 52.28 2by5 n ASN 115 Cb 0.52 1.69 0.25 0.00 -2.08 0.00 0.00 39.78 40.16 2by5 n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2by5 h SER 116 N 0.95 0.86 1.33 0.53 4.64 -2.00 -3.03 113.55 116.84 2by5 h SER 116 Ca -0.15 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2by5 h SER 116 Cb 0.59 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2by5 h SER 116 CO 0.20 0.62 -0.64 0.03 -0.87 0.00 0.00 176.83 176.16 2by5 h ARG 117 N 1.01 0.00 -4.03 4.77 3.08 -1.93 -3.42 114.38 113.86 2by5 h ARG 117 Ca 0.28 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.79 2by5 h ARG 117 Cb -0.09 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 29.57 2by5 h ARG 117 CO -0.06 0.00 -0.78 0.08 -1.07 0.00 0.00 179.97 178.13 2by5 s VAL 118 N -3.30 0.99 -0.02 2.04 1.01 -1.14 -4.50 120.40 115.47 2by5 s VAL 118 Ca 0.02 -0.64 -0.15 0.00 0.00 0.00 0.00 61.98 61.22 2by5 s VAL 118 Cb 0.08 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 35.24 2by5 s VAL 118 CO 0.75 0.04 0.31 0.00 0.00 0.00 0.00 175.10 176.20 2by5 s ALA 119 N 1.67 -0.79 0.65 5.51 0.00 -0.90 -1.95 121.76 125.94 2by5 s ALA 119 Ca -0.00 0.38 -0.12 0.00 0.00 0.00 0.00 51.96 52.22 2by5 s ALA 119 Cb -0.16 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 2by5 s ALA 119 CO -0.07 -0.25 1.05 -1.54 0.00 0.00 0.00 175.76 174.94 2by5 s SER 120 N -1.20 5.67 -0.08 0.00 1.04 -1.26 -2.87 113.70 115.00 2by5 s SER 120 Ca -0.12 1.64 -0.01 0.00 0.48 0.00 0.00 55.95 57.94 2by5 s SER 120 Cb -0.05 -2.50 -0.03 0.00 0.10 0.00 0.00 66.02 63.54 2by5 s SER 120 CO 0.04 -1.25 -0.04 -0.51 0.98 0.00 0.00 173.24 172.46 2by5 s ILE 121 N -2.87 3.92 0.43 -1.02 1.10 -0.05 -4.86 121.20 117.84 2by5 s ILE 121 Ca 0.59 -0.39 -0.25 0.00 -0.51 0.00 0.00 60.65 60.09 2by5 s ILE 121 Cb -0.14 -2.63 -0.08 0.00 0.15 0.00 0.00 42.46 39.76 2by5 s ILE 121 CO 0.48 0.59 1.26 -0.44 -2.11 0.00 0.00 174.94 174.72 2by5 s SER 122 N -0.68 6.21 0.48 4.50 0.01 -1.26 -4.58 113.70 118.38 2by5 s SER 122 Ca 0.10 2.55 -0.19 0.00 1.31 0.00 0.00 55.95 59.73 2by5 s SER 122 Cb -0.11 -2.63 -0.09 0.00 0.21 0.00 0.00 66.02 63.40 2by5 s SER 122 CO 0.02 -0.91 0.98 -0.76 0.41 0.00 0.00 173.24 172.98 2by5 s LEU 123 N -2.66 3.76 0.54 2.44 1.43 -1.26 -0.94 118.68 121.98 2by5 s LEU 123 Ca 0.60 1.65 -0.19 0.00 -1.03 0.00 0.00 54.13 55.16 2by5 s LEU 123 Cb -0.35 -4.53 -0.06 0.00 0.03 0.00 0.00 46.19 41.28 2by5 s LEU 123 CO 0.44 -0.54 1.11 -2.16 0.23 0.00 0.00 176.35 175.43 2by5 s PRO 124 N -3.65 3.43 -0.03 1.29 0.04 -1.26 -4.77 135.00 130.05 2by5 s PRO 124 Ca 0.61 1.53 0.21 0.00 0.04 0.00 0.00 61.00 63.40 2by5 s PRO 124 Cb -0.10 -2.02 -0.32 0.00 0.04 0.00 0.00 34.50 32.09 2by5 s PRO 124 CO 0.23 -0.77 0.51 0.25 0.04 0.00 0.00 177.00 177.26 2by5 n THR 125 N -1.29 0.00 -4.04 1.26 -2.24 -1.26 -4.96 114.28 101.74 2by5 n THR 125 Ca 0.11 -0.44 -0.10 0.00 -2.27 0.00 0.00 64.05 61.35 2by5 n THR 125 Cb 0.51 0.12 -0.11 0.00 -2.10 0.00 0.00 70.33 68.75 2by5 n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2by5 s SER 127 N -4.29 0.55 0.58 3.42 1.04 -1.26 -5.15 113.70 108.58 2by5 s SER 127 Ca -0.06 -0.65 -0.18 0.00 0.48 0.00 0.00 55.95 55.54 2by5 s SER 127 Cb 0.14 0.10 -0.04 0.00 0.10 0.00 0.00 66.02 66.31 2by5 s SER 127 CO 0.88 -0.34 1.10 0.00 0.98 0.00 0.00 173.24 175.86 2by5 s ALA 129 N -2.07 3.42 0.15 0.00 0.00 -1.26 -5.10 121.76 116.90 2by5 s ALA 129 Ca 0.69 -0.48 0.04 0.00 0.00 0.00 0.00 51.96 52.21 2by5 s ALA 129 Cb -0.21 -2.57 -0.04 0.00 0.00 0.00 0.00 23.12 20.31 2by5 s ALA 129 CO 0.32 -0.25 0.18 -1.12 0.00 0.00 0.00 175.76 174.88 2by5 s SER 130 N -3.91 5.80 0.30 0.00 0.01 -1.26 -5.06 113.70 109.58 2by5 s SER 130 Ca 0.47 -0.01 -0.29 0.00 1.31 0.00 0.00 55.95 57.44 2by5 s SER 130 Cb -0.10 -1.61 -0.13 0.00 0.21 0.00 0.00 66.02 64.39 2by5 s SER 130 CO 0.42 0.08 1.19 0.00 0.41 0.00 0.00 173.24 175.34 2by5 n ALA 132 N -0.31 0.60 0.00 1.44 0.00 -1.26 -1.70 120.51 119.29 2by5 n ALA 132 Ca -0.08 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2by5 n ALA 132 Cb 0.54 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.83 2by5 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2by5 n GLY 133 N 1.17 3.45 3.71 0.00 0.00 0.41 -4.97 105.19 108.98 2by5 n GLY 133 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2by5 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2by5 s THR 134 N -2.85 2.66 0.05 2.61 2.01 -0.69 -4.68 115.64 114.76 2by5 s THR 134 Ca 0.00 0.42 -0.26 0.00 0.31 0.00 0.00 61.69 62.16 2by5 s THR 134 Cb 0.00 -3.27 -0.05 0.00 0.01 0.00 0.00 72.50 69.19 2by5 s THR 134 CO 0.00 0.03 0.83 -1.58 -0.69 0.00 0.00 174.62 173.20 2by5 s GLN 135 N 1.45 4.55 0.25 4.92 2.00 -1.26 -1.25 119.66 130.32 2by5 s GLN 135 Ca 0.71 1.17 0.06 0.00 -2.00 0.00 0.00 55.36 55.30 2by5 s GLN 135 Cb -0.43 -3.38 -0.05 0.00 0.80 0.00 0.00 33.01 29.94 2by5 s GLN 135 CO 0.32 0.22 -0.05 0.00 -0.50 0.00 0.00 175.29 175.28 2by5 s LEU 137 N -3.38 2.89 -0.07 0.00 2.96 0.78 -1.26 118.68 120.59 2by5 s LEU 137 Ca 0.28 -0.38 0.02 0.00 -0.22 0.00 0.00 54.13 53.83 2by5 s LEU 137 Cb 0.04 -1.73 -0.03 0.00 0.50 0.00 0.00 46.19 44.98 2by5 s LEU 137 CO 0.10 0.01 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.40 2by5 s ILE 138 N 1.32 3.33 0.05 6.68 1.01 0.19 -1.34 121.20 132.44 2by5 s ILE 138 Ca 0.04 -0.61 -0.07 0.00 0.00 0.00 0.00 60.65 60.01 2by5 s ILE 138 Cb -0.14 -2.35 -0.01 0.00 0.01 0.00 0.00 42.46 39.97 2by5 s ILE 138 CO -0.02 0.58 0.13 -0.94 0.00 0.00 0.00 174.94 174.69 2by5 s SER 139 N -0.56 0.16 0.00 3.58 1.04 -1.20 -0.48 113.70 116.23 2by5 s SER 139 Ca 0.08 -0.55 0.00 0.00 0.48 0.00 0.00 55.95 55.96 2by5 s SER 139 Cb -0.12 0.26 0.00 0.00 0.10 0.00 0.00 66.02 66.27 2by5 s SER 139 CO 0.02 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.28 2by5 n GLY 140 N 0.54 -0.36 1.42 7.32 0.00 -0.46 -4.35 105.19 109.29 2by5 n GLY 140 Ca -0.18 -1.15 0.06 0.00 0.00 0.00 0.00 46.02 44.75 2by5 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2by5 n TRP 141 N -0.62 1.57 -1.68 1.61 8.01 -1.26 -1.81 117.44 123.24 2by5 n TRP 141 Ca 0.00 -0.90 -0.26 0.00 -1.31 0.00 0.00 57.50 55.03 2by5 n TRP 141 Cb 0.00 -0.45 0.19 0.00 -2.01 0.00 0.00 31.31 29.04 2by5 n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2by5 n GLY 142 N -0.08 -1.67 3.69 6.99 0.00 -1.24 -4.40 105.19 108.48 2by5 n GLY 142 Ca 0.27 -1.67 -0.43 0.00 0.00 0.00 0.00 46.02 44.19 2by5 n GLY 142 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2by5 n ASN 143 N -3.91 2.70 -0.97 1.61 2.85 0.15 -2.93 115.26 114.76 2by5 n ASN 143 Ca 0.15 1.20 0.10 0.00 -0.11 0.00 0.00 54.58 55.92 2by5 n ASN 143 Cb 0.51 -1.47 0.16 0.00 1.24 0.00 0.00 39.78 40.23 2by5 n ASN 143 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2by5 n THR 144 N 0.52 0.39 -5.05 -0.44 -2.24 -0.36 -1.02 114.28 106.07 2by5 n THR 144 Ca 0.06 -0.69 -0.31 0.00 -2.27 0.00 0.00 64.05 60.83 2by5 n THR 144 Cb 0.35 1.07 -0.15 0.00 -2.10 0.00 0.00 70.33 69.50 2by5 n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2by5 s LYS 145 N -1.44 2.02 0.27 -0.78 1.02 -1.26 -4.39 119.74 115.18 2by5 s LYS 145 Ca 0.32 -0.98 0.20 0.00 0.02 0.00 0.00 55.97 55.53 2by5 s LYS 145 Cb 0.19 -2.06 0.09 0.00 -0.52 0.00 0.00 37.83 35.53 2by5 s LYS 145 CO 0.27 0.55 1.25 0.66 -0.92 0.00 0.00 175.35 177.16 2by5 h SER 146 N 5.11 0.00 -3.25 2.83 4.64 -1.93 -3.43 113.55 117.52 2by5 h SER 146 Ca -0.45 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.35 2by5 h SER 146 Cb 1.13 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 62.87 2by5 h SER 146 CO 0.46 0.18 -0.80 -0.44 -0.87 0.00 0.00 176.83 175.36 2by5 s SER 147 N -5.88 2.02 0.00 4.97 0.01 -1.26 -4.64 113.70 108.93 2by5 s SER 147 Ca 0.02 -0.29 0.00 0.00 1.31 0.00 0.00 55.95 56.99 2by5 s SER 147 Cb 0.08 -0.82 0.00 0.00 0.21 0.00 0.00 66.02 65.48 2by5 s SER 147 CO 0.75 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.93 2by5 n GLY 148 N 4.61 -1.71 3.11 3.44 0.00 -1.26 -4.97 105.19 108.40 2by5 n GLY 148 Ca -0.16 -1.38 -0.12 0.00 0.00 0.00 0.00 46.02 44.36 2by5 n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2by5 s THR 149 N 0.00 -0.12 -0.20 2.61 2.01 -1.26 -4.61 115.64 114.07 2by5 s THR 149 Ca 0.00 0.16 -0.07 0.00 0.31 0.00 0.00 61.69 62.09 2by5 s THR 149 Cb 0.00 -0.45 0.09 0.00 0.01 0.00 0.00 72.50 72.15 2by5 s THR 149 CO 0.00 0.06 0.43 -0.55 -0.69 0.00 0.00 174.62 173.87 2by5 s SER 150 N 1.52 -0.30 -0.20 3.53 0.15 -1.26 -4.99 113.70 112.15 2by5 s SER 150 Ca -0.08 1.01 -0.07 0.00 0.70 0.00 0.00 55.95 57.52 2by5 s SER 150 Cb -0.10 1.37 -0.03 0.00 -1.71 0.00 0.00 66.02 65.55 2by5 s SER 150 CO -0.10 -0.23 0.05 -0.31 1.20 0.00 0.00 173.24 173.85 2by5 s TYR 151 N 2.59 3.15 -0.74 3.44 1.51 -1.26 -1.23 117.35 124.81 2by5 s TYR 151 Ca -0.02 -0.17 0.08 0.00 -1.01 0.00 0.00 57.07 55.95 2by5 s TYR 151 Cb -0.12 -2.12 0.43 0.00 -0.11 0.00 0.00 41.96 40.04 2by5 s TYR 151 CO -0.13 -0.07 1.17 -0.35 -1.11 0.00 0.00 175.55 175.06 2by5 n PRO 152 N 4.06 2.96 0.00 -1.71 -0.04 -1.26 -5.00 135.00 134.01 2by5 n PRO 152 Ca -0.16 -1.65 0.00 0.00 -0.04 0.00 0.00 63.50 61.65 2by5 n PRO 152 Cb 0.52 -1.85 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 2by5 n PRO 152 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2by5 n ASP 153 N 0.36 0.00 -4.96 3.54 8.00 -1.26 -4.86 116.55 117.37 2by5 n ASP 153 Ca 0.15 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.43 2by5 n ASP 153 Cb 0.71 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.79 2by5 n ASP 153 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2by5 s VAL 154 N 0.00 5.25 0.20 2.53 -7.23 -1.26 -1.22 120.40 118.67 2by5 s VAL 154 Ca 0.00 -0.90 -0.30 0.00 -1.81 0.00 0.00 61.98 58.97 2by5 s VAL 154 Cb 0.00 -3.85 -0.08 0.00 0.56 0.00 0.00 36.38 33.01 2by5 s VAL 154 CO 0.00 -0.33 1.27 -0.22 -0.31 0.00 0.00 175.10 175.51 2by5 s LEU 155 N -3.93 4.43 0.12 1.32 2.96 -1.24 -4.82 118.68 117.52 2by5 s LEU 155 Ca 0.35 2.35 0.05 0.00 -0.22 0.00 0.00 54.13 56.66 2by5 s LEU 155 Cb -0.09 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 2by5 s LEU 155 CO 0.30 -0.48 0.04 -0.54 -1.32 0.00 0.00 176.35 174.35 2by5 s LYS 156 N -0.18 2.63 0.08 1.98 -0.14 -0.75 -1.90 119.74 121.46 2by5 s LYS 156 Ca 0.55 -0.88 0.05 0.00 -1.36 0.00 0.00 55.97 54.33 2by5 s LYS 156 Cb -0.35 -2.55 -0.03 0.00 -1.68 0.00 0.00 37.83 33.22 2by5 s LYS 156 CO 0.38 0.52 -0.13 0.00 -0.76 0.00 0.00 175.35 175.35 2by5 s LEU 158 N -1.89 0.46 -0.13 0.00 2.96 0.37 -0.58 118.68 119.86 2by5 s LEU 158 Ca -0.01 0.45 -0.17 0.00 -0.22 0.00 0.00 54.13 54.18 2by5 s LEU 158 Cb -0.09 0.60 -0.04 0.00 0.50 0.00 0.00 46.19 47.16 2by5 s LEU 158 CO 0.02 -0.17 0.44 -0.54 -1.32 0.00 0.00 176.35 174.78 2by5 s LYS 159 N 1.32 4.32 -0.06 1.98 1.02 -1.26 -0.64 119.74 126.43 2by5 s LYS 159 Ca -0.08 0.38 -0.18 0.00 0.02 0.00 0.00 55.97 56.10 2by5 s LYS 159 Cb -0.11 -3.44 0.04 0.00 -0.52 0.00 0.00 37.83 33.80 2by5 s LYS 159 CO -0.08 0.16 0.42 0.00 -0.92 0.00 0.00 175.35 174.94 2by5 s ALA 160 N 0.62 -1.07 0.27 5.17 0.00 -0.39 -4.96 121.76 121.41 2by5 s ALA 160 Ca 0.24 0.77 -0.11 0.00 0.00 0.00 0.00 51.96 52.87 2by5 s ALA 160 Cb -0.15 -0.15 -0.07 0.00 0.00 0.00 0.00 23.12 22.75 2by5 s ALA 160 CO 0.09 -0.27 0.61 -1.25 0.00 0.00 0.00 175.76 174.94 2by5 s PRO 161 N -0.89 3.83 0.25 0.00 0.04 -1.26 -0.56 135.00 136.41 2by5 s PRO 161 Ca -0.10 0.36 -0.30 0.00 0.04 0.00 0.00 61.00 61.01 2by5 s PRO 161 Cb -0.04 -2.57 -0.09 0.00 0.04 0.00 0.00 34.50 31.84 2by5 s PRO 161 CO 0.04 0.24 1.30 0.42 0.04 0.00 0.00 177.00 179.04 2by5 s ILE 162 N -1.94 3.02 0.22 0.56 1.01 -0.38 -1.30 121.20 122.40 2by5 s ILE 162 Ca 0.49 0.91 0.00 0.00 0.00 0.00 0.00 60.65 62.05 2by5 s ILE 162 Cb -0.11 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 2by5 s ILE 162 CO 0.22 0.17 0.40 -0.76 0.00 0.00 0.00 174.94 174.97 2by5 s LEU 163 N -0.76 4.21 0.62 2.97 1.43 0.02 -0.44 118.68 126.73 2by5 s LEU 163 Ca 0.54 0.36 -0.19 0.00 -1.03 0.00 0.00 54.13 53.81 2by5 s LEU 163 Cb -0.38 -3.14 -0.03 0.00 0.03 0.00 0.00 46.19 42.67 2by5 s LEU 163 CO 0.43 -0.07 1.19 -1.54 0.23 0.00 0.00 176.35 176.59 2by5 n SER 164 N -0.89 1.71 -0.32 2.29 3.41 -1.26 -4.57 113.62 113.99 2by5 n SER 164 Ca -0.05 0.84 0.03 0.00 -0.26 0.00 0.00 58.87 59.43 2by5 n SER 164 Cb 0.54 -1.50 0.17 0.00 -0.26 0.00 0.00 64.21 63.16 2by5 n SER 164 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2by5 h ASP 165 N 0.64 0.80 -0.63 4.04 3.58 -1.97 -0.74 116.42 122.14 2by5 h ASP 165 Ca -0.50 0.03 -0.05 0.00 0.42 0.00 0.00 57.03 56.93 2by5 h ASP 165 Cb 1.34 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 42.24 2by5 h ASP 165 CO 0.53 0.47 0.20 0.77 -2.88 0.00 0.00 179.24 178.33 2by5 h SER 166 N 0.91 0.91 -0.12 2.28 4.64 -1.99 -0.43 113.55 119.75 2by5 h SER 166 Ca 0.41 -0.21 -0.10 0.00 -0.47 0.00 0.00 61.79 61.42 2by5 h SER 166 Cb 0.30 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 2by5 h SER 166 CO -0.22 0.87 -0.25 0.77 -0.87 0.00 0.00 176.83 177.14 2by5 h SER 167 N 0.90 0.57 -0.22 4.97 4.64 -1.81 -0.66 113.55 121.93 2by5 h SER 167 Ca 0.20 -0.20 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2by5 h SER 167 Cb 0.29 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 2by5 h SER 167 CO -0.01 0.81 0.04 0.00 -0.87 0.00 0.00 176.83 176.81 2by5 h LYS 169 N 0.17 0.79 -0.35 0.00 1.57 -0.99 -1.99 116.57 115.76 2by5 h LYS 169 Ca 0.07 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.57 2by5 h LYS 169 Cb 0.30 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2by5 h LYS 169 CO 0.00 0.78 -0.12 0.77 -0.57 0.00 0.00 179.45 180.31 2by5 h SER 170 N 0.74 0.60 -0.13 0.86 0.02 -0.98 -2.45 113.55 112.22 2by5 h SER 170 Ca 0.15 -0.17 -0.10 0.00 -0.84 0.00 0.00 61.79 60.83 2by5 h SER 170 Cb 0.41 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 2by5 h SER 170 CO 0.01 0.75 -0.25 0.00 -1.14 0.00 0.00 176.83 176.21 2by5 h ALA 171 N 1.31 1.01 -2.14 3.77 0.00 -0.77 -3.37 119.26 119.07 2by5 h ALA 171 Ca 0.10 -0.36 -0.58 0.00 0.00 0.00 0.00 54.91 54.07 2by5 h ALA 171 Cb 0.54 -0.13 -0.40 0.00 0.00 0.00 0.00 17.79 17.79 2by5 h ALA 171 CO 0.03 0.59 -0.88 0.66 0.00 0.00 0.00 179.25 179.66 2by5 n TYR 172 N -4.11 1.35 -1.65 0.00 4.01 -0.79 -4.90 117.16 111.06 2by5 n TYR 172 Ca -0.00 -3.82 -0.46 0.00 -0.16 0.00 0.00 57.90 53.47 2by5 n TYR 172 Cb 0.42 -0.41 -0.03 0.00 -0.31 0.00 0.00 39.34 39.01 2by5 n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2by5 n PRO 173 N 1.28 1.86 -0.96 -0.72 -0.02 -0.94 -2.17 135.00 133.34 2by5 n PRO 173 Ca 0.25 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 2by5 n PRO 173 Cb 0.47 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 2by5 n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2by5 n GLY 174 N 2.18 0.61 0.00 -1.23 0.00 -1.26 -4.84 105.19 100.64 2by5 n GLY 174 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2by5 n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2by5 n GLN 175 N -2.19 2.58 -3.45 1.61 6.02 -0.92 -5.01 117.38 116.02 2by5 n GLN 175 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.59 2by5 n GLN 175 Cb 0.05 -0.76 -0.10 0.00 1.02 0.00 0.00 30.24 30.45 2by5 n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2by5 s ILE 176 N -1.42 5.21 0.61 5.09 -1.09 -1.25 -5.02 121.20 123.33 2by5 s ILE 176 Ca 0.00 0.24 0.02 0.00 -2.23 0.00 0.00 60.65 58.68 2by5 s ILE 176 Cb 0.00 -3.71 0.08 0.00 -1.58 0.00 0.00 42.46 37.25 2by5 s ILE 176 CO 0.00 0.07 0.85 0.42 -1.23 0.00 0.00 174.94 175.05 2by5 s THR 177 N 1.96 2.40 -1.32 2.92 -4.23 -1.26 -4.98 115.64 111.13 2by5 s THR 177 Ca 0.11 -0.71 0.10 0.00 -1.18 0.00 0.00 61.69 60.02 2by5 s THR 177 Cb -0.16 -2.69 0.16 0.00 1.34 0.00 0.00 72.50 71.15 2by5 s THR 177 CO 0.11 0.00 1.25 -1.54 -0.54 0.00 0.00 174.62 173.90 2by5 n SER 178 N -2.49 0.00 -1.48 3.99 3.41 -1.26 -2.07 113.62 113.72 2by5 n SER 178 Ca 0.12 0.23 0.08 0.00 -0.26 0.00 0.00 58.87 59.04 2by5 n SER 178 Cb 0.60 -0.34 0.34 0.00 -0.26 0.00 0.00 64.21 64.55 2by5 n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2by5 n ASN 179 N -1.34 4.75 -4.07 4.04 3.02 -1.26 -4.92 115.26 115.48 2by5 n ASN 179 Ca 0.04 -2.65 -0.13 0.00 -0.03 0.00 0.00 54.58 51.81 2by5 n ASN 179 Cb 0.09 -0.58 -0.11 0.00 -0.61 0.00 0.00 39.78 38.57 2by5 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2by5 s MET 180 N -2.21 0.55 0.05 3.52 -1.94 -0.88 -1.09 119.30 117.31 2by5 s MET 180 Ca 0.48 -0.79 -0.03 0.00 -1.71 0.00 0.00 55.69 53.65 2by5 s MET 180 Cb 0.34 -0.31 -0.03 0.00 2.01 0.00 0.00 34.83 36.84 2by5 s MET 180 CO 0.19 0.05 0.02 -0.59 -0.01 0.00 0.00 175.02 174.68 2by5 s PHE 181 N -1.47 0.41 0.01 -0.03 -0.12 -0.35 -4.78 117.98 111.65 2by5 s PHE 181 Ca -0.09 -0.90 -0.02 0.00 -0.05 0.00 0.00 56.93 55.88 2by5 s PHE 181 Cb -0.09 -0.30 -0.04 0.00 -0.63 0.00 0.00 43.02 41.96 2by5 s PHE 181 CO 0.00 -0.39 0.20 0.00 -0.05 0.00 0.00 175.22 174.98 2by5 s ALA 183 N -1.38 -0.27 0.00 0.00 0.00 -0.68 -0.80 121.76 118.62 2by5 s ALA 183 Ca 0.30 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.93 2by5 s ALA 183 Cb -0.13 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.23 2by5 s ALA 183 CO 0.21 -0.32 0.00 0.41 0.00 0.00 0.00 175.76 176.06 2by5 n GLY 183 N 0.84 0.20 2.72 0.00 0.00 -0.42 -2.69 105.19 105.84 2by5 n GLY 183 Ca -0.20 -1.69 -0.20 0.00 0.00 0.00 0.00 46.02 43.93 2by5 n GLY 183 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2by5 s TYR 184 N -1.37 -0.02 0.41 1.61 2.02 -1.26 -4.33 117.35 114.41 2by5 s TYR 184 Ca 0.00 0.23 0.33 0.00 -0.37 0.00 0.00 57.07 57.27 2by5 s TYR 184 Cb 0.00 -0.45 1.70 0.00 -0.40 0.00 0.00 41.96 42.81 2by5 s TYR 184 CO 0.00 -0.34 2.14 -0.07 -1.57 0.00 0.00 175.55 175.71 2by5 h LEU 185 N 8.40 0.00 0.49 -1.29 3.38 -1.95 -3.44 115.31 120.90 2by5 h LEU 185 Ca -0.14 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2by5 h LEU 185 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2by5 h LEU 185 CO 0.19 0.06 -0.23 1.05 0.09 0.00 0.00 178.44 179.60 2by5 h GLU 186 N 0.00 -0.63 0.00 1.13 9.09 -1.96 0.18 114.58 122.39 2by5 h GLU 186 Ca -0.00 0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.45 2by5 h GLU 186 Cb 0.28 0.14 0.00 0.00 -1.65 0.00 0.00 28.75 27.52 2by5 h GLU 186 CO 0.01 -0.42 0.00 0.41 0.05 0.00 0.00 179.01 179.06 2by5 n GLY 187 N 0.11 2.49 2.73 1.06 0.00 -0.03 -4.47 105.19 107.08 2by5 n GLY 187 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 2by5 n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2by5 s LYS 188 N -0.33 0.35 -0.01 1.61 1.02 -1.26 -3.59 119.74 117.53 2by5 s LYS 188 Ca 0.00 0.19 -0.30 0.00 0.02 0.00 0.00 55.97 55.88 2by5 s LYS 188 Cb 0.00 -0.86 0.11 0.00 -0.52 0.00 0.00 37.83 36.56 2by5 s LYS 188 CO 0.00 -0.33 1.16 0.34 -0.92 0.00 0.00 175.35 175.60 2by5 s ASP 189 N 2.04 -0.12 0.85 2.83 2.15 -0.49 -4.31 116.67 119.63 2by5 s ASP 189 Ca 0.05 -0.16 -0.13 0.00 0.43 0.00 0.00 52.55 52.74 2by5 s ASP 189 Cb -0.12 0.25 0.12 0.00 -0.30 0.00 0.00 42.92 42.87 2by5 s ASP 189 CO -0.05 -0.46 1.21 -0.94 -0.17 0.00 0.00 175.17 174.77 2by5 s SER 190 N -2.79 4.02 0.36 -0.34 1.04 -1.26 -0.32 113.70 114.41 2by5 s SER 190 Ca 0.12 0.54 -0.11 0.00 0.48 0.00 0.00 55.95 56.97 2by5 s SER 190 Cb 0.02 -0.87 0.05 0.00 0.10 0.00 0.00 66.02 65.31 2by5 s SER 190 CO -0.03 -2.18 0.68 0.00 0.98 0.00 0.00 173.24 172.68 2by5 n GLN 192 N -0.50 1.20 0.00 0.00 3.00 -1.26 -0.82 117.38 119.00 2by5 n GLN 192 Ca -0.07 0.43 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 2by5 n GLN 192 Cb 0.54 -1.95 0.00 0.00 0.00 0.00 0.00 30.24 28.83 2by5 n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2by5 n GLY 193 N 2.08 2.28 0.14 1.08 0.00 -1.26 -0.68 105.19 108.83 2by5 n GLY 193 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.29 2by5 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2by5 h ASP 194 N 0.00 0.00 -0.88 1.61 3.32 -1.29 -3.31 116.42 115.87 2by5 h ASP 194 Ca 0.00 -0.04 -0.65 0.00 0.02 0.00 0.00 57.03 56.35 2by5 h ASP 194 Cb 0.00 0.00 0.06 0.00 0.22 0.00 0.00 39.33 39.61 2by5 h ASP 194 CO 0.00 0.02 -0.15 -1.20 -1.72 0.00 0.00 179.24 176.19 2by5 n SER 195 N -2.67 -0.44 0.00 6.45 7.64 -1.25 -1.33 113.62 122.02 2by5 n SER 195 Ca 0.02 1.01 0.00 0.00 1.01 0.00 0.00 58.87 60.91 2by5 n SER 195 Cb 0.51 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.89 2by5 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2by5 n GLY 196 N 1.50 2.50 3.95 0.23 0.00 -0.04 -0.38 105.19 112.94 2by5 n GLY 196 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 2by5 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2by5 s GLY 197 N -1.91 1.77 0.37 -0.02 0.00 -0.44 -3.35 107.32 103.73 2by5 s GLY 197 Ca 0.00 -1.34 -0.18 0.00 0.00 0.00 0.00 44.72 43.20 2by5 s GLY 197 CO 0.00 -0.63 0.83 2.56 0.00 0.00 0.00 173.10 175.86 2by5 s PRO 198 N -5.69 4.10 -0.24 2.90 0.04 -1.26 -0.93 135.00 133.92 2by5 s PRO 198 Ca 0.72 0.86 0.02 0.00 0.04 0.00 0.00 61.00 62.64 2by5 s PRO 198 Cb -0.04 -2.33 0.06 0.00 0.04 0.00 0.00 34.50 32.22 2by5 s PRO 198 CO 0.51 0.08 -0.09 0.08 0.04 0.00 0.00 177.00 177.62 2by5 s VAL 199 N -2.06 1.87 -0.11 -0.36 1.01 -0.19 -3.25 120.40 117.32 2by5 s VAL 199 Ca 0.57 -1.42 0.02 0.00 0.00 0.00 0.00 61.98 61.15 2by5 s VAL 199 Cb -0.10 -2.04 -0.01 0.00 0.00 0.00 0.00 36.38 34.23 2by5 s VAL 199 CO 0.16 -0.04 -0.16 -0.69 0.00 0.00 0.00 175.10 174.37 2by5 s VAL 200 N 1.24 2.83 -0.07 2.92 1.01 -0.45 -1.05 120.40 126.83 2by5 s VAL 200 Ca -0.07 -0.76 -0.00 0.00 0.00 0.00 0.00 61.98 61.15 2by5 s VAL 200 Cb -0.19 -2.15 0.03 0.00 0.00 0.00 0.00 36.38 34.07 2by5 s VAL 200 CO -0.06 0.54 -0.03 0.00 0.00 0.00 0.00 175.10 175.56 2by5 n SER 202 N 4.80 -3.94 -0.06 0.00 7.64 -1.26 -1.51 113.62 119.30 2by5 n SER 202 Ca -0.13 -0.88 -0.01 0.00 1.01 0.00 0.00 58.87 58.86 2by5 n SER 202 Cb 0.50 -3.41 -0.00 0.00 -1.01 0.00 0.00 64.21 60.29 2by5 n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2by5 n GLY 203 N -1.58 0.48 3.28 0.23 0.00 -1.26 -5.02 105.19 101.32 2by5 n GLY 203 Ca 0.03 -0.36 -0.28 0.00 0.00 0.00 0.00 46.02 45.42 2by5 n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2by5 s LYS 204 N -0.91 1.61 -0.67 1.61 -0.14 -0.57 -4.06 119.74 116.61 2by5 s LYS 204 Ca 0.00 -0.98 -0.27 0.00 -1.36 0.00 0.00 55.97 53.36 2by5 s LYS 204 Cb 0.00 -1.72 0.03 0.00 -1.68 0.00 0.00 37.83 34.46 2by5 s LYS 204 CO 0.00 0.45 1.21 -1.17 -0.76 0.00 0.00 175.35 175.07 2by5 s LEU 209 N -1.08 3.41 -0.08 3.17 2.96 -0.12 -0.98 118.68 125.96 2by5 s LEU 209 Ca 0.09 -0.32 0.21 0.00 -0.22 0.00 0.00 54.13 53.89 2by5 s LEU 209 Cb -0.09 -2.75 -0.31 0.00 0.50 0.00 0.00 46.19 43.54 2by5 s LEU 209 CO 0.01 -1.66 0.36 0.00 -1.32 0.00 0.00 176.35 173.74 2by5 n GLN 210 N 8.84 0.67 -4.02 1.98 1.13 -0.21 -4.15 117.38 121.62 2by5 n GLN 210 Ca 0.04 -0.14 -0.08 0.00 -1.94 0.00 0.00 57.00 54.87 2by5 n GLN 210 Cb 0.49 -1.52 -0.09 0.00 0.11 0.00 0.00 30.24 29.23 2by5 n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2by5 s GLY 211 N -4.79 0.47 -0.07 1.08 0.00 -0.75 -1.71 107.32 101.55 2by5 s GLY 211 Ca -0.09 -1.05 0.03 0.00 0.00 0.00 0.00 44.72 43.61 2by5 s GLY 211 CO 0.88 -1.11 -0.16 -0.42 0.00 0.00 0.00 173.10 172.29 2by5 s ILE 212 N -3.94 1.44 -0.08 0.90 1.01 -1.06 -1.02 121.20 118.46 2by5 s ILE 212 Ca 0.12 -0.67 -0.31 0.00 0.00 0.00 0.00 60.65 59.78 2by5 s ILE 212 Cb 0.06 -1.28 -0.09 0.00 0.01 0.00 0.00 42.46 41.16 2by5 s ILE 212 CO -0.06 0.42 2.01 0.52 0.00 0.00 0.00 174.94 177.83 2by5 n VAL 213 N 3.66 0.59 0.01 2.92 0.31 -0.11 -1.28 118.33 124.44 2by5 n VAL 213 Ca -0.21 -0.20 -0.01 0.00 -0.01 0.00 0.00 64.34 63.92 2by5 n VAL 213 Cb 0.52 -2.17 -0.00 0.00 -0.91 0.00 0.00 33.84 31.28 2by5 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2by5 n SER 214 N 8.17 0.54 -3.48 4.52 2.88 -0.99 -0.86 113.62 124.39 2by5 n SER 214 Ca 0.24 0.07 -0.07 0.00 -1.33 0.00 0.00 58.87 57.79 2by5 n SER 214 Cb 0.36 -0.22 -0.00 0.00 -0.75 0.00 0.00 64.21 63.61 2by5 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2by5 s TRP 215 N -1.49 -0.05 0.00 0.66 1.48 -0.66 -4.93 118.94 113.95 2by5 s TRP 215 Ca -0.02 -0.45 0.00 0.00 -1.06 0.00 0.00 56.10 54.57 2by5 s TRP 215 Cb 0.00 0.74 0.00 0.00 -1.16 0.00 0.00 33.47 33.05 2by5 s TRP 215 CO 0.03 -1.25 0.00 0.41 -4.06 0.00 0.00 176.95 172.08 2by5 n GLY 216 N -0.51 0.56 3.53 3.67 0.00 -1.26 -0.70 105.19 110.48 2by5 n GLY 216 Ca -0.06 -0.84 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 2by5 n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2by5 s SER 217 N 0.00 6.37 0.94 1.61 0.15 -1.26 -4.87 113.70 116.64 2by5 s SER 217 Ca 0.00 -0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.43 2by5 s SER 217 Cb 0.00 -2.35 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 2by5 s SER 217 CO 0.00 -0.85 0.00 0.61 1.20 0.00 0.00 173.24 174.20 2by5 n GLY 219 N 5.01 0.93 2.82 9.45 0.00 -1.26 -4.59 105.19 117.54 2by5 n GLY 219 Ca 0.00 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.23 2by5 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2by5 n ALA 220 N 3.69 -0.43 -2.14 0.00 0.00 -1.26 -4.60 120.51 115.77 2by5 n ALA 220 Ca -0.21 0.19 -0.34 0.00 0.00 0.00 0.00 53.44 53.08 2by5 n ALA 220 Cb 0.54 -1.87 -0.06 0.00 0.00 0.00 0.00 19.45 18.06 2by5 n ALA 220 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2by5 s GLN 221 N -4.39 4.07 0.23 0.00 -1.52 -1.26 -0.86 119.66 115.93 2by5 s GLN 221 Ca 0.00 0.72 -0.32 0.00 -1.95 0.00 0.00 55.36 53.81 2by5 s GLN 221 Cb 0.00 -2.58 -0.13 0.00 -0.22 0.00 0.00 33.01 30.08 2by5 s GLN 221 CO 0.00 0.24 1.47 1.17 -0.25 0.00 0.00 175.29 177.92 2by5 n LYS 222 N -0.02 2.16 -1.31 2.91 4.81 -1.26 -2.06 118.16 123.39 2by5 n LYS 222 Ca 0.02 0.77 -0.11 0.00 -0.87 0.00 0.00 58.31 58.12 2by5 n LYS 222 Cb 0.52 -2.47 -0.05 0.00 0.02 0.00 0.00 35.03 33.06 2by5 n LYS 222 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2by5 n ASN 223 N 2.46 -4.95 -3.35 3.14 5.03 0.64 -4.91 115.26 113.32 2by5 n ASN 223 Ca 0.12 0.27 -0.26 0.00 0.87 0.00 0.00 54.58 55.58 2by5 n ASN 223 Cb 0.32 -3.41 -0.09 0.00 -1.02 0.00 0.00 39.78 35.58 2by5 n ASN 223 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2by5 n LYS 224 N -1.82 0.96 -1.23 3.52 4.76 -0.87 -4.72 118.16 118.76 2by5 n LYS 224 Ca -0.11 -3.57 -0.29 0.00 -2.87 0.00 0.00 58.31 51.48 2by5 n LYS 224 Cb 0.46 -1.62 0.18 0.00 -1.84 0.00 0.00 35.03 32.22 2by5 n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2by5 s PRO 225 N -1.07 0.23 0.46 1.97 0.04 -1.26 -4.30 135.00 131.06 2by5 s PRO 225 Ca 0.34 0.34 -0.23 0.00 0.04 0.00 0.00 61.00 61.49 2by5 s PRO 225 Cb 0.11 -1.73 -0.07 0.00 0.04 0.00 0.00 34.50 32.85 2by5 s PRO 225 CO -0.13 -2.83 1.17 0.20 0.04 0.00 0.00 177.00 175.46 2by5 s GLY 226 N -3.66 2.78 -0.09 0.56 0.00 -1.10 -4.67 107.32 101.14 2by5 s GLY 226 Ca 0.66 0.94 0.01 0.00 0.00 0.00 0.00 44.72 46.34 2by5 s GLY 226 CO 0.56 1.40 -0.13 0.14 0.00 0.00 0.00 173.10 175.07 2by5 s VAL 227 N -1.54 3.11 0.01 1.40 1.01 0.12 -1.69 120.40 122.83 2by5 s VAL 227 Ca 0.63 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.98 2by5 s VAL 227 Cb -0.29 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 2by5 s VAL 227 CO 0.35 0.56 -0.11 -0.31 0.00 0.00 0.00 175.10 175.58 2by5 s TYR 228 N -0.17 0.99 0.20 5.22 2.02 0.42 -1.65 117.35 124.38 2by5 s TYR 228 Ca -0.00 -0.26 -0.30 0.00 -0.37 0.00 0.00 57.07 56.13 2by5 s TYR 228 Cb -0.13 -0.62 -0.09 0.00 -0.40 0.00 0.00 41.96 40.72 2by5 s TYR 228 CO 0.03 -0.00 1.35 0.99 -1.57 0.00 0.00 175.55 176.35 2by5 s THR 229 N -0.55 3.07 -0.94 -0.71 2.01 -0.40 -1.21 115.64 116.92 2by5 s THR 229 Ca 0.02 0.87 -0.20 0.00 0.31 0.00 0.00 61.69 62.69 2by5 s THR 229 Cb -0.06 -3.56 0.11 0.00 0.01 0.00 0.00 72.50 69.01 2by5 s THR 229 CO 0.00 0.13 1.18 -0.75 -0.69 0.00 0.00 174.62 174.49 2by5 s LYS 230 N -0.04 3.58 0.41 4.92 2.20 -0.25 -2.55 119.74 128.01 2by5 s LYS 230 Ca 0.58 -1.61 0.09 0.00 -0.36 0.00 0.00 55.97 54.67 2by5 s LYS 230 Cb -0.38 -4.97 0.89 0.00 -1.51 0.00 0.00 37.83 31.86 2by5 s LYS 230 CO 0.39 -1.85 2.00 0.28 -0.36 0.00 0.00 175.35 175.80 2by5 h VAL 231 N 6.02 1.00 -0.23 4.02 2.07 -1.63 -1.96 116.25 125.54 2by5 h VAL 231 Ca 0.15 -0.19 0.07 0.00 0.82 0.00 0.00 66.70 67.55 2by5 h VAL 231 Cb 1.02 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 2by5 h VAL 231 CO 1.17 0.10 0.22 0.00 0.02 0.00 0.00 177.57 179.08 2by5 n ASN 233 N -4.00 0.61 -0.42 0.00 3.02 -0.74 -3.55 115.26 110.19 2by5 n ASN 233 Ca 0.03 0.63 0.05 0.00 -0.03 0.00 0.00 54.58 55.26 2by5 n ASN 233 Cb 0.36 -0.77 0.05 0.00 -0.61 0.00 0.00 39.78 38.81 2by5 n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2by5 n TYR 234 N -2.15 0.04 -0.32 3.10 4.01 0.06 -4.69 117.16 117.19 2by5 n TYR 234 Ca 0.03 -0.04 -0.04 0.00 -0.16 0.00 0.00 57.90 57.68 2by5 n TYR 234 Cb 0.25 -0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.36 2by5 n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2by5 h VAL 235 N 1.97 1.25 -0.24 -0.72 2.07 -1.60 0.80 116.25 119.78 2by5 h VAL 235 Ca 0.00 -0.62 -0.12 0.00 0.82 0.00 0.00 66.70 66.78 2by5 h VAL 235 Cb 0.45 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 2by5 h VAL 235 CO 0.00 0.28 -0.35 0.77 0.02 0.00 0.00 177.57 178.29 2by5 h SER 236 N 1.22 0.55 -0.30 0.57 4.64 -1.87 -0.58 113.55 117.79 2by5 h SER 236 Ca 0.31 -0.22 -0.04 0.00 -0.47 0.00 0.00 61.79 61.36 2by5 h SER 236 Cb 0.02 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 2by5 h SER 236 CO -0.05 0.85 0.01 -0.25 -0.87 0.00 0.00 176.83 176.53 2by5 h TRP 237 N 0.44 0.55 -0.08 4.77 7.01 -1.76 -2.01 115.95 124.88 2by5 h TRP 237 Ca 0.05 -0.09 0.00 0.00 2.11 0.00 0.00 58.89 60.96 2by5 h TRP 237 Cb 0.82 -0.15 -0.00 0.00 -2.10 0.00 0.00 29.16 27.73 2by5 h TRP 237 CO 0.03 0.64 0.05 0.82 -2.79 0.00 0.00 178.44 177.19 2by5 h ILE 238 N 0.31 1.02 -0.39 2.65 2.04 -0.59 -0.18 117.51 122.38 2by5 h ILE 238 Ca 0.09 -0.05 -0.03 0.00 1.00 0.00 0.00 64.86 65.87 2by5 h ILE 238 Cb 0.41 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 2by5 h ILE 238 CO 0.01 0.02 0.15 0.11 0.00 0.00 0.00 178.15 178.44 2by5 h LYS 239 N 0.10 0.60 -0.22 2.37 1.57 -1.14 -0.87 116.57 118.98 2by5 h LYS 239 Ca 0.03 -0.11 -0.12 0.00 -1.87 0.00 0.00 60.65 58.57 2by5 h LYS 239 Cb -0.01 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 2by5 h LYS 239 CO -0.01 0.57 -0.37 -0.56 -0.57 0.00 0.00 179.45 178.52 2by5 h GLN 240 N 0.49 0.49 -0.36 3.15 -0.00 -1.24 -1.40 115.11 116.24 2by5 h GLN 240 Ca 0.13 -0.23 -0.05 0.00 -0.00 0.00 0.00 58.65 58.50 2by5 h GLN 240 Cb 0.21 -0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.67 2by5 h GLN 240 CO -0.01 0.79 0.04 1.15 -0.00 0.00 0.00 178.83 180.80 2by5 h THR 241 N 0.41 1.25 -0.83 1.86 2.02 -0.81 -2.59 112.91 114.21 2by5 h THR 241 Ca 0.04 -0.89 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 2by5 h THR 241 Cb 0.84 1.12 -0.04 0.00 -1.74 0.00 0.00 68.15 68.33 2by5 h THR 241 CO 0.07 0.30 0.45 0.40 0.37 0.00 0.00 175.52 177.10 2by5 h ILE 242 N 0.44 1.25 0.00 3.11 2.04 -1.01 -2.28 117.51 121.06 2by5 h ILE 242 Ca 0.11 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 2by5 h ILE 242 Cb 0.39 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2by5 h ILE 242 CO 0.01 0.28 -0.05 0.00 0.00 0.00 0.00 178.15 178.39 2by5 h ALA 243 N 1.32 1.10 -0.10 1.87 0.00 -0.87 -2.95 119.26 119.62 2by5 h ALA 243 Ca 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2by5 h ALA 243 Cb 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2by5 h ALA 243 CO -0.05 0.06 0.00 0.43 0.00 0.00 0.00 179.25 179.69 2by5 n SER 244 N -3.29 2.30 0.00 0.00 7.64 -0.99 -5.10 113.62 114.18 2by5 n SER 244 Ca -0.01 -2.03 0.00 0.00 1.01 0.00 0.00 58.87 57.84 2by5 n SER 244 Cb 0.21 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 2by5 n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62