#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f2s s VAL 17 N 0.00 4.78 -0.99 1.39 1.01 0.43 -4.03 120.40 122.99 1f2s s VAL 17 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.93 1f2s s VAL 17 Cb 0.00 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.28 1f2s s VAL 17 CO 0.00 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.24 1f2s n GLY 18 N 2.86 0.42 0.00 4.51 0.00 -1.25 -1.85 105.19 109.88 1f2s n GLY 18 Ca -0.18 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1f2s n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f2s n GLY 19 N -1.27 3.14 3.46 -0.02 0.00 -1.26 -4.86 105.19 104.37 1f2s n GLY 19 Ca -0.12 -2.06 -0.24 0.00 0.00 0.00 0.00 46.02 43.60 1f2s n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1f2s s TYR 20 N 1.48 1.76 -0.15 1.61 -0.85 -0.44 -4.96 117.35 115.79 1f2s s TYR 20 Ca 0.00 -1.35 -0.19 0.00 -0.52 0.00 0.00 57.07 55.02 1f2s s TYR 20 Cb 0.00 -1.06 -0.04 0.00 0.38 0.00 0.00 41.96 41.24 1f2s s TYR 20 CO 0.00 -0.40 0.52 0.99 -1.52 0.00 0.00 175.55 175.13 1f2s s THR 21 N -3.29 5.14 0.09 -3.49 2.01 -1.26 -0.33 115.64 114.50 1f2s s THR 21 Ca 0.28 1.00 -0.23 0.00 0.31 0.00 0.00 61.69 63.04 1f2s s THR 21 Cb 0.03 -3.85 -0.14 0.00 0.01 0.00 0.00 72.50 68.56 1f2s s THR 21 CO 0.17 0.25 1.72 0.00 -0.69 0.00 0.00 174.62 176.07 1f2s n GLY 23 N -1.14 3.24 3.70 0.00 0.00 -1.26 -4.81 105.19 104.91 1f2s n GLY 23 Ca -0.07 -1.44 -0.59 0.00 0.00 0.00 0.00 46.02 43.92 1f2s n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f2s n ALA 24 N 0.69 -0.32 -2.13 4.61 0.00 -1.26 -2.21 120.51 119.89 1f2s n ALA 24 Ca 0.00 0.38 -0.21 0.00 0.00 0.00 0.00 53.44 53.62 1f2s n ALA 24 Cb 0.00 -2.19 -0.04 0.00 0.00 0.00 0.00 19.45 17.23 1f2s n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1f2s n ASN 25 N 5.39 -5.78 -0.03 0.00 3.02 -1.26 -4.87 115.26 111.72 1f2s n ASN 25 Ca 0.28 0.16 0.13 0.00 -0.03 0.00 0.00 54.58 55.13 1f2s n ASN 25 Cb 0.10 -4.91 0.44 0.00 -0.61 0.00 0.00 39.78 34.80 1f2s n ASN 25 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1f2s n THR 26 N -3.46 0.00 -3.45 3.41 -2.24 -0.94 -3.91 114.28 103.69 1f2s n THR 26 Ca -0.24 -0.02 -0.26 0.00 -2.27 0.00 0.00 64.05 61.27 1f2s n THR 26 Cb 0.69 -0.06 -0.09 0.00 -2.10 0.00 0.00 70.33 68.77 1f2s n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1f2s n VAL 27 N -1.38 1.21 0.22 2.28 0.31 -1.26 -4.98 118.33 114.73 1f2s n VAL 27 Ca 0.08 -4.72 0.14 0.00 -0.01 0.00 0.00 64.34 59.83 1f2s n VAL 27 Cb 0.33 -2.04 0.77 0.00 -0.91 0.00 0.00 33.84 31.99 1f2s n VAL 27 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1f2s h PRO 28 N 4.48 0.00 -0.00 5.55 0.13 -1.77 -2.38 132.00 138.01 1f2s h PRO 28 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1f2s h PRO 28 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1f2s h PRO 28 CO 0.69 0.00 -0.59 2.48 -0.23 0.00 0.00 178.00 180.35 1f2s n TYR 29 N -2.51 0.00 -2.31 1.56 0.18 -1.12 -2.36 117.16 110.60 1f2s n TYR 29 Ca -0.02 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.34 1f2s n TYR 29 Cb 0.07 -0.16 -0.03 0.00 -0.38 0.00 0.00 39.34 38.84 1f2s n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1f2s s GLN 30 N -2.92 4.38 0.25 -3.48 2.00 -0.90 -0.73 119.66 118.27 1f2s s GLN 30 Ca 0.12 1.91 0.06 0.00 -2.00 0.00 0.00 55.36 55.45 1f2s s GLN 30 Cb 0.17 -3.30 -0.05 0.00 0.80 0.00 0.00 33.01 30.63 1f2s s GLN 30 CO 0.71 -0.34 -0.06 0.14 -0.50 0.00 0.00 175.29 175.25 1f2s s VAL 31 N 1.07 1.50 -0.09 1.34 -7.23 -0.82 -4.42 120.40 111.75 1f2s s VAL 31 Ca 0.61 -2.12 0.03 0.00 -1.81 0.00 0.00 61.98 58.70 1f2s s VAL 31 Cb -0.33 -2.33 -0.01 0.00 0.56 0.00 0.00 36.38 34.27 1f2s s VAL 31 CO 0.30 -0.37 -0.20 -0.55 -0.31 0.00 0.00 175.10 173.96 1f2s s SER 32 N -3.38 3.47 -0.20 4.85 0.15 -0.57 -2.14 113.70 115.87 1f2s s SER 32 Ca 0.27 -0.43 -0.14 0.00 0.70 0.00 0.00 55.95 56.35 1f2s s SER 32 Cb 0.03 -1.22 -0.04 0.00 -1.71 0.00 0.00 66.02 63.08 1f2s s SER 32 CO 0.10 0.21 0.32 -0.76 1.20 0.00 0.00 173.24 174.31 1f2s s LEU 33 N 0.06 4.17 -0.08 3.45 1.43 0.05 -1.01 118.68 126.74 1f2s s LEU 33 Ca -0.08 0.42 0.03 0.00 -1.03 0.00 0.00 54.13 53.47 1f2s s LEU 33 Cb -0.15 -2.39 0.01 0.00 0.03 0.00 0.00 46.19 43.69 1f2s s LEU 33 CO 0.05 -0.00 -0.16 0.21 0.23 0.00 0.00 176.35 176.69 1f2s s ASN 34 N 0.90 2.25 -0.44 2.29 2.47 0.02 -2.29 114.94 120.14 1f2s s ASN 34 Ca 0.16 -0.39 0.09 0.00 0.42 0.00 0.00 52.86 53.13 1f2s s ASN 34 Cb -0.14 -1.03 0.40 0.00 -1.45 0.00 0.00 41.25 39.03 1f2s s ASN 34 CO 0.06 0.06 0.98 -1.54 -3.72 0.00 0.00 177.10 172.94 1f2s n SER 37 N 3.85 3.42 0.00 -4.21 3.41 -1.26 -1.60 113.62 117.23 1f2s n SER 37 Ca -0.21 -3.40 0.00 0.00 -0.26 0.00 0.00 58.87 55.00 1f2s n SER 37 Cb 0.52 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 1f2s n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f2s n GLY 38 N -0.22 2.26 3.45 5.00 0.00 -1.26 -4.96 105.19 109.46 1f2s n GLY 38 Ca 0.29 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.20 1f2s n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1f2s s TYR 39 N -2.50 -0.48 0.07 1.61 1.13 -1.26 -5.14 117.35 110.78 1f2s s TYR 39 Ca 0.00 0.33 -0.31 0.00 -1.41 0.00 0.00 57.07 55.68 1f2s s TYR 39 Cb 0.00 0.55 -0.06 0.00 -1.10 0.00 0.00 41.96 41.35 1f2s s TYR 39 CO 0.00 -0.73 1.20 -1.58 -2.51 0.00 0.00 175.55 171.93 1f2s s HIS 40 N -3.40 3.44 0.00 -3.49 5.65 -1.26 -4.26 115.29 111.97 1f2s s HIS 40 Ca 0.02 1.30 0.00 0.00 0.25 0.00 0.00 55.06 56.63 1f2s s HIS 40 Cb -0.01 -3.42 0.00 0.00 -1.18 0.00 0.00 32.58 27.97 1f2s s HIS 40 CO -0.11 -1.28 0.00 1.97 -0.65 0.00 0.00 174.74 174.67 1f2s n PHE 41 N 3.85 0.00 -3.70 3.88 -1.74 -0.97 -4.97 117.46 113.80 1f2s n PHE 41 Ca 0.09 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.88 1f2s n PHE 41 Cb 0.46 0.00 -0.05 0.00 1.52 0.00 0.00 39.48 41.41 1f2s n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1f2s n GLY 43 N -0.21 2.37 3.79 0.00 0.00 0.18 -0.77 105.19 110.55 1f2s n GLY 43 Ca -0.15 -2.20 -0.01 0.00 0.00 0.00 0.00 46.02 43.66 1f2s n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1f2s s GLY 44 N -3.11 -0.15 -0.07 -0.02 0.00 -0.91 -3.86 107.32 99.20 1f2s s GLY 44 Ca 0.24 0.10 0.02 0.00 0.00 0.00 0.00 44.72 45.07 1f2s s GLY 44 CO 0.15 1.58 -0.11 -0.56 0.00 0.00 0.00 173.10 174.16 1f2s s SER 45 N -3.22 1.79 -0.14 1.64 0.01 -0.24 -1.94 113.70 111.59 1f2s s SER 45 Ca 0.18 -0.29 -0.29 0.00 1.31 0.00 0.00 55.95 56.86 1f2s s SER 45 Cb -0.00 -0.81 -0.01 0.00 0.21 0.00 0.00 66.02 65.41 1f2s s SER 45 CO 0.01 0.01 1.14 -0.22 0.41 0.00 0.00 173.24 174.58 1f2s s LEU 46 N 0.83 4.20 -0.04 2.44 2.96 0.09 -0.88 118.68 128.28 1f2s s LEU 46 Ca -0.11 1.62 0.18 0.00 -0.22 0.00 0.00 54.13 55.59 1f2s s LEU 46 Cb -0.15 -3.55 -0.27 0.00 0.50 0.00 0.00 46.19 42.72 1f2s s LEU 46 CO 0.02 -0.62 0.35 2.30 -1.32 0.00 0.00 176.35 177.08 1f2s n ILE 47 N 4.96 0.16 -3.81 6.68 -5.35 -0.30 -1.31 119.36 120.40 1f2s n ILE 47 Ca 0.11 -0.46 -0.05 0.00 -0.27 0.00 0.00 62.75 62.08 1f2s n ILE 47 Cb 0.46 -0.01 -0.01 0.00 -1.74 0.00 0.00 39.64 38.35 1f2s n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1f2s s ASN 48 N -4.24 -0.17 0.64 7.28 2.20 -1.20 -4.54 114.94 114.90 1f2s s ASN 48 Ca -0.07 -0.58 0.28 0.00 -0.94 0.00 0.00 52.86 51.56 1f2s s ASN 48 Cb 0.11 0.61 1.51 0.00 -2.00 0.00 0.00 41.25 41.48 1f2s s ASN 48 CO 0.75 -1.15 1.88 0.77 -2.94 0.00 0.00 177.10 176.41 1f2s h SER 49 N 2.00 0.00 -0.00 3.54 4.64 -1.96 -2.54 113.55 119.23 1f2s h SER 49 Ca -0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1f2s h SER 49 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1f2s h SER 49 CO 0.27 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 176.22 1f2s n GLN 50 N -3.20 0.53 -4.43 4.77 6.02 -1.26 -0.16 117.38 119.64 1f2s n GLN 50 Ca 0.02 -0.51 -0.20 0.00 -0.01 0.00 0.00 57.00 56.30 1f2s n GLN 50 Cb 0.52 -0.96 -0.14 0.00 1.02 0.00 0.00 30.24 30.68 1f2s n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1f2s s TRP 51 N -0.34 1.09 -0.01 1.08 0.52 -0.96 -0.56 118.94 119.77 1f2s s TRP 51 Ca 0.02 -0.27 0.05 0.00 0.02 0.00 0.00 56.10 55.92 1f2s s TRP 51 Cb 0.02 -0.68 -0.01 0.00 -1.15 0.00 0.00 33.47 31.64 1f2s s TRP 51 CO 0.03 -0.00 -0.16 0.08 0.02 0.00 0.00 176.95 176.92 1f2s s VAL 52 N -0.54 1.24 -0.12 4.03 1.01 -0.16 -1.15 120.40 124.71 1f2s s VAL 52 Ca 0.03 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.31 1f2s s VAL 52 Cb -0.06 -1.03 -0.03 0.00 0.00 0.00 0.00 36.38 35.26 1f2s s VAL 52 CO 0.00 0.35 -0.05 0.54 0.00 0.00 0.00 175.10 175.95 1f2s s VAL 53 N -0.37 3.83 0.05 2.92 0.11 -0.06 -0.37 120.40 126.52 1f2s s VAL 53 Ca 0.06 -0.40 0.00 0.00 -2.93 0.00 0.00 61.98 58.71 1f2s s VAL 53 Cb -0.06 -2.64 -0.00 0.00 -1.53 0.00 0.00 36.38 32.15 1f2s s VAL 53 CO -0.01 0.53 0.06 -0.24 -3.33 0.00 0.00 175.10 172.12 1f2s n SER 54 N 3.04 -0.16 -4.83 3.54 2.88 -0.23 -1.08 113.62 116.77 1f2s n SER 54 Ca -0.18 -1.27 -0.35 0.00 -1.33 0.00 0.00 58.87 55.74 1f2s n SER 54 Cb 0.53 0.32 -0.06 0.00 -0.75 0.00 0.00 64.21 64.25 1f2s n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1f2s s ALA 55 N -1.86 3.47 0.39 -1.46 0.00 -1.26 -0.30 121.76 120.73 1f2s s ALA 55 Ca 0.04 0.01 0.08 0.00 0.00 0.00 0.00 51.96 52.10 1f2s s ALA 55 Cb -0.00 -2.68 0.78 0.00 0.00 0.00 0.00 23.12 21.22 1f2s s ALA 55 CO 0.03 0.39 1.94 0.00 0.00 0.00 0.00 175.76 178.12 1f2s h ALA 56 N 3.27 1.54 0.00 0.00 0.00 -1.70 -1.76 119.26 120.60 1f2s h ALA 56 Ca -0.48 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1f2s h ALA 56 Cb 1.19 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1f2s h ALA 56 CO 0.66 0.34 0.00 -2.39 0.00 0.00 0.00 179.25 177.85 1f2s n HIS 57 N -4.32 0.00 1.28 0.00 1.44 -1.26 -1.96 115.22 110.39 1f2s n HIS 57 Ca 0.00 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.84 1f2s n HIS 57 Cb 0.22 -0.29 0.41 0.00 0.12 0.00 0.00 29.99 30.45 1f2s n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1f2s n TYR 59 N 0.41 2.70 -3.52 0.00 9.36 -0.83 -5.00 117.16 120.28 1f2s n TYR 59 Ca 0.18 0.35 -0.18 0.00 3.32 0.00 0.00 57.90 61.57 1f2s n TYR 59 Cb 0.38 -2.54 -0.06 0.00 -0.63 0.00 0.00 39.34 36.49 1f2s n TYR 59 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1f2s s LYS 60 N -0.93 1.07 0.24 2.98 1.02 -1.26 -5.16 119.74 117.70 1f2s s LYS 60 Ca 0.62 0.23 -0.15 0.00 0.02 0.00 0.00 55.97 56.69 1f2s s LYS 60 Cb -0.53 0.50 -0.08 0.00 -0.52 0.00 0.00 37.83 37.21 1f2s s LYS 60 CO 0.53 -0.34 0.66 -1.54 -0.92 0.00 0.00 175.35 173.74 1f2s s SER 61 N -1.26 6.83 -0.62 2.83 1.04 -1.26 -4.30 113.70 116.96 1f2s s SER 61 Ca -0.10 1.20 -0.02 0.00 0.48 0.00 0.00 55.95 57.51 1f2s s SER 61 Cb -0.00 -2.34 0.00 0.00 0.10 0.00 0.00 66.02 63.78 1f2s s SER 61 CO 0.09 -0.05 0.53 0.61 0.98 0.00 0.00 173.24 175.40 1f2s n GLY 62 N 0.20 0.12 3.80 7.32 0.00 -1.26 -5.02 105.19 110.35 1f2s n GLY 62 Ca -0.00 -0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.43 1f2s n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1f2s s ILE 63 N -3.17 4.48 -0.15 -0.61 1.01 -1.26 -4.82 121.20 116.67 1f2s s ILE 63 Ca 0.13 1.48 0.01 0.00 0.00 0.00 0.00 60.65 62.27 1f2s s ILE 63 Cb -0.06 -3.99 -0.00 0.00 0.01 0.00 0.00 42.46 38.43 1f2s s ILE 63 CO 0.36 0.36 -0.16 -1.58 0.00 0.00 0.00 174.94 173.91 1f2s s GLN 64 N -1.58 3.19 -0.14 2.79 0.74 -0.63 -1.04 119.66 123.00 1f2s s GLN 64 Ca 0.39 -0.77 -0.15 0.00 0.05 0.00 0.00 55.36 54.89 1f2s s GLN 64 Cb -0.20 -2.59 -0.05 0.00 1.10 0.00 0.00 33.01 31.28 1f2s s GLN 64 CO 0.23 0.02 0.34 0.08 -0.55 0.00 0.00 175.29 175.41 1f2s s VAL 65 N 0.79 5.26 -0.23 1.34 1.01 0.78 -0.80 120.40 128.56 1f2s s VAL 65 Ca -0.06 0.66 -0.02 0.00 0.00 0.00 0.00 61.98 62.56 1f2s s VAL 65 Cb -0.15 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.56 1f2s s VAL 65 CO -0.00 0.39 -0.08 -0.13 0.00 0.00 0.00 175.10 175.29 1f2s s ARG 66 N 0.34 3.07 0.27 2.72 0.52 -0.18 -1.15 118.95 124.54 1f2s s ARG 66 Ca 0.19 -0.82 0.09 0.00 -0.52 0.00 0.00 55.73 54.67 1f2s s ARG 66 Cb -0.14 -2.92 -0.04 0.00 0.52 0.00 0.00 34.95 32.37 1f2s s ARG 66 CO 0.06 -0.29 0.08 -0.51 0.02 0.00 0.00 175.30 174.66 1f2s s LEU 67 N 1.38 3.40 -1.32 2.53 1.02 0.43 -1.51 118.68 124.61 1f2s s LEU 67 Ca 0.03 -0.53 -0.01 0.00 0.02 0.00 0.00 54.13 53.65 1f2s s LEU 67 Cb -0.15 -1.93 0.00 0.00 0.02 0.00 0.00 46.19 44.13 1f2s s LEU 67 CO -0.06 -0.05 0.07 0.61 0.02 0.00 0.00 176.35 176.95 1f2s n GLY 69 N -1.02 -0.27 3.91 -3.19 0.00 -1.26 -1.40 105.19 101.95 1f2s n GLY 69 Ca -0.06 -0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.44 1f2s n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1f2s s GLU 70 N -4.88 3.58 0.00 1.61 0.41 -1.26 -3.85 118.70 114.31 1f2s s GLU 70 Ca 0.03 -0.17 0.00 0.00 -0.41 0.00 0.00 54.97 54.42 1f2s s GLU 70 Cb -0.01 -2.86 0.00 0.00 -1.78 0.00 0.00 34.13 29.48 1f2s s GLU 70 CO 0.04 0.46 0.00 -3.47 -0.49 0.00 0.00 175.26 171.80 1f2s n ASP 71 N -0.08 0.00 -4.56 -0.19 2.03 -1.26 -4.62 116.55 107.87 1f2s n ASP 71 Ca -0.03 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.85 1f2s n ASP 71 Cb 0.52 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.88 1f2s n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1f2s s ASN 72 N -1.29 6.50 0.39 1.67 3.84 -1.25 -3.25 114.94 121.55 1f2s s ASN 72 Ca 0.00 0.11 0.28 0.00 0.21 0.00 0.00 52.86 53.46 1f2s s ASN 72 Cb 0.00 -2.46 1.10 0.00 -0.55 0.00 0.00 41.25 39.34 1f2s s ASN 72 CO 0.00 -1.09 1.83 0.16 -2.79 0.00 0.00 177.10 175.21 1f2s h ILE 73 N 6.09 0.00 0.13 -5.21 3.07 -1.43 -3.21 117.51 116.96 1f2s h ILE 73 Ca -0.24 -0.41 -0.34 0.00 1.55 0.00 0.00 64.86 65.42 1f2s h ILE 73 Cb 1.07 1.29 -0.01 0.00 -0.27 0.00 0.00 36.82 38.90 1f2s h ILE 73 CO 1.04 0.00 -1.79 0.78 -1.05 0.00 0.00 178.15 177.13 1f2s h ASN 74 N 0.00 0.43 -2.77 2.16 2.35 -1.91 -3.47 115.58 112.37 1f2s h ASN 74 Ca 0.00 -0.75 -0.65 0.00 -0.55 0.00 0.00 56.30 54.35 1f2s h ASN 74 Cb 0.49 -0.14 -0.06 0.00 0.05 0.00 0.00 38.32 38.66 1f2s h ASN 74 CO 0.00 1.65 -0.38 -0.69 -1.65 0.00 0.00 177.43 176.36 1f2s s VAL 75 N -2.58 5.34 -0.20 2.81 1.01 -1.21 -5.07 120.40 120.50 1f2s s VAL 75 Ca -0.16 0.43 -0.25 0.00 0.00 0.00 0.00 61.98 62.01 1f2s s VAL 75 Cb 0.06 -3.51 -0.01 0.00 0.00 0.00 0.00 36.38 32.92 1f2s s VAL 75 CO 0.82 0.60 0.82 -0.69 0.00 0.00 0.00 175.10 176.65 1f2s s VAL 76 N -1.05 4.87 -0.65 2.92 1.01 -1.26 -4.70 120.40 121.54 1f2s s VAL 76 Ca 0.18 1.58 0.05 0.00 0.00 0.00 0.00 61.98 63.80 1f2s s VAL 76 Cb -0.14 -4.12 0.05 0.00 0.00 0.00 0.00 36.38 32.18 1f2s s VAL 76 CO 0.07 -0.00 0.72 -0.62 0.00 0.00 0.00 175.10 175.27 1f2s n GLU 77 N 5.48 0.08 0.00 2.72 1.02 -1.26 -5.02 120.64 123.66 1f2s n GLU 77 Ca 0.04 -0.92 0.00 0.00 -0.02 0.00 0.00 57.16 56.27 1f2s n GLU 77 Cb 0.48 -1.11 0.00 0.00 -0.02 0.00 0.00 31.44 30.80 1f2s n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1f2s n GLY 78 N 0.27 2.05 0.95 0.62 0.00 -1.26 -4.90 105.19 102.93 1f2s n GLY 78 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.15 1f2s n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1f2s n ASN 79 N 0.00 3.13 -4.82 1.61 5.03 -1.26 -5.00 115.26 113.94 1f2s n ASN 79 Ca 0.00 -1.91 -0.32 0.00 0.87 0.00 0.00 54.58 53.22 1f2s n ASN 79 Cb 0.00 -0.21 -0.01 0.00 -1.02 0.00 0.00 39.78 38.54 1f2s n ASN 79 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1f2s s GLU 80 N -1.31 3.62 -0.09 3.52 8.01 -1.25 -4.42 118.70 126.79 1f2s s GLU 80 Ca 0.32 1.06 -0.03 0.00 0.01 0.00 0.00 54.97 56.33 1f2s s GLU 80 Cb 0.19 -2.08 0.04 0.00 -4.31 0.00 0.00 34.13 27.97 1f2s s GLU 80 CO 0.26 -0.55 0.09 -0.65 0.01 0.00 0.00 175.26 174.42 1f2s s GLN 81 N -4.13 -0.01 -0.28 1.61 -0.21 -0.50 -4.97 119.66 111.16 1f2s s GLN 81 Ca 0.61 0.28 -0.06 0.00 0.02 0.00 0.00 55.36 56.21 1f2s s GLN 81 Cb -0.13 -0.85 0.01 0.00 1.00 0.00 0.00 33.01 33.04 1f2s s GLN 81 CO 0.35 -0.43 0.05 -0.06 -2.12 0.00 0.00 175.29 173.09 1f2s s PHE 82 N 2.19 3.13 -0.03 0.91 0.08 -1.26 -0.42 117.98 122.57 1f2s s PHE 82 Ca 0.04 -1.03 0.03 0.00 0.12 0.00 0.00 56.93 56.09 1f2s s PHE 82 Cb -0.13 -2.22 -0.00 0.00 -0.57 0.00 0.00 43.02 40.10 1f2s s PHE 82 CO -0.05 -0.59 -0.12 0.42 -0.10 0.00 0.00 175.22 174.78 1f2s s ILE 83 N 1.48 1.05 0.55 0.64 1.01 -0.30 -4.98 121.20 120.66 1f2s s ILE 83 Ca 0.03 -0.51 -0.18 0.00 0.00 0.00 0.00 60.65 59.98 1f2s s ILE 83 Cb -0.17 -0.92 -0.05 0.00 0.01 0.00 0.00 42.46 41.33 1f2s s ILE 83 CO 0.01 0.31 1.06 -0.44 0.00 0.00 0.00 174.94 175.89 1f2s s SER 84 N 0.09 5.96 0.02 3.58 0.01 -1.26 -0.15 113.70 121.95 1f2s s SER 84 Ca -0.03 1.90 -0.28 0.00 1.31 0.00 0.00 55.95 58.85 1f2s s SER 84 Cb -0.09 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 1f2s s SER 84 CO 0.01 -1.05 0.87 0.00 0.41 0.00 0.00 173.24 173.49 1f2s s ALA 85 N -2.21 3.26 -0.04 1.44 0.00 -0.21 -1.25 121.76 122.74 1f2s s ALA 85 Ca 0.66 0.41 0.02 0.00 0.00 0.00 0.00 51.96 53.05 1f2s s ALA 85 Cb -0.17 -3.18 -0.25 0.00 0.00 0.00 0.00 23.12 19.52 1f2s s ALA 85 CO 0.30 -0.10 0.66 0.66 0.00 0.00 0.00 175.76 177.28 1f2s h SER 86 N 6.29 0.23 -4.76 0.00 4.64 -0.49 -3.44 113.55 116.02 1f2s h SER 86 Ca -0.42 -0.43 -0.05 0.00 -0.47 0.00 0.00 61.79 60.43 1f2s h SER 86 Cb 1.21 -0.07 -0.20 0.00 -0.31 0.00 0.00 62.40 63.03 1f2s h SER 86 CO 0.74 1.37 0.20 -1.59 -0.87 0.00 0.00 176.83 176.68 1f2s s LYS 87 N -2.60 0.99 -0.15 4.77 -2.85 -1.17 -5.00 119.74 113.73 1f2s s LYS 87 Ca -0.11 0.38 0.00 0.00 -1.00 0.00 0.00 55.97 55.25 1f2s s LYS 87 Cb 0.07 0.47 0.02 0.00 -2.06 0.00 0.00 37.83 36.33 1f2s s LYS 87 CO 0.82 -0.28 -0.15 -1.12 0.10 0.00 0.00 175.35 174.72 1f2s s SER 88 N -0.90 2.71 -0.35 0.03 0.01 -1.26 -0.59 113.70 113.34 1f2s s SER 88 Ca -0.08 -0.50 -0.11 0.00 1.31 0.00 0.00 55.95 56.57 1f2s s SER 88 Cb -0.01 -1.20 0.01 0.00 0.21 0.00 0.00 66.02 65.04 1f2s s SER 88 CO 0.08 -0.05 0.19 -0.63 0.41 0.00 0.00 173.24 173.24 1f2s s ILE 89 N 1.45 4.64 0.15 1.44 -1.09 0.11 -4.95 121.20 122.95 1f2s s ILE 89 Ca 0.04 -0.67 -0.19 0.00 -2.23 0.00 0.00 60.65 57.61 1f2s s ILE 89 Cb -0.13 -3.50 -0.07 0.00 -1.58 0.00 0.00 42.46 37.17 1f2s s ILE 89 CO -0.10 -0.12 0.64 -0.69 -1.23 0.00 0.00 174.94 173.43 1f2s s VAL 90 N 1.59 4.67 0.26 2.92 1.01 -1.26 -1.11 120.40 128.47 1f2s s VAL 90 Ca 0.03 1.20 -0.31 0.00 0.00 0.00 0.00 61.98 62.91 1f2s s VAL 90 Cb -0.18 -3.88 -0.12 0.00 0.00 0.00 0.00 36.38 32.20 1f2s s VAL 90 CO 0.07 0.37 1.60 1.57 0.00 0.00 0.00 175.10 178.71 1f2s n HIS 91 N 1.17 2.70 -0.30 5.22 -0.00 -1.06 -4.87 115.22 118.08 1f2s n HIS 91 Ca -0.06 0.23 0.29 0.00 0.46 0.00 0.00 57.72 58.64 1f2s n HIS 91 Cb 0.51 -2.59 0.65 0.00 -0.12 0.00 0.00 29.99 28.43 1f2s n HIS 91 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1f2s h PRO 92 N 5.26 0.15 -0.38 1.57 0.11 -1.93 -1.14 132.00 135.65 1f2s h PRO 92 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1f2s h PRO 92 Cb 1.23 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1f2s h PRO 92 CO 0.83 0.10 0.00 0.43 -0.21 0.00 0.00 178.00 179.16 1f2s n SER 93 N -4.38 4.46 -4.74 -2.05 7.64 -1.26 -5.01 113.62 108.28 1f2s n SER 93 Ca 0.25 -2.91 -0.41 0.00 1.01 0.00 0.00 58.87 56.80 1f2s n SER 93 Cb 1.06 -0.57 -0.02 0.00 -1.01 0.00 0.00 64.21 63.66 1f2s n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1f2s s TYR 94 N -2.66 2.95 -0.26 1.43 5.04 -0.43 -4.65 117.35 118.77 1f2s s TYR 94 Ca 0.46 0.90 0.03 0.00 -2.44 0.00 0.00 57.07 56.02 1f2s s TYR 94 Cb 0.35 -3.91 0.06 0.00 0.35 0.00 0.00 41.96 38.82 1f2s s TYR 94 CO 0.12 -3.04 -0.11 1.21 -1.34 0.00 0.00 175.55 172.39 1f2s s ASN 95 N 0.50 4.41 0.42 4.32 3.84 -0.64 -4.99 114.94 122.80 1f2s s ASN 95 Ca 0.62 -1.38 0.30 0.00 0.21 0.00 0.00 52.86 52.61 1f2s s ASN 95 Cb -0.44 -1.54 1.43 0.00 -0.55 0.00 0.00 41.25 40.15 1f2s s ASN 95 CO 0.43 -0.19 1.89 0.77 -2.79 0.00 0.00 177.10 177.22 1f2s h SER 96 N 7.78 0.00 0.25 -4.21 4.64 -1.94 0.50 113.55 120.57 1f2s h SER 96 Ca -0.20 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.78 1f2s h SER 96 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1f2s h SER 96 CO 0.46 0.00 -1.73 0.78 -0.87 0.00 0.00 176.83 175.47 1f2s h ASN 97 N 0.00 0.52 0.00 4.97 2.35 -1.97 -3.38 115.58 118.07 1f2s h ASN 97 Ca 0.00 -0.82 0.00 0.00 -0.55 0.00 0.00 56.30 54.93 1f2s h ASN 97 Cb 0.21 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.41 1f2s h ASN 97 CO 0.00 1.69 -1.09 0.35 -1.65 0.00 0.00 177.43 176.74 1f2s n THR 98 N -3.53 0.00 -1.56 2.81 -2.24 -1.14 -4.99 114.28 103.63 1f2s n THR 98 Ca -0.23 -0.19 -0.14 0.00 -2.27 0.00 0.00 64.05 61.22 1f2s n THR 98 Cb 1.06 0.74 -0.05 0.00 -2.10 0.00 0.00 70.33 69.99 1f2s n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1f2s n LEU 99 N -1.60 -1.13 -4.75 3.22 4.77 0.17 -4.98 117.00 112.70 1f2s n LEU 99 Ca 0.01 0.28 -0.41 0.00 -0.03 0.00 0.00 56.01 55.87 1f2s n LEU 99 Cb 0.32 -2.09 -0.04 0.00 -2.33 0.00 0.00 43.42 39.28 1f2s n LEU 99 CO 0.35 -0.62 0.82 0.21 -1.33 0.00 0.00 177.39 176.82 1f2s s ASN 100 N -2.76 7.22 -1.12 -1.43 2.47 -1.20 -3.16 114.94 114.95 1f2s s ASN 100 Ca 0.00 2.23 -0.04 0.00 0.42 0.00 0.00 52.86 55.47 1f2s s ASN 100 Cb 0.00 -2.62 0.00 0.00 -1.45 0.00 0.00 41.25 37.19 1f2s s ASN 100 CO 0.00 -0.22 0.96 0.59 -3.72 0.00 0.00 177.10 174.71 1f2s n ASN 101 N 1.76 -4.14 -4.34 -4.21 4.13 -1.26 -1.63 115.26 105.57 1f2s n ASN 101 Ca 0.01 -0.50 -0.43 0.00 1.68 0.00 0.00 54.58 55.34 1f2s n ASN 101 Cb 0.45 -4.46 0.00 0.00 -1.54 0.00 0.00 39.78 34.23 1f2s n ASN 101 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1f2s n ASP 102 N -2.60 4.72 -3.80 6.41 2.03 -1.19 -4.29 116.55 117.82 1f2s n ASP 102 Ca -0.11 -2.91 -0.12 0.00 0.52 0.00 0.00 54.79 52.16 1f2s n ASP 102 Cb 0.59 -1.70 -0.10 0.00 -0.72 0.00 0.00 41.12 39.19 1f2s n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1f2s s ILE 103 N 3.57 0.04 -0.03 5.18 2.07 -1.26 -3.96 121.20 126.82 1f2s s ILE 103 Ca 0.51 -0.36 -0.15 0.00 -1.41 0.00 0.00 60.65 59.24 1f2s s ILE 103 Cb 0.06 -0.47 0.03 0.00 0.13 0.00 0.00 42.46 42.20 1f2s s ILE 103 CO 0.03 -0.20 0.32 -0.32 -1.91 0.00 0.00 174.94 172.86 1f2s s MET 104 N -0.80 0.64 -0.10 3.50 -2.45 0.59 -2.55 119.30 118.13 1f2s s MET 104 Ca -0.09 -0.10 0.02 0.00 -1.25 0.00 0.00 55.69 54.27 1f2s s MET 104 Cb -0.05 0.29 -0.02 0.00 1.25 0.00 0.00 34.83 36.31 1f2s s MET 104 CO 0.02 -0.17 -0.16 -0.51 1.05 0.00 0.00 175.02 175.25 1f2s s LEU 105 N -1.14 2.58 -0.15 4.11 1.02 -0.27 -1.07 118.68 123.76 1f2s s LEU 105 Ca -0.12 -0.33 0.02 0.00 0.02 0.00 0.00 54.13 53.71 1f2s s LEU 105 Cb -0.05 -1.55 0.01 0.00 0.02 0.00 0.00 46.19 44.63 1f2s s LEU 105 CO 0.04 0.23 -0.20 -0.63 0.02 0.00 0.00 176.35 175.80 1f2s s ILE 106 N -0.02 2.14 -0.08 -0.59 1.01 0.51 0.05 121.20 124.21 1f2s s ILE 106 Ca -0.04 -0.94 -0.15 0.00 0.00 0.00 0.00 60.65 59.52 1f2s s ILE 106 Cb -0.14 -1.87 -0.05 0.00 0.01 0.00 0.00 42.46 40.40 1f2s s ILE 106 CO 0.04 0.54 0.37 -0.75 0.00 0.00 0.00 174.94 175.14 1f2s s LYS 107 N 0.96 4.07 0.29 2.79 2.20 0.24 -0.99 119.74 129.30 1f2s s LYS 107 Ca -0.03 0.29 -0.21 0.00 -0.36 0.00 0.00 55.97 55.66 1f2s s LYS 107 Cb -0.15 -3.33 -0.09 0.00 -1.51 0.00 0.00 37.83 32.76 1f2s s LYS 107 CO -0.05 0.45 0.81 -0.51 -0.36 0.00 0.00 175.35 175.69 1f2s s LEU 108 N -0.25 4.26 0.45 5.43 1.43 0.28 0.20 118.68 130.48 1f2s s LEU 108 Ca 0.21 1.55 0.21 0.00 -1.03 0.00 0.00 54.13 55.07 1f2s s LEU 108 Cb -0.15 -3.89 1.09 0.00 0.03 0.00 0.00 46.19 43.27 1f2s s LEU 108 CO 0.09 -0.07 1.94 0.50 0.23 0.00 0.00 176.35 179.04 1f2s h LYS 109 N 3.01 0.00 -3.92 1.70 3.64 -1.47 -3.42 116.57 116.12 1f2s h LYS 109 Ca -0.48 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 58.73 1f2s h LYS 109 Cb 1.19 0.00 -0.22 0.00 -0.41 0.00 0.00 32.23 32.79 1f2s h LYS 109 CO 0.65 0.23 -0.69 -1.12 -2.27 0.00 0.00 179.45 176.24 1f2s s SER 110 N -6.46 0.19 0.29 4.20 0.01 -1.26 -5.00 113.70 105.67 1f2s s SER 110 Ca -0.02 -0.41 -0.29 0.00 1.31 0.00 0.00 55.95 56.53 1f2s s SER 110 Cb 0.13 0.09 -0.10 0.00 0.21 0.00 0.00 66.02 66.35 1f2s s SER 110 CO 0.65 -0.26 1.25 0.00 0.41 0.00 0.00 173.24 175.28 1f2s s ALA 111 N -1.24 3.48 0.38 1.44 0.00 -1.26 -4.87 121.76 119.69 1f2s s ALA 111 Ca -0.14 1.13 -0.24 0.00 0.00 0.00 0.00 51.96 52.71 1f2s s ALA 111 Cb -0.08 -3.43 -0.10 0.00 0.00 0.00 0.00 23.12 19.50 1f2s s ALA 111 CO -0.01 -0.48 0.98 0.00 0.00 0.00 0.00 175.76 176.25 1f2s s ALA 112 N -0.91 3.12 -0.29 0.00 0.00 0.77 -5.01 121.76 119.44 1f2s s ALA 112 Ca 0.49 0.55 -0.25 0.00 0.00 0.00 0.00 51.96 52.75 1f2s s ALA 112 Cb -0.37 -3.21 0.00 0.00 0.00 0.00 0.00 23.12 19.55 1f2s s ALA 112 CO 0.47 0.03 0.88 0.45 0.00 0.00 0.00 175.76 177.58 1f2s s SER 113 N -1.75 6.78 0.19 0.00 0.15 -1.26 -4.81 113.70 113.00 1f2s s SER 113 Ca 0.56 0.87 -0.23 0.00 0.70 0.00 0.00 55.95 57.85 1f2s s SER 113 Cb -0.17 -2.45 -0.08 0.00 -1.71 0.00 0.00 66.02 61.61 1f2s s SER 113 CO 0.22 -0.66 0.76 -0.76 1.20 0.00 0.00 173.24 174.00 1f2s s LEU 114 N 3.10 4.49 0.00 3.45 1.43 -1.26 -4.79 118.68 125.10 1f2s s LEU 114 Ca 0.36 1.56 0.00 0.00 -1.03 0.00 0.00 54.13 55.02 1f2s s LEU 114 Cb -0.14 -3.41 0.00 0.00 0.03 0.00 0.00 46.19 42.67 1f2s s LEU 114 CO 0.12 0.14 0.00 -0.46 0.23 0.00 0.00 176.35 176.38 1f2s n ASN 115 N 1.25 0.00 0.21 2.29 0.23 -0.05 -4.97 115.26 114.23 1f2s n ASN 115 Ca -0.04 0.00 0.08 0.00 -0.53 0.00 0.00 54.58 54.08 1f2s n ASN 115 Cb 0.50 0.00 0.46 0.00 -2.08 0.00 0.00 39.78 38.66 1f2s n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1f2s h SER 116 N 0.00 0.00 0.06 0.53 4.64 -2.01 -3.23 113.55 113.54 1f2s h SER 116 Ca 0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 1f2s h SER 116 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 1f2s h SER 116 CO 0.00 0.28 -2.09 0.54 -0.87 0.00 0.00 176.83 174.69 1f2s n ARG 117 N -3.59 0.67 -4.07 4.77 3.00 -1.26 -4.88 116.66 111.30 1f2s n ARG 117 Ca -0.01 -0.10 -0.32 0.00 -0.01 0.00 0.00 57.85 57.41 1f2s n ARG 117 Cb 0.41 -1.54 -0.16 0.00 0.00 0.00 0.00 32.46 31.18 1f2s n ARG 117 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1f2s s VAL 118 N -3.10 2.02 0.04 1.55 1.01 -1.22 -4.39 120.40 116.30 1f2s s VAL 118 Ca -0.08 -1.28 -0.09 0.00 0.00 0.00 0.00 61.98 60.52 1f2s s VAL 118 Cb 0.11 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 34.47 1f2s s VAL 118 CO 0.87 0.19 0.20 0.00 0.00 0.00 0.00 175.10 176.36 1f2s s ALA 119 N 1.23 -0.36 0.52 5.51 0.00 -1.00 -0.87 121.76 126.79 1f2s s ALA 119 Ca -0.03 -0.28 -0.05 0.00 0.00 0.00 0.00 51.96 51.59 1f2s s ALA 119 Cb -0.17 0.28 -0.02 0.00 0.00 0.00 0.00 23.12 23.21 1f2s s ALA 119 CO -0.08 -0.36 0.83 -1.54 0.00 0.00 0.00 175.76 174.60 1f2s s SER 120 N -2.10 6.05 -0.06 0.00 1.04 -1.26 -2.79 113.70 114.57 1f2s s SER 120 Ca -0.05 0.86 0.02 0.00 0.48 0.00 0.00 55.95 57.26 1f2s s SER 120 Cb -0.01 -2.07 -0.03 0.00 0.10 0.00 0.00 66.02 64.01 1f2s s SER 120 CO -0.04 -0.74 -0.10 -0.51 0.98 0.00 0.00 173.24 172.83 1f2s s ILE 121 N -2.83 3.44 0.38 -1.02 1.10 -0.43 -4.87 121.20 116.98 1f2s s ILE 121 Ca 0.50 -0.58 -0.26 0.00 -0.51 0.00 0.00 60.65 59.80 1f2s s ILE 121 Cb -0.10 -2.39 -0.09 0.00 0.15 0.00 0.00 42.46 40.03 1f2s s ILE 121 CO 0.45 0.60 1.15 -0.44 -2.11 0.00 0.00 174.94 174.59 1f2s s SER 122 N -0.77 6.65 0.36 4.50 0.01 -1.26 -4.65 113.70 118.54 1f2s s SER 122 Ca 0.12 2.31 -0.23 0.00 1.31 0.00 0.00 55.95 59.45 1f2s s SER 122 Cb -0.11 -2.61 -0.10 0.00 0.21 0.00 0.00 66.02 63.41 1f2s s SER 122 CO 0.01 -0.58 0.92 -0.76 0.41 0.00 0.00 173.24 173.24 1f2s s LEU 123 N -2.36 4.18 0.60 2.44 1.43 -1.26 -1.31 118.68 122.40 1f2s s LEU 123 Ca 0.55 1.73 -0.15 0.00 -1.03 0.00 0.00 54.13 55.23 1f2s s LEU 123 Cb -0.30 -4.18 -0.03 0.00 0.03 0.00 0.00 46.19 41.70 1f2s s LEU 123 CO 0.38 -0.17 1.05 -2.16 0.23 0.00 0.00 176.35 175.68 1f2s s PRO 124 N -2.50 3.32 -0.04 1.29 0.04 -1.26 -4.82 135.00 131.03 1f2s s PRO 124 Ca 0.54 1.17 0.18 0.00 0.04 0.00 0.00 61.00 62.94 1f2s s PRO 124 Cb -0.15 -2.03 -0.28 0.00 0.04 0.00 0.00 34.50 32.08 1f2s s PRO 124 CO 0.19 -0.81 0.37 0.25 0.04 0.00 0.00 177.00 177.05 1f2s n THR 125 N -2.10 0.12 -3.92 1.26 -2.24 -1.26 -4.96 114.28 101.18 1f2s n THR 125 Ca 0.09 -0.45 -0.09 0.00 -2.27 0.00 0.00 64.05 61.33 1f2s n THR 125 Cb 0.53 0.02 -0.08 0.00 -2.10 0.00 0.00 70.33 68.70 1f2s n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1f2s s SER 127 N -4.22 0.19 0.48 3.42 1.04 -1.26 -5.15 113.70 108.20 1f2s s SER 127 Ca -0.07 -0.76 -0.20 0.00 0.48 0.00 0.00 55.95 55.40 1f2s s SER 127 Cb 0.11 0.32 -0.09 0.00 0.10 0.00 0.00 66.02 66.46 1f2s s SER 127 CO 0.76 -0.72 1.00 0.00 0.98 0.00 0.00 173.24 175.26 1f2s s ALA 129 N -2.21 3.30 0.38 0.00 0.00 -1.26 -5.08 121.76 116.90 1f2s s ALA 129 Ca 0.63 0.01 -0.00 0.00 0.00 0.00 0.00 51.96 52.60 1f2s s ALA 129 Cb -0.12 -2.79 -0.03 0.00 0.00 0.00 0.00 23.12 20.18 1f2s s ALA 129 CO 0.20 0.21 0.60 -1.54 0.00 0.00 0.00 175.76 175.24 1f2s s SER 130 N -2.52 6.23 0.35 0.00 1.04 -1.26 -5.04 113.70 112.51 1f2s s SER 130 Ca 0.54 0.51 -0.28 0.00 0.48 0.00 0.00 55.95 57.20 1f2s s SER 130 Cb -0.10 -2.01 -0.11 0.00 0.10 0.00 0.00 66.02 63.90 1f2s s SER 130 CO 0.21 -0.39 1.48 0.00 0.98 0.00 0.00 173.24 175.52 1f2s s ALA 132 N -2.42 3.59 0.00 5.32 0.00 -1.26 -2.35 121.76 124.64 1f2s s ALA 132 Ca 0.42 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.91 1f2s s ALA 132 Cb -0.10 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.43 1f2s s ALA 132 CO 0.38 -0.98 0.00 0.41 0.00 0.00 0.00 175.76 175.56 1f2s n GLY 133 N 0.80 2.54 3.72 0.00 0.00 0.22 -4.94 105.19 107.53 1f2s n GLY 133 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1f2s n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1f2s s THR 134 N -2.72 3.50 0.03 2.61 2.01 -0.99 -4.70 115.64 115.39 1f2s s THR 134 Ca 0.00 1.12 -0.30 0.00 0.31 0.00 0.00 61.69 62.82 1f2s s THR 134 Cb 0.00 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 1f2s s THR 134 CO 0.00 0.11 1.01 -1.10 -0.69 0.00 0.00 174.62 173.95 1f2s s GLN 135 N 0.77 4.56 0.28 4.92 -1.52 -1.26 -1.79 119.66 125.63 1f2s s GLN 135 Ca 0.61 1.49 0.06 0.00 -1.95 0.00 0.00 55.36 55.57 1f2s s GLN 135 Cb -0.34 -3.42 -0.06 0.00 -0.22 0.00 0.00 33.01 28.96 1f2s s GLN 135 CO 0.32 -0.04 -0.05 0.00 -0.25 0.00 0.00 175.29 175.27 1f2s s LEU 137 N -3.44 2.66 -0.08 0.00 2.96 0.43 -0.95 118.68 120.26 1f2s s LEU 137 Ca 0.30 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.78 1f2s s LEU 137 Cb 0.04 -1.65 -0.02 0.00 0.50 0.00 0.00 46.19 45.06 1f2s s LEU 137 CO 0.12 0.02 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.41 1f2s s ILE 138 N 1.22 3.11 0.04 6.68 1.01 0.65 -1.35 121.20 132.55 1f2s s ILE 138 Ca 0.02 -0.69 -0.01 0.00 0.00 0.00 0.00 60.65 59.98 1f2s s ILE 138 Cb -0.14 -2.25 -0.03 0.00 0.01 0.00 0.00 42.46 40.05 1f2s s ILE 138 CO -0.04 0.57 -0.03 -0.94 0.00 0.00 0.00 174.94 174.50 1f2s s SER 139 N -0.40 0.39 0.00 3.58 1.04 -1.22 -0.09 113.70 117.00 1f2s s SER 139 Ca 0.05 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.68 1f2s s SER 139 Cb -0.12 0.16 0.00 0.00 0.10 0.00 0.00 66.02 66.16 1f2s s SER 139 CO 0.02 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.37 1f2s n GLY 140 N 0.70 0.75 1.58 7.32 0.00 -0.59 -4.48 105.19 110.47 1f2s n GLY 140 Ca -0.18 -0.96 -0.05 0.00 0.00 0.00 0.00 46.02 44.83 1f2s n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1f2s n TRP 141 N -0.40 1.87 -1.88 1.61 8.01 -1.26 -1.95 117.44 123.44 1f2s n TRP 141 Ca 0.00 -1.32 -0.30 0.00 -1.31 0.00 0.00 57.50 54.57 1f2s n TRP 141 Cb 0.00 -0.59 0.17 0.00 -2.01 0.00 0.00 31.31 28.88 1f2s n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1f2s s GLY 142 N -1.65 1.74 0.30 6.99 0.00 -1.24 -4.38 107.32 109.07 1f2s s GLY 142 Ca 0.50 -1.10 -0.27 0.00 0.00 0.00 0.00 44.72 43.85 1f2s s GLY 142 CO 0.09 -0.37 0.88 -2.01 0.00 0.00 0.00 173.10 171.69 1f2s n ASN 143 N -3.75 0.67 -0.76 1.64 2.85 0.22 -2.55 115.26 113.58 1f2s n ASN 143 Ca 0.14 1.14 0.08 0.00 -0.11 0.00 0.00 54.58 55.82 1f2s n ASN 143 Cb 0.60 -1.22 0.14 0.00 1.24 0.00 0.00 39.78 40.54 1f2s n ASN 143 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1f2s n THR 144 N 0.04 0.53 -5.25 -0.44 -2.24 0.25 -0.58 114.28 106.57 1f2s n THR 144 Ca 0.11 -0.76 -0.31 0.00 -2.27 0.00 0.00 64.05 60.82 1f2s n THR 144 Cb 0.32 0.89 -0.16 0.00 -2.10 0.00 0.00 70.33 69.28 1f2s n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1f2s s LYS 145 N -1.14 2.05 0.09 -0.78 1.02 -1.26 -4.36 119.74 115.36 1f2s s LYS 145 Ca 0.26 -0.94 -0.03 0.00 0.02 0.00 0.00 55.97 55.28 1f2s s LYS 145 Cb 0.15 -2.01 -0.25 0.00 -0.52 0.00 0.00 37.83 35.20 1f2s s LYS 145 CO 0.21 0.55 1.18 0.66 -0.92 0.00 0.00 175.35 177.02 1f2s h SER 146 N 5.43 0.38 -3.30 2.83 4.64 -1.94 -3.42 113.55 118.16 1f2s h SER 146 Ca -0.43 -0.40 -0.64 0.00 -0.47 0.00 0.00 61.79 59.86 1f2s h SER 146 Cb 1.12 -0.12 -0.36 0.00 -0.31 0.00 0.00 62.40 62.73 1f2s h SER 146 CO 0.47 1.30 -0.83 -0.44 -0.87 0.00 0.00 176.83 176.45 1f2s s SER 147 N -7.09 3.31 0.00 4.97 0.01 -1.26 -4.70 113.70 108.93 1f2s s SER 147 Ca -0.04 -0.80 0.00 0.00 1.31 0.00 0.00 55.95 56.43 1f2s s SER 147 Cb 0.08 -1.35 0.00 0.00 0.21 0.00 0.00 66.02 64.96 1f2s s SER 147 CO 0.87 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 175.05 1f2s n GLY 148 N 4.65 -0.02 3.20 3.44 0.00 -1.26 -5.01 105.19 110.19 1f2s n GLY 148 Ca -0.17 -1.88 -0.13 0.00 0.00 0.00 0.00 46.02 43.84 1f2s n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1f2s s THR 149 N 0.00 0.01 -0.30 2.61 2.01 -1.26 -4.82 115.64 113.88 1f2s s THR 149 Ca 0.00 -0.05 -0.08 0.00 0.31 0.00 0.00 61.69 61.87 1f2s s THR 149 Cb 0.00 -0.45 0.18 0.00 0.01 0.00 0.00 72.50 72.24 1f2s s THR 149 CO 0.00 -0.03 0.89 -0.55 -0.69 0.00 0.00 174.62 174.24 1f2s s SER 150 N 0.02 -0.79 -0.21 3.53 0.15 -1.26 -4.93 113.70 110.21 1f2s s SER 150 Ca -0.01 0.45 -0.07 0.00 0.70 0.00 0.00 55.95 57.01 1f2s s SER 150 Cb -0.03 1.64 -0.04 0.00 -1.71 0.00 0.00 66.02 65.89 1f2s s SER 150 CO 0.01 -0.15 0.06 -0.31 1.20 0.00 0.00 173.24 174.05 1f2s s TYR 151 N 2.92 3.17 0.60 3.44 2.02 -1.26 -0.59 117.35 127.64 1f2s s TYR 151 Ca 0.08 -0.13 -0.14 0.00 -0.37 0.00 0.00 57.07 56.51 1f2s s TYR 151 Cb -0.11 -2.14 -0.04 0.00 -0.40 0.00 0.00 41.96 39.27 1f2s s TYR 151 CO -0.16 -0.06 1.03 -1.25 -1.57 0.00 0.00 175.55 173.55 1f2s s PRO 152 N 0.88 3.46 -0.03 -1.71 0.04 -1.26 -5.00 135.00 131.37 1f2s s PRO 152 Ca 0.03 1.01 0.19 0.00 0.04 0.00 0.00 61.00 62.28 1f2s s PRO 152 Cb -0.14 -2.06 -0.21 0.00 0.04 0.00 0.00 34.50 32.13 1f2s s PRO 152 CO 0.02 -0.68 0.53 -0.40 0.04 0.00 0.00 177.00 176.51 1f2s n ASP 153 N -2.24 0.40 -4.65 6.66 3.85 -1.26 -4.93 116.55 114.38 1f2s n ASP 153 Ca 0.07 0.17 -0.27 0.00 -0.71 0.00 0.00 54.79 54.06 1f2s n ASP 153 Cb 0.53 0.87 -0.08 0.00 -1.35 0.00 0.00 41.12 41.09 1f2s n ASP 153 CO 0.00 0.00 0.00 0.68 -1.01 0.00 0.00 177.20 176.87 1f2s s VAL 154 N -2.97 3.62 0.19 2.12 -7.23 -1.26 -0.99 120.40 113.88 1f2s s VAL 154 Ca -0.06 -1.47 -0.31 0.00 -1.81 0.00 0.00 61.98 58.32 1f2s s VAL 154 Cb 0.09 -2.82 -0.11 0.00 0.56 0.00 0.00 36.38 34.11 1f2s s VAL 154 CO 0.84 -0.11 1.59 -0.22 -0.31 0.00 0.00 175.10 176.89 1f2s s LEU 155 N -2.93 4.37 0.13 1.32 2.96 -1.20 -4.86 118.68 118.47 1f2s s LEU 155 Ca 0.27 2.70 0.04 0.00 -0.22 0.00 0.00 54.13 56.92 1f2s s LEU 155 Cb -0.09 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 1f2s s LEU 155 CO 0.18 -0.85 0.12 -0.54 -1.32 0.00 0.00 176.35 173.94 1f2s s LYS 156 N 0.87 2.93 0.12 1.98 -0.14 -0.82 -2.32 119.74 122.35 1f2s s LYS 156 Ca 0.69 -0.79 0.06 0.00 -1.36 0.00 0.00 55.97 54.58 1f2s s LYS 156 Cb -0.45 -2.69 -0.04 0.00 -1.68 0.00 0.00 37.83 32.97 1f2s s LYS 156 CO 0.34 0.52 -0.15 0.00 -0.76 0.00 0.00 175.35 175.29 1f2s s LEU 158 N -2.33 0.37 -0.25 0.00 2.96 0.87 -1.33 118.68 118.96 1f2s s LEU 158 Ca 0.08 0.67 -0.11 0.00 -0.22 0.00 0.00 54.13 54.55 1f2s s LEU 158 Cb -0.06 1.02 -0.05 0.00 0.50 0.00 0.00 46.19 47.59 1f2s s LEU 158 CO 0.04 -0.16 0.17 -0.54 -1.32 0.00 0.00 176.35 174.54 1f2s s LYS 159 N 1.00 4.03 -0.03 1.98 1.02 -1.26 -0.25 119.74 126.22 1f2s s LYS 159 Ca -0.07 -0.29 -0.06 0.00 0.02 0.00 0.00 55.97 55.57 1f2s s LYS 159 Cb -0.07 -3.58 0.01 0.00 -0.52 0.00 0.00 37.83 33.66 1f2s s LYS 159 CO -0.07 -0.02 0.14 0.00 -0.92 0.00 0.00 175.35 174.48 1f2s s ALA 160 N 1.30 -0.35 0.34 5.17 0.00 -0.12 -4.94 121.76 123.16 1f2s s ALA 160 Ca 0.07 0.15 -0.10 0.00 0.00 0.00 0.00 51.96 52.08 1f2s s ALA 160 Cb -0.14 -0.08 -0.07 0.00 0.00 0.00 0.00 23.12 22.83 1f2s s ALA 160 CO 0.07 -0.14 0.70 -1.25 0.00 0.00 0.00 175.76 175.13 1f2s s PRO 161 N -0.64 3.81 0.11 0.00 0.04 -1.26 -0.42 135.00 136.64 1f2s s PRO 161 Ca -0.07 0.41 -0.30 0.00 0.04 0.00 0.00 61.00 61.08 1f2s s PRO 161 Cb -0.04 -2.48 -0.06 0.00 0.04 0.00 0.00 34.50 31.96 1f2s s PRO 161 CO 0.01 0.10 1.11 0.42 0.04 0.00 0.00 177.00 178.68 1f2s s ILE 162 N -2.16 4.07 0.40 0.56 1.01 -0.74 -2.27 121.20 122.07 1f2s s ILE 162 Ca 0.50 1.63 -0.03 0.00 0.00 0.00 0.00 60.65 62.75 1f2s s ILE 162 Cb -0.10 -4.04 -0.04 0.00 0.01 0.00 0.00 42.46 38.29 1f2s s ILE 162 CO 0.27 0.21 0.66 -0.76 0.00 0.00 0.00 174.94 175.32 1f2s s LEU 163 N 0.29 3.84 0.64 2.97 1.43 0.07 -0.61 118.68 127.31 1f2s s LEU 163 Ca 0.53 0.70 -0.16 0.00 -1.03 0.00 0.00 54.13 54.17 1f2s s LEU 163 Cb -0.28 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.33 1f2s s LEU 163 CO 0.32 -0.42 1.14 -0.94 0.23 0.00 0.00 176.35 176.68 1f2s s SER 164 N -3.98 5.11 0.22 2.29 1.04 -1.26 -4.63 113.70 112.49 1f2s s SER 164 Ca 0.44 2.13 -0.08 0.00 0.48 0.00 0.00 55.95 58.91 1f2s s SER 164 Cb -0.10 -2.57 0.31 0.00 0.10 0.00 0.00 66.02 63.76 1f2s s SER 164 CO 0.39 -1.63 1.75 -2.24 0.98 0.00 0.00 173.24 172.49 1f2s h ASP 165 N 0.32 0.27 -0.20 7.02 -0.00 -1.97 -2.06 116.42 119.80 1f2s h ASP 165 Ca -0.48 0.08 0.01 0.00 -0.00 0.00 0.00 57.03 56.64 1f2s h ASP 165 Cb 1.26 0.05 -0.01 0.00 -0.00 0.00 0.00 39.33 40.63 1f2s h ASP 165 CO 0.54 0.15 0.11 0.77 -0.00 0.00 0.00 179.24 180.81 1f2s h SER 166 N 0.44 0.17 -0.74 4.15 4.64 -2.00 -1.86 113.55 118.36 1f2s h SER 166 Ca 0.33 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.71 1f2s h SER 166 Cb 0.41 -0.03 -0.06 0.00 -0.31 0.00 0.00 62.40 62.41 1f2s h SER 166 CO -0.31 0.13 0.43 0.28 -0.87 0.00 0.00 176.83 176.49 1f2s h SER 167 N 0.23 0.66 -0.20 4.97 0.02 -1.80 -1.38 113.55 116.04 1f2s h SER 167 Ca 0.08 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 1f2s h SER 167 Cb 0.01 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 1f2s h SER 167 CO -0.05 0.42 0.07 0.00 -1.14 0.00 0.00 176.83 176.13 1f2s h LYS 169 N 0.15 0.47 0.00 0.00 1.57 -1.07 -1.94 116.57 115.74 1f2s h LYS 169 Ca 0.06 -0.19 -0.10 0.00 -1.87 0.00 0.00 60.65 58.55 1f2s h LYS 169 Cb 0.21 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1f2s h LYS 169 CO -0.00 0.72 -0.49 0.77 -0.57 0.00 0.00 179.45 179.87 1f2s h SER 170 N 0.41 0.00 0.05 0.86 0.02 -1.21 -2.45 113.55 111.24 1f2s h SER 170 Ca 0.05 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.78 1f2s h SER 170 Cb 0.72 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.27 1f2s h SER 170 CO 0.06 0.49 -0.86 0.00 -1.14 0.00 0.00 176.83 175.38 1f2s h ALA 171 N 1.51 0.34 -2.36 3.77 0.00 -0.97 -3.38 119.26 118.18 1f2s h ALA 171 Ca -0.00 -0.64 -0.59 0.00 0.00 0.00 0.00 54.91 53.67 1f2s h ALA 171 Cb 0.95 -0.01 -0.41 0.00 0.00 0.00 0.00 17.79 18.32 1f2s h ALA 171 CO 0.06 0.72 -0.77 0.66 0.00 0.00 0.00 179.25 179.92 1f2s n TYR 172 N -3.86 1.90 -1.67 0.00 4.01 -0.77 -4.93 117.16 111.84 1f2s n TYR 172 Ca -0.07 -3.92 -0.56 0.00 -0.16 0.00 0.00 57.90 53.19 1f2s n TYR 172 Cb 0.78 -0.40 -0.07 0.00 -0.31 0.00 0.00 39.34 39.34 1f2s n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1f2s n PRO 173 N 1.51 1.27 -0.93 -0.72 -0.02 -0.93 -1.47 135.00 133.70 1f2s n PRO 173 Ca 0.26 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1f2s n PRO 173 Cb 0.44 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1f2s n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1f2s n GLY 174 N 4.59 0.42 0.00 -1.23 0.00 -1.26 -4.86 105.19 102.86 1f2s n GLY 174 Ca 0.28 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.35 1f2s n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1f2s n GLN 175 N -1.67 3.47 -3.41 1.61 6.02 -0.54 -4.96 117.38 117.89 1f2s n GLN 175 Ca 0.00 -0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.61 1f2s n GLN 175 Cb 0.12 -1.00 -0.08 0.00 1.02 0.00 0.00 30.24 30.30 1f2s n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1f2s s ILE 176 N -2.01 5.20 0.54 5.09 -1.09 -1.24 -5.06 121.20 122.64 1f2s s ILE 176 Ca 0.04 0.65 0.08 0.00 -2.23 0.00 0.00 60.65 59.19 1f2s s ILE 176 Cb 0.08 -3.71 0.06 0.00 -1.58 0.00 0.00 42.46 37.31 1f2s s ILE 176 CO 0.43 0.24 0.65 0.42 -1.23 0.00 0.00 174.94 175.45 1f2s s THR 177 N 1.42 2.13 -0.88 2.92 -4.23 -1.26 -5.00 115.64 110.74 1f2s s THR 177 Ca 0.18 -1.15 0.16 0.00 -1.18 0.00 0.00 61.69 59.69 1f2s s THR 177 Cb -0.15 -2.28 0.14 0.00 1.34 0.00 0.00 72.50 71.56 1f2s s THR 177 CO 0.08 0.00 1.49 -1.54 -0.54 0.00 0.00 174.62 174.11 1f2s n SER 178 N -2.04 0.15 -1.89 3.99 3.41 -1.26 -2.56 113.62 113.42 1f2s n SER 178 Ca 0.10 0.54 0.01 0.00 -0.26 0.00 0.00 58.87 59.25 1f2s n SER 178 Cb 0.62 -0.57 0.35 0.00 -0.26 0.00 0.00 64.21 64.35 1f2s n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1f2s n ASN 179 N -1.66 5.19 -4.02 4.04 3.02 -1.26 -4.93 115.26 115.63 1f2s n ASN 179 Ca 0.03 -3.09 -0.08 0.00 -0.03 0.00 0.00 54.58 51.40 1f2s n ASN 179 Cb 0.17 -0.71 -0.11 0.00 -0.61 0.00 0.00 39.78 38.53 1f2s n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1f2s s MET 180 N -2.90 0.43 0.03 3.52 -1.94 -1.06 -1.49 119.30 115.90 1f2s s MET 180 Ca 0.54 -0.84 -0.07 0.00 -1.71 0.00 0.00 55.69 53.61 1f2s s MET 180 Cb 0.43 0.13 -0.00 0.00 2.01 0.00 0.00 34.83 37.39 1f2s s MET 180 CO 0.14 -0.07 0.13 -0.59 -0.01 0.00 0.00 175.02 174.63 1f2s s PHE 181 N -2.36 0.13 -0.07 -0.03 -0.71 -0.45 -4.81 117.98 109.68 1f2s s PHE 181 Ca -0.07 -0.37 -0.05 0.00 -1.04 0.00 0.00 56.93 55.39 1f2s s PHE 181 Cb -0.03 -0.09 -0.04 0.00 -1.21 0.00 0.00 43.02 41.64 1f2s s PHE 181 CO -0.04 -0.37 0.16 0.00 -1.34 0.00 0.00 175.22 173.63 1f2s s ALA 183 N -1.15 -0.23 0.00 0.00 0.00 -0.99 -0.75 121.76 118.64 1f2s s ALA 183 Ca 0.20 0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.49 1f2s s ALA 183 Cb -0.12 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.80 1f2s s ALA 183 CO 0.10 -0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.21 1f2s n GLY 184 N 3.24 0.52 2.88 0.00 0.00 -0.96 -2.98 105.19 107.88 1f2s n GLY 184 Ca -0.15 -1.41 -0.20 0.00 0.00 0.00 0.00 46.02 44.27 1f2s n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1f2s s TYR 184 N -4.00 0.67 -0.39 1.61 1.51 -1.26 -4.42 117.35 111.06 1f2s s TYR 184 Ca 0.00 -0.17 0.26 0.00 -1.01 0.00 0.00 57.07 56.15 1f2s s TYR 184 Cb 0.00 -0.62 1.03 0.00 -0.11 0.00 0.00 41.96 42.26 1f2s s TYR 184 CO 0.00 -0.18 1.76 -0.07 -1.11 0.00 0.00 175.55 175.95 1f2s h LEU 185 N 7.23 0.00 -0.22 -1.29 3.38 -1.96 -1.13 115.31 121.32 1f2s h LEU 185 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1f2s h LEU 185 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1f2s h LEU 185 CO 0.46 0.00 0.00 -0.08 0.09 0.00 0.00 178.44 178.91 1f2s h GLU 186 N 0.00 0.00 0.00 1.13 4.81 -1.95 0.40 114.58 118.96 1f2s h GLU 186 Ca 0.00 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1f2s h GLU 186 Cb 0.42 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 1f2s h GLU 186 CO 0.00 0.00 -0.02 0.41 -0.73 0.00 0.00 179.01 178.67 1f2s n GLY 187 N 0.92 -2.05 0.43 1.92 0.00 -0.43 -4.53 105.19 101.45 1f2s n GLY 187 Ca 0.04 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1f2s n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f2s n GLY 188 N -0.42 2.95 2.84 -0.02 0.00 -0.31 -4.88 105.19 105.35 1f2s n GLY 188 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.86 1f2s n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f2s s LYS 188 N -0.01 0.32 -0.02 1.61 1.02 -1.26 -3.77 119.74 117.62 1f2s s LYS 188 Ca 0.00 0.03 -0.31 0.00 0.02 0.00 0.00 55.97 55.71 1f2s s LYS 188 Cb 0.00 -0.45 0.12 0.00 -0.52 0.00 0.00 37.83 36.98 1f2s s LYS 188 CO 0.00 -0.09 1.28 0.34 -0.92 0.00 0.00 175.35 175.96 1f2s s ASP 189 N 0.79 -0.06 0.78 2.83 3.68 -0.77 -4.33 116.67 119.58 1f2s s ASP 189 Ca -0.08 -0.13 -0.08 0.00 2.13 0.00 0.00 52.55 54.39 1f2s s ASP 189 Cb -0.11 0.17 0.11 0.00 -1.45 0.00 0.00 42.92 41.64 1f2s s ASP 189 CO -0.01 -0.31 1.09 -0.94 0.13 0.00 0.00 175.17 175.14 1f2s s SER 190 N -2.94 4.24 0.37 -0.34 1.04 -1.26 -0.43 113.70 114.38 1f2s s SER 190 Ca 0.14 0.21 -0.12 0.00 0.48 0.00 0.00 55.95 56.66 1f2s s SER 190 Cb 0.04 -0.63 0.05 0.00 0.10 0.00 0.00 66.02 65.58 1f2s s SER 190 CO -0.04 -1.97 0.70 0.00 0.98 0.00 0.00 173.24 172.92 1f2s n GLN 192 N -0.51 1.54 0.00 0.00 3.00 -1.26 -1.15 117.38 119.00 1f2s n GLN 192 Ca -0.07 0.56 0.00 0.00 -0.01 0.00 0.00 57.00 57.48 1f2s n GLN 192 Cb 0.56 -2.26 0.00 0.00 0.00 0.00 0.00 30.24 28.54 1f2s n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1f2s n GLY 193 N 3.14 0.58 0.02 1.08 0.00 -1.26 -0.61 105.19 108.14 1f2s n GLY 193 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 1f2s n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1f2s n ASP 194 N 0.00 0.64 -4.54 1.61 8.00 -0.30 -3.71 116.55 118.25 1f2s n ASP 194 Ca 0.00 -0.33 -0.47 0.00 0.71 0.00 0.00 54.79 54.70 1f2s n ASP 194 Cb 0.00 0.81 -0.03 0.00 -0.02 0.00 0.00 41.12 41.88 1f2s n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1f2s n SER 195 N -1.85 0.64 0.00 -2.24 7.64 -1.26 -1.73 113.62 114.82 1f2s n SER 195 Ca 0.02 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.06 1f2s n SER 195 Cb 0.41 -1.17 0.00 0.00 -1.01 0.00 0.00 64.21 62.44 1f2s n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1f2s n GLY 196 N 1.65 2.44 3.80 0.23 0.00 -0.27 0.48 105.19 113.52 1f2s n GLY 196 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1f2s n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1f2s s GLY 197 N -1.95 1.61 0.42 -0.02 0.00 -0.70 -3.18 107.32 103.50 1f2s s GLY 197 Ca 0.00 -0.29 -0.22 0.00 0.00 0.00 0.00 44.72 44.21 1f2s s GLY 197 CO 0.00 0.18 0.97 2.56 0.00 0.00 0.00 173.10 176.81 1f2s s PRO 198 N -5.18 4.21 -0.29 2.90 0.04 -1.26 -1.15 135.00 134.27 1f2s s PRO 198 Ca 0.62 1.21 -0.00 0.00 0.04 0.00 0.00 61.00 62.87 1f2s s PRO 198 Cb -0.15 -2.28 0.09 0.00 0.04 0.00 0.00 34.50 32.20 1f2s s PRO 198 CO 0.54 -0.05 0.06 0.08 0.04 0.00 0.00 177.00 177.67 1f2s s VAL 199 N -2.03 1.15 -0.17 -0.36 1.01 -0.99 -3.43 120.40 115.58 1f2s s VAL 199 Ca 0.61 -1.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.12 1f2s s VAL 199 Cb -0.12 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.46 1f2s s VAL 199 CO 0.17 -0.52 0.02 -0.69 0.00 0.00 0.00 175.10 174.08 1f2s s VAL 200 N 1.50 4.41 -0.07 2.92 1.01 -0.46 -1.27 120.40 128.44 1f2s s VAL 200 Ca 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.87 1f2s s VAL 200 Cb -0.18 -2.97 0.02 0.00 0.00 0.00 0.00 36.38 33.26 1f2s s VAL 200 CO -0.18 0.47 -0.06 0.00 0.00 0.00 0.00 175.10 175.34 1f2s n SER 202 N 4.43 -5.30 -0.58 0.00 7.64 -1.26 -1.80 113.62 116.75 1f2s n SER 202 Ca -0.18 -0.64 -0.08 0.00 1.01 0.00 0.00 58.87 58.98 1f2s n SER 202 Cb 0.51 -4.60 -0.03 0.00 -1.01 0.00 0.00 64.21 59.07 1f2s n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1f2s n GLY 203 N -1.82 0.90 3.13 0.23 0.00 -1.26 -5.00 105.19 101.37 1f2s n GLY 203 Ca -0.02 -0.30 -0.21 0.00 0.00 0.00 0.00 46.02 45.49 1f2s n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f2s s LYS 204 N -2.33 1.02 -0.63 1.61 -0.14 -0.75 -4.21 119.74 114.32 1f2s s LYS 204 Ca 0.00 -0.67 -0.27 0.00 -1.36 0.00 0.00 55.97 53.67 1f2s s LYS 204 Cb 0.00 -1.02 0.01 0.00 -1.68 0.00 0.00 37.83 35.14 1f2s s LYS 204 CO 0.00 0.26 1.49 -1.17 -0.76 0.00 0.00 175.35 175.17 1f2s s LEU 209 N -0.84 3.30 -0.06 3.17 2.96 -0.43 -1.27 118.68 125.51 1f2s s LEU 209 Ca 0.03 0.08 0.20 0.00 -0.22 0.00 0.00 54.13 54.23 1f2s s LEU 209 Cb -0.07 -2.77 -0.28 0.00 0.50 0.00 0.00 46.19 43.57 1f2s s LEU 209 CO 0.01 -1.92 0.42 0.00 -1.32 0.00 0.00 176.35 173.53 1f2s n GLN 210 N 9.02 0.66 -4.13 1.98 1.13 -0.40 -4.20 117.38 121.44 1f2s n GLN 210 Ca 0.12 -0.09 -0.11 0.00 -1.94 0.00 0.00 57.00 54.98 1f2s n GLN 210 Cb 0.50 -1.56 -0.08 0.00 0.11 0.00 0.00 30.24 29.20 1f2s n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1f2s s GLY 211 N -4.82 1.11 -0.05 1.08 0.00 -0.90 -1.91 107.32 101.83 1f2s s GLY 211 Ca -0.08 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 43.25 1f2s s GLY 211 CO 0.87 -1.12 -0.02 -0.42 0.00 0.00 0.00 173.10 172.42 1f2s s ILE 212 N -4.11 0.37 0.06 0.90 1.01 -1.13 -2.35 121.20 115.96 1f2s s ILE 212 Ca 0.33 0.02 -0.32 0.00 0.00 0.00 0.00 60.65 60.68 1f2s s ILE 212 Cb 0.04 -0.46 -0.11 0.00 0.01 0.00 0.00 42.46 41.95 1f2s s ILE 212 CO 0.11 0.21 1.88 0.52 0.00 0.00 0.00 174.94 177.66 1f2s n VAL 213 N 4.41 0.51 0.01 2.92 0.31 -0.30 -1.68 118.33 124.51 1f2s n VAL 213 Ca -0.20 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 1f2s n VAL 213 Cb 0.50 -2.11 0.00 0.00 -0.91 0.00 0.00 33.84 31.32 1f2s n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1f2s n SER 214 N 6.28 0.21 -2.96 4.52 2.88 -1.05 -1.11 113.62 122.38 1f2s n SER 214 Ca 0.19 0.03 -0.12 0.00 -1.33 0.00 0.00 58.87 57.64 1f2s n SER 214 Cb 0.37 -0.06 -0.00 0.00 -0.75 0.00 0.00 64.21 63.76 1f2s n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1f2s s TRP 215 N -1.19 0.64 0.00 0.66 1.48 -0.88 -4.91 118.94 114.75 1f2s s TRP 215 Ca 0.00 -1.10 0.00 0.00 -1.06 0.00 0.00 56.10 53.94 1f2s s TRP 215 Cb 0.00 0.39 0.00 0.00 -1.16 0.00 0.00 33.47 32.70 1f2s s TRP 215 CO 0.00 -1.40 0.00 0.41 -4.06 0.00 0.00 176.95 171.90 1f2s n GLY 216 N -0.57 -0.25 3.22 3.67 0.00 -1.26 -0.64 105.19 109.36 1f2s n GLY 216 Ca -0.04 -0.90 -0.41 0.00 0.00 0.00 0.00 46.02 44.66 1f2s n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1f2s s SER 217 N 0.00 5.80 0.21 1.61 0.15 -1.26 -4.96 113.70 115.24 1f2s s SER 217 Ca 0.00 -2.06 0.00 0.00 0.70 0.00 0.00 55.95 54.59 1f2s s SER 217 Cb 0.00 -2.03 0.00 0.00 -1.71 0.00 0.00 66.02 62.28 1f2s s SER 217 CO 0.00 -0.67 0.00 0.61 1.20 0.00 0.00 173.24 174.38 1f2s n GLY 219 N 4.72 -1.06 2.84 9.45 0.00 -1.26 -4.69 105.19 115.19 1f2s n GLY 219 Ca -0.05 -1.22 -0.17 0.00 0.00 0.00 0.00 46.02 44.58 1f2s n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f2s n ALA 221 N 3.97 -0.47 -1.82 0.00 0.00 -1.26 -4.66 120.51 116.27 1f2s n ALA 221 Ca -0.25 0.22 -0.33 0.00 0.00 0.00 0.00 53.44 53.07 1f2s n ALA 221 Cb 0.51 -1.86 -0.07 0.00 0.00 0.00 0.00 19.45 18.04 1f2s n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1f2s s GLN 221 N -4.25 4.23 0.26 0.00 -1.52 -1.26 -1.16 119.66 115.96 1f2s s GLN 221 Ca 0.00 1.14 -0.31 0.00 -1.95 0.00 0.00 55.36 54.25 1f2s s GLN 221 Cb 0.00 -2.21 -0.13 0.00 -0.22 0.00 0.00 33.01 30.45 1f2s s GLN 221 CO 0.00 -0.03 1.46 1.17 -0.25 0.00 0.00 175.29 177.63 1f2s n LYS 222 N -0.58 2.22 -1.80 2.91 4.81 -1.26 -2.01 118.16 122.44 1f2s n LYS 222 Ca 0.07 0.79 -0.18 0.00 -0.87 0.00 0.00 58.31 58.12 1f2s n LYS 222 Cb 0.54 -2.48 -0.06 0.00 0.02 0.00 0.00 35.03 33.05 1f2s n LYS 222 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1f2s n ASN 223 N 2.12 -4.90 -3.25 3.14 4.13 0.13 -4.90 115.26 111.73 1f2s n ASN 223 Ca 0.11 0.32 -0.25 0.00 1.68 0.00 0.00 54.58 56.44 1f2s n ASN 223 Cb 0.33 -4.30 -0.07 0.00 -1.54 0.00 0.00 39.78 34.20 1f2s n ASN 223 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1f2s n LYS 224 N -2.43 1.06 -1.39 3.52 4.76 -0.85 -4.76 118.16 118.08 1f2s n LYS 224 Ca -0.19 -3.52 -0.30 0.00 -2.87 0.00 0.00 58.31 51.43 1f2s n LYS 224 Cb 0.61 -1.45 0.12 0.00 -1.84 0.00 0.00 35.03 32.47 1f2s n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1f2s s PRO 225 N -1.39 1.63 0.60 1.97 0.04 -1.26 -4.24 135.00 132.34 1f2s s PRO 225 Ca 0.36 0.70 -0.17 0.00 0.04 0.00 0.00 61.00 61.93 1f2s s PRO 225 Cb 0.16 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.81 1f2s s PRO 225 CO -0.09 -1.95 1.11 0.20 0.04 0.00 0.00 177.00 176.30 1f2s s GLY 226 N -3.68 2.35 -0.10 0.56 0.00 -1.16 -4.70 107.32 100.59 1f2s s GLY 226 Ca 0.62 0.64 0.02 0.00 0.00 0.00 0.00 44.72 46.00 1f2s s GLY 226 CO 0.55 0.99 -0.16 0.14 0.00 0.00 0.00 173.10 174.62 1f2s s VAL 227 N -2.12 2.78 0.12 1.40 1.01 0.19 -2.36 120.40 121.41 1f2s s VAL 227 Ca 0.69 -0.78 0.08 0.00 0.00 0.00 0.00 61.98 61.97 1f2s s VAL 227 Cb -0.21 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1f2s s VAL 227 CO 0.35 0.55 -0.19 -0.31 0.00 0.00 0.00 175.10 175.49 1f2s s TYR 228 N 0.11 1.73 0.03 5.22 2.02 -0.01 -2.06 117.35 124.38 1f2s s TYR 228 Ca -0.08 -0.44 -0.30 0.00 -0.37 0.00 0.00 57.07 55.88 1f2s s TYR 228 Cb -0.15 -0.92 -0.05 0.00 -0.40 0.00 0.00 41.96 40.44 1f2s s TYR 228 CO 0.05 0.22 1.18 0.99 -1.57 0.00 0.00 175.55 176.43 1f2s s THR 229 N -1.47 4.16 -0.93 -0.71 2.01 -0.68 -1.35 115.64 116.67 1f2s s THR 229 Ca 0.08 1.54 -0.24 0.00 0.31 0.00 0.00 61.69 63.38 1f2s s THR 229 Cb -0.08 -3.99 0.04 0.00 0.01 0.00 0.00 72.50 68.48 1f2s s THR 229 CO 0.05 0.09 1.43 -0.75 -0.69 0.00 0.00 174.62 174.75 1f2s s LYS 230 N 1.34 3.43 0.48 4.92 2.20 -0.56 -2.83 119.74 128.73 1f2s s LYS 230 Ca 0.57 -0.83 0.17 0.00 -0.36 0.00 0.00 55.97 55.53 1f2s s LYS 230 Cb -0.28 -5.02 1.17 0.00 -1.51 0.00 0.00 37.83 32.20 1f2s s LYS 230 CO 0.27 -2.25 2.03 0.28 -0.36 0.00 0.00 175.35 175.32 1f2s h VAL 231 N 6.62 0.89 0.00 4.02 2.07 -1.69 -2.59 116.25 125.57 1f2s h VAL 231 Ca 0.06 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1f2s h VAL 231 Cb 1.02 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1f2s h VAL 231 CO 1.38 0.04 -0.01 0.00 0.02 0.00 0.00 177.57 178.99 1f2s n ASN 233 N -3.51 0.00 -0.16 0.00 3.02 -0.98 -3.72 115.26 109.92 1f2s n ASN 233 Ca -0.03 0.29 0.02 0.00 -0.03 0.00 0.00 54.58 54.83 1f2s n ASN 233 Cb 0.10 -0.43 0.03 0.00 -0.61 0.00 0.00 39.78 38.87 1f2s n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1f2s n TYR 234 N -1.43 0.07 -0.14 3.10 4.01 0.10 -4.82 117.16 118.05 1f2s n TYR 234 Ca 0.09 -0.25 -0.03 0.00 -0.16 0.00 0.00 57.90 57.55 1f2s n TYR 234 Cb 0.30 -0.02 0.04 0.00 -0.31 0.00 0.00 39.34 39.35 1f2s n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1f2s h VAL 235 N 0.62 0.60 -0.46 -0.72 2.07 -1.62 -0.56 116.25 116.18 1f2s h VAL 235 Ca 0.00 -0.02 -0.09 0.00 0.82 0.00 0.00 66.70 67.41 1f2s h VAL 235 Cb 0.35 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 1f2s h VAL 235 CO 0.00 0.01 -0.07 0.77 0.02 0.00 0.00 177.57 178.30 1f2s h SER 236 N 0.07 0.79 -0.44 0.57 4.64 -1.88 -1.45 113.55 115.84 1f2s h SER 236 Ca 0.23 -0.22 -0.01 0.00 -0.47 0.00 0.00 61.79 61.32 1f2s h SER 236 Cb 0.35 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 1f2s h SER 236 CO -0.42 0.90 0.23 -0.25 -0.87 0.00 0.00 176.83 176.42 1f2s h TRP 237 N 0.74 0.61 0.16 4.77 7.01 -1.69 -0.96 115.95 126.59 1f2s h TRP 237 Ca 0.13 -0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.10 1f2s h TRP 237 Cb 0.55 -0.19 0.00 0.00 -2.10 0.00 0.00 29.16 27.42 1f2s h TRP 237 CO 0.03 0.48 -0.08 0.82 -2.79 0.00 0.00 178.44 176.90 1f2s h ILE 238 N 0.57 0.86 -0.83 2.65 2.04 -0.93 -1.41 117.51 120.47 1f2s h ILE 238 Ca 0.15 -0.08 0.05 0.00 1.00 0.00 0.00 64.86 65.98 1f2s h ILE 238 Cb 0.07 0.91 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 1f2s h ILE 238 CO -0.02 0.02 0.54 0.11 0.00 0.00 0.00 178.15 178.80 1f2s h LYS 239 N -0.25 0.95 -0.01 2.37 1.57 -1.11 -0.98 116.57 119.11 1f2s h LYS 239 Ca -0.02 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1f2s h LYS 239 Cb 0.20 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 1f2s h LYS 239 CO 0.04 0.63 -0.00 0.37 -0.57 0.00 0.00 179.45 179.91 1f2s h GLN 240 N 0.98 0.01 0.03 3.15 4.15 -1.00 -2.94 115.11 119.49 1f2s h GLN 240 Ca 0.34 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.77 1f2s h GLN 240 Cb 0.11 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.79 1f2s h GLN 240 CO -0.11 0.43 -0.08 1.15 -1.93 0.00 0.00 178.83 178.28 1f2s h THR 241 N -0.40 0.79 -0.90 2.39 2.02 -0.91 -2.15 112.91 113.75 1f2s h THR 241 Ca 0.00 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.29 1f2s h THR 241 Cb 0.42 0.79 -0.08 0.00 -1.74 0.00 0.00 68.15 67.55 1f2s h THR 241 CO 0.00 0.00 0.53 0.40 0.37 0.00 0.00 175.52 176.82 1f2s h ILE 242 N -0.16 0.90 -0.00 3.11 2.04 -1.27 -1.52 117.51 120.61 1f2s h ILE 242 Ca 0.02 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.59 1f2s h ILE 242 Cb 0.18 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.23 1f2s h ILE 242 CO -0.07 0.16 -0.06 0.00 0.00 0.00 0.00 178.15 178.18 1f2s n ALA 243 N -2.37 2.64 0.03 1.87 0.00 -1.08 -3.88 120.51 117.73 1f2s n ALA 243 Ca 0.16 -0.20 0.03 0.00 0.00 0.00 0.00 53.44 53.42 1f2s n ALA 243 Cb 0.32 -1.41 0.05 0.00 0.00 0.00 0.00 19.45 18.41 1f2s n ALA 243 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1f2s n SER 244 N -1.15 2.03 0.00 0.00 7.64 -0.60 -5.08 113.62 116.46 1f2s n SER 244 Ca 0.14 -1.69 0.00 0.00 1.01 0.00 0.00 58.87 58.33 1f2s n SER 244 Cb 0.26 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 1f2s n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62