#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c12 s ILE 2 N 0.00 4.76 -0.70 0.53 1.01 -1.26 -4.99 121.20 120.55 1c12 s ILE 2 Ca 0.00 1.46 -0.24 0.00 0.00 0.00 0.00 60.65 61.87 1c12 s ILE 2 Cb 0.00 -4.19 0.06 0.00 0.01 0.00 0.00 42.46 38.34 1c12 s ILE 2 CO 0.00 -0.22 1.07 -0.70 0.00 0.00 0.00 174.94 175.09 1c12 s GLU 3 N 3.04 3.15 -0.34 2.79 2.12 -1.26 -4.72 118.70 123.48 1c12 s GLU 3 Ca 0.36 -0.69 -0.19 0.00 0.36 0.00 0.00 54.97 54.82 1c12 s GLU 3 Cb -0.14 -4.25 -0.00 0.00 0.26 0.00 0.00 34.13 29.99 1c12 s GLU 3 CO 0.11 -1.92 0.55 -0.51 -0.54 0.00 0.00 175.26 172.94 1c12 s LEU 4 N 4.55 4.28 -0.20 2.70 2.01 -1.26 -1.72 118.68 129.04 1c12 s LEU 4 Ca 0.27 0.10 -0.06 0.00 0.01 0.00 0.00 54.13 54.45 1c12 s LEU 4 Cb -0.14 -2.65 -0.03 0.00 0.01 0.00 0.00 46.19 43.38 1c12 s LEU 4 CO 0.11 -0.49 0.02 -0.89 1.01 0.00 0.00 176.35 176.11 1c12 s THR 5 N 2.48 4.19 0.14 5.49 2.01 0.02 -4.29 115.64 125.68 1c12 s THR 5 Ca 0.21 -0.23 0.04 0.00 0.31 0.00 0.00 61.69 62.02 1c12 s THR 5 Cb -0.15 -2.90 -0.04 0.00 0.01 0.00 0.00 72.50 69.42 1c12 s THR 5 CO 0.13 0.43 0.13 -1.10 -0.69 0.00 0.00 174.62 173.52 1c12 s GLN 6 N 0.87 2.95 -0.26 4.92 -0.21 -1.26 -0.67 119.66 126.00 1c12 s GLN 6 Ca 0.02 -0.79 -0.25 0.00 0.02 0.00 0.00 55.36 54.35 1c12 s GLN 6 Cb -0.14 -2.70 0.07 0.00 1.00 0.00 0.00 33.01 31.24 1c12 s GLN 6 CO 0.02 0.51 0.72 -1.54 -2.12 0.00 0.00 175.29 172.88 1c12 s SER 7 N -2.91 -0.74 1.02 5.90 1.04 -0.80 -4.58 113.70 112.62 1c12 s SER 7 Ca 0.31 1.41 -0.16 0.00 0.48 0.00 0.00 55.95 57.99 1c12 s SER 7 Cb -0.11 1.43 0.21 0.00 0.10 0.00 0.00 66.02 67.65 1c12 s SER 7 CO 0.23 -0.26 1.19 -2.16 0.98 0.00 0.00 173.24 173.22 1c12 s PRO 8 N 0.31 0.19 0.05 4.02 0.04 -1.26 -2.01 135.00 136.33 1c12 s PRO 8 Ca -0.00 -0.06 0.25 0.00 0.04 0.00 0.00 61.00 61.24 1c12 s PRO 8 Cb -0.05 -1.76 0.60 0.00 0.04 0.00 0.00 34.50 33.33 1c12 s PRO 8 CO 0.01 -2.78 1.49 -1.13 0.04 0.00 0.00 177.00 174.64 1c12 n SER 9 N -4.10 0.49 -3.62 6.66 3.41 -1.26 -4.51 113.62 110.69 1c12 n SER 9 Ca 0.12 0.03 0.01 0.00 -0.26 0.00 0.00 58.87 58.76 1c12 n SER 9 Cb 0.59 0.04 -0.01 0.00 -0.26 0.00 0.00 64.21 64.58 1c12 n SER 9 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1c12 s SER 10 N -3.45 -0.07 -0.29 4.04 1.04 -1.26 -2.46 113.70 111.26 1c12 s SER 10 Ca 0.10 -0.12 -0.18 0.00 0.48 0.00 0.00 55.95 56.23 1c12 s SER 10 Cb 0.16 0.16 0.13 0.00 0.10 0.00 0.00 66.02 66.58 1c12 s SER 10 CO 0.67 -0.30 0.96 0.00 0.98 0.00 0.00 173.24 175.55 1c12 s MET 11 N -2.43 0.44 -0.36 4.02 0.00 -0.16 -4.84 119.30 115.97 1c12 s MET 11 Ca 0.13 0.71 -0.23 0.00 0.00 0.00 0.00 55.69 56.31 1c12 s MET 11 Cb 0.04 0.12 0.01 0.00 0.00 0.00 0.00 34.83 34.99 1c12 s MET 11 CO -0.04 -0.08 0.75 -1.12 0.00 0.00 0.00 175.02 174.53 1c12 s SER 12 N 1.14 6.52 0.05 -1.18 0.01 -1.25 -0.19 113.70 118.80 1c12 s SER 12 Ca -0.07 0.31 -0.00 0.00 1.31 0.00 0.00 55.95 57.50 1c12 s SER 12 Cb -0.04 -2.38 -0.03 0.00 0.21 0.00 0.00 66.02 63.78 1c12 s SER 12 CO -0.14 -0.70 -0.04 0.68 0.41 0.00 0.00 173.24 173.46 1c12 s VAL 13 N 3.01 0.28 0.25 3.43 -7.23 0.10 -4.68 120.40 115.55 1c12 s VAL 13 Ca 0.30 -1.53 0.02 0.00 -1.81 0.00 0.00 61.98 58.96 1c12 s VAL 13 Cb -0.13 -1.13 -0.03 0.00 0.56 0.00 0.00 36.38 35.64 1c12 s VAL 13 CO 0.16 -0.80 0.40 -0.44 -0.31 0.00 0.00 175.10 174.11 1c12 s SER 14 N -2.44 6.33 0.27 4.85 0.01 -1.26 -1.76 113.70 119.71 1c12 s SER 14 Ca 0.00 0.25 -0.30 0.00 1.31 0.00 0.00 55.95 57.21 1c12 s SER 14 Cb 0.01 -1.94 -0.11 0.00 0.21 0.00 0.00 66.02 64.19 1c12 s SER 14 CO -0.06 -0.10 1.55 -0.76 0.41 0.00 0.00 173.24 174.27 1c12 s LEU 15 N -3.82 4.36 0.00 2.44 1.02 -1.26 -2.26 118.68 119.16 1c12 s LEU 15 Ca 0.36 2.85 0.00 0.00 0.02 0.00 0.00 54.13 57.36 1c12 s LEU 15 Cb -0.10 -3.63 0.00 0.00 0.02 0.00 0.00 46.19 42.48 1c12 s LEU 15 CO 0.31 -0.84 0.00 0.61 0.02 0.00 0.00 176.35 176.44 1c12 n GLY 16 N 2.25 0.26 3.90 -3.19 0.00 -0.65 -4.91 105.19 102.85 1c12 n GLY 16 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1c12 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1c12 s ASP 17 N -2.20 5.55 -0.14 1.61 -0.00 -0.96 -4.32 116.67 116.21 1c12 s ASP 17 Ca 0.00 0.96 -0.03 0.00 -0.00 0.00 0.00 52.55 53.48 1c12 s ASP 17 Cb 0.00 -1.86 -0.03 0.00 -0.00 0.00 0.00 42.92 41.04 1c12 s ASP 17 CO 0.00 -1.19 -0.05 -0.89 -0.00 0.00 0.00 175.17 173.04 1c12 s THR 18 N -3.18 3.75 0.04 -1.27 2.01 -1.26 -0.57 115.64 115.17 1c12 s THR 18 Ca 0.56 -0.41 0.08 0.00 0.31 0.00 0.00 61.69 62.23 1c12 s THR 18 Cb -0.11 -2.63 -0.03 0.00 0.01 0.00 0.00 72.50 69.75 1c12 s THR 18 CO 0.49 0.51 -0.23 -0.69 -0.69 0.00 0.00 174.62 174.01 1c12 s VAL 19 N 0.26 1.82 -0.08 3.82 1.01 -0.90 -4.98 120.40 121.34 1c12 s VAL 19 Ca -0.04 -1.26 0.01 0.00 0.00 0.00 0.00 61.98 60.68 1c12 s VAL 19 Cb -0.14 -1.57 0.02 0.00 0.00 0.00 0.00 36.38 34.68 1c12 s VAL 19 CO 0.03 0.25 -0.09 -0.55 0.00 0.00 0.00 175.10 174.74 1c12 s SER 20 N -1.21 1.85 -0.06 3.32 0.15 -1.26 -1.11 113.70 115.38 1c12 s SER 20 Ca 0.09 -0.28 0.03 0.00 0.70 0.00 0.00 55.95 56.49 1c12 s SER 20 Cb -0.09 -0.79 -0.02 0.00 -1.71 0.00 0.00 66.02 63.41 1c12 s SER 20 CO 0.02 -0.04 -0.15 -0.63 1.20 0.00 0.00 173.24 173.64 1c12 s ILE 21 N 1.14 2.98 0.14 6.45 1.01 0.19 -4.75 121.20 128.37 1c12 s ILE 21 Ca -0.06 -0.74 0.10 0.00 0.00 0.00 0.00 60.65 59.95 1c12 s ILE 21 Cb -0.14 -2.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.11 1c12 s ILE 21 CO -0.02 0.58 -0.22 0.42 0.00 0.00 0.00 174.94 175.70 1c12 s THR 22 N -0.51 2.01 -0.04 2.92 -4.23 -0.85 0.10 115.64 115.04 1c12 s THR 22 Ca 0.07 -1.79 0.01 0.00 -1.18 0.00 0.00 61.69 58.80 1c12 s THR 22 Cb -0.12 -1.85 0.02 0.00 1.34 0.00 0.00 72.50 71.89 1c12 s THR 22 CO 0.01 -0.10 -0.06 0.00 -0.54 0.00 0.00 174.62 173.94 1c12 s HIS 24 N 0.71 2.67 0.07 0.00 2.46 0.15 -1.77 115.29 119.59 1c12 s HIS 24 Ca -0.10 -1.06 -0.07 0.00 0.47 0.00 0.00 55.06 54.30 1c12 s HIS 24 Cb -0.13 -1.79 -0.05 0.00 -0.13 0.00 0.00 32.58 30.48 1c12 s HIS 24 CO 0.00 -0.45 0.35 0.00 -2.47 0.00 0.00 174.74 172.17 1c12 s ALA 25 N 0.55 3.79 -1.88 1.58 0.00 0.19 -0.80 121.76 125.19 1c12 s ALA 25 Ca -0.12 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.33 1c12 s ALA 25 Cb -0.17 -2.15 0.00 0.00 0.00 0.00 0.00 23.12 20.81 1c12 s ALA 25 CO 0.04 0.63 0.40 -1.13 0.00 0.00 0.00 175.76 175.70 1c12 n SER 26 N 0.71 0.05 -3.60 0.00 3.41 -0.70 -4.74 113.62 108.75 1c12 n SER 26 Ca -0.07 -0.86 0.01 0.00 -0.26 0.00 0.00 58.87 57.69 1c12 n SER 26 Cb 0.52 -0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.44 1c12 n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1c12 s GLN 27 N -1.88 0.05 0.04 4.33 -2.07 -1.26 -4.93 119.66 113.94 1c12 s GLN 27 Ca 0.00 -0.02 -0.30 0.00 -1.82 0.00 0.00 55.36 53.21 1c12 s GLN 27 Cb 0.00 0.02 -0.08 0.00 -1.09 0.00 0.00 33.01 31.86 1c12 s GLN 27 CO 0.00 -0.02 1.81 0.20 -1.32 0.00 0.00 175.29 175.95 1c12 s GLY 28 N -2.55 1.47 0.00 2.60 0.00 -1.26 -4.47 107.32 103.11 1c12 s GLY 28 Ca 0.13 1.24 0.14 0.00 0.00 0.00 0.00 44.72 46.23 1c12 s GLY 28 CO -0.05 3.19 1.20 0.29 0.00 0.00 0.00 173.10 177.74 1c12 n ILE 29 N 5.21 0.67 -3.72 0.90 -5.35 -0.70 -4.96 119.36 111.41 1c12 n ILE 29 Ca 0.18 -0.84 -0.25 0.00 -0.27 0.00 0.00 62.75 61.57 1c12 n ILE 29 Cb 0.41 0.76 0.05 0.00 -1.74 0.00 0.00 39.64 39.12 1c12 n ILE 29 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1c12 n SER 30 N 0.78 -4.26 -0.88 7.28 7.64 -1.25 -2.05 113.62 120.88 1c12 n SER 30 Ca 0.13 -0.69 -0.11 0.00 1.01 0.00 0.00 58.87 59.20 1c12 n SER 30 Cb 0.43 -4.43 -0.05 0.00 -1.01 0.00 0.00 64.21 59.16 1c12 n SER 30 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1c12 n SER 31 N -2.97 -5.35 -4.19 6.43 2.88 -1.26 -4.91 113.62 104.24 1c12 n SER 31 Ca -0.07 0.28 -0.43 0.00 -1.33 0.00 0.00 58.87 57.32 1c12 n SER 31 Cb 0.58 -3.86 0.00 0.00 -0.75 0.00 0.00 64.21 60.19 1c12 n SER 31 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1c12 n ASN 32 N -0.92 5.25 -3.80 -3.46 3.02 -0.87 -2.32 115.26 112.16 1c12 n ASN 32 Ca -0.11 -3.06 -0.12 0.00 -0.03 0.00 0.00 54.58 51.25 1c12 n ASN 32 Cb 0.54 -1.51 -0.10 0.00 -0.61 0.00 0.00 39.78 38.11 1c12 n ASN 32 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1c12 s ILE 33 N 0.69 0.06 0.14 2.41 2.07 -1.26 -2.47 121.20 122.84 1c12 s ILE 33 Ca 0.40 -0.46 0.05 0.00 -1.41 0.00 0.00 60.65 59.23 1c12 s ILE 33 Cb 0.02 -0.51 -0.04 0.00 0.13 0.00 0.00 42.46 42.06 1c12 s ILE 33 CO 0.00 -0.25 -0.11 -0.83 -1.91 0.00 0.00 174.94 171.84 1c12 s GLY 34 N -1.08 1.07 -0.10 1.50 0.00 -0.90 -1.73 107.32 106.08 1c12 s GLY 34 Ca -0.11 -1.46 0.03 0.00 0.00 0.00 0.00 44.72 43.18 1c12 s GLY 34 CO 0.03 -1.55 -0.22 -0.98 0.00 0.00 0.00 173.10 170.37 1c12 s TRP 35 N -3.13 2.59 0.11 1.90 0.52 -0.50 -1.73 118.94 118.70 1c12 s TRP 35 Ca 0.15 -0.97 0.08 0.00 0.02 0.00 0.00 56.10 55.38 1c12 s TRP 35 Cb 0.01 -1.73 -0.04 0.00 -1.15 0.00 0.00 33.47 30.57 1c12 s TRP 35 CO 0.01 -0.38 -0.15 -0.51 0.02 0.00 0.00 176.95 175.94 1c12 s LEU 36 N 0.32 2.82 -0.12 2.99 1.02 0.12 0.34 118.68 126.17 1c12 s LEU 36 Ca -0.17 -0.49 0.03 0.00 0.02 0.00 0.00 54.13 53.52 1c12 s LEU 36 Cb -0.17 -1.65 0.01 0.00 0.02 0.00 0.00 46.19 44.40 1c12 s LEU 36 CO 0.08 0.18 -0.21 -1.58 0.02 0.00 0.00 176.35 174.85 1c12 s GLN 37 N -2.11 2.80 -0.22 1.70 0.74 0.99 -1.16 119.66 122.40 1c12 s GLN 37 Ca 0.19 -0.78 0.01 0.00 0.05 0.00 0.00 55.36 54.82 1c12 s GLN 37 Cb -0.11 -2.23 0.03 0.00 1.10 0.00 0.00 33.01 31.81 1c12 s GLN 37 CO 0.11 0.05 -0.13 -1.14 -0.55 0.00 0.00 175.29 173.62 1c12 s GLN 38 N 0.67 2.76 0.69 1.67 0.74 0.49 -0.53 119.66 126.16 1c12 s GLN 38 Ca -0.11 -1.00 -0.05 0.00 0.05 0.00 0.00 55.36 54.24 1c12 s GLN 38 Cb -0.16 -2.79 0.07 0.00 1.10 0.00 0.00 33.01 31.23 1c12 s GLN 38 CO 0.02 -0.36 0.99 0.15 -0.55 0.00 0.00 175.29 175.54 1c12 s LYS 39 N 1.26 2.10 -0.20 1.67 1.02 -1.19 -1.75 119.74 122.63 1c12 s LYS 39 Ca -0.00 -0.47 -0.39 0.00 0.02 0.00 0.00 55.97 55.13 1c12 s LYS 39 Cb -0.16 -2.23 -0.15 0.00 -0.52 0.00 0.00 37.83 34.77 1c12 s LYS 39 CO -0.08 -1.24 1.74 -2.30 -0.92 0.00 0.00 175.35 172.55 1c12 n PRO 40 N -2.86 1.39 0.00 -1.68 -0.02 -1.26 -2.44 135.00 128.13 1c12 n PRO 40 Ca 0.09 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1c12 n PRO 40 Cb 0.60 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1c12 n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1c12 n GLY 41 N 4.10 2.01 0.00 -1.23 0.00 -1.26 -4.82 105.19 103.99 1c12 n GLY 41 Ca 0.25 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1c12 n GLY 41 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1c12 n LYS 42 N 0.00 1.49 -3.43 1.61 3.00 -1.02 -5.13 118.16 114.68 1c12 n LYS 42 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 58.10 1c12 n LYS 42 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.03 1c12 n LYS 42 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1c12 s SER 43 N -1.48 5.11 0.23 3.14 0.15 -1.26 -4.85 113.70 114.73 1c12 s SER 43 Ca 0.00 -0.78 -0.01 0.00 0.70 0.00 0.00 55.95 55.86 1c12 s SER 43 Cb 0.00 -0.30 -0.04 0.00 -1.71 0.00 0.00 66.02 63.97 1c12 s SER 43 CO 0.00 -0.85 0.42 -0.36 1.20 0.00 0.00 173.24 173.65 1c12 s PHE 44 N -2.53 3.48 -0.04 3.44 0.08 -1.26 -3.16 117.98 117.99 1c12 s PHE 44 Ca 0.49 0.36 -0.01 0.00 0.12 0.00 0.00 56.93 57.89 1c12 s PHE 44 Cb -0.05 -1.87 0.03 0.00 -0.57 0.00 0.00 43.02 40.57 1c12 s PHE 44 CO 0.30 0.34 0.08 0.21 -0.10 0.00 0.00 175.22 176.04 1c12 s LYS 45 N -3.46 -0.00 0.02 0.44 2.36 0.31 -4.97 119.74 114.43 1c12 s LYS 45 Ca 0.39 0.30 -0.30 0.00 -2.55 0.00 0.00 55.97 53.81 1c12 s LYS 45 Cb -0.11 -0.27 -0.04 0.00 -1.05 0.00 0.00 37.83 36.36 1c12 s LYS 45 CO 0.30 -0.21 1.08 0.20 1.55 0.00 0.00 175.35 178.27 1c12 s GLY 46 N 1.38 2.65 -0.13 5.54 0.00 -1.26 -0.01 107.32 115.50 1c12 s GLY 46 Ca -0.06 0.68 -0.11 0.00 0.00 0.00 0.00 44.72 45.23 1c12 s GLY 46 CO -0.04 1.86 -0.22 1.04 0.00 0.00 0.00 173.10 175.75 1c12 n LEU 47 N 3.97 1.45 -4.14 0.66 4.77 0.15 -4.72 117.00 119.14 1c12 n LEU 47 Ca 0.07 0.37 -0.14 0.00 -0.03 0.00 0.00 56.01 56.28 1c12 n LEU 47 Cb 0.49 -0.72 -0.11 0.00 -2.33 0.00 0.00 43.42 40.74 1c12 n LEU 47 CO 0.54 -0.39 -0.42 0.27 -1.33 0.00 0.00 177.39 176.07 1c12 s ILE 48 N -2.26 0.83 0.18 -0.08 -5.25 -1.18 -1.87 121.20 111.57 1c12 s ILE 48 Ca -0.18 -1.48 0.06 0.00 -0.99 0.00 0.00 60.65 58.06 1c12 s ILE 48 Cb 0.02 -1.16 -0.05 0.00 2.95 0.00 0.00 42.46 44.23 1c12 s ILE 48 CO 0.27 -0.50 -0.11 -0.72 -1.79 0.00 0.00 174.94 172.09 1c12 s TYR 49 N -2.12 1.47 -1.53 1.37 -0.85 0.19 -1.41 117.35 114.46 1c12 s TYR 49 Ca 0.01 -0.70 -0.10 0.00 -0.52 0.00 0.00 57.07 55.77 1c12 s TYR 49 Cb -0.05 -0.73 0.08 0.00 0.38 0.00 0.00 41.96 41.64 1c12 s TYR 49 CO -0.00 0.19 0.72 1.58 -1.52 0.00 0.00 175.55 176.51 1c12 n HIS 50 N -0.29 -1.88 0.00 -3.49 -0.00 -0.90 -1.64 115.22 107.02 1c12 n HIS 50 Ca -0.09 0.82 0.00 0.00 -0.00 0.00 0.00 57.72 58.45 1c12 n HIS 50 Cb 0.61 -3.61 0.00 0.00 -0.00 0.00 0.00 29.99 26.99 1c12 n HIS 50 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1c12 n GLY 51 N -1.67 0.47 0.00 1.57 0.00 -0.70 -4.13 105.19 100.73 1c12 n GLY 51 Ca -0.09 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.94 1c12 n GLY 51 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1c12 n THR 52 N 0.00 0.04 -2.69 2.61 -2.24 -1.20 -3.37 114.28 107.43 1c12 n THR 52 Ca 0.00 -0.09 -0.42 0.00 -2.27 0.00 0.00 64.05 61.27 1c12 n THR 52 Cb 0.00 0.15 -0.03 0.00 -2.10 0.00 0.00 70.33 68.35 1c12 n THR 52 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1c12 s ASN 53 N -2.59 7.36 0.47 3.42 0.01 -0.65 -4.33 114.94 118.63 1c12 s ASN 53 Ca -0.01 1.71 -0.13 0.00 -0.71 0.00 0.00 52.86 53.72 1c12 s ASN 53 Cb 0.02 -2.57 -0.07 0.00 0.41 0.00 0.00 41.25 39.04 1c12 s ASN 53 CO 0.14 -0.25 0.88 -0.76 -1.51 0.00 0.00 177.10 175.59 1c12 s LEU 54 N 0.88 3.69 0.33 0.60 1.02 -1.26 0.53 118.68 124.48 1c12 s LEU 54 Ca 0.52 1.33 -0.00 0.00 0.02 0.00 0.00 54.13 55.99 1c12 s LEU 54 Cb -0.22 -4.25 -0.04 0.00 0.02 0.00 0.00 46.19 41.71 1c12 s LEU 54 CO 0.28 -0.52 0.55 -1.61 0.02 0.00 0.00 176.35 175.07 1c12 s GLU 55 N -4.07 3.51 0.09 1.70 2.02 -0.78 -4.82 118.70 116.35 1c12 s GLU 55 Ca 0.55 -0.28 -0.34 0.00 0.02 0.00 0.00 54.97 54.91 1c12 s GLU 55 Cb -0.10 -2.66 -0.14 0.00 0.10 0.00 0.00 34.13 31.33 1c12 s GLU 55 CO 0.33 0.16 1.63 -3.47 0.02 0.00 0.00 175.26 173.94 1c12 n ASP 56 N -1.63 3.06 0.00 -0.19 2.03 -1.26 -1.64 116.55 116.92 1c12 n ASP 56 Ca -0.04 1.06 0.00 0.00 0.52 0.00 0.00 54.79 56.33 1c12 n ASP 56 Cb 0.56 -1.39 0.00 0.00 -0.72 0.00 0.00 41.12 39.57 1c12 n ASP 56 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1c12 n GLY 57 N 3.60 3.22 3.64 0.27 0.00 -1.26 -5.04 105.19 109.62 1c12 n GLY 57 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1c12 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c12 s VAL 58 N -2.61 3.83 0.35 1.61 1.01 -0.65 -4.97 120.40 118.97 1c12 s VAL 58 Ca 0.00 0.96 -0.26 0.00 0.00 0.00 0.00 61.98 62.68 1c12 s VAL 58 Cb 0.00 -3.77 -0.12 0.00 0.00 0.00 0.00 36.38 32.49 1c12 s VAL 58 CO 0.00 -0.25 1.05 -0.81 0.00 0.00 0.00 175.10 175.09 1c12 n PRO 59 N 7.34 1.48 -0.03 2.72 -0.04 -1.26 -4.86 135.00 140.36 1c12 n PRO 59 Ca 0.17 0.52 0.24 0.00 -0.04 0.00 0.00 63.50 64.40 1c12 n PRO 59 Cb 0.45 -2.01 0.66 0.00 -0.04 0.00 0.00 33.50 32.56 1c12 n PRO 59 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1c12 h SER 60 N 1.90 0.00 0.07 3.54 4.64 -2.00 -2.72 113.55 118.97 1c12 h SER 60 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1c12 h SER 60 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1c12 h SER 60 CO 0.59 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 174.44 1c12 n ARG 61 N -3.58 0.30 -3.83 4.77 1.85 -1.26 -4.67 116.66 110.24 1c12 n ARG 61 Ca 0.13 0.06 -0.37 0.00 -1.00 0.00 0.00 57.85 56.67 1c12 n ARG 61 Cb 0.94 -1.50 -0.06 0.00 -1.05 0.00 0.00 32.46 30.80 1c12 n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1c12 s PHE 62 N -2.18 3.61 -0.18 2.89 0.08 -1.03 -1.97 117.98 119.20 1c12 s PHE 62 Ca 0.15 0.58 -0.14 0.00 0.12 0.00 0.00 56.93 57.64 1c12 s PHE 62 Cb 0.08 -1.98 0.05 0.00 -0.57 0.00 0.00 43.02 40.60 1c12 s PHE 62 CO 0.14 0.72 0.47 -1.12 -0.10 0.00 0.00 175.22 175.33 1c12 s SER 63 N -1.11 -0.54 0.12 1.36 0.01 -0.04 -4.98 113.70 108.51 1c12 s SER 63 Ca 0.17 0.98 0.08 0.00 1.31 0.00 0.00 55.95 58.50 1c12 s SER 63 Cb -0.13 0.94 -0.04 0.00 0.21 0.00 0.00 66.02 67.00 1c12 s SER 63 CO 0.06 -0.18 -0.15 -0.83 0.41 0.00 0.00 173.24 172.56 1c12 s GLY 64 N 0.75 1.73 0.15 3.44 0.00 -1.26 0.10 107.32 112.23 1c12 s GLY 64 Ca -0.04 -1.33 -0.14 0.00 0.00 0.00 0.00 44.72 43.21 1c12 s GLY 64 CO -0.06 -1.31 0.39 -1.35 0.00 0.00 0.00 173.10 170.78 1c12 s SER 65 N -2.22 -0.15 0.00 1.64 1.04 -0.06 -4.45 113.70 109.50 1c12 s SER 65 Ca 0.20 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 56.11 1c12 s SER 65 Cb -0.11 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.50 1c12 s SER 65 CO 0.12 -0.91 0.00 0.61 0.98 0.00 0.00 173.24 174.03 1c12 n GLY 66 N -0.24 4.27 3.24 7.32 0.00 -1.26 0.12 105.19 118.63 1c12 n GLY 66 Ca -0.12 -1.52 -0.09 0.00 0.00 0.00 0.00 46.02 44.28 1c12 n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c12 s SER 67 N 0.00 0.08 0.76 1.61 0.01 -0.16 -4.90 113.70 111.10 1c12 s SER 67 Ca 0.00 -0.67 0.00 0.00 1.31 0.00 0.00 55.95 56.59 1c12 s SER 67 Cb 0.00 0.37 0.00 0.00 0.21 0.00 0.00 66.02 66.60 1c12 s SER 67 CO 0.00 -0.77 0.00 0.61 0.41 0.00 0.00 173.24 173.49 1c12 n GLY 68 N -0.10 0.82 0.31 3.44 0.00 -1.26 -1.30 105.19 107.10 1c12 n GLY 68 Ca -0.14 0.66 0.03 0.00 0.00 0.00 0.00 46.02 46.57 1c12 n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c12 n ALA 69 N 8.10 2.12 -3.94 4.61 0.00 -1.26 -1.72 120.51 128.42 1c12 n ALA 69 Ca 0.00 -1.03 -0.28 0.00 0.00 0.00 0.00 53.44 52.13 1c12 n ALA 69 Cb 0.00 -0.22 -0.17 0.00 0.00 0.00 0.00 19.45 19.07 1c12 n ALA 69 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1c12 s ASP 70 N -0.96 2.50 0.14 0.00 1.01 -0.42 -0.64 116.67 118.30 1c12 s ASP 70 Ca 0.11 -0.45 0.07 0.00 0.71 0.00 0.00 52.55 52.99 1c12 s ASP 70 Cb 0.06 -0.97 -0.04 0.00 1.01 0.00 0.00 42.92 42.98 1c12 s ASP 70 CO 0.08 -0.11 -0.15 -0.31 0.21 0.00 0.00 175.17 174.89 1c12 s TYR 71 N 1.61 1.51 -0.02 4.23 1.51 -0.73 -0.99 117.35 124.48 1c12 s TYR 71 Ca 0.04 -0.54 -0.05 0.00 -1.01 0.00 0.00 57.07 55.50 1c12 s TYR 71 Cb -0.13 -0.77 0.01 0.00 -0.11 0.00 0.00 41.96 40.95 1c12 s TYR 71 CO -0.09 0.20 0.12 0.45 -1.11 0.00 0.00 175.55 175.12 1c12 s SER 72 N -2.57 -0.04 -0.12 2.29 0.15 0.32 -1.58 113.70 112.15 1c12 s SER 72 Ca 0.11 0.01 0.00 0.00 0.70 0.00 0.00 55.95 56.77 1c12 s SER 72 Cb -0.05 0.23 -0.02 0.00 -1.71 0.00 0.00 66.02 64.48 1c12 s SER 72 CO 0.04 -0.20 -0.13 -0.22 1.20 0.00 0.00 173.24 173.93 1c12 s LEU 73 N -0.67 2.76 -0.07 3.45 2.96 0.11 -0.89 118.68 126.34 1c12 s LEU 73 Ca -0.08 -0.29 0.03 0.00 -0.22 0.00 0.00 54.13 53.57 1c12 s LEU 73 Cb -0.05 -1.61 0.01 0.00 0.50 0.00 0.00 46.19 45.04 1c12 s LEU 73 CO 0.01 0.19 -0.16 -0.89 -1.32 0.00 0.00 176.35 174.18 1c12 s THR 74 N 0.19 1.41 -0.41 3.68 2.01 0.11 -0.64 115.64 122.00 1c12 s THR 74 Ca -0.07 -0.66 0.04 0.00 0.31 0.00 0.00 61.69 61.30 1c12 s THR 74 Cb -0.15 -1.24 0.11 0.00 0.01 0.00 0.00 72.50 71.23 1c12 s THR 74 CO 0.05 0.41 0.14 -0.63 -0.69 0.00 0.00 174.62 173.90 1c12 s ILE 75 N 0.41 2.30 -0.04 1.82 1.01 -0.27 -0.87 121.20 125.57 1c12 s ILE 75 Ca -0.12 -2.68 -0.30 0.00 0.00 0.00 0.00 60.65 57.55 1c12 s ILE 75 Cb -0.15 -2.66 -0.03 0.00 0.01 0.00 0.00 42.46 39.63 1c12 s ILE 75 CO 0.04 -0.69 1.12 -0.44 0.00 0.00 0.00 174.94 174.97 1c12 s SER 76 N 0.46 7.15 -0.38 3.58 0.01 -0.83 -2.13 113.70 121.57 1c12 s SER 76 Ca 0.13 1.76 -0.10 0.00 1.31 0.00 0.00 55.95 59.06 1c12 s SER 76 Cb -0.22 -2.56 0.01 0.00 0.21 0.00 0.00 66.02 63.46 1c12 s SER 76 CO -0.05 -0.48 0.35 -1.20 0.41 0.00 0.00 173.24 172.27 1c12 n SER 77 N 4.72 -7.94 -4.75 2.44 7.64 -1.00 -4.81 113.62 109.92 1c12 n SER 77 Ca 0.09 0.89 -0.35 0.00 1.01 0.00 0.00 58.87 60.51 1c12 n SER 77 Cb 0.48 -5.27 0.05 0.00 -1.01 0.00 0.00 64.21 58.45 1c12 n SER 77 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1c12 s LEU 78 N -2.20 3.57 0.38 -3.43 1.43 0.26 -4.73 118.68 113.96 1c12 s LEU 78 Ca 0.15 2.36 0.04 0.00 -1.03 0.00 0.00 54.13 55.66 1c12 s LEU 78 Cb -0.04 -4.59 -0.06 0.00 0.03 0.00 0.00 46.19 41.53 1c12 s LEU 78 CO 0.77 -1.75 0.05 -1.61 0.23 0.00 0.00 176.35 174.04 1c12 s GLU 79 N -3.50 1.83 0.34 1.70 2.02 -1.26 -1.63 118.70 118.19 1c12 s GLU 79 Ca 0.76 -2.05 0.04 0.00 0.02 0.00 0.00 54.97 53.74 1c12 s GLU 79 Cb -0.30 -1.13 0.66 0.00 0.10 0.00 0.00 34.13 33.46 1c12 s GLU 79 CO 0.36 -0.20 1.94 0.66 0.02 0.00 0.00 175.26 178.05 1c12 h SER 80 N 1.90 0.76 -0.25 -0.19 4.64 -1.99 -1.51 113.55 116.91 1c12 h SER 80 Ca -0.41 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.86 1c12 h SER 80 Cb 1.25 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 63.17 1c12 h SER 80 CO 0.72 0.49 -0.01 -0.33 -0.87 0.00 0.00 176.83 176.83 1c12 h GLU 81 N 0.86 0.56 0.00 4.77 3.07 -2.02 -2.98 114.58 118.84 1c12 h GLU 81 Ca 0.34 -0.13 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1c12 h GLU 81 Cb 0.22 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 1c12 h GLU 81 CO -0.12 0.59 0.00 -0.44 -1.40 0.00 0.00 179.01 177.64 1c12 h ASP 82 N 0.53 0.00 -2.17 1.42 3.32 -1.67 -3.40 116.42 114.45 1c12 h ASP 82 Ca 0.11 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.62 1c12 h ASP 82 Cb 0.36 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.83 1c12 h ASP 82 CO 0.01 0.00 1.13 -0.36 -1.72 0.00 0.00 179.24 178.30 1c12 s PHE 83 N -3.59 2.23 0.00 4.55 0.08 -1.13 -4.85 117.98 115.27 1c12 s PHE 83 Ca -0.01 -0.02 0.00 0.00 0.12 0.00 0.00 56.93 57.01 1c12 s PHE 83 Cb 0.08 -4.57 0.00 0.00 -0.57 0.00 0.00 43.02 37.96 1c12 s PHE 83 CO 0.28 -2.09 0.00 0.00 -0.10 0.00 0.00 175.22 173.31 1c12 n ALA 84 N 9.77 0.00 -2.97 5.36 0.00 -1.25 -4.85 120.51 126.57 1c12 n ALA 84 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.19 1c12 n ALA 84 Cb 0.50 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.80 1c12 n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1c12 s ASP 85 N 1.94 4.02 -0.09 0.00 1.11 -0.72 -0.97 116.67 121.97 1c12 s ASP 85 Ca 0.00 -0.30 0.02 0.00 0.18 0.00 0.00 52.55 52.45 1c12 s ASP 85 Cb 0.00 -1.48 -0.02 0.00 1.07 0.00 0.00 42.92 42.49 1c12 s ASP 85 CO 0.00 0.20 -0.16 -0.31 1.18 0.00 0.00 175.17 176.08 1c12 s TYR 86 N 0.16 2.70 0.04 4.23 1.51 -0.08 -0.38 117.35 125.53 1c12 s TYR 86 Ca -0.07 -0.49 0.05 0.00 -1.01 0.00 0.00 57.07 55.54 1c12 s TYR 86 Cb -0.15 -1.72 -0.02 0.00 -0.11 0.00 0.00 41.96 39.96 1c12 s TYR 86 CO 0.05 -0.07 -0.14 0.71 -1.11 0.00 0.00 175.55 174.98 1c12 s TYR 87 N -0.14 1.25 0.16 2.71 2.02 -0.31 -1.26 117.35 121.79 1c12 s TYR 87 Ca -0.02 -0.35 0.08 0.00 -0.37 0.00 0.00 57.07 56.41 1c12 s TYR 87 Cb -0.14 -0.74 -0.04 0.00 -0.40 0.00 0.00 41.96 40.64 1c12 s TYR 87 CO 0.04 0.03 -0.05 0.00 -1.57 0.00 0.00 175.55 174.00 1c12 s VAL 89 N -1.64 -0.01 -0.24 0.00 0.11 -0.71 -0.58 120.40 117.34 1c12 s VAL 89 Ca 0.26 0.02 -0.12 0.00 -2.93 0.00 0.00 61.98 59.20 1c12 s VAL 89 Cb -0.09 -0.16 -0.05 0.00 -1.53 0.00 0.00 36.38 34.55 1c12 s VAL 89 CO 0.17 0.01 0.25 -1.58 -3.33 0.00 0.00 175.10 170.62 1c12 s GLN 90 N 0.18 4.06 -0.03 1.54 -0.44 0.55 -2.13 119.66 123.39 1c12 s GLN 90 Ca -0.01 -0.12 0.08 0.00 -2.50 0.00 0.00 55.36 52.81 1c12 s GLN 90 Cb -0.02 -3.58 0.22 0.00 -1.64 0.00 0.00 33.01 27.99 1c12 s GLN 90 CO -0.00 -0.06 1.18 2.48 0.50 0.00 0.00 175.29 179.38 1c12 n TYR 91 N 4.64 0.32 0.18 1.67 0.18 -1.03 -2.59 117.16 120.53 1c12 n TYR 91 Ca -0.12 -0.58 0.07 0.00 1.88 0.00 0.00 57.90 59.15 1c12 n TYR 91 Cb 0.52 -0.07 0.17 0.00 -0.38 0.00 0.00 39.34 39.57 1c12 n TYR 91 CO 0.00 0.00 0.00 -0.24 -2.08 0.00 0.00 176.86 174.54 1c12 h VAL 92 N 1.15 0.52 -3.03 -3.48 3.04 -1.87 -3.46 116.25 109.11 1c12 h VAL 92 Ca 0.00 -1.60 -0.17 0.00 -1.01 0.00 0.00 66.70 63.92 1c12 h VAL 92 Cb 0.75 2.15 -0.27 0.00 -2.01 0.00 0.00 31.29 31.91 1c12 h VAL 92 CO 0.02 0.28 -0.43 -1.58 -1.01 0.00 0.00 177.57 174.86 1c12 s GLN 93 N -3.18 0.28 0.21 4.17 0.74 -1.26 -5.12 119.66 115.50 1c12 s GLN 93 Ca 0.04 0.46 -0.30 0.00 0.05 0.00 0.00 55.36 55.61 1c12 s GLN 93 Cb 0.07 0.04 -0.09 0.00 1.10 0.00 0.00 33.01 34.14 1c12 s GLN 93 CO 0.70 -0.09 1.21 -0.06 -0.55 0.00 0.00 175.29 176.49 1c12 s PHE 94 N 0.64 3.39 -0.06 1.67 0.08 -1.26 -3.12 117.98 119.32 1c12 s PHE 94 Ca -0.04 1.43 -0.20 0.00 0.12 0.00 0.00 56.93 58.25 1c12 s PHE 94 Cb -0.05 -3.45 -0.05 0.00 -0.57 0.00 0.00 43.02 38.90 1c12 s PHE 94 CO -0.04 -1.26 0.56 -1.25 -0.10 0.00 0.00 175.22 173.13 1c12 s PRO 95 N -0.52 4.33 -0.14 0.24 0.04 -1.26 -4.93 135.00 132.75 1c12 s PRO 95 Ca 0.52 0.63 -0.39 0.00 0.04 0.00 0.00 61.00 61.80 1c12 s PRO 95 Cb -0.34 -3.40 -0.16 0.00 0.04 0.00 0.00 34.50 30.65 1c12 s PRO 95 CO 0.39 0.24 1.62 1.19 0.04 0.00 0.00 177.00 180.48 1c12 n PHE 96 N 3.28 1.90 -4.26 0.56 0.99 -1.18 -4.76 117.46 114.00 1c12 n PHE 96 Ca -0.06 0.53 -0.31 0.00 -0.00 0.00 0.00 57.45 57.61 1c12 n PHE 96 Cb 0.51 -2.43 -0.09 0.00 -1.00 0.00 0.00 39.48 36.47 1c12 n PHE 96 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 1c12 s THR 97 N 2.54 3.70 0.29 4.37 -4.23 -1.07 -4.93 115.64 116.32 1c12 s THR 97 Ca 0.93 -1.01 0.08 0.00 -1.18 0.00 0.00 61.69 60.51 1c12 s THR 97 Cb -1.00 -2.71 -0.04 0.00 1.34 0.00 0.00 72.50 70.09 1c12 s THR 97 CO 0.58 0.20 0.12 -0.36 -0.54 0.00 0.00 174.62 174.63 1c12 s PHE 98 N -1.19 2.84 0.41 3.99 0.40 -1.26 -0.33 117.98 122.85 1c12 s PHE 98 Ca 0.22 -0.24 -0.03 0.00 -0.60 0.00 0.00 56.93 56.28 1c12 s PHE 98 Cb -0.11 -1.43 -0.04 0.00 0.51 0.00 0.00 43.02 41.95 1c12 s PHE 98 CO 0.14 0.48 0.68 0.20 0.70 0.00 0.00 175.22 177.41 1c12 s GLY 99 N -3.80 1.46 0.11 4.36 0.00 0.26 -4.59 107.32 105.11 1c12 s GLY 99 Ca 0.34 -0.67 0.08 0.00 0.00 0.00 0.00 44.72 44.48 1c12 s GLY 99 CO 0.23 -0.55 1.25 -1.14 0.00 0.00 0.00 173.10 172.89 1c12 n SER 100 N -1.97 0.19 0.00 1.64 3.41 -1.26 -4.67 113.62 110.96 1c12 n SER 100 Ca -0.02 0.59 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 1c12 n SER 100 Cb 0.55 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 1c12 n SER 100 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1c12 n GLY 101 N -1.33 -0.48 2.82 5.00 0.00 -1.26 -5.04 105.19 104.91 1c12 n GLY 101 Ca -0.00 -1.63 -0.17 0.00 0.00 0.00 0.00 46.02 44.21 1c12 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c12 s THR 102 N -3.01 0.20 -0.25 2.61 2.01 -0.39 -4.58 115.64 112.23 1c12 s THR 102 Ca 0.00 0.08 -0.08 0.00 0.31 0.00 0.00 61.69 62.00 1c12 s THR 102 Cb 0.00 -0.29 -0.04 0.00 0.01 0.00 0.00 72.50 72.18 1c12 s THR 102 CO 0.00 0.15 0.11 -0.75 -0.69 0.00 0.00 174.62 173.44 1c12 s LYS 103 N 1.07 3.81 -0.57 4.92 2.20 -1.03 -0.90 119.74 129.24 1c12 s LYS 103 Ca -0.09 -0.40 -0.22 0.00 -0.36 0.00 0.00 55.97 54.90 1c12 s LYS 103 Cb -0.14 -3.41 0.06 0.00 -1.51 0.00 0.00 37.83 32.83 1c12 s LYS 103 CO -0.02 -0.10 0.86 -0.51 -0.36 0.00 0.00 175.35 175.22 1c12 s LEU 104 N 1.42 4.47 -0.10 5.43 1.43 -0.14 -0.99 118.68 130.21 1c12 s LEU 104 Ca 0.06 -0.73 -0.09 0.00 -1.03 0.00 0.00 54.13 52.34 1c12 s LEU 104 Cb -0.15 -2.59 -0.04 0.00 0.03 0.00 0.00 46.19 43.43 1c12 s LEU 104 CO 0.05 -1.20 0.21 -1.61 0.23 0.00 0.00 176.35 174.04 1c12 s GLU 105 N 3.58 3.64 -0.15 1.70 2.02 0.73 -3.96 118.70 126.25 1c12 s GLU 105 Ca 0.23 0.00 -0.29 0.00 0.02 0.00 0.00 54.97 54.93 1c12 s GLU 105 Cb -0.16 -3.22 -0.01 0.00 0.10 0.00 0.00 34.13 30.84 1c12 s GLU 105 CO 0.14 0.70 1.09 -1.50 0.02 0.00 0.00 175.26 175.72 1c12 s ILE 106 N -0.88 4.58 0.41 -1.63 1.10 -1.26 0.03 121.20 123.55 1c12 s ILE 106 Ca 0.17 1.89 -0.24 0.00 -0.51 0.00 0.00 60.65 61.96 1c12 s ILE 106 Cb -0.13 -4.22 -0.09 0.00 0.15 0.00 0.00 42.46 38.17 1c12 s ILE 106 CO 0.06 -0.09 1.03 -0.75 -2.11 0.00 0.00 174.94 173.08 1c12 s LYS 107 N 2.73 4.16 0.30 3.50 2.20 -0.72 -4.78 119.74 127.12 1c12 s LYS 107 Ca 0.49 1.46 -0.10 0.00 -0.36 0.00 0.00 55.97 57.46 1c12 s LYS 107 Cb -0.19 -2.49 0.01 0.00 -1.51 0.00 0.00 37.83 33.65 1c12 s LYS 107 CO 0.14 -0.14 0.52 -0.98 -0.36 0.00 0.00 175.35 174.52 1c12 s ARG 108 N -2.59 1.76 0.72 4.03 1.70 -1.26 -4.81 118.95 118.50 1c12 s ARG 108 Ca 0.59 -1.45 -0.12 0.00 -0.47 0.00 0.00 55.73 54.28 1c12 s ARG 108 Cb -0.20 0.48 0.03 0.00 -0.57 0.00 0.00 34.95 34.69 1c12 s ARG 108 CO 0.25 -0.74 1.09 0.00 -1.08 0.00 0.00 175.30 174.82 1c12 s ALA 109 N -3.48 2.39 0.77 7.88 0.00 -1.26 -4.99 121.76 123.07 1c12 s ALA 109 Ca 0.24 0.35 -0.15 0.00 0.00 0.00 0.00 51.96 52.40 1c12 s ALA 109 Cb -0.01 -3.28 0.05 0.00 0.00 0.00 0.00 23.12 19.88 1c12 s ALA 109 CO 0.13 -1.51 1.16 -0.25 0.00 0.00 0.00 175.76 175.29 1c12 n ASP 110 N -3.05 1.06 -3.67 0.00 10.43 -1.26 -4.85 116.55 115.21 1c12 n ASP 110 Ca 0.09 0.64 -0.09 0.00 2.57 0.00 0.00 54.79 58.00 1c12 n ASP 110 Cb 0.53 -1.49 -0.09 0.00 1.84 0.00 0.00 41.12 41.90 1c12 n ASP 110 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1c12 s ALA 111 N -1.94 -1.28 0.48 2.24 0.00 -0.92 -4.91 121.76 115.43 1c12 s ALA 111 Ca 0.75 1.74 -0.20 0.00 0.00 0.00 0.00 51.96 54.24 1c12 s ALA 111 Cb -0.32 -1.15 -0.09 0.00 0.00 0.00 0.00 23.12 21.57 1c12 s ALA 111 CO 0.49 -0.42 1.01 0.00 0.00 0.00 0.00 175.76 176.84 1c12 s ALA 112 N 1.78 2.92 0.36 0.00 0.00 -1.26 -0.53 121.76 125.02 1c12 s ALA 112 Ca -0.08 0.52 -0.21 0.00 0.00 0.00 0.00 51.96 52.19 1c12 s ALA 112 Cb -0.09 -3.22 -0.10 0.00 0.00 0.00 0.00 23.12 19.71 1c12 s ALA 112 CO -0.14 -0.23 0.88 -1.25 0.00 0.00 0.00 175.76 175.02 1c12 s PRO 113 N -3.32 4.27 -0.29 0.00 0.04 -1.26 -4.50 135.00 129.94 1c12 s PRO 113 Ca 0.65 1.05 -0.18 0.00 0.04 0.00 0.00 61.00 62.56 1c12 s PRO 113 Cb -0.14 -2.46 -0.02 0.00 0.04 0.00 0.00 34.50 31.92 1c12 s PRO 113 CO 0.20 0.13 0.53 0.99 0.04 0.00 0.00 177.00 178.88 1c12 s THR 114 N -1.93 5.04 -0.09 1.26 2.01 -0.62 -4.89 115.64 116.41 1c12 s THR 114 Ca 0.55 0.72 -0.05 0.00 0.31 0.00 0.00 61.69 63.22 1c12 s THR 114 Cb -0.12 -3.89 -0.04 0.00 0.01 0.00 0.00 72.50 68.46 1c12 s THR 114 CO 0.17 -0.03 0.11 -0.69 -0.69 0.00 0.00 174.62 173.49 1c12 s VAL 115 N 2.37 5.18 -0.06 3.82 1.01 -1.26 -1.17 120.40 130.29 1c12 s VAL 115 Ca 0.21 0.02 -0.03 0.00 0.00 0.00 0.00 61.98 62.18 1c12 s VAL 115 Cb -0.15 -3.27 0.04 0.00 0.00 0.00 0.00 36.38 32.99 1c12 s VAL 115 CO 0.11 0.56 0.14 -0.44 0.00 0.00 0.00 175.10 175.47 1c12 s SER 116 N -1.16 -0.08 -0.10 3.32 0.01 -0.63 -4.98 113.70 110.08 1c12 s SER 116 Ca 0.17 0.28 0.03 0.00 1.31 0.00 0.00 55.95 57.74 1c12 s SER 116 Cb -0.12 0.17 -0.01 0.00 0.21 0.00 0.00 66.02 66.27 1c12 s SER 116 CO 0.06 -0.15 -0.19 -0.51 0.41 0.00 0.00 173.24 172.86 1c12 s ILE 117 N 1.19 2.57 -0.10 1.44 2.07 -1.26 -0.74 121.20 126.38 1c12 s ILE 117 Ca -0.09 -0.85 0.03 0.00 -1.41 0.00 0.00 60.65 58.33 1c12 s ILE 117 Cb -0.12 -2.02 -0.01 0.00 0.13 0.00 0.00 42.46 40.45 1c12 s ILE 117 CO -0.06 0.55 -0.21 -0.36 -1.91 0.00 0.00 174.94 172.95 1c12 s PHE 118 N 0.12 2.60 0.63 3.50 0.08 0.13 -4.99 117.98 120.05 1c12 s PHE 118 Ca -0.09 -0.85 -0.13 0.00 0.12 0.00 0.00 56.93 55.98 1c12 s PHE 118 Cb -0.15 -1.72 -0.02 0.00 -0.57 0.00 0.00 43.02 40.56 1c12 s PHE 118 CO 0.06 -0.30 1.05 -2.14 -0.10 0.00 0.00 175.22 173.78 1c12 s PRO 119 N 0.20 3.24 0.30 0.24 0.02 -1.26 -2.48 135.00 135.26 1c12 s PRO 119 Ca -0.13 1.03 -0.29 0.00 0.02 0.00 0.00 61.00 61.63 1c12 s PRO 119 Cb -0.16 -2.03 -0.10 0.00 0.02 0.00 0.00 34.50 32.23 1c12 s PRO 119 CO 0.07 -0.86 1.29 -1.25 -0.33 0.00 0.00 177.00 175.91 1c12 s PRO 120 N -4.61 4.39 0.69 5.54 0.04 -1.24 -4.87 135.00 134.96 1c12 s PRO 120 Ca 0.60 2.14 -0.14 0.00 0.04 0.00 0.00 61.00 63.64 1c12 s PRO 120 Cb -0.14 -3.10 0.02 0.00 0.04 0.00 0.00 34.50 31.31 1c12 s PRO 120 CO 0.46 -0.15 1.13 -1.54 0.04 0.00 0.00 177.00 176.94 1c12 s SER 121 N -0.39 4.77 0.25 6.66 1.04 -1.26 -4.89 113.70 119.89 1c12 s SER 121 Ca 0.50 2.07 -0.05 0.00 0.48 0.00 0.00 55.95 58.95 1c12 s SER 121 Cb -0.38 -2.56 0.28 0.00 0.10 0.00 0.00 66.02 63.46 1c12 s SER 121 CO 0.49 -1.86 1.90 0.28 0.98 0.00 0.00 173.24 175.03 1c12 h SER 122 N -0.21 1.09 -0.83 7.02 0.02 -1.99 -2.13 113.55 116.52 1c12 h SER 122 Ca -0.47 -0.07 0.07 0.00 -0.84 0.00 0.00 61.79 60.49 1c12 h SER 122 Cb 1.26 -0.27 -0.06 0.00 0.14 0.00 0.00 62.40 63.46 1c12 h SER 122 CO 0.52 0.84 0.50 -0.33 -1.14 0.00 0.00 176.83 177.22 1c12 h GLU 123 N 1.25 0.87 -0.17 3.45 5.08 -2.00 -1.76 114.58 121.30 1c12 h GLU 123 Ca 0.32 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.52 1c12 h GLU 123 Cb -0.05 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.01 1c12 h GLU 123 CO -0.06 0.57 -0.34 0.37 -1.00 0.00 0.00 179.01 178.55 1c12 h GLN 124 N 0.90 0.54 -0.01 2.33 4.15 -1.78 -3.18 115.11 118.05 1c12 h GLN 124 Ca 0.37 -0.35 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1c12 h GLN 124 Cb 0.22 0.04 -0.00 0.00 0.21 0.00 0.00 27.48 27.95 1c12 h GLN 124 CO -0.19 0.96 0.01 -0.07 -1.93 0.00 0.00 178.83 177.60 1c12 h LEU 125 N 0.18 0.00 -0.79 -2.39 3.38 -0.97 -0.76 115.31 113.96 1c12 h LEU 125 Ca 0.01 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 1c12 h LEU 125 Cb 0.94 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.66 1c12 h LEU 125 CO 0.08 0.00 0.16 0.74 0.09 0.00 0.00 178.44 179.50 1c12 h THR 126 N 0.00 1.26 -0.54 0.22 2.02 -1.31 -2.68 112.91 111.87 1c12 h THR 126 Ca 0.00 -0.95 -0.09 0.00 0.77 0.00 0.00 66.41 66.14 1c12 h THR 126 Cb 0.02 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 1c12 h THR 126 CO -0.00 0.36 -0.02 0.28 0.37 0.00 0.00 175.52 176.52 1c12 h SER 127 N 1.01 0.96 0.00 4.18 0.02 -1.21 -3.47 113.55 115.04 1c12 h SER 127 Ca 0.21 -0.31 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1c12 h SER 127 Cb 0.37 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.65 1c12 h SER 127 CO 0.00 1.04 0.00 0.61 -1.14 0.00 0.00 176.83 177.34 1c12 n GLY 128 N -0.37 1.61 3.57 -3.77 0.00 -0.96 -5.07 105.19 100.20 1c12 n GLY 128 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 1c12 n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c12 s GLY 129 N -1.94 1.99 -0.32 -0.02 0.00 -1.17 -0.82 107.32 105.03 1c12 s GLY 129 Ca 0.00 -1.92 0.04 0.00 0.00 0.00 0.00 44.72 42.83 1c12 s GLY 129 CO 0.00 -1.92 0.46 0.00 0.00 0.00 0.00 173.10 171.64 1c12 s ALA 130 N -2.51 -1.41 -0.18 3.20 0.00 -0.97 -3.32 121.76 116.57 1c12 s ALA 130 Ca 0.32 0.16 -0.11 0.00 0.00 0.00 0.00 51.96 52.33 1c12 s ALA 130 Cb -0.02 -2.23 -0.05 0.00 0.00 0.00 0.00 23.12 20.82 1c12 s ALA 130 CO 0.18 -1.89 0.18 -1.12 0.00 0.00 0.00 175.76 173.11 1c12 s SER 131 N 2.33 6.29 -0.27 0.00 0.01 -1.26 -1.71 113.70 119.08 1c12 s SER 131 Ca 0.12 0.33 -0.05 0.00 1.31 0.00 0.00 55.95 57.65 1c12 s SER 131 Cb -0.11 -2.11 0.01 0.00 0.21 0.00 0.00 66.02 64.01 1c12 s SER 131 CO -0.23 0.18 0.03 -0.69 0.41 0.00 0.00 173.24 172.94 1c12 s VAL 132 N 0.26 3.62 -0.11 3.43 1.01 -0.36 -3.60 120.40 124.66 1c12 s VAL 132 Ca 0.11 -0.71 -0.06 0.00 0.00 0.00 0.00 61.98 61.32 1c12 s VAL 132 Cb -0.12 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 1c12 s VAL 132 CO 0.00 0.18 0.11 -0.69 0.00 0.00 0.00 175.10 174.71 1c12 s VAL 133 N 1.46 5.28 -0.07 2.92 1.01 -1.04 -0.37 120.40 129.59 1c12 s VAL 133 Ca 0.03 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.13 1c12 s VAL 133 Cb -0.16 -3.29 0.02 0.00 0.00 0.00 0.00 36.38 32.94 1c12 s VAL 133 CO -0.00 0.61 -0.07 0.00 0.00 0.00 0.00 175.10 175.64 1c12 s PHE 135 N 1.18 3.11 -0.38 0.00 2.99 0.08 -1.29 117.98 123.68 1c12 s PHE 135 Ca -0.06 -0.04 0.04 0.00 0.00 0.00 0.00 56.93 56.86 1c12 s PHE 135 Cb -0.14 -1.90 0.11 0.00 0.00 0.00 0.00 43.02 41.09 1c12 s PHE 135 CO -0.02 0.20 0.10 -0.51 -0.00 0.00 0.00 175.22 175.00 1c12 s LEU 136 N -0.16 4.39 -0.07 -0.37 1.02 0.12 -1.60 118.68 122.01 1c12 s LEU 136 Ca 0.04 -2.31 -0.03 0.00 0.02 0.00 0.00 54.13 51.86 1c12 s LEU 136 Cb -0.13 -1.55 -0.04 0.00 0.02 0.00 0.00 46.19 44.50 1c12 s LEU 136 CO 0.02 -0.35 0.06 0.20 0.02 0.00 0.00 176.35 176.31 1c12 s ASN 137 N 0.69 5.68 -0.70 2.29 0.01 -0.32 0.99 114.94 123.59 1c12 s ASN 137 Ca 0.12 0.23 -0.05 0.00 -0.71 0.00 0.00 52.86 52.45 1c12 s ASN 137 Cb -0.20 -1.68 0.01 0.00 0.41 0.00 0.00 41.25 39.78 1c12 s ASN 137 CO -0.08 0.35 0.65 0.59 -1.51 0.00 0.00 177.10 177.11 1c12 n ASN 138 N 1.80 -6.75 -4.48 -1.22 4.13 -1.15 -1.60 115.26 105.99 1c12 n ASN 138 Ca -0.17 -0.27 -0.23 0.00 1.68 0.00 0.00 54.58 55.59 1c12 n ASN 138 Cb 0.54 -3.93 -0.11 0.00 -1.54 0.00 0.00 39.78 34.74 1c12 n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1c12 s PHE 139 N -2.82 2.11 -0.28 3.10 -0.12 -0.46 -4.37 117.98 115.14 1c12 s PHE 139 Ca 0.07 -0.76 -0.19 0.00 -0.05 0.00 0.00 56.93 55.99 1c12 s PHE 139 Cb -0.01 -1.33 0.09 0.00 -0.63 0.00 0.00 43.02 41.14 1c12 s PHE 139 CO 0.81 0.25 0.78 -0.47 -0.05 0.00 0.00 175.22 176.54 1c12 s TYR 140 N -3.01 -0.84 0.73 3.49 6.14 0.31 -1.77 117.35 122.39 1c12 s TYR 140 Ca 0.33 1.81 -0.08 0.00 0.64 0.00 0.00 57.07 59.77 1c12 s TYR 140 Cb 0.07 0.46 0.07 0.00 0.42 0.00 0.00 41.96 42.97 1c12 s TYR 140 CO 0.15 -0.41 1.05 -1.25 0.64 0.00 0.00 175.55 175.72 1c12 s PRO 141 N 1.08 2.10 0.60 4.97 0.04 -1.26 -2.17 135.00 140.36 1c12 s PRO 141 Ca -0.06 -0.22 0.31 0.00 0.04 0.00 0.00 61.00 61.07 1c12 s PRO 141 Cb -0.05 -2.13 1.15 0.00 0.04 0.00 0.00 34.50 33.52 1c12 s PRO 141 CO -0.12 -1.33 1.46 -0.22 0.04 0.00 0.00 177.00 176.82 1c12 h LYS 142 N -0.70 0.00 -6.14 4.56 3.64 -1.97 -3.40 116.57 112.56 1c12 h LYS 142 Ca -0.44 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.40 1c12 h LYS 142 Cb 1.31 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.10 1c12 h LYS 142 CO 0.60 0.00 1.30 -0.51 -2.27 0.00 0.00 179.45 178.58 1c12 s ASP 143 N -3.86 5.61 -0.08 4.20 1.01 -1.26 -4.96 116.67 117.32 1c12 s ASP 143 Ca -0.03 0.82 -0.05 0.00 0.71 0.00 0.00 52.55 54.00 1c12 s ASP 143 Cb 0.16 -2.53 0.03 0.00 1.01 0.00 0.00 42.92 41.60 1c12 s ASP 143 CO 0.56 -2.02 0.19 -0.51 0.21 0.00 0.00 175.17 173.60 1c12 s ILE 144 N 7.91 -0.02 -0.14 0.77 2.07 -1.26 -4.76 121.20 125.76 1c12 s ILE 144 Ca 0.73 0.09 -0.04 0.00 -1.41 0.00 0.00 60.65 60.02 1c12 s ILE 144 Cb -0.17 -0.30 -0.03 0.00 0.13 0.00 0.00 42.46 42.09 1c12 s ILE 144 CO 0.27 0.04 -0.02 0.21 -1.91 0.00 0.00 174.94 173.53 1c12 s ASN 145 N 0.69 5.01 -0.20 4.50 3.04 -0.88 -4.95 114.94 122.16 1c12 s ASN 145 Ca -0.05 -0.04 0.01 0.00 0.04 0.00 0.00 52.86 52.83 1c12 s ASN 145 Cb -0.06 -1.72 0.04 0.00 -1.54 0.00 0.00 41.25 37.96 1c12 s ASN 145 CO -0.04 0.22 -0.11 -0.69 -3.04 0.00 0.00 177.10 173.44 1c12 s VAL 146 N 0.06 1.73 -0.13 -5.21 1.01 -1.26 0.18 120.40 116.79 1c12 s VAL 146 Ca 0.01 -1.05 -0.05 0.00 0.00 0.00 0.00 61.98 60.89 1c12 s VAL 146 Cb -0.13 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 1c12 s VAL 146 CO 0.02 0.20 0.05 -0.54 0.00 0.00 0.00 175.10 174.83 1c12 s LYS 147 N 1.36 3.46 -0.29 2.72 -0.14 0.17 -4.95 119.74 122.06 1c12 s LYS 147 Ca -0.01 -0.33 -0.04 0.00 -1.36 0.00 0.00 55.97 54.24 1c12 s LYS 147 Cb -0.16 -3.03 0.03 0.00 -1.68 0.00 0.00 37.83 32.99 1c12 s LYS 147 CO -0.08 0.56 0.02 -1.58 -0.76 0.00 0.00 175.35 173.51 1c12 s TRP 148 N -0.44 3.19 -0.08 3.18 0.52 -1.26 0.42 118.94 124.46 1c12 s TRP 148 Ca 0.09 -1.51 -0.01 0.00 0.02 0.00 0.00 56.10 54.70 1c12 s TRP 148 Cb -0.12 -2.16 -0.03 0.00 -1.15 0.00 0.00 33.47 30.01 1c12 s TRP 148 CO 0.02 -0.72 -0.04 0.15 0.02 0.00 0.00 176.95 176.38 1c12 s LYS 149 N 1.36 2.93 -0.30 4.98 1.02 -0.32 0.54 119.74 129.94 1c12 s LYS 149 Ca -0.02 -0.49 0.01 0.00 0.02 0.00 0.00 55.97 55.50 1c12 s LYS 149 Cb -0.18 -2.71 0.07 0.00 -0.52 0.00 0.00 37.83 34.49 1c12 s LYS 149 CO -0.00 0.64 -0.01 0.42 -0.92 0.00 0.00 175.35 175.48 1c12 s ILE 150 N -0.73 2.61 -1.33 2.17 1.01 0.76 -1.24 121.20 124.45 1c12 s ILE 150 Ca 0.11 -1.71 -0.01 0.00 0.00 0.00 0.00 60.65 59.04 1c12 s ILE 150 Cb -0.11 -2.62 0.00 0.00 0.01 0.00 0.00 42.46 39.74 1c12 s ILE 150 CO 0.02 -0.23 0.15 0.47 0.00 0.00 0.00 174.94 175.35 1c12 n ASP 151 N 4.49 -4.91 0.00 3.58 8.00 0.22 -2.48 116.55 125.46 1c12 n ASP 151 Ca -0.09 -0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.33 1c12 n ASP 151 Cb 0.42 -3.94 0.00 0.00 -0.02 0.00 0.00 41.12 37.58 1c12 n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1c12 n GLY 152 N -1.12 0.72 3.24 0.44 0.00 -1.26 -4.99 105.19 102.22 1c12 n GLY 152 Ca -0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 1c12 n GLY 152 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1c12 s SER 153 N -2.99 3.41 0.40 1.61 0.15 -1.03 -5.06 113.70 110.19 1c12 s SER 153 Ca 0.00 -0.52 -0.26 0.00 0.70 0.00 0.00 55.95 55.87 1c12 s SER 153 Cb 0.00 -1.50 -0.10 0.00 -1.71 0.00 0.00 66.02 62.71 1c12 s SER 153 CO 0.00 0.10 1.32 -0.62 1.20 0.00 0.00 173.24 175.25 1c12 n GLU 154 N 3.92 2.11 -4.43 5.44 1.02 -1.26 -0.17 120.64 127.27 1c12 n GLU 154 Ca -0.19 0.75 -0.29 0.00 -0.02 0.00 0.00 57.16 57.40 1c12 n GLU 154 Cb 0.52 -2.44 -0.17 0.00 -0.02 0.00 0.00 31.44 29.33 1c12 n GLU 154 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1c12 s ARG 155 N -2.15 2.38 -0.25 3.49 6.06 0.19 -4.82 118.95 123.84 1c12 s ARG 155 Ca 0.59 -0.61 -0.16 0.00 -2.50 0.00 0.00 55.73 53.04 1c12 s ARG 155 Cb -0.51 -2.02 -0.14 0.00 0.06 0.00 0.00 34.95 32.34 1c12 s ARG 155 CO 0.60 -0.08 -0.18 1.04 -2.50 0.00 0.00 175.30 174.18 1c12 n GLN 156 N 4.26 0.57 -2.28 5.12 1.13 -1.26 -4.38 117.38 120.55 1c12 n GLN 156 Ca -0.19 0.36 -0.39 0.00 -1.94 0.00 0.00 57.00 54.85 1c12 n GLN 156 Cb 0.51 -1.57 -0.02 0.00 0.11 0.00 0.00 30.24 29.27 1c12 n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 1c12 s ASN 157 N -7.17 6.66 0.00 1.08 0.02 -1.26 -3.38 114.94 110.88 1c12 s ASN 157 Ca -0.35 2.40 0.00 0.00 -1.02 0.00 0.00 52.86 53.89 1c12 s ASN 157 Cb 0.11 -2.62 0.00 0.00 0.02 0.00 0.00 41.25 38.76 1c12 s ASN 157 CO 0.51 -0.59 0.00 0.61 0.02 0.00 0.00 177.10 177.65 1c12 n GLY 158 N 0.73 1.34 3.63 0.66 0.00 -1.26 -4.87 105.19 105.41 1c12 n GLY 158 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1c12 n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c12 s VAL 159 N -2.64 4.39 -0.27 1.61 1.01 -1.22 -2.47 120.40 120.81 1c12 s VAL 159 Ca 0.00 1.57 -0.04 0.00 0.00 0.00 0.00 61.98 63.50 1c12 s VAL 159 Cb 0.00 -4.44 0.01 0.00 0.00 0.00 0.00 36.38 31.96 1c12 s VAL 159 CO 0.00 -0.61 0.01 -0.22 0.00 0.00 0.00 175.10 174.28 1c12 s LEU 160 N 3.93 3.51 0.12 3.92 2.96 0.18 -4.95 118.68 128.35 1c12 s LEU 160 Ca 0.47 -0.74 0.03 0.00 -0.22 0.00 0.00 54.13 53.66 1c12 s LEU 160 Cb -0.11 -1.78 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 1c12 s LEU 160 CO 0.20 -0.15 0.18 0.20 -1.32 0.00 0.00 176.35 175.46 1c12 s ASN 161 N 1.43 5.93 -0.25 3.68 0.02 -1.26 -0.73 114.94 123.76 1c12 s ASN 161 Ca 0.02 0.07 -0.14 0.00 -1.02 0.00 0.00 52.86 51.79 1c12 s ASN 161 Cb -0.17 -1.69 0.08 0.00 0.02 0.00 0.00 41.25 39.49 1c12 s ASN 161 CO -0.01 0.11 0.61 -0.55 0.02 0.00 0.00 177.10 177.29 1c12 s SER 162 N -2.84 -0.84 0.17 -1.22 0.15 -0.28 -4.99 113.70 103.85 1c12 s SER 162 Ca 0.32 1.36 0.09 0.00 0.70 0.00 0.00 55.95 58.43 1c12 s SER 162 Cb -0.11 1.32 -0.04 0.00 -1.71 0.00 0.00 66.02 65.47 1c12 s SER 162 CO 0.25 -0.23 -0.15 0.26 1.20 0.00 0.00 173.24 174.58 1c12 s TRP 163 N 1.72 2.54 0.26 3.44 0.51 -1.26 -0.90 118.94 125.25 1c12 s TRP 163 Ca -0.09 -0.26 0.04 0.00 -2.12 0.00 0.00 56.10 53.67 1c12 s TRP 163 Cb -0.07 -1.26 -0.03 0.00 -0.81 0.00 0.00 33.47 31.30 1c12 s TRP 163 CO -0.18 0.49 0.40 0.95 -0.51 0.00 0.00 176.95 178.09 1c12 s THR 164 N -1.59 5.21 0.96 2.01 -4.23 -1.09 -5.04 115.64 111.88 1c12 s THR 164 Ca 0.23 -0.90 -0.13 0.00 -1.18 0.00 0.00 61.69 59.71 1c12 s THR 164 Cb -0.09 -3.85 0.17 0.00 1.34 0.00 0.00 72.50 70.07 1c12 s THR 164 CO 0.13 -0.37 1.12 -1.81 -0.54 0.00 0.00 174.62 173.15 1c12 s ASP 165 N -3.99 2.99 -0.23 3.99 1.01 -1.26 -4.59 116.67 114.59 1c12 s ASP 165 Ca 0.35 1.03 -0.29 0.00 0.71 0.00 0.00 52.55 54.36 1c12 s ASP 165 Cb -0.09 -1.63 -0.04 0.00 1.01 0.00 0.00 42.92 42.17 1c12 s ASP 165 CO 0.30 -2.88 1.95 -1.58 0.21 0.00 0.00 175.17 173.17 1c12 s GLN 166 N -5.15 3.42 0.21 8.23 0.74 -1.26 -4.80 119.66 121.05 1c12 s GLN 166 Ca 0.65 1.84 -0.32 0.00 0.05 0.00 0.00 55.36 57.58 1c12 s GLN 166 Cb -0.16 -4.24 -0.14 0.00 1.10 0.00 0.00 33.01 29.57 1c12 s GLN 166 CO 0.55 -1.76 1.29 -3.47 -0.55 0.00 0.00 175.29 171.35 1c12 n ASP 167 N 10.24 2.12 0.03 6.67 2.03 -0.76 -4.87 116.55 132.00 1c12 n ASP 167 Ca 0.25 1.14 0.11 0.00 0.52 0.00 0.00 54.79 56.81 1c12 n ASP 167 Cb 0.45 -1.33 0.46 0.00 -0.72 0.00 0.00 41.12 39.98 1c12 n ASP 167 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1c12 n SER 168 N 2.07 0.17 -0.03 1.67 3.41 -1.26 -0.87 113.62 118.77 1c12 n SER 168 Ca 0.13 0.53 -0.02 0.00 -0.26 0.00 0.00 58.87 59.24 1c12 n SER 168 Cb 0.29 -0.57 -0.01 0.00 -0.26 0.00 0.00 64.21 63.66 1c12 n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1c12 n LYS 169 N -1.67 0.21 0.00 4.33 5.02 -1.26 -4.64 118.16 120.16 1c12 n LYS 169 Ca 0.05 0.37 0.11 0.00 -2.02 0.00 0.00 58.31 56.83 1c12 n LYS 169 Cb 0.27 -1.19 0.15 0.00 -0.02 0.00 0.00 35.03 34.25 1c12 n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1c12 n ASP 170 N -3.37 0.63 -1.47 4.39 3.85 -1.26 -4.97 116.55 114.35 1c12 n ASP 170 Ca -0.03 -0.44 -0.16 0.00 -0.71 0.00 0.00 54.79 53.45 1c12 n ASP 170 Cb 0.13 0.45 -0.04 0.00 -1.35 0.00 0.00 41.12 40.31 1c12 n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 1c12 n SER 171 N -1.51 -4.83 -5.00 -1.12 7.64 -0.05 -5.01 113.62 103.73 1c12 n SER 171 Ca 0.05 0.22 -0.18 0.00 1.01 0.00 0.00 58.87 59.97 1c12 n SER 171 Cb 0.34 -3.83 0.02 0.00 -1.01 0.00 0.00 64.21 59.73 1c12 n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1c12 s THR 172 N -2.68 2.89 0.10 0.44 -4.23 -1.26 -4.66 115.64 106.25 1c12 s THR 172 Ca 0.00 -0.91 0.09 0.00 -1.18 0.00 0.00 61.69 59.69 1c12 s THR 172 Cb 0.00 -2.98 -0.04 0.00 1.34 0.00 0.00 72.50 70.82 1c12 s THR 172 CO 0.00 0.00 -0.21 -0.31 -0.54 0.00 0.00 174.62 173.56 1c12 s TYR 173 N -2.47 2.46 0.03 3.99 1.51 -0.73 -1.82 117.35 120.32 1c12 s TYR 173 Ca 0.56 -0.30 0.05 0.00 -1.01 0.00 0.00 57.07 56.37 1c12 s TYR 173 Cb -0.10 -1.34 -0.02 0.00 -0.11 0.00 0.00 41.96 40.39 1c12 s TYR 173 CO 0.35 0.34 -0.16 -1.12 -1.11 0.00 0.00 175.55 173.84 1c12 s SER 174 N -1.95 1.89 0.12 2.29 0.01 -1.26 -1.36 113.70 113.44 1c12 s SER 174 Ca 0.16 -0.43 0.09 0.00 1.31 0.00 0.00 55.95 57.08 1c12 s SER 174 Cb -0.10 -0.15 -0.04 0.00 0.21 0.00 0.00 66.02 65.94 1c12 s SER 174 CO 0.08 0.10 -0.21 -0.32 0.41 0.00 0.00 173.24 173.30 1c12 s MET 175 N -0.96 1.19 -0.17 12.44 1.75 0.28 -2.69 119.30 131.14 1c12 s MET 175 Ca 0.04 -1.23 -0.03 0.00 -1.25 0.00 0.00 55.69 53.23 1c12 s MET 175 Cb -0.08 -1.45 0.05 0.00 2.84 0.00 0.00 34.83 36.20 1c12 s MET 175 CO 0.01 0.33 0.03 0.45 -0.65 0.00 0.00 175.02 175.19 1c12 s SER 176 N -2.05 2.60 -0.21 1.11 0.15 -0.07 0.11 113.70 115.34 1c12 s SER 176 Ca 0.09 -0.65 -0.03 0.00 0.70 0.00 0.00 55.95 56.06 1c12 s SER 176 Cb -0.09 -0.56 -0.01 0.00 -1.71 0.00 0.00 66.02 63.65 1c12 s SER 176 CO 0.05 -0.28 -0.07 -0.55 1.20 0.00 0.00 173.24 173.59 1c12 s SER 177 N 1.89 4.15 -0.10 5.45 0.15 -0.41 -1.13 113.70 123.69 1c12 s SER 177 Ca 0.00 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.24 1c12 s SER 177 Cb -0.16 -1.70 -0.02 0.00 -1.71 0.00 0.00 66.02 62.43 1c12 s SER 177 CO -0.07 -0.01 -0.10 -0.89 1.20 0.00 0.00 173.24 173.36 1c12 s THR 178 N 1.41 3.36 -0.42 6.45 2.01 0.09 -1.28 115.64 127.26 1c12 s THR 178 Ca 0.05 -0.58 -0.06 0.00 0.31 0.00 0.00 61.69 61.42 1c12 s THR 178 Cb -0.14 -2.40 0.10 0.00 0.01 0.00 0.00 72.50 70.08 1c12 s THR 178 CO -0.04 0.55 0.25 -0.22 -0.69 0.00 0.00 174.62 174.47 1c12 s LEU 179 N -0.14 5.31 -0.21 4.42 2.96 0.49 -0.65 118.68 130.87 1c12 s LEU 179 Ca 0.00 -1.87 -0.19 0.00 -0.22 0.00 0.00 54.13 51.86 1c12 s LEU 179 Cb -0.13 -1.91 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 1c12 s LEU 179 CO 0.03 -0.58 0.56 -0.89 -1.32 0.00 0.00 176.35 174.15 1c12 s THR 180 N 1.26 5.07 0.37 3.68 2.01 -1.03 -1.22 115.64 125.78 1c12 s THR 180 Ca 0.06 1.03 0.02 0.00 0.31 0.00 0.00 61.69 63.11 1c12 s THR 180 Cb -0.24 -3.88 -0.01 0.00 0.01 0.00 0.00 72.50 68.38 1c12 s THR 180 CO -0.02 0.14 0.08 0.18 -0.69 0.00 0.00 174.62 174.31 1c12 n LEU 181 N 5.01 0.00 -4.91 4.42 4.77 -0.70 -4.72 117.00 120.88 1c12 n LEU 181 Ca -0.03 -2.62 -0.20 0.00 -0.03 0.00 0.00 56.01 53.12 1c12 n LEU 181 Cb 0.50 0.68 -0.02 0.00 -2.33 0.00 0.00 43.42 42.24 1c12 n LEU 181 CO 0.42 -0.39 -0.04 0.42 -1.33 0.00 0.00 177.39 176.47 1c12 s THR 182 N -2.73 3.96 0.32 -5.08 -4.23 -1.26 -2.30 115.64 104.32 1c12 s THR 182 Ca 0.12 -1.22 0.26 0.00 -1.18 0.00 0.00 61.69 59.67 1c12 s THR 182 Cb 0.01 -3.34 0.27 0.00 1.34 0.00 0.00 72.50 70.78 1c12 s THR 182 CO 0.08 -0.20 1.99 0.50 -0.54 0.00 0.00 174.62 176.45 1c12 h LYS 183 N 1.15 0.00 0.39 3.99 3.64 -1.21 -1.52 116.57 123.01 1c12 h LYS 183 Ca -0.46 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.90 1c12 h LYS 183 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1c12 h LYS 183 CO 0.57 0.16 -0.19 0.22 -2.27 0.00 0.00 179.45 177.94 1c12 h ASP 184 N 0.00 -0.44 0.53 4.20 1.82 -1.95 -2.33 116.42 118.25 1c12 h ASP 184 Ca -0.00 -0.12 -0.08 0.00 -0.39 0.00 0.00 57.03 56.44 1c12 h ASP 184 Cb 0.48 0.11 -0.01 0.00 0.68 0.00 0.00 39.33 40.59 1c12 h ASP 184 CO 0.02 -0.09 -0.38 -0.33 -1.61 0.00 0.00 179.24 176.85 1c12 h GLU 185 N -0.83 0.00 -0.30 0.28 5.08 -1.95 -3.07 114.58 113.79 1c12 h GLU 185 Ca -0.05 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1c12 h GLU 185 Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1c12 h GLU 185 CO 0.09 0.38 0.10 -0.92 -1.00 0.00 0.00 179.01 177.65 1c12 h TYR 186 N 0.00 0.47 0.00 4.33 5.03 -1.22 -2.64 116.97 122.94 1c12 h TYR 186 Ca -0.00 -0.05 0.00 0.00 2.58 0.00 0.00 58.73 61.26 1c12 h TYR 186 Cb 0.74 -0.14 0.00 0.00 1.55 0.00 0.00 36.73 38.89 1c12 h TYR 186 CO 0.00 0.49 0.00 0.39 -1.32 0.00 0.00 178.16 177.72 1c12 n GLU 187 N -4.71 0.44 0.00 1.82 -0.58 -0.88 -2.74 120.64 114.00 1c12 n GLU 187 Ca -0.02 0.05 0.11 0.00 -0.42 0.00 0.00 57.16 56.88 1c12 n GLU 187 Cb 0.16 -1.50 0.02 0.00 -0.57 0.00 0.00 31.44 29.55 1c12 n GLU 187 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1c12 n ARG 188 N -1.12 1.52 -4.20 3.49 1.74 -0.99 -4.95 116.66 112.14 1c12 n ARG 188 Ca 0.12 -1.25 -0.17 0.00 -0.77 0.00 0.00 57.85 55.77 1c12 n ARG 188 Cb 0.10 -1.47 -0.11 0.00 -1.02 0.00 0.00 32.46 29.95 1c12 n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1c12 s HIS 189 N -2.35 1.26 -0.10 -1.55 3.76 -1.11 -5.09 115.29 110.12 1c12 s HIS 189 Ca 0.21 -0.56 0.01 0.00 -0.15 0.00 0.00 55.06 54.58 1c12 s HIS 189 Cb 0.19 -0.68 -0.07 0.00 1.11 0.00 0.00 32.58 33.13 1c12 s HIS 189 CO 0.50 0.08 -0.08 0.09 -0.85 0.00 0.00 174.74 174.48 1c12 n ASN 190 N 0.74 3.17 -4.62 1.40 3.02 -1.26 -4.75 115.26 112.95 1c12 n ASN 190 Ca -0.17 -0.05 -0.37 0.00 -0.03 0.00 0.00 54.58 53.95 1c12 n ASN 190 Cb 0.56 -0.07 -0.10 0.00 -0.61 0.00 0.00 39.78 39.56 1c12 n ASN 190 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1c12 s SER 191 N -4.90 6.10 -0.20 6.41 0.15 -1.26 -1.28 113.70 118.72 1c12 s SER 191 Ca -0.13 0.09 0.01 0.00 0.70 0.00 0.00 55.95 56.62 1c12 s SER 191 Cb 0.03 -2.13 0.04 0.00 -1.71 0.00 0.00 66.02 62.26 1c12 s SER 191 CO 0.25 -0.01 -0.09 -0.31 1.20 0.00 0.00 173.24 174.28 1c12 s TYR 192 N 1.47 2.35 -0.07 3.44 2.02 -1.10 0.73 117.35 126.19 1c12 s TYR 192 Ca 0.08 -1.57 0.03 0.00 -0.37 0.00 0.00 57.07 55.24 1c12 s TYR 192 Cb -0.15 -1.60 0.01 0.00 -0.40 0.00 0.00 41.96 39.81 1c12 s TYR 192 CO 0.08 -0.74 -0.17 0.95 -1.57 0.00 0.00 175.55 174.10 1c12 s THR 193 N 1.42 1.51 -0.40 -0.71 -4.23 -0.37 -2.10 115.64 110.76 1c12 s THR 193 Ca -0.02 -0.71 -0.15 0.00 -1.18 0.00 0.00 61.69 59.64 1c12 s THR 193 Cb -0.17 -1.33 0.02 0.00 1.34 0.00 0.00 72.50 72.36 1c12 s THR 193 CO -0.08 0.44 0.29 0.00 -0.54 0.00 0.00 174.62 174.73 1c12 s GLU 195 N 1.68 3.39 0.05 0.00 2.12 0.17 -1.70 118.70 124.41 1c12 s GLU 195 Ca 0.05 -0.62 0.01 0.00 0.36 0.00 0.00 54.97 54.77 1c12 s GLU 195 Cb -0.19 -2.98 -0.04 0.00 0.26 0.00 0.00 34.13 31.18 1c12 s GLU 195 CO 0.10 -0.15 0.12 0.00 -0.54 0.00 0.00 175.26 174.79 1c12 s ALA 196 N 1.36 3.71 -0.20 6.30 0.00 0.47 0.43 121.76 133.83 1c12 s ALA 196 Ca 0.04 -0.92 0.01 0.00 0.00 0.00 0.00 51.96 51.09 1c12 s ALA 196 Cb -0.14 -1.59 0.04 0.00 0.00 0.00 0.00 23.12 21.43 1c12 s ALA 196 CO -0.02 0.76 -0.10 0.99 0.00 0.00 0.00 175.76 177.39 1c12 s THR 197 N -1.38 1.60 -0.01 0.00 2.01 0.13 -1.57 115.64 116.42 1c12 s THR 197 Ca 0.29 -0.99 -0.07 0.00 0.31 0.00 0.00 61.69 61.23 1c12 s THR 197 Cb -0.12 -1.69 0.00 0.00 0.01 0.00 0.00 72.50 70.70 1c12 s THR 197 CO 0.22 0.15 0.14 -2.28 -0.69 0.00 0.00 174.62 172.17 1c12 s HIS 198 N 1.41 0.01 -0.58 4.92 2.46 -1.26 -2.06 115.29 120.19 1c12 s HIS 198 Ca -0.01 -0.05 0.20 0.00 0.47 0.00 0.00 55.06 55.67 1c12 s HIS 198 Cb -0.16 -0.03 0.86 0.00 -0.13 0.00 0.00 32.58 33.12 1c12 s HIS 198 CO -0.08 -0.26 1.60 0.36 -2.47 0.00 0.00 174.74 173.88 1c12 n LYS 199 N 1.66 0.13 0.00 2.88 2.85 -1.26 -2.23 118.16 122.19 1c12 n LYS 199 Ca -0.21 0.43 0.13 0.00 -1.05 0.00 0.00 58.31 57.60 1c12 n LYS 199 Cb 0.56 -1.78 0.70 0.00 -0.65 0.00 0.00 35.03 33.86 1c12 n LYS 199 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 1c12 n THR 200 N -2.03 0.10 -3.71 0.58 -1.04 -1.26 -4.65 114.28 102.27 1c12 n THR 200 Ca 0.02 0.03 -0.13 0.00 -2.04 0.00 0.00 64.05 61.93 1c12 n THR 200 Cb 0.16 -0.62 -0.13 0.00 -1.82 0.00 0.00 70.33 67.93 1c12 n THR 200 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1c12 s SER 201 N -2.28 -0.14 0.39 8.00 0.15 -0.95 -4.96 113.70 113.92 1c12 s SER 201 Ca 0.31 0.55 0.28 0.00 0.70 0.00 0.00 55.95 57.79 1c12 s SER 201 Cb 0.17 0.48 0.99 0.00 -1.71 0.00 0.00 66.02 65.95 1c12 s SER 201 CO 0.34 -0.18 1.81 0.71 1.20 0.00 0.00 173.24 177.11 1c12 h THR 202 N 5.95 0.00 -3.46 6.45 1.35 -1.82 -3.42 112.91 117.96 1c12 h THR 202 Ca -0.35 -0.51 -0.68 0.00 -0.55 0.00 0.00 66.41 64.32 1c12 h THR 202 Cb 1.15 1.43 -0.32 0.00 -1.73 0.00 0.00 68.15 68.67 1c12 h THR 202 CO 0.32 0.00 -0.88 -0.94 -0.25 0.00 0.00 175.52 173.77 1c12 s SER 203 N -5.17 3.12 0.35 5.36 1.04 -1.26 -5.11 113.70 112.03 1c12 s SER 203 Ca 0.05 -0.54 -0.27 0.00 0.48 0.00 0.00 55.95 55.67 1c12 s SER 203 Cb 0.09 -1.32 -0.12 0.00 0.10 0.00 0.00 66.02 64.77 1c12 s SER 203 CO 0.53 0.18 1.05 -2.65 0.98 0.00 0.00 173.24 173.33 1c12 n PRO 204 N 3.42 1.48 -2.60 4.02 -0.02 -1.26 -4.92 135.00 135.12 1c12 n PRO 204 Ca -0.19 0.52 -0.43 0.00 -2.02 0.00 0.00 63.50 61.39 1c12 n PRO 204 Cb 0.53 -2.00 -0.02 0.00 -0.02 0.00 0.00 33.50 31.99 1c12 n PRO 204 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1c12 s ILE 205 N -1.15 4.59 -0.18 4.25 1.09 -0.61 -4.89 121.20 124.29 1c12 s ILE 205 Ca 0.60 1.90 0.00 0.00 -1.10 0.00 0.00 60.65 62.05 1c12 s ILE 205 Cb -0.62 -4.23 0.01 0.00 -1.06 0.00 0.00 42.46 36.56 1c12 s ILE 205 CO 0.59 -0.14 -0.18 -0.69 -0.10 0.00 0.00 174.94 174.43 1c12 s VAL 206 N 3.06 2.29 -0.08 2.92 1.01 -1.26 -0.39 120.40 127.94 1c12 s VAL 206 Ca 0.47 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.62 1c12 s VAL 206 Cb -0.17 -1.97 0.00 0.00 0.00 0.00 0.00 36.38 34.24 1c12 s VAL 206 CO 0.10 0.52 -0.20 -0.75 0.00 0.00 0.00 175.10 174.78 1c12 s LYS 207 N 1.24 2.51 0.19 2.72 2.47 -0.69 -5.00 119.74 123.18 1c12 s LYS 207 Ca 0.03 -0.72 -0.12 0.00 -1.56 0.00 0.00 55.97 53.60 1c12 s LYS 207 Cb -0.14 -1.96 0.00 0.00 -1.46 0.00 0.00 37.83 34.28 1c12 s LYS 207 CO -0.10 0.15 0.40 -1.54 0.16 0.00 0.00 175.35 174.42 1c12 s SER 208 N 0.40 -0.08 0.28 1.43 1.04 -1.26 0.22 113.70 115.73 1c12 s SER 208 Ca -0.16 -0.76 0.01 0.00 0.48 0.00 0.00 55.95 55.52 1c12 s SER 208 Cb -0.17 0.51 -0.02 0.00 0.10 0.00 0.00 66.02 66.44 1c12 s SER 208 CO 0.07 -1.00 0.29 0.72 0.98 0.00 0.00 173.24 174.31 1c12 s PHE 209 N -3.95 1.29 -0.05 5.02 -0.12 -0.89 -5.02 117.98 114.26 1c12 s PHE 209 Ca 0.16 -1.41 0.03 0.00 -0.05 0.00 0.00 56.93 55.66 1c12 s PHE 209 Cb 0.01 -0.44 0.01 0.00 -0.63 0.00 0.00 43.02 41.96 1c12 s PHE 209 CO 0.01 -0.87 -0.14 1.21 -0.05 0.00 0.00 175.22 175.38 1c12 s ASN 210 N -3.24 1.85 0.66 1.98 3.84 -1.26 -2.72 114.94 116.05 1c12 s ASN 210 Ca 0.36 -0.31 0.31 0.00 0.21 0.00 0.00 52.86 53.43 1c12 s ASN 210 Cb 0.03 -0.72 1.68 0.00 -0.55 0.00 0.00 41.25 41.69 1c12 s ASN 210 CO 0.19 0.08 1.95 -0.09 -2.79 0.00 0.00 177.10 176.44 1c12 h ARG 211 N 6.68 0.00 0.00 0.43 2.43 -1.48 -1.23 114.38 121.21 1c12 h ARG 211 Ca -0.31 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 1c12 h ARG 211 Cb 1.18 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1c12 h ARG 211 CO 0.48 0.00 -0.51 0.09 -1.51 0.00 0.00 179.97 178.52 1c12 n ASN 212 N -2.95 0.53 -3.65 -3.80 3.02 -1.26 -4.89 115.26 102.25 1c12 n ASN 212 Ca -0.02 -0.05 -0.30 0.00 -0.03 0.00 0.00 54.58 54.19 1c12 n ASN 212 Cb 0.37 0.16 0.24 0.00 -0.61 0.00 0.00 39.78 39.94 1c12 n ASN 212 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1c12 n GLU 213 N -1.73 -2.57 0.00 3.52 1.02 -0.47 -5.29 120.64 115.12 1c12 n GLU 213 Ca 0.05 -1.83 0.15 0.00 -0.02 0.00 0.00 57.16 55.51 1c12 n GLU 213 Cb 0.37 -1.55 0.81 0.00 -0.02 0.00 0.00 31.44 31.05 1c12 n GLU 213 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31