#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b9i s MET 53 N 2.47 0.26 0.02 0.00 0.00 -1.26 -1.93 119.30 118.86 3b9i s MET 53 Ca 0.10 -0.17 0.03 0.00 0.00 0.00 0.00 55.69 55.65 3b9i s MET 53 Cb -0.14 -0.21 -0.02 0.00 0.00 0.00 0.00 34.83 34.46 3b9i s MET 53 CO -0.27 0.06 -0.09 0.14 0.00 0.00 0.00 175.02 174.86 3b9i s VAL 54 N -0.23 0.67 -0.07 10.11 -7.23 -0.78 -2.15 120.40 120.73 3b9i s VAL 54 Ca -0.01 -0.75 0.00 0.00 -1.81 0.00 0.00 61.98 59.42 3b9i s VAL 54 Cb -0.02 -0.64 0.02 0.00 0.56 0.00 0.00 36.38 36.30 3b9i s VAL 54 CO -0.00 -0.08 -0.04 -0.75 -0.31 0.00 0.00 175.10 173.91 3b9i s LYS 55 N -0.92 0.94 -0.26 4.82 2.20 0.50 -2.19 119.74 124.82 3b9i s LYS 55 Ca -0.02 -0.08 -0.12 0.00 -0.36 0.00 0.00 55.97 55.38 3b9i s LYS 55 Cb -0.07 -1.04 -0.05 0.00 -1.51 0.00 0.00 37.83 35.17 3b9i s LYS 55 CO 0.00 -0.17 0.25 0.12 -0.36 0.00 0.00 175.35 175.19 3b9i s PHE 56 N 1.35 3.26 -0.36 4.03 5.36 0.20 0.97 117.98 132.79 3b9i s PHE 56 Ca -0.04 0.27 -0.17 0.00 -0.96 0.00 0.00 56.93 56.03 3b9i s PHE 56 Cb -0.13 -2.42 -0.00 0.00 -0.34 0.00 0.00 43.02 40.13 3b9i s PHE 56 CO -0.03 -0.11 0.47 -1.21 -1.46 0.00 0.00 175.22 172.88 3b9i s GLU 57 N 1.64 3.51 0.52 10.12 0.41 -0.18 -2.26 118.70 132.47 3b9i s GLU 57 Ca 0.10 -0.33 0.30 0.00 -0.41 0.00 0.00 54.97 54.64 3b9i s GLU 57 Cb -0.15 -3.84 1.38 0.00 -1.78 0.00 0.00 34.13 29.74 3b9i s GLU 57 CO 0.09 -0.67 2.01 1.25 -0.49 0.00 0.00 175.26 177.45 3b9i h LEU 58 N 9.04 0.00 -0.95 1.80 5.85 -1.46 0.87 115.31 130.45 3b9i h LEU 58 Ca -0.28 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.35 3b9i h LEU 58 Cb 1.13 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 3b9i h LEU 58 CO 0.76 0.10 -0.26 0.77 -0.34 0.00 0.00 178.44 179.48 3b9i h SER 59 N 0.00 0.45 0.00 1.25 4.64 -1.74 -3.28 113.55 114.88 3b9i h SER 59 Ca -0.00 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 3b9i h SER 59 Cb 0.47 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 3b9i h SER 59 CO 0.01 0.71 -0.87 -1.54 -0.87 0.00 0.00 176.83 174.28 3b9i n SER 60 N -4.12 1.29 -3.51 4.97 3.41 -1.05 -4.98 113.62 109.64 3b9i n SER 60 Ca -0.00 -0.46 -0.25 0.00 -0.26 0.00 0.00 58.87 57.90 3b9i n SER 60 Cb 0.41 1.18 0.06 0.00 -0.26 0.00 0.00 64.21 65.60 3b9i n SER 60 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3b9i n SER 61 N -1.48 -5.96 -4.49 4.04 7.64 0.27 -5.00 113.62 108.64 3b9i n SER 61 Ca 0.00 -0.52 -0.30 0.00 1.01 0.00 0.00 58.87 59.07 3b9i n SER 61 Cb 0.20 -4.73 -0.12 0.00 -1.01 0.00 0.00 64.21 58.55 3b9i n SER 61 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3b9i s LYS 62 N -6.22 1.99 0.06 1.43 -0.14 -1.18 -4.87 119.74 110.82 3b9i s LYS 62 Ca 0.53 -1.05 -0.13 0.00 -1.36 0.00 0.00 55.97 53.96 3b9i s LYS 62 Cb -0.24 -2.19 -0.06 0.00 -1.68 0.00 0.00 37.83 33.66 3b9i s LYS 62 CO 0.65 0.52 0.44 -1.58 -0.76 0.00 0.00 175.35 174.62 3b9i s TRP 63 N -1.05 3.65 -0.07 3.18 0.52 -1.26 -1.01 118.94 122.90 3b9i s TRP 63 Ca 0.17 0.93 0.03 0.00 0.02 0.00 0.00 56.10 57.25 3b9i s TRP 63 Cb -0.11 -2.26 -0.02 0.00 -1.15 0.00 0.00 33.47 29.93 3b9i s TRP 63 CO 0.08 0.55 -0.15 -1.01 0.02 0.00 0.00 176.95 176.45 3b9i s HIS 64 N -1.28 2.72 0.04 -1.98 3.76 0.27 -4.94 115.29 113.88 3b9i s HIS 64 Ca 0.30 -0.34 -0.01 0.00 -0.15 0.00 0.00 55.06 54.86 3b9i s HIS 64 Cb -0.15 -1.69 -0.03 0.00 1.11 0.00 0.00 32.58 31.81 3b9i s HIS 64 CO 0.16 0.04 -0.03 -1.64 -0.85 0.00 0.00 174.74 172.43 3b9i s MET 65 N -0.37 0.50 0.25 1.40 1.00 -1.26 -0.37 119.30 120.45 3b9i s MET 65 Ca 0.04 -0.98 0.10 0.00 0.00 0.00 0.00 55.69 54.85 3b9i s MET 65 Cb -0.12 0.17 0.28 0.00 0.00 0.00 0.00 34.83 35.16 3b9i s MET 65 CO 0.02 -0.09 1.57 1.79 0.00 0.00 0.00 175.02 178.31 3b9i h THR 66 N 3.72 1.47 -3.74 2.05 1.35 -1.80 -3.47 112.91 112.50 3b9i h THR 66 Ca -0.33 -2.27 -0.09 0.00 -0.55 0.00 0.00 66.41 63.17 3b9i h THR 66 Cb 1.17 2.22 -0.15 0.00 -1.73 0.00 0.00 68.15 69.66 3b9i h THR 66 CO 0.56 0.65 -0.38 -0.55 -0.25 0.00 0.00 175.52 175.55 3b9i s SER 67 N -6.84 0.10 0.29 5.36 0.15 -1.26 -5.06 113.70 106.45 3b9i s SER 67 Ca -0.01 -0.57 0.01 0.00 0.70 0.00 0.00 55.95 56.08 3b9i s SER 67 Cb 0.12 0.32 0.54 0.00 -1.71 0.00 0.00 66.02 65.30 3b9i s SER 67 CO 0.77 -0.68 1.87 -0.65 1.20 0.00 0.00 173.24 175.76 3b9i h PRO 68 N 2.97 0.99 -2.67 5.44 0.11 -2.03 -3.33 132.00 133.48 3b9i h PRO 68 Ca -0.33 -0.06 -0.59 0.00 0.11 0.00 0.00 66.00 65.13 3b9i h PRO 68 Cb 1.20 -0.22 -0.39 0.00 0.11 0.00 0.00 31.00 31.69 3b9i h PRO 68 CO 0.54 0.65 -0.83 0.15 -0.21 0.00 0.00 178.00 178.31 3b9i s LYS 69 N -5.93 0.73 0.18 1.05 1.02 -1.26 -5.12 119.74 110.41 3b9i s LYS 69 Ca -0.12 -1.51 -0.33 0.00 0.02 0.00 0.00 55.97 54.03 3b9i s LYS 69 Cb 0.21 -1.55 -0.13 0.00 -0.52 0.00 0.00 37.83 35.84 3b9i s LYS 69 CO 0.80 -1.20 1.61 -2.30 -0.92 0.00 0.00 175.35 173.34 3b9i n PRO 70 N 3.89 2.31 0.21 -1.68 -0.02 -1.25 -4.89 135.00 133.58 3b9i n PRO 70 Ca 0.12 0.83 0.05 0.00 -2.02 0.00 0.00 63.50 62.49 3b9i n PRO 70 Cb 0.37 -2.62 0.47 0.00 -0.02 0.00 0.00 33.50 31.69 3b9i n PRO 70 CO 0.00 0.00 0.00 1.12 1.98 0.00 0.00 175.50 178.60 3b9i h HIS 71 N 6.10 0.00 0.00 6.00 2.07 -1.96 -3.30 115.15 124.06 3b9i h HIS 71 Ca -0.44 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.08 3b9i h HIS 71 Cb 1.24 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.22 3b9i h HIS 71 CO 0.63 0.27 -0.85 0.00 -3.07 0.00 0.00 177.93 174.91 3b9i s VAL 73 N -3.13 0.00 -0.19 0.00 0.11 -1.24 -0.65 120.40 115.30 3b9i s VAL 73 Ca 0.06 -0.04 -0.07 0.00 -2.93 0.00 0.00 61.98 59.01 3b9i s VAL 73 Cb 0.15 -0.93 -0.04 0.00 -1.53 0.00 0.00 36.38 34.04 3b9i s VAL 73 CO 0.77 -0.02 0.04 0.20 -3.33 0.00 0.00 175.10 172.76 3b9i s ASN 74 N -0.51 5.33 0.11 3.54 0.01 0.13 -4.60 114.94 118.95 3b9i s ASN 74 Ca -0.06 -0.03 0.07 0.00 -0.71 0.00 0.00 52.86 52.12 3b9i s ASN 74 Cb -0.03 -1.91 -0.04 0.00 0.41 0.00 0.00 41.25 39.68 3b9i s ASN 74 CO 0.05 0.12 -0.07 0.42 -1.51 0.00 0.00 177.10 176.11 3b9i s THR 75 N 0.67 3.51 0.13 1.60 -4.23 -1.26 0.50 115.64 116.55 3b9i s THR 75 Ca 0.02 -1.25 0.04 0.00 -1.18 0.00 0.00 61.69 59.32 3b9i s THR 75 Cb -0.13 -2.66 -0.04 0.00 1.34 0.00 0.00 72.50 71.00 3b9i s THR 75 CO 0.02 0.08 -0.10 0.42 -0.54 0.00 0.00 174.62 174.51 3b9i s THR 76 N -1.29 1.06 -1.56 3.99 -4.23 -0.98 -5.00 115.64 107.63 3b9i s THR 76 Ca 0.23 -1.93 0.23 0.00 -1.18 0.00 0.00 61.69 59.03 3b9i s THR 76 Cb -0.11 -1.70 0.46 0.00 1.34 0.00 0.00 72.50 72.49 3b9i s THR 76 CO 0.15 -0.70 1.74 -1.54 -0.54 0.00 0.00 174.62 173.72 3b9i n SER 77 N 0.03 0.00 -0.21 3.99 3.41 -1.26 -1.59 113.62 118.00 3b9i n SER 77 Ca -0.12 -0.19 0.14 0.00 -0.26 0.00 0.00 58.87 58.44 3b9i n SER 77 Cb 0.60 -0.22 0.63 0.00 -0.26 0.00 0.00 64.21 64.95 3b9i n SER 77 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3b9i n ASP 78 N -1.22 0.72 0.00 4.04 5.68 -1.26 -4.90 116.55 119.61 3b9i n ASP 78 Ca 0.12 -0.94 0.00 0.00 -0.50 0.00 0.00 54.79 53.47 3b9i n ASP 78 Cb 0.16 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 3b9i n ASP 78 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3b9i n GLY 79 N 1.20 0.77 3.95 6.12 0.00 -0.62 -5.06 105.19 111.55 3b9i n GLY 79 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 3b9i n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3b9i s LYS 80 N -0.59 2.22 0.14 1.61 1.02 -1.25 -4.74 119.74 118.15 3b9i s LYS 80 Ca 0.00 -0.47 -0.16 0.00 0.02 0.00 0.00 55.97 55.36 3b9i s LYS 80 Cb 0.00 -2.26 0.03 0.00 -0.52 0.00 0.00 37.83 35.08 3b9i s LYS 80 CO 0.00 -1.14 0.43 -0.48 -0.92 0.00 0.00 175.35 173.24 3b9i s LEU 81 N -5.12 0.32 -0.07 3.17 0.05 -0.67 -2.33 118.68 114.03 3b9i s LEU 81 Ca 0.60 -0.37 -0.00 0.00 0.05 0.00 0.00 54.13 54.41 3b9i s LEU 81 Cb -0.10 1.91 0.02 0.00 -2.05 0.00 0.00 46.19 45.97 3b9i s LEU 81 CO 0.43 -0.90 -0.03 -0.75 -0.55 0.00 0.00 176.35 174.54 3b9i s LYS 82 N -3.82 0.87 0.17 1.48 2.20 0.18 -0.49 119.74 120.33 3b9i s LYS 82 Ca 0.05 -0.05 -0.32 0.00 -0.36 0.00 0.00 55.97 55.29 3b9i s LYS 82 Cb 0.01 -1.02 -0.10 0.00 -1.51 0.00 0.00 37.83 35.21 3b9i s LYS 82 CO -0.09 -0.20 1.61 0.42 -0.36 0.00 0.00 175.35 176.73 3b9i s ILE 83 N 1.45 2.49 -0.11 5.43 -1.09 -0.23 0.20 121.20 129.34 3b9i s ILE 83 Ca -0.02 0.34 0.13 0.00 -2.23 0.00 0.00 60.65 58.87 3b9i s ILE 83 Cb -0.13 -3.22 -0.19 0.00 -1.58 0.00 0.00 42.46 37.34 3b9i s ILE 83 CO -0.03 0.03 0.11 0.18 -1.23 0.00 0.00 174.94 174.00 3b9i n LEU 84 N 4.05 0.00 -4.16 2.97 4.77 0.17 0.43 117.00 125.23 3b9i n LEU 84 Ca 0.14 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.79 3b9i n LEU 84 Cb 0.38 0.27 -0.15 0.00 -2.33 0.00 0.00 43.42 41.59 3b9i n LEU 84 CO 0.62 0.27 -0.46 -1.58 -1.33 0.00 0.00 177.39 174.91 3b9i s GLN 85 N -2.50 2.84 0.39 3.23 2.00 -1.11 -4.55 119.66 119.95 3b9i s GLN 85 Ca -0.07 -0.96 -0.28 0.00 -2.00 0.00 0.00 55.36 52.06 3b9i s GLN 85 Cb 0.05 -2.81 -0.10 0.00 0.80 0.00 0.00 33.01 30.95 3b9i s GLN 85 CO 0.59 -0.34 1.45 -1.12 -0.50 0.00 0.00 175.29 175.36 3b9i s SER 86 N 1.29 6.31 0.00 6.67 0.01 -1.26 -4.53 113.70 122.18 3b9i s SER 86 Ca 0.01 2.97 0.00 0.00 1.31 0.00 0.00 55.95 60.23 3b9i s SER 86 Cb -0.16 -2.66 0.00 0.00 0.21 0.00 0.00 66.02 63.41 3b9i s SER 86 CO -0.08 -0.89 0.00 0.61 0.41 0.00 0.00 173.24 173.30 3b9i n GLY 87 N 0.53 -2.11 3.69 3.44 0.00 -0.75 -4.95 105.19 105.04 3b9i n GLY 87 Ca 0.02 -1.20 -0.41 0.00 0.00 0.00 0.00 46.02 44.43 3b9i n GLY 87 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3b9i s THR 88 N -2.29 4.93 0.13 2.61 2.01 -1.26 -1.03 115.64 120.73 3b9i s THR 88 Ca 0.00 1.63 0.10 0.00 0.31 0.00 0.00 61.69 63.73 3b9i s THR 88 Cb 0.00 -4.13 -0.04 0.00 0.01 0.00 0.00 72.50 68.34 3b9i s THR 88 CO 0.00 0.12 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.50 3b9i s TYR 89 N 1.56 2.10 -0.36 4.92 2.02 0.51 -0.55 117.35 127.55 3b9i s TYR 89 Ca 0.40 -0.40 -0.09 0.00 -0.37 0.00 0.00 57.07 56.62 3b9i s TYR 89 Cb -0.18 -1.13 0.04 0.00 -0.40 0.00 0.00 41.96 40.29 3b9i s TYR 89 CO 0.16 0.31 0.17 -1.17 -1.57 0.00 0.00 175.55 173.45 3b9i s LEU 90 N -2.08 4.59 -0.05 -1.29 2.96 -0.48 -0.04 118.68 122.30 3b9i s LEU 90 Ca 0.12 -1.11 -0.21 0.00 -0.22 0.00 0.00 54.13 52.70 3b9i s LEU 90 Cb -0.10 -1.95 -0.05 0.00 0.50 0.00 0.00 46.19 44.60 3b9i s LEU 90 CO 0.06 -0.38 0.61 -0.63 -1.32 0.00 0.00 176.35 174.69 3b9i s ILE 91 N 1.47 5.01 0.30 6.68 1.01 -0.18 -1.60 121.20 133.90 3b9i s ILE 91 Ca 0.00 1.26 0.04 0.00 0.00 0.00 0.00 60.65 61.96 3b9i s ILE 91 Cb -0.20 -3.95 -0.03 0.00 0.01 0.00 0.00 42.46 38.29 3b9i s ILE 91 CO 0.05 0.34 0.27 -0.72 0.00 0.00 0.00 174.94 174.88 3b9i s TYR 92 N 0.33 1.52 0.00 3.97 -0.85 -0.82 -0.10 117.35 121.40 3b9i s TYR 92 Ca 0.32 -1.54 0.00 0.00 -0.52 0.00 0.00 57.07 55.33 3b9i s TYR 92 Cb -0.17 -0.59 0.00 0.00 0.38 0.00 0.00 41.96 41.57 3b9i s TYR 92 CO 0.16 -0.85 0.00 0.41 -1.52 0.00 0.00 175.55 173.75 3b9i n GLY 93 N -0.53 1.77 2.89 5.49 0.00 -1.23 -2.16 105.19 111.42 3b9i n GLY 93 Ca 0.05 -1.12 -0.21 0.00 0.00 0.00 0.00 46.02 44.75 3b9i n GLY 93 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3b9i s GLN 94 N -2.00 0.87 -0.28 1.61 -0.21 0.64 -1.96 119.66 118.33 3b9i s GLN 94 Ca 0.00 -0.11 -0.08 0.00 0.02 0.00 0.00 55.36 55.19 3b9i s GLN 94 Cb 0.00 -0.90 -0.01 0.00 1.00 0.00 0.00 33.01 33.10 3b9i s GLN 94 CO 0.00 -0.10 0.10 0.08 -2.12 0.00 0.00 175.29 173.25 3b9i s VAL 95 N 1.03 4.34 -0.28 1.09 1.01 0.36 -1.69 120.40 126.25 3b9i s VAL 95 Ca -0.09 -0.40 -0.12 0.00 0.00 0.00 0.00 61.98 61.37 3b9i s VAL 95 Cb -0.14 -3.15 -0.05 0.00 0.00 0.00 0.00 36.38 33.04 3b9i s VAL 95 CO -0.00 0.17 0.23 -0.63 0.00 0.00 0.00 175.10 174.87 3b9i s ILE 96 N 1.59 5.28 0.38 2.22 -1.09 -1.26 -1.56 121.20 126.75 3b9i s ILE 96 Ca 0.05 0.25 -0.15 0.00 -2.23 0.00 0.00 60.65 58.56 3b9i s ILE 96 Cb -0.16 -3.57 -0.09 0.00 -1.58 0.00 0.00 42.46 37.06 3b9i s ILE 96 CO 0.04 0.22 0.82 -2.16 -1.23 0.00 0.00 174.94 172.63 3b9i s PRO 97 N 1.83 4.00 0.72 2.79 0.04 -1.26 -0.87 135.00 142.25 3b9i s PRO 97 Ca 0.09 0.75 -0.14 0.00 0.04 0.00 0.00 61.00 61.75 3b9i s PRO 97 Cb -0.16 -2.34 0.03 0.00 0.04 0.00 0.00 34.50 32.08 3b9i s PRO 97 CO 0.11 0.03 1.13 0.14 0.04 0.00 0.00 177.00 178.45 3b9i s VAL 98 N -2.18 2.94 0.25 -0.36 -7.23 -0.12 -4.61 120.40 109.09 3b9i s VAL 98 Ca 0.56 0.40 -0.30 0.00 -1.81 0.00 0.00 61.98 60.83 3b9i s VAL 98 Cb -0.10 -2.87 -0.15 0.00 0.56 0.00 0.00 36.38 33.82 3b9i s VAL 98 CO 0.21 -0.31 1.06 -0.67 -0.31 0.00 0.00 175.10 175.09 3b9i n ASP 99 N -2.90 1.32 -0.12 4.85 -0.08 -1.26 -4.87 116.55 113.50 3b9i n ASP 99 Ca 0.11 1.16 0.22 0.00 -1.51 0.00 0.00 54.79 54.77 3b9i n ASP 99 Cb 0.52 -1.26 0.64 0.00 2.34 0.00 0.00 41.12 43.36 3b9i n ASP 99 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 3b9i h LYS 100 N 2.51 0.12 0.00 -0.67 1.57 -1.93 -0.70 116.57 117.48 3b9i h LYS 100 Ca -0.41 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 3b9i h LYS 100 Cb 1.34 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.62 3b9i h LYS 100 CO 0.64 0.08 0.00 0.36 -0.57 0.00 0.00 179.45 179.96 3b9i n LYS 101 N -4.38 0.09 0.01 3.15 2.85 -1.26 -2.35 118.16 116.26 3b9i n LYS 101 Ca 0.15 0.42 0.11 0.00 -1.05 0.00 0.00 58.31 57.94 3b9i n LYS 101 Cb 0.72 -1.70 0.05 0.00 -0.65 0.00 0.00 35.03 33.44 3b9i n LYS 101 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3b9i n TYR 102 N -1.87 0.08 -1.67 5.58 4.02 -0.27 -4.95 117.16 118.08 3b9i n TYR 102 Ca 0.01 0.02 -0.43 0.00 -0.01 0.00 0.00 57.90 57.50 3b9i n TYR 102 Cb 0.13 -0.22 -0.03 0.00 -0.02 0.00 0.00 39.34 39.19 3b9i n TYR 102 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 3b9i n ILE 103 N -1.65 0.60 -0.07 -0.72 2.08 -0.99 -4.89 119.36 113.72 3b9i n ILE 103 Ca 0.04 -0.11 -0.07 0.00 0.56 0.00 0.00 62.75 63.17 3b9i n ILE 103 Cb 0.37 -2.22 -0.03 0.00 -0.75 0.00 0.00 39.64 37.01 3b9i n ILE 103 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 3b9i h LYS 104 N 9.72 0.00 0.00 0.38 1.63 -1.92 -3.49 116.57 122.89 3b9i h LYS 104 Ca -0.48 0.00 -0.32 0.00 -0.85 0.00 0.00 60.65 59.00 3b9i h LYS 104 Cb 1.24 0.00 0.16 0.00 -0.60 0.00 0.00 32.23 33.02 3b9i h LYS 104 CO 0.94 0.18 0.10 -0.40 -3.45 0.00 0.00 179.45 176.82 3b9i n ASP 105 N -4.60 -1.79 -0.51 4.20 5.68 -1.26 -5.01 116.55 113.26 3b9i n ASP 105 Ca -0.11 -1.05 0.05 0.00 -0.50 0.00 0.00 54.79 53.18 3b9i n ASP 105 Cb 0.32 -0.80 0.10 0.00 -1.14 0.00 0.00 41.12 39.60 3b9i n ASP 105 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 3b9i n ASN 106 N -4.46 2.48 -4.76 -1.12 5.15 -1.26 -5.02 115.26 106.28 3b9i n ASN 106 Ca 0.12 -1.80 -0.40 0.00 -0.60 0.00 0.00 54.58 51.90 3b9i n ASN 106 Cb 0.47 -0.14 -0.04 0.00 -0.53 0.00 0.00 39.78 39.55 3b9i n ASN 106 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3b9i s ALA 107 N -0.94 3.44 0.70 5.20 0.00 -1.26 -5.05 121.76 123.84 3b9i s ALA 107 Ca 0.18 1.00 -0.11 0.00 0.00 0.00 0.00 51.96 53.03 3b9i s ALA 107 Cb 0.10 -3.37 0.01 0.00 0.00 0.00 0.00 23.12 19.86 3b9i s ALA 107 CO 0.13 -0.31 1.07 -1.25 0.00 0.00 0.00 175.76 175.40 3b9i s PRO 108 N -1.50 2.87 -0.71 0.00 0.04 -1.26 -4.96 135.00 129.48 3b9i s PRO 108 Ca 0.46 1.02 -0.27 0.00 0.04 0.00 0.00 61.00 62.25 3b9i s PRO 108 Cb -0.34 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 32.23 3b9i s PRO 108 CO 0.44 -1.16 1.45 0.12 0.04 0.00 0.00 177.00 177.89 3b9i s PHE 109 N -2.95 2.11 -0.03 0.56 5.36 -1.26 -4.76 117.98 117.00 3b9i s PHE 109 Ca 0.59 0.17 0.04 0.00 -0.96 0.00 0.00 56.93 56.77 3b9i s PHE 109 Cb -0.15 -4.48 -0.00 0.00 -0.34 0.00 0.00 43.02 38.05 3b9i s PHE 109 CO 0.53 -2.14 -0.14 0.08 -1.46 0.00 0.00 175.22 172.09 3b9i s VAL 110 N 6.68 1.15 -0.04 3.12 1.01 -1.26 -3.29 120.40 127.77 3b9i s VAL 110 Ca 0.44 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.88 3b9i s VAL 110 Cb -0.09 -0.99 0.00 0.00 0.00 0.00 0.00 36.38 35.30 3b9i s VAL 110 CO 0.16 0.34 -0.12 -0.69 0.00 0.00 0.00 175.10 174.78 3b9i s VAL 111 N 0.04 1.10 0.02 2.92 1.01 0.37 -1.92 120.40 123.95 3b9i s VAL 111 Ca -0.02 -0.50 0.06 0.00 0.00 0.00 0.00 61.98 61.51 3b9i s VAL 111 Cb -0.10 -0.97 -0.02 0.00 0.00 0.00 0.00 36.38 35.29 3b9i s VAL 111 CO 0.01 0.33 -0.18 -1.10 0.00 0.00 0.00 175.10 174.16 3b9i s GLN 112 N 0.32 1.30 -0.20 2.72 -0.21 0.35 -0.11 119.66 123.84 3b9i s GLN 112 Ca -0.07 -0.78 -0.06 0.00 0.02 0.00 0.00 55.36 54.46 3b9i s GLN 112 Cb -0.12 -1.34 -0.03 0.00 1.00 0.00 0.00 33.01 32.52 3b9i s GLN 112 CO 0.02 0.35 0.03 0.42 -2.12 0.00 0.00 175.29 173.99 3b9i s ILE 113 N -0.66 4.19 -0.13 1.08 1.01 0.38 -0.64 121.20 126.43 3b9i s ILE 113 Ca 0.06 -0.23 -0.06 0.00 0.00 0.00 0.00 60.65 60.41 3b9i s ILE 113 Cb -0.08 -2.90 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 3b9i s ILE 113 CO 0.01 0.42 0.10 -0.31 0.00 0.00 0.00 174.94 175.16 3b9i s TYR 114 N 0.98 3.44 -0.32 3.97 1.51 0.62 0.12 117.35 127.67 3b9i s TYR 114 Ca 0.02 0.38 -0.07 0.00 -1.01 0.00 0.00 57.07 56.39 3b9i s TYR 114 Cb -0.14 -1.96 0.02 0.00 -0.11 0.00 0.00 41.96 39.78 3b9i s TYR 114 CO 0.02 0.55 0.10 0.21 -1.11 0.00 0.00 175.55 175.32 3b9i s LYS 115 N -0.64 2.86 4.56 -0.62 2.20 -0.05 -2.34 119.74 125.70 3b9i s LYS 115 Ca 0.12 -1.02 0.00 0.00 -0.36 0.00 0.00 55.97 54.71 3b9i s LYS 115 Cb -0.12 -3.43 0.00 0.00 -1.51 0.00 0.00 37.83 32.77 3b9i s LYS 115 CO 0.02 -0.56 0.00 1.63 -0.36 0.00 0.00 175.35 176.08 3b9i n LYS 116 N 4.85 0.00 0.00 4.03 5.02 0.13 -2.11 118.16 130.08 3b9i n LYS 116 Ca -0.13 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.20 3b9i n LYS 116 Cb 0.46 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.44 3b9i n LYS 116 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3b9i n ASN 117 N 9.59 0.69 -4.74 4.39 3.02 -1.26 -4.95 115.26 122.01 3b9i n ASN 117 Ca 0.00 -0.85 -0.35 0.00 -0.03 0.00 0.00 54.58 53.35 3b9i n ASN 117 Cb 0.00 0.81 -0.08 0.00 -0.61 0.00 0.00 39.78 39.90 3b9i n ASN 117 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3b9i s ASP 118 N -1.65 5.76 0.24 6.41 1.01 -0.90 -5.06 116.67 122.47 3b9i s ASP 118 Ca 0.05 0.24 -0.31 0.00 0.71 0.00 0.00 52.55 53.24 3b9i s ASP 118 Cb 0.07 -1.83 -0.13 0.00 1.01 0.00 0.00 42.92 42.04 3b9i s ASP 118 CO 0.32 0.33 1.44 0.52 0.21 0.00 0.00 175.17 177.99 3b9i n VAL 119 N 2.50 0.86 -0.07 -1.27 0.31 -1.26 -0.87 118.33 118.52 3b9i n VAL 119 Ca -0.18 -0.21 -0.08 0.00 -0.01 0.00 0.00 64.34 63.85 3b9i n VAL 119 Cb 0.54 -1.52 -0.10 0.00 -0.91 0.00 0.00 33.84 31.85 3b9i n VAL 119 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 3b9i n LEU 120 N 2.28 0.85 -3.72 7.52 7.94 0.31 -4.76 117.00 127.43 3b9i n LEU 120 Ca 0.12 -0.03 -0.11 0.00 -1.11 0.00 0.00 56.01 54.88 3b9i n LEU 120 Cb 0.32 0.07 -0.11 0.00 0.53 0.00 0.00 43.42 44.22 3b9i n LEU 120 CO 0.63 0.47 -0.01 -1.58 -1.11 0.00 0.00 177.39 175.79 3b9i s GLN 121 N -2.34 0.34 -0.18 1.96 0.74 -0.79 -4.98 119.66 114.41 3b9i s GLN 121 Ca -0.12 0.66 -0.01 0.00 0.05 0.00 0.00 55.36 55.94 3b9i s GLN 121 Cb 0.05 -0.01 0.00 0.00 1.10 0.00 0.00 33.01 34.15 3b9i s GLN 121 CO 0.52 -0.14 -0.13 0.99 -0.55 0.00 0.00 175.29 175.98 3b9i s THR 122 N 1.13 2.69 0.07 -0.34 2.01 -1.26 -0.47 115.64 119.47 3b9i s THR 122 Ca -0.08 -0.74 0.07 0.00 0.31 0.00 0.00 61.69 61.25 3b9i s THR 122 Cb -0.08 -2.16 -0.03 0.00 0.01 0.00 0.00 72.50 70.24 3b9i s THR 122 CO -0.09 0.50 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.39 3b9i s LEU 123 N 1.15 2.24 -0.16 4.42 1.43 0.85 -5.00 118.68 123.60 3b9i s LEU 123 Ca 0.01 -0.59 -0.28 0.00 -1.03 0.00 0.00 54.13 52.24 3b9i s LEU 123 Cb -0.14 -0.82 0.07 0.00 0.03 0.00 0.00 46.19 45.33 3b9i s LEU 123 CO -0.05 0.07 0.72 0.00 0.23 0.00 0.00 176.35 177.32 3b9i s MET 124 N -1.55 0.92 0.20 1.70 0.23 -1.26 -0.48 119.30 119.06 3b9i s MET 124 Ca 0.05 0.60 -0.05 0.00 -1.03 0.00 0.00 55.69 55.26 3b9i s MET 124 Cb -0.09 0.44 0.02 0.00 -1.53 0.00 0.00 34.83 33.67 3b9i s MET 124 CO 0.03 -0.21 0.36 0.27 -2.03 0.00 0.00 175.02 173.44 3b9i n ASN 125 N 1.75 -1.04 -3.56 -1.18 0.23 -1.21 -5.04 115.26 105.22 3b9i n ASN 125 Ca -0.16 -1.89 -0.41 0.00 -0.53 0.00 0.00 54.58 51.59 3b9i n ASN 125 Cb 0.56 1.78 -0.01 0.00 -2.08 0.00 0.00 39.78 40.03 3b9i n ASN 125 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 3b9i n ASP 126 N -1.48 6.48 -3.96 0.53 2.03 -1.26 -4.49 116.55 114.40 3b9i n ASP 126 Ca -0.03 -2.82 -0.31 0.00 0.52 0.00 0.00 54.79 52.14 3b9i n ASP 126 Cb 0.31 -1.55 -0.01 0.00 -0.72 0.00 0.00 41.12 39.15 3b9i n ASP 126 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3b9i n PHE 127 N 4.20 -1.61 -4.66 -0.67 3.72 -1.26 -5.01 117.46 112.17 3b9i n PHE 127 Ca 0.62 0.54 -0.29 0.00 -0.05 0.00 0.00 57.45 58.26 3b9i n PHE 127 Cb 0.31 -3.37 -0.10 0.00 -0.94 0.00 0.00 39.48 35.38 3b9i n PHE 127 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3b9i s GLN 128 N -6.69 2.03 0.30 -1.08 -0.21 -1.26 -4.78 119.66 107.97 3b9i s GLN 128 Ca 0.20 -2.20 -0.28 0.00 0.02 0.00 0.00 55.36 53.11 3b9i s GLN 128 Cb -0.09 -1.60 -0.14 0.00 1.00 0.00 0.00 33.01 32.19 3b9i s GLN 128 CO 0.91 -0.15 1.01 1.51 -2.12 0.00 0.00 175.29 176.46 3b9i n ILE 129 N -1.05 2.02 -3.56 1.08 3.06 -1.26 -4.48 119.36 115.17 3b9i n ILE 129 Ca -0.09 -0.50 -0.29 0.00 -2.50 0.00 0.00 62.75 59.37 3b9i n ILE 129 Cb 0.67 -1.03 -0.12 0.00 0.54 0.00 0.00 39.64 39.70 3b9i n ILE 129 CO 0.00 0.00 0.00 -0.22 -2.50 0.00 0.00 176.55 173.83 3b9i s LEU 130 N 0.34 1.59 0.46 9.51 2.96 -0.60 -4.99 118.68 127.94 3b9i s LEU 130 Ca 0.59 -2.30 -0.24 0.00 -0.22 0.00 0.00 54.13 51.95 3b9i s LEU 130 Cb -0.68 -0.63 -0.08 0.00 0.50 0.00 0.00 46.19 45.31 3b9i s LEU 130 CO 0.60 -0.30 1.36 -2.84 -1.32 0.00 0.00 176.35 173.85 3b9i s PRO 131 N 0.86 3.64 0.30 0.98 0.02 -1.26 -0.49 135.00 139.04 3b9i s PRO 131 Ca 0.17 2.26 0.06 0.00 0.02 0.00 0.00 61.00 63.52 3b9i s PRO 131 Cb -0.23 -2.57 -0.06 0.00 0.02 0.00 0.00 34.50 31.65 3b9i s PRO 131 CO -0.00 -0.80 -0.04 0.96 -0.33 0.00 0.00 177.00 176.79 3b9i s ILE 132 N -1.26 1.63 0.00 2.83 -4.36 -0.83 -4.91 121.20 114.30 3b9i s ILE 132 Ca 0.62 -2.10 0.00 0.00 -0.26 0.00 0.00 60.65 58.91 3b9i s ILE 132 Cb -0.40 -2.55 0.00 0.00 1.25 0.00 0.00 42.46 40.76 3b9i s ILE 132 CO 0.51 -0.23 0.00 0.61 0.24 0.00 0.00 174.94 176.07 3b9i n GLY 133 N -0.63 0.44 0.00 6.27 0.00 -1.26 -3.55 105.19 106.46 3b9i n GLY 133 Ca -0.05 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.42 3b9i n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b9i n GLY 134 N 0.00 0.97 3.69 -0.02 0.00 0.86 -4.97 105.19 105.72 3b9i n GLY 134 Ca 0.00 -1.97 -0.41 0.00 0.00 0.00 0.00 46.02 43.64 3b9i n GLY 134 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b9i s VAL 135 N -1.42 4.92 -0.01 1.61 1.01 -1.26 -1.01 120.40 124.24 3b9i s VAL 135 Ca 0.00 1.65 0.00 0.00 0.00 0.00 0.00 61.98 63.63 3b9i s VAL 135 Cb 0.00 -4.14 0.01 0.00 0.00 0.00 0.00 36.38 32.25 3b9i s VAL 135 CO 0.00 0.10 0.01 -0.31 0.00 0.00 0.00 175.10 174.90 3b9i s TYR 136 N 1.65 0.07 -0.18 5.22 2.02 0.95 -4.98 117.35 122.10 3b9i s TYR 136 Ca 0.40 0.03 -0.29 0.00 -0.37 0.00 0.00 57.07 56.84 3b9i s TYR 136 Cb -0.17 -0.13 -0.02 0.00 -0.40 0.00 0.00 41.96 41.23 3b9i s TYR 136 CO 0.16 -0.04 1.44 -1.21 -1.57 0.00 0.00 175.55 174.33 3b9i s GLU 137 N 0.41 4.05 0.26 -0.62 0.41 -1.26 -0.36 118.70 121.59 3b9i s GLU 137 Ca -0.03 1.69 0.11 0.00 -0.41 0.00 0.00 54.97 56.33 3b9i s GLU 137 Cb -0.05 -3.90 -0.05 0.00 -1.78 0.00 0.00 34.13 28.35 3b9i s GLU 137 CO -0.01 -0.96 -0.19 -0.51 -0.49 0.00 0.00 175.26 173.10 3b9i s LEU 138 N 4.19 2.57 0.03 1.80 1.43 -0.20 -4.97 118.68 123.54 3b9i s LEU 138 Ca 0.63 -1.02 0.08 0.00 -1.03 0.00 0.00 54.13 52.79 3b9i s LEU 138 Cb -0.24 -1.03 -0.03 0.00 0.03 0.00 0.00 46.19 44.92 3b9i s LEU 138 CO 0.23 0.01 -0.22 -1.00 0.23 0.00 0.00 176.35 175.60 3b9i s HIS 139 N -2.53 2.45 -0.47 0.29 3.76 -1.26 -1.81 115.29 115.72 3b9i s HIS 139 Ca 0.28 -0.33 -0.43 0.00 -0.15 0.00 0.00 55.06 54.43 3b9i s HIS 139 Cb -0.04 -1.46 -0.18 0.00 1.11 0.00 0.00 32.58 32.00 3b9i s HIS 139 CO 0.13 0.16 1.56 0.00 -0.85 0.00 0.00 174.74 175.75 3b9i n ALA 140 N 1.82 -1.06 0.00 -1.40 0.00 -1.26 -0.36 120.51 118.26 3b9i n ALA 140 Ca -0.16 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.70 3b9i n ALA 140 Cb 0.52 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.16 3b9i n ALA 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b9i n GLY 141 N 4.19 1.93 3.64 0.00 0.00 0.17 -4.96 105.19 110.15 3b9i n GLY 141 Ca 0.32 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.92 3b9i n GLY 141 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3b9i s ASP 142 N -0.67 6.20 -0.09 1.61 1.01 0.52 -4.71 116.67 120.54 3b9i s ASP 142 Ca 0.00 2.32 -0.30 0.00 0.71 0.00 0.00 52.55 55.29 3b9i s ASP 142 Cb 0.00 -2.53 -0.02 0.00 1.01 0.00 0.00 42.92 41.39 3b9i s ASP 142 CO 0.00 -1.30 1.01 0.20 0.21 0.00 0.00 175.17 175.29 3b9i s ASN 143 N 5.31 7.26 -0.14 0.27 0.01 -1.26 -1.07 114.94 125.31 3b9i s ASN 143 Ca 0.88 1.56 -0.00 0.00 -0.71 0.00 0.00 52.86 54.59 3b9i s ASN 143 Cb -0.37 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 38.72 3b9i s ASN 143 CO 0.38 -0.43 -0.13 -0.63 -1.51 0.00 0.00 177.10 174.78 3b9i s ILE 144 N 1.87 3.00 0.21 0.60 -1.09 0.36 0.23 121.20 126.38 3b9i s ILE 144 Ca 0.49 -0.67 -0.17 0.00 -2.23 0.00 0.00 60.65 58.07 3b9i s ILE 144 Cb -0.19 -2.27 0.02 0.00 -1.58 0.00 0.00 42.46 38.44 3b9i s ILE 144 CO 0.20 0.51 0.54 -0.72 -1.23 0.00 0.00 174.94 174.23 3b9i s TYR 145 N 0.57 -0.06 -0.07 3.97 -0.85 -0.99 -1.67 117.35 118.24 3b9i s TYR 145 Ca -0.08 -0.29 0.00 0.00 -0.52 0.00 0.00 57.07 56.18 3b9i s TYR 145 Cb -0.16 0.40 -0.03 0.00 0.38 0.00 0.00 41.96 42.55 3b9i s TYR 145 CO 0.03 -0.96 -0.06 -0.51 -1.52 0.00 0.00 175.55 172.54 3b9i s LEU 146 N -2.90 3.21 -0.11 -3.49 1.02 -1.26 -0.27 118.68 114.88 3b9i s LEU 146 Ca 0.11 -0.01 0.02 0.00 0.02 0.00 0.00 54.13 54.27 3b9i s LEU 146 Cb -0.01 -1.71 0.01 0.00 0.02 0.00 0.00 46.19 44.50 3b9i s LEU 146 CO -0.00 0.35 -0.16 -0.75 0.02 0.00 0.00 176.35 175.81 3b9i s LYS 147 N -0.74 2.29 0.13 1.70 2.20 0.19 -4.98 119.74 120.53 3b9i s LYS 147 Ca 0.11 -0.59 -0.00 0.00 -0.36 0.00 0.00 55.97 55.13 3b9i s LYS 147 Cb -0.11 -1.91 -0.04 0.00 -1.51 0.00 0.00 37.83 34.26 3b9i s LYS 147 CO 0.02 -0.03 0.30 -0.06 -0.36 0.00 0.00 175.35 175.22 3b9i s PHE 148 N 0.88 3.49 0.26 4.03 0.08 -1.26 -0.49 117.98 124.97 3b9i s PHE 148 Ca -0.09 0.27 -0.01 0.00 0.12 0.00 0.00 56.93 57.23 3b9i s PHE 148 Cb -0.15 -1.79 0.35 0.00 -0.57 0.00 0.00 43.02 40.86 3b9i s PHE 148 CO -0.00 0.49 1.74 -0.97 -0.10 0.00 0.00 175.22 176.38 3b9i h ASN 149 N 2.49 0.67 -2.07 1.36 -1.24 -1.68 -3.42 115.58 111.69 3b9i h ASN 149 Ca -0.47 -0.19 -0.12 0.00 0.71 0.00 0.00 56.30 56.23 3b9i h ASN 149 Cb 1.18 -0.18 -0.29 0.00 0.73 0.00 0.00 38.32 39.76 3b9i h ASN 149 CO 0.71 0.81 -0.44 -0.55 -1.29 0.00 0.00 177.43 176.67 3b9i s SER 150 N -6.71 0.02 0.56 1.15 0.15 -1.26 -5.01 113.70 102.60 3b9i s SER 150 Ca -0.09 0.50 0.29 0.00 0.70 0.00 0.00 55.95 57.36 3b9i s SER 150 Cb 0.14 1.22 1.46 0.00 -1.71 0.00 0.00 66.02 67.14 3b9i s SER 150 CO 0.81 -0.28 1.90 0.11 1.20 0.00 0.00 173.24 176.98 3b9i h LYS 151 N 8.17 0.00 0.00 5.44 6.56 -1.99 -0.45 116.57 134.30 3b9i h LYS 151 Ca -0.18 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.41 3b9i h LYS 151 Cb 1.14 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.80 3b9i h LYS 151 CO 0.22 0.00 0.00 -0.44 -2.06 0.00 0.00 179.45 177.17 3b9i h ASP 152 N 0.00 0.00 1.12 0.86 5.19 -1.99 -2.65 116.42 118.94 3b9i h ASP 152 Ca 0.31 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.72 3b9i h ASP 152 Cb 1.39 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.90 3b9i h ASP 152 CO -0.00 0.00 0.00 0.45 -3.12 0.00 0.00 179.24 176.57 3b9i h HIS 153 N 0.00 0.00 -3.53 4.55 3.86 -1.49 -3.46 115.15 115.08 3b9i h HIS 153 Ca 0.00 0.00 -0.62 0.00 -1.16 0.00 0.00 60.37 58.59 3b9i h HIS 153 Cb 0.31 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 28.65 3b9i h HIS 153 CO 0.00 0.00 -0.46 0.42 0.86 0.00 0.00 177.93 178.75 3b9i s ILE 154 N -3.45 5.34 -0.70 2.45 -1.09 -1.00 -0.95 121.20 121.80 3b9i s ILE 154 Ca 0.04 0.25 -0.25 0.00 -2.23 0.00 0.00 60.65 58.46 3b9i s ILE 154 Cb 0.09 -3.53 0.05 0.00 -1.58 0.00 0.00 42.46 37.49 3b9i s ILE 154 CO 0.52 0.34 1.14 -1.58 -1.23 0.00 0.00 174.94 174.14 3b9i s GLN 155 N 1.01 3.17 0.32 2.79 0.74 -0.05 -4.76 119.66 122.88 3b9i s GLN 155 Ca 0.09 -0.46 0.06 0.00 0.05 0.00 0.00 55.36 55.09 3b9i s GLN 155 Cb -0.13 -4.19 0.71 0.00 1.10 0.00 0.00 33.01 30.50 3b9i s GLN 155 CO 0.04 -1.99 1.85 0.87 -0.55 0.00 0.00 175.29 175.51 3b9i h LYS 156 N 9.82 0.79 -0.67 1.67 1.57 -1.91 -3.32 116.57 124.52 3b9i h LYS 156 Ca -0.28 -0.05 0.06 0.00 -1.87 0.00 0.00 60.65 58.51 3b9i h LYS 156 Cb 1.06 -0.18 -0.09 0.00 0.08 0.00 0.00 32.23 33.10 3b9i h LYS 156 CO 1.23 0.52 -0.49 1.15 -0.57 0.00 0.00 179.45 181.30 3b9i h THR 157 N 0.82 0.00 -0.58 -0.16 2.02 -1.90 -2.42 112.91 110.69 3b9i h THR 157 Ca 0.48 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 67.47 3b9i h THR 157 Cb 0.65 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.94 3b9i h THR 157 CO -0.24 0.00 0.18 0.59 0.37 0.00 0.00 175.52 176.41 3b9i n ASN 158 N -4.91 4.07 -4.65 4.18 3.02 -1.25 -4.56 115.26 111.15 3b9i n ASN 158 Ca 0.00 -3.33 -0.37 0.00 -0.03 0.00 0.00 54.58 50.85 3b9i n ASN 158 Cb 0.24 -0.69 -0.09 0.00 -0.61 0.00 0.00 39.78 38.63 3b9i n ASN 158 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3b9i s THR 159 N -3.04 5.29 0.07 3.41 2.01 -0.93 -4.73 115.64 117.73 3b9i s THR 159 Ca 0.50 0.37 -0.07 0.00 0.31 0.00 0.00 61.69 62.81 3b9i s THR 159 Cb 0.42 -3.59 -0.01 0.00 0.01 0.00 0.00 72.50 69.33 3b9i s THR 159 CO 0.09 0.29 0.13 -0.72 -0.69 0.00 0.00 174.62 173.73 3b9i s TYR 160 N 1.27 0.24 0.25 4.92 -0.85 -0.68 -1.48 117.35 121.02 3b9i s TYR 160 Ca 0.12 -0.68 -0.19 0.00 -0.52 0.00 0.00 57.07 55.80 3b9i s TYR 160 Cb -0.14 -0.14 0.02 0.00 0.38 0.00 0.00 41.96 42.08 3b9i s TYR 160 CO 0.06 -0.49 0.63 1.67 -1.52 0.00 0.00 175.55 175.91 3b9i s TRP 161 N -3.75 -0.08 -1.95 -3.49 -2.14 -0.96 -0.26 118.94 106.31 3b9i s TRP 161 Ca 0.04 -0.32 0.00 0.00 2.66 0.00 0.00 56.10 58.48 3b9i s TRP 161 Cb 0.05 0.54 0.00 0.00 -3.10 0.00 0.00 33.47 30.96 3b9i s TRP 161 CO -0.10 -1.12 0.00 0.41 -2.66 0.00 0.00 176.95 173.48 3b9i n GLY 162 N -0.42 -0.54 3.12 3.67 0.00 -0.92 0.59 105.19 110.68 3b9i n GLY 162 Ca -0.05 -0.77 -0.07 0.00 0.00 0.00 0.00 46.02 45.12 3b9i n GLY 162 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3b9i s ILE 163 N -3.07 0.20 -0.04 -0.61 -5.25 -0.93 -1.95 121.20 109.55 3b9i s ILE 163 Ca 0.00 -1.68 0.01 0.00 -0.99 0.00 0.00 60.65 57.99 3b9i s ILE 163 Cb 0.00 -1.49 0.02 0.00 2.95 0.00 0.00 42.46 43.94 3b9i s ILE 163 CO 0.00 -0.91 -0.04 -0.51 -1.79 0.00 0.00 174.94 171.68 3b9i s ILE 164 N -3.91 0.53 0.02 8.37 2.07 -0.62 -1.86 121.20 125.79 3b9i s ILE 164 Ca 0.07 -0.12 -0.30 0.00 -1.41 0.00 0.00 60.65 58.89 3b9i s ILE 164 Cb 0.07 -0.56 -0.06 0.00 0.13 0.00 0.00 42.46 42.04 3b9i s ILE 164 CO -0.10 0.22 1.48 -0.22 -1.91 0.00 0.00 174.94 174.42 3b9i s LEU 165 N 0.92 4.33 -0.02 8.50 2.96 -0.81 -1.38 118.68 133.18 3b9i s LEU 165 Ca -0.11 2.24 -0.17 0.00 -0.22 0.00 0.00 54.13 55.86 3b9i s LEU 165 Cb -0.14 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 42.93 3b9i s LEU 165 CO 0.00 -0.77 0.48 -0.04 -1.32 0.00 0.00 176.35 174.70 3b9i s MET 166 N 2.47 4.14 0.95 1.98 -1.94 0.29 -4.71 119.30 122.49 3b9i s MET 166 Ca 0.67 0.53 -0.14 0.00 -1.71 0.00 0.00 55.69 55.04 3b9i s MET 166 Cb -0.34 -3.30 0.17 0.00 2.01 0.00 0.00 34.83 33.37 3b9i s MET 166 CO 0.28 0.50 1.18 -1.25 -0.01 0.00 0.00 175.02 175.72 3b9i s PRO 167 N -0.53 0.78 0.49 2.03 0.04 -1.26 -4.66 135.00 131.88 3b9i s PRO 167 Ca 0.26 0.08 -0.20 0.00 0.04 0.00 0.00 61.00 61.18 3b9i s PRO 167 Cb -0.17 -1.82 -0.08 0.00 0.04 0.00 0.00 34.50 32.47 3b9i s PRO 167 CO 0.14 -2.40 1.03 -0.51 0.04 0.00 0.00 177.00 175.31 3b9i s ASP 168 N -4.24 6.35 -0.73 6.66 1.01 -1.26 -5.00 116.67 119.46 3b9i s ASP 168 Ca 0.67 1.90 0.04 0.00 0.71 0.00 0.00 52.55 55.86 3b9i s ASP 168 Cb -0.11 -2.56 0.21 0.00 1.01 0.00 0.00 42.92 41.47 3b9i s ASP 168 CO 0.53 -0.77 0.66 0.18 0.21 0.00 0.00 175.17 175.98 3b9i n LEU 169 N -1.02 3.58 0.08 1.23 4.77 -1.26 -4.92 117.00 119.46 3b9i n LEU 169 Ca 0.09 -5.28 0.13 0.00 -0.03 0.00 0.00 56.01 50.92 3b9i n LEU 169 Cb 0.53 -0.80 0.44 0.00 -2.33 0.00 0.00 43.42 41.25 3b9i n LEU 169 CO 0.40 1.82 0.88 -0.81 -1.33 0.00 0.00 177.39 178.35 3b9i n PRO 170 N 1.63 0.21 -3.75 3.23 -0.05 -1.26 -4.83 135.00 130.18 3b9i n PRO 170 Ca 0.24 0.17 -0.36 0.00 -0.05 0.00 0.00 63.50 63.49 3b9i n PRO 170 Cb 0.37 -1.74 -0.10 0.00 -0.05 0.00 0.00 33.50 31.99 3b9i n PRO 170 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 175.50 175.39 3b9i s PHE 171 N -3.08 3.29 0.48 0.54 0.08 -1.26 -5.05 117.98 112.97 3b9i s PHE 171 Ca 0.11 0.14 0.05 0.00 0.12 0.00 0.00 56.93 57.35 3b9i s PHE 171 Cb 0.14 -2.22 -0.02 0.00 -0.57 0.00 0.00 43.02 40.35 3b9i s PHE 171 CO 0.59 0.06 0.18 0.42 -0.10 0.00 0.00 175.22 176.37 3b9i s ILE 172 N 0.91 1.76 0.00 0.64 1.01 -1.26 -5.28 121.20 118.98 3b9i s ILE 172 Ca 0.06 -1.74 0.00 0.00 0.00 0.00 0.00 60.65 58.97 3b9i s ILE 172 Cb -0.13 -2.51 0.00 0.00 0.01 0.00 0.00 42.46 39.83 3b9i s ILE 172 CO 0.03 0.00 0.00 -0.24 0.00 0.00 0.00 174.94 174.73