#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cee n GLN 2 N 0.00 2.13 -4.08 0.03 3.00 -1.26 -4.93 117.38 112.27 1cee n GLN 2 Ca 0.00 0.76 -0.20 0.00 -0.01 0.00 0.00 57.00 57.55 1cee n GLN 2 Cb 0.00 -2.50 -0.16 0.00 0.00 0.00 0.00 30.24 27.58 1cee n GLN 2 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1cee s THR 3 N 0.60 0.48 -0.23 5.09 2.01 -1.26 -3.02 115.64 119.30 1cee s THR 3 Ca 0.75 -0.07 -0.16 0.00 0.31 0.00 0.00 61.69 62.52 1cee s THR 3 Cb -0.67 -0.53 -0.04 0.00 0.01 0.00 0.00 72.50 71.27 1cee s THR 3 CO 0.42 0.22 0.42 -0.63 -0.69 0.00 0.00 174.62 174.36 1cee s ILE 4 N 1.09 5.16 -1.04 1.82 1.09 -1.08 -4.90 121.20 123.34 1cee s ILE 4 Ca -0.08 0.72 -0.16 0.00 -1.10 0.00 0.00 60.65 60.02 1cee s ILE 4 Cb -0.14 -3.75 0.16 0.00 -1.06 0.00 0.00 42.46 37.68 1cee s ILE 4 CO -0.01 0.19 1.22 -0.75 -0.10 0.00 0.00 174.94 175.48 1cee s LYS 5 N 1.74 3.83 -0.16 2.79 2.20 -1.26 0.12 119.74 129.00 1cee s LYS 5 Ca 0.19 -2.24 -0.23 0.00 -0.36 0.00 0.00 55.97 53.33 1cee s LYS 5 Cb -0.15 -4.91 -0.02 0.00 -1.51 0.00 0.00 37.83 31.23 1cee s LYS 5 CO 0.09 -1.69 0.72 0.00 -0.36 0.00 0.00 175.35 174.10 1cee s VAL 7 N 1.75 1.65 -0.37 0.00 1.01 -1.25 0.16 120.40 123.35 1cee s VAL 7 Ca 0.34 -0.85 -0.24 0.00 0.00 0.00 0.00 61.98 61.24 1cee s VAL 7 Cb -0.16 -1.40 0.01 0.00 0.00 0.00 0.00 36.38 34.82 1cee s VAL 7 CO 0.13 0.47 0.81 -0.69 0.00 0.00 0.00 175.10 175.81 1cee s VAL 8 N -0.08 4.70 -0.10 2.92 1.01 0.63 -0.79 120.40 128.69 1cee s VAL 8 Ca -0.03 0.92 -0.02 0.00 0.00 0.00 0.00 61.98 62.86 1cee s VAL 8 Cb -0.12 -4.24 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 1cee s VAL 8 CO 0.02 -0.47 -0.02 0.68 0.00 0.00 0.00 175.10 175.31 1cee s VAL 9 N 3.18 4.07 0.00 2.92 -7.23 0.95 -3.69 120.40 120.60 1cee s VAL 9 Ca 0.33 -0.33 0.00 0.00 -1.81 0.00 0.00 61.98 60.17 1cee s VAL 9 Cb -0.13 -2.72 0.00 0.00 0.56 0.00 0.00 36.38 34.10 1cee s VAL 9 CO 0.18 0.58 0.00 0.61 -0.31 0.00 0.00 175.10 176.15 1cee n GLY 10 N 2.46 4.17 3.30 2.32 0.00 -1.26 -3.21 105.19 112.96 1cee n GLY 10 Ca -0.18 -0.38 -0.34 0.00 0.00 0.00 0.00 46.02 45.11 1cee n GLY 10 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1cee s ASP 11 N 0.00 4.00 0.00 1.61 1.47 -1.26 -3.99 116.67 118.49 1cee s ASP 11 Ca 0.00 -0.41 0.00 0.00 1.18 0.00 0.00 52.55 53.32 1cee s ASP 11 Cb 0.00 -1.65 0.00 0.00 -0.34 0.00 0.00 42.92 40.93 1cee s ASP 11 CO 0.00 0.05 0.00 0.61 0.68 0.00 0.00 175.17 176.51 1cee n GLY 12 N 4.33 0.75 3.16 2.12 0.00 -1.25 -5.02 105.19 109.27 1cee n GLY 12 Ca -0.19 -0.67 0.06 0.00 0.00 0.00 0.00 46.02 45.22 1cee n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cee s ALA 13 N -1.18 -3.80 0.00 4.61 0.00 -1.26 -4.82 121.76 115.31 1cee s ALA 13 Ca 0.00 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.32 1cee s ALA 13 Cb 0.00 -2.57 0.00 0.00 0.00 0.00 0.00 23.12 20.55 1cee s ALA 13 CO 0.00 -1.42 0.00 1.33 0.00 0.00 0.00 175.76 175.67 1cee n VAL 14 N 5.34 0.00 0.00 0.00 0.24 -1.26 -4.93 118.33 117.72 1cee n VAL 14 Ca -0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.21 1cee n VAL 14 Cb 0.55 -0.92 0.00 0.00 -1.47 0.00 0.00 33.84 32.00 1cee n VAL 14 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1cee n GLY 15 N 2.28 0.00 0.19 7.63 0.00 -1.26 -4.42 105.19 109.61 1cee n GLY 15 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1cee n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1cee h LYS 16 N 0.00 -0.37 0.03 1.61 6.56 -1.98 -3.15 116.57 119.28 1cee h LYS 16 Ca 0.00 0.03 0.02 0.00 -1.06 0.00 0.00 60.65 59.63 1cee h LYS 16 Cb 0.00 0.08 -0.05 0.00 -0.57 0.00 0.00 32.23 31.70 1cee h LYS 16 CO 0.00 -0.04 -0.48 1.15 -2.06 0.00 0.00 179.45 178.02 1cee h THR 17 N -0.95 0.00 -1.42 -0.16 2.02 -1.98 -0.21 112.91 110.21 1cee h THR 17 Ca -0.04 0.00 0.42 0.00 0.77 0.00 0.00 66.41 67.56 1cee h THR 17 Cb 0.50 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.83 1cee h THR 17 CO 0.06 0.00 0.99 0.00 0.37 0.00 0.00 175.52 176.94 1cee h LEU 19 N 0.07 0.35 -0.72 0.00 6.46 -1.13 -2.89 115.31 117.45 1cee h LEU 19 Ca 0.73 -0.43 0.05 0.00 -0.12 0.00 0.00 57.88 58.12 1cee h LEU 19 Cb 2.66 -0.11 -0.05 0.00 -0.73 0.00 0.00 40.66 42.42 1cee h LEU 19 CO -0.14 1.35 0.43 -0.07 -0.62 0.00 0.00 178.44 179.38 1cee h LEU 20 N 0.06 0.66 0.41 2.25 3.38 0.25 0.35 115.31 122.66 1cee h LEU 20 Ca -0.18 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 1cee h LEU 20 Cb 1.97 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.62 1cee h LEU 20 CO 0.17 0.43 -0.20 0.40 0.09 0.00 0.00 178.44 179.33 1cee h ILE 21 N 0.79 0.00 -0.23 1.22 1.08 -1.43 -3.11 117.51 115.83 1cee h ILE 21 Ca 0.32 -0.41 0.07 0.00 -0.39 0.00 0.00 64.86 64.44 1cee h ILE 21 Cb 0.15 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 33.90 1cee h ILE 21 CO -0.17 0.00 0.40 0.77 -0.69 0.00 0.00 178.15 178.46 1cee h SER 22 N -0.96 0.00 0.60 1.72 4.64 -1.45 0.87 113.55 118.97 1cee h SER 22 Ca -0.06 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.23 1cee h SER 22 Cb 0.43 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.52 1cee h SER 22 CO 0.09 0.00 -0.29 0.22 -0.87 0.00 0.00 176.83 175.98 1cee h TYR 23 N 0.00 -0.75 0.00 4.77 3.20 -0.24 0.20 116.97 124.14 1cee h TYR 23 Ca 0.11 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.96 1cee h TYR 23 Cb 0.91 0.25 0.00 0.00 1.54 0.00 0.00 36.73 39.43 1cee h TYR 23 CO 0.00 -0.41 -1.39 -2.37 -1.64 0.00 0.00 178.16 172.35 1cee n THR 24 N -5.36 0.22 -0.03 1.81 5.66 -0.77 -4.30 114.28 111.52 1cee n THR 24 Ca -0.12 -0.41 0.06 0.00 -3.05 0.00 0.00 64.05 60.53 1cee n THR 24 Cb 0.35 0.02 -0.15 0.00 -1.55 0.00 0.00 70.33 69.01 1cee n THR 24 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1cee n THR 25 N -2.24 0.25 -1.28 1.09 -2.24 0.30 -4.98 114.28 105.18 1cee n THR 25 Ca -0.01 -0.50 -0.10 0.00 -2.27 0.00 0.00 64.05 61.17 1cee n THR 25 Cb 0.51 -0.06 -0.04 0.00 -2.10 0.00 0.00 70.33 68.64 1cee n THR 25 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1cee n ASN 26 N -2.27 -4.66 -3.91 3.42 5.15 0.69 -4.93 115.26 108.75 1cee n ASN 26 Ca -0.09 0.24 -0.26 0.00 -0.60 0.00 0.00 54.58 53.86 1cee n ASN 26 Cb 0.62 -3.00 -0.17 0.00 -0.53 0.00 0.00 39.78 36.70 1cee n ASN 26 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 1cee s LYS 27 N -2.60 1.48 -0.34 1.20 2.36 -1.26 -4.94 119.74 115.65 1cee s LYS 27 Ca 0.00 -0.24 -0.27 0.00 -2.55 0.00 0.00 55.97 52.91 1cee s LYS 27 Cb 0.00 -1.53 0.01 0.00 -1.05 0.00 0.00 37.83 35.26 1cee s LYS 27 CO 0.00 -0.24 0.95 0.12 1.55 0.00 0.00 175.35 177.73 1cee s PHE 28 N 1.63 3.13 0.99 4.03 5.36 -1.26 -3.13 117.98 128.72 1cee s PHE 28 Ca 0.03 0.94 -0.12 0.00 -0.96 0.00 0.00 56.93 56.82 1cee s PHE 28 Cb -0.13 -3.58 0.18 0.00 -0.34 0.00 0.00 43.02 39.15 1cee s PHE 28 CO -0.07 -0.75 1.09 -1.25 -1.46 0.00 0.00 175.22 172.78 1cee s PRO 29 N 3.44 0.53 0.00 10.12 0.04 -1.26 -5.00 135.00 142.86 1cee s PRO 29 Ca 0.40 0.56 0.00 0.00 0.04 0.00 0.00 61.00 61.99 1cee s PRO 29 Cb -0.12 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.67 1cee s PRO 29 CO 0.16 -2.68 0.25 0.43 0.04 0.00 0.00 177.00 175.21 1cee n SER 30 N -4.14 0.51 -4.56 6.66 7.64 -1.26 -5.06 113.62 113.41 1cee n SER 30 Ca 0.05 -0.78 -0.37 0.00 1.01 0.00 0.00 58.87 58.78 1cee n SER 30 Cb 0.57 0.29 0.06 0.00 -1.01 0.00 0.00 64.21 64.12 1cee n SER 30 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1cee n GLU 31 N -0.29 0.60 -3.94 1.43 4.71 -1.26 -4.98 120.64 116.91 1cee n GLU 31 Ca 0.00 0.25 -0.31 0.00 -0.01 0.00 0.00 57.16 57.09 1cee n GLU 31 Cb 0.03 -2.02 -0.15 0.00 -1.01 0.00 0.00 31.44 28.29 1cee n GLU 31 CO 0.00 0.00 0.00 -0.47 0.09 0.00 0.00 177.13 176.75 1cee s TYR 32 N -1.70 3.15 0.00 -0.32 6.14 -1.26 -5.05 117.35 118.31 1cee s TYR 32 Ca 0.72 -2.61 0.00 0.00 0.64 0.00 0.00 57.07 55.82 1cee s TYR 32 Cb -0.39 -2.53 0.00 0.00 0.42 0.00 0.00 41.96 39.46 1cee s TYR 32 CO 0.51 -0.92 0.00 1.55 0.64 0.00 0.00 175.55 177.33 1cee n VAL 33 N 4.43 0.00 -1.42 3.14 3.14 -1.26 -5.16 118.33 121.19 1cee n VAL 33 Ca 0.01 0.00 -0.36 0.00 -2.96 0.00 0.00 64.34 61.03 1cee n VAL 33 Cb 0.42 0.00 0.08 0.00 -1.06 0.00 0.00 33.84 33.28 1cee n VAL 33 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1cee n PRO 34 N 0.00 0.61 -3.00 1.45 -0.04 -1.26 -4.98 135.00 127.78 1cee n PRO 34 Ca 0.00 0.26 -0.36 0.00 -0.04 0.00 0.00 63.50 63.36 1cee n PRO 34 Cb 0.00 -2.24 -0.06 0.00 -0.04 0.00 0.00 33.50 31.16 1cee n PRO 34 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1cee s THR 35 N -1.74 4.47 -0.05 0.52 2.01 -1.26 -4.98 115.64 114.60 1cee s THR 35 Ca 0.75 1.43 -0.01 0.00 0.31 0.00 0.00 61.69 64.16 1cee s THR 35 Cb -0.36 -3.88 -0.02 0.00 0.01 0.00 0.00 72.50 68.25 1cee s THR 35 CO 0.49 0.16 -0.05 0.55 -0.69 0.00 0.00 174.62 175.07 1cee n VAL 36 N 0.59 0.26 -2.92 3.82 3.14 -1.26 -4.03 118.33 117.93 1cee n VAL 36 Ca -0.01 -0.08 0.02 0.00 -2.96 0.00 0.00 64.34 61.32 1cee n VAL 36 Cb 0.51 -1.26 0.00 0.00 -1.06 0.00 0.00 33.84 32.03 1cee n VAL 36 CO 0.00 0.00 0.00 0.12 -6.46 0.00 0.00 176.83 170.49 1cee s PHE 37 N -2.09 -0.72 -0.28 1.45 5.36 -1.25 -3.03 117.98 117.42 1cee s PHE 37 Ca -0.06 0.16 0.02 0.00 -0.96 0.00 0.00 56.93 56.08 1cee s PHE 37 Cb 0.02 0.13 0.08 0.00 -0.34 0.00 0.00 43.02 42.91 1cee s PHE 37 CO 0.09 -0.48 -0.01 -0.51 -1.46 0.00 0.00 175.22 172.85 1cee s ASP 38 N 2.09 4.23 -0.29 6.13 1.11 -0.93 -5.00 116.67 124.01 1cee s ASP 38 Ca 0.16 -1.56 -0.10 0.00 0.18 0.00 0.00 52.55 51.23 1cee s ASP 38 Cb 0.01 -1.31 -0.03 0.00 1.07 0.00 0.00 42.92 42.65 1cee s ASP 38 CO -0.15 -0.30 0.17 0.21 1.18 0.00 0.00 175.17 176.29 1cee s ASN 39 N 1.24 5.80 0.29 0.27 3.04 -1.26 -2.31 114.94 122.02 1cee s ASN 39 Ca 0.01 -0.19 0.10 0.00 0.04 0.00 0.00 52.86 52.82 1cee s ASN 39 Cb -0.19 -2.07 -0.05 0.00 -1.54 0.00 0.00 41.25 37.40 1cee s ASN 39 CO -0.09 -0.10 -0.08 -0.31 -3.04 0.00 0.00 177.10 173.47 1cee s TYR 40 N 1.71 2.49 -0.10 0.43 2.02 0.13 -4.98 117.35 119.05 1cee s TYR 40 Ca 0.06 -0.33 -0.01 0.00 -0.37 0.00 0.00 57.07 56.43 1cee s TYR 40 Cb -0.16 -1.19 0.03 0.00 -0.40 0.00 0.00 41.96 40.23 1cee s TYR 40 CO 0.09 0.62 -0.05 0.00 -1.57 0.00 0.00 175.55 174.64 1cee s ALA 41 N -2.46 1.13 -0.06 3.71 0.00 -1.26 0.96 121.76 123.78 1cee s ALA 41 Ca 0.32 -0.42 -0.03 0.00 0.00 0.00 0.00 51.96 51.83 1cee s ALA 41 Cb -0.04 -0.86 -0.04 0.00 0.00 0.00 0.00 23.12 22.18 1cee s ALA 41 CO 0.18 -0.43 0.08 0.08 0.00 0.00 0.00 175.76 175.67 1cee s VAL 42 N 1.79 4.89 -0.33 0.00 1.01 -0.15 -4.93 120.40 122.68 1cee s VAL 42 Ca 0.05 -0.16 -0.10 0.00 0.00 0.00 0.00 61.98 61.77 1cee s VAL 42 Cb -0.12 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.11 1cee s VAL 42 CO -0.07 0.50 0.16 -0.89 0.00 0.00 0.00 175.10 174.80 1cee s THR 43 N -1.06 4.47 0.20 3.92 2.01 -1.26 0.16 115.64 124.07 1cee s THR 43 Ca 0.18 -0.65 0.09 0.00 0.31 0.00 0.00 61.69 61.62 1cee s THR 43 Cb -0.12 -3.37 -0.04 0.00 0.01 0.00 0.00 72.50 68.98 1cee s THR 43 CO 0.08 -0.05 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.10 1cee s VAL 44 N 1.57 1.91 -0.96 3.82 1.01 -1.13 -4.98 120.40 121.64 1cee s VAL 44 Ca 0.03 -2.10 -0.18 0.00 0.00 0.00 0.00 61.98 59.73 1cee s VAL 44 Cb -0.18 -1.99 0.14 0.00 0.00 0.00 0.00 36.38 34.34 1cee s VAL 44 CO 0.06 -0.42 1.16 -0.04 0.00 0.00 0.00 175.10 175.86 1cee s MET 45 N -3.20 3.65 -0.20 2.72 -1.94 -1.26 -0.93 119.30 118.14 1cee s MET 45 Ca 0.20 -1.85 -0.08 0.00 -1.71 0.00 0.00 55.69 52.25 1cee s MET 45 Cb -0.04 -4.93 -0.04 0.00 2.01 0.00 0.00 34.83 31.83 1cee s MET 45 CO 0.08 -1.77 0.08 0.42 -0.01 0.00 0.00 175.02 173.82 1cee s ILE 46 N 2.56 4.80 -1.81 2.53 1.01 -0.47 -4.39 121.20 125.42 1cee s ILE 46 Ca 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.96 1cee s ILE 46 Cb -0.05 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.24 1cee s ILE 46 CO -0.08 0.43 0.00 0.61 0.00 0.00 0.00 174.94 175.89 1cee n GLY 47 N 3.84 0.17 2.18 6.18 0.00 -1.26 -1.42 105.19 114.87 1cee n GLY 47 Ca -0.16 -0.05 -0.07 0.00 0.00 0.00 0.00 46.02 45.74 1cee n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cee n GLY 48 N -0.89 0.70 2.98 -0.02 0.00 -1.26 -5.02 105.19 101.67 1cee n GLY 48 Ca -0.23 -0.71 -0.14 0.00 0.00 0.00 0.00 46.02 44.94 1cee n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cee s GLU 49 N -3.01 0.38 -1.08 1.61 8.01 -0.51 -5.08 118.70 119.03 1cee s GLU 49 Ca 0.00 -0.36 -0.23 0.00 0.01 0.00 0.00 54.97 54.39 1cee s GLU 49 Cb 0.00 -0.26 -0.08 0.00 -4.31 0.00 0.00 34.13 29.48 1cee s GLU 49 CO 0.00 0.06 1.95 -1.25 0.01 0.00 0.00 175.26 176.03 1cee s PRO 50 N -0.63 2.47 0.66 0.39 0.04 -1.26 -1.37 135.00 135.29 1cee s PRO 50 Ca -0.03 -0.81 -0.10 0.00 0.04 0.00 0.00 61.00 60.09 1cee s PRO 50 Cb -0.05 -5.17 0.15 0.00 0.04 0.00 0.00 34.50 29.48 1cee s PRO 50 CO -0.00 -3.81 0.89 0.66 0.04 0.00 0.00 177.00 174.78 1cee n TYR 51 N 14.41 -3.87 -3.51 0.56 4.02 -0.11 -4.91 117.16 123.75 1cee n TYR 51 Ca 0.43 -0.87 -0.24 0.00 -0.01 0.00 0.00 57.90 57.20 1cee n TYR 51 Cb 0.47 -0.68 -0.14 0.00 -0.02 0.00 0.00 39.34 38.96 1cee n TYR 51 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1cee s THR 52 N -2.89 -0.19 -0.60 -0.72 2.01 -1.17 -2.84 115.64 109.25 1cee s THR 52 Ca 0.51 -0.51 -0.28 0.00 0.31 0.00 0.00 61.69 61.73 1cee s THR 52 Cb -0.02 -0.87 0.02 0.00 0.01 0.00 0.00 72.50 71.64 1cee s THR 52 CO 0.36 -0.52 1.37 -0.22 -0.69 0.00 0.00 174.62 174.92 1cee s LEU 53 N 2.20 3.36 -0.43 4.42 1.98 0.41 -2.62 118.68 128.00 1cee s LEU 53 Ca 0.08 0.12 -0.28 0.00 -2.89 0.00 0.00 54.13 51.15 1cee s LEU 53 Cb -0.15 -2.96 0.00 0.00 0.66 0.00 0.00 46.19 43.74 1cee s LEU 53 CO -0.28 -1.72 1.49 -0.83 -1.89 0.00 0.00 176.35 173.12 1cee s GLY 54 N 4.19 0.98 -0.38 7.98 0.00 0.32 -0.98 107.32 119.43 1cee s GLY 54 Ca 0.48 -0.19 -0.21 0.00 0.00 0.00 0.00 44.72 44.80 1cee s GLY 54 CO 0.23 2.88 0.66 1.08 0.00 0.00 0.00 173.10 177.95 1cee s LEU 55 N 5.91 4.29 -0.16 0.66 1.43 0.27 0.14 118.68 131.22 1cee s LEU 55 Ca 0.63 0.05 -0.03 0.00 -1.03 0.00 0.00 54.13 53.76 1cee s LEU 55 Cb -0.15 -2.81 -0.02 0.00 0.03 0.00 0.00 46.19 43.24 1cee s LEU 55 CO 0.31 -0.67 -0.07 -0.36 0.23 0.00 0.00 176.35 175.80 1cee s PHE 56 N 2.82 2.95 -0.27 0.29 0.40 0.41 0.23 117.98 124.80 1cee s PHE 56 Ca 0.25 -0.49 0.03 0.00 -0.60 0.00 0.00 56.93 56.12 1cee s PHE 56 Cb -0.14 -1.94 0.07 0.00 0.51 0.00 0.00 43.02 41.51 1cee s PHE 56 CO 0.16 -0.16 -0.08 0.34 0.70 0.00 0.00 175.22 176.18 1cee s ASP 57 N 0.52 4.49 0.55 1.36 -1.08 -0.98 -0.27 116.67 121.27 1cee s ASP 57 Ca -0.05 -1.53 0.03 0.00 -0.52 0.00 0.00 52.55 50.48 1cee s ASP 57 Cb -0.15 -1.55 0.05 0.00 -1.46 0.00 0.00 42.92 39.81 1cee s ASP 57 CO 0.03 -0.23 0.77 0.42 0.52 0.00 0.00 175.17 176.68 1cee s THR 58 N 1.07 2.60 0.36 1.71 -4.23 -1.24 -2.19 115.64 113.71 1cee s THR 58 Ca -0.05 -0.76 -0.07 0.00 -1.18 0.00 0.00 61.69 59.63 1cee s THR 58 Cb -0.20 -2.83 -0.05 0.00 1.34 0.00 0.00 72.50 70.76 1cee s THR 58 CO -0.06 0.00 0.66 0.00 -0.54 0.00 0.00 174.62 174.68 1cee s ALA 59 N -2.72 3.50 -0.18 3.99 0.00 -1.17 -4.67 121.76 120.52 1cee s ALA 59 Ca 0.59 -0.44 0.13 0.00 0.00 0.00 0.00 51.96 52.24 1cee s ALA 59 Cb -0.09 -2.47 -0.19 0.00 0.00 0.00 0.00 23.12 20.37 1cee s ALA 59 CO 0.38 0.07 0.36 0.41 0.00 0.00 0.00 175.76 176.98 1cee n GLY 60 N -1.27 -0.51 0.29 0.00 0.00 -1.26 -4.84 105.19 97.62 1cee n GLY 60 Ca -0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 46.02 45.67 1cee n GLY 60 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1cee n GLN 61 N -1.79 -1.06 -0.00 1.61 6.02 -1.26 -3.90 117.38 116.99 1cee n GLN 61 Ca -0.01 -0.10 0.03 0.00 -0.01 0.00 0.00 57.00 56.91 1cee n GLN 61 Cb 0.31 -0.16 -0.05 0.00 1.02 0.00 0.00 30.24 31.36 1cee n GLN 61 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1cee n GLU 62 N -1.61 0.56 0.14 -1.09 2.13 -1.26 -4.58 120.64 114.93 1cee n GLU 62 Ca 0.01 -0.06 -0.01 0.00 0.66 0.00 0.00 57.16 57.76 1cee n GLU 62 Cb 0.04 -1.14 0.23 0.00 0.27 0.00 0.00 31.44 30.84 1cee n GLU 62 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1cee h ASP 63 N 0.00 0.06 -0.20 4.31 5.19 -2.01 -2.66 116.42 121.11 1cee h ASP 63 Ca 0.00 -0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 1cee h ASP 63 Cb 0.31 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.80 1cee h ASP 63 CO 0.00 0.57 0.00 -1.22 -3.12 0.00 0.00 179.24 175.47 1cee n TYR 64 N -3.92 0.28 -0.03 4.55 4.02 -1.26 -4.16 117.16 116.64 1cee n TYR 64 Ca -0.02 -0.14 0.23 0.00 -0.01 0.00 0.00 57.90 57.97 1cee n TYR 64 Cb 0.54 -0.01 0.72 0.00 -0.02 0.00 0.00 39.34 40.57 1cee n TYR 64 CO 0.00 0.00 0.00 0.38 -1.01 0.00 0.00 176.86 176.23 1cee h ASP 65 N 1.17 0.00 -0.06 7.72 3.04 -1.74 0.37 116.42 126.93 1cee h ASP 65 Ca 0.00 0.00 -0.10 0.00 -3.24 0.00 0.00 57.03 53.69 1cee h ASP 65 Cb 0.30 0.00 0.01 0.00 -1.04 0.00 0.00 39.33 38.59 1cee h ASP 65 CO 0.01 0.00 -0.37 0.03 -2.04 0.00 0.00 179.24 176.87 1cee h ARG 66 N 0.00 0.35 -0.68 4.15 -0.00 -1.85 -3.23 114.38 113.12 1cee h ARG 66 Ca 0.29 -0.30 -0.03 0.00 -0.50 0.00 0.00 59.98 59.44 1cee h ARG 66 Cb 1.29 0.07 -0.02 0.00 0.00 0.00 0.00 29.97 31.31 1cee h ARG 66 CO -0.00 0.95 0.04 1.47 0.00 0.00 0.00 179.97 182.43 1cee n LEU 67 N -4.39 5.01 -0.05 3.04 -0.00 -0.16 -4.43 117.00 116.02 1cee n LEU 67 Ca -0.09 -2.55 -0.10 0.00 -0.00 0.00 0.00 56.01 53.26 1cee n LEU 67 Cb 0.53 -0.66 -0.09 0.00 -0.00 0.00 0.00 43.42 43.20 1cee n LEU 67 CO 0.43 0.59 0.32 -0.09 -0.00 0.00 0.00 177.39 178.63 1cee h ARG 68 N 3.12 -0.02 0.00 1.47 2.43 -0.36 -3.31 114.38 117.71 1cee h ARG 68 Ca 0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1cee h ARG 68 Cb 1.79 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.35 1cee h ARG 68 CO 0.45 0.66 0.00 -0.35 -1.51 0.00 0.00 179.97 179.22 1cee n PRO 69 N -4.70 0.61 0.00 0.20 -0.04 -1.26 -3.12 135.00 126.69 1cee n PRO 69 Ca -0.07 0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.52 1cee n PRO 69 Cb 0.34 -1.50 0.71 0.00 -0.04 0.00 0.00 33.50 33.00 1cee n PRO 69 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1cee n LEU 70 N -1.03 0.00 -0.43 1.53 4.32 -1.25 -3.08 117.00 117.06 1cee n LEU 70 Ca 0.15 0.00 0.07 0.00 -0.02 0.00 0.00 56.01 56.21 1cee n LEU 70 Cb 0.08 0.00 0.16 0.00 -1.62 0.00 0.00 43.42 42.05 1cee n LEU 70 CO 0.12 0.00 0.62 -1.20 -1.22 0.00 0.00 177.39 175.71 1cee n SER 71 N -0.93 2.92 -2.16 -1.43 7.64 -1.18 -4.65 113.62 113.82 1cee n SER 71 Ca 0.18 -2.75 -0.09 0.00 1.01 0.00 0.00 58.87 57.22 1cee n SER 71 Cb 0.08 -0.38 0.05 0.00 -1.01 0.00 0.00 64.21 62.95 1cee n SER 71 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1cee n TYR 72 N -0.70 1.65 -0.48 1.43 4.01 -1.18 -4.83 117.16 117.06 1cee n TYR 72 Ca 0.15 -1.96 0.40 0.00 -0.16 0.00 0.00 57.90 56.33 1cee n TYR 72 Cb 0.64 -0.27 0.68 0.00 -0.31 0.00 0.00 39.34 40.08 1cee n TYR 72 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1cee h PRO 73 N 2.13 0.02 0.00 -0.72 0.11 -1.82 -3.16 132.00 128.56 1cee h PRO 73 Ca 0.08 -0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.06 1cee h PRO 73 Cb 1.41 -0.01 -0.10 0.00 0.11 0.00 0.00 31.00 32.41 1cee h PRO 73 CO 0.40 0.01 -0.11 0.00 -0.21 0.00 0.00 178.00 178.10 1cee n GLN 74 N -4.67 0.72 -1.51 1.05 10.64 -1.26 -5.14 117.38 117.20 1cee n GLN 74 Ca 0.40 -1.01 -0.49 0.00 -1.83 0.00 0.00 57.00 54.07 1cee n GLN 74 Cb 1.57 0.09 -0.04 0.00 -0.86 0.00 0.00 30.24 31.01 1cee n GLN 74 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 1cee n THR 75 N -0.70 1.42 0.00 -0.39 -1.04 -1.20 -4.92 114.28 107.45 1cee n THR 75 Ca -0.13 -0.35 0.00 0.00 -2.04 0.00 0.00 64.05 61.52 1cee n THR 75 Cb 0.73 -0.51 0.00 0.00 -1.82 0.00 0.00 70.33 68.74 1cee n THR 75 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1cee n ASP 76 N 1.76 0.00 -4.95 8.00 9.92 -1.06 -4.95 116.55 125.26 1cee n ASP 76 Ca 0.15 0.23 -0.21 0.00 -0.53 0.00 0.00 54.79 54.43 1cee n ASP 76 Cb 0.25 -0.37 0.01 0.00 -0.64 0.00 0.00 41.12 40.36 1cee n ASP 76 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1cee s VAL 77 N -0.74 2.33 -0.03 2.53 0.11 -1.24 -2.89 120.40 120.46 1cee s VAL 77 Ca 0.00 -1.23 -0.01 0.00 -2.93 0.00 0.00 61.98 57.81 1cee s VAL 77 Cb 0.00 -2.56 0.03 0.00 -1.53 0.00 0.00 36.38 32.32 1cee s VAL 77 CO 0.00 0.00 0.03 -0.36 -3.33 0.00 0.00 175.10 171.44 1cee s PHE 78 N -2.58 0.11 -0.67 1.54 0.08 -1.01 -3.76 117.98 111.69 1cee s PHE 78 Ca 0.49 0.13 -0.19 0.00 0.12 0.00 0.00 56.93 57.49 1cee s PHE 78 Cb -0.05 -0.36 0.12 0.00 -0.57 0.00 0.00 43.02 42.16 1cee s PHE 78 CO 0.30 -0.13 0.80 -0.51 -0.10 0.00 0.00 175.22 175.57 1cee s LEU 79 N 1.41 5.40 -1.03 -0.37 1.43 0.03 -1.66 118.68 123.88 1cee s LEU 79 Ca -0.05 -1.62 -0.15 0.00 -1.03 0.00 0.00 54.13 51.28 1cee s LEU 79 Cb -0.13 -2.32 0.18 0.00 0.03 0.00 0.00 46.19 43.95 1cee s LEU 79 CO -0.03 -1.08 1.17 -0.69 0.23 0.00 0.00 176.35 175.95 1cee s VAL 80 N 2.54 5.12 -0.41 -1.59 1.01 -1.08 -0.04 120.40 125.95 1cee s VAL 80 Ca 0.16 -2.29 -0.19 0.00 0.00 0.00 0.00 61.98 59.67 1cee s VAL 80 Cb -0.19 -4.76 0.02 0.00 0.00 0.00 0.00 36.38 31.45 1cee s VAL 80 CO 0.03 -1.44 0.55 0.00 0.00 0.00 0.00 175.10 174.24 1cee s PHE 82 N 2.50 2.73 -0.09 0.00 -0.71 -1.03 -4.83 117.98 116.56 1cee s PHE 82 Ca 0.18 -0.21 -0.30 0.00 -1.04 0.00 0.00 56.93 55.57 1cee s PHE 82 Cb -0.15 -1.22 -0.03 0.00 -1.21 0.00 0.00 43.02 40.41 1cee s PHE 82 CO 0.16 0.61 1.22 0.45 -1.34 0.00 0.00 175.22 176.32 1cee s SER 83 N -3.62 7.01 0.28 1.98 0.15 -1.26 -1.49 113.70 116.74 1cee s SER 83 Ca 0.31 1.78 0.04 0.00 0.70 0.00 0.00 55.95 58.78 1cee s SER 83 Cb -0.07 -2.55 0.41 0.00 -1.71 0.00 0.00 66.02 62.10 1cee s SER 83 CO 0.20 -0.65 1.70 0.58 1.20 0.00 0.00 173.24 176.27 1cee h VAL 84 N 5.17 1.29 -0.73 4.45 2.07 -1.60 -2.95 116.25 123.93 1cee h VAL 84 Ca -0.32 -1.42 -0.46 0.00 0.82 0.00 0.00 66.70 65.33 1cee h VAL 84 Cb 1.14 1.53 -0.22 0.00 -1.52 0.00 0.00 31.29 32.23 1cee h VAL 84 CO 0.91 0.44 0.59 1.33 0.02 0.00 0.00 177.57 180.86 1cee n VAL 85 N -4.07 3.00 -3.19 2.57 0.24 -1.26 0.15 118.33 115.77 1cee n VAL 85 Ca -0.01 -1.98 -0.13 0.00 -2.04 0.00 0.00 64.34 60.18 1cee n VAL 85 Cb 0.45 -1.03 -0.05 0.00 -1.47 0.00 0.00 33.84 31.74 1cee n VAL 85 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1cee s SER 86 N -0.76 0.14 0.59 -1.34 0.15 -1.12 -4.86 113.70 106.50 1cee s SER 86 Ca 0.46 -1.84 0.29 0.00 0.70 0.00 0.00 55.95 55.55 1cee s SER 86 Cb 0.37 0.90 1.43 0.00 -1.71 0.00 0.00 66.02 67.01 1cee s SER 86 CO 0.02 -0.17 1.84 -0.65 1.20 0.00 0.00 173.24 175.48 1cee h PRO 87 N 6.18 0.00 -0.53 5.44 0.11 -1.82 0.68 132.00 142.07 1cee h PRO 87 Ca 0.10 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.09 1cee h PRO 87 Cb 1.06 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1cee h PRO 87 CO 0.17 0.00 -0.14 1.03 -0.21 0.00 0.00 178.00 178.85 1cee h SER 88 N 0.00 1.03 -0.24 -2.05 0.87 -1.94 0.21 113.55 111.43 1cee h SER 88 Ca 0.25 -0.35 -0.11 0.00 -1.23 0.00 0.00 61.79 60.35 1cee h SER 88 Cb 1.36 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 63.04 1cee h SER 88 CO -0.00 1.15 -0.27 0.77 -0.53 0.00 0.00 176.83 177.95 1cee h SER 89 N 0.90 0.65 -0.55 6.23 4.64 -1.17 -2.61 113.55 121.64 1cee h SER 89 Ca 0.13 -0.49 -0.10 0.00 -0.47 0.00 0.00 61.79 60.86 1cee h SER 89 Cb 0.71 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.60 1cee h SER 89 CO 0.05 1.01 -0.06 0.15 -0.87 0.00 0.00 176.83 177.11 1cee h PHE 90 N 0.31 1.13 0.00 4.77 3.57 -1.42 0.14 116.94 125.43 1cee h PHE 90 Ca 0.03 -0.21 -0.01 0.00 3.53 0.00 0.00 57.97 61.31 1cee h PHE 90 Cb 0.84 -0.29 -0.00 0.00 2.79 0.00 0.00 35.95 39.29 1cee h PHE 90 CO 0.08 1.02 -0.03 0.93 -2.23 0.00 0.00 178.31 178.08 1cee h GLU 91 N 0.92 0.00 0.00 1.11 5.08 -0.54 -0.26 114.58 120.88 1cee h GLU 91 Ca 0.15 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.25 1cee h GLU 91 Cb 0.62 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.82 1cee h GLU 91 CO 0.04 0.03 -1.51 -0.91 -1.00 0.00 0.00 179.01 175.66 1cee h ASN 92 N 0.00 0.00 -0.71 1.42 2.35 -0.97 -3.11 115.58 114.56 1cee h ASN 92 Ca -0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1cee h ASN 92 Cb 0.07 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.40 1cee h ASN 92 CO 0.00 0.97 0.35 0.58 -1.65 0.00 0.00 177.43 177.69 1cee h VAL 93 N 0.00 1.23 0.00 2.81 2.07 0.89 1.68 116.25 124.94 1cee h VAL 93 Ca -0.21 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 1cee h VAL 93 Cb 1.93 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1cee h VAL 93 CO 0.09 0.26 -0.04 0.07 0.02 0.00 0.00 177.57 177.98 1cee h LYS 94 N 0.98 0.00 -1.32 1.57 2.10 -1.31 -3.16 116.57 115.43 1cee h LYS 94 Ca 0.24 0.00 -0.41 0.00 -2.00 0.00 0.00 60.65 58.48 1cee h LYS 94 Cb 0.09 0.00 -0.31 0.00 -0.90 0.00 0.00 32.23 31.11 1cee h LYS 94 CO -0.03 0.04 -0.93 0.39 -2.00 0.00 0.00 179.45 176.91 1cee n GLU 95 N -3.12 0.91 0.00 0.07 1.02 -0.54 -4.87 120.64 114.10 1cee n GLU 95 Ca 0.02 -2.83 0.00 0.00 -0.02 0.00 0.00 57.16 54.33 1cee n GLU 95 Cb 0.43 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 1cee n GLU 95 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1cee n LYS 96 N 0.67 0.00 0.16 3.49 0.00 0.56 -4.67 118.16 118.36 1cee n LYS 96 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 58.31 58.38 1cee n LYS 96 Cb 0.64 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.61 1cee n LYS 96 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.40 175.91 1cee h TRP 97 N 0.00 -0.44 -0.20 5.64 4.06 -1.08 -2.97 115.95 120.97 1cee h TRP 97 Ca 0.00 -0.01 -0.05 0.00 2.06 0.00 0.00 58.89 60.89 1cee h TRP 97 Cb 0.00 0.14 -0.01 0.00 -1.00 0.00 0.00 29.16 28.30 1cee h TRP 97 CO 0.00 -0.12 -0.09 0.28 -3.56 0.00 0.00 178.44 174.95 1cee h VAL 98 N -0.99 1.30 -0.55 1.49 2.07 -1.80 -3.23 116.25 114.53 1cee h VAL 98 Ca -0.05 -1.13 0.11 0.00 0.82 0.00 0.00 66.70 66.45 1cee h VAL 98 Cb 0.51 1.64 -0.09 0.00 -1.52 0.00 0.00 31.29 31.83 1cee h VAL 98 CO 0.08 0.34 0.02 -0.65 0.02 0.00 0.00 177.57 177.38 1cee h PRO 99 N 0.10 0.13 -0.98 1.57 0.11 -1.85 0.27 132.00 131.36 1cee h PRO 99 Ca 0.04 -0.01 0.22 0.00 0.11 0.00 0.00 66.00 66.37 1cee h PRO 99 Cb 0.56 -0.03 -0.09 0.00 0.11 0.00 0.00 31.00 31.56 1cee h PRO 99 CO 0.03 0.09 0.63 0.93 -0.21 0.00 0.00 178.00 179.46 1cee h GLU 100 N 0.14 0.49 0.24 1.05 5.08 -1.54 0.32 114.58 120.35 1cee h GLU 100 Ca 0.28 -0.03 -0.34 0.00 -1.00 0.00 0.00 59.36 58.27 1cee h GLU 100 Cb 0.44 -0.11 0.03 0.00 0.50 0.00 0.00 28.75 29.61 1cee h GLU 100 CO -0.45 0.32 -1.57 0.82 -1.00 0.00 0.00 179.01 177.13 1cee h ILE 101 N 0.50 1.17 0.00 3.13 2.04 -0.98 -3.30 117.51 120.07 1cee h ILE 101 Ca 0.54 -2.64 -0.03 0.00 1.00 0.00 0.00 64.86 63.73 1cee h ILE 101 Cb 1.20 2.96 -0.00 0.00 -0.74 0.00 0.00 36.82 40.24 1cee h ILE 101 CO -0.27 0.83 -0.15 0.71 0.00 0.00 0.00 178.15 179.27 1cee h THR 102 N 0.14 0.95 0.00 -0.27 1.35 0.11 1.22 112.91 116.41 1cee h THR 102 Ca -0.29 -0.53 -0.03 0.00 -0.55 0.00 0.00 66.41 65.02 1cee h THR 102 Cb 2.16 1.30 -0.00 0.00 -1.73 0.00 0.00 68.15 69.87 1cee h THR 102 CO 0.25 0.14 -0.13 0.45 -0.25 0.00 0.00 175.52 175.98 1cee h HIS 103 N 0.00 0.00 0.00 4.73 3.86 -0.53 -3.07 115.15 120.14 1cee h HIS 103 Ca -0.00 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 59.03 1cee h HIS 103 Cb 0.29 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.73 1cee h HIS 103 CO 0.00 0.13 -1.61 0.72 0.86 0.00 0.00 177.93 178.03 1cee n HIS 104 N -3.44 0.00 -3.37 2.45 -0.00 -0.59 -4.93 115.22 105.34 1cee n HIS 104 Ca -0.01 0.00 -0.26 0.00 -0.00 0.00 0.00 57.72 57.45 1cee n HIS 104 Cb 0.30 -0.40 -0.10 0.00 -0.00 0.00 0.00 29.99 29.79 1cee n HIS 104 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1cee n PRO 106 N 3.04 1.04 -0.09 0.00 -0.04 -1.16 -3.39 135.00 134.41 1cee n PRO 106 Ca 0.26 -0.06 -0.09 0.00 -0.04 0.00 0.00 63.50 63.57 1cee n PRO 106 Cb 0.47 -1.43 -0.14 0.00 -0.04 0.00 0.00 33.50 32.36 1cee n PRO 106 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1cee n LYS 107 N -0.86 1.06 -1.73 0.54 -0.00 -1.26 -4.97 118.16 110.95 1cee n LYS 107 Ca 0.20 -0.01 -0.40 0.00 -0.00 0.00 0.00 58.31 58.10 1cee n LYS 107 Cb 0.11 -1.46 0.02 0.00 -0.00 0.00 0.00 35.03 33.70 1cee n LYS 107 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1cee n THR 108 N -2.66 2.74 -1.63 0.58 -2.24 -1.22 -4.92 114.28 104.93 1cee n THR 108 Ca -0.29 -0.50 -0.42 0.00 -2.27 0.00 0.00 64.05 60.57 1cee n THR 108 Cb 1.08 -1.69 0.01 0.00 -2.10 0.00 0.00 70.33 67.63 1cee n THR 108 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1cee n PRO 109 N -0.13 1.52 -3.70 -0.78 -0.04 -1.14 -4.93 135.00 125.80 1cee n PRO 109 Ca 0.06 0.54 -0.30 0.00 -0.04 0.00 0.00 63.50 63.77 1cee n PRO 109 Cb 0.41 -2.10 -0.14 0.00 -0.04 0.00 0.00 33.50 31.63 1cee n PRO 109 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1cee s PHE 110 N -1.22 1.63 0.02 0.54 0.08 -1.26 -2.40 117.98 115.37 1cee s PHE 110 Ca 0.61 -1.81 -0.30 0.00 0.12 0.00 0.00 56.93 55.55 1cee s PHE 110 Cb -0.57 -1.66 -0.05 0.00 -0.57 0.00 0.00 43.02 40.18 1cee s PHE 110 CO 0.58 -0.86 1.18 -1.17 -0.10 0.00 0.00 175.22 174.85 1cee s LEU 111 N 1.38 4.34 -0.47 -0.37 2.96 -0.67 -1.40 118.68 124.45 1cee s LEU 111 Ca 0.12 1.92 -0.21 0.00 -0.22 0.00 0.00 54.13 55.74 1cee s LEU 111 Cb -0.19 -3.57 0.04 0.00 0.50 0.00 0.00 46.19 42.97 1cee s LEU 111 CO -0.19 -0.48 0.69 -0.22 -1.32 0.00 0.00 176.35 174.82 1cee s LEU 112 N 1.40 4.57 0.12 -0.68 0.20 0.81 -2.64 118.68 122.46 1cee s LEU 112 Ca 0.57 -0.50 0.04 0.00 0.69 0.00 0.00 54.13 54.94 1cee s LEU 112 Cb -0.27 -2.67 -0.04 0.00 -0.43 0.00 0.00 46.19 42.78 1cee s LEU 112 CO 0.27 -0.88 0.07 -0.69 -0.29 0.00 0.00 176.35 174.83 1cee s VAL 113 N 2.94 4.32 -0.17 1.68 1.01 -0.43 0.90 120.40 130.65 1cee s VAL 113 Ca 0.22 -0.98 -0.04 0.00 0.00 0.00 0.00 61.98 61.17 1cee s VAL 113 Cb -0.15 -3.12 0.07 0.00 0.00 0.00 0.00 36.38 33.17 1cee s VAL 113 CO 0.17 0.03 0.13 -0.83 0.00 0.00 0.00 175.10 174.60 1cee s GLY 114 N -2.65 0.22 0.50 4.51 0.00 -0.71 -2.46 107.32 106.72 1cee s GLY 114 Ca 0.29 -0.06 0.06 0.00 0.00 0.00 0.00 44.72 45.01 1cee s GLY 114 CO 0.21 1.84 0.40 -1.59 0.00 0.00 0.00 173.10 173.97 1cee s THR 115 N 2.21 1.99 0.00 0.90 2.01 -0.56 -2.59 115.64 119.59 1cee s THR 115 Ca 0.04 -1.45 0.00 0.00 0.31 0.00 0.00 61.69 60.59 1cee s THR 115 Cb -0.16 -2.43 0.00 0.00 0.01 0.00 0.00 72.50 69.92 1cee s THR 115 CO -0.10 0.00 0.00 1.67 -0.69 0.00 0.00 174.62 175.50 1cee n GLN 116 N -1.69 0.00 0.08 4.92 -0.06 -1.26 -1.88 117.38 117.49 1cee n GLN 116 Ca 0.01 0.00 -0.05 0.00 -2.00 0.00 0.00 57.00 54.95 1cee n GLN 116 Cb 0.64 -2.41 -0.03 0.00 -4.06 0.00 0.00 30.24 24.37 1cee n GLN 116 CO 0.00 0.00 0.00 0.82 -0.20 0.00 0.00 177.06 177.68 1cee h ILE 117 N 0.00 1.63 -0.78 1.69 2.04 -1.88 -3.32 117.51 116.89 1cee h ILE 117 Ca 0.00 -3.03 0.14 0.00 1.00 0.00 0.00 64.86 62.97 1cee h ILE 117 Cb 0.96 2.64 -0.14 0.00 -0.74 0.00 0.00 36.82 39.54 1cee h ILE 117 CO 0.00 0.87 -0.31 0.44 0.00 0.00 0.00 178.15 179.14 1cee h ASP 118 N 0.00 -1.12 -0.38 1.72 5.19 -1.95 0.21 116.42 120.11 1cee h ASP 118 Ca -0.01 0.26 -0.05 0.00 -0.62 0.00 0.00 57.03 56.61 1cee h ASP 118 Cb 1.57 0.61 -0.01 0.00 0.18 0.00 0.00 39.33 41.67 1cee h ASP 118 CO 0.12 -0.29 0.05 -0.07 -3.12 0.00 0.00 179.24 175.92 1cee h LEU 119 N -0.06 0.62 -2.08 1.55 4.07 -1.91 -1.91 115.31 115.58 1cee h LEU 119 Ca 0.32 -0.27 0.08 0.00 0.08 0.00 0.00 57.88 58.08 1cee h LEU 119 Cb 0.58 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.15 1cee h LEU 119 CO -0.82 0.73 0.23 -0.09 -1.08 0.00 0.00 178.44 177.41 1cee h ARG 120 N 0.48 0.00 -0.52 1.13 2.43 -0.96 0.46 114.38 117.40 1cee h ARG 120 Ca 0.11 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1cee h ARG 120 Cb 0.39 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1cee h ARG 120 CO 0.01 0.00 0.00 -3.47 -1.51 0.00 0.00 179.97 175.00 1cee n ASP 121 N -4.21 5.11 -3.90 -3.80 2.03 0.50 -4.76 116.55 107.51 1cee n ASP 121 Ca 0.04 -2.84 -0.29 0.00 0.52 0.00 0.00 54.79 52.21 1cee n ASP 121 Cb 0.38 -0.63 -0.13 0.00 -0.72 0.00 0.00 41.12 40.02 1cee n ASP 121 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1cee s ASP 122 N -1.07 4.35 0.36 1.67 2.15 0.16 -4.97 116.67 119.32 1cee s ASP 122 Ca 0.51 -3.22 0.19 0.00 0.43 0.00 0.00 52.55 50.45 1cee s ASP 122 Cb 0.38 -1.56 1.27 0.00 -0.30 0.00 0.00 42.92 42.71 1cee s ASP 122 CO 0.16 -0.19 1.60 -0.65 -0.17 0.00 0.00 175.17 175.92 1cee h PRO 123 N 6.18 0.09 -0.92 4.34 0.11 -1.86 0.81 132.00 140.74 1cee h PRO 123 Ca -0.00 -0.01 0.26 0.00 0.11 0.00 0.00 66.00 66.36 1cee h PRO 123 Cb 0.85 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.90 1cee h PRO 123 CO 0.67 0.06 0.66 0.77 -0.21 0.00 0.00 178.00 179.95 1cee h SER 124 N 0.09 0.07 0.02 -2.05 0.02 -1.93 0.97 113.55 110.73 1cee h SER 124 Ca 0.81 0.01 -0.37 0.00 -0.84 0.00 0.00 61.79 61.40 1cee h SER 124 Cb 2.08 -0.00 -0.05 0.00 0.14 0.00 0.00 62.40 64.56 1cee h SER 124 CO -0.73 0.02 -2.08 0.35 -1.14 0.00 0.00 176.83 173.25 1cee n THR 125 N -4.30 1.57 -0.34 -2.27 -2.24 0.27 -2.84 114.28 104.12 1cee n THR 125 Ca 0.19 -0.36 0.10 0.00 -2.27 0.00 0.00 64.05 61.71 1cee n THR 125 Cb 0.95 -1.82 0.29 0.00 -2.10 0.00 0.00 70.33 67.65 1cee n THR 125 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1cee h ILE 126 N -0.64 0.85 0.00 2.28 2.04 -0.52 0.41 117.51 121.92 1cee h ILE 126 Ca -0.54 -0.30 -0.08 0.00 1.00 0.00 0.00 64.86 64.95 1cee h ILE 126 Cb 1.65 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 1cee h ILE 126 CO -0.22 0.16 -0.40 -0.33 0.00 0.00 0.00 178.15 177.36 1cee h GLU 127 N 0.88 0.00 -0.51 2.37 5.08 0.76 0.14 114.58 123.29 1cee h GLU 127 Ca 0.51 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.77 1cee h GLU 127 Cb 0.64 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 1cee h GLU 127 CO -0.28 0.34 -0.06 -0.22 -1.00 0.00 0.00 179.01 177.80 1cee h LYS 128 N 0.00 0.94 0.00 2.33 3.64 -0.12 -3.20 116.57 120.16 1cee h LYS 128 Ca -0.01 -0.33 -0.12 0.00 -1.27 0.00 0.00 60.65 58.92 1cee h LYS 128 Cb 1.28 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 33.00 1cee h LYS 128 CO 0.04 0.99 -1.75 1.47 -2.27 0.00 0.00 179.45 177.93 1cee n LEU 129 N -4.24 0.38 0.03 5.20 -0.00 -0.21 -3.97 117.00 114.18 1cee n LEU 129 Ca 0.01 0.16 0.21 0.00 -0.00 0.00 0.00 56.01 56.39 1cee n LEU 129 Cb 0.36 0.11 0.57 0.00 -0.00 0.00 0.00 43.42 44.46 1cee n LEU 129 CO 0.44 0.11 1.19 0.00 -0.00 0.00 0.00 177.39 179.12 1cee h ALA 130 N 1.64 2.33 0.00 1.47 0.00 -0.95 0.96 119.26 124.70 1cee h ALA 130 Ca -0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1cee h ALA 130 Cb 1.41 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 1cee h ALA 130 CO 0.02 -1.06 -1.74 1.63 0.00 0.00 0.00 179.25 178.09 1cee n LYS 131 N -3.30 0.52 0.10 0.00 5.02 -1.25 -4.36 118.16 114.89 1cee n LYS 131 Ca 0.11 -0.14 0.12 0.00 -2.02 0.00 0.00 58.31 56.39 1cee n LYS 131 Cb 0.97 -1.38 0.27 0.00 -0.02 0.00 0.00 35.03 34.87 1cee n LYS 131 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 1cee h ASN 132 N 0.00 0.00 -0.00 4.39 2.35 0.64 -3.47 115.58 119.49 1cee h ASN 132 Ca -0.02 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 1cee h ASN 132 Cb 0.78 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.15 1cee h ASN 132 CO 0.00 0.04 0.00 0.29 -1.65 0.00 0.00 177.43 176.11 1cee n LYS 133 N -2.28 0.00 -5.05 0.81 4.01 0.75 -5.07 118.16 111.33 1cee n LYS 133 Ca 0.04 0.00 -0.31 0.00 -0.51 0.00 0.00 58.31 57.53 1cee n LYS 133 Cb 0.45 -0.50 -0.15 0.00 -0.51 0.00 0.00 35.03 34.33 1cee n LYS 133 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 1cee s GLN 134 N -1.41 2.11 0.06 1.97 -0.21 -0.95 -5.04 119.66 116.19 1cee s GLN 134 Ca 0.00 -0.93 0.01 0.00 0.02 0.00 0.00 55.36 54.45 1cee s GLN 134 Cb 0.00 -2.11 -0.04 0.00 1.00 0.00 0.00 33.01 31.86 1cee s GLN 134 CO 0.00 0.56 -0.05 0.15 -2.12 0.00 0.00 175.29 173.83 1cee s LYS 135 N -0.89 0.65 0.13 2.91 3.01 -1.26 -3.66 119.74 120.63 1cee s LYS 135 Ca 0.11 -1.14 -0.24 0.00 -1.01 0.00 0.00 55.97 53.70 1cee s LYS 135 Cb -0.10 -0.03 -0.07 0.00 -1.01 0.00 0.00 37.83 36.62 1cee s LYS 135 CO 0.01 -0.05 0.72 -1.25 0.51 0.00 0.00 175.35 175.29 1cee s PRO 136 N -3.31 4.47 0.05 -1.68 0.04 -1.26 -4.16 135.00 129.15 1cee s PRO 136 Ca 0.04 1.04 -0.30 0.00 0.04 0.00 0.00 61.00 61.82 1cee s PRO 136 Cb 0.03 -3.26 -0.05 0.00 0.04 0.00 0.00 34.50 31.25 1cee s PRO 136 CO -0.06 0.57 1.09 0.42 0.04 0.00 0.00 177.00 179.06 1cee s ILE 137 N -1.05 4.36 0.36 0.56 -1.09 0.39 -4.96 121.20 119.77 1cee s ILE 137 Ca 0.34 1.74 -0.05 0.00 -2.23 0.00 0.00 60.65 60.44 1cee s ILE 137 Cb -0.22 -4.11 -0.05 0.00 -1.58 0.00 0.00 42.46 36.50 1cee s ILE 137 CO 0.24 0.16 0.64 0.42 -1.23 0.00 0.00 174.94 175.17 1cee s THR 138 N 0.87 4.97 0.29 2.92 -4.23 -1.26 -4.91 115.64 114.28 1cee s THR 138 Ca 0.55 0.11 0.02 0.00 -1.18 0.00 0.00 61.69 61.20 1cee s THR 138 Cb -0.26 -3.78 0.30 0.00 1.34 0.00 0.00 72.50 70.10 1cee s THR 138 CO 0.29 -0.50 1.66 -0.65 -0.54 0.00 0.00 174.62 174.89 1cee h PRO 139 N 1.18 0.26 -0.01 3.99 0.11 -2.00 -2.59 132.00 132.95 1cee h PRO 139 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1cee h PRO 139 Cb 1.20 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1cee h PRO 139 CO 0.64 0.17 -0.02 1.49 -0.21 0.00 0.00 178.00 180.07 1cee h GLU 140 N 0.26 -0.02 -0.82 1.05 4.81 -1.98 0.54 114.58 118.43 1cee h GLU 140 Ca 0.55 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.86 1cee h GLU 140 Cb 1.09 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 30.37 1cee h GLU 140 CO -0.61 -0.01 -0.54 1.15 -0.73 0.00 0.00 179.01 178.27 1cee h THR 141 N -0.02 0.00 -0.33 0.32 2.02 -1.87 0.55 112.91 113.58 1cee h THR 141 Ca 0.00 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.25 1cee h THR 141 Cb 0.03 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.37 1cee h THR 141 CO -0.02 0.00 -0.09 0.00 0.37 0.00 0.00 175.52 175.78 1cee h ALA 142 N 0.29 0.21 -0.08 6.16 0.00 -1.37 -2.14 119.26 122.33 1cee h ALA 142 Ca 0.13 0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.21 1cee h ALA 142 Cb 0.41 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 1cee h ALA 142 CO -0.81 -0.47 -0.33 1.49 0.00 0.00 0.00 179.25 179.13 1cee h GLU 143 N -0.01 -0.42 -0.95 0.00 4.22 0.27 0.19 114.58 117.87 1cee h GLU 143 Ca 0.16 0.03 0.28 0.00 0.08 0.00 0.00 59.36 59.91 1cee h GLU 143 Cb 0.26 0.10 -0.15 0.00 0.50 0.00 0.00 28.75 29.46 1cee h GLU 143 CO -0.35 -0.28 0.42 -0.22 -2.18 0.00 0.00 179.01 176.40 1cee h LYS 144 N -0.44 0.27 -0.09 1.92 3.64 0.57 0.70 116.57 123.14 1cee h LYS 144 Ca 0.08 -0.02 -0.21 0.00 -1.27 0.00 0.00 60.65 59.24 1cee h LYS 144 Cb 0.56 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1cee h LYS 144 CO -0.32 0.18 -0.79 -0.07 -2.27 0.00 0.00 179.45 176.18 1cee h LEU 145 N 0.28 0.67 -2.01 5.20 3.38 -0.67 -0.29 115.31 121.88 1cee h LEU 145 Ca 0.65 -0.46 0.15 0.00 0.09 0.00 0.00 57.88 58.32 1cee h LEU 145 Cb 1.41 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 1cee h LEU 145 CO -0.63 1.23 0.44 0.00 0.09 0.00 0.00 178.44 179.56 1cee h ALA 146 N 0.76 2.38 0.02 1.53 0.00 0.34 1.04 119.26 125.32 1cee h ALA 146 Ca -0.05 -0.02 -0.36 0.00 0.00 0.00 0.00 54.91 54.49 1cee h ALA 146 Cb 1.39 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.16 1cee h ALA 146 CO 0.15 -0.71 -2.20 0.54 0.00 0.00 0.00 179.25 177.03 1cee n ARG 147 N -4.09 0.68 -0.07 0.00 1.74 -0.68 0.77 116.66 115.00 1cee n ARG 147 Ca 0.10 0.13 -0.12 0.00 -0.77 0.00 0.00 57.85 57.20 1cee n ARG 147 Cb 0.65 -1.61 0.01 0.00 -1.02 0.00 0.00 32.46 30.50 1cee n ARG 147 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 1cee h ASP 148 N 0.01 0.87 -0.35 0.55 3.58 0.63 -2.90 116.42 118.80 1cee h ASP 148 Ca -0.48 -0.41 0.00 0.00 0.42 0.00 0.00 57.03 56.56 1cee h ASP 148 Cb 2.09 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 42.89 1cee h ASP 148 CO 0.02 1.17 0.00 0.18 -2.88 0.00 0.00 179.24 177.73 1cee n LEU 149 N -4.03 3.77 -1.74 2.28 4.77 0.34 -4.87 117.00 117.52 1cee n LEU 149 Ca -0.02 -1.91 -0.18 0.00 -0.03 0.00 0.00 56.01 53.86 1cee n LEU 149 Cb 0.56 -0.60 -0.06 0.00 -2.33 0.00 0.00 43.42 40.99 1cee n LEU 149 CO 0.48 0.48 -0.19 0.29 -1.33 0.00 0.00 177.39 177.12 1cee n LYS 150 N 0.39 -1.51 -1.82 3.23 4.01 -1.10 -4.89 118.16 116.48 1cee n LYS 150 Ca 0.16 1.04 -0.42 0.00 -0.51 0.00 0.00 58.31 58.59 1cee n LYS 150 Cb 0.80 -5.46 -0.03 0.00 -0.51 0.00 0.00 35.03 29.83 1cee n LYS 150 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1cee s ALA 151 N -2.65 3.86 0.48 7.82 0.00 0.23 -4.62 121.76 126.89 1cee s ALA 151 Ca 0.00 1.50 0.28 0.00 0.00 0.00 0.00 51.96 53.74 1cee s ALA 151 Cb 0.00 -3.66 1.35 0.00 0.00 0.00 0.00 23.12 20.81 1cee s ALA 151 CO 0.00 -0.87 1.82 -0.39 0.00 0.00 0.00 175.76 176.32 1cee h VAL 152 N 3.84 0.51 0.00 0.00 -1.51 -1.44 -3.41 116.25 114.24 1cee h VAL 152 Ca -0.43 -0.06 0.00 0.00 -1.23 0.00 0.00 66.70 64.98 1cee h VAL 152 Cb 1.20 0.33 0.00 0.00 -2.13 0.00 0.00 31.29 30.69 1cee h VAL 152 CO 0.92 0.03 0.00 0.29 -1.23 0.00 0.00 177.57 177.58 1cee n LYS 153 N -4.37 0.00 -3.96 5.19 5.02 -1.26 -5.03 118.16 113.75 1cee n LYS 153 Ca 0.23 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 56.16 1cee n LYS 153 Cb 1.01 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.94 1cee n LYS 153 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1cee s TYR 154 N -2.00 3.45 -0.08 2.13 5.04 -1.26 -0.13 117.35 124.50 1cee s TYR 154 Ca 0.00 0.38 -0.06 0.00 -2.44 0.00 0.00 57.07 54.96 1cee s TYR 154 Cb 0.00 -1.96 0.03 0.00 0.35 0.00 0.00 41.96 40.38 1cee s TYR 154 CO 0.00 0.55 0.19 0.14 -1.34 0.00 0.00 175.55 175.10 1cee s VAL 155 N -0.62 -0.02 0.00 3.14 -7.23 0.26 -4.94 120.40 110.99 1cee s VAL 155 Ca 0.12 0.07 0.08 0.00 -1.81 0.00 0.00 61.98 60.44 1cee s VAL 155 Cb -0.12 -0.29 -0.02 0.00 0.56 0.00 0.00 36.38 36.51 1cee s VAL 155 CO 0.02 0.03 -0.25 -0.70 -0.31 0.00 0.00 175.10 173.89 1cee s GLU 156 N 0.57 1.88 0.21 4.82 2.12 -1.26 -1.75 118.70 125.29 1cee s GLU 156 Ca -0.04 -0.95 -0.21 0.00 0.36 0.00 0.00 54.97 54.13 1cee s GLU 156 Cb -0.05 -1.90 0.07 0.00 0.26 0.00 0.00 34.13 32.51 1cee s GLU 156 CO -0.03 0.51 1.00 0.00 -0.54 0.00 0.00 175.26 176.20 1cee s SER 158 N -3.34 1.07 -0.10 0.00 0.15 -1.17 -4.29 113.70 106.01 1cee s SER 158 Ca 0.21 -0.89 0.19 0.00 0.70 0.00 0.00 55.95 56.16 1cee s SER 158 Cb -0.03 0.08 -0.27 0.00 -1.71 0.00 0.00 66.02 64.09 1cee s SER 158 CO 0.06 -0.40 0.32 0.00 1.20 0.00 0.00 173.24 174.42 1cee n ALA 159 N 0.35 2.05 0.06 5.45 0.00 -1.26 -2.08 120.51 125.08 1cee n ALA 159 Ca -0.15 -0.93 -0.13 0.00 0.00 0.00 0.00 53.44 52.23 1cee n ALA 159 Cb 0.59 -0.49 -0.14 0.00 0.00 0.00 0.00 19.45 19.41 1cee n ALA 159 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1cee h LEU 160 N 0.00 0.26 0.00 0.00 5.85 -1.95 -3.37 115.31 116.10 1cee h LEU 160 Ca -0.29 -0.34 -0.21 0.00 0.84 0.00 0.00 57.88 57.87 1cee h LEU 160 Cb 1.69 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.60 1cee h LEU 160 CO 0.02 1.28 -2.15 0.41 -0.34 0.00 0.00 178.44 177.66 1cee n THR 161 N -3.40 0.79 -1.63 1.05 -1.04 -1.26 -5.00 114.28 103.80 1cee n THR 161 Ca -0.11 -0.67 -0.07 0.00 -2.04 0.00 0.00 64.05 61.16 1cee n THR 161 Cb 1.02 -0.29 -0.02 0.00 -1.82 0.00 0.00 70.33 69.22 1cee n THR 161 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1cee n GLN 162 N -2.51 -0.52 -1.68 -2.82 6.02 -0.88 -4.93 117.38 110.05 1cee n GLN 162 Ca -0.20 0.56 -0.40 0.00 -0.01 0.00 0.00 57.00 56.95 1cee n GLN 162 Cb 0.89 -4.40 -0.03 0.00 1.02 0.00 0.00 30.24 27.72 1cee n GLN 162 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1cee s LYS 163 N -3.40 2.67 -1.57 -1.09 2.47 -1.24 -2.18 119.74 115.41 1cee s LYS 163 Ca 0.00 1.55 0.00 0.00 -1.56 0.00 0.00 55.97 55.96 1cee s LYS 163 Cb 0.00 -4.44 0.00 0.00 -1.46 0.00 0.00 37.83 31.93 1cee s LYS 163 CO 0.00 -2.63 0.00 0.41 0.16 0.00 0.00 175.35 173.29 1cee n GLY 164 N 5.81 1.10 0.12 5.54 0.00 -1.26 -3.03 105.19 113.48 1cee n GLY 164 Ca 0.31 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.28 1cee n GLY 164 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1cee h LEU 165 N 0.00 -0.31 -1.43 0.99 5.85 -1.67 -1.77 115.31 116.97 1cee h LEU 165 Ca -0.32 0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.52 1cee h LEU 165 Cb 1.05 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 42.13 1cee h LEU 165 CO 0.46 -0.17 0.50 0.50 -0.34 0.00 0.00 178.44 179.38 1cee h LYS 166 N -0.26 0.61 0.00 1.25 3.64 -1.89 0.40 116.57 120.32 1cee h LYS 166 Ca -0.02 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1cee h LYS 166 Cb 0.22 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1cee h LYS 166 CO 0.01 0.41 -0.11 -0.97 -2.27 0.00 0.00 179.45 176.51 1cee h ASN 167 N 0.63 0.00 0.38 4.20 -1.24 -1.91 -2.85 115.58 114.79 1cee h ASN 167 Ca 0.35 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.34 1cee h ASN 167 Cb 0.52 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.58 1cee h ASN 167 CO -0.13 0.11 -0.18 0.58 -1.29 0.00 0.00 177.43 176.52 1cee h VAL 168 N 0.00 0.63 -0.92 2.57 2.07 0.01 -3.03 116.25 117.58 1cee h VAL 168 Ca -0.00 -0.29 0.06 0.00 0.82 0.00 0.00 66.70 67.29 1cee h VAL 168 Cb 0.20 0.78 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 1cee h VAL 168 CO 0.01 0.06 0.60 -0.26 0.02 0.00 0.00 177.57 178.00 1cee h PHE 169 N -0.67 1.08 -0.56 1.57 0.04 -1.53 -0.77 116.94 116.10 1cee h PHE 169 Ca -0.05 0.03 0.16 0.00 2.80 0.00 0.00 57.97 60.91 1cee h PHE 169 Cb 0.48 -0.36 -0.02 0.00 2.20 0.00 0.00 35.95 38.25 1cee h PHE 169 CO -0.01 0.58 0.43 -0.44 -0.60 0.00 0.00 178.31 178.27 1cee h ASP 170 N 1.08 0.00 0.93 2.17 3.32 -1.39 0.22 116.42 122.75 1cee h ASP 170 Ca 0.39 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.22 1cee h ASP 170 Cb 0.15 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.67 1cee h ASP 170 CO -0.14 0.00 -1.06 -0.08 -1.72 0.00 0.00 179.24 176.24 1cee h GLU 171 N 0.00 0.04 0.09 3.56 4.81 -1.08 -3.09 114.58 118.91 1cee h GLU 171 Ca 0.27 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1cee h GLU 171 Cb 1.12 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1cee h GLU 171 CO -0.00 1.01 -0.04 0.00 -0.73 0.00 0.00 179.01 179.25 1cee h ALA 172 N 0.94 -0.87 -0.56 2.92 0.00 -0.39 -1.38 119.26 119.93 1cee h ALA 172 Ca -0.04 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 54.96 1cee h ALA 172 Cb 1.81 0.05 -0.11 0.00 0.00 0.00 0.00 17.79 19.54 1cee h ALA 172 CO 0.14 -0.86 -0.16 0.82 0.00 0.00 0.00 179.25 179.19 1cee h ILE 173 N -0.14 0.40 -0.80 0.00 5.03 -1.66 1.49 117.51 121.84 1cee h ILE 173 Ca -0.01 0.00 0.23 0.00 -0.12 0.00 0.00 64.86 64.96 1cee h ILE 173 Cb 0.09 0.40 -0.03 0.00 -3.03 0.00 0.00 36.82 34.25 1cee h ILE 173 CO 0.02 0.00 0.60 0.25 -0.68 0.00 0.00 178.15 178.34 1cee h LEU 174 N -0.03 0.00 0.04 1.44 5.85 -1.58 -1.62 115.31 119.41 1cee h LEU 174 Ca 0.27 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.70 1cee h LEU 174 Cb 0.43 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1cee h LEU 174 CO -0.59 0.00 -1.55 0.00 -0.34 0.00 0.00 178.44 175.96 1cee n ALA 175 N -2.65 0.84 -0.35 1.25 0.00 0.30 -4.25 120.51 115.64 1cee n ALA 175 Ca 0.16 -0.55 0.25 0.00 0.00 0.00 0.00 53.44 53.30 1cee n ALA 175 Cb 0.89 -0.56 0.50 0.00 0.00 0.00 0.00 19.45 20.28 1cee n ALA 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1cee h ALA 176 N -0.35 2.13 -3.28 0.00 0.00 0.25 -3.41 119.26 114.60 1cee h ALA 176 Ca -0.39 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1cee h ALA 176 Cb 1.54 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1cee h ALA 176 CO -0.13 -0.67 0.00 1.28 0.00 0.00 0.00 179.25 179.73 1cee n LEU 177 N -4.86 0.00 -3.64 0.00 4.77 -0.80 -4.62 117.00 107.84 1cee n LEU 177 Ca 0.30 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.23 1cee n LEU 177 Cb 0.99 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 42.07 1cee n LEU 177 CO 0.16 -0.29 0.73 -1.83 -1.33 0.00 0.00 177.39 174.83 1cee s GLU 178 N -0.89 0.99 0.00 3.23 -1.05 -1.26 -5.00 118.70 114.71 1cee s GLU 178 Ca 0.00 -0.48 0.00 0.00 -0.15 0.00 0.00 54.97 54.34 1cee s GLU 178 Cb 0.00 0.38 0.00 0.00 -0.44 0.00 0.00 34.13 34.07 1cee s GLU 178 CO 0.00 -0.44 0.09 -0.35 0.95 0.00 0.00 175.26 175.51