#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c2i s VAL 17 N 0.00 4.46 -1.08 1.39 1.01 -0.22 -4.12 120.40 121.85 1c2i s VAL 17 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 1c2i s VAL 17 Cb 0.00 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.44 1c2i s VAL 17 CO 0.00 0.54 0.10 0.61 0.00 0.00 0.00 175.10 176.35 1c2i n GLY 18 N 2.81 -0.14 0.00 4.51 0.00 -1.23 -1.95 105.19 109.19 1c2i n GLY 18 Ca -0.18 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1c2i n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c2i n GLY 19 N -1.07 4.92 3.21 -0.02 0.00 -1.26 -4.83 105.19 106.14 1c2i n GLY 19 Ca -0.13 -2.04 -0.12 0.00 0.00 0.00 0.00 46.02 43.73 1c2i n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1c2i s TYR 20 N 1.46 1.12 -0.05 1.61 -0.85 -0.22 -4.93 117.35 115.49 1c2i s TYR 20 Ca 0.00 -1.23 -0.30 0.00 -0.52 0.00 0.00 57.07 55.02 1c2i s TYR 20 Cb 0.00 -0.61 -0.04 0.00 0.38 0.00 0.00 41.96 41.69 1c2i s TYR 20 CO 0.00 -0.47 1.30 0.99 -1.52 0.00 0.00 175.55 175.85 1c2i s THR 21 N -3.96 4.04 0.07 -3.49 2.01 -1.26 -0.30 115.64 112.75 1c2i s THR 21 Ca 0.31 1.37 -0.25 0.00 0.31 0.00 0.00 61.69 63.42 1c2i s THR 21 Cb 0.07 -3.88 -0.16 0.00 0.01 0.00 0.00 72.50 68.53 1c2i s THR 21 CO 0.07 -0.02 1.63 0.00 -0.69 0.00 0.00 174.62 175.61 1c2i n GLY 23 N -0.97 3.57 3.69 0.00 0.00 -1.26 -4.84 105.19 105.38 1c2i n GLY 23 Ca -0.09 -1.57 -0.44 0.00 0.00 0.00 0.00 46.02 43.92 1c2i n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c2i n ALA 24 N -0.39 1.88 -3.65 4.61 0.00 -1.26 -2.30 120.51 119.39 1c2i n ALA 24 Ca 0.00 0.40 -0.28 0.00 0.00 0.00 0.00 53.44 53.56 1c2i n ALA 24 Cb 0.00 -2.45 0.01 0.00 0.00 0.00 0.00 19.45 17.01 1c2i n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1c2i n ASN 25 N 4.19 -4.37 -0.21 0.00 5.03 -1.26 -4.86 115.26 113.77 1c2i n ASN 25 Ca 0.17 -0.61 0.12 0.00 0.87 0.00 0.00 54.58 55.14 1c2i n ASN 25 Cb 0.32 -3.55 0.25 0.00 -1.02 0.00 0.00 39.78 35.78 1c2i n ASN 25 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1c2i n THR 26 N -4.35 0.00 -3.47 3.41 -2.24 -0.97 -4.26 114.28 102.40 1c2i n THR 26 Ca 0.01 -0.11 -0.27 0.00 -2.27 0.00 0.00 64.05 61.41 1c2i n THR 26 Cb 0.54 0.55 -0.09 0.00 -2.10 0.00 0.00 70.33 69.23 1c2i n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1c2i n VAL 27 N -0.80 1.02 0.41 2.28 0.31 -1.26 -4.99 118.33 115.30 1c2i n VAL 27 Ca 0.10 -4.63 0.10 0.00 -0.01 0.00 0.00 64.34 59.89 1c2i n VAL 27 Cb 0.36 -2.03 0.41 0.00 -0.91 0.00 0.00 33.84 31.67 1c2i n VAL 27 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1c2i n PRO 28 N 1.49 0.11 0.00 5.55 -0.02 -1.26 -1.96 135.00 138.91 1c2i n PRO 28 Ca 0.26 0.37 0.13 0.00 -2.02 0.00 0.00 63.50 62.23 1c2i n PRO 28 Cb 0.43 -1.72 0.27 0.00 -0.02 0.00 0.00 33.50 32.47 1c2i n PRO 28 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 1c2i n TYR 29 N -1.93 0.00 -2.64 6.00 0.18 -1.20 -1.76 117.16 115.81 1c2i n TYR 29 Ca 0.02 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.39 1c2i n TYR 29 Cb 0.19 -0.05 -0.04 0.00 -0.38 0.00 0.00 39.34 39.06 1c2i n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1c2i s GLN 30 N -2.34 4.64 0.22 -3.48 2.00 -0.83 -0.70 119.66 119.17 1c2i s GLN 30 Ca 0.26 1.55 0.11 0.00 -2.00 0.00 0.00 55.36 55.27 1c2i s GLN 30 Cb 0.19 -3.35 -0.05 0.00 0.80 0.00 0.00 33.01 30.60 1c2i s GLN 30 CO 0.47 0.12 -0.20 0.14 -0.50 0.00 0.00 175.29 175.32 1c2i s VAL 31 N 0.11 2.22 -0.11 1.34 -7.23 -0.60 -4.50 120.40 111.63 1c2i s VAL 31 Ca 0.49 -2.17 0.03 0.00 -1.81 0.00 0.00 61.98 58.52 1c2i s VAL 31 Cb -0.25 -2.13 -0.00 0.00 0.56 0.00 0.00 36.38 34.56 1c2i s VAL 31 CO 0.31 -0.32 -0.22 -0.55 -0.31 0.00 0.00 175.10 174.01 1c2i s SER 32 N -3.06 3.24 -0.20 4.85 0.15 -0.46 -2.24 113.70 115.97 1c2i s SER 32 Ca 0.23 -0.53 -0.12 0.00 0.70 0.00 0.00 55.95 56.24 1c2i s SER 32 Cb -0.06 -1.45 -0.05 0.00 -1.71 0.00 0.00 66.02 62.76 1c2i s SER 32 CO 0.11 0.15 0.21 -0.76 1.20 0.00 0.00 173.24 174.15 1c2i s LEU 33 N 0.38 4.18 -0.07 3.45 1.43 0.68 -1.05 118.68 127.68 1c2i s LEU 33 Ca -0.17 0.29 0.04 0.00 -1.03 0.00 0.00 54.13 53.26 1c2i s LEU 33 Cb -0.17 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 43.83 1c2i s LEU 33 CO 0.08 0.09 -0.19 0.21 0.23 0.00 0.00 176.35 176.77 1c2i s ASN 34 N 0.69 2.50 -0.34 2.29 3.84 -0.04 -1.41 114.94 122.47 1c2i s ASN 34 Ca 0.11 -0.43 0.13 0.00 0.21 0.00 0.00 52.86 52.88 1c2i s ASN 34 Cb -0.13 -0.99 0.46 0.00 -0.55 0.00 0.00 41.25 40.04 1c2i s ASN 34 CO 0.03 0.13 1.06 -1.54 -2.79 0.00 0.00 177.10 173.99 1c2i n SER 37 N 3.45 2.97 0.00 -4.21 3.41 -1.26 -1.45 113.62 116.53 1c2i n SER 37 Ca -0.20 -3.04 0.00 0.00 -0.26 0.00 0.00 58.87 55.37 1c2i n SER 37 Cb 0.52 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1c2i n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c2i n GLY 38 N -0.39 1.37 3.55 5.00 0.00 -1.26 -5.00 105.19 108.46 1c2i n GLY 38 Ca 0.23 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.18 1c2i n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1c2i s TYR 39 N -2.17 -0.30 0.03 1.61 1.13 -1.26 -5.14 117.35 111.25 1c2i s TYR 39 Ca 0.00 0.14 -0.30 0.00 -1.41 0.00 0.00 57.07 55.50 1c2i s TYR 39 Cb 0.00 0.55 -0.05 0.00 -1.10 0.00 0.00 41.96 41.36 1c2i s TYR 39 CO 0.00 -0.56 1.17 -1.58 -2.51 0.00 0.00 175.55 172.07 1c2i s HIS 40 N -3.10 3.41 0.00 -3.49 5.65 -1.26 -4.26 115.29 112.25 1c2i s HIS 40 Ca 0.06 1.33 0.00 0.00 0.25 0.00 0.00 55.06 56.71 1c2i s HIS 40 Cb -0.01 -3.38 0.00 0.00 -1.18 0.00 0.00 32.58 28.01 1c2i s HIS 40 CO -0.07 -1.12 0.00 1.97 -0.65 0.00 0.00 174.74 174.87 1c2i n PHE 41 N 4.20 0.00 -3.72 3.88 1.16 -0.50 -4.97 117.46 117.50 1c2i n PHE 41 Ca 0.09 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.58 1c2i n PHE 41 Cb 0.47 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.31 1c2i n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1c2i s GLY 43 N -2.87 2.20 0.17 0.00 0.00 0.34 -0.23 107.32 106.93 1c2i s GLY 43 Ca 0.09 -1.50 -0.23 0.00 0.00 0.00 0.00 44.72 43.08 1c2i s GLY 43 CO -0.02 -1.87 1.03 -0.32 0.00 0.00 0.00 173.10 171.92 1c2i s GLY 44 N -4.39 0.02 -0.02 0.20 0.00 -0.95 -3.65 107.32 98.54 1c2i s GLY 44 Ca 0.41 -0.20 0.05 0.00 0.00 0.00 0.00 44.72 44.98 1c2i s GLY 44 CO 0.26 1.83 -0.16 -0.56 0.00 0.00 0.00 173.10 174.47 1c2i s SER 45 N -3.29 1.89 -0.15 1.64 0.01 -0.25 -1.56 113.70 111.98 1c2i s SER 45 Ca 0.20 -0.29 -0.24 0.00 1.31 0.00 0.00 55.95 56.92 1c2i s SER 45 Cb -0.02 -0.27 -0.02 0.00 0.21 0.00 0.00 66.02 65.91 1c2i s SER 45 CO 0.04 0.18 0.79 -0.22 0.41 0.00 0.00 173.24 174.44 1c2i s LEU 46 N -0.28 4.20 -0.01 2.44 2.96 0.13 -1.40 118.68 126.72 1c2i s LEU 46 Ca 0.04 1.15 0.17 0.00 -0.22 0.00 0.00 54.13 55.27 1c2i s LEU 46 Cb -0.07 -3.17 -0.22 0.00 0.50 0.00 0.00 46.19 43.23 1c2i s LEU 46 CO -0.00 -0.33 0.57 2.30 -1.32 0.00 0.00 176.35 177.57 1c2i n ILE 47 N 4.54 0.00 -3.67 6.68 -5.35 -0.45 -0.90 119.36 120.21 1c2i n ILE 47 Ca 0.03 -0.23 0.01 0.00 -0.27 0.00 0.00 62.75 62.29 1c2i n ILE 47 Cb 0.49 0.63 -0.00 0.00 -1.74 0.00 0.00 39.64 39.02 1c2i n ILE 47 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1c2i s ASN 48 N -3.16 -0.07 0.66 7.28 6.03 -1.22 -4.56 114.94 119.91 1c2i s ASN 48 Ca 0.01 -0.20 0.36 0.00 -1.03 0.00 0.00 52.86 52.00 1c2i s ASN 48 Cb 0.12 0.22 1.95 0.00 -3.03 0.00 0.00 41.25 40.51 1c2i s ASN 48 CO 0.70 -0.41 2.11 0.77 -2.03 0.00 0.00 177.10 178.23 1c2i h SER 49 N 2.00 0.00 -0.01 3.54 4.64 -1.96 -2.86 113.55 118.90 1c2i h SER 49 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1c2i h SER 49 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1c2i h SER 49 CO 0.28 0.00 -0.03 0.00 -0.87 0.00 0.00 176.83 176.21 1c2i n GLN 50 N -3.03 0.50 -4.20 4.77 6.02 -1.26 -0.97 117.38 119.21 1c2i n GLN 50 Ca -0.02 -0.73 -0.17 0.00 -0.01 0.00 0.00 57.00 56.07 1c2i n GLN 50 Cb 0.26 -1.06 -0.13 0.00 1.02 0.00 0.00 30.24 30.33 1c2i n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1c2i s TRP 51 N -0.60 0.87 0.04 1.08 0.52 -1.08 -1.20 118.94 118.57 1c2i s TRP 51 Ca 0.06 -0.35 0.06 0.00 0.02 0.00 0.00 56.10 55.89 1c2i s TRP 51 Cb 0.05 -0.52 -0.02 0.00 -1.15 0.00 0.00 33.47 31.82 1c2i s TRP 51 CO 0.09 -0.02 -0.18 0.08 0.02 0.00 0.00 176.95 176.94 1c2i s VAL 52 N -0.90 1.45 -0.07 4.03 1.01 -0.02 -1.34 120.40 124.56 1c2i s VAL 52 Ca -0.03 -1.11 0.03 0.00 0.00 0.00 0.00 61.98 60.87 1c2i s VAL 52 Cb -0.07 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.01 1c2i s VAL 52 CO 0.01 0.13 -0.16 0.68 0.00 0.00 0.00 175.10 175.76 1c2i s VAL 53 N -0.81 2.89 0.00 2.92 -7.23 -0.49 -0.68 120.40 117.00 1c2i s VAL 53 Ca 0.05 -0.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.46 1c2i s VAL 53 Cb -0.08 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 34.72 1c2i s VAL 53 CO 0.02 0.57 0.00 -0.24 -0.31 0.00 0.00 175.10 175.14 1c2i n SER 54 N 2.72 0.00 -4.89 4.85 2.88 -0.19 -1.09 113.62 117.90 1c2i n SER 54 Ca -0.17 -0.51 -0.34 0.00 -1.33 0.00 0.00 58.87 56.51 1c2i n SER 54 Cb 0.52 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 1c2i n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1c2i s ALA 55 N -1.74 3.87 0.35 -1.46 0.00 -1.26 -1.19 121.76 120.33 1c2i s ALA 55 Ca 0.00 -0.61 0.19 0.00 0.00 0.00 0.00 51.96 51.54 1c2i s ALA 55 Cb 0.00 -2.03 0.99 0.00 0.00 0.00 0.00 23.12 22.08 1c2i s ALA 55 CO 0.00 0.66 1.91 0.00 0.00 0.00 0.00 175.76 178.34 1c2i h ALA 56 N 3.96 1.31 0.00 0.00 0.00 -1.72 -1.56 119.26 121.25 1c2i h ALA 56 Ca -0.50 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.17 1c2i h ALA 56 Cb 1.20 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1c2i h ALA 56 CO 0.66 0.33 0.00 -2.39 0.00 0.00 0.00 179.25 177.85 1c2i n HIS 57 N -3.85 0.00 0.36 0.00 1.44 -1.26 -1.43 115.22 110.48 1c2i n HIS 57 Ca -0.02 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.81 1c2i n HIS 57 Cb 0.35 -0.05 0.22 0.00 0.12 0.00 0.00 29.99 30.63 1c2i n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1c2i s TYR 59 N -1.51 2.79 0.17 0.00 6.14 -0.51 -4.98 117.35 119.45 1c2i s TYR 59 Ca 0.39 0.91 -0.18 0.00 0.64 0.00 0.00 57.07 58.82 1c2i s TYR 59 Cb 0.23 -4.00 0.04 0.00 0.42 0.00 0.00 41.96 38.65 1c2i s TYR 59 CO 0.32 -3.25 0.51 0.15 0.64 0.00 0.00 175.55 173.91 1c2i s LYS 60 N -0.76 1.28 0.04 4.97 1.02 -1.26 -5.14 119.74 119.88 1c2i s LYS 60 Ca 0.60 -0.74 0.00 0.00 0.02 0.00 0.00 55.97 55.85 1c2i s LYS 60 Cb -0.46 0.52 -0.04 0.00 -0.52 0.00 0.00 37.83 37.33 1c2i s LYS 60 CO 0.49 -0.54 0.13 0.45 -0.92 0.00 0.00 175.35 174.97 1c2i s SER 61 N -2.83 5.94 -0.17 2.83 0.15 -1.26 -4.63 113.70 113.73 1c2i s SER 61 Ca 0.06 0.17 -0.00 0.00 0.70 0.00 0.00 55.95 56.88 1c2i s SER 61 Cb -0.00 -1.74 -0.00 0.00 -1.71 0.00 0.00 66.02 62.57 1c2i s SER 61 CO -0.07 0.21 0.14 0.61 1.20 0.00 0.00 173.24 175.33 1c2i n GLY 62 N 0.69 0.33 3.85 9.45 0.00 -1.26 -5.05 105.19 113.21 1c2i n GLY 62 Ca -0.09 -0.39 -0.36 0.00 0.00 0.00 0.00 46.02 45.17 1c2i n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c2i s ILE 63 N -3.05 5.32 -0.06 -0.61 1.01 -1.26 -4.56 121.20 117.98 1c2i s ILE 63 Ca 0.00 0.11 0.06 0.00 0.00 0.00 0.00 60.65 60.81 1c2i s ILE 63 Cb -0.00 -3.32 -0.01 0.00 0.01 0.00 0.00 42.46 39.14 1c2i s ILE 63 CO 0.10 0.59 -0.25 -1.58 0.00 0.00 0.00 174.94 173.81 1c2i s GLN 64 N -1.08 2.61 -0.20 2.79 0.74 -0.53 -2.09 119.66 121.89 1c2i s GLN 64 Ca 0.16 -0.89 -0.11 0.00 0.05 0.00 0.00 55.36 54.57 1c2i s GLN 64 Cb -0.12 -2.16 -0.05 0.00 1.10 0.00 0.00 33.01 31.78 1c2i s GLN 64 CO 0.05 0.34 0.17 0.08 -0.55 0.00 0.00 175.29 175.38 1c2i s VAL 65 N -0.06 5.38 -0.21 1.34 1.01 1.00 -0.86 120.40 128.00 1c2i s VAL 65 Ca -0.06 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.18 1c2i s VAL 65 Cb -0.14 -3.51 0.02 0.00 0.00 0.00 0.00 36.38 32.75 1c2i s VAL 65 CO 0.05 0.41 -0.14 -0.13 0.00 0.00 0.00 175.10 175.28 1c2i s ARG 66 N 0.53 2.91 0.19 2.72 0.52 -0.21 -0.34 118.95 125.26 1c2i s ARG 66 Ca 0.10 -0.90 0.05 0.00 -0.52 0.00 0.00 55.73 54.46 1c2i s ARG 66 Cb -0.12 -2.74 -0.04 0.00 0.52 0.00 0.00 34.95 32.57 1c2i s ARG 66 CO 0.00 -0.29 0.18 -0.51 0.02 0.00 0.00 175.30 174.70 1c2i s LEU 67 N 1.29 3.89 -1.43 2.53 1.02 0.32 -1.36 118.68 124.95 1c2i s LEU 67 Ca 0.02 -0.11 0.00 0.00 0.02 0.00 0.00 54.13 54.06 1c2i s LEU 67 Cb -0.15 -2.48 0.00 0.00 0.02 0.00 0.00 46.19 43.58 1c2i s LEU 67 CO -0.09 0.04 0.00 0.61 0.02 0.00 0.00 176.35 176.92 1c2i n GLY 69 N -0.62 0.44 3.86 -3.19 0.00 -1.26 -1.36 105.19 103.07 1c2i n GLY 69 Ca -0.08 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.35 1c2i n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1c2i s GLU 70 N -4.19 3.93 0.00 1.61 0.41 -1.26 -3.96 118.70 115.23 1c2i s GLU 70 Ca 0.00 0.50 0.00 0.00 -0.41 0.00 0.00 54.97 55.06 1c2i s GLU 70 Cb 0.00 -2.58 0.00 0.00 -1.78 0.00 0.00 34.13 29.77 1c2i s GLU 70 CO 0.00 0.26 0.00 -3.47 -0.49 0.00 0.00 175.26 171.56 1c2i n ASP 71 N -0.12 0.00 -4.63 -0.19 2.03 -1.26 -4.56 116.55 107.81 1c2i n ASP 71 Ca 0.01 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.90 1c2i n ASP 71 Cb 0.53 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.89 1c2i n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1c2i s ASN 72 N 0.01 6.84 0.00 1.67 3.84 -1.25 -3.26 114.94 122.79 1c2i s ASN 72 Ca 0.00 0.94 0.31 0.00 0.21 0.00 0.00 52.86 54.32 1c2i s ASN 72 Cb 0.00 -2.48 1.75 0.00 -0.55 0.00 0.00 41.25 39.97 1c2i s ASN 72 CO 0.00 -0.72 2.16 2.30 -2.79 0.00 0.00 177.10 178.05 1c2i n ILE 73 N 5.61 0.00 0.58 -5.21 -5.35 0.56 -3.11 119.36 112.43 1c2i n ILE 73 Ca 0.08 -0.01 0.07 0.00 -0.27 0.00 0.00 62.75 62.62 1c2i n ILE 73 Cb 0.47 -0.46 0.01 0.00 -1.74 0.00 0.00 39.64 37.92 1c2i n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1c2i n ASN 74 N -1.06 1.55 -4.04 7.28 3.02 -1.26 -4.95 115.26 115.80 1c2i n ASN 74 Ca 0.21 -1.28 -0.25 0.00 -0.03 0.00 0.00 54.58 53.23 1c2i n ASN 74 Cb 0.16 0.38 -0.16 0.00 -0.61 0.00 0.00 39.78 39.55 1c2i n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1c2i s VAL 75 N -1.54 1.17 -0.46 2.41 1.01 -1.18 -5.09 120.40 116.72 1c2i s VAL 75 Ca 0.12 -0.52 -0.28 0.00 0.00 0.00 0.00 61.98 61.30 1c2i s VAL 75 Cb 0.11 -1.06 0.03 0.00 0.00 0.00 0.00 36.38 35.46 1c2i s VAL 75 CO 0.30 0.36 1.07 -0.69 0.00 0.00 0.00 175.10 176.14 1c2i s VAL 76 N 0.54 4.30 -2.52 2.92 1.01 -1.26 -4.70 120.40 120.69 1c2i s VAL 76 Ca -0.13 1.13 0.26 0.00 0.00 0.00 0.00 61.98 63.24 1c2i s VAL 76 Cb -0.15 -4.54 0.32 0.00 0.00 0.00 0.00 36.38 32.00 1c2i s VAL 76 CO 0.03 -0.92 1.47 -0.62 0.00 0.00 0.00 175.10 175.06 1c2i n GLU 77 N 7.58 1.73 0.00 2.72 1.02 -1.26 -4.96 120.64 127.47 1c2i n GLU 77 Ca 0.10 -1.24 0.00 0.00 -0.02 0.00 0.00 57.16 56.00 1c2i n GLU 77 Cb 0.49 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1c2i n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1c2i n GLY 78 N 1.29 2.77 1.68 0.62 0.00 -1.26 -4.94 105.19 105.35 1c2i n GLY 78 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1c2i n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1c2i n ASN 79 N 0.00 4.66 -4.95 1.61 3.02 -1.26 -5.01 115.26 113.33 1c2i n ASN 79 Ca 0.00 -3.17 -0.23 0.00 -0.03 0.00 0.00 54.58 51.15 1c2i n ASN 79 Cb 0.00 -0.68 -0.02 0.00 -0.61 0.00 0.00 39.78 38.47 1c2i n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1c2i s GLU 80 N -2.94 3.47 -0.05 3.52 8.01 -1.25 -4.15 118.70 125.30 1c2i s GLU 80 Ca 0.52 -0.52 -0.01 0.00 0.01 0.00 0.00 54.97 54.97 1c2i s GLU 80 Cb 0.41 -2.78 0.03 0.00 -4.31 0.00 0.00 34.13 27.49 1c2i s GLU 80 CO 0.12 0.29 0.02 -0.65 0.01 0.00 0.00 175.26 175.05 1c2i s GLN 81 N -4.09 0.30 -0.24 1.61 -0.21 -0.46 -4.96 119.66 111.61 1c2i s GLN 81 Ca 0.37 0.18 -0.04 0.00 0.02 0.00 0.00 55.36 55.90 1c2i s GLN 81 Cb -0.09 -0.68 0.00 0.00 1.00 0.00 0.00 33.01 33.24 1c2i s GLN 81 CO 0.32 -0.26 -0.03 -0.06 -2.12 0.00 0.00 175.29 173.14 1c2i s PHE 82 N 1.75 3.01 -0.03 0.91 2.99 -1.26 -0.53 117.98 124.82 1c2i s PHE 82 Ca 0.01 -1.11 0.02 0.00 0.00 0.00 0.00 56.93 55.84 1c2i s PHE 82 Cb -0.13 -2.11 0.01 0.00 0.00 0.00 0.00 43.02 40.80 1c2i s PHE 82 CO -0.03 -0.60 -0.06 0.42 -0.00 0.00 0.00 175.22 174.94 1c2i s ILE 83 N 1.44 0.60 0.59 0.64 1.01 0.54 -4.96 121.20 121.05 1c2i s ILE 83 Ca 0.04 -0.20 -0.14 0.00 0.00 0.00 0.00 60.65 60.34 1c2i s ILE 83 Cb -0.15 -0.58 -0.05 0.00 0.01 0.00 0.00 42.46 41.69 1c2i s ILE 83 CO -0.03 0.22 1.02 -0.44 0.00 0.00 0.00 174.94 175.71 1c2i s SER 84 N 0.60 6.14 0.24 3.58 0.01 -1.26 -0.00 113.70 123.00 1c2i s SER 84 Ca -0.08 1.61 -0.21 0.00 1.31 0.00 0.00 55.95 58.57 1c2i s SER 84 Cb -0.12 -2.50 -0.09 0.00 0.21 0.00 0.00 66.02 63.52 1c2i s SER 84 CO 0.00 -0.93 0.77 0.00 0.41 0.00 0.00 173.24 173.50 1c2i s ALA 85 N -2.77 3.38 -0.18 1.44 0.00 -0.89 -0.69 121.76 122.05 1c2i s ALA 85 Ca 0.59 0.25 0.18 0.00 0.00 0.00 0.00 51.96 52.98 1c2i s ALA 85 Cb -0.12 -2.90 -0.25 0.00 0.00 0.00 0.00 23.12 19.84 1c2i s ALA 85 CO 0.41 0.29 0.16 -1.13 0.00 0.00 0.00 175.76 175.49 1c2i n SER 86 N 0.76 0.08 -3.57 0.00 3.41 0.56 -4.70 113.62 110.16 1c2i n SER 86 Ca -0.02 0.04 -0.17 0.00 -0.26 0.00 0.00 58.87 58.47 1c2i n SER 86 Cb 0.51 0.96 -0.07 0.00 -0.26 0.00 0.00 64.21 65.36 1c2i n SER 86 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1c2i s LYS 87 N -2.57 0.96 0.02 4.33 2.20 -1.24 -5.02 119.74 118.42 1c2i s LYS 87 Ca -0.09 0.33 0.07 0.00 -0.36 0.00 0.00 55.97 55.91 1c2i s LYS 87 Cb 0.07 0.45 -0.02 0.00 -1.51 0.00 0.00 37.83 36.82 1c2i s LYS 87 CO 0.83 -0.27 -0.20 -1.12 -0.36 0.00 0.00 175.35 174.23 1c2i s SER 88 N -0.92 2.39 -0.21 1.43 0.01 -1.26 -0.99 113.70 114.14 1c2i s SER 88 Ca -0.09 -0.44 -0.02 0.00 1.31 0.00 0.00 55.95 56.70 1c2i s SER 88 Cb -0.01 -0.23 0.06 0.00 0.21 0.00 0.00 66.02 66.05 1c2i s SER 88 CO 0.08 0.20 0.02 -0.63 0.41 0.00 0.00 173.24 173.31 1c2i s ILE 89 N -0.64 0.80 0.18 1.44 1.01 0.37 -4.99 121.20 119.38 1c2i s ILE 89 Ca 0.07 -0.78 -0.21 0.00 0.00 0.00 0.00 60.65 59.74 1c2i s ILE 89 Cb -0.08 -1.26 -0.08 0.00 0.01 0.00 0.00 42.46 41.04 1c2i s ILE 89 CO 0.01 -0.21 0.70 -0.69 0.00 0.00 0.00 174.94 174.75 1c2i s VAL 90 N 1.73 4.56 0.19 2.92 1.01 -1.26 -1.18 120.40 128.36 1c2i s VAL 90 Ca -0.02 1.34 -0.32 0.00 0.00 0.00 0.00 61.98 62.98 1c2i s VAL 90 Cb -0.18 -3.92 -0.15 0.00 0.00 0.00 0.00 36.38 32.14 1c2i s VAL 90 CO -0.08 0.33 1.24 1.57 0.00 0.00 0.00 175.10 178.15 1c2i n HIS 91 N 1.06 1.54 -0.08 5.22 -0.00 -0.86 -4.81 115.22 117.29 1c2i n HIS 91 Ca -0.04 0.61 0.25 0.00 0.46 0.00 0.00 57.72 58.99 1c2i n HIS 91 Cb 0.51 -2.33 0.72 0.00 -0.12 0.00 0.00 29.99 28.76 1c2i n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1c2i h PRO 92 N 3.64 0.00 -0.36 1.57 0.13 -1.93 -2.40 132.00 132.65 1c2i h PRO 92 Ca -0.44 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.65 1c2i h PRO 92 Cb 1.32 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.43 1c2i h PRO 92 CO 0.72 0.00 0.02 0.43 -0.23 0.00 0.00 178.00 178.94 1c2i n SER 93 N -4.18 4.04 -4.73 1.44 7.64 -1.26 -5.01 113.62 111.55 1c2i n SER 93 Ca 0.14 -3.12 -0.42 0.00 1.01 0.00 0.00 58.87 56.49 1c2i n SER 93 Cb 0.82 -0.59 -0.03 0.00 -1.01 0.00 0.00 64.21 63.40 1c2i n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1c2i s TYR 94 N -2.89 3.02 -0.32 1.43 6.14 -0.90 -4.67 117.35 119.16 1c2i s TYR 94 Ca 0.45 0.83 -0.01 0.00 0.64 0.00 0.00 57.07 58.98 1c2i s TYR 94 Cb 0.37 -3.88 0.07 0.00 0.42 0.00 0.00 41.96 38.93 1c2i s TYR 94 CO 0.09 -3.07 0.03 1.21 0.64 0.00 0.00 175.55 174.45 1c2i s ASN 95 N 0.73 4.89 0.00 4.32 3.84 -0.83 -4.99 114.94 122.90 1c2i s ASN 95 Ca 0.64 -1.55 0.12 0.00 0.21 0.00 0.00 52.86 52.29 1c2i s ASN 95 Cb -0.43 -1.70 0.51 0.00 -0.55 0.00 0.00 41.25 39.08 1c2i s ASN 95 CO 0.38 -0.32 1.36 -1.54 -2.79 0.00 0.00 177.10 174.19 1c2i n SER 96 N 4.55 0.00 -0.01 -4.21 3.41 -1.26 -0.47 113.62 115.63 1c2i n SER 96 Ca -0.09 0.45 -0.17 0.00 -0.26 0.00 0.00 58.87 58.80 1c2i n SER 96 Cb 0.43 -0.47 -0.14 0.00 -0.26 0.00 0.00 64.21 63.77 1c2i n SER 96 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1c2i n ASN 97 N -1.47 1.69 -0.01 4.04 5.03 -1.26 -4.39 115.26 118.90 1c2i n ASN 97 Ca 0.03 0.25 0.09 0.00 0.87 0.00 0.00 54.58 55.83 1c2i n ASN 97 Cb 0.13 -0.56 -0.13 0.00 -1.02 0.00 0.00 39.78 38.20 1c2i n ASN 97 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1c2i n THR 98 N -3.32 0.00 -1.65 3.41 -2.24 -1.15 -4.98 114.28 104.34 1c2i n THR 98 Ca -0.28 -0.33 -0.10 0.00 -2.27 0.00 0.00 64.05 61.07 1c2i n THR 98 Cb 1.05 0.33 -0.03 0.00 -2.10 0.00 0.00 70.33 69.58 1c2i n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1c2i n LEU 99 N -1.95 -1.03 -4.76 3.22 4.77 0.38 -5.00 117.00 112.64 1c2i n LEU 99 Ca -0.02 0.15 -0.40 0.00 -0.03 0.00 0.00 56.01 55.71 1c2i n LEU 99 Cb 0.43 -1.66 -0.04 0.00 -2.33 0.00 0.00 43.42 39.82 1c2i n LEU 99 CO 0.38 -0.36 0.80 0.21 -1.33 0.00 0.00 177.39 177.09 1c2i s ASN 100 N -2.75 7.25 -0.96 -1.43 2.47 -1.21 -3.19 114.94 115.12 1c2i s ASN 100 Ca 0.00 2.28 -0.03 0.00 0.42 0.00 0.00 52.86 55.53 1c2i s ASN 100 Cb 0.00 -2.63 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 1c2i s ASN 100 CO 0.00 -0.16 0.82 0.59 -3.72 0.00 0.00 177.10 174.63 1c2i n ASN 101 N 1.16 -3.45 -4.33 -4.21 3.02 -1.26 -1.96 115.26 104.23 1c2i n ASN 101 Ca -0.01 -0.44 -0.43 0.00 -0.03 0.00 0.00 54.58 53.67 1c2i n ASN 101 Cb 0.45 -3.99 0.00 0.00 -0.61 0.00 0.00 39.78 35.63 1c2i n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1c2i n ASP 102 N -2.32 4.80 -3.76 6.41 2.03 -1.19 -4.30 116.55 118.21 1c2i n ASP 102 Ca -0.12 -2.93 -0.13 0.00 0.52 0.00 0.00 54.79 52.12 1c2i n ASP 102 Cb 0.59 -1.67 -0.09 0.00 -0.72 0.00 0.00 41.12 39.22 1c2i n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1c2i s ILE 103 N 3.18 0.03 0.02 5.18 2.07 -1.26 -3.97 121.20 126.45 1c2i s ILE 103 Ca 0.49 -0.26 -0.12 0.00 -1.41 0.00 0.00 60.65 59.35 1c2i s ILE 103 Cb 0.05 -0.56 0.01 0.00 0.13 0.00 0.00 42.46 42.09 1c2i s ILE 103 CO 0.02 -0.15 0.24 0.00 -1.91 0.00 0.00 174.94 173.15 1c2i s MET 104 N -0.67 0.69 -0.05 3.50 0.23 -0.33 -2.03 119.30 120.63 1c2i s MET 104 Ca -0.08 -0.46 0.03 0.00 -1.03 0.00 0.00 55.69 54.16 1c2i s MET 104 Cb -0.04 0.29 -0.03 0.00 -1.53 0.00 0.00 34.83 33.53 1c2i s MET 104 CO 0.03 -0.20 -0.14 -0.51 -2.03 0.00 0.00 175.02 172.16 1c2i s LEU 105 N -1.80 2.73 -0.09 0.18 1.43 -0.33 -1.02 118.68 119.79 1c2i s LEU 105 Ca -0.08 -0.20 0.02 0.00 -1.03 0.00 0.00 54.13 52.84 1c2i s LEU 105 Cb -0.03 -1.56 0.01 0.00 0.03 0.00 0.00 46.19 44.65 1c2i s LEU 105 CO -0.01 0.34 -0.15 -0.63 0.23 0.00 0.00 176.35 176.13 1c2i s ILE 106 N -0.68 1.40 -0.10 -0.59 1.01 0.14 -0.47 121.20 121.91 1c2i s ILE 106 Ca 0.10 -0.61 -0.05 0.00 0.00 0.00 0.00 60.65 60.10 1c2i s ILE 106 Cb -0.11 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 1c2i s ILE 106 CO 0.01 0.42 0.10 -0.75 0.00 0.00 0.00 174.94 174.71 1c2i s LYS 107 N 0.80 3.28 0.24 2.79 2.20 -0.17 -0.84 119.74 128.05 1c2i s LYS 107 Ca -0.11 -0.24 -0.13 0.00 -0.36 0.00 0.00 55.97 55.13 1c2i s LYS 107 Cb -0.16 -3.05 -0.08 0.00 -1.51 0.00 0.00 37.83 33.04 1c2i s LYS 107 CO 0.02 0.74 0.63 -0.51 -0.36 0.00 0.00 175.35 175.87 1c2i s LEU 108 N -1.07 4.18 0.27 5.43 1.43 -0.34 -0.33 118.68 128.26 1c2i s LEU 108 Ca 0.16 1.12 0.01 0.00 -1.03 0.00 0.00 54.13 54.38 1c2i s LEU 108 Cb -0.12 -3.73 0.37 0.00 0.03 0.00 0.00 46.19 42.75 1c2i s LEU 108 CO 0.05 -0.07 1.72 0.11 0.23 0.00 0.00 176.35 178.39 1c2i h LYS 109 N 2.73 0.58 -5.44 1.70 1.57 -1.18 -3.41 116.57 113.11 1c2i h LYS 109 Ca -0.48 -0.20 -0.42 0.00 -1.87 0.00 0.00 60.65 57.68 1c2i h LYS 109 Cb 1.18 -0.04 -0.16 0.00 0.08 0.00 0.00 32.23 33.28 1c2i h LYS 109 CO 0.67 0.74 -0.74 -1.12 -0.57 0.00 0.00 179.45 178.43 1c2i s SER 110 N -6.77 2.21 0.35 0.86 0.01 -1.26 -5.01 113.70 104.09 1c2i s SER 110 Ca -0.08 -0.93 -0.25 0.00 1.31 0.00 0.00 55.95 56.00 1c2i s SER 110 Cb 0.14 -0.09 -0.10 0.00 0.21 0.00 0.00 66.02 66.18 1c2i s SER 110 CO 0.80 -0.18 0.96 0.00 0.41 0.00 0.00 173.24 175.22 1c2i s ALA 111 N -2.66 3.17 0.65 1.44 0.00 -1.26 -4.85 121.76 118.24 1c2i s ALA 111 Ca 0.16 0.52 -0.11 0.00 0.00 0.00 0.00 51.96 52.53 1c2i s ALA 111 Cb -0.02 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 19.89 1c2i s ALA 111 CO 0.04 0.13 1.05 0.00 0.00 0.00 0.00 175.76 176.98 1c2i s ALA 112 N -1.72 3.04 -0.24 0.00 0.00 -0.14 -5.01 121.76 117.68 1c2i s ALA 112 Ca 0.53 -0.20 -0.09 0.00 0.00 0.00 0.00 51.96 52.20 1c2i s ALA 112 Cb -0.17 -3.04 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 1c2i s ALA 112 CO 0.22 -0.84 0.12 -1.12 0.00 0.00 0.00 175.76 174.14 1c2i s SER 113 N -4.24 5.77 0.11 0.00 0.01 -1.26 -4.85 113.70 109.23 1c2i s SER 113 Ca 0.56 0.01 -0.21 0.00 1.31 0.00 0.00 55.95 57.62 1c2i s SER 113 Cb -0.11 -2.04 -0.07 0.00 0.21 0.00 0.00 66.02 64.01 1c2i s SER 113 CO 0.53 0.04 0.63 -0.76 0.41 0.00 0.00 173.24 174.09 1c2i s LEU 114 N 1.18 4.54 0.00 2.44 1.43 -1.26 -4.78 118.68 122.23 1c2i s LEU 114 Ca 0.06 1.37 0.00 0.00 -1.03 0.00 0.00 54.13 54.53 1c2i s LEU 114 Cb -0.14 -3.04 0.00 0.00 0.03 0.00 0.00 46.19 43.04 1c2i s LEU 114 CO 0.05 0.25 0.00 -0.46 0.23 0.00 0.00 176.35 176.42 1c2i n ASN 115 N 1.64 0.00 0.14 2.29 0.23 0.23 -4.97 115.26 114.82 1c2i n ASN 115 Ca -0.09 -0.11 -0.00 0.00 -0.53 0.00 0.00 54.58 53.85 1c2i n ASN 115 Cb 0.50 0.00 0.25 0.00 -2.08 0.00 0.00 39.78 38.46 1c2i n ASN 115 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1c2i h SER 116 N 0.00 0.08 1.09 0.53 0.02 -2.00 -3.20 113.55 110.06 1c2i h SER 116 Ca 0.00 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 1c2i h SER 116 Cb 0.00 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.52 1c2i h SER 116 CO 0.00 0.54 -0.92 0.03 -1.14 0.00 0.00 176.83 175.34 1c2i h ARG 117 N 0.06 0.00 -4.27 3.45 3.08 -1.93 -3.44 114.38 111.33 1c2i h ARG 117 Ca 0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 1c2i h ARG 117 Cb 0.85 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 30.52 1c2i h ARG 117 CO 0.06 0.03 -0.78 0.08 -1.07 0.00 0.00 179.97 178.29 1c2i s VAL 118 N -3.31 1.43 0.06 2.04 1.01 -1.21 -4.42 120.40 116.00 1c2i s VAL 118 Ca 0.00 -1.15 -0.00 0.00 0.00 0.00 0.00 61.98 60.83 1c2i s VAL 118 Cb 0.09 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 1c2i s VAL 118 CO 0.78 -0.11 -0.04 0.00 0.00 0.00 0.00 175.10 175.73 1c2i s ALA 119 N 1.44 0.59 0.40 5.51 0.00 -0.72 -0.60 121.76 128.39 1c2i s ALA 119 Ca -0.05 -1.21 0.03 0.00 0.00 0.00 0.00 51.96 50.72 1c2i s ALA 119 Cb -0.19 0.24 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 1c2i s ALA 119 CO -0.06 -0.33 0.59 -1.54 0.00 0.00 0.00 175.76 174.42 1c2i s SER 120 N -2.87 5.90 0.09 0.00 1.04 -1.26 -3.24 113.70 113.35 1c2i s SER 120 Ca 0.07 0.11 0.07 0.00 0.48 0.00 0.00 55.95 56.68 1c2i s SER 120 Cb 0.07 -1.43 -0.04 0.00 0.10 0.00 0.00 66.02 64.71 1c2i s SER 120 CO -0.08 -0.59 -0.14 -0.51 0.98 0.00 0.00 173.24 172.90 1c2i s ILE 121 N -2.40 3.13 0.32 -1.02 1.10 -0.08 -4.88 121.20 117.36 1c2i s ILE 121 Ca 0.47 -1.30 -0.21 0.00 -0.51 0.00 0.00 60.65 59.10 1c2i s ILE 121 Cb -0.10 -2.43 -0.09 0.00 0.15 0.00 0.00 42.46 39.99 1c2i s ILE 121 CO 0.35 0.16 0.84 -0.44 -2.11 0.00 0.00 174.94 173.74 1c2i s SER 122 N -2.02 7.05 0.42 4.50 0.01 -1.26 -4.61 113.70 117.81 1c2i s SER 122 Ca 0.19 1.57 -0.12 0.00 1.31 0.00 0.00 55.95 58.89 1c2i s SER 122 Cb -0.11 -2.48 -0.07 0.00 0.21 0.00 0.00 66.02 63.57 1c2i s SER 122 CO 0.11 -0.13 0.82 -0.76 0.41 0.00 0.00 173.24 173.69 1c2i s LEU 123 N -2.47 3.80 0.58 2.44 1.43 -1.26 -0.87 118.68 122.34 1c2i s LEU 123 Ca 0.51 1.26 -0.15 0.00 -1.03 0.00 0.00 54.13 54.72 1c2i s LEU 123 Cb -0.14 -4.15 -0.04 0.00 0.03 0.00 0.00 46.19 41.89 1c2i s LEU 123 CO 0.19 -0.43 1.04 -2.16 0.23 0.00 0.00 176.35 175.22 1c2i s PRO 124 N -3.82 3.45 -0.10 1.29 0.04 -1.26 -4.79 135.00 129.82 1c2i s PRO 124 Ca 0.53 1.11 0.20 0.00 0.04 0.00 0.00 61.00 62.88 1c2i s PRO 124 Cb -0.10 -2.06 -0.28 0.00 0.04 0.00 0.00 34.50 32.10 1c2i s PRO 124 CO 0.30 -0.69 0.31 0.25 0.04 0.00 0.00 177.00 177.21 1c2i n THR 125 N -2.04 0.76 -4.02 1.26 -2.24 -1.26 -4.97 114.28 101.77 1c2i n THR 125 Ca 0.08 -0.69 -0.10 0.00 -2.27 0.00 0.00 64.05 61.08 1c2i n THR 125 Cb 0.53 -0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.42 1c2i n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1c2i s SER 127 N -5.09 -0.03 0.41 3.42 1.04 -1.26 -5.16 113.70 107.03 1c2i s SER 127 Ca -0.09 -1.00 -0.14 0.00 0.48 0.00 0.00 55.95 55.20 1c2i s SER 127 Cb 0.10 0.53 -0.08 0.00 0.10 0.00 0.00 66.02 66.66 1c2i s SER 127 CO 0.86 -1.05 0.83 0.00 0.98 0.00 0.00 173.24 174.86 1c2i s ALA 129 N -2.28 3.42 0.36 0.00 0.00 -1.26 -5.07 121.76 116.93 1c2i s ALA 129 Ca 0.55 -0.36 -0.13 0.00 0.00 0.00 0.00 51.96 52.01 1c2i s ALA 129 Cb -0.10 -2.59 -0.08 0.00 0.00 0.00 0.00 23.12 20.35 1c2i s ALA 129 CO 0.25 -0.06 0.76 -1.12 0.00 0.00 0.00 175.76 175.59 1c2i s SER 130 N -3.44 6.67 0.41 0.00 0.01 -1.26 -5.01 113.70 111.09 1c2i s SER 130 Ca 0.49 1.24 -0.27 0.00 1.31 0.00 0.00 55.95 58.72 1c2i s SER 130 Cb -0.10 -2.36 -0.10 0.00 0.21 0.00 0.00 66.02 63.67 1c2i s SER 130 CO 0.35 -0.30 1.45 0.00 0.41 0.00 0.00 173.24 175.15 1c2i n ALA 132 N -0.78 2.16 0.00 1.44 0.00 -1.26 -1.25 120.51 120.82 1c2i n ALA 132 Ca 0.03 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1c2i n ALA 132 Cb 0.53 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.59 1c2i n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c2i n GLY 133 N 0.53 3.14 3.77 0.00 0.00 0.48 -4.92 105.19 108.19 1c2i n GLY 133 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1c2i n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c2i s THR 134 N -2.92 2.62 -0.01 2.61 2.01 -0.38 -4.61 115.64 114.96 1c2i s THR 134 Ca 0.00 0.61 -0.18 0.00 0.31 0.00 0.00 61.69 62.43 1c2i s THR 134 Cb 0.00 -3.39 -0.05 0.00 0.01 0.00 0.00 72.50 69.07 1c2i s THR 134 CO 0.00 0.14 0.50 -1.10 -0.69 0.00 0.00 174.62 173.46 1c2i s GLN 135 N -1.61 4.16 0.31 4.92 -1.52 -1.26 -0.93 119.66 123.73 1c2i s GLN 135 Ca 0.51 0.56 0.04 0.00 -1.95 0.00 0.00 55.36 54.52 1c2i s GLN 135 Cb -0.41 -3.30 -0.06 0.00 -0.22 0.00 0.00 33.01 29.02 1c2i s GLN 135 CO 0.53 0.49 0.03 0.00 -0.25 0.00 0.00 175.29 176.08 1c2i s LEU 137 N -3.46 2.25 -0.04 0.00 2.96 0.43 -1.03 118.68 119.78 1c2i s LEU 137 Ca 0.34 -0.53 0.07 0.00 -0.22 0.00 0.00 54.13 53.79 1c2i s LEU 137 Cb 0.07 -1.48 -0.02 0.00 0.50 0.00 0.00 46.19 45.27 1c2i s LEU 137 CO 0.14 0.12 -0.25 -0.63 -1.32 0.00 0.00 176.35 174.41 1c2i s ILE 138 N 0.60 2.12 0.05 6.68 1.01 -0.04 -1.03 121.20 130.59 1c2i s ILE 138 Ca -0.11 -1.06 -0.03 0.00 0.00 0.00 0.00 60.65 59.45 1c2i s ILE 138 Cb -0.16 -1.75 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 1c2i s ILE 138 CO 0.03 0.58 0.03 -0.94 0.00 0.00 0.00 174.94 174.63 1c2i s SER 139 N -0.40 0.36 0.00 3.58 1.04 -1.23 -0.47 113.70 116.59 1c2i s SER 139 Ca 0.04 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.63 1c2i s SER 139 Cb -0.12 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.22 1c2i s SER 139 CO 0.01 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.26 1c2i n GLY 140 N 0.28 0.94 1.46 7.32 0.00 -0.52 -4.47 105.19 110.19 1c2i n GLY 140 Ca -0.16 -1.05 -0.08 0.00 0.00 0.00 0.00 46.02 44.74 1c2i n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1c2i n TRP 141 N -0.64 1.65 -2.12 1.61 8.01 -1.26 -1.91 117.44 122.78 1c2i n TRP 141 Ca 0.00 -1.56 -0.28 0.00 -1.31 0.00 0.00 57.50 54.35 1c2i n TRP 141 Cb 0.00 -0.60 0.17 0.00 -2.01 0.00 0.00 31.31 28.87 1c2i n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1c2i s GLY 142 N -2.07 1.78 0.39 6.99 0.00 -1.25 -4.42 107.32 108.75 1c2i s GLY 142 Ca 0.48 -1.38 -0.24 0.00 0.00 0.00 0.00 44.72 43.58 1c2i s GLY 142 CO 0.04 -0.65 0.86 -2.01 0.00 0.00 0.00 173.10 171.34 1c2i n ASN 143 N -3.52 0.55 -0.43 1.64 5.15 -0.42 -2.86 115.26 115.37 1c2i n ASN 143 Ca 0.15 1.02 0.05 0.00 -0.60 0.00 0.00 54.58 55.20 1c2i n ASN 143 Cb 0.60 -1.26 0.07 0.00 -0.53 0.00 0.00 39.78 38.65 1c2i n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1c2i n THR 144 N -0.49 0.30 -5.00 -0.44 -2.24 -0.24 0.24 114.28 106.40 1c2i n THR 144 Ca 0.10 -0.65 -0.32 0.00 -2.27 0.00 0.00 64.05 60.91 1c2i n THR 144 Cb 0.38 0.99 -0.14 0.00 -2.10 0.00 0.00 70.33 69.45 1c2i n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1c2i s LYS 145 N -0.86 2.62 -0.08 -0.78 -0.14 -1.26 -4.45 119.74 114.80 1c2i s LYS 145 Ca 0.14 -0.77 -0.19 0.00 -1.36 0.00 0.00 55.97 53.79 1c2i s LYS 145 Cb 0.09 -2.34 -0.15 0.00 -1.68 0.00 0.00 37.83 33.75 1c2i s LYS 145 CO 0.12 0.49 0.72 0.66 -0.76 0.00 0.00 175.35 176.58 1c2i h SER 146 N 5.75 -0.12 -2.98 2.83 4.64 -1.94 -3.35 113.55 118.38 1c2i h SER 146 Ca -0.39 -0.43 -0.72 0.00 -0.47 0.00 0.00 61.79 59.77 1c2i h SER 146 Cb 1.16 0.03 -0.34 0.00 -0.31 0.00 0.00 62.40 62.95 1c2i h SER 146 CO 0.50 0.52 0.12 -1.20 -0.87 0.00 0.00 176.83 175.90 1c2i n SER 147 N -4.84 4.91 0.00 4.97 7.64 -1.26 -4.72 113.62 120.32 1c2i n SER 147 Ca -0.07 -3.28 0.00 0.00 1.01 0.00 0.00 58.87 56.53 1c2i n SER 147 Cb 0.27 -1.07 0.00 0.00 -1.01 0.00 0.00 64.21 62.40 1c2i n SER 147 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c2i n GLY 148 N 1.72 -0.14 2.92 0.23 0.00 -1.26 -5.12 105.19 103.55 1c2i n GLY 148 Ca 0.25 -1.36 -0.24 0.00 0.00 0.00 0.00 46.02 44.67 1c2i n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c2i s THR 149 N -1.90 0.87 -0.26 2.61 2.01 -1.26 -4.42 115.64 113.29 1c2i s THR 149 Ca 0.00 -0.26 -0.07 0.00 0.31 0.00 0.00 61.69 61.67 1c2i s THR 149 Cb 0.00 -0.87 0.13 0.00 0.01 0.00 0.00 72.50 71.76 1c2i s THR 149 CO 0.00 0.32 0.55 -0.55 -0.69 0.00 0.00 174.62 174.25 1c2i s SER 150 N 1.22 -0.79 -0.19 3.53 0.15 -1.26 -4.95 113.70 111.41 1c2i s SER 150 Ca -0.05 1.18 -0.07 0.00 0.70 0.00 0.00 55.95 57.71 1c2i s SER 150 Cb -0.14 1.89 -0.04 0.00 -1.71 0.00 0.00 66.02 66.03 1c2i s SER 150 CO -0.02 -0.24 0.05 -0.31 1.20 0.00 0.00 173.24 173.92 1c2i s TYR 151 N 2.78 3.17 0.55 3.44 2.02 -1.26 -1.08 117.35 126.97 1c2i s TYR 151 Ca 0.01 -0.10 -0.09 0.00 -0.37 0.00 0.00 57.07 56.52 1c2i s TYR 151 Cb -0.13 -2.09 -0.04 0.00 -0.40 0.00 0.00 41.96 39.30 1c2i s TYR 151 CO -0.17 0.01 0.93 -1.25 -1.57 0.00 0.00 175.55 173.49 1c2i s PRO 152 N 0.64 3.61 -0.02 -1.71 0.04 -1.26 -5.00 135.00 131.29 1c2i s PRO 152 Ca 0.02 0.55 0.20 0.00 0.04 0.00 0.00 61.00 61.82 1c2i s PRO 152 Cb -0.13 -2.21 -0.30 0.00 0.04 0.00 0.00 34.50 31.90 1c2i s PRO 152 CO 0.02 -0.39 0.50 -0.25 0.04 0.00 0.00 177.00 176.91 1c2i n ASP 153 N -2.41 0.45 -4.67 6.66 8.00 -1.26 -4.90 116.55 118.40 1c2i n ASP 153 Ca 0.04 -0.13 -0.25 0.00 0.71 0.00 0.00 54.79 55.16 1c2i n ASP 153 Cb 0.54 1.80 -0.07 0.00 -0.02 0.00 0.00 41.12 43.37 1c2i n ASP 153 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1c2i s VAL 154 N -3.33 3.70 0.22 2.53 -7.23 -1.26 -0.33 120.40 114.70 1c2i s VAL 154 Ca -0.05 -1.61 -0.30 0.00 -1.81 0.00 0.00 61.98 58.20 1c2i s VAL 154 Cb 0.13 -2.92 -0.10 0.00 0.56 0.00 0.00 36.38 34.05 1c2i s VAL 154 CO 0.84 -0.24 1.44 -0.22 -0.31 0.00 0.00 175.10 176.61 1c2i s LEU 155 N -3.33 4.38 0.11 1.32 2.96 -1.20 -4.81 118.68 118.11 1c2i s LEU 155 Ca 0.30 2.61 0.07 0.00 -0.22 0.00 0.00 54.13 56.88 1c2i s LEU 155 Cb -0.08 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 1c2i s LEU 155 CO 0.20 -0.70 -0.07 -0.54 -1.32 0.00 0.00 176.35 173.92 1c2i s LYS 156 N 0.02 2.25 0.21 1.98 -0.14 -0.80 -1.78 119.74 121.47 1c2i s LYS 156 Ca 0.61 -1.00 0.09 0.00 -1.36 0.00 0.00 55.97 54.32 1c2i s LYS 156 Cb -0.41 -2.36 -0.05 0.00 -1.68 0.00 0.00 37.83 33.33 1c2i s LYS 156 CO 0.40 0.51 -0.18 0.00 -0.76 0.00 0.00 175.35 175.32 1c2i s LEU 158 N -3.07 -0.29 -0.19 0.00 2.96 0.38 -1.06 118.68 117.41 1c2i s LEU 158 Ca 0.22 1.01 -0.09 0.00 -0.22 0.00 0.00 54.13 55.05 1c2i s LEU 158 Cb -0.04 1.54 -0.05 0.00 0.50 0.00 0.00 46.19 48.14 1c2i s LEU 158 CO 0.09 -0.20 0.12 -0.54 -1.32 0.00 0.00 176.35 174.49 1c2i s LYS 159 N 1.53 4.09 -0.02 1.98 1.02 -1.26 -0.86 119.74 126.22 1c2i s LYS 159 Ca -0.09 -0.23 -0.16 0.00 0.02 0.00 0.00 55.97 55.51 1c2i s LYS 159 Cb -0.08 -3.37 0.03 0.00 -0.52 0.00 0.00 37.83 33.89 1c2i s LYS 159 CO -0.14 0.34 0.34 0.00 -0.92 0.00 0.00 175.35 174.97 1c2i s ALA 160 N 0.24 -0.86 0.33 5.17 0.00 -0.20 -4.94 121.76 121.50 1c2i s ALA 160 Ca 0.08 0.42 -0.05 0.00 0.00 0.00 0.00 51.96 52.42 1c2i s ALA 160 Cb -0.11 0.05 -0.05 0.00 0.00 0.00 0.00 23.12 23.01 1c2i s ALA 160 CO -0.01 -0.27 0.60 -1.25 0.00 0.00 0.00 175.76 174.83 1c2i s PRO 161 N -1.27 3.61 0.23 0.00 0.04 -1.26 -0.21 135.00 136.14 1c2i s PRO 161 Ca -0.13 0.01 -0.30 0.00 0.04 0.00 0.00 61.00 60.63 1c2i s PRO 161 Cb -0.05 -2.59 -0.09 0.00 0.04 0.00 0.00 34.50 31.81 1c2i s PRO 161 CO 0.05 0.13 1.02 0.42 0.04 0.00 0.00 177.00 178.66 1c2i s ILE 162 N -2.23 3.89 0.36 0.56 1.01 -0.11 -1.96 121.20 122.73 1c2i s ILE 162 Ca 0.44 1.82 0.04 0.00 0.00 0.00 0.00 60.65 62.95 1c2i s ILE 162 Cb -0.10 -4.16 -0.01 0.00 0.01 0.00 0.00 42.46 38.20 1c2i s ILE 162 CO 0.33 0.40 0.53 -0.76 0.00 0.00 0.00 174.94 175.43 1c2i s LEU 163 N -1.00 3.91 0.63 2.97 1.43 -0.34 -0.39 118.68 125.90 1c2i s LEU 163 Ca 0.44 0.03 -0.17 0.00 -1.03 0.00 0.00 54.13 53.40 1c2i s LEU 163 Cb -0.28 -2.93 -0.01 0.00 0.03 0.00 0.00 46.19 43.00 1c2i s LEU 163 CO 0.35 -0.47 1.16 -0.94 0.23 0.00 0.00 176.35 176.68 1c2i s SER 164 N -4.16 5.08 0.48 2.29 1.04 -1.26 -4.68 113.70 112.49 1c2i s SER 164 Ca 0.45 2.21 0.25 0.00 0.48 0.00 0.00 55.95 59.33 1c2i s SER 164 Cb -0.10 -2.58 1.19 0.00 0.10 0.00 0.00 66.02 64.63 1c2i s SER 164 CO 0.33 -1.66 1.96 0.44 0.98 0.00 0.00 173.24 175.30 1c2i h ASP 165 N 0.45 0.00 -0.49 7.02 3.32 -1.97 -2.44 116.42 122.31 1c2i h ASP 165 Ca -0.49 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.44 1c2i h ASP 165 Cb 1.27 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.81 1c2i h ASP 165 CO 0.54 0.19 -0.16 0.77 -1.72 0.00 0.00 179.24 178.86 1c2i h SER 166 N 0.00 0.99 0.43 6.45 4.64 -1.98 0.11 113.55 124.19 1c2i h SER 166 Ca -0.00 -0.38 -0.14 0.00 -0.47 0.00 0.00 61.79 60.80 1c2i h SER 166 Cb 0.52 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 1c2i h SER 166 CO 0.02 1.14 -0.60 0.77 -0.87 0.00 0.00 176.83 177.29 1c2i h SER 167 N 0.83 0.19 0.20 4.97 4.64 -1.87 -0.60 113.55 121.92 1c2i h SER 167 Ca 0.12 -0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.32 1c2i h SER 167 Cb 0.73 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 1c2i h SER 167 CO 0.06 0.75 -0.10 0.00 -0.87 0.00 0.00 176.83 176.67 1c2i h LYS 169 N -0.52 0.59 0.00 0.00 1.57 -0.72 -2.14 116.57 115.34 1c2i h LYS 169 Ca -0.03 -0.18 -0.05 0.00 -1.87 0.00 0.00 60.65 58.52 1c2i h LYS 169 Cb 0.39 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 1c2i h LYS 169 CO 0.05 0.69 -0.26 0.77 -0.57 0.00 0.00 179.45 180.13 1c2i h SER 170 N 0.54 0.00 0.67 0.86 0.02 -1.09 -2.39 113.55 112.16 1c2i h SER 170 Ca 0.10 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.82 1c2i h SER 170 Cb 0.52 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 1c2i h SER 170 CO 0.03 0.26 -1.05 0.00 -1.14 0.00 0.00 176.83 174.93 1c2i h ALA 171 N 1.74 0.31 -2.29 3.77 0.00 -1.01 -3.39 119.26 118.39 1c2i h ALA 171 Ca -0.00 -0.82 -0.59 0.00 0.00 0.00 0.00 54.91 53.49 1c2i h ALA 171 Cb 0.61 -0.06 -0.40 0.00 0.00 0.00 0.00 17.79 17.94 1c2i h ALA 171 CO 0.03 1.00 -0.82 0.66 0.00 0.00 0.00 179.25 180.12 1c2i n TYR 172 N -3.55 1.58 -1.75 0.00 4.02 -0.85 -4.97 117.16 111.64 1c2i n TYR 172 Ca -0.05 -3.86 -0.42 0.00 -0.01 0.00 0.00 57.90 53.56 1c2i n TYR 172 Cb 0.92 -0.38 -0.02 0.00 -0.02 0.00 0.00 39.34 39.84 1c2i n TYR 172 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 176.86 173.71 1c2i s PRO 173 N -1.52 4.12 -0.52 -0.72 0.02 -0.93 -1.73 135.00 133.72 1c2i s PRO 173 Ca 0.35 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.97 1c2i s PRO 173 Cb 0.11 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.58 1c2i s PRO 173 CO -0.10 -0.71 0.00 0.41 -0.33 0.00 0.00 177.00 176.27 1c2i n GLY 174 N 3.31 0.62 0.00 0.52 0.00 -1.26 -4.83 105.19 103.55 1c2i n GLY 174 Ca 0.13 -0.13 0.02 0.00 0.00 0.00 0.00 46.02 46.03 1c2i n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1c2i n GLN 175 N -1.16 4.98 -3.84 1.61 6.02 -0.70 -5.01 117.38 119.27 1c2i n GLN 175 Ca -0.05 -0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.58 1c2i n GLN 175 Cb 0.37 -0.73 -0.08 0.00 1.02 0.00 0.00 30.24 30.82 1c2i n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1c2i s ILE 176 N -1.48 5.26 0.54 5.09 -1.09 -1.25 -5.03 121.20 123.24 1c2i s ILE 176 Ca 0.01 0.13 0.05 0.00 -2.23 0.00 0.00 60.65 58.61 1c2i s ILE 176 Cb 0.03 -3.37 0.03 0.00 -1.58 0.00 0.00 42.46 37.57 1c2i s ILE 176 CO 0.15 0.49 0.35 0.42 -1.23 0.00 0.00 174.94 175.11 1c2i s THR 177 N 0.03 1.61 -1.29 2.92 -4.23 -1.26 -4.99 115.64 108.43 1c2i s THR 177 Ca 0.09 -1.56 0.14 0.00 -1.18 0.00 0.00 61.69 59.18 1c2i s THR 177 Cb -0.11 -2.17 0.21 0.00 1.34 0.00 0.00 72.50 71.76 1c2i s THR 177 CO -0.00 0.00 1.41 -1.54 -0.54 0.00 0.00 174.62 173.95 1c2i n SER 178 N -1.69 0.00 -1.62 3.99 3.41 -1.26 -2.28 113.62 114.16 1c2i n SER 178 Ca -0.04 0.22 0.09 0.00 -0.26 0.00 0.00 58.87 58.88 1c2i n SER 178 Cb 0.65 -0.36 0.36 0.00 -0.26 0.00 0.00 64.21 64.60 1c2i n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1c2i n ASN 179 N -1.36 4.83 -4.10 4.04 3.02 -1.26 -4.91 115.26 115.53 1c2i n ASN 179 Ca 0.06 -2.48 -0.12 0.00 -0.03 0.00 0.00 54.58 52.01 1c2i n ASN 179 Cb 0.13 -0.59 -0.11 0.00 -0.61 0.00 0.00 39.78 38.60 1c2i n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1c2i s MET 180 N -1.92 0.64 0.08 3.52 -1.94 -0.97 -1.34 119.30 117.37 1c2i s MET 180 Ca 0.51 -0.99 -0.08 0.00 -1.71 0.00 0.00 55.69 53.42 1c2i s MET 180 Cb 0.34 -0.24 -0.00 0.00 2.01 0.00 0.00 34.83 36.94 1c2i s MET 180 CO 0.24 0.02 0.17 -0.59 -0.01 0.00 0.00 175.02 174.85 1c2i s PHE 181 N -2.31 0.16 0.05 -0.03 -0.12 -0.33 -4.77 117.98 110.63 1c2i s PHE 181 Ca -0.01 -0.55 0.04 0.00 -0.05 0.00 0.00 56.93 56.35 1c2i s PHE 181 Cb -0.04 -0.08 -0.04 0.00 -0.63 0.00 0.00 43.02 42.24 1c2i s PHE 181 CO -0.02 -0.51 -0.01 0.00 -0.05 0.00 0.00 175.22 174.63 1c2i s ALA 183 N -1.21 -0.49 0.00 0.00 0.00 -0.95 -1.19 121.76 117.92 1c2i s ALA 183 Ca 0.23 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.39 1c2i s ALA 183 Cb -0.12 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 22.96 1c2i s ALA 183 CO 0.15 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.13 1c2i n GLY 184 N 1.91 0.73 2.81 0.00 0.00 -0.83 -2.80 105.19 107.00 1c2i n GLY 184 Ca -0.19 -1.63 -0.21 0.00 0.00 0.00 0.00 46.02 43.99 1c2i n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1c2i s TYR 184 N -3.73 0.56 0.16 1.61 1.51 -1.26 -4.36 117.35 111.83 1c2i s TYR 184 Ca 0.00 -0.11 0.34 0.00 -1.01 0.00 0.00 57.07 56.29 1c2i s TYR 184 Cb 0.00 -0.65 1.41 0.00 -0.11 0.00 0.00 41.96 42.61 1c2i s TYR 184 CO 0.00 -0.24 2.00 -0.07 -1.11 0.00 0.00 175.55 176.14 1c2i h LEU 185 N 7.79 0.00 -0.80 -1.29 3.38 -1.94 -2.13 115.31 120.31 1c2i h LEU 185 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1c2i h LEU 185 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1c2i h LEU 185 CO 0.36 0.02 0.00 1.05 0.09 0.00 0.00 178.44 179.96 1c2i h GLU 186 N 0.00 0.00 0.00 1.13 4.11 -1.95 0.25 114.58 118.12 1c2i h GLU 186 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1c2i h GLU 186 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1c2i h GLU 186 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.49 1c2i n GLY 187 N 0.38 -2.47 1.70 1.06 0.00 -0.80 -4.37 105.19 100.69 1c2i n GLY 187 Ca 0.02 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.09 1c2i n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c2i n GLY 188 N -0.07 2.28 3.10 -0.02 0.00 -0.25 -4.88 105.19 105.34 1c2i n GLY 188 Ca 0.00 -0.51 -0.27 0.00 0.00 0.00 0.00 46.02 45.24 1c2i n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c2i s LYS 188 N 0.00 2.20 0.06 1.61 1.02 -1.26 -3.55 119.74 119.82 1c2i s LYS 188 Ca 0.00 -0.58 -0.27 0.00 0.02 0.00 0.00 55.97 55.13 1c2i s LYS 188 Cb 0.00 -1.73 0.09 0.00 -0.52 0.00 0.00 37.83 35.67 1c2i s LYS 188 CO 0.00 0.08 1.15 0.34 -0.92 0.00 0.00 175.35 176.00 1c2i s ASP 189 N 0.55 -0.08 0.68 2.83 3.68 -0.82 -4.26 116.67 119.24 1c2i s ASP 189 Ca -0.16 -0.29 0.01 0.00 2.13 0.00 0.00 52.55 54.24 1c2i s ASP 189 Cb -0.17 0.31 0.11 0.00 -1.45 0.00 0.00 42.92 41.72 1c2i s ASP 189 CO 0.06 -0.58 0.94 -0.94 0.13 0.00 0.00 175.17 174.77 1c2i s SER 190 N -3.08 4.56 0.38 -0.34 1.04 -1.26 -1.06 113.70 113.93 1c2i s SER 190 Ca 0.16 -0.41 -0.15 0.00 0.48 0.00 0.00 55.95 56.02 1c2i s SER 190 Cb 0.02 -0.04 0.06 0.00 0.10 0.00 0.00 66.02 66.15 1c2i s SER 190 CO -0.00 -1.71 0.80 0.00 0.98 0.00 0.00 173.24 173.31 1c2i n GLN 192 N -0.55 1.97 0.00 0.00 7.27 -1.26 -0.91 117.38 123.90 1c2i n GLN 192 Ca -0.08 0.70 0.00 0.00 0.07 0.00 0.00 57.00 57.69 1c2i n GLN 192 Cb 0.59 -2.32 0.00 0.00 2.41 0.00 0.00 30.24 30.92 1c2i n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1c2i n GLY 193 N 1.88 2.39 0.13 1.69 0.00 -1.26 -1.30 105.19 108.72 1c2i n GLY 193 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.24 1c2i n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1c2i h ASP 194 N 0.49 0.00 -0.90 1.61 3.45 -1.33 -3.33 116.42 116.41 1c2i h ASP 194 Ca 0.00 -0.04 -0.67 0.00 0.43 0.00 0.00 57.03 56.75 1c2i h ASP 194 Cb 0.00 0.00 0.07 0.00 -0.56 0.00 0.00 39.33 38.84 1c2i h ASP 194 CO 0.00 0.02 -0.16 -1.20 -1.57 0.00 0.00 179.24 176.33 1c2i n SER 195 N -2.67 -0.46 0.00 6.45 7.64 -1.25 -1.36 113.62 121.96 1c2i n SER 195 Ca 0.02 1.04 0.00 0.00 1.01 0.00 0.00 58.87 60.93 1c2i n SER 195 Cb 0.52 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.88 1c2i n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c2i n GLY 196 N 1.54 2.76 3.85 0.23 0.00 -0.37 -0.51 105.19 112.69 1c2i n GLY 196 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 1c2i n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c2i s GLY 197 N -1.72 1.68 0.41 -0.02 0.00 -0.47 -3.48 107.32 103.72 1c2i s GLY 197 Ca 0.00 -0.94 -0.19 0.00 0.00 0.00 0.00 44.72 43.59 1c2i s GLY 197 CO 0.00 -0.25 0.90 2.56 0.00 0.00 0.00 173.10 176.31 1c2i s PRO 198 N -5.66 4.15 -0.24 2.90 0.04 -1.26 -1.47 135.00 133.46 1c2i s PRO 198 Ca 0.69 0.99 -0.02 0.00 0.04 0.00 0.00 61.00 62.70 1c2i s PRO 198 Cb -0.08 -2.24 0.07 0.00 0.04 0.00 0.00 34.50 32.30 1c2i s PRO 198 CO 0.53 -0.00 0.06 0.08 0.04 0.00 0.00 177.00 177.70 1c2i s VAL 199 N -2.17 0.56 -0.15 -0.36 1.01 -0.89 -3.47 120.40 114.94 1c2i s VAL 199 Ca 0.60 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 1c2i s VAL 199 Cb -0.09 -1.20 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 1c2i s VAL 199 CO 0.16 -0.39 -0.10 -0.69 0.00 0.00 0.00 175.10 174.08 1c2i s VAL 200 N 1.82 3.28 -0.06 2.92 1.01 -0.19 -1.04 120.40 128.14 1c2i s VAL 200 Ca 0.03 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.45 1c2i s VAL 200 Cb -0.17 -2.41 0.02 0.00 0.00 0.00 0.00 36.38 33.82 1c2i s VAL 200 CO -0.16 0.50 -0.09 0.00 0.00 0.00 0.00 175.10 175.35 1c2i n SER 202 N 3.85 -4.11 0.00 0.00 7.64 -1.26 -1.96 113.62 117.78 1c2i n SER 202 Ca -0.24 -0.74 0.00 0.00 1.01 0.00 0.00 58.87 58.91 1c2i n SER 202 Cb 0.51 -3.33 0.00 0.00 -1.01 0.00 0.00 64.21 60.38 1c2i n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c2i n GLY 203 N -1.45 0.51 3.30 0.23 0.00 -1.26 -5.03 105.19 101.48 1c2i n GLY 203 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 1c2i n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c2i s LYS 204 N -0.16 1.25 -0.58 1.61 -0.14 -0.83 -4.27 119.74 116.62 1c2i s LYS 204 Ca 0.00 -1.14 -0.28 0.00 -1.36 0.00 0.00 55.97 53.19 1c2i s LYS 204 Cb 0.00 -1.51 0.03 0.00 -1.68 0.00 0.00 37.83 34.67 1c2i s LYS 204 CO 0.00 0.36 1.21 -1.17 -0.76 0.00 0.00 175.35 174.99 1c2i s LEU 209 N -1.75 3.45 -0.05 3.17 2.96 -0.04 -1.41 118.68 125.00 1c2i s LEU 209 Ca 0.08 0.12 0.18 0.00 -0.22 0.00 0.00 54.13 54.29 1c2i s LEU 209 Cb -0.10 -3.17 -0.27 0.00 0.50 0.00 0.00 46.19 43.15 1c2i s LEU 209 CO 0.04 -1.49 0.35 0.00 -1.32 0.00 0.00 176.35 173.92 1c2i n GLN 210 N 8.45 0.66 -4.09 1.98 1.13 -0.20 -4.18 117.38 121.14 1c2i n GLN 210 Ca 0.09 -0.14 -0.10 0.00 -1.94 0.00 0.00 57.00 54.90 1c2i n GLN 210 Cb 0.49 -1.44 -0.08 0.00 0.11 0.00 0.00 30.24 29.32 1c2i n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1c2i s GLY 211 N -4.28 0.94 -0.05 1.08 0.00 -0.83 -2.10 107.32 102.08 1c2i s GLY 211 Ca -0.07 -1.27 0.02 0.00 0.00 0.00 0.00 44.72 43.40 1c2i s GLY 211 CO 0.76 -1.05 -0.08 -0.42 0.00 0.00 0.00 173.10 172.30 1c2i s ILE 212 N -4.07 0.81 -0.03 0.90 1.01 -1.10 -2.08 121.20 116.64 1c2i s ILE 212 Ca 0.28 -0.31 -0.30 0.00 0.00 0.00 0.00 60.65 60.33 1c2i s ILE 212 Cb 0.04 -0.77 -0.08 0.00 0.01 0.00 0.00 42.46 41.67 1c2i s ILE 212 CO 0.08 0.28 1.98 -0.69 0.00 0.00 0.00 174.94 176.58 1c2i s VAL 213 N 0.66 3.09 0.02 2.92 1.01 -0.54 -1.52 120.40 126.03 1c2i s VAL 213 Ca -0.11 0.10 -0.01 0.00 0.00 0.00 0.00 61.98 61.96 1c2i s VAL 213 Cb -0.14 -3.07 -0.00 0.00 0.00 0.00 0.00 36.38 33.16 1c2i s VAL 213 CO 0.02 -0.02 -0.02 -0.24 0.00 0.00 0.00 175.10 174.83 1c2i n SER 214 N 8.33 0.47 -1.61 3.32 2.88 -1.02 -1.24 113.62 124.75 1c2i n SER 214 Ca 0.22 0.06 -0.04 0.00 -1.33 0.00 0.00 58.87 57.78 1c2i n SER 214 Cb 0.42 -0.21 -0.00 0.00 -0.75 0.00 0.00 64.21 63.67 1c2i n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1c2i n TRP 215 N -2.93 -1.08 -1.24 0.66 4.27 -0.77 -4.94 117.44 111.40 1c2i n TRP 215 Ca -0.01 -0.68 0.00 0.00 -3.89 0.00 0.00 57.50 52.92 1c2i n TRP 215 Cb 0.04 0.23 0.00 0.00 -1.36 0.00 0.00 31.31 30.22 1c2i n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1c2i n GLY 216 N -0.18 -1.72 3.29 -1.67 0.00 -1.26 -0.45 105.19 103.20 1c2i n GLY 216 Ca -0.01 -1.10 -0.39 0.00 0.00 0.00 0.00 46.02 44.51 1c2i n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1c2i s SER 217 N -1.43 5.55 0.90 1.61 0.15 -1.26 -4.96 113.70 114.26 1c2i s SER 217 Ca 0.00 -1.31 0.00 0.00 0.70 0.00 0.00 55.95 55.34 1c2i s SER 217 Cb 0.00 -1.96 0.00 0.00 -1.71 0.00 0.00 66.02 62.35 1c2i s SER 217 CO 0.00 -0.44 0.00 0.61 1.20 0.00 0.00 173.24 174.61 1c2i n GLY 219 N 4.89 1.18 2.96 9.45 0.00 -1.26 -4.52 105.19 117.89 1c2i n GLY 219 Ca -0.11 -0.62 -0.13 0.00 0.00 0.00 0.00 46.02 45.17 1c2i n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c2i n ALA 221 N 3.55 -0.78 -2.18 0.00 0.00 -1.26 -4.62 120.51 115.21 1c2i n ALA 221 Ca -0.19 0.15 -0.31 0.00 0.00 0.00 0.00 53.44 53.09 1c2i n ALA 221 Cb 0.56 -2.20 -0.04 0.00 0.00 0.00 0.00 19.45 17.76 1c2i n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1c2i s GLN 221 N -5.23 3.85 0.33 0.00 -0.21 -1.26 -1.09 119.66 116.04 1c2i s GLN 221 Ca 0.08 0.52 -0.29 0.00 0.02 0.00 0.00 55.36 55.70 1c2i s GLN 221 Cb -0.04 -2.42 -0.10 0.00 1.00 0.00 0.00 33.01 31.45 1c2i s GLN 221 CO 0.10 0.04 1.32 0.21 -2.12 0.00 0.00 175.29 174.85 1c2i s LYS 222 N -3.52 4.34 -1.80 2.91 2.20 -1.26 -2.59 119.74 120.02 1c2i s LYS 222 Ca 0.52 2.23 0.00 0.00 -0.36 0.00 0.00 55.97 58.36 1c2i s LYS 222 Cb -0.10 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.15 1c2i s LYS 222 CO 0.26 -0.21 0.00 0.09 -0.36 0.00 0.00 175.35 175.13 1c2i n ASN 223 N 0.87 -4.55 -3.37 1.43 3.02 0.88 -4.91 115.26 108.63 1c2i n ASN 223 Ca 0.00 0.40 -0.26 0.00 -0.03 0.00 0.00 54.58 54.70 1c2i n ASN 223 Cb 0.42 -4.09 -0.08 0.00 -0.61 0.00 0.00 39.78 35.41 1c2i n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1c2i n LYS 224 N -2.18 1.61 -1.03 3.52 4.76 -1.07 -4.74 118.16 119.02 1c2i n LYS 224 Ca -0.17 -4.00 -0.29 0.00 -2.87 0.00 0.00 58.31 50.98 1c2i n LYS 224 Cb 0.57 -1.82 0.18 0.00 -1.84 0.00 0.00 35.03 32.12 1c2i n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1c2i s PRO 225 N -1.71 0.33 0.49 1.97 0.04 -1.26 -4.34 135.00 130.52 1c2i s PRO 225 Ca 0.36 0.68 -0.19 0.00 0.04 0.00 0.00 61.00 61.89 1c2i s PRO 225 Cb 0.13 -1.71 -0.08 0.00 0.04 0.00 0.00 34.50 32.88 1c2i s PRO 225 CO -0.08 -2.84 1.00 0.20 0.04 0.00 0.00 177.00 175.32 1c2i s GLY 226 N -3.23 2.27 -0.10 0.56 0.00 -1.12 -4.57 107.32 101.13 1c2i s GLY 226 Ca 0.66 0.38 0.02 0.00 0.00 0.00 0.00 44.72 45.77 1c2i s GLY 226 CO 0.59 0.67 -0.16 0.14 0.00 0.00 0.00 173.10 174.33 1c2i s VAL 227 N -2.32 2.78 0.11 1.40 1.01 0.41 -2.24 120.40 121.55 1c2i s VAL 227 Ca 0.62 -0.78 0.10 0.00 0.00 0.00 0.00 61.98 61.92 1c2i s VAL 227 Cb -0.12 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 1c2i s VAL 227 CO 0.24 0.55 -0.25 -0.31 0.00 0.00 0.00 175.10 175.33 1c2i s TYR 228 N 0.09 2.11 0.12 5.22 2.02 0.57 -1.84 117.35 125.64 1c2i s TYR 228 Ca -0.07 -0.39 -0.30 0.00 -0.37 0.00 0.00 57.07 55.93 1c2i s TYR 228 Cb -0.15 -1.16 -0.06 0.00 -0.40 0.00 0.00 41.96 40.18 1c2i s TYR 228 CO 0.05 0.27 1.14 0.99 -1.57 0.00 0.00 175.55 176.43 1c2i s THR 229 N -1.07 3.98 -0.96 -0.71 2.01 -0.58 -1.19 115.64 117.13 1c2i s THR 229 Ca 0.11 1.56 -0.20 0.00 0.31 0.00 0.00 61.69 63.47 1c2i s THR 229 Cb -0.10 -4.00 0.11 0.00 0.01 0.00 0.00 72.50 68.52 1c2i s THR 229 CO 0.05 0.20 1.22 -0.75 -0.69 0.00 0.00 174.62 174.64 1c2i s LYS 230 N 0.32 3.60 0.46 4.92 2.20 -0.45 -2.70 119.74 128.08 1c2i s LYS 230 Ca 0.54 -1.60 0.20 0.00 -0.36 0.00 0.00 55.97 54.75 1c2i s LYS 230 Cb -0.29 -5.04 1.19 0.00 -1.51 0.00 0.00 37.83 32.18 1c2i s LYS 230 CO 0.32 -1.89 1.90 0.28 -0.36 0.00 0.00 175.35 175.61 1c2i h VAL 231 N 6.07 0.70 -0.03 4.02 2.07 -1.74 -2.51 116.25 124.84 1c2i h VAL 231 Ca 0.17 -0.10 0.01 0.00 0.82 0.00 0.00 66.70 67.60 1c2i h VAL 231 Cb 1.02 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1c2i h VAL 231 CO 1.19 0.05 0.08 0.00 0.02 0.00 0.00 177.57 178.92 1c2i n ASN 233 N -3.33 0.53 -0.46 0.00 4.13 -0.94 -3.94 115.26 111.24 1c2i n ASN 233 Ca -0.02 0.53 0.05 0.00 1.68 0.00 0.00 54.58 56.81 1c2i n ASN 233 Cb 0.16 -0.65 0.13 0.00 -1.54 0.00 0.00 39.78 37.87 1c2i n ASN 233 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1c2i n TYR 234 N -1.99 0.38 -0.16 3.10 4.01 0.00 -4.76 117.16 117.74 1c2i n TYR 234 Ca 0.06 -0.59 -0.08 0.00 -0.16 0.00 0.00 57.90 57.13 1c2i n TYR 234 Cb 0.40 -0.08 0.01 0.00 -0.31 0.00 0.00 39.34 39.36 1c2i n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1c2i h VAL 235 N 1.31 1.17 -0.50 -0.72 2.07 -1.67 0.47 116.25 118.38 1c2i h VAL 235 Ca 0.00 -0.45 -0.04 0.00 0.82 0.00 0.00 66.70 67.04 1c2i h VAL 235 Cb 0.79 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1c2i h VAL 235 CO 0.03 0.18 0.18 0.77 0.02 0.00 0.00 177.57 178.75 1c2i h SER 236 N 0.63 0.71 -0.54 0.57 4.64 -1.90 0.65 113.55 118.32 1c2i h SER 236 Ca 0.17 -0.19 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1c2i h SER 236 Cb 0.06 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 61.94 1c2i h SER 236 CO -0.03 0.71 0.33 -0.25 -0.87 0.00 0.00 176.83 176.73 1c2i h TRP 237 N 0.67 0.70 0.27 4.77 7.01 -1.83 -0.86 115.95 126.68 1c2i h TRP 237 Ca 0.16 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.15 1c2i h TRP 237 Cb 0.24 -0.23 0.00 0.00 -2.10 0.00 0.00 29.16 27.07 1c2i h TRP 237 CO 0.01 0.47 -0.13 0.82 -2.79 0.00 0.00 178.44 176.82 1c2i h ILE 238 N 0.72 0.77 -0.79 2.65 2.04 -0.43 -0.74 117.51 121.73 1c2i h ILE 238 Ca 0.19 -0.22 0.06 0.00 1.00 0.00 0.00 64.86 65.89 1c2i h ILE 238 Cb -0.04 0.90 -0.06 0.00 -0.74 0.00 0.00 36.82 36.88 1c2i h ILE 238 CO -0.04 0.05 0.48 0.11 0.00 0.00 0.00 178.15 178.75 1c2i h LYS 239 N -0.47 0.85 -0.46 2.37 1.57 -0.76 -0.29 116.57 119.38 1c2i h LYS 239 Ca -0.04 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.56 1c2i h LYS 239 Cb 0.35 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1c2i h LYS 239 CO 0.06 0.56 -0.25 0.37 -0.57 0.00 0.00 179.45 179.62 1c2i h GLN 240 N 0.87 0.97 -0.13 3.15 4.15 -1.09 -2.72 115.11 120.31 1c2i h GLN 240 Ca 0.35 -0.43 -0.07 0.00 0.77 0.00 0.00 58.65 59.27 1c2i h GLN 240 Cb 0.17 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 27.84 1c2i h GLN 240 CO -0.17 1.10 -0.18 1.15 -1.93 0.00 0.00 178.83 178.79 1c2i h THR 241 N 0.83 1.36 -0.06 2.39 2.02 -0.68 -2.72 112.91 116.06 1c2i h THR 241 Ca 0.10 -1.40 -0.08 0.00 0.77 0.00 0.00 66.41 65.80 1c2i h THR 241 Cb 0.83 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 69.20 1c2i h THR 241 CO 0.07 0.41 -0.32 0.16 0.37 0.00 0.00 175.52 176.21 1c2i h ILE 242 N -0.04 1.25 0.00 3.11 3.07 -1.08 -2.33 117.51 121.49 1c2i h ILE 242 Ca 0.01 -1.20 -0.05 0.00 1.55 0.00 0.00 64.86 65.17 1c2i h ILE 242 Cb 0.74 1.57 -0.01 0.00 -0.27 0.00 0.00 36.82 38.85 1c2i h ILE 242 CO 0.04 0.35 -0.23 0.00 -1.05 0.00 0.00 178.15 177.27 1c2i h ALA 243 N 1.57 1.01 -0.72 0.16 0.00 -1.48 -2.94 119.26 116.86 1c2i h ALA 243 Ca 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1c2i h ALA 243 Cb 0.62 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1c2i h ALA 243 CO 0.05 0.28 0.00 0.43 0.00 0.00 0.00 179.25 180.01 1c2i n SER 244 N -3.38 3.92 0.00 0.00 7.64 -0.91 -5.11 113.62 115.79 1c2i n SER 244 Ca 0.00 -2.00 0.00 0.00 1.01 0.00 0.00 58.87 57.88 1c2i n SER 244 Cb 0.44 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1c2i n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62