#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o3o s VAL 17 N 0.00 4.32 -1.08 1.39 1.01 0.15 -3.86 120.40 122.33 1o3o s VAL 17 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.75 1o3o s VAL 17 Cb 0.00 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.54 1o3o s VAL 17 CO 0.00 0.57 0.00 0.61 0.00 0.00 0.00 175.10 176.28 1o3o n GLY 18 N 2.53 1.15 0.00 4.51 0.00 -1.21 -1.82 105.19 110.34 1o3o n GLY 18 Ca -0.18 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1o3o n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o3o n GLY 19 N -1.61 2.08 3.16 -0.02 0.00 -1.26 -4.82 105.19 102.72 1o3o n GLY 19 Ca -0.10 -2.08 -0.10 0.00 0.00 0.00 0.00 46.02 43.74 1o3o n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1o3o s TYR 20 N 1.55 0.90 -0.01 1.61 1.13 0.65 -4.91 117.35 118.28 1o3o s TYR 20 Ca 0.00 -1.21 -0.30 0.00 -1.41 0.00 0.00 57.07 54.15 1o3o s TYR 20 Cb 0.00 -0.51 -0.06 0.00 -1.10 0.00 0.00 41.96 40.29 1o3o s TYR 20 CO 0.00 -0.49 1.56 0.99 -2.51 0.00 0.00 175.55 175.10 1o3o s THR 21 N -4.01 3.51 0.17 -3.49 2.01 -1.26 -0.58 115.64 111.99 1o3o s THR 21 Ca 0.24 0.80 -0.10 0.00 0.31 0.00 0.00 61.69 62.94 1o3o s THR 21 Cb 0.07 -3.51 0.06 0.00 0.01 0.00 0.00 72.50 69.13 1o3o s THR 21 CO 0.02 -0.03 1.64 0.00 -0.69 0.00 0.00 174.62 175.56 1o3o n GLY 23 N -0.45 2.94 3.58 0.00 0.00 -1.26 -4.79 105.19 105.20 1o3o n GLY 23 Ca 0.03 -1.45 -0.50 0.00 0.00 0.00 0.00 46.02 44.10 1o3o n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o3o n ALA 24 N 1.11 -0.92 -2.17 4.61 0.00 -1.26 -2.50 120.51 119.39 1o3o n ALA 24 Ca 0.00 0.48 -0.10 0.00 0.00 0.00 0.00 53.44 53.82 1o3o n ALA 24 Cb 0.00 -2.02 -0.01 0.00 0.00 0.00 0.00 19.45 17.41 1o3o n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1o3o n ASN 25 N 2.09 -3.09 0.01 0.00 4.13 -1.26 -4.82 115.26 112.33 1o3o n ASN 25 Ca 0.16 0.26 0.13 0.00 1.68 0.00 0.00 54.58 56.80 1o3o n ASN 25 Cb 0.23 -2.74 0.37 0.00 -1.54 0.00 0.00 39.78 36.11 1o3o n ASN 25 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1o3o n THR 26 N -2.82 0.08 -3.50 3.41 -2.24 -1.04 -4.12 114.28 104.05 1o3o n THR 26 Ca -0.11 -0.05 -0.27 0.00 -2.27 0.00 0.00 64.05 61.35 1o3o n THR 26 Cb 0.52 -0.10 -0.09 0.00 -2.10 0.00 0.00 70.33 68.56 1o3o n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1o3o n VAL 27 N -1.62 1.34 0.34 2.28 0.31 -1.26 -4.97 118.33 114.74 1o3o n VAL 27 Ca 0.06 -4.76 0.09 0.00 -0.01 0.00 0.00 64.34 59.71 1o3o n VAL 27 Cb 0.36 -2.06 0.39 0.00 -0.91 0.00 0.00 33.84 31.61 1o3o n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1o3o n PRO 28 N 1.41 0.10 0.00 5.55 -0.04 -1.26 -1.64 135.00 139.12 1o3o n PRO 28 Ca 0.26 0.42 0.12 0.00 -0.04 0.00 0.00 63.50 64.25 1o3o n PRO 28 Cb 0.42 -1.72 0.14 0.00 -0.04 0.00 0.00 33.50 32.30 1o3o n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1o3o n TYR 29 N -1.92 0.00 -2.33 0.54 4.11 -1.19 -2.05 117.16 114.33 1o3o n TYR 29 Ca 0.02 0.00 -0.41 0.00 -0.00 0.00 0.00 57.90 57.51 1o3o n TYR 29 Cb 0.15 -0.07 -0.03 0.00 -0.00 0.00 0.00 39.34 39.39 1o3o n TYR 29 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.86 175.72 1o3o s GLN 30 N -2.61 4.48 0.17 -3.48 2.00 -0.65 -1.04 119.66 118.52 1o3o s GLN 30 Ca 0.18 1.94 0.06 0.00 -2.00 0.00 0.00 55.36 55.54 1o3o s GLN 30 Cb 0.18 -3.20 -0.05 0.00 0.80 0.00 0.00 33.01 30.74 1o3o s GLN 30 CO 0.61 -0.09 -0.12 0.14 -0.50 0.00 0.00 175.29 175.33 1o3o s VAL 31 N -0.30 1.41 -0.08 1.34 -7.23 -0.63 -4.49 120.40 110.42 1o3o s VAL 31 Ca 0.52 -2.12 0.03 0.00 -1.81 0.00 0.00 61.98 58.59 1o3o s VAL 31 Cb -0.34 -1.93 -0.02 0.00 0.56 0.00 0.00 36.38 34.65 1o3o s VAL 31 CO 0.39 -0.68 -0.15 -0.55 -0.31 0.00 0.00 175.10 173.81 1o3o s SER 32 N -3.22 3.97 -0.24 4.85 0.15 -0.58 -2.16 113.70 116.46 1o3o s SER 32 Ca 0.19 -0.26 -0.09 0.00 0.70 0.00 0.00 55.95 56.49 1o3o s SER 32 Cb 0.01 -1.09 -0.04 0.00 -1.71 0.00 0.00 66.02 63.19 1o3o s SER 32 CO 0.03 0.28 0.13 -0.76 1.20 0.00 0.00 173.24 174.12 1o3o s LEU 33 N -0.35 3.89 -0.07 3.45 1.43 0.19 -0.98 118.68 126.23 1o3o s LEU 33 Ca 0.03 0.01 0.05 0.00 -1.03 0.00 0.00 54.13 53.19 1o3o s LEU 33 Cb -0.12 -2.04 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 1o3o s LEU 33 CO 0.02 0.04 -0.23 0.21 0.23 0.00 0.00 176.35 176.62 1o3o s ASN 34 N 1.22 2.89 -0.36 2.29 3.84 -0.07 -1.67 114.94 123.08 1o3o s ASN 34 Ca 0.06 -0.49 0.12 0.00 0.21 0.00 0.00 52.86 52.76 1o3o s ASN 34 Cb -0.14 -0.96 0.45 0.00 -0.55 0.00 0.00 41.25 40.04 1o3o s ASN 34 CO 0.05 0.20 1.06 -1.54 -2.79 0.00 0.00 177.10 174.08 1o3o n SER 37 N 3.17 3.14 0.00 -4.21 3.41 -1.26 -1.31 113.62 116.56 1o3o n SER 37 Ca -0.18 -3.15 0.00 0.00 -0.26 0.00 0.00 58.87 55.28 1o3o n SER 37 Cb 0.52 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1o3o n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1o3o n GLY 38 N -0.36 0.40 3.59 5.00 0.00 -1.26 -4.99 105.19 107.57 1o3o n GLY 38 Ca 0.25 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.22 1o3o n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1o3o s TYR 39 N -2.00 -0.14 -0.08 1.61 1.13 -1.26 -5.13 117.35 111.48 1o3o s TYR 39 Ca 0.00 0.07 -0.30 0.00 -1.41 0.00 0.00 57.07 55.44 1o3o s TYR 39 Cb 0.00 0.52 -0.03 0.00 -1.10 0.00 0.00 41.96 41.35 1o3o s TYR 39 CO 0.00 -0.25 1.22 -1.58 -2.51 0.00 0.00 175.55 172.43 1o3o s HIS 40 N -2.50 3.08 0.00 -3.49 5.65 -1.26 -4.30 115.29 112.48 1o3o s HIS 40 Ca 0.09 1.14 0.00 0.00 0.25 0.00 0.00 55.06 56.55 1o3o s HIS 40 Cb -0.00 -3.45 0.00 0.00 -1.18 0.00 0.00 32.58 27.94 1o3o s HIS 40 CO -0.05 -1.46 0.00 1.97 -0.65 0.00 0.00 174.74 174.55 1o3o n PHE 41 N 5.60 0.00 -3.87 3.88 -1.74 -0.67 -4.98 117.46 115.68 1o3o n PHE 41 Ca 0.12 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.92 1o3o n PHE 41 Cb 0.46 0.00 -0.04 0.00 1.52 0.00 0.00 39.48 41.42 1o3o n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1o3o s GLY 43 N -2.94 2.09 0.10 0.00 0.00 0.10 -0.64 107.32 106.04 1o3o s GLY 43 Ca 0.15 -1.63 -0.26 0.00 0.00 0.00 0.00 44.72 42.98 1o3o s GLY 43 CO 0.04 -1.84 1.10 -0.32 0.00 0.00 0.00 173.10 172.08 1o3o s GLY 44 N -4.47 -0.15 -0.05 0.20 0.00 -0.92 -3.70 107.32 98.24 1o3o s GLY 44 Ca 0.46 0.09 0.03 0.00 0.00 0.00 0.00 44.72 45.30 1o3o s GLY 44 CO 0.29 1.49 -0.12 -0.56 0.00 0.00 0.00 173.10 174.20 1o3o s SER 45 N -3.21 1.66 -0.16 1.64 0.01 0.03 -1.60 113.70 112.08 1o3o s SER 45 Ca 0.18 -0.27 -0.29 0.00 1.31 0.00 0.00 55.95 56.88 1o3o s SER 45 Cb -0.00 -0.58 -0.00 0.00 0.21 0.00 0.00 66.02 65.64 1o3o s SER 45 CO 0.02 0.07 1.06 -0.22 0.41 0.00 0.00 173.24 174.58 1o3o s LEU 46 N 0.35 4.18 -0.00 2.44 2.96 -0.21 -0.70 118.68 127.70 1o3o s LEU 46 Ca -0.08 1.51 0.10 0.00 -0.22 0.00 0.00 54.13 55.44 1o3o s LEU 46 Cb -0.12 -3.55 -0.13 0.00 0.50 0.00 0.00 46.19 42.89 1o3o s LEU 46 CO 0.02 -0.58 0.38 2.30 -1.32 0.00 0.00 176.35 177.14 1o3o n ILE 47 N 4.95 0.00 -3.83 6.68 -5.35 -0.61 -1.56 119.36 119.64 1o3o n ILE 47 Ca 0.11 -0.25 -0.07 0.00 -0.27 0.00 0.00 62.75 62.27 1o3o n ILE 47 Cb 0.47 0.76 -0.00 0.00 -1.74 0.00 0.00 39.64 39.13 1o3o n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1o3o s ASN 48 N -2.38 -0.14 0.24 7.28 2.20 -1.21 -4.55 114.94 116.38 1o3o s ASN 48 Ca 0.01 -0.75 0.19 0.00 -0.94 0.00 0.00 52.86 51.38 1o3o s ASN 48 Cb 0.08 0.70 0.93 0.00 -2.00 0.00 0.00 41.25 40.96 1o3o s ASN 48 CO 0.43 -1.34 1.58 -1.54 -2.94 0.00 0.00 177.10 173.29 1o3o n SER 49 N -0.83 0.49 0.00 3.54 3.41 -1.26 -3.11 113.62 115.86 1o3o n SER 49 Ca -0.06 0.68 0.00 0.00 -0.26 0.00 0.00 58.87 59.24 1o3o n SER 49 Cb 0.60 -0.76 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 1o3o n SER 49 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1o3o n GLN 50 N -2.11 1.46 -4.34 4.33 7.27 -1.26 -0.79 117.38 121.94 1o3o n GLN 50 Ca 0.00 -1.02 -0.19 0.00 0.07 0.00 0.00 57.00 55.87 1o3o n GLN 50 Cb 0.10 -0.87 -0.14 0.00 2.41 0.00 0.00 30.24 31.74 1o3o n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1o3o s TRP 51 N -0.55 0.92 0.07 3.69 0.52 -1.18 -0.60 118.94 121.80 1o3o s TRP 51 Ca 0.00 -0.24 0.07 0.00 0.02 0.00 0.00 56.10 55.95 1o3o s TRP 51 Cb 0.00 -0.57 -0.03 0.00 -1.15 0.00 0.00 33.47 31.72 1o3o s TRP 51 CO 0.00 -0.01 -0.20 0.08 0.02 0.00 0.00 176.95 176.84 1o3o s VAL 52 N -0.50 1.59 -0.08 4.03 1.01 -0.19 -1.58 120.40 124.69 1o3o s VAL 52 Ca 0.02 -1.34 0.02 0.00 0.00 0.00 0.00 61.98 60.68 1o3o s VAL 52 Cb -0.05 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 34.88 1o3o s VAL 52 CO 0.00 0.04 -0.15 -0.69 0.00 0.00 0.00 175.10 174.30 1o3o s VAL 53 N -1.00 2.98 0.00 2.92 1.01 0.12 -0.90 120.40 125.54 1o3o s VAL 53 Ca 0.06 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.31 1o3o s VAL 53 Cb -0.09 -2.19 0.00 0.00 0.00 0.00 0.00 36.38 34.09 1o3o s VAL 53 CO 0.03 0.57 0.00 -0.24 0.00 0.00 0.00 175.10 175.45 1o3o n SER 54 N 2.80 0.00 -4.87 3.32 2.88 -0.03 -0.79 113.62 116.94 1o3o n SER 54 Ca -0.18 -0.60 -0.36 0.00 -1.33 0.00 0.00 58.87 56.40 1o3o n SER 54 Cb 0.52 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1o3o n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1o3o s ALA 55 N -1.64 3.82 0.48 -1.46 0.00 -1.26 -0.81 121.76 120.90 1o3o s ALA 55 Ca 0.00 -0.51 0.14 0.00 0.00 0.00 0.00 51.96 51.58 1o3o s ALA 55 Cb 0.00 -2.11 1.13 0.00 0.00 0.00 0.00 23.12 22.14 1o3o s ALA 55 CO 0.00 0.60 2.10 0.00 0.00 0.00 0.00 175.76 178.46 1o3o h ALA 56 N 4.50 1.88 0.00 0.00 0.00 -1.68 -0.23 119.26 123.73 1o3o h ALA 56 Ca -0.52 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1o3o h ALA 56 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1o3o h ALA 56 CO 0.62 0.10 0.00 -2.39 0.00 0.00 0.00 179.25 177.58 1o3o n HIS 57 N -4.49 0.00 1.24 0.00 1.44 -1.26 -1.69 115.22 110.46 1o3o n HIS 57 Ca -0.02 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.82 1o3o n HIS 57 Cb 0.11 -0.29 0.30 0.00 0.12 0.00 0.00 29.99 30.23 1o3o n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1o3o n TYR 59 N 0.38 2.27 -3.62 0.00 4.19 -0.68 -4.99 117.16 114.71 1o3o n TYR 59 Ca 0.15 0.48 -0.00 0.00 3.31 0.00 0.00 57.90 61.84 1o3o n TYR 59 Cb 0.44 -2.39 -0.01 0.00 0.49 0.00 0.00 39.34 37.87 1o3o n TYR 59 CO 0.00 0.00 0.00 -1.59 0.91 0.00 0.00 176.86 176.18 1o3o s LYS 60 N -2.29 0.39 0.36 2.98 -2.85 -1.26 -5.14 119.74 111.94 1o3o s LYS 60 Ca 0.61 -0.20 0.07 0.00 -1.00 0.00 0.00 55.97 55.45 1o3o s LYS 60 Cb -0.49 0.14 -0.00 0.00 -2.06 0.00 0.00 37.83 35.42 1o3o s LYS 60 CO 0.58 -0.18 0.51 -1.54 0.10 0.00 0.00 175.35 174.82 1o3o s SER 61 N -2.77 5.88 -0.39 0.03 1.04 -1.26 -4.58 113.70 111.65 1o3o s SER 61 Ca 0.13 -0.22 -0.02 0.00 0.48 0.00 0.00 55.95 56.32 1o3o s SER 61 Cb 0.03 -1.10 0.00 0.00 0.10 0.00 0.00 66.02 65.06 1o3o s SER 61 CO -0.04 -0.54 0.33 0.61 0.98 0.00 0.00 173.24 174.58 1o3o n GLY 62 N -1.72 0.38 3.78 7.32 0.00 -1.26 -5.01 105.19 108.68 1o3o n GLY 62 Ca 0.02 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 1o3o n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o3o s ILE 63 N -3.10 5.42 -0.08 -0.61 1.01 -1.26 -4.41 121.20 118.17 1o3o s ILE 63 Ca 0.10 0.19 0.04 0.00 0.00 0.00 0.00 60.65 60.98 1o3o s ILE 63 Cb -0.05 -3.43 -0.01 0.00 0.01 0.00 0.00 42.46 38.98 1o3o s ILE 63 CO 0.22 0.51 -0.21 -1.58 0.00 0.00 0.00 174.94 173.87 1o3o s GLN 64 N -0.15 2.79 -0.21 2.79 0.74 -0.42 -2.23 119.66 122.97 1o3o s GLN 64 Ca 0.10 -0.83 -0.12 0.00 0.05 0.00 0.00 55.36 54.56 1o3o s GLN 64 Cb -0.11 -2.31 -0.05 0.00 1.10 0.00 0.00 33.01 31.64 1o3o s GLN 64 CO 0.00 0.35 0.23 0.08 -0.55 0.00 0.00 175.29 175.40 1o3o s VAL 65 N -0.06 5.33 -0.26 1.34 1.01 0.21 -0.90 120.40 127.07 1o3o s VAL 65 Ca -0.06 0.36 -0.04 0.00 0.00 0.00 0.00 61.98 62.25 1o3o s VAL 65 Cb -0.14 -3.57 0.02 0.00 0.00 0.00 0.00 36.38 32.69 1o3o s VAL 65 CO 0.05 0.36 -0.01 -0.13 0.00 0.00 0.00 175.10 175.37 1o3o s ARG 65 N 0.80 2.97 0.24 2.72 0.52 -0.15 -1.03 118.95 125.02 1o3o s ARG 65 Ca 0.12 -0.91 0.06 0.00 -0.52 0.00 0.00 55.73 54.48 1o3o s ARG 65 Cb -0.13 -3.13 -0.03 0.00 0.52 0.00 0.00 34.95 32.17 1o3o s ARG 65 CO 0.03 -0.40 0.26 -0.51 0.02 0.00 0.00 175.30 174.70 1o3o s LEU 66 N 1.40 4.01 -1.73 2.53 1.02 -0.20 -1.53 118.68 124.18 1o3o s LEU 66 Ca 0.01 -0.12 0.00 0.00 0.02 0.00 0.00 54.13 54.04 1o3o s LEU 66 Cb -0.17 -2.55 0.00 0.00 0.02 0.00 0.00 46.19 43.49 1o3o s LEU 66 CO -0.02 -0.05 0.00 0.61 0.02 0.00 0.00 176.35 176.92 1o3o n GLY 69 N -1.24 0.34 3.87 -3.19 0.00 -1.26 -1.50 105.19 102.21 1o3o n GLY 69 Ca -0.08 -0.10 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 1o3o n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o3o s GLU 70 N -4.49 3.86 0.05 1.61 0.41 -1.26 -3.81 118.70 115.08 1o3o s GLU 70 Ca 0.00 0.42 0.00 0.00 -0.41 0.00 0.00 54.97 54.98 1o3o s GLU 70 Cb 0.00 -2.54 0.00 0.00 -1.78 0.00 0.00 34.13 29.81 1o3o s GLU 70 CO 0.00 0.22 0.00 -3.47 -0.49 0.00 0.00 175.26 171.52 1o3o n ASP 71 N -0.38 -0.07 -4.56 -0.19 4.64 -1.26 -4.62 116.55 110.11 1o3o n ASP 71 Ca 0.02 0.09 -0.41 0.00 -1.38 0.00 0.00 54.79 53.10 1o3o n ASP 71 Cb 0.53 0.13 -0.08 0.00 -1.04 0.00 0.00 41.12 40.66 1o3o n ASP 71 CO 0.00 0.00 0.00 0.21 -0.82 0.00 0.00 177.20 176.59 1o3o s ASN 72 N -4.01 6.32 0.00 1.67 3.84 -1.26 -2.62 114.94 118.88 1o3o s ASN 72 Ca 0.00 -0.04 0.27 0.00 0.21 0.00 0.00 52.86 53.30 1o3o s ASN 72 Cb 0.00 -2.27 1.37 0.00 -0.55 0.00 0.00 41.25 39.80 1o3o s ASN 72 CO 0.00 -0.50 1.92 2.30 -2.79 0.00 0.00 177.10 178.03 1o3o n ILE 73 N 5.45 0.12 0.82 -5.21 -5.35 -0.24 -3.47 119.36 111.48 1o3o n ILE 73 Ca -0.04 0.03 0.09 0.00 -0.27 0.00 0.00 62.75 62.55 1o3o n ILE 73 Cb 0.49 -0.58 -0.03 0.00 -1.74 0.00 0.00 39.64 37.77 1o3o n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1o3o n ASN 74 N -1.28 1.50 -4.15 7.28 3.02 -1.26 -4.97 115.26 115.40 1o3o n ASN 74 Ca 0.13 -1.25 -0.22 0.00 -0.03 0.00 0.00 54.58 53.20 1o3o n ASN 74 Cb 0.21 0.62 -0.14 0.00 -0.61 0.00 0.00 39.78 39.86 1o3o n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1o3o s VAL 75 N -2.25 1.24 -0.17 2.41 1.01 -1.23 -5.12 120.40 116.29 1o3o s VAL 75 Ca 0.13 -0.86 -0.19 0.00 0.00 0.00 0.00 61.98 61.05 1o3o s VAL 75 Cb 0.14 -1.07 -0.03 0.00 0.00 0.00 0.00 36.38 35.41 1o3o s VAL 75 CO 0.53 0.20 0.54 -0.69 0.00 0.00 0.00 175.10 175.68 1o3o s VAL 76 N -0.60 5.11 0.00 2.92 1.01 -1.26 -4.74 120.40 122.83 1o3o s VAL 76 Ca 0.05 1.03 0.00 0.00 0.00 0.00 0.00 61.98 63.05 1o3o s VAL 76 Cb -0.07 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1o3o s VAL 76 CO 0.00 0.21 0.31 -0.62 0.00 0.00 0.00 175.10 175.01 1o3o n GLU 77 N 4.45 -0.52 0.00 2.72 1.02 -1.26 -5.11 120.64 121.94 1o3o n GLU 77 Ca -0.05 -0.32 0.00 0.00 -0.02 0.00 0.00 57.16 56.77 1o3o n GLU 77 Cb 0.51 -0.80 0.00 0.00 -0.02 0.00 0.00 31.44 31.13 1o3o n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1o3o n GLY 78 N -0.01 2.78 2.78 0.62 0.00 -1.26 -5.00 105.19 105.10 1o3o n GLY 78 Ca 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.20 1o3o n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1o3o n ASN 79 N 0.00 0.00 -4.79 1.61 3.02 -1.26 -4.96 115.26 108.88 1o3o n ASN 79 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.20 1o3o n ASN 79 Cb 0.00 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.13 1o3o n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1o3o s GLU 80 N -0.07 4.06 -0.07 3.52 8.01 -1.25 -4.25 118.70 128.66 1o3o s GLU 80 Ca 0.00 1.39 -0.00 0.00 0.01 0.00 0.00 54.97 56.37 1o3o s GLU 80 Cb 0.00 -2.34 0.03 0.00 -4.31 0.00 0.00 34.13 27.51 1o3o s GLU 80 CO 0.00 -0.21 -0.02 -0.65 0.01 0.00 0.00 175.26 174.39 1o3o s GLN 81 N -2.84 0.76 -0.28 1.61 -0.21 -0.56 -4.96 119.66 113.17 1o3o s GLN 81 Ca 0.61 0.01 -0.07 0.00 0.02 0.00 0.00 55.36 55.94 1o3o s GLN 81 Cb -0.18 -0.98 0.00 0.00 1.00 0.00 0.00 33.01 32.85 1o3o s GLN 81 CO 0.22 -0.23 0.07 -0.06 -2.12 0.00 0.00 175.29 173.17 1o3o s PHE 82 N 1.60 3.12 -0.06 0.91 0.08 -1.26 -1.03 117.98 121.34 1o3o s PHE 82 Ca -0.00 -0.90 0.03 0.00 0.12 0.00 0.00 56.93 56.18 1o3o s PHE 82 Cb -0.13 -2.24 0.01 0.00 -0.57 0.00 0.00 43.02 40.09 1o3o s PHE 82 CO -0.04 -0.54 -0.15 0.42 -0.10 0.00 0.00 175.22 174.81 1o3o s ILE 83 N 1.51 1.29 0.50 0.64 1.01 -0.20 -4.96 121.20 120.99 1o3o s ILE 83 Ca 0.03 -0.60 -0.20 0.00 0.00 0.00 0.00 60.65 59.89 1o3o s ILE 83 Cb -0.17 -1.14 -0.08 0.00 0.01 0.00 0.00 42.46 41.08 1o3o s ILE 83 CO 0.02 0.38 1.05 -0.44 0.00 0.00 0.00 174.94 175.95 1o3o s SER 84 N 0.41 6.26 0.09 3.58 0.01 -1.26 -0.62 113.70 122.17 1o3o s SER 84 Ca -0.11 1.95 -0.30 0.00 1.31 0.00 0.00 55.95 58.80 1o3o s SER 84 Cb -0.14 -2.56 -0.06 0.00 0.21 0.00 0.00 66.02 63.47 1o3o s SER 84 CO 0.04 -0.84 1.05 0.00 0.41 0.00 0.00 173.24 173.90 1o3o s ALA 85 N -1.98 3.29 -0.04 1.44 0.00 -0.95 -0.69 121.76 122.84 1o3o s ALA 85 Ca 0.68 0.69 -0.06 0.00 0.00 0.00 0.00 51.96 53.27 1o3o s ALA 85 Cb -0.17 -3.35 -0.28 0.00 0.00 0.00 0.00 23.12 19.32 1o3o s ALA 85 CO 0.21 -0.21 0.70 0.66 0.00 0.00 0.00 175.76 177.13 1o3o h SER 86 N 5.98 0.46 -5.00 0.00 4.64 -0.46 -3.43 113.55 115.73 1o3o h SER 86 Ca -0.43 -0.72 -0.06 0.00 -0.47 0.00 0.00 61.79 60.12 1o3o h SER 86 Cb 1.21 -0.15 -0.18 0.00 -0.31 0.00 0.00 62.40 62.97 1o3o h SER 86 CO 0.75 1.61 0.14 -1.59 -0.87 0.00 0.00 176.83 176.87 1o3o s LYS 87 N -2.59 1.04 -0.06 4.77 -2.85 -1.17 -4.98 119.74 113.90 1o3o s LYS 87 Ca -0.13 0.13 0.06 0.00 -1.00 0.00 0.00 55.97 55.03 1o3o s LYS 87 Cb 0.06 0.49 -0.01 0.00 -2.06 0.00 0.00 37.83 36.31 1o3o s LYS 87 CO 0.84 -0.34 -0.25 -1.12 0.10 0.00 0.00 175.35 174.58 1o3o s SER 88 N -1.38 3.04 -0.35 0.03 0.01 -1.26 -0.92 113.70 112.86 1o3o s SER 88 Ca -0.10 -0.50 0.02 0.00 1.31 0.00 0.00 55.95 56.68 1o3o s SER 88 Cb -0.01 -0.81 0.10 0.00 0.21 0.00 0.00 66.02 65.51 1o3o s SER 88 CO 0.07 0.25 0.07 -0.63 0.41 0.00 0.00 173.24 173.40 1o3o s ILE 89 N -0.18 2.49 0.28 1.44 1.01 0.11 -4.96 121.20 121.38 1o3o s ILE 89 Ca -0.03 -2.23 -0.28 0.00 0.00 0.00 0.00 60.65 58.11 1o3o s ILE 89 Cb -0.13 -2.78 -0.09 0.00 0.01 0.00 0.00 42.46 39.46 1o3o s ILE 89 CO 0.03 -0.57 0.94 -0.69 0.00 0.00 0.00 174.94 174.65 1o3o s VAL 90 N 0.97 4.14 0.19 2.92 1.01 -1.26 -1.45 120.40 126.91 1o3o s VAL 90 Ca 0.09 1.96 -0.33 0.00 0.00 0.00 0.00 61.98 63.70 1o3o s VAL 90 Cb -0.20 -4.17 -0.14 0.00 0.00 0.00 0.00 36.38 31.87 1o3o s VAL 90 CO -0.07 0.33 1.51 1.57 0.00 0.00 0.00 175.10 178.44 1o3o n HIS 91 N 1.05 2.21 0.19 5.22 -0.00 -0.89 -4.83 115.22 118.17 1o3o n HIS 91 Ca -0.00 0.34 0.14 0.00 0.46 0.00 0.00 57.72 58.66 1o3o n HIS 91 Cb 0.48 -2.51 0.73 0.00 -0.12 0.00 0.00 29.99 28.58 1o3o n HIS 91 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1o3o h PRO 92 N 5.27 0.00 -0.58 1.57 0.11 -1.93 -1.47 132.00 134.97 1o3o h PRO 92 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1o3o h PRO 92 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1o3o h PRO 92 CO 0.84 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 179.06 1o3o n SER 93 N -4.23 5.69 -4.75 -2.05 7.64 -1.26 -4.97 113.62 109.69 1o3o n SER 93 Ca 0.01 -2.92 -0.41 0.00 1.01 0.00 0.00 58.87 56.57 1o3o n SER 93 Cb 0.27 -0.68 -0.02 0.00 -1.01 0.00 0.00 64.21 62.76 1o3o n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1o3o s TYR 94 N -2.73 3.06 -0.23 1.43 6.04 -0.56 -4.64 117.35 119.72 1o3o s TYR 94 Ca 0.55 1.22 0.02 0.00 0.04 0.00 0.00 57.07 58.90 1o3o s TYR 94 Cb 0.41 -3.73 0.05 0.00 -1.04 0.00 0.00 41.96 37.65 1o3o s TYR 94 CO 0.16 -2.22 -0.14 1.21 -1.54 0.00 0.00 175.55 173.03 1o3o s ASN 95 N -0.01 3.96 0.28 4.32 3.84 -1.00 -5.01 114.94 121.33 1o3o s ASN 95 Ca 0.54 -1.13 0.25 0.00 0.21 0.00 0.00 52.86 52.74 1o3o s ASN 95 Cb -0.40 -1.50 0.96 0.00 -0.55 0.00 0.00 41.25 39.76 1o3o s ASN 95 CO 0.47 -0.13 1.75 0.77 -2.79 0.00 0.00 177.10 177.17 1o3o h SER 96 N 7.84 0.00 0.57 -4.21 4.64 -1.94 0.89 113.55 121.34 1o3o h SER 96 Ca -0.28 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 60.76 1o3o h SER 96 Cb 1.08 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.14 1o3o h SER 96 CO 0.52 0.00 -1.49 0.78 -0.87 0.00 0.00 176.83 175.77 1o3o h ASN 97 N 0.00 0.19 0.00 4.97 2.35 -1.97 -3.37 115.58 117.75 1o3o h ASN 97 Ca 0.00 -0.29 0.00 0.00 -0.55 0.00 0.00 56.30 55.46 1o3o h ASN 97 Cb 0.49 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.80 1o3o h ASN 97 CO 0.00 1.24 -1.60 0.35 -1.65 0.00 0.00 177.43 175.77 1o3o n THR 98 N -3.31 0.00 -1.92 2.81 -2.24 -1.16 -4.96 114.28 103.50 1o3o n THR 98 Ca -0.14 -0.34 -0.11 0.00 -2.27 0.00 0.00 64.05 61.19 1o3o n THR 98 Cb 1.02 0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 69.51 1o3o n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1o3o n LEU 99 N -1.97 -1.28 -4.78 3.22 4.77 0.30 -4.99 117.00 112.27 1o3o n LEU 99 Ca -0.02 0.09 -0.37 0.00 -0.03 0.00 0.00 56.01 55.67 1o3o n LEU 99 Cb 0.42 -1.81 -0.04 0.00 -2.33 0.00 0.00 43.42 39.66 1o3o n LEU 99 CO 0.36 -0.28 0.74 0.21 -1.33 0.00 0.00 177.39 177.10 1o3o s ASN 100 N -2.62 6.90 -1.27 -1.43 2.47 -1.21 -2.99 114.94 114.80 1o3o s ASN 100 Ca 0.00 2.09 -0.02 0.00 0.42 0.00 0.00 52.86 55.35 1o3o s ASN 100 Cb 0.00 -2.60 0.01 0.00 -1.45 0.00 0.00 41.25 37.21 1o3o s ASN 100 CO 0.00 -0.39 0.95 0.59 -3.72 0.00 0.00 177.10 174.53 1o3o n ASN 101 N 0.27 -2.60 -4.05 -4.21 3.02 -1.26 -2.37 115.26 104.06 1o3o n ASN 101 Ca 0.03 -0.67 -0.43 0.00 -0.03 0.00 0.00 54.58 53.49 1o3o n ASN 101 Cb 0.48 -4.78 0.00 0.00 -0.61 0.00 0.00 39.78 34.87 1o3o n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1o3o n ASP 102 N -3.08 4.58 -3.87 6.41 2.03 -1.16 -4.31 116.55 117.15 1o3o n ASP 102 Ca -0.23 -2.94 -0.11 0.00 0.52 0.00 0.00 54.79 52.03 1o3o n ASP 102 Cb 0.65 -1.63 -0.11 0.00 -0.72 0.00 0.00 41.12 39.31 1o3o n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1o3o s ILE 103 N 2.56 0.06 -0.05 5.18 2.07 -1.26 -3.85 121.20 125.91 1o3o s ILE 103 Ca 0.46 -0.47 -0.07 0.00 -1.41 0.00 0.00 60.65 59.16 1o3o s ILE 103 Cb 0.08 -0.32 0.01 0.00 0.13 0.00 0.00 42.46 42.37 1o3o s ILE 103 CO -0.02 -0.26 0.18 -0.32 -1.91 0.00 0.00 174.94 172.62 1o3o s MET 104 N -0.86 0.32 -0.03 3.50 -2.45 0.01 -2.10 119.30 117.69 1o3o s MET 104 Ca -0.09 0.05 0.01 0.00 -1.25 0.00 0.00 55.69 54.41 1o3o s MET 104 Cb -0.05 0.15 -0.03 0.00 1.25 0.00 0.00 34.83 36.14 1o3o s MET 104 CO 0.01 -0.06 -0.04 -0.51 1.05 0.00 0.00 175.02 175.46 1o3o s LEU 105 N -0.40 3.30 -0.06 4.11 1.43 -0.53 -0.85 118.68 125.68 1o3o s LEU 105 Ca -0.05 -0.03 0.03 0.00 -1.03 0.00 0.00 54.13 53.05 1o3o s LEU 105 Cb -0.03 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.38 1o3o s LEU 105 CO 0.01 0.32 -0.16 -0.63 0.23 0.00 0.00 176.35 176.13 1o3o s ILE 106 N -0.94 1.37 -0.09 -0.59 1.01 -0.08 0.04 121.20 121.92 1o3o s ILE 106 Ca 0.15 -0.64 -0.05 0.00 0.00 0.00 0.00 60.65 60.12 1o3o s ILE 106 Cb -0.11 -1.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.11 1o3o s ILE 106 CO 0.05 0.40 0.10 -0.75 0.00 0.00 0.00 174.94 174.74 1o3o s LYS 107 N 0.41 3.27 0.31 2.79 2.20 -0.10 -1.02 119.74 127.61 1o3o s LYS 107 Ca -0.12 -0.25 -0.10 0.00 -0.36 0.00 0.00 55.97 55.13 1o3o s LYS 107 Cb -0.15 -3.04 -0.07 0.00 -1.51 0.00 0.00 37.83 33.07 1o3o s LYS 107 CO 0.04 0.74 0.66 -0.51 -0.36 0.00 0.00 175.35 175.92 1o3o s LEU 108 N -1.09 4.02 0.19 5.43 1.43 0.23 0.20 118.68 129.08 1o3o s LEU 108 Ca 0.16 1.03 -0.10 0.00 -1.03 0.00 0.00 54.13 54.19 1o3o s LEU 108 Cb -0.12 -3.85 0.09 0.00 0.03 0.00 0.00 46.19 42.35 1o3o s LEU 108 CO 0.05 -0.22 1.71 0.50 0.23 0.00 0.00 176.35 178.62 1o3o h LYS 109 N 1.94 1.04 -5.02 1.70 3.64 -1.18 -3.40 116.57 115.29 1o3o h LYS 109 Ca -0.47 -0.24 -0.37 0.00 -1.27 0.00 0.00 60.65 58.30 1o3o h LYS 109 Cb 1.18 -0.14 -0.14 0.00 -0.41 0.00 0.00 32.23 32.71 1o3o h LYS 109 CO 0.66 0.92 -0.65 -1.54 -2.27 0.00 0.00 179.45 176.58 1o3o s SER 110 N -6.34 1.67 0.48 4.20 1.04 -1.26 -4.98 113.70 108.51 1o3o s SER 110 Ca -0.12 -1.26 -0.18 0.00 0.48 0.00 0.00 55.95 54.87 1o3o s SER 110 Cb 0.14 0.04 -0.09 0.00 0.10 0.00 0.00 66.02 66.21 1o3o s SER 110 CO 0.83 -0.57 0.96 0.00 0.98 0.00 0.00 173.24 175.44 1o3o s ALA 111 N -3.50 3.07 0.48 5.32 0.00 -1.26 -4.82 121.76 121.05 1o3o s ALA 111 Ca 0.30 0.24 -0.10 0.00 0.00 0.00 0.00 51.96 52.41 1o3o s ALA 111 Cb 0.06 -3.11 -0.05 0.00 0.00 0.00 0.00 23.12 20.02 1o3o s ALA 111 CO 0.10 -0.08 0.86 0.00 0.00 0.00 0.00 175.76 176.63 1o3o s ALA 112 N -2.44 3.27 -0.20 0.00 0.00 0.03 -5.00 121.76 117.41 1o3o s ALA 112 Ca 0.60 -0.20 -0.19 0.00 0.00 0.00 0.00 51.96 52.16 1o3o s ALA 112 Cb -0.10 -2.81 -0.03 0.00 0.00 0.00 0.00 23.12 20.19 1o3o s ALA 112 CO 0.24 -0.26 0.55 -1.12 0.00 0.00 0.00 175.76 175.17 1o3o s SER 113 N -3.59 6.60 0.11 0.00 0.01 -1.26 -4.87 113.70 110.69 1o3o s SER 113 Ca 0.52 0.72 -0.02 0.00 1.31 0.00 0.00 55.95 58.48 1o3o s SER 113 Cb -0.10 -2.31 -0.05 0.00 0.21 0.00 0.00 66.02 63.77 1o3o s SER 113 CO 0.39 -0.21 0.30 -0.76 0.41 0.00 0.00 173.24 173.37 1o3o s LEU 114 N 1.71 4.31 0.00 2.44 1.43 -1.26 -4.79 118.68 122.52 1o3o s LEU 114 Ca 0.25 0.42 0.00 0.00 -1.03 0.00 0.00 54.13 53.77 1o3o s LEU 114 Cb -0.16 -3.13 0.00 0.00 0.03 0.00 0.00 46.19 42.94 1o3o s LEU 114 CO 0.10 0.10 0.00 -0.46 0.23 0.00 0.00 176.35 176.32 1o3o n ASN 115 N 0.11 0.43 0.07 2.29 0.23 -0.07 -4.97 115.26 113.36 1o3o n ASN 115 Ca -0.04 0.00 -0.02 0.00 -0.53 0.00 0.00 54.58 53.99 1o3o n ASN 115 Cb 0.52 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.15 1o3o n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1o3o h SER 116 N 0.00 0.00 1.23 0.53 4.64 -2.00 -3.33 113.55 114.62 1o3o h SER 116 Ca 0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 1o3o h SER 116 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1o3o h SER 116 CO 0.00 0.69 -0.81 0.03 -0.87 0.00 0.00 176.83 175.87 1o3o h ARG 117 N 0.00 0.00 -4.26 4.77 -0.00 -1.94 -3.44 114.38 109.51 1o3o h ARG 117 Ca -0.10 0.00 -0.56 0.00 -0.50 0.00 0.00 59.98 58.82 1o3o h ARG 117 Cb 1.61 0.00 -0.37 0.00 0.00 0.00 0.00 29.97 31.21 1o3o h ARG 117 CO 0.07 0.40 -0.80 0.08 0.00 0.00 0.00 179.97 179.73 1o3o s VAL 118 N -2.97 1.20 0.07 2.04 1.01 -1.25 -4.40 120.40 116.10 1o3o s VAL 118 Ca 0.02 -0.64 -0.11 0.00 0.00 0.00 0.00 61.98 61.25 1o3o s VAL 118 Cb 0.08 -1.32 0.01 0.00 0.00 0.00 0.00 36.38 35.14 1o3o s VAL 118 CO 0.77 0.19 0.25 0.00 0.00 0.00 0.00 175.10 176.30 1o3o s ALA 119 N 1.60 -0.46 0.54 5.51 0.00 -0.87 -0.89 121.76 127.19 1o3o s ALA 119 Ca 0.01 -0.33 -0.02 0.00 0.00 0.00 0.00 51.96 51.63 1o3o s ALA 119 Cb -0.15 0.44 0.02 0.00 0.00 0.00 0.00 23.12 23.42 1o3o s ALA 119 CO -0.08 -0.48 0.79 -1.54 0.00 0.00 0.00 175.76 174.45 1o3o s SER 120 N -2.52 5.52 0.11 0.00 1.04 -1.26 -3.17 113.70 113.43 1o3o s SER 120 Ca 0.00 0.33 0.08 0.00 0.48 0.00 0.00 55.95 56.84 1o3o s SER 120 Cb 0.02 -1.36 -0.04 0.00 0.10 0.00 0.00 66.02 64.74 1o3o s SER 120 CO -0.08 -1.00 -0.12 -0.51 0.98 0.00 0.00 173.24 172.51 1o3o s ILE 121 N -2.79 3.22 0.39 -1.02 1.10 -0.60 -4.87 121.20 116.64 1o3o s ILE 121 Ca 0.53 -1.36 -0.20 0.00 -0.51 0.00 0.00 60.65 59.11 1o3o s ILE 121 Cb -0.10 -2.51 -0.10 0.00 0.15 0.00 0.00 42.46 39.89 1o3o s ILE 121 CO 0.40 0.09 0.91 -0.44 -2.11 0.00 0.00 174.94 173.79 1o3o s SER 122 N -2.24 6.96 0.42 4.50 0.01 -1.26 -4.64 113.70 117.45 1o3o s SER 122 Ca 0.21 1.63 -0.11 0.00 1.31 0.00 0.00 55.95 58.98 1o3o s SER 122 Cb -0.11 -2.51 -0.07 0.00 0.21 0.00 0.00 66.02 63.55 1o3o s SER 122 CO 0.13 -0.29 0.80 -0.76 0.41 0.00 0.00 173.24 173.52 1o3o s LEU 123 N -2.99 3.80 0.53 2.44 1.43 -1.26 -0.82 118.68 121.81 1o3o s LEU 123 Ca 0.59 1.18 -0.16 0.00 -1.03 0.00 0.00 54.13 54.71 1o3o s LEU 123 Cb -0.10 -4.07 -0.07 0.00 0.03 0.00 0.00 46.19 41.97 1o3o s LEU 123 CO 0.15 -0.42 1.00 -2.16 0.23 0.00 0.00 176.35 175.14 1o3o s PRO 124 N -3.89 3.85 -0.12 1.29 0.04 -1.26 -4.76 135.00 130.16 1o3o s PRO 124 Ca 0.52 0.99 0.18 0.00 0.04 0.00 0.00 61.00 62.73 1o3o s PRO 124 Cb -0.10 -2.12 -0.26 0.00 0.04 0.00 0.00 34.50 32.06 1o3o s PRO 124 CO 0.32 -0.35 0.29 0.25 0.04 0.00 0.00 177.00 177.55 1o3o n THR 125 N -1.66 1.06 -4.13 1.26 -2.24 -1.26 -4.94 114.28 102.36 1o3o n THR 125 Ca 0.07 -0.75 -0.09 0.00 -2.27 0.00 0.00 64.05 61.00 1o3o n THR 125 Cb 0.54 -0.42 -0.10 0.00 -2.10 0.00 0.00 70.33 68.25 1o3o n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1o3o s SER 127 N -5.34 0.32 0.63 3.42 1.04 -1.26 -5.14 113.70 107.37 1o3o s SER 127 Ca -0.08 -1.15 -0.11 0.00 0.48 0.00 0.00 55.95 55.08 1o3o s SER 127 Cb 0.08 0.29 -0.03 0.00 0.10 0.00 0.00 66.02 66.46 1o3o s SER 127 CO 0.85 -0.72 1.04 0.00 0.98 0.00 0.00 173.24 175.39 1o3o s ALA 129 N -3.20 3.79 0.35 0.00 0.00 -1.26 -5.10 121.76 116.34 1o3o s ALA 129 Ca 0.55 -0.88 0.04 0.00 0.00 0.00 0.00 51.96 51.67 1o3o s ALA 129 Cb -0.11 -2.02 -0.01 0.00 0.00 0.00 0.00 23.12 20.98 1o3o s ALA 129 CO 0.54 0.26 0.52 -1.54 0.00 0.00 0.00 175.76 175.54 1o3o s SER 130 N -3.51 6.03 0.59 0.00 1.04 -1.26 -5.00 113.70 111.58 1o3o s SER 130 Ca 0.39 0.07 -0.20 0.00 0.48 0.00 0.00 55.95 56.69 1o3o s SER 130 Cb -0.10 -1.52 -0.04 0.00 0.10 0.00 0.00 66.02 64.46 1o3o s SER 130 CO 0.31 -0.44 1.25 0.00 0.98 0.00 0.00 173.24 175.34 1o3o n ALA 132 N -1.75 1.12 0.00 5.32 0.00 -1.26 -1.31 120.51 122.63 1o3o n ALA 132 Ca -0.02 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1o3o n ALA 132 Cb 0.58 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.74 1o3o n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o3o n GLY 133 N 0.93 3.21 3.76 0.00 0.00 0.82 -4.92 105.19 108.98 1o3o n GLY 133 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1o3o n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1o3o s THR 134 N -2.20 2.34 -0.03 2.61 2.01 -0.43 -4.65 115.64 115.29 1o3o s THR 134 Ca 0.00 0.31 -0.16 0.00 0.31 0.00 0.00 61.69 62.14 1o3o s THR 134 Cb 0.00 -3.20 -0.05 0.00 0.01 0.00 0.00 72.50 69.26 1o3o s THR 134 CO 0.00 0.06 0.45 -1.58 -0.69 0.00 0.00 174.62 172.86 1o3o s GLN 135 N -1.01 4.10 0.17 4.92 2.00 -1.26 -1.26 119.66 127.31 1o3o s GLN 135 Ca 0.58 0.47 0.03 0.00 -2.00 0.00 0.00 55.36 54.43 1o3o s GLN 135 Cb -0.44 -3.29 -0.05 0.00 0.80 0.00 0.00 33.01 30.03 1o3o s GLN 135 CO 0.51 0.52 -0.04 0.00 -0.50 0.00 0.00 175.29 175.78 1o3o s LEU 137 N -3.19 3.13 -0.05 0.00 2.96 0.01 -0.72 118.68 120.83 1o3o s LEU 137 Ca 0.21 -0.18 0.07 0.00 -0.22 0.00 0.00 54.13 54.01 1o3o s LEU 137 Cb 0.05 -1.75 -0.01 0.00 0.50 0.00 0.00 46.19 44.98 1o3o s LEU 137 CO 0.03 0.16 -0.25 -0.63 -1.32 0.00 0.00 176.35 174.34 1o3o s ILE 138 N 0.43 2.04 0.07 6.68 1.01 0.11 -1.33 121.20 130.20 1o3o s ILE 138 Ca -0.05 -1.07 -0.01 0.00 0.00 0.00 0.00 60.65 59.53 1o3o s ILE 138 Cb -0.15 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.57 1o3o s ILE 138 CO 0.03 0.57 -0.02 -0.94 0.00 0.00 0.00 174.94 174.58 1o3o s SER 139 N -0.29 0.56 0.00 3.58 1.04 -1.24 -0.97 113.70 116.38 1o3o s SER 139 Ca 0.00 -1.03 0.00 0.00 0.48 0.00 0.00 55.95 55.40 1o3o s SER 139 Cb -0.13 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.19 1o3o s SER 139 CO 0.02 -0.60 0.00 0.61 0.98 0.00 0.00 173.24 174.25 1o3o n GLY 140 N 0.06 0.97 1.49 7.32 0.00 -0.21 -4.53 105.19 110.29 1o3o n GLY 140 Ca -0.13 -1.07 -0.10 0.00 0.00 0.00 0.00 46.02 44.72 1o3o n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1o3o n TRP 141 N -0.72 1.69 -2.13 1.61 8.01 -1.26 -1.84 117.44 122.81 1o3o n TRP 141 Ca 0.00 -1.68 -0.27 0.00 -1.31 0.00 0.00 57.50 54.24 1o3o n TRP 141 Cb 0.00 -0.63 0.12 0.00 -2.01 0.00 0.00 31.31 28.79 1o3o n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1o3o s GLY 142 N -2.16 1.72 0.32 6.99 0.00 -1.25 -4.50 107.32 108.44 1o3o s GLY 142 Ca 0.48 -1.15 -0.27 0.00 0.00 0.00 0.00 44.72 43.79 1o3o s GLY 142 CO 0.03 -0.56 0.93 -2.01 0.00 0.00 0.00 173.10 171.49 1o3o n ASN 143 N -3.29 0.90 -0.64 1.64 5.15 0.05 -2.19 115.26 116.87 1o3o n ASN 143 Ca 0.12 1.13 0.07 0.00 -0.60 0.00 0.00 54.58 55.30 1o3o n ASN 143 Cb 0.60 -1.26 0.12 0.00 -0.53 0.00 0.00 39.78 38.71 1o3o n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1o3o n THR 144 N -0.01 0.47 -4.84 -0.44 -2.24 -0.49 0.21 114.28 106.94 1o3o n THR 144 Ca 0.10 -0.74 -0.32 0.00 -2.27 0.00 0.00 64.05 60.83 1o3o n THR 144 Cb 0.33 0.91 -0.13 0.00 -2.10 0.00 0.00 70.33 69.34 1o3o n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1o3o s LYS 145 N -1.06 2.29 0.07 -0.78 1.02 -1.26 -4.48 119.74 115.54 1o3o s LYS 145 Ca 0.21 -0.84 0.24 0.00 0.02 0.00 0.00 55.97 55.60 1o3o s LYS 145 Cb 0.13 -2.27 0.24 0.00 -0.52 0.00 0.00 37.83 35.41 1o3o s LYS 145 CO 0.18 0.58 1.21 -1.13 -0.92 0.00 0.00 175.35 175.27 1o3o n SER 146 N 1.99 0.64 -3.67 2.83 3.41 -1.26 -4.53 113.62 113.03 1o3o n SER 146 Ca -0.16 -0.08 -0.29 0.00 -0.26 0.00 0.00 58.87 58.07 1o3o n SER 146 Cb 0.52 0.44 -0.13 0.00 -0.26 0.00 0.00 64.21 64.78 1o3o n SER 146 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1o3o s SER 147 N -3.92 3.53 0.00 4.04 0.01 -1.26 -4.53 113.70 111.56 1o3o s SER 147 Ca 0.06 -2.54 0.00 0.00 1.31 0.00 0.00 55.95 54.78 1o3o s SER 147 Cb 0.14 -0.92 0.00 0.00 0.21 0.00 0.00 66.02 65.46 1o3o s SER 147 CO 0.75 -0.28 0.00 0.61 0.41 0.00 0.00 173.24 174.74 1o3o n GLY 148 N 3.65 1.75 3.24 3.44 0.00 -1.26 -5.04 105.19 110.96 1o3o n GLY 148 Ca 0.09 -2.24 -0.34 0.00 0.00 0.00 0.00 46.02 43.54 1o3o n GLY 148 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o3o s THR 149 N -1.52 2.74 -0.04 2.61 -4.23 -1.26 -4.53 115.64 109.41 1o3o s THR 149 Ca 0.00 -0.73 -0.02 0.00 -1.18 0.00 0.00 61.69 59.77 1o3o s THR 149 Cb 0.00 -2.19 0.03 0.00 1.34 0.00 0.00 72.50 71.68 1o3o s THR 149 CO 0.00 0.49 0.04 -0.55 -0.54 0.00 0.00 174.62 174.07 1o3o s SER 150 N 1.13 1.08 -0.14 3.99 0.15 -1.26 -4.99 113.70 113.66 1o3o s SER 150 Ca 0.01 0.04 -0.02 0.00 0.70 0.00 0.00 55.95 56.68 1o3o s SER 150 Cb -0.14 -0.20 -0.02 0.00 -1.71 0.00 0.00 66.02 63.95 1o3o s SER 150 CO -0.04 -0.22 -0.09 -0.31 1.20 0.00 0.00 173.24 173.77 1o3o s TYR 151 N 1.96 2.89 0.71 3.44 1.51 -1.26 -1.39 117.35 125.20 1o3o s TYR 151 Ca 0.03 -0.53 -0.10 0.00 -1.01 0.00 0.00 57.07 55.46 1o3o s TYR 151 Cb -0.12 -1.89 0.04 0.00 -0.11 0.00 0.00 41.96 39.87 1o3o s TYR 151 CO -0.03 -0.16 1.07 -1.25 -1.11 0.00 0.00 175.55 174.07 1o3o s PRO 152 N 0.38 2.54 -0.12 -1.71 0.04 -1.26 -4.97 135.00 129.89 1o3o s PRO 152 Ca -0.08 0.17 -0.09 0.00 0.04 0.00 0.00 61.00 61.04 1o3o s PRO 152 Cb -0.15 -2.07 -0.26 0.00 0.04 0.00 0.00 34.50 32.06 1o3o s PRO 152 CO 0.04 -1.15 0.38 -0.44 0.04 0.00 0.00 177.00 175.88 1o3o h ASP 153 N -0.66 0.39 -2.09 6.66 3.32 -1.95 -3.47 116.42 118.63 1o3o h ASP 153 Ca -0.45 -0.90 -0.47 0.00 0.02 0.00 0.00 57.03 55.22 1o3o h ASP 153 Cb 1.28 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.68 1o3o h ASP 153 CO 0.63 1.81 -0.45 0.68 -1.72 0.00 0.00 179.24 180.19 1o3o s VAL 154 N -2.53 4.60 0.15 -1.35 -7.23 -1.26 -1.08 120.40 111.70 1o3o s VAL 154 Ca -0.22 -1.17 -0.31 0.00 -1.81 0.00 0.00 61.98 58.46 1o3o s VAL 154 Cb 0.06 -3.56 -0.10 0.00 0.56 0.00 0.00 36.38 33.34 1o3o s VAL 154 CO 0.76 -0.29 1.70 -0.22 -0.31 0.00 0.00 175.10 176.74 1o3o s LEU 155 N -3.97 4.38 0.09 1.32 2.96 -1.08 -4.81 118.68 117.57 1o3o s LEU 155 Ca 0.36 2.71 0.06 0.00 -0.22 0.00 0.00 54.13 57.03 1o3o s LEU 155 Cb -0.08 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 1o3o s LEU 155 CO 0.28 -0.93 -0.04 -0.54 -1.32 0.00 0.00 176.35 173.80 1o3o s LYS 156 N 1.84 2.40 0.16 1.98 -0.14 -0.76 -1.43 119.74 123.78 1o3o s LYS 156 Ca 0.75 -0.90 0.09 0.00 -1.36 0.00 0.00 55.97 54.55 1o3o s LYS 156 Cb -0.45 -2.46 -0.04 0.00 -1.68 0.00 0.00 37.83 33.20 1o3o s LYS 156 CO 0.33 0.53 -0.19 0.00 -0.76 0.00 0.00 175.35 175.26 1o3o s LEU 158 N -2.57 0.13 -0.25 0.00 2.96 -0.14 -0.25 118.68 118.56 1o3o s LEU 158 Ca 0.15 0.82 -0.12 0.00 -0.22 0.00 0.00 54.13 54.77 1o3o s LEU 158 Cb -0.07 1.28 -0.05 0.00 0.50 0.00 0.00 46.19 47.86 1o3o s LEU 158 CO 0.07 -0.17 0.23 -0.54 -1.32 0.00 0.00 176.35 174.62 1o3o s LYS 159 N 1.04 4.05 0.01 1.98 -0.14 -1.26 -0.72 119.74 124.71 1o3o s LYS 159 Ca -0.07 -0.17 0.00 0.00 -1.36 0.00 0.00 55.97 54.37 1o3o s LYS 159 Cb -0.07 -3.59 -0.01 0.00 -1.68 0.00 0.00 37.83 32.48 1o3o s LYS 159 CO -0.09 -0.07 -0.02 0.00 -0.76 0.00 0.00 175.35 174.42 1o3o s ALA 160 N 1.42 0.09 0.31 5.17 0.00 0.10 -4.92 121.76 123.93 1o3o s ALA 160 Ca 0.10 -0.31 -0.13 0.00 0.00 0.00 0.00 51.96 51.61 1o3o s ALA 160 Cb -0.15 0.07 -0.08 0.00 0.00 0.00 0.00 23.12 22.96 1o3o s ALA 160 CO 0.07 -0.07 0.70 -1.25 0.00 0.00 0.00 175.76 175.21 1o3o s PRO 161 N -0.75 3.94 0.14 0.00 0.04 -1.26 -0.62 135.00 136.49 1o3o s PRO 161 Ca -0.08 0.57 -0.30 0.00 0.04 0.00 0.00 61.00 61.23 1o3o s PRO 161 Cb -0.05 -2.48 -0.07 0.00 0.04 0.00 0.00 34.50 31.94 1o3o s PRO 161 CO -0.00 0.18 1.11 0.42 0.04 0.00 0.00 177.00 178.74 1o3o s ILE 162 N -1.97 3.98 0.55 0.56 1.01 -0.39 -1.56 121.20 123.38 1o3o s ILE 162 Ca 0.52 1.63 -0.01 0.00 0.00 0.00 0.00 60.65 62.80 1o3o s ILE 162 Cb -0.10 -4.04 0.03 0.00 0.01 0.00 0.00 42.46 38.35 1o3o s ILE 162 CO 0.19 0.24 0.79 -0.76 0.00 0.00 0.00 174.94 175.40 1o3o s LEU 163 N -0.00 3.30 0.63 2.97 1.43 0.03 -0.13 118.68 126.91 1o3o s LEU 163 Ca 0.51 0.18 -0.13 0.00 -1.03 0.00 0.00 54.13 53.66 1o3o s LEU 163 Cb -0.29 -3.02 -0.02 0.00 0.03 0.00 0.00 46.19 42.89 1o3o s LEU 163 CO 0.33 -1.09 1.04 -0.94 0.23 0.00 0.00 176.35 175.93 1o3o s SER 164 N -4.38 5.80 0.33 2.29 1.04 -1.26 -4.56 113.70 112.96 1o3o s SER 164 Ca 0.55 1.62 0.02 0.00 0.48 0.00 0.00 55.95 58.62 1o3o s SER 164 Cb -0.10 -2.50 0.57 0.00 0.10 0.00 0.00 66.02 64.09 1o3o s SER 164 CO 0.40 -1.16 1.93 -0.78 0.98 0.00 0.00 173.24 174.61 1o3o h ASP 165 N -0.15 0.68 -0.22 7.02 -0.00 -1.97 -1.89 116.42 119.88 1o3o h ASP 165 Ca -0.45 -0.07 -0.01 0.00 -0.00 0.00 0.00 57.03 56.50 1o3o h ASP 165 Cb 1.21 -0.17 -0.01 0.00 -0.00 0.00 0.00 39.33 40.35 1o3o h ASP 165 CO 0.58 0.59 0.10 0.28 -0.00 0.00 0.00 179.24 180.80 1o3o h SER 166 N 0.75 0.30 -0.71 2.28 0.02 -1.98 -0.24 113.55 113.97 1o3o h SER 166 Ca 0.19 -0.14 -0.06 0.00 -0.84 0.00 0.00 61.79 60.94 1o3o h SER 166 Cb 0.10 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 1o3o h SER 166 CO -0.02 0.35 0.20 0.28 -1.14 0.00 0.00 176.83 176.50 1o3o h SER 167 N 0.22 1.06 0.18 3.07 0.02 -1.85 0.54 113.55 116.79 1o3o h SER 167 Ca 0.08 -0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 1o3o h SER 167 Cb 0.14 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.40 1o3o h SER 167 CO -0.01 0.99 -0.09 0.00 -1.14 0.00 0.00 176.83 176.59 1o3o h LYS 169 N -0.31 0.00 0.02 0.00 1.57 -0.93 -1.26 116.57 115.66 1o3o h LYS 169 Ca -0.03 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.53 1o3o h LYS 169 Cb 0.24 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 1o3o h LYS 169 CO 0.04 0.18 -0.97 1.03 -0.57 0.00 0.00 179.45 179.16 1o3o h SER 170 N 0.00 0.46 -0.18 0.86 0.87 -0.53 -2.61 113.55 112.42 1o3o h SER 170 Ca -0.00 -0.38 -0.15 0.00 -1.23 0.00 0.00 61.79 60.02 1o3o h SER 170 Cb 0.52 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1o3o h SER 170 CO 0.02 1.20 -0.48 0.00 -0.53 0.00 0.00 176.83 177.04 1o3o h ALA 171 N 0.77 0.30 -2.18 6.23 0.00 -0.04 -3.36 119.26 120.98 1o3o h ALA 171 Ca -0.08 -0.49 -0.60 0.00 0.00 0.00 0.00 54.91 53.75 1o3o h ALA 171 Cb 1.62 -0.04 -0.42 0.00 0.00 0.00 0.00 17.79 18.95 1o3o h ALA 171 CO 0.16 0.46 -0.64 0.66 0.00 0.00 0.00 179.25 179.90 1o3o n TYR 172 N -4.18 3.33 -1.65 0.00 4.01 -0.58 -4.98 117.16 113.10 1o3o n TYR 172 Ca -0.06 -4.10 -0.47 0.00 -0.16 0.00 0.00 57.90 53.11 1o3o n TYR 172 Cb 0.58 -0.54 -0.04 0.00 -0.31 0.00 0.00 39.34 39.03 1o3o n TYR 172 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1o3o n PRO 173 N 0.83 1.95 -0.88 -0.72 -0.04 -0.98 -1.67 135.00 133.48 1o3o n PRO 173 Ca 0.29 0.70 0.00 0.00 -0.04 0.00 0.00 63.50 64.46 1o3o n PRO 173 Cb 0.42 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.44 1o3o n PRO 173 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1o3o n GLY 174 N 3.21 0.28 0.34 0.55 0.00 -1.26 -4.82 105.19 103.49 1o3o n GLY 174 Ca 0.17 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.25 1o3o n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1o3o n GLN 175 N -1.15 1.52 -3.69 1.61 6.02 -0.67 -4.97 117.38 116.06 1o3o n GLN 175 Ca 0.00 -0.85 -0.36 0.00 -0.01 0.00 0.00 57.00 55.78 1o3o n GLN 175 Cb 0.18 -1.16 -0.10 0.00 1.02 0.00 0.00 30.24 30.18 1o3o n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1o3o s ILE 176 N -1.31 5.25 0.54 5.09 -1.09 -1.25 -5.04 121.20 123.39 1o3o s ILE 176 Ca 0.11 0.14 0.08 0.00 -2.23 0.00 0.00 60.65 58.75 1o3o s ILE 176 Cb 0.09 -3.44 0.06 0.00 -1.58 0.00 0.00 42.46 37.59 1o3o s ILE 176 CO 0.24 0.35 0.65 0.42 -1.23 0.00 0.00 174.94 175.36 1o3o s THR 177 N 1.07 2.14 -2.00 2.92 -4.23 -1.26 -4.96 115.64 109.31 1o3o s THR 177 Ca 0.07 -1.15 0.18 0.00 -1.18 0.00 0.00 61.69 59.62 1o3o s THR 177 Cb -0.14 -2.28 0.52 0.00 1.34 0.00 0.00 72.50 71.94 1o3o s THR 177 CO 0.04 0.00 1.54 -1.54 -0.54 0.00 0.00 174.62 174.12 1o3o n SER 178 N -2.04 0.00 -1.17 3.99 3.41 -1.26 -2.33 113.62 114.22 1o3o n SER 178 Ca 0.10 -0.89 0.06 0.00 -0.26 0.00 0.00 58.87 57.88 1o3o n SER 178 Cb 0.62 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.85 1o3o n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1o3o n ASN 179 N -0.89 4.17 -4.11 4.04 3.02 -1.26 -4.92 115.26 115.31 1o3o n ASN 179 Ca 0.14 -3.08 -0.11 0.00 -0.03 0.00 0.00 54.58 51.49 1o3o n ASN 179 Cb 0.06 -0.59 -0.11 0.00 -0.61 0.00 0.00 39.78 38.53 1o3o n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1o3o s MET 180 N -2.87 0.68 0.05 3.52 -1.94 -0.98 -1.03 119.30 116.71 1o3o s MET 180 Ca 0.46 -1.07 -0.12 0.00 -1.71 0.00 0.00 55.69 53.25 1o3o s MET 180 Cb 0.37 -0.21 0.01 0.00 2.01 0.00 0.00 34.83 37.01 1o3o s MET 180 CO 0.10 0.01 0.26 -0.59 -0.01 0.00 0.00 175.02 174.79 1o3o s PHE 181 N -2.63 -0.04 0.05 -0.03 -0.71 -0.45 -4.78 117.98 109.38 1o3o s PHE 181 Ca 0.02 -0.14 0.02 0.00 -1.04 0.00 0.00 56.93 55.79 1o3o s PHE 181 Cb -0.01 0.05 -0.04 0.00 -1.21 0.00 0.00 43.02 41.81 1o3o s PHE 181 CO -0.03 -0.49 0.08 0.00 -1.34 0.00 0.00 175.22 173.44 1o3o s ALA 183 N -1.32 -0.49 0.00 0.00 0.00 -0.86 -0.79 121.76 118.30 1o3o s ALA 183 Ca 0.27 0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1o3o s ALA 183 Cb -0.12 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.11 1o3o s ALA 183 CO 0.19 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 176.13 1o3o n GLY 184 N 1.34 0.92 2.98 0.00 0.00 -0.60 -2.52 105.19 107.31 1o3o n GLY 184 Ca -0.22 -1.94 -0.29 0.00 0.00 0.00 0.00 46.02 43.57 1o3o n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1o3o s TYR 184 N -2.56 1.98 0.02 1.61 2.02 -1.26 -4.41 117.35 114.74 1o3o s TYR 184 Ca 0.00 -1.10 0.32 0.00 -0.37 0.00 0.00 57.07 55.92 1o3o s TYR 184 Cb 0.00 -1.49 1.23 0.00 -0.40 0.00 0.00 41.96 41.30 1o3o s TYR 184 CO 0.00 -0.63 1.93 -0.07 -1.57 0.00 0.00 175.55 175.21 1o3o h LEU 185 N 8.08 0.00 -0.43 -1.29 3.38 -1.94 -2.26 115.31 120.85 1o3o h LEU 185 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1o3o h LEU 185 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1o3o h LEU 185 CO 0.49 0.00 0.00 1.05 0.09 0.00 0.00 178.44 180.07 1o3o h GLU 186 N 0.00 0.00 0.00 1.13 9.09 -1.94 0.44 114.58 123.30 1o3o h GLU 186 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1o3o h GLU 186 Cb 0.57 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.67 1o3o h GLU 186 CO 0.00 0.00 0.00 0.41 0.05 0.00 0.00 179.01 179.47 1o3o n GLY 187 N 0.69 -0.10 2.01 1.06 0.00 -0.85 -4.49 105.19 103.51 1o3o n GLY 187 Ca 0.04 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.14 1o3o n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o3o n GLY 188 N -0.22 2.95 2.83 -0.02 0.00 -0.69 -4.94 105.19 105.09 1o3o n GLY 188 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1o3o n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o3o s LYS 188 N -0.20 0.67 0.06 1.61 1.02 -1.26 -3.36 119.74 118.28 1o3o s LYS 188 Ca 0.00 0.01 -0.27 0.00 0.02 0.00 0.00 55.97 55.73 1o3o s LYS 188 Cb 0.00 -0.87 0.10 0.00 -0.52 0.00 0.00 37.83 36.54 1o3o s LYS 188 CO 0.00 -0.19 1.16 0.34 -0.92 0.00 0.00 175.35 175.73 1o3o s ASP 189 N 1.43 -0.08 0.61 2.83 3.68 -0.76 -4.25 116.67 120.13 1o3o s ASP 189 Ca -0.03 -0.30 -0.00 0.00 2.13 0.00 0.00 52.55 54.35 1o3o s ASP 189 Cb -0.13 0.30 0.05 0.00 -1.45 0.00 0.00 42.92 41.69 1o3o s ASP 189 CO -0.03 -0.57 0.85 -0.94 0.13 0.00 0.00 175.17 174.61 1o3o s SER 190 N -3.12 5.04 0.27 -0.34 1.04 -1.26 -0.67 113.70 114.65 1o3o s SER 190 Ca 0.16 0.01 -0.05 0.00 0.48 0.00 0.00 55.95 56.55 1o3o s SER 190 Cb 0.01 -0.77 0.02 0.00 0.10 0.00 0.00 66.02 65.39 1o3o s SER 190 CO -0.00 -1.34 0.44 0.00 0.98 0.00 0.00 173.24 173.32 1o3o n GLN 192 N -0.41 2.13 0.00 0.00 10.64 -1.26 -0.94 117.38 127.54 1o3o n GLN 192 Ca -0.02 0.75 0.00 0.00 -1.83 0.00 0.00 57.00 55.90 1o3o n GLN 192 Cb 0.43 -2.36 0.00 0.00 -0.86 0.00 0.00 30.24 27.46 1o3o n GLN 192 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1o3o n GLY 193 N 1.15 2.58 0.10 2.61 0.00 -1.26 -0.77 105.19 109.61 1o3o n GLY 193 Ca 0.06 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.21 1o3o n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1o3o h ASP 194 N 0.35 0.00 -0.90 1.61 3.32 -1.34 -3.35 116.42 116.11 1o3o h ASP 194 Ca 0.00 -0.10 -0.65 0.00 0.02 0.00 0.00 57.03 56.30 1o3o h ASP 194 Cb 0.00 0.00 0.07 0.00 0.22 0.00 0.00 39.33 39.62 1o3o h ASP 194 CO 0.00 0.05 -0.23 -1.20 -1.72 0.00 0.00 179.24 176.14 1o3o n SER 195 N -2.36 -0.60 0.00 6.45 7.64 -1.25 -1.69 113.62 121.81 1o3o n SER 195 Ca 0.04 1.03 0.00 0.00 1.01 0.00 0.00 58.87 60.94 1o3o n SER 195 Cb 0.46 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 1o3o n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o3o n GLY 196 N 1.59 2.94 3.87 0.23 0.00 -0.31 0.01 105.19 113.53 1o3o n GLY 196 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1o3o n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o3o s GLY 197 N -1.67 1.68 0.43 -0.02 0.00 -0.68 -3.30 107.32 103.77 1o3o s GLY 197 Ca 0.00 -0.94 -0.21 0.00 0.00 0.00 0.00 44.72 43.57 1o3o s GLY 197 CO 0.00 -0.26 0.94 2.56 0.00 0.00 0.00 173.10 176.34 1o3o s PRO 198 N -5.68 4.22 -0.24 2.90 0.04 -1.26 -0.62 135.00 134.36 1o3o s PRO 198 Ca 0.69 1.10 -0.01 0.00 0.04 0.00 0.00 61.00 62.82 1o3o s PRO 198 Cb -0.08 -2.19 0.07 0.00 0.04 0.00 0.00 34.50 32.35 1o3o s PRO 198 CO 0.52 -0.02 0.04 0.08 0.04 0.00 0.00 177.00 177.66 1o3o s VAL 199 N -2.17 0.83 -0.14 -0.36 1.01 -0.93 -3.59 120.40 115.05 1o3o s VAL 199 Ca 0.62 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.64 1o3o s VAL 199 Cb -0.09 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.89 1o3o s VAL 199 CO 0.13 -0.34 -0.14 -0.69 0.00 0.00 0.00 175.10 174.06 1o3o s VAL 200 N 1.69 2.91 -0.07 2.92 1.01 -0.44 -1.05 120.40 127.37 1o3o s VAL 200 Ca 0.02 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.32 1o3o s VAL 200 Cb -0.17 -2.22 0.01 0.00 0.00 0.00 0.00 36.38 34.00 1o3o s VAL 200 CO -0.13 0.52 -0.14 0.00 0.00 0.00 0.00 175.10 175.35 1o3o n SER 202 N 3.77 -1.46 -0.75 0.00 7.64 -1.26 -1.28 113.62 120.28 1o3o n SER 202 Ca -0.22 -1.02 -0.10 0.00 1.01 0.00 0.00 58.87 58.54 1o3o n SER 202 Cb 0.52 -2.86 -0.04 0.00 -1.01 0.00 0.00 64.21 60.82 1o3o n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o3o n GLY 203 N -1.80 1.11 3.18 0.23 0.00 -1.26 -5.01 105.19 101.64 1o3o n GLY 203 Ca -0.16 -0.43 -0.22 0.00 0.00 0.00 0.00 46.02 45.22 1o3o n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o3o s LYS 204 N -2.70 1.08 -0.51 1.61 -0.14 -0.40 -4.12 119.74 114.56 1o3o s LYS 204 Ca 0.00 -0.80 -0.29 0.00 -1.36 0.00 0.00 55.97 53.52 1o3o s LYS 204 Cb 0.00 -1.13 0.03 0.00 -1.68 0.00 0.00 37.83 35.05 1o3o s LYS 204 CO 0.00 0.28 1.22 -1.17 -0.76 0.00 0.00 175.35 174.92 1o3o s LEU 209 N -1.12 3.55 -0.12 3.17 2.96 -0.00 -1.53 118.68 125.59 1o3o s LEU 209 Ca 0.04 0.39 0.15 0.00 -0.22 0.00 0.00 54.13 54.49 1o3o s LEU 209 Cb -0.08 -3.39 -0.22 0.00 0.50 0.00 0.00 46.19 43.00 1o3o s LEU 209 CO 0.01 -1.39 0.15 0.00 -1.32 0.00 0.00 176.35 173.80 1o3o n GLN 210 N 8.13 1.15 -4.17 1.98 1.13 -0.21 -4.04 117.38 121.35 1o3o n GLN 210 Ca 0.12 -0.05 -0.12 0.00 -1.94 0.00 0.00 57.00 55.01 1o3o n GLN 210 Cb 0.49 -1.41 -0.09 0.00 0.11 0.00 0.00 30.24 29.34 1o3o n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1o3o s GLY 211 N -4.66 1.33 -0.05 1.08 0.00 -0.89 -2.05 107.32 102.09 1o3o s GLY 211 Ca -0.07 -1.58 0.02 0.00 0.00 0.00 0.00 44.72 43.08 1o3o s GLY 211 CO 0.67 -1.28 -0.10 -0.42 0.00 0.00 0.00 173.10 171.97 1o3o s ILE 212 N -4.09 0.93 0.04 0.90 1.01 -1.04 -2.18 121.20 116.77 1o3o s ILE 212 Ca 0.36 -0.39 -0.30 0.00 0.00 0.00 0.00 60.65 60.32 1o3o s ILE 212 Cb 0.06 -0.85 -0.08 0.00 0.01 0.00 0.00 42.46 41.59 1o3o s ILE 212 CO 0.12 0.30 1.80 -0.69 0.00 0.00 0.00 174.94 176.48 1o3o s VAL 213 N 0.54 3.07 0.01 2.92 1.01 0.21 -1.29 120.40 126.87 1o3o s VAL 213 Ca -0.10 0.29 -0.00 0.00 0.00 0.00 0.00 61.98 62.16 1o3o s VAL 213 Cb -0.13 -3.18 -0.00 0.00 0.00 0.00 0.00 36.38 33.06 1o3o s VAL 213 CO 0.02 -0.02 -0.01 -0.24 0.00 0.00 0.00 175.10 174.86 1o3o n SER 214 N 6.71 0.16 -1.70 3.32 2.88 -0.98 -1.16 113.62 122.85 1o3o n SER 214 Ca 0.18 0.02 -0.05 0.00 -1.33 0.00 0.00 58.87 57.70 1o3o n SER 214 Cb 0.41 -0.11 -0.00 0.00 -0.75 0.00 0.00 64.21 63.76 1o3o n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1o3o n TRP 215 N -2.65 -1.08 0.00 0.66 4.27 -0.80 -4.91 117.44 112.93 1o3o n TRP 215 Ca -0.00 -0.79 0.00 0.00 -3.89 0.00 0.00 57.50 52.82 1o3o n TRP 215 Cb 0.01 0.26 0.00 0.00 -1.36 0.00 0.00 31.31 30.22 1o3o n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1o3o n GLY 216 N -0.21 -0.37 3.35 -1.67 0.00 -1.26 -0.91 105.19 104.12 1o3o n GLY 216 Ca -0.01 -1.02 -0.41 0.00 0.00 0.00 0.00 46.02 44.58 1o3o n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1o3o s SER 217 N 0.00 5.73 0.62 1.61 0.15 -1.26 -4.95 113.70 115.61 1o3o s SER 217 Ca 0.00 -1.16 0.00 0.00 0.70 0.00 0.00 55.95 55.49 1o3o s SER 217 Cb 0.00 -2.02 0.00 0.00 -1.71 0.00 0.00 66.02 62.29 1o3o s SER 217 CO 0.00 -0.44 0.00 0.61 1.20 0.00 0.00 173.24 174.61 1o3o n GLY 219 N 4.99 -0.32 2.87 9.45 0.00 -1.26 -4.64 105.19 116.28 1o3o n GLY 219 Ca -0.11 -1.05 -0.15 0.00 0.00 0.00 0.00 46.02 44.71 1o3o n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o3o n ALA 221 N 3.49 -0.88 -2.24 0.00 0.00 -1.26 -4.58 120.51 115.04 1o3o n ALA 221 Ca -0.19 0.17 -0.33 0.00 0.00 0.00 0.00 53.44 53.09 1o3o n ALA 221 Cb 0.55 -2.68 -0.06 0.00 0.00 0.00 0.00 19.45 17.27 1o3o n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1o3o s GLN 221 N -5.47 3.99 0.43 0.00 -1.52 -1.26 -1.71 119.66 114.12 1o3o s GLN 221 Ca 0.19 0.57 -0.26 0.00 -1.95 0.00 0.00 55.36 53.91 1o3o s GLN 221 Cb -0.09 -2.64 -0.09 0.00 -0.22 0.00 0.00 33.01 29.96 1o3o s GLN 221 CO 0.23 0.29 1.39 1.17 -0.25 0.00 0.00 175.29 178.12 1o3o n LYS 222 N 0.07 2.23 -1.03 2.91 4.81 -1.26 -1.95 118.16 123.93 1o3o n LYS 222 Ca 0.00 0.79 -0.06 0.00 -0.87 0.00 0.00 58.31 58.18 1o3o n LYS 222 Cb 0.52 -2.56 -0.02 0.00 0.02 0.00 0.00 35.03 32.99 1o3o n LYS 222 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1o3o n ASN 223 N 0.06 -4.73 -3.73 3.14 5.03 0.15 -4.88 115.26 110.31 1o3o n ASN 223 Ca 0.05 0.14 -0.28 0.00 0.87 0.00 0.00 54.58 55.36 1o3o n ASN 223 Cb 0.40 -3.29 -0.11 0.00 -1.02 0.00 0.00 39.78 35.76 1o3o n ASN 223 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1o3o n LYS 224 N -0.15 1.62 -1.51 3.52 4.76 -0.82 -4.79 118.16 120.78 1o3o n LYS 224 Ca -0.06 -4.26 -0.29 0.00 -2.87 0.00 0.00 58.31 50.84 1o3o n LYS 224 Cb 0.45 -2.15 0.15 0.00 -1.84 0.00 0.00 35.03 31.64 1o3o n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1o3o s PRO 225 N -1.34 0.94 0.52 1.97 0.04 -1.26 -4.31 135.00 131.55 1o3o s PRO 225 Ca 0.29 0.25 -0.17 0.00 0.04 0.00 0.00 61.00 61.41 1o3o s PRO 225 Cb 0.00 -1.82 -0.08 0.00 0.04 0.00 0.00 34.50 32.65 1o3o s PRO 225 CO -0.15 -2.32 0.99 0.20 0.04 0.00 0.00 177.00 175.76 1o3o s GLY 226 N -4.02 2.12 -0.08 0.56 0.00 -1.05 -4.62 107.32 100.24 1o3o s GLY 226 Ca 0.65 0.25 0.04 0.00 0.00 0.00 0.00 44.72 45.66 1o3o s GLY 226 CO 0.54 0.54 -0.19 0.14 0.00 0.00 0.00 173.10 174.12 1o3o s VAL 227 N -2.53 2.55 0.08 1.40 1.01 -0.09 -2.03 120.40 120.79 1o3o s VAL 227 Ca 0.60 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.77 1o3o s VAL 227 Cb -0.11 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1o3o s VAL 227 CO 0.30 0.56 -0.19 -0.31 0.00 0.00 0.00 175.10 175.46 1o3o s TYR 228 N -0.14 1.66 0.16 5.22 2.02 0.03 -1.90 117.35 124.39 1o3o s TYR 228 Ca -0.03 -0.41 -0.30 0.00 -0.37 0.00 0.00 57.07 55.96 1o3o s TYR 228 Cb -0.14 -0.94 -0.08 0.00 -0.40 0.00 0.00 41.96 40.41 1o3o s TYR 228 CO 0.04 0.14 1.21 0.99 -1.57 0.00 0.00 175.55 176.36 1o3o s THR 229 N -1.06 3.64 -0.93 -0.71 2.01 -0.41 -1.34 115.64 116.84 1o3o s THR 229 Ca 0.05 1.33 -0.20 0.00 0.31 0.00 0.00 61.69 63.17 1o3o s THR 229 Cb -0.09 -3.85 0.11 0.00 0.01 0.00 0.00 72.50 68.67 1o3o s THR 229 CO 0.03 0.19 1.19 -0.75 -0.69 0.00 0.00 174.62 174.59 1o3o s LYS 230 N 0.07 3.55 0.41 4.92 2.20 -0.20 -2.49 119.74 128.20 1o3o s LYS 230 Ca 0.54 -1.51 0.12 0.00 -0.36 0.00 0.00 55.97 54.76 1o3o s LYS 230 Cb -0.32 -4.96 0.95 0.00 -1.51 0.00 0.00 37.83 31.98 1o3o s LYS 230 CO 0.35 -1.89 1.95 0.28 -0.36 0.00 0.00 175.35 175.68 1o3o h VAL 231 N 6.08 0.89 -0.20 4.02 2.07 -1.72 -2.46 116.25 124.92 1o3o h VAL 231 Ca 0.13 -0.18 0.06 0.00 0.82 0.00 0.00 66.70 67.53 1o3o h VAL 231 Cb 1.02 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1o3o h VAL 231 CO 1.19 0.09 0.28 0.00 0.02 0.00 0.00 177.57 179.16 1o3o n ASN 233 N -3.56 0.05 -0.18 0.00 3.02 -0.93 -3.67 115.26 109.98 1o3o n ASN 233 Ca 0.02 0.28 0.02 0.00 -0.03 0.00 0.00 54.58 54.87 1o3o n ASN 233 Cb 0.40 -0.40 0.04 0.00 -0.61 0.00 0.00 39.78 39.22 1o3o n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1o3o n TYR 234 N -1.44 0.12 -0.21 3.10 4.01 0.24 -4.78 117.16 118.21 1o3o n TYR 234 Ca 0.09 -0.46 -0.04 0.00 -0.16 0.00 0.00 57.90 57.33 1o3o n TYR 234 Cb 0.32 -0.04 0.14 0.00 -0.31 0.00 0.00 39.34 39.45 1o3o n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1o3o h VAL 235 N 0.59 1.24 -0.49 -0.72 2.07 -1.61 -1.32 116.25 116.01 1o3o h VAL 235 Ca 0.00 -0.76 -0.11 0.00 0.82 0.00 0.00 66.70 66.64 1o3o h VAL 235 Cb 0.53 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1o3o h VAL 235 CO 0.00 0.31 -0.15 0.77 0.02 0.00 0.00 177.57 178.52 1o3o h SER 236 N 0.99 0.94 -0.44 0.57 4.64 -1.88 -0.93 113.55 117.44 1o3o h SER 236 Ca 0.23 -0.32 -0.03 0.00 -0.47 0.00 0.00 61.79 61.20 1o3o h SER 236 Cb 0.21 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 1o3o h SER 236 CO -0.02 1.08 0.17 -0.25 -0.87 0.00 0.00 176.83 176.94 1o3o h TRP 237 N 0.82 0.68 0.07 4.77 7.01 -1.82 -0.01 115.95 127.47 1o3o h TRP 237 Ca 0.12 -0.05 -0.00 0.00 2.11 0.00 0.00 58.89 61.07 1o3o h TRP 237 Cb 0.69 -0.20 0.00 0.00 -2.10 0.00 0.00 29.16 27.55 1o3o h TRP 237 CO 0.04 0.59 -0.04 0.82 -2.79 0.00 0.00 178.44 177.06 1o3o h ILE 238 N 0.57 1.06 -0.73 2.65 2.04 -1.08 0.41 117.51 122.43 1o3o h ILE 238 Ca 0.15 -0.48 0.01 0.00 1.00 0.00 0.00 64.86 65.53 1o3o h ILE 238 Cb 0.20 1.38 -0.04 0.00 -0.74 0.00 0.00 36.82 37.62 1o3o h ILE 238 CO -0.01 0.12 0.48 0.11 0.00 0.00 0.00 178.15 178.85 1o3o h LYS 239 N -0.32 0.95 -0.25 2.37 1.57 -0.95 -0.86 116.57 119.08 1o3o h LYS 239 Ca -0.01 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 1o3o h LYS 239 Cb 0.27 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1o3o h LYS 239 CO 0.02 0.63 -0.01 1.96 -0.57 0.00 0.00 179.45 181.47 1o3o h GLN 240 N 0.98 0.45 -0.32 3.15 4.20 -0.90 -1.54 115.11 121.13 1o3o h GLN 240 Ca 0.27 -0.15 -0.03 0.00 0.06 0.00 0.00 58.65 58.80 1o3o h GLN 240 Cb -0.09 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 1o3o h GLN 240 CO -0.07 0.63 0.09 1.15 -0.67 0.00 0.00 178.83 179.96 1o3o h THR 241 N 0.22 1.21 -0.55 -0.54 2.02 -0.67 -2.10 112.91 112.50 1o3o h THR 241 Ca 0.07 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.54 1o3o h THR 241 Cb 0.44 1.07 -0.03 0.00 -1.74 0.00 0.00 68.15 67.89 1o3o h THR 241 CO 0.02 0.24 0.32 0.40 0.37 0.00 0.00 175.52 176.86 1o3o h ILE 242 N 0.36 1.18 0.00 3.11 2.04 -1.13 -2.15 117.51 120.92 1o3o h ILE 242 Ca 0.10 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 1o3o h ILE 242 Cb 0.27 0.45 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 1o3o h ILE 242 CO -0.00 0.19 -0.03 0.00 0.00 0.00 0.00 178.15 178.31 1o3o h ALA 243 N 1.15 1.75 -0.59 1.87 0.00 -1.07 -2.51 119.26 119.86 1o3o h ALA 243 Ca 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1o3o h ALA 243 Cb 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1o3o h ALA 243 CO -0.03 0.04 0.00 0.43 0.00 0.00 0.00 179.25 179.68 1o3o n SER 244 N -4.21 3.59 0.00 0.00 7.64 -0.81 -5.08 113.62 114.75 1o3o n SER 244 Ca -0.03 -2.00 0.00 0.00 1.01 0.00 0.00 58.87 57.85 1o3o n SER 244 Cb 0.11 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.92 1o3o n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62