#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h9i s VAL 17 N 0.00 5.27 -0.41 1.39 1.01 0.31 -4.15 120.40 123.81 1h9i s VAL 17 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 61.98 62.65 1h9i s VAL 17 Cb 0.00 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.69 1h9i s VAL 17 CO 0.00 0.38 0.00 0.61 0.00 0.00 0.00 175.10 176.09 1h9i n GLY 18 N 3.31 0.67 0.00 4.51 0.00 -1.25 -1.25 105.19 111.18 1h9i n GLY 18 Ca -0.11 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1h9i n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h9i n GLY 19 N -2.47 2.96 3.13 -0.02 0.00 -1.26 -4.90 105.19 102.64 1h9i n GLY 19 Ca -0.04 -1.94 -0.09 0.00 0.00 0.00 0.00 46.02 43.95 1h9i n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1h9i s TYR 20 N 2.38 0.72 0.02 1.61 1.13 -0.24 -4.95 117.35 118.03 1h9i s TYR 20 Ca 0.00 -1.01 -0.30 0.00 -1.41 0.00 0.00 57.07 54.34 1h9i s TYR 20 Cb 0.00 -0.46 -0.06 0.00 -1.10 0.00 0.00 41.96 40.34 1h9i s TYR 20 CO 0.00 -0.29 1.47 0.99 -2.51 0.00 0.00 175.55 175.22 1h9i s THR 21 N -3.79 3.50 0.66 -3.49 2.01 -1.26 -0.40 115.64 112.88 1h9i s THR 21 Ca 0.11 0.91 -0.16 0.00 0.31 0.00 0.00 61.69 62.87 1h9i s THR 21 Cb 0.07 -3.59 0.00 0.00 0.01 0.00 0.00 72.50 68.99 1h9i s THR 21 CO -0.07 -0.00 1.14 0.00 -0.69 0.00 0.00 174.62 175.00 1h9i s ALA 23 N -2.17 3.57 0.11 0.00 0.00 -1.26 -4.86 121.76 117.16 1h9i s ALA 23 Ca 0.70 1.53 -0.35 0.00 0.00 0.00 0.00 51.96 53.84 1h9i s ALA 23 Cb -0.23 -3.59 -0.15 0.00 0.00 0.00 0.00 23.12 19.14 1h9i s ALA 23 CO 0.41 -1.00 1.49 0.00 0.00 0.00 0.00 175.76 176.66 1h9i n ALA 24 N 0.59 0.34 -1.77 0.00 0.00 -1.26 -1.41 120.51 117.01 1h9i n ALA 24 Ca 0.01 0.47 -0.19 0.00 0.00 0.00 0.00 53.44 53.73 1h9i n ALA 24 Cb 0.39 -2.24 -0.06 0.00 0.00 0.00 0.00 19.45 17.54 1h9i n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1h9i n ASN 25 N 3.20 -5.18 -0.19 0.00 4.13 -1.26 -4.85 115.26 111.10 1h9i n ASN 25 Ca 0.18 0.36 0.14 0.00 1.68 0.00 0.00 54.58 56.94 1h9i n ASN 25 Cb 0.24 -4.54 0.53 0.00 -1.54 0.00 0.00 39.78 34.47 1h9i n ASN 25 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1h9i n SER 26 N -1.39 0.74 -3.54 6.41 3.41 -0.50 -4.21 113.62 114.54 1h9i n SER 26 Ca -0.20 -0.77 -0.27 0.00 -0.26 0.00 0.00 58.87 57.37 1h9i n SER 26 Cb 0.64 0.01 -0.09 0.00 -0.26 0.00 0.00 64.21 64.51 1h9i n SER 26 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1h9i n ILE 27 N -0.76 2.08 0.54 -1.33 2.08 -1.26 -4.97 119.36 115.73 1h9i n ILE 27 Ca 0.14 -5.09 0.10 0.00 0.56 0.00 0.00 62.75 58.46 1h9i n ILE 27 Cb 0.30 -2.11 0.41 0.00 -0.75 0.00 0.00 39.64 37.49 1h9i n ILE 27 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 1h9i n PRO 28 N 1.16 0.07 0.00 0.38 -0.04 -1.26 -1.68 135.00 133.63 1h9i n PRO 28 Ca 0.27 0.27 0.12 0.00 -0.04 0.00 0.00 63.50 64.12 1h9i n PRO 28 Cb 0.40 -1.63 0.25 0.00 -0.04 0.00 0.00 33.50 32.48 1h9i n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1h9i n TYR 29 N -1.76 0.00 -2.31 0.54 0.18 -1.20 -2.16 117.16 110.45 1h9i n TYR 29 Ca 0.04 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.40 1h9i n TYR 29 Cb 0.22 -0.15 -0.03 0.00 -0.38 0.00 0.00 39.34 39.00 1h9i n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1h9i s GLN 30 N -2.75 4.40 0.26 -3.48 2.00 -0.68 -0.69 119.66 118.73 1h9i s GLN 30 Ca 0.17 1.92 0.10 0.00 -2.00 0.00 0.00 55.36 55.55 1h9i s GLN 30 Cb 0.18 -3.28 -0.05 0.00 0.80 0.00 0.00 33.01 30.66 1h9i s GLN 30 CO 0.63 -0.30 -0.17 0.14 -0.50 0.00 0.00 175.29 175.09 1h9i s VAL 31 N 0.84 2.20 -0.13 1.34 -7.23 -0.51 -4.38 120.40 112.54 1h9i s VAL 31 Ca 0.60 -2.32 -0.02 0.00 -1.81 0.00 0.00 61.98 58.43 1h9i s VAL 31 Cb -0.33 -2.26 -0.03 0.00 0.56 0.00 0.00 36.38 34.32 1h9i s VAL 31 CO 0.31 -0.44 -0.07 -0.55 -0.31 0.00 0.00 175.10 174.05 1h9i s SER 32 N -3.46 4.59 -0.14 4.85 0.15 -0.53 -2.19 113.70 116.97 1h9i s SER 32 Ca 0.28 -0.14 -0.16 0.00 0.70 0.00 0.00 55.95 56.62 1h9i s SER 32 Cb -0.03 -1.59 -0.04 0.00 -1.71 0.00 0.00 66.02 62.65 1h9i s SER 32 CO 0.13 0.22 0.40 -0.76 1.20 0.00 0.00 173.24 174.42 1h9i s LEU 33 N 0.06 4.25 -0.06 3.45 1.43 0.40 -0.96 118.68 127.26 1h9i s LEU 33 Ca -0.01 0.67 0.02 0.00 -1.03 0.00 0.00 54.13 53.78 1h9i s LEU 33 Cb -0.14 -2.55 0.01 0.00 0.03 0.00 0.00 46.19 43.54 1h9i s LEU 33 CO 0.03 0.03 -0.12 0.21 0.23 0.00 0.00 176.35 176.73 1h9i s ASN 34 N 0.60 1.74 -0.49 2.29 3.84 0.53 -2.00 114.94 121.45 1h9i s ASN 34 Ca 0.22 -0.29 0.08 0.00 0.21 0.00 0.00 52.86 53.07 1h9i s ASN 34 Cb -0.14 -0.74 0.30 0.00 -0.55 0.00 0.00 41.25 40.12 1h9i s ASN 34 CO 0.07 0.05 0.74 -1.54 -2.79 0.00 0.00 177.10 173.63 1h9i n SER 37 N 3.69 2.30 0.00 -4.21 3.41 -1.26 -0.65 113.62 116.90 1h9i n SER 37 Ca -0.22 -3.21 0.00 0.00 -0.26 0.00 0.00 58.87 55.18 1h9i n SER 37 Cb 0.52 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 1h9i n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1h9i n GLY 38 N 0.56 3.02 3.64 5.00 0.00 -1.26 -4.95 105.19 111.21 1h9i n GLY 38 Ca 0.27 -0.59 -0.09 0.00 0.00 0.00 0.00 46.02 45.61 1h9i n GLY 38 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h9i s SER 39 N 0.29 -0.26 0.27 1.61 1.04 -1.26 -5.14 113.70 110.25 1h9i s SER 39 Ca 0.00 -0.56 -0.31 0.00 0.48 0.00 0.00 55.95 55.56 1h9i s SER 39 Cb 0.00 0.63 -0.12 0.00 0.10 0.00 0.00 66.02 66.64 1h9i s SER 39 CO 0.00 -1.16 1.65 -2.28 0.98 0.00 0.00 173.24 172.43 1h9i s HIS 40 N -3.90 2.79 0.00 5.02 2.46 -1.26 -4.46 115.29 115.93 1h9i s HIS 40 Ca 0.11 0.60 0.00 0.00 0.47 0.00 0.00 55.06 56.24 1h9i s HIS 40 Cb -0.03 -4.12 0.00 0.00 -0.13 0.00 0.00 32.58 28.31 1h9i s HIS 40 CO 0.02 -3.94 0.00 1.97 -2.47 0.00 0.00 174.74 170.32 1h9i n PHE 41 N 2.83 0.00 -3.73 3.88 -1.74 -0.85 -4.96 117.46 112.90 1h9i n PHE 41 Ca 0.11 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.90 1h9i n PHE 41 Cb 0.36 0.00 -0.05 0.00 1.52 0.00 0.00 39.48 41.31 1h9i n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1h9i n GLY 43 N -0.18 1.34 3.83 0.00 0.00 0.12 -0.45 105.19 109.85 1h9i n GLY 43 Ca -0.15 -2.11 -0.03 0.00 0.00 0.00 0.00 46.02 43.74 1h9i n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h9i s GLY 44 N -4.08 -0.02 -0.05 -0.02 0.00 -0.93 -3.79 107.32 98.42 1h9i s GLY 44 Ca 0.45 -0.14 0.02 0.00 0.00 0.00 0.00 44.72 45.05 1h9i s GLY 44 CO 0.29 1.65 -0.10 -0.56 0.00 0.00 0.00 173.10 174.38 1h9i s SER 45 N -3.26 1.52 -0.32 1.64 0.01 -0.55 -1.42 113.70 111.33 1h9i s SER 45 Ca 0.19 -0.25 -0.27 0.00 1.31 0.00 0.00 55.95 56.93 1h9i s SER 45 Cb -0.02 -0.66 0.01 0.00 0.21 0.00 0.00 66.02 65.56 1h9i s SER 45 CO 0.04 0.02 0.99 -0.22 0.41 0.00 0.00 173.24 174.48 1h9i s LEU 46 N 0.62 3.99 0.00 2.44 2.96 0.14 -1.39 118.68 127.44 1h9i s LEU 46 Ca -0.12 0.93 0.11 0.00 -0.22 0.00 0.00 54.13 54.82 1h9i s LEU 46 Cb -0.14 -3.40 0.01 0.00 0.50 0.00 0.00 46.19 43.16 1h9i s LEU 46 CO 0.02 -0.80 0.67 2.30 -1.32 0.00 0.00 176.35 177.23 1h9i n ILE 47 N 5.76 0.00 -3.51 6.68 -5.35 -0.74 -1.25 119.36 120.96 1h9i n ILE 47 Ca 0.09 -0.41 -0.12 0.00 -0.27 0.00 0.00 62.75 62.05 1h9i n ILE 47 Cb 0.47 1.14 -0.03 0.00 -1.74 0.00 0.00 39.64 39.48 1h9i n ILE 47 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1h9i s ASN 48 N -1.33 -0.45 0.63 7.28 3.84 -1.07 -4.72 114.94 119.13 1h9i s ASN 48 Ca 0.09 -0.06 0.34 0.00 0.21 0.00 0.00 52.86 53.44 1h9i s ASN 48 Cb 0.08 0.55 1.92 0.00 -0.55 0.00 0.00 41.25 43.25 1h9i s ASN 48 CO 0.25 -0.89 2.17 0.77 -2.79 0.00 0.00 177.10 176.60 1h9i h SER 49 N 2.23 0.00 -0.07 -4.21 4.64 -1.94 -2.78 113.55 111.41 1h9i h SER 49 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1h9i h SER 49 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1h9i h SER 49 CO 0.41 0.00 0.00 1.67 -0.87 0.00 0.00 176.83 178.04 1h9i n GLN 50 N -3.39 1.37 -4.06 4.77 7.27 -1.26 -0.40 117.38 121.68 1h9i n GLN 50 Ca -0.01 -1.26 -0.17 0.00 0.07 0.00 0.00 57.00 55.63 1h9i n GLN 50 Cb 0.23 -1.09 -0.15 0.00 2.41 0.00 0.00 30.24 31.64 1h9i n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1h9i s TRP 51 N -0.70 0.44 0.05 3.69 0.52 -1.05 -0.61 118.94 121.28 1h9i s TRP 51 Ca 0.07 -0.07 0.08 0.00 0.02 0.00 0.00 56.10 56.20 1h9i s TRP 51 Cb 0.04 -0.39 -0.03 0.00 -1.15 0.00 0.00 33.47 31.94 1h9i s TRP 51 CO 0.06 -0.08 -0.23 0.08 0.02 0.00 0.00 176.95 176.79 1h9i s VAL 52 N 0.48 2.40 0.01 4.03 1.01 -0.25 -1.80 120.40 126.28 1h9i s VAL 52 Ca -0.05 -1.32 0.07 0.00 0.00 0.00 0.00 61.98 60.68 1h9i s VAL 52 Cb -0.08 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 1h9i s VAL 52 CO -0.01 0.35 -0.21 0.54 0.00 0.00 0.00 175.10 175.77 1h9i s VAL 53 N -0.86 2.50 0.01 2.92 0.11 -0.49 -0.85 120.40 123.74 1h9i s VAL 53 Ca 0.13 -1.12 -0.00 0.00 -2.93 0.00 0.00 61.98 58.06 1h9i s VAL 53 Cb -0.10 -1.97 0.00 0.00 -1.53 0.00 0.00 36.38 32.78 1h9i s VAL 53 CO 0.03 0.46 0.02 -0.24 -3.33 0.00 0.00 175.10 172.04 1h9i n SER 54 N 1.99 -0.05 -4.77 3.54 2.88 -0.23 -1.48 113.62 115.50 1h9i n SER 54 Ca -0.16 -1.06 -0.40 0.00 -1.33 0.00 0.00 58.87 55.92 1h9i n SER 54 Cb 0.52 0.09 -0.06 0.00 -0.75 0.00 0.00 64.21 64.01 1h9i n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h9i s ALA 55 N -1.51 3.42 0.45 -1.46 0.00 -1.26 -0.98 121.76 120.41 1h9i s ALA 55 Ca 0.01 0.41 0.14 0.00 0.00 0.00 0.00 51.96 52.52 1h9i s ALA 55 Cb -0.00 -3.02 1.03 0.00 0.00 0.00 0.00 23.12 21.13 1h9i s ALA 55 CO 0.01 0.25 2.02 0.00 0.00 0.00 0.00 175.76 178.04 1h9i h ALA 56 N 4.42 1.74 0.00 0.00 0.00 -1.70 -1.51 119.26 122.21 1h9i h ALA 56 Ca -0.46 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1h9i h ALA 56 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1h9i h ALA 56 CO 0.67 0.19 0.00 -2.39 0.00 0.00 0.00 179.25 177.72 1h9i n HIS 57 N -4.37 0.00 1.65 0.00 1.44 -1.26 -1.63 115.22 111.04 1h9i n HIS 57 Ca -0.02 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.77 1h9i n HIS 57 Cb 0.20 -0.41 0.36 0.00 0.12 0.00 0.00 29.99 30.27 1h9i n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1h9i s TYR 59 N -1.89 2.72 0.06 0.00 5.04 -0.65 -5.01 117.35 117.62 1h9i s TYR 59 Ca 0.24 1.02 -0.06 0.00 -2.44 0.00 0.00 57.07 55.82 1h9i s TYR 59 Cb 0.12 -4.00 -0.01 0.00 0.35 0.00 0.00 41.96 38.42 1h9i s TYR 59 CO 0.19 -3.13 0.12 0.15 -1.34 0.00 0.00 175.55 171.53 1h9i s LYS 60 N -1.29 0.69 0.25 4.97 1.02 -1.26 -5.06 119.74 119.06 1h9i s LYS 60 Ca 0.57 -0.87 0.26 0.00 0.02 0.00 0.00 55.97 55.95 1h9i s LYS 60 Cb -0.46 0.27 0.80 0.00 -0.52 0.00 0.00 37.83 37.92 1h9i s LYS 60 CO 0.55 -0.19 1.75 0.66 -0.92 0.00 0.00 175.35 177.21 1h9i h SER 61 N 3.27 0.00 -3.61 2.83 4.64 -2.00 -3.42 113.55 115.26 1h9i h SER 61 Ca -0.33 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.63 1h9i h SER 61 Cb 1.18 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.95 1h9i h SER 61 CO 0.54 0.00 -0.76 -0.60 -0.87 0.00 0.00 176.83 175.14 1h9i s ARG 62 N -3.16 0.53 -0.08 4.77 3.52 -1.26 -5.02 118.95 118.25 1h9i s ARG 62 Ca 0.09 -0.07 -0.05 0.00 -0.13 0.00 0.00 55.73 55.57 1h9i s ARG 62 Cb 0.11 -0.58 0.03 0.00 -1.56 0.00 0.00 34.95 32.95 1h9i s ARG 62 CO 0.57 -0.03 0.18 0.42 -0.81 0.00 0.00 175.30 175.63 1h9i s ILE 63 N 0.61 -0.03 -0.24 4.11 1.01 -1.26 -4.82 121.20 120.57 1h9i s ILE 63 Ca -0.07 0.10 -0.11 0.00 0.00 0.00 0.00 60.65 60.57 1h9i s ILE 63 Cb -0.10 -0.28 -0.05 0.00 0.01 0.00 0.00 42.46 42.04 1h9i s ILE 63 CO -0.00 0.04 0.21 -1.58 0.00 0.00 0.00 174.94 173.60 1h9i s GLN 64 N 0.77 4.07 -0.17 2.79 0.74 0.18 -1.40 119.66 126.64 1h9i s GLN 64 Ca -0.06 -0.20 -0.17 0.00 0.05 0.00 0.00 55.36 54.99 1h9i s GLN 64 Cb -0.07 -3.56 -0.04 0.00 1.10 0.00 0.00 33.01 30.44 1h9i s GLN 64 CO -0.04 0.00 0.44 0.08 -0.55 0.00 0.00 175.29 175.22 1h9i s VAL 65 N 1.23 5.19 -0.27 1.34 1.01 -0.03 -0.35 120.40 128.52 1h9i s VAL 65 Ca 0.09 0.83 -0.03 0.00 0.00 0.00 0.00 61.98 62.87 1h9i s VAL 65 Cb -0.14 -3.77 0.02 0.00 0.00 0.00 0.00 36.38 32.49 1h9i s VAL 65 CO 0.06 0.28 -0.01 -0.13 0.00 0.00 0.00 175.10 175.30 1h9i s ARG 66 N 1.05 2.90 0.23 2.72 0.52 -0.13 -1.04 118.95 125.20 1h9i s ARG 66 Ca 0.22 -0.95 0.06 0.00 -0.52 0.00 0.00 55.73 54.53 1h9i s ARG 66 Cb -0.15 -3.13 -0.03 0.00 0.52 0.00 0.00 34.95 32.16 1h9i s ARG 66 CO 0.09 -0.43 0.27 -0.51 0.02 0.00 0.00 175.30 174.74 1h9i s LEU 67 N 1.38 4.07 -0.90 2.53 1.43 0.09 -1.45 118.68 125.82 1h9i s LEU 67 Ca 0.01 -0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.03 1h9i s LEU 67 Cb -0.17 -2.61 0.00 0.00 0.03 0.00 0.00 46.19 43.44 1h9i s LEU 67 CO -0.02 -0.04 0.00 0.61 0.23 0.00 0.00 176.35 177.13 1h9i n GLY 69 N -1.18 1.04 3.84 -3.19 0.00 -1.26 -1.23 105.19 103.20 1h9i n GLY 69 Ca -0.08 -0.64 -0.33 0.00 0.00 0.00 0.00 46.02 44.96 1h9i n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h9i s GLU 70 N -2.71 4.06 0.12 1.61 0.41 -1.26 -3.96 118.70 116.97 1h9i s GLU 70 Ca 0.00 0.74 0.00 0.00 -0.41 0.00 0.00 54.97 55.30 1h9i s GLU 70 Cb 0.00 -2.49 0.00 0.00 -1.78 0.00 0.00 34.13 29.86 1h9i s GLU 70 CO 0.00 0.18 0.00 1.58 -0.49 0.00 0.00 175.26 176.53 1h9i n HIS 71 N -0.20 -0.94 -3.11 1.61 -0.00 -1.26 -4.68 115.22 106.64 1h9i n HIS 71 Ca 0.03 0.17 -0.43 0.00 -0.00 0.00 0.00 57.72 57.48 1h9i n HIS 71 Cb 0.53 0.36 -0.06 0.00 -0.00 0.00 0.00 29.99 30.81 1h9i n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1h9i s ASN 72 N -4.89 6.28 0.00 0.26 3.84 -1.26 -2.39 114.94 116.79 1h9i s ASN 72 Ca 0.00 -0.54 0.23 0.00 0.21 0.00 0.00 52.86 52.75 1h9i s ASN 72 Cb 0.00 -2.31 0.98 0.00 -0.55 0.00 0.00 41.25 39.37 1h9i s ASN 72 CO 0.00 -0.84 1.73 2.30 -2.79 0.00 0.00 177.10 177.50 1h9i n ILE 73 N 5.78 0.43 0.46 -5.21 -5.35 -0.05 -2.64 119.36 112.79 1h9i n ILE 73 Ca -0.03 0.11 0.11 0.00 -0.27 0.00 0.00 62.75 62.66 1h9i n ILE 73 Cb 0.47 -0.72 -0.08 0.00 -1.74 0.00 0.00 39.64 37.58 1h9i n ILE 73 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1h9i n ASP 74 N -1.49 0.52 -3.99 7.28 8.00 -1.26 -4.93 116.55 120.68 1h9i n ASP 74 Ca 0.06 -0.31 -0.25 0.00 0.71 0.00 0.00 54.79 55.00 1h9i n ASP 74 Cb 0.26 1.22 -0.17 0.00 -0.02 0.00 0.00 41.12 42.42 1h9i n ASP 74 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1h9i s VAL 75 N -3.26 1.10 -0.01 2.53 1.01 -1.08 -5.10 120.40 115.58 1h9i s VAL 75 Ca 0.01 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 1h9i s VAL 75 Cb 0.14 -1.04 -0.05 0.00 0.00 0.00 0.00 36.38 35.44 1h9i s VAL 75 CO 0.85 0.36 1.32 -0.76 0.00 0.00 0.00 175.10 176.87 1h9i s LEU 76 N 0.99 4.31 -0.00 3.92 1.02 -1.26 -4.66 118.68 123.00 1h9i s LEU 76 Ca -0.08 2.01 0.07 0.00 0.02 0.00 0.00 54.13 56.15 1h9i s LEU 76 Cb -0.15 -3.56 -0.09 0.00 0.02 0.00 0.00 46.19 42.41 1h9i s LEU 76 CO -0.00 -0.65 0.28 -0.62 0.02 0.00 0.00 176.35 175.37 1h9i n GLU 77 N 5.15 3.37 0.00 1.70 1.02 -1.26 -5.04 120.64 125.58 1h9i n GLU 77 Ca 0.12 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1h9i n GLU 77 Cb 0.45 -0.94 0.00 0.00 -0.02 0.00 0.00 31.44 30.92 1h9i n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h9i n GLY 78 N 1.42 1.92 0.79 0.62 0.00 -1.26 -4.97 105.19 103.71 1h9i n GLY 78 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 1h9i n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h9i n ASN 79 N 0.00 2.70 -4.79 1.61 3.02 -1.26 -5.01 115.26 111.53 1h9i n ASN 79 Ca 0.00 -1.80 -0.34 0.00 -0.03 0.00 0.00 54.58 52.41 1h9i n ASN 79 Cb 0.00 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 1h9i n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1h9i s GLU 80 N -1.42 3.37 -0.06 3.52 8.01 -1.25 -4.51 118.70 126.35 1h9i s GLU 80 Ca 0.24 1.41 0.03 0.00 0.01 0.00 0.00 54.97 56.66 1h9i s GLU 80 Cb 0.16 -2.03 0.01 0.00 -4.31 0.00 0.00 34.13 27.96 1h9i s GLU 80 CO 0.23 -0.80 -0.15 -0.65 0.01 0.00 0.00 175.26 173.91 1h9i s GLN 81 N -3.59 1.88 -0.29 1.61 -0.21 -0.37 -4.98 119.66 113.71 1h9i s GLN 81 Ca 0.68 -0.53 -0.04 0.00 0.02 0.00 0.00 55.36 55.50 1h9i s GLN 81 Cb -0.19 -1.55 0.03 0.00 1.00 0.00 0.00 33.01 32.30 1h9i s GLN 81 CO 0.30 0.11 0.02 -0.06 -2.12 0.00 0.00 175.29 173.54 1h9i s PHE 82 N 0.43 3.19 -0.06 0.91 0.40 -1.26 -0.74 117.98 120.86 1h9i s PHE 82 Ca -0.12 -1.53 0.01 0.00 -0.60 0.00 0.00 56.93 54.69 1h9i s PHE 82 Cb -0.15 -2.16 0.02 0.00 0.51 0.00 0.00 43.02 41.25 1h9i s PHE 82 CO 0.04 -0.73 -0.07 0.42 0.70 0.00 0.00 175.22 175.58 1h9i s ILE 83 N 1.35 0.78 0.48 0.64 1.01 -0.21 -4.98 121.20 120.27 1h9i s ILE 83 Ca -0.02 -0.24 -0.19 0.00 0.00 0.00 0.00 60.65 60.20 1h9i s ILE 83 Cb -0.18 -0.78 -0.09 0.00 0.01 0.00 0.00 42.46 41.42 1h9i s ILE 83 CO -0.00 0.29 0.99 0.20 0.00 0.00 0.00 174.94 176.42 1h9i s ASN 84 N 1.02 6.61 0.02 3.58 0.01 -1.26 -0.85 114.94 124.06 1h9i s ASN 84 Ca -0.09 1.74 -0.30 0.00 -0.71 0.00 0.00 52.86 53.50 1h9i s ASN 84 Cb -0.14 -2.54 -0.04 0.00 0.41 0.00 0.00 41.25 38.93 1h9i s ASN 84 CO -0.00 -0.59 1.15 0.00 -1.51 0.00 0.00 177.10 176.15 1h9i s ALA 85 N -2.23 3.37 -0.11 0.60 0.00 -0.49 -1.11 121.76 121.79 1h9i s ALA 85 Ca 0.63 0.72 0.04 0.00 0.00 0.00 0.00 51.96 53.35 1h9i s ALA 85 Cb -0.12 -3.44 -0.24 0.00 0.00 0.00 0.00 23.12 19.32 1h9i s ALA 85 CO 0.21 -0.48 0.40 0.00 0.00 0.00 0.00 175.76 175.89 1h9i n ALA 86 N 4.26 1.22 -3.22 0.00 0.00 0.93 -4.78 120.51 118.93 1h9i n ALA 86 Ca 0.09 -0.77 -0.13 0.00 0.00 0.00 0.00 53.44 52.63 1h9i n ALA 86 Cb 0.47 -0.65 -0.14 0.00 0.00 0.00 0.00 19.45 19.13 1h9i n ALA 86 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1h9i s LYS 87 N -2.56 0.05 -0.14 0.00 1.02 -1.05 -4.99 119.74 112.06 1h9i s LYS 87 Ca -0.16 0.14 -0.00 0.00 0.02 0.00 0.00 55.97 55.98 1h9i s LYS 87 Cb 0.07 -0.06 0.03 0.00 -0.52 0.00 0.00 37.83 37.36 1h9i s LYS 87 CO 0.78 -0.06 -0.07 0.42 -0.92 0.00 0.00 175.35 175.50 1h9i s ILE 88 N 0.41 1.14 -0.22 2.17 1.01 -1.26 -0.33 121.20 124.12 1h9i s ILE 88 Ca -0.03 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.13 1h9i s ILE 88 Cb -0.05 -1.22 0.06 0.00 0.01 0.00 0.00 42.46 41.26 1h9i s ILE 88 CO -0.01 0.26 -0.06 -0.63 0.00 0.00 0.00 174.94 174.50 1h9i s ILE 89 N 1.64 1.47 0.35 2.92 1.01 0.13 -5.01 121.20 123.71 1h9i s ILE 89 Ca 0.03 -1.10 -0.09 0.00 0.00 0.00 0.00 60.65 59.48 1h9i s ILE 89 Cb -0.14 -1.71 -0.06 0.00 0.01 0.00 0.00 42.46 40.56 1h9i s ILE 89 CO -0.08 -0.04 0.69 0.42 0.00 0.00 0.00 174.94 175.93 1h9i s THR 90 N 1.43 4.85 0.21 2.92 -4.23 -1.26 -0.90 115.64 118.67 1h9i s THR 90 Ca -0.04 0.48 -0.32 0.00 -1.18 0.00 0.00 61.69 60.63 1h9i s THR 90 Cb -0.18 -3.71 -0.14 0.00 1.34 0.00 0.00 72.50 69.81 1h9i s THR 90 CO -0.07 -0.40 1.43 1.57 -0.54 0.00 0.00 174.62 176.61 1h9i n HIS 91 N -1.01 2.10 0.32 3.99 -0.00 -0.58 -4.84 115.22 115.20 1h9i n HIS 91 Ca 0.01 0.42 0.16 0.00 0.46 0.00 0.00 57.72 58.77 1h9i n HIS 91 Cb 0.54 -2.46 0.66 0.00 -0.12 0.00 0.00 29.99 28.60 1h9i n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1h9i h PRO 92 N 4.57 0.00 -0.33 1.57 0.13 -1.92 -2.03 132.00 133.99 1h9i h PRO 92 Ca -0.45 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.64 1h9i h PRO 92 Cb 1.28 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.38 1h9i h PRO 92 CO 0.78 0.00 0.01 0.09 -0.23 0.00 0.00 178.00 178.66 1h9i n ASN 93 N -2.76 3.86 -4.68 1.44 3.02 -1.26 -4.99 115.26 109.88 1h9i n ASN 93 Ca 0.01 -3.14 -0.43 0.00 -0.03 0.00 0.00 54.58 50.99 1h9i n ASN 93 Cb 0.25 -0.58 -0.01 0.00 -0.61 0.00 0.00 39.78 38.83 1h9i n ASN 93 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1h9i n PHE 94 N -0.52 2.13 -3.95 3.10 7.35 -0.77 -4.68 117.46 120.13 1h9i n PHE 94 Ca 0.25 0.56 -0.29 0.00 -0.76 0.00 0.00 57.45 57.21 1h9i n PHE 94 Cb 0.97 -2.40 -0.16 0.00 0.35 0.00 0.00 39.48 38.24 1h9i n PHE 94 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1h9i s ASN 95 N -0.28 2.76 0.30 -2.13 3.84 -0.85 -5.00 114.94 113.58 1h9i s ASN 95 Ca 0.57 -0.58 0.25 0.00 0.21 0.00 0.00 52.86 53.31 1h9i s ASN 95 Cb -0.59 -1.02 1.00 0.00 -0.55 0.00 0.00 41.25 40.08 1h9i s ASN 95 CO 0.61 -0.13 1.76 1.23 -2.79 0.00 0.00 177.10 177.78 1h9i h GLY 96 N 8.09 0.00 0.23 1.21 0.00 -1.94 0.31 103.07 110.97 1h9i h GLY 96 Ca -0.30 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.74 1h9i h GLY 96 CO 0.45 0.00 -1.61 0.70 0.00 0.00 0.00 176.54 176.08 1h9i n ASN 97 N -2.39 1.97 0.07 0.19 5.03 -1.26 -4.32 115.26 114.54 1h9i n ASN 97 Ca 0.02 0.33 0.12 0.00 0.87 0.00 0.00 54.58 55.93 1h9i n ASN 97 Cb 0.28 -0.92 0.21 0.00 -1.02 0.00 0.00 39.78 38.33 1h9i n ASN 97 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 1h9i h THR 98 N -0.58 0.00 -0.86 3.41 1.35 -1.98 -3.47 112.91 110.77 1h9i h THR 98 Ca -0.40 -0.51 -0.35 0.00 -0.55 0.00 0.00 66.41 64.61 1h9i h THR 98 Cb 1.60 1.16 -0.13 0.00 -1.73 0.00 0.00 68.15 69.05 1h9i h THR 98 CO -0.11 0.00 -0.32 0.18 -0.25 0.00 0.00 175.52 175.02 1h9i n LEU 99 N -2.16 -1.26 -4.76 3.87 4.32 0.11 -4.99 117.00 112.12 1h9i n LEU 99 Ca 0.04 0.41 -0.41 0.00 -0.02 0.00 0.00 56.01 56.03 1h9i n LEU 99 Cb 0.44 -2.43 -0.03 0.00 -1.62 0.00 0.00 43.42 39.78 1h9i n LEU 99 CO 0.35 -0.87 0.94 -0.62 -1.22 0.00 0.00 177.39 175.98 1h9i s ASP 100 N -2.80 6.90 -1.25 -1.43 2.15 -1.24 -3.43 116.67 115.56 1h9i s ASP 100 Ca 0.00 2.54 -0.02 0.00 0.43 0.00 0.00 52.55 55.49 1h9i s ASP 100 Cb 0.00 -2.64 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 1h9i s ASP 100 CO 0.00 -0.45 1.02 0.59 -0.17 0.00 0.00 175.17 176.15 1h9i n ASN 101 N 1.33 -3.00 -4.10 -0.34 3.02 -1.26 -2.01 115.26 108.90 1h9i n ASN 101 Ca 0.01 -0.62 -0.43 0.00 -0.03 0.00 0.00 54.58 53.51 1h9i n ASN 101 Cb 0.43 -4.99 0.00 0.00 -0.61 0.00 0.00 39.78 34.61 1h9i n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1h9i n ASP 102 N -3.09 5.05 -3.83 6.41 2.03 -1.22 -4.24 116.55 117.66 1h9i n ASP 102 Ca -0.22 -3.04 -0.12 0.00 0.52 0.00 0.00 54.79 51.93 1h9i n ASP 102 Cb 0.64 -1.54 -0.11 0.00 -0.72 0.00 0.00 41.12 39.39 1h9i n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1h9i s ILE 103 N 1.16 0.03 -0.06 5.18 2.07 -1.26 -3.83 121.20 124.49 1h9i s ILE 103 Ca 0.42 -0.24 -0.06 0.00 -1.41 0.00 0.00 60.65 59.36 1h9i s ILE 103 Cb 0.05 -0.32 0.02 0.00 0.13 0.00 0.00 42.46 42.34 1h9i s ILE 103 CO 0.00 -0.13 0.17 -0.32 -1.91 0.00 0.00 174.94 172.75 1h9i s MET 104 N -0.43 0.21 -0.07 3.50 -2.45 -0.15 -1.52 119.30 118.38 1h9i s MET 104 Ca -0.05 0.21 -0.02 0.00 -1.25 0.00 0.00 55.69 54.58 1h9i s MET 104 Cb -0.03 0.10 -0.03 0.00 1.25 0.00 0.00 34.83 36.11 1h9i s MET 104 CO 0.01 -0.03 0.01 -0.51 1.05 0.00 0.00 175.02 175.55 1h9i s LEU 105 N 0.04 3.63 -0.13 4.11 1.43 -0.08 -1.07 118.68 126.61 1h9i s LEU 105 Ca -0.01 0.14 0.02 0.00 -1.03 0.00 0.00 54.13 53.26 1h9i s LEU 105 Cb -0.01 -1.88 0.01 0.00 0.03 0.00 0.00 46.19 44.34 1h9i s LEU 105 CO 0.00 0.36 -0.20 -0.63 0.23 0.00 0.00 176.35 176.12 1h9i s ILE 106 N -0.93 1.87 -0.23 -0.59 1.01 -0.03 -0.69 121.20 121.61 1h9i s ILE 106 Ca 0.15 -0.86 -0.16 0.00 0.00 0.00 0.00 60.65 59.77 1h9i s ILE 106 Cb -0.11 -1.67 -0.04 0.00 0.01 0.00 0.00 42.46 40.65 1h9i s ILE 106 CO 0.04 0.51 0.43 -0.75 0.00 0.00 0.00 174.94 175.17 1h9i s LYS 107 N 0.92 4.12 0.50 2.79 2.20 0.56 -1.09 119.74 129.74 1h9i s LYS 107 Ca -0.06 0.21 -0.19 0.00 -0.36 0.00 0.00 55.97 55.58 1h9i s LYS 107 Cb -0.15 -3.59 -0.08 0.00 -1.51 0.00 0.00 37.83 32.50 1h9i s LYS 107 CO -0.03 -0.17 1.03 -0.51 -0.36 0.00 0.00 175.35 175.31 1h9i s LEU 108 N 1.72 3.76 0.41 5.43 1.43 0.22 -0.05 118.68 131.61 1h9i s LEU 108 Ca 0.19 1.85 0.17 0.00 -1.03 0.00 0.00 54.13 55.30 1h9i s LEU 108 Cb -0.15 -4.55 0.90 0.00 0.03 0.00 0.00 46.19 42.42 1h9i s LEU 108 CO 0.09 -0.80 1.89 0.77 0.23 0.00 0.00 176.35 178.53 1h9i h SER 109 N 1.31 0.00 -5.17 2.29 4.64 -1.42 -3.42 113.55 111.78 1h9i h SER 109 Ca -0.49 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.71 1h9i h SER 109 Cb 1.21 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.14 1h9i h SER 109 CO 0.59 0.30 -0.64 -0.94 -0.87 0.00 0.00 176.83 175.27 1h9i s SER 110 N -6.72 0.38 0.43 4.97 1.04 -1.26 -5.00 113.70 107.54 1h9i s SER 110 Ca -0.03 -0.83 -0.25 0.00 0.48 0.00 0.00 55.95 55.32 1h9i s SER 110 Cb 0.14 0.20 -0.08 0.00 0.10 0.00 0.00 66.02 66.38 1h9i s SER 110 CO 0.69 -0.55 1.26 -2.84 0.98 0.00 0.00 173.24 172.78 1h9i s PRO 111 N -3.34 3.86 0.61 4.02 0.02 -1.26 -4.86 135.00 134.05 1h9i s PRO 111 Ca 0.01 2.04 -0.18 0.00 0.02 0.00 0.00 61.00 62.90 1h9i s PRO 111 Cb 0.04 -2.63 -0.02 0.00 0.02 0.00 0.00 34.50 31.90 1h9i s PRO 111 CO -0.08 -0.55 1.17 0.00 -0.33 0.00 0.00 177.00 177.22 1h9i s ALA 112 N -1.34 2.50 -0.26 -1.55 0.00 0.46 -4.98 121.76 116.59 1h9i s ALA 112 Ca 0.60 0.87 -0.27 0.00 0.00 0.00 0.00 51.96 53.16 1h9i s ALA 112 Cb -0.35 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.36 1h9i s ALA 112 CO 0.44 -1.20 0.93 0.99 0.00 0.00 0.00 175.76 176.93 1h9i s THR 113 N -1.82 4.73 0.06 0.00 2.01 -1.26 -4.91 115.64 114.44 1h9i s THR 113 Ca 0.74 1.71 -0.21 0.00 0.31 0.00 0.00 61.69 64.24 1h9i s THR 113 Cb -0.27 -4.23 -0.06 0.00 0.01 0.00 0.00 72.50 67.94 1h9i s THR 113 CO 0.35 -0.19 0.61 -0.76 -0.69 0.00 0.00 174.62 173.94 1h9i s LEU 114 N 3.10 4.50 0.00 4.42 1.43 -1.26 -4.78 118.68 126.09 1h9i s LEU 114 Ca 0.39 1.29 0.00 0.00 -1.03 0.00 0.00 54.13 54.78 1h9i s LEU 114 Cb -0.15 -2.97 0.00 0.00 0.03 0.00 0.00 46.19 43.11 1h9i s LEU 114 CO 0.09 0.20 0.00 -0.46 0.23 0.00 0.00 176.35 176.41 1h9i n ASN 115 N 2.06 0.00 0.25 2.29 0.23 -0.06 -4.98 115.26 115.05 1h9i n ASN 115 Ca -0.08 -0.39 0.15 0.00 -0.53 0.00 0.00 54.58 53.73 1h9i n ASN 115 Cb 0.51 0.00 0.48 0.00 -2.08 0.00 0.00 39.78 38.68 1h9i n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1h9i h SER 116 N 0.00 0.00 0.00 0.53 4.64 -1.99 -3.10 113.55 113.63 1h9i h SER 116 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h9i h SER 116 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1h9i h SER 116 CO 0.00 0.00 -1.11 0.54 -0.87 0.00 0.00 176.83 175.39 1h9i n ARG 117 N -3.05 0.25 -3.83 4.77 1.74 -1.26 -4.83 116.66 110.45 1h9i n ARG 117 Ca 0.02 -0.03 -0.28 0.00 -0.77 0.00 0.00 57.85 56.80 1h9i n ARG 117 Cb 0.39 -1.48 -0.16 0.00 -1.02 0.00 0.00 32.46 30.19 1h9i n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1h9i s VAL 118 N -3.02 0.89 0.12 1.55 1.01 -1.17 -4.44 120.40 115.35 1h9i s VAL 118 Ca 0.06 -0.62 -0.10 0.00 0.00 0.00 0.00 61.98 61.32 1h9i s VAL 118 Cb 0.15 -1.20 0.00 0.00 0.00 0.00 0.00 36.38 35.34 1h9i s VAL 118 CO 0.85 -0.01 0.26 0.00 0.00 0.00 0.00 175.10 176.19 1h9i s ALA 119 N 1.71 -0.27 0.44 5.51 0.00 -0.92 -0.88 121.76 127.36 1h9i s ALA 119 Ca -0.00 -0.62 -0.02 0.00 0.00 0.00 0.00 51.96 51.32 1h9i s ALA 119 Cb -0.16 0.64 -0.02 0.00 0.00 0.00 0.00 23.12 23.57 1h9i s ALA 119 CO -0.07 -0.58 0.69 0.95 0.00 0.00 0.00 175.76 176.75 1h9i s THR 120 N -3.89 4.64 0.08 0.00 -4.23 -1.26 -3.27 115.64 107.72 1h9i s THR 120 Ca 0.09 -0.20 0.09 0.00 -1.18 0.00 0.00 61.69 60.49 1h9i s THR 120 Cb 0.04 -3.74 -0.03 0.00 1.34 0.00 0.00 72.50 70.11 1h9i s THR 120 CO -0.08 -0.60 -0.24 0.54 -0.54 0.00 0.00 174.62 173.70 1h9i s VAL 121 N -2.58 1.98 0.42 2.29 0.11 -0.38 -4.86 120.40 117.38 1h9i s VAL 121 Ca 0.46 -1.46 -0.24 0.00 -2.93 0.00 0.00 61.98 57.81 1h9i s VAL 121 Cb -0.10 -1.74 -0.08 0.00 -1.53 0.00 0.00 36.38 32.93 1h9i s VAL 121 CO 0.40 0.19 1.09 -0.55 -3.33 0.00 0.00 175.10 172.90 1h9i s SER 122 N -1.55 6.56 0.66 3.54 0.15 -1.26 -4.51 113.70 117.29 1h9i s SER 122 Ca 0.10 2.14 -0.12 0.00 0.70 0.00 0.00 55.95 58.77 1h9i s SER 122 Cb -0.10 -2.59 -0.01 0.00 -1.71 0.00 0.00 66.02 61.61 1h9i s SER 122 CO 0.03 -0.64 1.05 -0.76 1.20 0.00 0.00 173.24 174.13 1h9i s LEU 123 N -2.76 3.24 0.30 3.45 1.43 -1.26 -0.57 118.68 122.51 1h9i s LEU 123 Ca 0.60 1.62 -0.28 0.00 -1.03 0.00 0.00 54.13 55.04 1h9i s LEU 123 Cb -0.24 -4.50 -0.09 0.00 0.03 0.00 0.00 46.19 41.38 1h9i s LEU 123 CO 0.30 -1.26 1.03 -2.16 0.23 0.00 0.00 176.35 174.49 1h9i s PRO 124 N -4.83 4.60 0.30 1.29 0.04 -1.26 -4.68 135.00 130.47 1h9i s PRO 124 Ca 0.59 1.62 0.20 0.00 0.04 0.00 0.00 61.00 63.45 1h9i s PRO 124 Cb -0.14 -3.05 0.13 0.00 0.04 0.00 0.00 34.50 31.48 1h9i s PRO 124 CO 0.50 0.23 1.37 0.00 0.04 0.00 0.00 177.00 179.14 1h9i h ARG 125 N 3.59 0.00 -3.10 4.56 3.08 -1.96 -3.47 114.38 117.08 1h9i h ARG 125 Ca -0.47 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.57 1h9i h ARG 125 Cb 1.21 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 31.15 1h9i h ARG 125 CO 0.66 0.20 0.15 -1.54 -1.07 0.00 0.00 179.97 178.37 1h9i s SER 127 N -6.10 -0.43 0.53 7.04 1.04 -1.26 -5.16 113.70 109.36 1h9i s SER 127 Ca 0.04 -0.21 -0.20 0.00 0.48 0.00 0.00 55.95 56.06 1h9i s SER 127 Cb 0.07 0.60 -0.06 0.00 0.10 0.00 0.00 66.02 66.73 1h9i s SER 127 CO 0.73 -1.03 1.14 0.00 0.98 0.00 0.00 173.24 175.07 1h9i s ALA 129 N -1.71 3.35 0.44 0.00 0.00 -1.26 -5.04 121.76 117.54 1h9i s ALA 129 Ca 0.72 0.70 -0.20 0.00 0.00 0.00 0.00 51.96 53.18 1h9i s ALA 129 Cb -0.25 -3.24 -0.10 0.00 0.00 0.00 0.00 23.12 19.52 1h9i s ALA 129 CO 0.29 0.09 0.95 0.00 0.00 0.00 0.00 175.76 177.09 1h9i s ALA 130 N -1.19 3.06 0.27 0.00 0.00 -1.26 -5.00 121.76 117.64 1h9i s ALA 130 Ca 0.42 0.35 -0.29 0.00 0.00 0.00 0.00 51.96 52.45 1h9i s ALA 130 Cb -0.28 -3.13 -0.14 0.00 0.00 0.00 0.00 23.12 19.57 1h9i s ALA 130 CO 0.34 0.08 1.03 0.00 0.00 0.00 0.00 175.76 177.21 1h9i n ALA 132 N -0.78 -0.30 0.00 0.00 0.00 -1.26 -1.93 120.51 116.24 1h9i n ALA 132 Ca 0.07 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1h9i n ALA 132 Cb 0.54 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1h9i n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h9i n GLY 133 N 1.35 1.29 3.75 0.00 0.00 0.00 -4.98 105.19 106.60 1h9i n GLY 133 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1h9i n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1h9i s THR 134 N -2.33 2.72 0.02 2.61 2.01 -0.81 -4.71 115.64 115.14 1h9i s THR 134 Ca 0.00 0.63 -0.21 0.00 0.31 0.00 0.00 61.69 62.42 1h9i s THR 134 Cb 0.00 -3.40 -0.06 0.00 0.01 0.00 0.00 72.50 69.05 1h9i s THR 134 CO 0.00 0.11 0.62 -0.70 -0.69 0.00 0.00 174.62 173.96 1h9i s GLU 135 N -0.66 4.33 0.23 4.92 2.12 -1.26 -1.48 118.70 126.90 1h9i s GLU 135 Ca 0.57 0.79 0.05 0.00 0.36 0.00 0.00 54.97 56.74 1h9i s GLU 135 Cb -0.41 -3.33 -0.05 0.00 0.26 0.00 0.00 34.13 30.60 1h9i s GLU 135 CO 0.45 0.39 -0.06 0.00 -0.54 0.00 0.00 175.26 175.50 1h9i s LEU 137 N -3.33 2.79 -0.07 0.00 2.96 -0.24 -1.27 118.68 119.51 1h9i s LEU 137 Ca 0.26 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.78 1h9i s LEU 137 Cb 0.03 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 45.01 1h9i s LEU 137 CO 0.08 0.03 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.43 1h9i s ILE 138 N 1.20 3.58 0.06 6.68 1.01 0.54 -1.47 121.20 132.80 1h9i s ILE 138 Ca 0.02 -0.52 -0.07 0.00 0.00 0.00 0.00 60.65 60.08 1h9i s ILE 138 Cb -0.14 -2.46 -0.01 0.00 0.01 0.00 0.00 42.46 39.86 1h9i s ILE 138 CO -0.02 0.59 0.13 -0.94 0.00 0.00 0.00 174.94 174.70 1h9i s SER 139 N -0.71 0.18 0.00 3.58 1.04 -1.20 -1.01 113.70 115.58 1h9i s SER 139 Ca 0.11 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 55.90 1h9i s SER 139 Cb -0.11 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.29 1h9i s SER 139 CO 0.01 -0.63 0.00 0.61 0.98 0.00 0.00 173.24 174.21 1h9i n GLY 140 N 0.27 -0.45 1.50 7.32 0.00 -0.67 -4.39 105.19 108.77 1h9i n GLY 140 Ca -0.16 -1.18 -0.07 0.00 0.00 0.00 0.00 46.02 44.60 1h9i n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1h9i n TRP 141 N -0.69 1.74 -2.03 1.61 8.01 -1.26 -1.92 117.44 122.89 1h9i n TRP 141 Ca 0.00 -1.48 -0.29 0.00 -1.31 0.00 0.00 57.50 54.42 1h9i n TRP 141 Cb 0.00 -0.60 0.19 0.00 -2.01 0.00 0.00 31.31 28.89 1h9i n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1h9i s GLY 142 N -1.92 1.80 0.24 6.99 0.00 -1.24 -4.42 107.32 108.77 1h9i s GLY 142 Ca 0.49 -1.36 -0.31 0.00 0.00 0.00 0.00 44.72 43.54 1h9i s GLY 142 CO 0.06 -0.58 1.23 -2.01 0.00 0.00 0.00 173.10 171.80 1h9i n ASN 143 N -3.70 1.99 -1.02 1.64 5.15 0.09 -2.91 115.26 116.50 1h9i n ASN 143 Ca 0.16 1.16 0.11 0.00 -0.60 0.00 0.00 54.58 55.41 1h9i n ASN 143 Cb 0.59 -1.34 0.17 0.00 -0.53 0.00 0.00 39.78 38.67 1h9i n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1h9i n THR 144 N 1.20 0.37 -4.76 -0.44 -2.24 -0.36 -1.38 114.28 106.68 1h9i n THR 144 Ca 0.11 -0.69 -0.30 0.00 -2.27 0.00 0.00 64.05 60.90 1h9i n THR 144 Cb 0.30 1.10 -0.14 0.00 -2.10 0.00 0.00 70.33 69.49 1h9i n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1h9i s LYS 145 N -1.52 1.85 0.24 -0.78 1.02 -1.26 -4.43 119.74 114.86 1h9i s LYS 145 Ca 0.33 -1.09 0.18 0.00 0.02 0.00 0.00 55.97 55.40 1h9i s LYS 145 Cb 0.20 -2.05 0.05 0.00 -0.52 0.00 0.00 37.83 35.51 1h9i s LYS 145 CO 0.29 0.51 1.26 0.66 -0.92 0.00 0.00 175.35 177.15 1h9i h SER 146 N 4.59 0.00 -3.25 2.83 4.64 -1.93 -3.42 113.55 117.00 1h9i h SER 146 Ca -0.47 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.37 1h9i h SER 146 Cb 1.15 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.85 1h9i h SER 146 CO 0.44 0.38 -0.77 -0.44 -0.87 0.00 0.00 176.83 175.57 1h9i s SER 147 N -6.10 2.26 0.00 4.97 0.01 -1.26 -4.60 113.70 108.97 1h9i s SER 147 Ca 0.02 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 56.83 1h9i s SER 147 Cb 0.08 -0.53 0.00 0.00 0.21 0.00 0.00 66.02 65.78 1h9i s SER 147 CO 0.76 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.77 1h9i n GLY 148 N 5.10 -1.50 2.85 3.44 0.00 -1.26 -5.03 105.19 108.79 1h9i n GLY 148 Ca -0.08 -2.09 -0.19 0.00 0.00 0.00 0.00 46.02 43.67 1h9i n GLY 148 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1h9i s SER 149 N -3.96 0.72 -0.23 1.61 0.01 -1.26 -4.64 113.70 105.95 1h9i s SER 149 Ca 0.00 -0.07 -0.03 0.00 1.31 0.00 0.00 55.95 57.15 1h9i s SER 149 Cb 0.00 -0.33 0.11 0.00 0.21 0.00 0.00 66.02 66.00 1h9i s SER 149 CO 0.00 -0.08 0.25 -0.55 0.41 0.00 0.00 173.24 173.27 1h9i s SER 150 N 1.02 1.32 -0.24 2.44 0.15 -1.26 -4.97 113.70 112.15 1h9i s SER 150 Ca -0.10 -0.27 -0.15 0.00 0.70 0.00 0.00 55.95 56.13 1h9i s SER 150 Cb -0.14 0.49 -0.04 0.00 -1.71 0.00 0.00 66.02 64.62 1h9i s SER 150 CO -0.01 -0.34 0.38 -0.31 1.20 0.00 0.00 173.24 174.16 1h9i s TYR 151 N 2.36 3.30 0.52 3.44 1.51 -1.26 -1.22 117.35 125.99 1h9i s TYR 151 Ca 0.08 0.49 -0.07 0.00 -1.01 0.00 0.00 57.07 56.57 1h9i s TYR 151 Cb -0.15 -2.55 -0.03 0.00 -0.11 0.00 0.00 41.96 39.11 1h9i s TYR 151 CO -0.17 -0.14 0.85 -1.25 -1.11 0.00 0.00 175.55 173.73 1h9i s PRO 152 N 1.76 3.52 -0.01 -1.71 0.04 -1.26 -5.00 135.00 132.34 1h9i s PRO 152 Ca 0.16 0.32 -0.09 0.00 0.04 0.00 0.00 61.00 61.43 1h9i s PRO 152 Cb -0.15 -2.30 -0.30 0.00 0.04 0.00 0.00 34.50 31.78 1h9i s PRO 152 CO 0.09 -0.32 0.81 0.77 0.04 0.00 0.00 177.00 178.39 1h9i h SER 153 N 0.07 0.57 -3.06 6.66 0.02 -1.93 -3.47 113.55 112.42 1h9i h SER 153 Ca -0.46 -0.77 -0.60 0.00 -0.84 0.00 0.00 61.79 59.11 1h9i h SER 153 Cb 1.20 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 63.51 1h9i h SER 153 CO 0.62 1.64 -0.19 -0.76 -1.14 0.00 0.00 176.83 177.00 1h9i s LEU 154 N -7.23 4.45 0.21 5.07 1.43 -1.26 -0.87 118.68 120.48 1h9i s LEU 154 Ca -0.12 0.97 -0.32 0.00 -1.03 0.00 0.00 54.13 53.63 1h9i s LEU 154 Cb 0.06 -2.70 -0.13 0.00 0.03 0.00 0.00 46.19 43.45 1h9i s LEU 154 CO 0.87 0.29 1.61 -0.11 0.23 0.00 0.00 176.35 179.24 1h9i n LEU 155 N 1.62 3.63 -4.77 1.79 7.94 -1.01 -4.86 117.00 121.35 1h9i n LEU 155 Ca -0.12 1.09 -0.32 0.00 -1.11 0.00 0.00 56.01 55.55 1h9i n LEU 155 Cb 0.52 -1.51 -0.07 0.00 0.53 0.00 0.00 43.42 42.90 1h9i n LEU 155 CO 0.39 -0.07 -0.26 -1.10 -1.11 0.00 0.00 177.39 175.23 1h9i s GLN 156 N 0.60 2.95 0.11 1.96 -1.52 -0.81 -0.90 119.66 122.05 1h9i s GLN 156 Ca 0.74 -0.60 0.09 0.00 -1.95 0.00 0.00 55.36 53.63 1h9i s GLN 156 Cb -0.58 -2.78 -0.04 0.00 -0.22 0.00 0.00 33.01 29.40 1h9i s GLN 156 CO 0.39 0.60 -0.23 0.00 -0.25 0.00 0.00 175.29 175.81 1h9i s LEU 158 N -1.89 -0.19 -0.14 0.00 2.96 -0.18 -1.08 118.68 118.15 1h9i s LEU 158 Ca 0.09 0.89 -0.17 0.00 -0.22 0.00 0.00 54.13 54.72 1h9i s LEU 158 Cb -0.10 1.31 -0.04 0.00 0.50 0.00 0.00 46.19 47.86 1h9i s LEU 158 CO 0.05 -0.20 0.45 -0.54 -1.32 0.00 0.00 176.35 174.78 1h9i s LYS 159 N 1.66 4.30 -0.09 1.98 1.02 -1.26 -0.34 119.74 127.01 1h9i s LYS 159 Ca -0.08 0.37 -0.23 0.00 0.02 0.00 0.00 55.97 56.06 1h9i s LYS 159 Cb -0.09 -3.46 0.05 0.00 -0.52 0.00 0.00 37.83 33.81 1h9i s LYS 159 CO -0.13 0.12 0.54 0.00 -0.92 0.00 0.00 175.35 174.96 1h9i s ALA 160 N 0.77 -1.38 0.27 5.17 0.00 -0.40 -4.97 121.76 121.23 1h9i s ALA 160 Ca 0.24 1.14 -0.02 0.00 0.00 0.00 0.00 51.96 53.32 1h9i s ALA 160 Cb -0.15 -0.29 -0.04 0.00 0.00 0.00 0.00 23.12 22.64 1h9i s ALA 160 CO 0.09 -0.31 0.49 -1.25 0.00 0.00 0.00 175.76 174.78 1h9i s PRO 161 N -0.73 3.55 0.17 0.00 0.04 -1.26 -0.34 135.00 136.42 1h9i s PRO 161 Ca -0.08 -0.23 -0.31 0.00 0.04 0.00 0.00 61.00 60.43 1h9i s PRO 161 Cb -0.03 -2.73 -0.08 0.00 0.04 0.00 0.00 34.50 31.70 1h9i s PRO 161 CO 0.05 0.27 1.35 0.08 0.04 0.00 0.00 177.00 178.79 1h9i s VAL 162 N -2.06 3.22 0.27 -0.36 1.01 -0.55 -1.44 120.40 120.49 1h9i s VAL 162 Ca 0.41 0.95 0.02 0.00 0.00 0.00 0.00 61.98 63.36 1h9i s VAL 162 Cb -0.10 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 1h9i s VAL 162 CO 0.31 0.11 0.43 -0.76 0.00 0.00 0.00 175.10 175.20 1h9i s LEU 163 N 0.37 4.19 0.77 3.92 1.43 0.30 -0.82 118.68 128.84 1h9i s LEU 163 Ca 0.60 0.28 -0.11 0.00 -1.03 0.00 0.00 54.13 53.87 1h9i s LEU 163 Cb -0.37 -3.09 0.05 0.00 0.03 0.00 0.00 46.19 42.81 1h9i s LEU 163 CO 0.35 -0.15 1.08 -0.94 0.23 0.00 0.00 176.35 176.93 1h9i s SER 164 N -3.81 4.69 0.25 2.29 1.04 -1.26 -4.61 113.70 112.29 1h9i s SER 164 Ca 0.37 1.47 -0.05 0.00 0.48 0.00 0.00 55.95 58.22 1h9i s SER 164 Cb -0.10 -2.25 0.28 0.00 0.10 0.00 0.00 66.02 64.06 1h9i s SER 164 CO 0.32 -1.86 1.92 -0.78 0.98 0.00 0.00 173.24 173.82 1h9i h ASP 165 N -1.01 1.14 -0.58 7.02 3.58 -1.97 -1.59 116.42 123.00 1h9i h ASP 165 Ca -0.46 -0.03 -0.09 0.00 0.42 0.00 0.00 57.03 56.88 1h9i h ASP 165 Cb 1.25 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 41.99 1h9i h ASP 165 CO 0.57 0.82 0.02 0.77 -2.88 0.00 0.00 179.24 178.54 1h9i h SER 166 N 1.34 1.00 -0.31 2.28 4.64 -1.99 0.20 113.55 120.72 1h9i h SER 166 Ca 0.38 -0.27 -0.09 0.00 -0.47 0.00 0.00 61.79 61.34 1h9i h SER 166 Cb -0.12 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 61.68 1h9i h SER 166 CO -0.09 1.04 -0.11 0.77 -0.87 0.00 0.00 176.83 177.58 1h9i h SER 167 N 0.95 0.71 0.01 4.97 4.64 -1.87 0.21 113.55 123.17 1h9i h SER 167 Ca 0.17 -0.21 -0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1h9i h SER 167 Cb 0.52 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1h9i h SER 167 CO 0.03 0.85 -0.00 0.00 -0.87 0.00 0.00 176.83 176.83 1h9i h LYS 169 N -0.12 0.00 -0.02 0.00 1.57 -0.41 -2.10 116.57 115.49 1h9i h LYS 169 Ca -0.00 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 1h9i h LYS 169 Cb 0.12 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 1h9i h LYS 169 CO 0.00 0.49 -0.54 1.03 -0.57 0.00 0.00 179.45 179.86 1h9i h SER 170 N 0.00 0.05 0.57 0.86 0.87 -0.78 -2.48 113.55 112.64 1h9i h SER 170 Ca -0.00 -0.03 -0.16 0.00 -1.23 0.00 0.00 61.79 60.37 1h9i h SER 170 Cb 0.95 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.88 1h9i h SER 170 CO 0.06 0.58 -0.71 0.28 -0.53 0.00 0.00 176.83 176.52 1h9i h SER 171 N 0.04 0.14 -2.09 6.23 0.02 -0.39 -3.39 113.55 114.11 1h9i h SER 171 Ca -0.00 -0.09 -0.56 0.00 -0.84 0.00 0.00 61.79 60.30 1h9i h SER 171 Cb 0.96 -0.04 -0.40 0.00 0.14 0.00 0.00 62.40 63.06 1h9i h SER 171 CO 0.07 0.80 -0.94 -1.22 -1.14 0.00 0.00 176.83 174.40 1h9i n TYR 172 N -3.75 1.36 -1.77 3.45 4.01 -0.88 -4.90 117.16 114.68 1h9i n TYR 172 Ca -0.02 -3.83 -0.41 0.00 -0.16 0.00 0.00 57.90 53.48 1h9i n TYR 172 Cb 0.69 -0.44 -0.01 0.00 -0.31 0.00 0.00 39.34 39.27 1h9i n TYR 172 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1h9i s PRO 173 N -2.11 4.12 0.00 -0.72 0.04 -0.95 -1.56 135.00 133.82 1h9i s PRO 173 Ca 0.39 2.59 0.00 0.00 0.04 0.00 0.00 61.00 64.02 1h9i s PRO 173 Cb 0.22 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.74 1h9i s PRO 173 CO -0.08 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 176.73 1h9i n GLY 174 N 2.11 0.26 0.00 0.56 0.00 -1.26 -4.85 105.19 102.01 1h9i n GLY 174 Ca 0.08 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.17 1h9i n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1h9i n GLN 175 N -1.38 1.52 -3.47 1.61 6.02 -0.60 -4.95 117.38 116.14 1h9i n GLN 175 Ca 0.00 -0.05 -0.38 0.00 -0.01 0.00 0.00 57.00 56.56 1h9i n GLN 175 Cb 0.12 -1.26 -0.09 0.00 1.02 0.00 0.00 30.24 30.03 1h9i n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1h9i s ILE 176 N -2.63 5.23 0.57 5.09 -1.09 -1.25 -5.03 121.20 122.09 1h9i s ILE 176 Ca 0.02 0.48 0.06 0.00 -2.23 0.00 0.00 60.65 58.98 1h9i s ILE 176 Cb 0.11 -3.65 0.07 0.00 -1.58 0.00 0.00 42.46 37.41 1h9i s ILE 176 CO 0.62 0.23 0.79 0.42 -1.23 0.00 0.00 174.94 175.77 1h9i s THR 177 N 1.64 2.37 -0.81 2.92 -4.23 -1.26 -4.98 115.64 111.28 1h9i s THR 177 Ca 0.14 -0.89 0.11 0.00 -1.18 0.00 0.00 61.69 59.87 1h9i s THR 177 Cb -0.15 -2.48 0.10 0.00 1.34 0.00 0.00 72.50 71.31 1h9i s THR 177 CO 0.08 0.00 1.34 0.61 -0.54 0.00 0.00 174.62 176.11 1h9i n GLY 178 N -2.29 -0.81 1.47 3.99 0.00 -1.26 -2.46 105.19 103.83 1h9i n GLY 178 Ca 0.13 0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.26 1h9i n GLY 178 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h9i n ASN 179 N -1.72 4.82 -4.09 1.61 3.02 -1.26 -4.94 115.26 112.70 1h9i n ASN 179 Ca 0.01 -2.77 -0.18 0.00 -0.03 0.00 0.00 54.58 51.61 1h9i n ASN 179 Cb 0.09 -0.59 -0.13 0.00 -0.61 0.00 0.00 39.78 38.53 1h9i n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1h9i s MET 180 N -2.42 0.78 0.07 3.52 -1.94 -1.03 -1.12 119.30 117.17 1h9i s MET 180 Ca 0.49 -0.62 0.03 0.00 -1.71 0.00 0.00 55.69 53.88 1h9i s MET 180 Cb 0.36 -0.74 -0.03 0.00 2.01 0.00 0.00 34.83 36.42 1h9i s MET 180 CO 0.16 0.18 -0.10 0.96 -0.01 0.00 0.00 175.02 176.22 1h9i s ILE 181 N -0.75 0.83 -0.15 2.53 -4.36 0.09 -4.82 121.20 114.57 1h9i s ILE 181 Ca -0.00 -1.34 -0.07 0.00 -0.26 0.00 0.00 60.65 58.98 1h9i s ILE 181 Cb -0.07 -1.00 -0.04 0.00 1.25 0.00 0.00 42.46 42.60 1h9i s ILE 181 CO 0.01 -0.40 0.09 0.00 0.24 0.00 0.00 174.94 174.87 1h9i s VAL 183 N -0.29 0.53 -5.00 0.00 1.01 -0.88 -0.54 120.40 115.23 1h9i s VAL 183 Ca 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1h9i s VAL 183 Cb -0.12 -0.56 0.00 0.00 0.00 0.00 0.00 36.38 35.70 1h9i s VAL 183 CO 0.01 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.95 1h9i n GLY 184 N 4.06 0.35 2.91 4.51 0.00 -0.52 -3.29 105.19 113.20 1h9i n GLY 184 Ca -0.25 -1.37 -0.25 0.00 0.00 0.00 0.00 46.02 44.15 1h9i n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1h9i s PHE 184 N -3.81 1.28 0.14 1.61 0.08 -1.26 -4.34 117.98 111.68 1h9i s PHE 184 Ca 0.00 -0.56 0.34 0.00 0.12 0.00 0.00 56.93 56.83 1h9i s PHE 184 Cb 0.00 -1.07 1.42 0.00 -0.57 0.00 0.00 43.02 42.80 1h9i s PHE 184 CO 0.00 -0.40 2.00 -0.07 -0.10 0.00 0.00 175.22 176.65 1h9i h LEU 185 N 7.84 0.00 0.00 -0.37 3.38 -1.96 -1.39 115.31 122.81 1h9i h LEU 185 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1h9i h LEU 185 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1h9i h LEU 185 CO 0.41 0.01 0.00 -1.84 0.09 0.00 0.00 178.44 177.11 1h9i n GLU 186 N -3.10 0.36 0.00 1.13 0.00 -1.26 -0.45 120.64 117.32 1h9i n GLU 186 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.19 1h9i n GLU 186 Cb 0.29 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.23 1h9i n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1h9i n GLY 187 N 1.10 -2.47 2.84 -1.84 0.00 -0.53 -4.39 105.19 99.91 1h9i n GLY 187 Ca 0.13 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.46 1h9i n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h9i n GLY 188 N -0.33 3.06 2.85 -0.02 0.00 -0.09 -4.87 105.19 105.79 1h9i n GLY 188 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1h9i n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h9i s LYS 188 N -0.24 0.98 0.15 1.61 1.02 -1.26 -3.89 119.74 118.11 1h9i s LYS 188 Ca 0.00 -0.07 -0.24 0.00 0.02 0.00 0.00 55.97 55.68 1h9i s LYS 188 Cb 0.00 -1.15 0.08 0.00 -0.52 0.00 0.00 37.83 36.23 1h9i s LYS 188 CO 0.00 -0.23 1.04 0.34 -0.92 0.00 0.00 175.35 175.58 1h9i s ASP 189 N 1.63 -0.07 0.79 2.83 2.15 -0.38 -4.36 116.67 119.25 1h9i s ASP 189 Ca 0.01 -0.50 -0.07 0.00 0.43 0.00 0.00 52.55 52.42 1h9i s ASP 189 Cb -0.13 0.45 0.13 0.00 -0.30 0.00 0.00 42.92 43.07 1h9i s ASP 189 CO -0.05 -0.86 1.10 -0.94 -0.17 0.00 0.00 175.17 174.25 1h9i s SER 190 N -3.20 4.10 0.27 -0.34 1.04 -1.26 -0.53 113.70 113.78 1h9i s SER 190 Ca 0.18 0.06 -0.10 0.00 0.48 0.00 0.00 55.95 56.57 1h9i s SER 190 Cb -0.01 -0.42 0.04 0.00 0.10 0.00 0.00 66.02 65.73 1h9i s SER 190 CO 0.03 -2.05 0.54 0.00 0.98 0.00 0.00 173.24 172.73 1h9i n GLN 192 N -0.36 1.80 0.00 0.00 3.00 -1.26 -1.20 117.38 119.35 1h9i n GLN 192 Ca -0.06 0.64 0.00 0.00 -0.01 0.00 0.00 57.00 57.57 1h9i n GLN 192 Cb 0.41 -2.31 0.00 0.00 0.00 0.00 0.00 30.24 28.34 1h9i n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1h9i n GLY 193 N 2.56 0.68 0.02 1.08 0.00 -1.26 -0.73 105.19 107.55 1h9i n GLY 193 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.28 1h9i n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h9i n ASP 194 N 0.00 0.62 -4.60 1.61 8.00 -0.34 -3.72 116.55 118.11 1h9i n ASP 194 Ca 0.00 -0.31 -0.46 0.00 0.71 0.00 0.00 54.79 54.73 1h9i n ASP 194 Cb 0.00 0.89 -0.02 0.00 -0.02 0.00 0.00 41.12 41.96 1h9i n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1h9i n SER 195 N -1.89 1.52 0.00 -2.24 7.64 -1.26 -1.74 113.62 115.65 1h9i n SER 195 Ca 0.02 1.17 0.00 0.00 1.01 0.00 0.00 58.87 61.07 1h9i n SER 195 Cb 0.43 -1.29 0.00 0.00 -1.01 0.00 0.00 64.21 62.34 1h9i n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1h9i n GLY 196 N 1.53 1.97 3.82 0.23 0.00 -0.45 0.11 105.19 112.41 1h9i n GLY 196 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1h9i n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h9i s GLY 197 N -1.98 1.60 0.24 -0.02 0.00 -0.71 -3.11 107.32 103.33 1h9i s GLY 197 Ca 0.00 -0.43 -0.18 0.00 0.00 0.00 0.00 44.72 44.11 1h9i s GLY 197 CO 0.00 0.06 0.70 2.56 0.00 0.00 0.00 173.10 176.42 1h9i s PRO 198 N -5.30 4.15 -0.30 2.90 0.04 -1.26 -1.45 135.00 133.77 1h9i s PRO 198 Ca 0.62 0.76 0.00 0.00 0.04 0.00 0.00 61.00 62.42 1h9i s PRO 198 Cb -0.14 -2.77 0.06 0.00 0.04 0.00 0.00 34.50 31.70 1h9i s PRO 198 CO 0.53 0.34 -0.01 0.08 0.04 0.00 0.00 177.00 177.99 1h9i s VAL 199 N -1.63 2.72 -0.18 -0.36 1.01 -0.59 -3.27 120.40 118.09 1h9i s VAL 199 Ca 0.45 -1.62 -0.02 0.00 0.00 0.00 0.00 61.98 60.79 1h9i s VAL 199 Cb -0.15 -2.65 -0.01 0.00 0.00 0.00 0.00 36.38 33.57 1h9i s VAL 199 CO 0.20 -0.19 -0.08 -0.69 0.00 0.00 0.00 175.10 174.33 1h9i s VAL 200 N 1.16 3.20 -0.11 2.92 1.01 -0.54 -0.89 120.40 127.15 1h9i s VAL 200 Ca -0.03 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.38 1h9i s VAL 200 Cb -0.20 -2.41 0.02 0.00 0.00 0.00 0.00 36.38 33.79 1h9i s VAL 200 CO -0.03 0.47 -0.12 0.00 0.00 0.00 0.00 175.10 175.41 1h9i n ASN 202 N 4.50 -3.54 -0.87 0.00 3.02 -1.26 -1.61 115.26 115.50 1h9i n ASN 202 Ca -0.17 -0.82 -0.11 0.00 -0.03 0.00 0.00 54.58 53.45 1h9i n ASN 202 Cb 0.51 -3.81 -0.05 0.00 -0.61 0.00 0.00 39.78 35.82 1h9i n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h9i n GLY 203 N -1.67 1.24 3.13 7.41 0.00 -1.26 -5.01 105.19 109.03 1h9i n GLY 203 Ca -0.06 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.29 1h9i n GLY 203 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h9i s GLN 204 N -2.90 1.25 -0.54 1.61 -0.21 -0.63 -4.01 119.66 114.23 1h9i s GLN 204 Ca 0.00 -0.57 -0.28 0.00 0.02 0.00 0.00 55.36 54.54 1h9i s GLN 204 Cb 0.00 -1.21 0.01 0.00 1.00 0.00 0.00 33.01 32.81 1h9i s GLN 204 CO 0.00 0.33 1.44 -1.17 -2.12 0.00 0.00 175.29 173.78 1h9i s LEU 209 N -0.40 3.42 -0.02 2.90 2.96 0.27 -0.35 118.68 127.46 1h9i s LEU 209 Ca 0.06 0.38 0.16 0.00 -0.22 0.00 0.00 54.13 54.51 1h9i s LEU 209 Cb -0.06 -3.10 -0.25 0.00 0.50 0.00 0.00 46.19 43.28 1h9i s LEU 209 CO -0.01 -1.71 0.35 0.00 -1.32 0.00 0.00 176.35 173.67 1h9i n GLN 210 N 8.61 0.49 -3.99 1.98 1.13 -0.07 -4.01 117.38 121.51 1h9i n GLN 210 Ca 0.13 -0.15 -0.08 0.00 -1.94 0.00 0.00 57.00 54.97 1h9i n GLN 210 Cb 0.49 -1.38 -0.09 0.00 0.11 0.00 0.00 30.24 29.37 1h9i n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1h9i s GLY 211 N -3.86 0.32 -0.10 1.08 0.00 -0.93 -2.14 107.32 101.70 1h9i s GLY 211 Ca -0.06 -0.96 0.02 0.00 0.00 0.00 0.00 44.72 43.72 1h9i s GLY 211 CO 0.67 -1.10 -0.16 -0.42 0.00 0.00 0.00 173.10 172.10 1h9i s ILE 212 N -3.90 1.49 0.04 0.90 1.01 -0.98 -1.54 121.20 118.22 1h9i s ILE 212 Ca 0.07 -0.66 -0.34 0.00 0.00 0.00 0.00 60.65 59.72 1h9i s ILE 212 Cb 0.07 -1.35 -0.13 0.00 0.01 0.00 0.00 42.46 41.06 1h9i s ILE 212 CO -0.10 0.44 1.74 0.52 0.00 0.00 0.00 174.94 177.54 1h9i n VAL 213 N 4.04 0.31 0.02 2.92 0.31 -0.53 -1.38 118.33 124.02 1h9i n VAL 213 Ca -0.20 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1h9i n VAL 213 Cb 0.52 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.70 1h9i n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1h9i n SER 214 N 5.16 0.16 -3.37 4.52 2.88 -1.02 -1.34 113.62 120.61 1h9i n SER 214 Ca 0.20 0.05 -0.10 0.00 -1.33 0.00 0.00 58.87 57.69 1h9i n SER 214 Cb 0.30 -0.03 -0.01 0.00 -0.75 0.00 0.00 64.21 63.72 1h9i n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1h9i s TRP 215 N -1.21 0.34 -0.02 0.66 1.48 -0.70 -4.90 118.94 114.59 1h9i s TRP 215 Ca 0.00 -0.81 -0.30 0.00 -1.06 0.00 0.00 56.10 53.93 1h9i s TRP 215 Cb 0.00 0.47 0.12 0.00 -1.16 0.00 0.00 33.47 32.90 1h9i s TRP 215 CO 0.00 -1.30 1.30 0.20 -4.06 0.00 0.00 176.95 173.09 1h9i s GLY 216 N -3.07 -0.32 -0.41 3.67 0.00 -1.26 -0.56 107.32 105.36 1h9i s GLY 216 Ca 0.20 0.49 -0.20 0.00 0.00 0.00 0.00 44.72 45.21 1h9i s GLY 216 CO 0.12 2.00 0.60 -0.19 0.00 0.00 0.00 173.10 175.64 1h9i s TYR 217 N -2.24 3.11 0.00 1.90 1.51 -1.26 -4.94 117.35 115.43 1h9i s TYR 217 Ca 0.19 0.03 0.00 0.00 -1.01 0.00 0.00 57.07 56.29 1h9i s TYR 217 Cb 0.03 -3.20 0.00 0.00 -0.11 0.00 0.00 41.96 38.68 1h9i s TYR 217 CO -0.03 -0.76 0.00 0.41 -1.11 0.00 0.00 175.55 174.06 1h9i n GLY 219 N 4.93 0.97 2.89 0.71 0.00 -1.26 -4.64 105.19 108.79 1h9i n GLY 219 Ca -0.03 -0.71 -0.17 0.00 0.00 0.00 0.00 46.02 45.11 1h9i n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h9i n ALA 221 N 3.59 -0.27 -1.87 0.00 0.00 -1.26 -4.63 120.51 116.06 1h9i n ALA 221 Ca -0.20 0.22 -0.33 0.00 0.00 0.00 0.00 53.44 53.13 1h9i n ALA 221 Cb 0.54 -1.65 -0.06 0.00 0.00 0.00 0.00 19.45 18.28 1h9i n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1h9i s GLN 221 N -3.56 4.14 0.21 0.00 -1.52 -1.26 -0.91 119.66 116.76 1h9i s GLN 221 Ca 0.00 1.02 -0.32 0.00 -1.95 0.00 0.00 55.36 54.10 1h9i s GLN 221 Cb 0.00 -2.21 -0.13 0.00 -0.22 0.00 0.00 33.01 30.45 1h9i s GLN 221 CO 0.00 -0.05 1.55 1.17 -0.25 0.00 0.00 175.29 177.71 1h9i n LYS 222 N -0.79 2.27 -1.69 2.91 4.81 -1.26 -1.98 118.16 122.43 1h9i n LYS 222 Ca 0.06 0.81 -0.20 0.00 -0.87 0.00 0.00 58.31 58.12 1h9i n LYS 222 Cb 0.54 -2.56 -0.07 0.00 0.02 0.00 0.00 35.03 32.96 1h9i n LYS 222 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1h9i n ASN 223 N 2.92 -5.29 -3.32 3.14 5.15 0.41 -4.90 115.26 113.37 1h9i n ASN 223 Ca 0.14 0.43 -0.25 0.00 -0.60 0.00 0.00 54.58 54.29 1h9i n ASN 223 Cb 0.31 -4.65 -0.08 0.00 -0.53 0.00 0.00 39.78 34.83 1h9i n ASN 223 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1h9i n LYS 224 N -2.41 1.34 -1.41 1.20 4.76 -0.84 -4.66 118.16 116.15 1h9i n LYS 224 Ca -0.20 -3.77 -0.29 0.00 -2.87 0.00 0.00 58.31 51.18 1h9i n LYS 224 Cb 0.66 -1.65 0.17 0.00 -1.84 0.00 0.00 35.03 32.36 1h9i n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1h9i s PRO 225 N -1.53 0.52 0.53 1.97 0.04 -1.26 -4.36 135.00 130.91 1h9i s PRO 225 Ca 0.36 0.22 -0.19 0.00 0.04 0.00 0.00 61.00 61.43 1h9i s PRO 225 Cb 0.14 -1.77 -0.07 0.00 0.04 0.00 0.00 34.50 32.84 1h9i s PRO 225 CO -0.09 -2.60 1.08 0.20 0.04 0.00 0.00 177.00 175.62 1h9i s GLY 226 N -3.94 2.49 -0.10 0.56 0.00 -1.21 -4.72 107.32 100.41 1h9i s GLY 226 Ca 0.66 0.66 0.00 0.00 0.00 0.00 0.00 44.72 46.04 1h9i s GLY 226 CO 0.55 0.99 -0.11 0.14 0.00 0.00 0.00 173.10 174.67 1h9i s VAL 227 N -1.98 3.31 0.03 1.40 1.01 0.28 -2.08 120.40 122.37 1h9i s VAL 227 Ca 0.69 -0.59 0.05 0.00 0.00 0.00 0.00 61.98 62.12 1h9i s VAL 227 Cb -0.19 -2.37 -0.02 0.00 0.00 0.00 0.00 36.38 33.80 1h9i s VAL 227 CO 0.25 0.55 -0.15 -0.31 0.00 0.00 0.00 175.10 175.45 1h9i s TYR 228 N -0.12 1.28 0.22 5.22 1.51 0.15 -1.72 117.35 123.88 1h9i s TYR 228 Ca -0.00 -0.34 -0.30 0.00 -1.01 0.00 0.00 57.07 55.42 1h9i s TYR 228 Cb -0.13 -0.77 -0.09 0.00 -0.11 0.00 0.00 41.96 40.85 1h9i s TYR 228 CO 0.03 0.03 1.39 0.99 -1.11 0.00 0.00 175.55 176.88 1h9i s THR 229 N -0.77 2.90 -0.89 -0.71 2.01 -0.48 -0.73 115.64 116.98 1h9i s THR 229 Ca 0.03 0.75 -0.22 0.00 0.31 0.00 0.00 61.69 62.56 1h9i s THR 229 Cb -0.08 -3.48 0.08 0.00 0.01 0.00 0.00 72.50 69.04 1h9i s THR 229 CO 0.01 0.11 1.21 -0.75 -0.69 0.00 0.00 174.62 174.51 1h9i s LYS 230 N -0.16 3.46 0.40 4.92 2.20 -0.27 -2.32 119.74 127.97 1h9i s LYS 230 Ca 0.59 -1.24 0.06 0.00 -0.36 0.00 0.00 55.97 55.02 1h9i s LYS 230 Cb -0.40 -4.85 0.82 0.00 -1.51 0.00 0.00 37.83 31.89 1h9i s LYS 230 CO 0.40 -1.95 2.04 0.28 -0.36 0.00 0.00 175.35 175.76 1h9i h VAL 231 N 6.18 1.12 0.00 4.02 2.07 -1.72 -2.37 116.25 125.55 1h9i h VAL 231 Ca 0.04 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.30 1h9i h VAL 231 Cb 1.03 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 1h9i h VAL 231 CO 1.24 0.12 0.00 0.00 0.02 0.00 0.00 177.57 178.95 1h9i n ASN 233 N -2.63 0.17 -0.34 0.00 3.02 -0.89 -4.03 115.26 110.55 1h9i n ASN 233 Ca -0.01 0.03 0.03 0.00 -0.03 0.00 0.00 54.58 54.60 1h9i n ASN 233 Cb 0.10 -0.26 0.08 0.00 -0.61 0.00 0.00 39.78 39.09 1h9i n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1h9i n TYR 234 N -1.34 0.23 -0.32 3.10 4.01 -0.02 -4.74 117.16 118.08 1h9i n TYR 234 Ca 0.10 -0.44 -0.04 0.00 -0.16 0.00 0.00 57.90 57.35 1h9i n TYR 234 Cb 0.30 -0.03 0.08 0.00 -0.31 0.00 0.00 39.34 39.38 1h9i n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1h9i h VAL 235 N 1.13 1.25 -0.45 -0.72 2.07 -1.70 -1.32 116.25 116.51 1h9i h VAL 235 Ca 0.00 -0.60 -0.10 0.00 0.82 0.00 0.00 66.70 66.82 1h9i h VAL 235 Cb 0.59 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 1h9i h VAL 235 CO 0.00 0.27 -0.11 -1.13 0.02 0.00 0.00 177.57 176.62 1h9i h ASN 236 N 1.20 0.88 -0.98 0.57 -1.24 -1.90 -2.52 115.58 111.59 1h9i h ASN 236 Ca 0.31 -0.36 0.03 0.00 0.71 0.00 0.00 56.30 56.98 1h9i h ASN 236 Cb 0.01 -0.24 -0.06 0.00 0.73 0.00 0.00 38.32 38.76 1h9i h ASN 236 CO -0.05 1.04 0.64 -0.25 -1.29 0.00 0.00 177.43 177.52 1h9i h TRP 237 N 0.71 1.21 -0.26 0.67 7.01 -1.77 -1.54 115.95 121.98 1h9i h TRP 237 Ca 0.11 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.10 1h9i h TRP 237 Cb 0.66 -0.40 -0.01 0.00 -2.10 0.00 0.00 29.16 27.30 1h9i h TRP 237 CO 0.05 0.71 -0.02 0.82 -2.79 0.00 0.00 178.44 177.21 1h9i h ILE 238 N 1.26 1.26 -0.38 2.65 2.04 -1.13 -1.08 117.51 122.13 1h9i h ILE 238 Ca 0.39 -0.96 0.02 0.00 1.00 0.00 0.00 64.86 65.30 1h9i h ILE 238 Cb -0.03 1.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 1h9i h ILE 238 CO -0.11 0.30 0.22 1.56 0.00 0.00 0.00 178.15 180.12 1h9i h GLN 239 N 0.24 0.43 -0.21 2.37 1.08 -1.21 -1.52 115.11 116.28 1h9i h GLN 239 Ca 0.07 -0.03 -0.12 0.00 -1.45 0.00 0.00 58.65 57.12 1h9i h GLN 239 Cb 0.45 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.77 1h9i h GLN 239 CO 0.02 0.29 -0.39 0.37 -0.95 0.00 0.00 178.83 178.16 1h9i h GLN 240 N 0.45 0.49 -0.34 1.46 5.75 -1.17 -2.02 115.11 119.72 1h9i h GLN 240 Ca 0.15 -0.24 -0.03 0.00 -0.15 0.00 0.00 58.65 58.38 1h9i h GLN 240 Cb 0.02 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 1h9i h GLN 240 CO -0.08 0.80 0.08 1.15 -2.65 0.00 0.00 178.83 178.13 1h9i h THR 241 N 0.41 1.22 -0.54 2.39 2.02 -0.95 -2.75 112.91 114.71 1h9i h THR 241 Ca 0.04 -0.75 -0.03 0.00 0.77 0.00 0.00 66.41 66.44 1h9i h THR 241 Cb 0.86 1.07 -0.03 0.00 -1.74 0.00 0.00 68.15 68.32 1h9i h THR 241 CO 0.07 0.25 0.22 0.40 0.37 0.00 0.00 175.52 176.83 1h9i h ILE 242 N 0.39 1.20 0.00 3.11 2.04 -1.15 -2.18 117.51 120.92 1h9i h ILE 242 Ca 0.11 -0.62 -0.03 0.00 1.00 0.00 0.00 64.86 65.31 1h9i h ILE 242 Cb 0.30 0.55 -0.00 0.00 -0.74 0.00 0.00 36.82 36.93 1h9i h ILE 242 CO 0.00 0.24 -0.16 0.00 0.00 0.00 0.00 178.15 178.23 1h9i h ALA 243 N 1.47 1.63 -0.09 1.87 0.00 -1.18 -2.17 119.26 120.79 1h9i h ALA 243 Ca 0.19 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1h9i h ALA 243 Cb 0.15 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1h9i h ALA 243 CO -0.02 0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.43 1h9i n ALA 244 N -2.46 2.53 -0.75 0.00 0.00 -0.84 -5.10 120.51 113.89 1h9i n ALA 244 Ca -0.02 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.88 1h9i n ALA 244 Cb 0.23 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1h9i n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59