#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nlb s ILE 2 N 0.00 5.36 -0.05 5.09 1.01 -1.26 -3.67 121.20 127.69 1nlb s ILE 2 Ca 0.00 0.17 -0.14 0.00 0.00 0.00 0.00 60.65 60.68 1nlb s ILE 2 Cb 0.00 -3.44 0.03 0.00 0.01 0.00 0.00 42.46 39.06 1nlb s ILE 2 CO 0.00 0.45 0.31 -1.58 0.00 0.00 0.00 174.94 174.13 1nlb s GLN 3 N 0.28 0.58 -0.17 2.79 0.74 -0.77 -5.01 119.66 118.10 1nlb s GLN 3 Ca 0.08 -0.01 0.01 0.00 0.05 0.00 0.00 55.36 55.49 1nlb s GLN 3 Cb -0.11 0.26 0.02 0.00 1.10 0.00 0.00 33.01 34.28 1nlb s GLN 3 CO -0.01 -0.14 -0.18 -0.51 -0.55 0.00 0.00 175.29 173.89 1nlb s LEU 4 N -0.89 2.06 -0.25 3.68 1.02 -1.26 -1.88 118.68 121.16 1nlb s LEU 4 Ca -0.10 -0.63 -0.04 0.00 0.02 0.00 0.00 54.13 53.38 1nlb s LEU 4 Cb -0.04 -1.41 0.01 0.00 0.02 0.00 0.00 46.19 44.77 1nlb s LEU 4 CO 0.03 -0.02 -0.01 -0.69 0.02 0.00 0.00 176.35 175.68 1nlb s VAL 5 N 1.33 3.37 0.10 -1.59 1.01 0.72 -4.22 120.40 121.13 1nlb s VAL 5 Ca 0.05 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.29 1nlb s VAL 5 Cb -0.13 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1nlb s VAL 5 CO -0.12 0.24 0.26 -1.10 0.00 0.00 0.00 175.10 174.38 1nlb s GLN 6 N 1.43 3.47 0.98 2.72 -0.21 -1.26 -0.29 119.66 126.50 1nlb s GLN 6 Ca 0.03 -0.43 -0.12 0.00 0.02 0.00 0.00 55.36 54.86 1nlb s GLN 6 Cb -0.16 -2.98 0.18 0.00 1.00 0.00 0.00 33.01 31.05 1nlb s GLN 6 CO -0.02 0.55 1.08 -1.54 -2.12 0.00 0.00 175.29 173.25 1nlb s SER 7 N -2.75 2.62 1.08 5.90 1.04 -0.75 -4.97 113.70 115.87 1nlb s SER 7 Ca 0.36 1.59 -0.14 0.00 0.48 0.00 0.00 55.95 58.24 1nlb s SER 7 Cb -0.12 -2.25 0.23 0.00 0.10 0.00 0.00 66.02 63.98 1nlb s SER 7 CO 0.28 -3.19 1.08 -0.83 0.98 0.00 0.00 173.24 171.55 1nlb s GLY 8 N -3.05 1.55 0.44 7.32 0.00 -1.26 -4.63 107.32 107.69 1nlb s GLY 8 Ca 0.65 -0.43 -0.26 0.00 0.00 0.00 0.00 44.72 44.69 1nlb s GLY 8 CO 0.59 0.26 1.42 -1.55 0.00 0.00 0.00 173.10 173.83 1nlb n PRO 9 N -4.47 2.27 -5.20 2.90 -0.04 -1.26 -4.73 135.00 124.47 1nlb n PRO 9 Ca 0.06 0.81 -0.31 0.00 -0.04 0.00 0.00 63.50 64.01 1nlb n PRO 9 Cb 0.57 -2.61 -0.15 0.00 -0.04 0.00 0.00 33.50 31.27 1nlb n PRO 9 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1nlb s GLU 10 N -2.38 2.21 -0.19 0.54 0.41 -0.33 -5.00 118.70 113.97 1nlb s GLU 10 Ca 0.60 -0.87 0.01 0.00 -0.41 0.00 0.00 54.97 54.30 1nlb s GLU 10 Cb -0.46 -2.13 0.02 0.00 -1.78 0.00 0.00 34.13 29.78 1nlb s GLU 10 CO 0.58 0.58 -0.18 -1.17 -0.49 0.00 0.00 175.26 174.58 1nlb s LEU 11 N -0.64 2.28 0.08 1.80 0.20 -1.26 -0.88 118.68 120.25 1nlb s LEU 11 Ca 0.10 -0.68 0.03 0.00 0.69 0.00 0.00 54.13 54.27 1nlb s LEU 11 Cb -0.10 -1.50 -0.03 0.00 -0.43 0.00 0.00 46.19 44.12 1nlb s LEU 11 CO -0.01 -0.02 -0.09 -0.54 -0.29 0.00 0.00 176.35 175.41 1nlb s LYS 12 N 1.29 0.73 0.30 1.98 -0.14 -0.70 -4.99 119.74 118.20 1nlb s LYS 12 Ca 0.04 -1.04 -0.07 0.00 -1.36 0.00 0.00 55.97 53.54 1nlb s LYS 12 Cb -0.14 -0.39 -0.06 0.00 -1.68 0.00 0.00 37.83 35.57 1nlb s LYS 12 CO -0.12 0.05 0.59 0.15 -0.76 0.00 0.00 175.35 175.27 1nlb s LYS 13 N -2.54 3.68 0.42 1.68 1.02 -1.25 -0.97 119.74 121.77 1nlb s LYS 13 Ca 0.01 0.13 -0.25 0.00 0.02 0.00 0.00 55.97 55.87 1nlb s LYS 13 Cb -0.04 -2.60 -0.10 0.00 -0.52 0.00 0.00 37.83 34.57 1nlb s LYS 13 CO -0.01 0.18 1.24 -2.30 -0.92 0.00 0.00 175.35 173.54 1nlb n PRO 14 N -0.90 1.86 0.00 -1.68 -0.02 -1.26 -1.89 135.00 131.11 1nlb n PRO 14 Ca -0.01 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1nlb n PRO 14 Cb 0.54 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1nlb n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nlb n GLY 15 N 0.86 2.20 3.96 -1.23 0.00 0.61 -4.90 105.19 106.68 1nlb n GLY 15 Ca 0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 1nlb n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nlb s GLU 16 N -0.48 1.21 0.15 1.61 2.02 -0.79 -4.29 118.70 118.13 1nlb s GLU 16 Ca 0.00 -0.67 0.09 0.00 0.02 0.00 0.00 54.97 54.42 1nlb s GLU 16 Cb 0.00 -2.07 -0.04 0.00 0.10 0.00 0.00 34.13 32.12 1nlb s GLU 16 CO 0.00 -1.92 -0.18 0.99 0.02 0.00 0.00 175.26 174.18 1nlb s THR 17 N -3.53 2.80 0.01 3.63 2.01 -1.26 -1.18 115.64 118.12 1nlb s THR 17 Ca 0.70 -1.65 -0.00 0.00 0.31 0.00 0.00 61.69 61.04 1nlb s THR 17 Cb -0.05 -2.32 -0.01 0.00 0.01 0.00 0.00 72.50 70.13 1nlb s THR 17 CO 0.49 0.01 -0.01 0.54 -0.69 0.00 0.00 174.62 174.96 1nlb s VAL 18 N -1.37 0.05 -0.09 3.82 0.11 -0.88 -5.00 120.40 117.05 1nlb s VAL 18 Ca 0.20 -0.38 -0.01 0.00 -2.93 0.00 0.00 61.98 58.85 1nlb s VAL 18 Cb -0.10 -0.12 0.03 0.00 -1.53 0.00 0.00 36.38 34.66 1nlb s VAL 18 CO 0.11 -0.21 -0.02 -0.75 -3.33 0.00 0.00 175.10 170.90 1nlb s LYS 19 N -0.62 0.83 0.19 1.54 2.20 -1.26 -0.64 119.74 121.98 1nlb s LYS 19 Ca -0.07 -0.00 0.09 0.00 -0.36 0.00 0.00 55.97 55.63 1nlb s LYS 19 Cb -0.04 -1.17 -0.04 0.00 -1.51 0.00 0.00 37.83 35.06 1nlb s LYS 19 CO -0.00 -0.31 -0.07 0.96 -0.36 0.00 0.00 175.35 175.56 1nlb s ILE 20 N 1.90 3.28 0.28 5.43 -4.36 -0.09 -4.96 121.20 122.70 1nlb s ILE 20 Ca 0.05 -1.66 0.12 0.00 -0.26 0.00 0.00 60.65 58.89 1nlb s ILE 20 Cb -0.13 -2.65 -0.05 0.00 1.25 0.00 0.00 42.46 40.89 1nlb s ILE 20 CO -0.06 -0.14 -0.19 -0.94 0.24 0.00 0.00 174.94 173.84 1nlb s SER 21 N -2.95 3.58 -0.25 4.36 1.04 -1.26 -1.43 113.70 116.79 1nlb s SER 21 Ca 0.26 -1.04 -0.03 0.00 0.48 0.00 0.00 55.95 55.62 1nlb s SER 21 Cb -0.09 -0.30 0.10 0.00 0.10 0.00 0.00 66.02 65.83 1nlb s SER 21 CO 0.16 0.03 0.17 0.00 0.98 0.00 0.00 173.24 174.58 1nlb s LYS 23 N 2.19 4.26 0.01 0.00 2.20 0.61 -1.03 119.74 127.98 1nlb s LYS 23 Ca 0.07 0.48 0.00 0.00 -0.36 0.00 0.00 55.97 56.17 1nlb s LYS 23 Cb -0.16 -3.51 -0.04 0.00 -1.51 0.00 0.00 37.83 32.61 1nlb s LYS 23 CO -0.27 -0.04 0.08 0.00 -0.36 0.00 0.00 175.35 174.76 1nlb s ALA 24 N 1.26 3.57 0.09 3.13 0.00 -0.08 -0.20 121.76 129.52 1nlb s ALA 24 Ca 0.26 -0.90 -0.17 0.00 0.00 0.00 0.00 51.96 51.15 1nlb s ALA 24 Cb -0.15 -1.55 0.04 0.00 0.00 0.00 0.00 23.12 21.45 1nlb s ALA 24 CO 0.10 0.70 0.41 -1.54 0.00 0.00 0.00 175.76 175.43 1nlb s SER 25 N -1.83 -0.26 0.00 0.00 1.04 -0.79 -4.80 113.70 107.06 1nlb s SER 25 Ca 0.24 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.50 1nlb s SER 25 Cb -0.12 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.45 1nlb s SER 25 CO 0.15 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.21 1nlb n GLY 26 N 0.09 0.69 3.74 7.32 0.00 -1.24 -1.84 105.19 113.94 1nlb n GLY 26 Ca -0.17 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 1nlb n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1nlb s TYR 27 N -2.38 0.10 -0.65 1.61 1.13 -1.26 -4.60 117.35 111.30 1nlb s TYR 27 Ca 0.00 -0.53 -0.27 0.00 -1.41 0.00 0.00 57.07 54.85 1nlb s TYR 27 Cb 0.00 0.50 0.02 0.00 -1.10 0.00 0.00 41.96 41.38 1nlb s TYR 27 CO 0.00 -1.18 1.37 0.99 -2.51 0.00 0.00 175.55 174.23 1nlb s THR 28 N -3.76 3.74 0.31 -3.49 2.01 -1.26 -4.89 115.64 108.30 1nlb s THR 28 Ca 0.16 0.53 0.08 0.00 0.31 0.00 0.00 61.69 62.77 1nlb s THR 28 Cb -0.04 -4.65 0.33 0.00 0.01 0.00 0.00 72.50 68.16 1nlb s THR 28 CO 0.09 -1.49 1.64 0.15 -0.69 0.00 0.00 174.62 174.32 1nlb h PHE 29 N 10.83 0.53 0.00 4.92 3.57 -1.94 -0.38 116.94 134.47 1nlb h PHE 29 Ca -0.27 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.28 1nlb h PHE 29 Cb 1.08 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.73 1nlb h PHE 29 CO 1.08 -0.25 0.00 0.25 -2.23 0.00 0.00 178.31 177.16 1nlb n THR 30 N -5.20 0.02 1.23 4.41 -2.24 -1.26 -3.54 114.28 107.69 1nlb n THR 30 Ca 0.26 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.17 1nlb n THR 30 Cb 0.84 -0.53 0.30 0.00 -2.10 0.00 0.00 70.33 68.84 1nlb n THR 30 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1nlb n ASP 31 N -1.09 1.76 -3.84 3.42 8.00 -0.15 -4.14 116.55 120.50 1nlb n ASP 31 Ca 0.20 -1.42 -0.12 0.00 0.71 0.00 0.00 54.79 54.15 1nlb n ASP 31 Cb 0.14 0.13 -0.13 0.00 -0.02 0.00 0.00 41.12 41.24 1nlb n ASP 31 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1nlb s PHE 32 N -2.24 -0.07 0.61 1.24 0.08 -1.23 -5.09 117.98 111.29 1nlb s PHE 32 Ca 0.28 0.17 -0.16 0.00 0.12 0.00 0.00 56.93 57.35 1nlb s PHE 32 Cb 0.20 0.01 -0.02 0.00 -0.57 0.00 0.00 43.02 42.64 1nlb s PHE 32 CO 0.43 -0.04 1.10 -1.54 -0.10 0.00 0.00 175.22 175.07 1nlb s SER 33 N 0.09 5.45 -0.14 1.36 1.04 -1.26 -4.50 113.70 115.74 1nlb s SER 33 Ca -0.00 1.99 0.00 0.00 0.48 0.00 0.00 55.95 58.41 1nlb s SER 33 Cb -0.01 -2.55 -0.01 0.00 0.10 0.00 0.00 66.02 63.55 1nlb s SER 33 CO -0.00 -1.40 -0.14 -0.32 0.98 0.00 0.00 173.24 172.36 1nlb s MET 34 N -3.89 3.30 0.24 4.02 1.75 -1.05 -2.64 119.30 121.03 1nlb s MET 34 Ca 0.67 -0.72 0.09 0.00 -1.25 0.00 0.00 55.69 54.48 1nlb s MET 34 Cb -0.20 -2.62 -0.04 0.00 2.84 0.00 0.00 34.83 34.81 1nlb s MET 34 CO 0.36 0.13 0.01 -1.01 -0.65 0.00 0.00 175.02 173.85 1nlb s HIS 35 N 0.56 2.75 -0.07 4.11 3.76 0.10 -0.83 115.29 125.67 1nlb s HIS 35 Ca -0.09 -0.20 0.04 0.00 -0.15 0.00 0.00 55.06 54.67 1nlb s HIS 35 Cb -0.16 -1.25 -0.00 0.00 1.11 0.00 0.00 32.58 32.28 1nlb s HIS 35 CO 0.04 0.59 -0.21 -1.58 -0.85 0.00 0.00 174.74 172.73 1nlb s TRP 36 N -2.16 2.11 -0.04 1.40 0.52 -0.76 -0.69 118.94 119.33 1nlb s TRP 36 Ca 0.30 -0.71 0.01 0.00 0.02 0.00 0.00 56.10 55.73 1nlb s TRP 36 Cb -0.07 -1.42 0.02 0.00 -1.15 0.00 0.00 33.47 30.85 1nlb s TRP 36 CO 0.20 -0.26 -0.06 0.08 0.02 0.00 0.00 176.95 176.92 1nlb s VAL 37 N 0.14 0.62 0.36 4.03 1.01 -0.04 -0.66 120.40 125.86 1nlb s VAL 37 Ca -0.09 -0.20 0.09 0.00 0.00 0.00 0.00 61.98 61.77 1nlb s VAL 37 Cb -0.14 -0.61 -0.06 0.00 0.00 0.00 0.00 36.38 35.57 1nlb s VAL 37 CO 0.05 0.23 0.01 0.54 0.00 0.00 0.00 175.10 175.93 1nlb s ASN 38 N 0.70 4.07 -0.21 3.32 4.22 -0.15 0.17 114.94 127.05 1nlb s ASN 38 Ca -0.10 -1.11 -0.05 0.00 -2.14 0.00 0.00 52.86 49.46 1nlb s ASN 38 Cb -0.13 -0.46 0.11 0.00 1.28 0.00 0.00 41.25 42.04 1nlb s ASN 38 CO 0.01 -0.31 0.40 -1.58 -2.04 0.00 0.00 177.10 173.57 1nlb s GLN 39 N -3.72 0.33 0.56 3.55 0.74 0.33 -1.05 119.66 120.38 1nlb s GLN 39 Ca 0.35 0.83 -0.18 0.00 0.05 0.00 0.00 55.36 56.41 1nlb s GLN 39 Cb 0.03 0.01 -0.05 0.00 1.10 0.00 0.00 33.01 34.09 1nlb s GLN 39 CO 0.19 -0.41 1.08 0.00 -0.55 0.00 0.00 175.29 175.60 1nlb s ALA 40 N 2.58 2.72 -0.29 1.58 0.00 -1.26 -1.19 121.76 125.91 1nlb s ALA 40 Ca 0.04 0.59 -0.42 0.00 0.00 0.00 0.00 51.96 52.18 1nlb s ALA 40 Cb -0.13 -3.29 -0.17 0.00 0.00 0.00 0.00 23.12 19.53 1nlb s ALA 40 CO -0.14 -0.73 1.63 -2.30 0.00 0.00 0.00 175.76 174.23 1nlb n PRO 41 N -1.59 0.77 -0.93 0.00 -0.02 -1.26 -0.90 135.00 131.08 1nlb n PRO 41 Ca 0.10 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 1nlb n PRO 41 Cb 0.52 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 1nlb n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nlb n GLY 42 N 3.84 0.23 0.00 -1.23 0.00 -1.26 -4.98 105.19 101.79 1nlb n GLY 42 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1nlb n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nlb n LYS 43 N -0.83 1.86 -1.74 1.61 5.02 -0.08 -5.15 118.16 118.85 1nlb n LYS 43 Ca 0.00 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.99 1nlb n LYS 43 Cb 0.24 0.00 0.21 0.00 -0.02 0.00 0.00 35.03 35.46 1nlb n LYS 43 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1nlb s GLY 44 N -1.18 1.75 0.01 0.72 0.00 -1.26 -4.67 107.32 102.69 1nlb s GLY 44 Ca 0.00 -1.20 -0.21 0.00 0.00 0.00 0.00 44.72 43.31 1nlb s GLY 44 CO 0.00 -0.37 0.61 1.08 0.00 0.00 0.00 173.10 174.42 1nlb s LEU 45 N -6.16 4.44 -0.11 0.66 1.43 -1.26 -4.19 118.68 113.48 1nlb s LEU 45 Ca 0.74 1.21 0.01 0.00 -1.03 0.00 0.00 54.13 55.07 1nlb s LEU 45 Cb -0.04 -2.96 0.02 0.00 0.03 0.00 0.00 46.19 43.24 1nlb s LEU 45 CO 0.54 0.12 -0.14 0.20 0.23 0.00 0.00 176.35 177.30 1nlb s ASN 46 N -0.30 2.34 -0.15 2.29 0.01 -0.22 -4.99 114.94 113.91 1nlb s ASN 46 Ca 0.32 -0.40 -0.29 0.00 -0.71 0.00 0.00 52.86 51.77 1nlb s ASN 46 Cb -0.19 -1.03 -0.00 0.00 0.41 0.00 0.00 41.25 40.44 1nlb s ASN 46 CO 0.18 -0.00 1.04 0.86 -1.51 0.00 0.00 177.10 177.67 1nlb s TRP 47 N 1.06 3.41 -0.05 2.20 -0.00 -1.26 -0.98 118.94 123.31 1nlb s TRP 47 Ca -0.06 1.51 0.11 0.00 -0.00 0.00 0.00 56.10 57.67 1nlb s TRP 47 Cb -0.15 -3.24 -0.23 0.00 -0.00 0.00 0.00 33.47 29.85 1nlb s TRP 47 CO -0.02 -0.42 0.62 -1.33 -0.00 0.00 0.00 176.95 175.79 1nlb n MET 48 N 5.55 0.64 -0.80 5.86 2.81 0.16 -4.70 117.12 126.64 1nlb n MET 48 Ca 0.10 0.29 0.00 0.00 -1.81 0.00 0.00 57.70 56.28 1nlb n MET 48 Cb 0.47 -1.78 0.00 0.00 -0.71 0.00 0.00 33.22 31.21 1nlb n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1nlb n GLY 49 N 1.60 0.63 3.40 3.03 0.00 -1.22 -0.88 105.19 111.76 1nlb n GLY 49 Ca -0.19 -1.74 -0.10 0.00 0.00 0.00 0.00 46.02 44.00 1nlb n GLY 49 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1nlb s TRP 50 N -2.75 0.35 -0.04 1.61 1.48 -0.77 -1.82 118.94 117.00 1nlb s TRP 50 Ca 0.00 -0.71 0.05 0.00 -1.06 0.00 0.00 56.10 54.39 1nlb s TRP 50 Cb 0.00 0.03 -0.01 0.00 -1.16 0.00 0.00 33.47 32.33 1nlb s TRP 50 CO 0.00 -0.79 -0.20 0.08 -4.06 0.00 0.00 176.95 171.98 1nlb s VAL 51 N -3.97 1.62 -0.38 -0.66 1.01 -0.01 -1.63 120.40 116.39 1nlb s VAL 51 Ca 0.18 -0.84 -0.28 0.00 0.00 0.00 0.00 61.98 61.03 1nlb s VAL 51 Cb 0.02 -1.38 0.02 0.00 0.00 0.00 0.00 36.38 35.05 1nlb s VAL 51 CO 0.02 0.46 1.06 0.21 0.00 0.00 0.00 175.10 176.85 1nlb s ASN 52 N -0.17 6.79 0.14 3.32 3.84 -0.41 -2.53 114.94 125.91 1nlb s ASN 52 Ca 0.00 0.78 0.23 0.00 0.21 0.00 0.00 52.86 54.08 1nlb s ASN 52 Cb -0.11 -2.53 0.90 0.00 -0.55 0.00 0.00 41.25 38.97 1nlb s ASN 52 CO 0.02 -0.98 1.71 0.35 -2.79 0.00 0.00 177.10 175.40 1nlb n THR 52 N 6.18 0.65 -0.06 -5.21 -2.24 -1.26 0.15 114.28 112.49 1nlb n THR 52 Ca 0.11 0.06 -0.22 0.00 -2.27 0.00 0.00 64.05 61.73 1nlb n THR 52 Cb 0.48 -0.85 -0.13 0.00 -2.10 0.00 0.00 70.33 67.73 1nlb n THR 52 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1nlb n GLU 53 N -1.94 0.66 -0.05 -0.78 -0.58 -1.26 -4.56 120.64 112.13 1nlb n GLU 53 Ca 0.04 0.39 -0.09 0.00 -0.42 0.00 0.00 57.16 57.08 1nlb n GLU 53 Cb 0.29 -1.70 -0.15 0.00 -0.57 0.00 0.00 31.44 29.31 1nlb n GLU 53 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1nlb n THR 54 N -3.92 1.53 -0.05 2.62 -1.04 -1.20 -4.99 114.28 107.22 1nlb n THR 54 Ca -0.34 -0.82 0.00 0.00 -2.04 0.00 0.00 64.05 60.85 1nlb n THR 54 Cb 0.88 -0.82 0.00 0.00 -1.82 0.00 0.00 70.33 68.57 1nlb n THR 54 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nlb n GLY 55 N 1.64 1.39 3.72 3.41 0.00 0.40 -5.02 105.19 110.73 1nlb n GLY 55 Ca -0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 1nlb n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1nlb s GLU 56 N -0.51 4.39 0.10 1.61 2.56 -1.25 -4.62 118.70 120.99 1nlb s GLU 56 Ca 0.00 1.93 0.02 0.00 0.00 0.00 0.00 54.97 56.91 1nlb s GLU 56 Cb 0.00 -3.28 -0.04 0.00 2.00 0.00 0.00 34.13 32.81 1nlb s GLU 56 CO 0.00 -0.31 0.21 -1.25 -0.56 0.00 0.00 175.26 173.35 1nlb s PRO 57 N 0.84 3.30 -0.04 4.30 0.04 -1.26 -1.29 135.00 140.89 1nlb s PRO 57 Ca 0.60 -0.58 0.01 0.00 0.04 0.00 0.00 61.00 61.08 1nlb s PRO 57 Cb -0.33 -2.93 0.02 0.00 0.04 0.00 0.00 34.50 31.30 1nlb s PRO 57 CO 0.31 0.56 -0.04 -0.08 0.04 0.00 0.00 177.00 177.79 1nlb s THR 58 N -1.60 0.46 0.00 1.26 -1.32 -0.64 -5.02 115.64 108.79 1nlb s THR 58 Ca 0.34 -0.10 0.03 0.00 -1.21 0.00 0.00 61.69 60.75 1nlb s THR 58 Cb -0.12 -0.49 -0.03 0.00 -1.51 0.00 0.00 72.50 70.34 1nlb s THR 58 CO 0.27 0.20 -0.07 -0.31 -2.21 0.00 0.00 174.62 172.50 1nlb s TYR 59 N 0.84 2.89 0.54 9.09 2.02 -1.26 -1.85 117.35 129.61 1nlb s TYR 59 Ca -0.11 -0.04 -0.19 0.00 -0.37 0.00 0.00 57.07 56.37 1nlb s TYR 59 Cb -0.14 -1.61 -0.06 0.00 -0.40 0.00 0.00 41.96 39.76 1nlb s TYR 59 CO -0.00 0.38 1.09 0.00 -1.57 0.00 0.00 175.55 175.44 1nlb s ALA 60 N -1.00 2.74 0.27 3.71 0.00 -0.06 -4.83 121.76 122.59 1nlb s ALA 60 Ca 0.17 0.67 -0.06 0.00 0.00 0.00 0.00 51.96 52.74 1nlb s ALA 60 Cb -0.11 -3.30 0.50 0.00 0.00 0.00 0.00 23.12 20.21 1nlb s ALA 60 CO 0.08 -0.67 1.59 -0.44 0.00 0.00 0.00 175.76 176.32 1nlb h ASP 61 N 1.11 -0.65 0.10 0.00 3.45 -1.93 0.33 116.42 118.82 1nlb h ASP 61 Ca -0.49 0.26 0.00 0.00 0.43 0.00 0.00 57.03 57.23 1nlb h ASP 61 Cb 1.24 0.50 0.00 0.00 -0.56 0.00 0.00 39.33 40.51 1nlb h ASP 61 CO 0.57 -0.29 0.00 0.44 -1.57 0.00 0.00 179.24 178.39 1nlb h ASP 62 N 0.02 0.00 -0.04 6.45 3.45 -1.94 -2.71 116.42 121.66 1nlb h ASP 62 Ca 0.47 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.90 1nlb h ASP 62 Cb 0.82 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.56 1nlb h ASP 62 CO -0.87 0.00 -0.54 0.49 -1.57 0.00 0.00 179.24 176.75 1nlb n PHE 63 N -2.44 0.14 -3.41 4.55 3.01 0.11 -5.03 117.46 114.40 1nlb n PHE 63 Ca -0.01 -1.50 -0.37 0.00 1.01 0.00 0.00 57.45 56.57 1nlb n PHE 63 Cb 0.07 -0.25 -0.06 0.00 -0.01 0.00 0.00 39.48 39.23 1nlb n PHE 63 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1nlb s LYS 64 N -3.15 4.01 0.00 -1.08 1.02 -1.02 -4.24 119.74 115.27 1nlb s LYS 64 Ca 0.38 0.51 0.00 0.00 0.02 0.00 0.00 55.97 56.89 1nlb s LYS 64 Cb 0.37 -3.15 0.00 0.00 -0.52 0.00 0.00 37.83 34.53 1nlb s LYS 64 CO -0.07 0.62 0.00 0.41 -0.92 0.00 0.00 175.35 175.39 1nlb n GLY 65 N 1.51 1.95 0.02 -3.33 0.00 -1.26 -4.75 105.19 99.33 1nlb n GLY 65 Ca -0.11 -0.67 0.14 0.00 0.00 0.00 0.00 46.02 45.38 1nlb n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nlb n ARG 66 N 0.00 0.35 -4.34 1.61 1.74 -1.26 -4.87 116.66 109.89 1nlb n ARG 66 Ca 0.00 -0.04 -0.34 0.00 -0.77 0.00 0.00 57.85 56.69 1nlb n ARG 66 Cb 0.00 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 29.85 1nlb n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1nlb s PHE 67 N -2.68 3.15 -0.04 -1.55 0.08 -1.26 -0.67 117.98 115.00 1nlb s PHE 67 Ca 0.24 0.17 -0.01 0.00 0.12 0.00 0.00 56.93 57.45 1nlb s PHE 67 Cb 0.20 -1.76 0.03 0.00 -0.57 0.00 0.00 43.02 40.92 1nlb s PHE 67 CO 0.49 0.47 0.04 0.00 -0.10 0.00 0.00 175.22 176.12 1nlb s ALA 68 N -0.95 0.27 -0.17 5.36 0.00 -0.19 -4.97 121.76 121.12 1nlb s ALA 68 Ca 0.15 0.17 -0.11 0.00 0.00 0.00 0.00 51.96 52.17 1nlb s ALA 68 Cb -0.11 -0.51 -0.05 0.00 0.00 0.00 0.00 23.12 22.45 1nlb s ALA 68 CO 0.05 -0.34 0.19 -0.06 0.00 0.00 0.00 175.76 175.60 1nlb s PHE 69 N 1.73 3.46 0.25 0.00 2.99 -1.26 -0.84 117.98 124.32 1nlb s PHE 69 Ca -0.00 0.46 0.02 0.00 0.00 0.00 0.00 56.93 57.41 1nlb s PHE 69 Cb -0.12 -2.19 -0.04 0.00 0.00 0.00 0.00 43.02 40.67 1nlb s PHE 69 CO -0.03 0.35 0.18 -1.54 -0.00 0.00 0.00 175.22 174.18 1nlb s SER 70 N 0.14 0.78 0.09 1.36 1.04 -0.66 -4.77 113.70 111.68 1nlb s SER 70 Ca 0.12 -1.52 0.01 0.00 0.48 0.00 0.00 55.95 55.04 1nlb s SER 70 Cb -0.12 0.43 -0.04 0.00 0.10 0.00 0.00 66.02 66.39 1nlb s SER 70 CO 0.01 -0.91 -0.05 -0.76 0.98 0.00 0.00 173.24 172.51 1nlb s LEU 71 N -3.25 2.47 -0.43 2.42 1.43 -1.26 -0.82 118.68 119.23 1nlb s LEU 71 Ca 0.39 -1.02 0.06 0.00 -1.03 0.00 0.00 54.13 52.54 1nlb s LEU 71 Cb 0.05 0.03 0.22 0.00 0.03 0.00 0.00 46.19 46.52 1nlb s LEU 71 CO 0.17 -0.52 0.47 1.21 0.23 0.00 0.00 176.35 177.91 1nlb n GLU 72 N -0.00 0.68 -0.25 1.70 4.07 -0.52 -4.97 120.64 121.34 1nlb n GLU 72 Ca -0.12 -3.35 0.06 0.00 -0.06 0.00 0.00 57.16 53.69 1nlb n GLU 72 Cb 0.61 -1.49 0.19 0.00 -0.06 0.00 0.00 31.44 30.69 1nlb n GLU 72 CO 0.00 0.00 0.00 1.15 -0.06 0.00 0.00 177.13 178.22 1nlb h THR 73 N 3.13 0.46 -0.27 6.31 2.02 -1.96 -0.26 112.91 122.33 1nlb h THR 73 Ca 0.15 -0.08 0.08 0.00 0.77 0.00 0.00 66.41 67.34 1nlb h THR 73 Cb 0.87 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1nlb h THR 73 CO 0.46 0.04 0.24 0.77 0.37 0.00 0.00 175.52 177.40 1nlb h SER 74 N 0.22 0.00 -0.50 4.18 4.64 -1.95 0.76 113.55 120.91 1nlb h SER 74 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1nlb h SER 74 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1nlb h SER 74 CO -0.56 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.40 1nlb n ALA 75 N -2.46 2.48 -4.12 5.18 0.00 -0.16 -4.97 120.51 116.46 1nlb n ALA 75 Ca 0.04 -1.39 -0.30 0.00 0.00 0.00 0.00 53.44 51.78 1nlb n ALA 75 Cb 0.39 -0.70 -0.04 0.00 0.00 0.00 0.00 19.45 19.10 1nlb n ALA 75 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1nlb n SER 76 N 0.82 -0.87 -4.16 0.00 7.64 0.26 -4.71 113.62 112.60 1nlb n SER 76 Ca 0.19 -1.08 -0.25 0.00 1.01 0.00 0.00 58.87 58.74 1nlb n SER 76 Cb 0.61 -2.61 -0.16 0.00 -1.01 0.00 0.00 64.21 61.05 1nlb n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1nlb s THR 77 N -3.85 1.42 0.01 0.44 2.01 -1.04 -0.91 115.64 113.73 1nlb s THR 77 Ca 0.23 -0.75 0.03 0.00 0.31 0.00 0.00 61.69 61.50 1nlb s THR 77 Cb -0.13 -1.19 -0.04 0.00 0.01 0.00 0.00 72.50 71.16 1nlb s THR 77 CO 0.93 0.40 -0.03 0.00 -0.69 0.00 0.00 174.62 175.23 1nlb s ALA 78 N -0.28 3.17 0.13 7.40 0.00 -0.20 -1.44 121.76 130.54 1nlb s ALA 78 Ca 0.04 -1.01 0.08 0.00 0.00 0.00 0.00 51.96 51.07 1nlb s ALA 78 Cb -0.08 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.77 1nlb s ALA 78 CO 0.00 0.64 -0.18 0.71 0.00 0.00 0.00 175.76 176.93 1nlb s TYR 79 N -1.08 1.72 -0.09 0.00 2.02 -0.00 -0.52 117.35 119.39 1nlb s TYR 79 Ca 0.19 -0.46 -0.01 0.00 -0.37 0.00 0.00 57.07 56.43 1nlb s TYR 79 Cb -0.11 -0.90 0.03 0.00 -0.40 0.00 0.00 41.96 40.57 1nlb s TYR 79 CO 0.10 0.24 -0.04 -1.17 -1.57 0.00 0.00 175.55 173.11 1nlb s LEU 80 N -2.28 0.93 -0.08 -1.29 0.20 -0.51 -1.66 118.68 113.99 1nlb s LEU 80 Ca 0.10 -0.20 0.03 0.00 0.69 0.00 0.00 54.13 54.75 1nlb s LEU 80 Cb -0.08 -0.65 -0.02 0.00 -0.43 0.00 0.00 46.19 45.02 1nlb s LEU 80 CO 0.05 -0.15 -0.15 -1.58 -0.29 0.00 0.00 176.35 174.23 1nlb s GLN 81 N 1.78 2.83 -0.16 1.98 0.74 -0.02 -0.91 119.66 125.90 1nlb s GLN 81 Ca 0.04 -0.72 0.01 0.00 0.05 0.00 0.00 55.36 54.74 1nlb s GLN 81 Cb -0.13 -2.44 0.01 0.00 1.10 0.00 0.00 33.01 31.55 1nlb s GLN 81 CO -0.06 0.44 -0.19 0.42 -0.55 0.00 0.00 175.29 175.35 1nlb s ILE 82 N -0.26 2.20 0.24 -2.34 1.01 0.19 -1.02 121.20 121.21 1nlb s ILE 82 Ca 0.01 -0.91 -0.01 0.00 0.00 0.00 0.00 60.65 59.74 1nlb s ILE 82 Cb -0.13 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1nlb s ILE 82 CO 0.03 0.53 0.44 0.20 0.00 0.00 0.00 174.94 176.14 1nlb s ASN 82 N 1.05 6.38 -1.18 3.58 0.01 0.15 -2.07 114.94 122.87 1nlb s ASN 82 Ca -0.01 0.45 -0.30 0.00 -0.71 0.00 0.00 52.86 52.28 1nlb s ASN 82 Cb -0.14 -2.03 0.03 0.00 0.41 0.00 0.00 41.25 39.52 1nlb s ASN 82 CO -0.07 -0.10 0.72 -0.24 -1.51 0.00 0.00 177.10 175.90 1nlb n SER 82 N -0.87 -4.54 -4.61 -1.22 2.88 -1.18 -4.83 113.62 99.26 1nlb n SER 82 Ca -0.04 -1.21 -0.42 0.00 -1.33 0.00 0.00 58.87 55.87 1nlb n SER 82 Cb 0.54 -2.19 0.01 0.00 -0.75 0.00 0.00 64.21 61.82 1nlb n SER 82 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1nlb n LEU 82 N -4.76 2.51 -4.43 2.46 4.77 -0.32 -4.54 117.00 112.68 1nlb n LEU 82 Ca -0.11 1.05 -0.25 0.00 -0.03 0.00 0.00 56.01 56.67 1nlb n LEU 82 Cb 0.57 -1.35 -0.11 0.00 -2.33 0.00 0.00 43.42 40.21 1nlb n LEU 82 CO 0.72 -1.48 -0.50 -0.54 -1.33 0.00 0.00 177.39 174.26 1nlb s LYS 83 N -1.96 1.56 0.45 3.23 -0.14 -1.26 -0.29 119.74 121.33 1nlb s LYS 83 Ca 0.63 -1.62 0.18 0.00 -1.36 0.00 0.00 55.97 53.79 1nlb s LYS 83 Cb -0.57 -1.74 1.12 0.00 -1.68 0.00 0.00 37.83 34.96 1nlb s LYS 83 CO 0.57 0.35 1.94 -0.91 -0.76 0.00 0.00 175.35 176.54 1nlb h ASN 84 N 2.78 0.31 0.39 2.83 2.35 -1.96 0.83 115.58 123.12 1nlb h ASN 84 Ca -0.43 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 1nlb h ASN 84 Cb 1.23 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.56 1nlb h ASN 84 CO 0.54 0.16 0.00 -0.62 -1.65 0.00 0.00 177.43 175.86 1nlb n GLU 85 N -4.46 0.08 0.00 0.81 4.71 -1.26 -1.92 120.64 118.60 1nlb n GLU 85 Ca 0.13 0.41 0.15 0.00 -0.01 0.00 0.00 57.16 57.84 1nlb n GLU 85 Cb 0.54 -1.67 0.72 0.00 -1.01 0.00 0.00 31.44 30.02 1nlb n GLU 85 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1nlb n ASP 86 N -1.82 0.11 -4.62 1.62 8.00 0.29 -4.79 116.55 115.33 1nlb n ASP 86 Ca 0.02 -0.24 -0.43 0.00 0.71 0.00 0.00 54.79 54.85 1nlb n ASP 86 Cb 0.13 -0.23 -0.03 0.00 -0.02 0.00 0.00 41.12 40.97 1nlb n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1nlb s THR 87 N -2.56 3.13 -0.03 -3.53 2.01 -0.81 -4.84 115.64 109.00 1nlb s THR 87 Ca 0.28 0.14 -0.28 0.00 0.31 0.00 0.00 61.69 62.14 1nlb s THR 87 Cb 0.20 -3.14 0.09 0.00 0.01 0.00 0.00 72.50 69.67 1nlb s THR 87 CO 0.47 -0.07 1.26 0.00 -0.69 0.00 0.00 174.62 175.60 1nlb n ALA 88 N 9.99 -3.58 -2.82 7.40 0.00 -0.82 -4.43 120.51 126.25 1nlb n ALA 88 Ca 0.25 -0.77 -0.35 0.00 0.00 0.00 0.00 53.44 52.57 1nlb n ALA 88 Cb 0.44 0.12 -0.10 0.00 0.00 0.00 0.00 19.45 19.92 1nlb n ALA 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1nlb s THR 89 N -2.02 4.54 -0.22 0.00 2.01 -0.33 -1.08 115.64 118.55 1nlb s THR 89 Ca 0.30 -0.13 -0.04 0.00 0.31 0.00 0.00 61.69 62.13 1nlb s THR 89 Cb -0.01 -3.00 -0.01 0.00 0.01 0.00 0.00 72.50 69.49 1nlb s THR 89 CO -0.01 0.51 -0.04 -0.31 -0.69 0.00 0.00 174.62 174.08 1nlb s TYR 90 N 0.01 2.96 0.05 4.92 2.02 0.03 -0.52 117.35 126.82 1nlb s TYR 90 Ca 0.04 -0.89 0.03 0.00 -0.37 0.00 0.00 57.07 55.89 1nlb s TYR 90 Cb -0.12 -2.10 -0.04 0.00 -0.40 0.00 0.00 41.96 39.30 1nlb s TYR 90 CO 0.01 -0.51 -0.01 -0.06 -1.57 0.00 0.00 175.55 173.42 1nlb s PHE 91 N 1.40 3.01 0.11 2.71 0.40 0.13 -1.11 117.98 124.62 1nlb s PHE 91 Ca 0.05 0.01 0.06 0.00 -0.60 0.00 0.00 56.93 56.45 1nlb s PHE 91 Cb -0.14 -1.59 -0.04 0.00 0.51 0.00 0.00 43.02 41.76 1nlb s PHE 91 CO -0.03 0.46 -0.06 0.00 0.70 0.00 0.00 175.22 176.30 1nlb s ALA 93 N -1.30 -1.07 -0.03 0.00 0.00 0.14 -0.93 121.76 118.57 1nlb s ALA 93 Ca 0.23 0.88 -0.22 0.00 0.00 0.00 0.00 51.96 52.86 1nlb s ALA 93 Cb -0.11 -0.29 -0.05 0.00 0.00 0.00 0.00 23.12 22.68 1nlb s ALA 93 CO 0.16 -0.26 0.65 0.50 0.00 0.00 0.00 175.76 176.81 1nlb s ARG 94 N -0.62 4.39 -0.16 0.00 3.52 -0.59 -0.72 118.95 124.77 1nlb s ARG 94 Ca -0.07 0.81 -0.07 0.00 -0.13 0.00 0.00 55.73 56.26 1nlb s ARG 94 Cb -0.03 -3.39 -0.04 0.00 -1.56 0.00 0.00 34.95 29.92 1nlb s ARG 94 CO 0.04 0.23 0.10 0.12 -0.81 0.00 0.00 175.30 174.97 1nlb s PHE 95 N 0.26 3.39 0.28 5.12 5.99 -1.08 -2.76 117.98 129.17 1nlb s PHE 95 Ca 0.34 0.29 0.07 0.00 0.00 0.00 0.00 56.93 57.63 1nlb s PHE 95 Cb -0.18 -2.02 -0.03 0.00 0.00 0.00 0.00 43.02 40.79 1nlb s PHE 95 CO 0.18 0.40 0.29 -0.51 -0.00 0.00 0.00 175.22 175.58 1nlb s LEU 96 N -0.20 3.88 0.55 6.12 1.43 -0.41 -4.26 118.68 125.79 1nlb s LEU 96 Ca 0.09 -0.24 0.22 0.00 -1.03 0.00 0.00 54.13 53.17 1nlb s LEU 96 Cb -0.12 -2.46 1.51 0.00 0.03 0.00 0.00 46.19 45.15 1nlb s LEU 96 CO 0.01 -0.17 2.18 -0.07 0.23 0.00 0.00 176.35 178.53 1nlb h LEU 97 N 1.29 0.00 -0.25 1.79 4.07 -1.99 0.24 115.31 120.47 1nlb h LEU 97 Ca -0.48 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.48 1nlb h LEU 97 Cb 1.24 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.98 1nlb h LEU 97 CO 0.59 0.00 0.00 0.54 -1.08 0.00 0.00 178.44 178.49 1nlb n ARG 98 N -4.23 0.80 -3.19 1.13 1.74 -1.26 -4.86 116.66 106.79 1nlb n ARG 98 Ca -0.02 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.88 1nlb n ARG 98 Cb 0.12 -1.10 0.05 0.00 -1.02 0.00 0.00 32.46 30.51 1nlb n ARG 98 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1nlb n GLN 99 N -0.35 -5.42 -3.89 5.56 1.13 0.07 -5.04 117.38 109.44 1nlb n GLN 99 Ca 0.00 0.67 -0.09 0.00 -1.94 0.00 0.00 57.00 55.63 1nlb n GLN 99 Cb 0.05 -5.14 -0.07 0.00 0.11 0.00 0.00 30.24 25.19 1nlb n GLN 99 CO 0.00 0.00 0.00 1.52 -1.44 0.00 0.00 177.06 177.14 1nlb s TYR 100 N -3.18 0.23 -0.31 1.08 -0.85 -1.24 -4.95 117.35 108.13 1nlb s TYR 100 Ca 0.38 -0.63 -0.18 0.00 -0.52 0.00 0.00 57.07 56.12 1nlb s TYR 100 Cb -0.17 -0.03 -0.01 0.00 0.38 0.00 0.00 41.96 42.12 1nlb s TYR 100 CO 0.48 -0.64 0.53 -0.06 -1.52 0.00 0.00 175.55 174.34 1nlb s PHE 100 N -3.90 3.22 -0.69 -3.49 0.08 -1.26 -1.29 117.98 110.64 1nlb s PHE 100 Ca 0.10 0.42 0.23 0.00 0.12 0.00 0.00 56.93 57.80 1nlb s PHE 100 Cb 0.04 -2.86 -0.01 0.00 -0.57 0.00 0.00 43.02 39.61 1nlb s PHE 100 CO -0.06 -0.43 0.98 -0.40 -0.10 0.00 0.00 175.22 175.21 1nlb n ASP 101 N 5.69 0.64 -3.76 1.36 3.85 -1.11 -4.92 116.55 118.30 1nlb n ASP 101 Ca -0.04 -0.39 -0.13 0.00 -0.71 0.00 0.00 54.79 53.52 1nlb n ASP 101 Cb 0.49 0.91 -0.11 0.00 -1.35 0.00 0.00 41.12 41.06 1nlb n ASP 101 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1nlb s VAL 102 N -3.16 -0.01 0.12 2.12 0.11 -1.26 -5.04 120.40 113.28 1nlb s VAL 102 Ca 0.04 0.02 0.07 0.00 -2.93 0.00 0.00 61.98 59.18 1nlb s VAL 102 Cb 0.15 -0.43 -0.04 0.00 -1.53 0.00 0.00 36.38 34.54 1nlb s VAL 102 CO 0.82 0.01 -0.16 0.26 -3.33 0.00 0.00 175.10 172.70 1nlb s TRP 103 N 0.37 1.51 0.83 1.54 0.52 -1.26 -1.54 118.94 120.92 1nlb s TRP 103 Ca -0.02 -0.51 -0.12 0.00 0.02 0.00 0.00 56.10 55.48 1nlb s TRP 103 Cb -0.03 -0.79 0.09 0.00 -1.15 0.00 0.00 33.47 31.58 1nlb s TRP 103 CO -0.02 0.18 1.14 0.20 0.02 0.00 0.00 176.95 178.48 1nlb s GLY 104 N -2.33 1.59 0.00 0.98 0.00 -0.10 -4.55 107.32 102.91 1nlb s GLY 104 Ca 0.09 -0.50 0.24 0.00 0.00 0.00 0.00 44.72 44.54 1nlb s GLY 104 CO 0.04 -0.01 1.77 0.00 0.00 0.00 0.00 173.10 174.90 1nlb n ALA 105 N -3.46 2.11 0.00 3.20 0.00 -1.26 -4.74 120.51 116.37 1nlb n ALA 105 Ca 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1nlb n ALA 105 Cb 0.59 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1nlb n ALA 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nlb n GLY 106 N 0.94 1.17 3.06 0.00 0.00 -1.26 -5.02 105.19 104.08 1nlb n GLY 106 Ca 0.07 -1.61 -0.32 0.00 0.00 0.00 0.00 46.02 44.16 1nlb n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nlb s THR 107 N -2.10 1.86 -0.20 2.61 2.01 -0.27 -4.91 115.64 114.64 1nlb s THR 107 Ca 0.00 -0.97 -0.21 0.00 0.31 0.00 0.00 61.69 60.82 1nlb s THR 107 Cb 0.00 -1.79 -0.02 0.00 0.01 0.00 0.00 72.50 70.70 1nlb s THR 107 CO 0.00 0.36 0.65 -0.89 -0.69 0.00 0.00 174.62 174.05 1nlb s THR 108 N 1.34 5.00 -0.12 -0.82 2.01 -1.26 -0.79 115.64 120.99 1nlb s THR 108 Ca 0.02 1.23 0.02 0.00 0.31 0.00 0.00 61.69 63.26 1nlb s THR 108 Cb -0.15 -3.96 -0.00 0.00 0.01 0.00 0.00 72.50 68.40 1nlb s THR 108 CO -0.10 0.09 -0.19 0.68 -0.69 0.00 0.00 174.62 174.40 1nlb s VAL 109 N 2.05 2.46 -0.10 3.82 -7.23 -0.24 -1.19 120.40 119.97 1nlb s VAL 109 Ca 0.29 -0.87 0.01 0.00 -1.81 0.00 0.00 61.98 59.60 1nlb s VAL 109 Cb -0.16 -1.99 -0.02 0.00 0.56 0.00 0.00 36.38 34.77 1nlb s VAL 109 CO 0.10 0.54 -0.11 0.42 -0.31 0.00 0.00 175.10 175.74 1nlb s THR 110 N 0.46 3.31 -0.29 5.32 -4.23 -0.06 -1.95 115.64 118.19 1nlb s THR 110 Ca -0.13 -0.60 -0.07 0.00 -1.18 0.00 0.00 61.69 59.71 1nlb s THR 110 Cb -0.17 -2.36 0.00 0.00 1.34 0.00 0.00 72.50 71.31 1nlb s THR 110 CO 0.06 0.55 0.09 -0.69 -0.54 0.00 0.00 174.62 174.09 1nlb s VAL 111 N -0.20 4.08 0.01 2.29 1.01 -1.26 -1.73 120.40 124.60 1nlb s VAL 111 Ca 0.01 -0.59 -0.26 0.00 0.00 0.00 0.00 61.98 61.14 1nlb s VAL 111 Cb -0.13 -3.07 0.06 0.00 0.00 0.00 0.00 36.38 33.24 1nlb s VAL 111 CO 0.03 0.12 0.60 -0.55 0.00 0.00 0.00 175.10 175.30 1nlb s SER 112 N 1.53 -0.56 0.07 3.32 0.15 -0.14 -4.63 113.70 113.44 1nlb s SER 112 Ca 0.03 0.41 0.25 0.00 0.70 0.00 0.00 55.95 57.35 1nlb s SER 112 Cb -0.17 0.52 0.58 0.00 -1.71 0.00 0.00 66.02 65.24 1nlb s SER 112 CO 0.03 -0.69 1.49 -1.54 1.20 0.00 0.00 173.24 173.72 1nlb n SER 113 N 0.57 0.53 -4.77 5.45 3.41 -1.26 -3.97 113.62 113.59 1nlb n SER 113 Ca -0.19 0.09 -0.40 0.00 -0.26 0.00 0.00 58.87 58.11 1nlb n SER 113 Cb 0.59 0.01 0.01 0.00 -0.26 0.00 0.00 64.21 64.56 1nlb n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nlb s ALA 114 N -3.08 3.29 0.16 7.33 0.00 -1.26 -4.99 121.76 123.21 1nlb s ALA 114 Ca 0.09 1.45 -0.16 0.00 0.00 0.00 0.00 51.96 53.34 1nlb s ALA 114 Cb 0.16 -3.58 -0.07 0.00 0.00 0.00 0.00 23.12 19.62 1nlb s ALA 114 CO 0.67 -1.13 0.60 -1.59 0.00 0.00 0.00 175.76 174.32 1nlb s LYS 115 N -2.37 4.09 0.23 0.00 0.00 -1.26 -5.00 119.74 115.43 1nlb s LYS 115 Ca 0.59 0.63 -0.31 0.00 0.00 0.00 0.00 55.97 56.89 1nlb s LYS 115 Cb -0.43 -2.96 -0.11 0.00 0.00 0.00 0.00 37.83 34.33 1nlb s LYS 115 CO 0.56 0.48 1.57 0.99 0.00 0.00 0.00 175.35 178.95 1nlb s THR 116 N -1.43 2.36 -0.12 3.79 2.01 -1.26 -4.72 115.64 116.27 1nlb s THR 116 Ca 0.38 0.28 -0.10 0.00 0.31 0.00 0.00 61.69 62.55 1nlb s THR 116 Cb -0.16 -3.18 0.03 0.00 0.01 0.00 0.00 72.50 69.20 1nlb s THR 116 CO 0.20 0.04 0.31 0.28 -0.69 0.00 0.00 174.62 174.75 1nlb s THR 117 N 0.48 -0.00 0.58 -0.82 -1.32 0.01 -4.94 115.64 109.63 1nlb s THR 117 Ca 0.66 0.01 -0.18 0.00 -1.21 0.00 0.00 61.69 60.97 1nlb s THR 117 Cb -0.46 -0.43 -0.04 0.00 -1.51 0.00 0.00 72.50 70.06 1nlb s THR 117 CO 0.40 0.00 1.10 -2.16 -2.21 0.00 0.00 174.62 171.76 1nlb s PRO 118 N 0.21 3.22 0.56 7.08 0.04 -1.26 -1.51 135.00 143.35 1nlb s PRO 118 Ca -0.00 1.46 -0.08 0.00 0.04 0.00 0.00 61.00 62.42 1nlb s PRO 118 Cb -0.02 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.49 1nlb s PRO 118 CO -0.00 -0.93 0.91 -1.25 0.04 0.00 0.00 177.00 175.77 1nlb s PRO 119 N -3.64 3.40 -0.12 0.56 0.04 -1.26 -4.42 135.00 129.55 1nlb s PRO 119 Ca 0.69 0.35 -0.04 0.00 0.04 0.00 0.00 61.00 62.05 1nlb s PRO 119 Cb -0.21 -2.24 -0.03 0.00 0.04 0.00 0.00 34.50 32.06 1nlb s PRO 119 CO 0.32 -0.47 0.02 -1.12 0.04 0.00 0.00 177.00 175.79 1nlb s SER 120 N -4.18 5.32 -0.21 6.66 0.01 0.02 -4.93 113.70 116.39 1nlb s SER 120 Ca 0.52 0.10 -0.02 0.00 1.31 0.00 0.00 55.95 57.86 1nlb s SER 120 Cb -0.11 -1.69 0.00 0.00 0.21 0.00 0.00 66.02 64.44 1nlb s SER 120 CO 0.48 0.29 -0.11 -0.69 0.41 0.00 0.00 173.24 173.63 1nlb s VAL 121 N -0.36 2.83 -0.05 3.43 1.01 -1.26 -1.16 120.40 124.84 1nlb s VAL 121 Ca 0.08 -0.70 0.05 0.00 0.00 0.00 0.00 61.98 61.41 1nlb s VAL 121 Cb -0.12 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 1nlb s VAL 121 CO 0.02 0.46 -0.22 -0.31 0.00 0.00 0.00 175.10 175.05 1nlb s TYR 122 N 1.40 2.51 0.36 5.22 2.02 0.29 -4.97 117.35 124.17 1nlb s TYR 122 Ca 0.05 -0.53 -0.25 0.00 -0.37 0.00 0.00 57.07 55.98 1nlb s TYR 122 Cb -0.14 -1.61 -0.10 0.00 -0.40 0.00 0.00 41.96 39.72 1nlb s TYR 122 CO -0.07 -0.09 0.96 -1.25 -1.57 0.00 0.00 175.55 173.53 1nlb s PRO 123 N -0.34 4.44 -0.29 -1.71 0.04 -1.26 -0.45 135.00 135.43 1nlb s PRO 123 Ca 0.02 1.31 0.03 0.00 0.04 0.00 0.00 61.00 62.40 1nlb s PRO 123 Cb -0.12 -2.63 0.07 0.00 0.04 0.00 0.00 34.50 31.86 1nlb s PRO 123 CO 0.02 0.15 -0.04 -0.51 0.04 0.00 0.00 177.00 176.66 1nlb s LEU 124 N -2.39 3.95 0.15 -3.56 1.43 0.48 -4.86 118.68 113.89 1nlb s LEU 124 Ca 0.54 -1.63 0.11 0.00 -1.03 0.00 0.00 54.13 52.11 1nlb s LEU 124 Cb -0.17 -1.60 -0.04 0.00 0.03 0.00 0.00 46.19 44.41 1nlb s LEU 124 CO 0.22 -0.27 -0.25 0.00 0.23 0.00 0.00 176.35 176.28 1nlb s ALA 125 N 1.06 2.38 0.62 4.21 0.00 -1.26 -0.71 121.76 128.05 1nlb s ALA 125 Ca -0.02 -1.52 -0.18 0.00 0.00 0.00 0.00 51.96 50.24 1nlb s ALA 125 Cb -0.20 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.54 1nlb s ALA 125 CO -0.05 0.48 1.10 -0.35 0.00 0.00 0.00 175.76 176.93 1nlb n PRO 126 N 0.67 1.00 -1.69 0.00 -0.04 -1.26 -4.91 135.00 128.76 1nlb n PRO 126 Ca -0.16 0.39 -0.37 0.00 -0.04 0.00 0.00 63.50 63.32 1nlb n PRO 126 Cb 0.54 -2.31 0.07 0.00 -0.04 0.00 0.00 33.50 31.76 1nlb n PRO 126 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nlb n GLY 127 N 1.14 0.52 0.00 0.55 0.00 -1.26 -4.56 105.19 101.58 1nlb n GLY 127 Ca 0.14 -0.17 0.03 0.00 0.00 0.00 0.00 46.02 46.03 1nlb n GLY 127 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1nlb n SER 128 N -1.98 0.00 -0.19 1.61 3.41 -1.26 -2.44 113.62 112.77 1nlb n SER 128 Ca 0.16 0.45 0.08 0.00 -0.26 0.00 0.00 58.87 59.30 1nlb n SER 128 Cb 0.48 -0.46 0.12 0.00 -0.26 0.00 0.00 64.21 64.09 1nlb n SER 128 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nlb n ALA 129 N -1.46 2.30 -2.58 7.33 0.00 -1.26 -5.05 120.51 119.78 1nlb n ALA 129 Ca 0.02 -2.40 -0.32 0.00 0.00 0.00 0.00 53.44 50.74 1nlb n ALA 129 Cb 0.08 -0.40 -0.05 0.00 0.00 0.00 0.00 19.45 19.08 1nlb n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nlb s ALA 130 N -2.40 3.71 0.35 0.00 0.00 -1.02 -5.06 121.76 117.34 1nlb s ALA 130 Ca 0.27 -0.45 -0.28 0.00 0.00 0.00 0.00 51.96 51.50 1nlb s ALA 130 Cb 0.24 -2.24 -0.10 0.00 0.00 0.00 0.00 23.12 21.02 1nlb s ALA 130 CO 0.02 0.61 1.34 1.14 0.00 0.00 0.00 175.76 178.86 1nlb s GLN 131 N -2.59 4.27 -0.11 0.00 1.03 -1.26 -4.96 119.66 116.04 1nlb s GLN 131 Ca 0.42 2.27 -0.06 0.00 0.04 0.00 0.00 55.36 58.03 1nlb s GLN 131 Cb -0.12 -3.02 -0.04 0.00 0.03 0.00 0.00 33.01 29.86 1nlb s GLN 131 CO 0.23 -0.28 0.11 0.99 -2.54 0.00 0.00 175.29 173.80 1nlb s THR 132 N -1.15 5.22 0.00 3.63 2.01 -1.26 -5.11 115.64 118.98 1nlb s THR 132 Ca 0.50 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.59 1nlb s THR 132 Cb -0.41 -3.27 0.00 0.00 0.01 0.00 0.00 72.50 68.83 1nlb s THR 132 CO 0.54 0.60 0.00 0.59 -0.69 0.00 0.00 174.62 175.66 1nlb n ASN 133 N 1.96 1.31 -0.02 3.53 3.02 -1.26 -5.03 115.26 118.77 1nlb n ASN 133 Ca -0.19 -0.36 -0.12 0.00 -0.03 0.00 0.00 54.58 53.88 1nlb n ASN 133 Cb 0.55 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.73 1nlb n ASN 133 CO 0.00 0.00 0.00 -1.28 -2.62 0.00 0.00 177.26 173.36 1nlb h SER 134 N 0.00 0.74 -2.35 6.41 0.87 -1.99 -3.43 113.55 113.80 1nlb h SER 134 Ca 0.00 -0.41 -0.57 0.00 -1.23 0.00 0.00 61.79 59.58 1nlb h SER 134 Cb 0.00 -0.21 -0.10 0.00 -0.44 0.00 0.00 62.40 61.65 1nlb h SER 134 CO 0.00 1.16 -0.65 -0.04 -0.53 0.00 0.00 176.83 176.78 1nlb s MET 135 N -3.96 2.32 -0.01 2.24 -1.94 -1.26 -0.39 119.30 116.30 1nlb s MET 135 Ca -0.08 -1.35 0.02 0.00 -1.71 0.00 0.00 55.69 52.57 1nlb s MET 135 Cb 0.11 -2.21 0.00 0.00 2.01 0.00 0.00 34.83 34.74 1nlb s MET 135 CO 0.86 0.38 -0.06 0.54 -0.01 0.00 0.00 175.02 176.74 1nlb s VAL 136 N -2.19 0.48 -0.14 -6.03 0.11 0.19 -4.67 120.40 108.15 1nlb s VAL 136 Ca 0.30 -0.22 -0.03 0.00 -2.93 0.00 0.00 61.98 59.11 1nlb s VAL 136 Cb -0.07 -0.43 -0.02 0.00 -1.53 0.00 0.00 36.38 34.32 1nlb s VAL 136 CO 0.20 0.15 -0.06 -0.89 -3.33 0.00 0.00 175.10 171.17 1nlb s THR 137 N 0.09 3.70 0.35 5.04 2.01 -1.26 -1.22 115.64 124.35 1nlb s THR 137 Ca -0.01 -0.43 0.09 0.00 0.31 0.00 0.00 61.69 61.65 1nlb s THR 137 Cb -0.05 -2.60 -0.06 0.00 0.01 0.00 0.00 72.50 69.80 1nlb s THR 137 CO -0.00 0.51 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.67 1nlb s LEU 138 N 0.24 2.92 0.27 4.42 1.43 0.88 -4.63 118.68 124.21 1nlb s LEU 138 Ca -0.04 -1.07 -0.05 0.00 -1.03 0.00 0.00 54.13 51.94 1nlb s LEU 138 Cb -0.14 -1.24 -0.02 0.00 0.03 0.00 0.00 46.19 44.82 1nlb s LEU 138 CO 0.03 -0.26 0.35 -0.83 0.23 0.00 0.00 176.35 175.88 1nlb s GLY 139 N -3.70 1.24 -0.08 -3.19 0.00 0.11 -1.10 107.32 100.59 1nlb s GLY 139 Ca 0.35 -1.42 -0.03 0.00 0.00 0.00 0.00 44.72 43.61 1nlb s GLY 139 CO 0.19 -1.05 0.17 0.00 0.00 0.00 0.00 173.10 172.41 1nlb s LEU 141 N 2.05 3.38 -0.42 0.00 2.96 0.41 -1.47 118.68 125.59 1nlb s LEU 141 Ca 0.00 -0.19 -0.02 0.00 -0.22 0.00 0.00 54.13 53.70 1nlb s LEU 141 Cb -0.12 -1.89 0.11 0.00 0.50 0.00 0.00 46.19 44.80 1nlb s LEU 141 CO -0.06 0.01 0.21 -0.69 -1.32 0.00 0.00 176.35 174.50 1nlb s VAL 142 N 1.32 3.20 0.07 1.68 1.01 0.51 -0.55 120.40 127.63 1nlb s VAL 142 Ca 0.05 -2.17 0.07 0.00 0.00 0.00 0.00 61.98 59.93 1nlb s VAL 142 Cb -0.15 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 1nlb s VAL 142 CO 0.02 -0.70 -0.15 -0.75 0.00 0.00 0.00 175.10 173.53 1nlb s LYS 143 N 1.01 2.09 -0.88 2.72 2.20 -0.30 -0.78 119.74 125.80 1nlb s LYS 143 Ca 0.09 -1.00 -0.03 0.00 -0.36 0.00 0.00 55.97 54.68 1nlb s LYS 143 Cb -0.22 -2.24 0.00 0.00 -1.51 0.00 0.00 37.83 33.86 1nlb s LYS 143 CO -0.04 0.53 0.75 0.41 -0.36 0.00 0.00 175.35 176.63 1nlb n GLY 144 N 1.20 -0.10 3.59 5.54 0.00 -0.52 -0.80 105.19 114.10 1nlb n GLY 144 Ca -0.15 -0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.56 1nlb n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1nlb s TYR 145 N -3.24 2.48 -0.28 1.61 1.13 -0.96 -4.41 117.35 113.68 1nlb s TYR 145 Ca 0.17 -0.47 -0.23 0.00 -1.41 0.00 0.00 57.07 55.13 1nlb s TYR 145 Cb -0.08 -1.44 0.11 0.00 -1.10 0.00 0.00 41.96 39.45 1nlb s TYR 145 CO 0.51 0.53 0.93 0.12 -2.51 0.00 0.00 175.55 175.12 1nlb s PHE 146 N -2.56 -0.61 0.00 -3.49 2.19 -0.57 -0.31 117.98 112.64 1nlb s PHE 146 Ca 0.34 1.41 0.00 0.00 0.33 0.00 0.00 56.93 59.01 1nlb s PHE 146 Cb 0.01 0.36 0.00 0.00 -1.31 0.00 0.00 43.02 42.08 1nlb s PHE 146 CO 0.18 -0.29 0.00 -0.35 1.83 0.00 0.00 175.22 176.59 1nlb n PRO 147 N 2.66 1.14 -1.67 10.12 -0.04 -1.26 -0.81 135.00 145.15 1nlb n PRO 147 Ca -0.14 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.01 1nlb n PRO 147 Cb 0.56 0.00 0.04 0.00 -0.04 0.00 0.00 33.50 34.06 1nlb n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1nlb s GLU 148 N -1.45 3.06 0.55 0.54 0.41 -1.26 -4.78 118.70 115.77 1nlb s GLU 148 Ca 0.00 0.96 0.07 0.00 -0.41 0.00 0.00 54.97 55.59 1nlb s GLU 148 Cb 0.00 -2.01 0.07 0.00 -1.78 0.00 0.00 34.13 30.41 1nlb s GLU 148 CO 0.00 -1.00 0.54 -0.35 -0.49 0.00 0.00 175.26 173.96 1nlb n PRO 149 N -2.95 0.66 -4.04 0.39 -0.04 -1.26 -4.98 135.00 122.78 1nlb n PRO 149 Ca 0.07 -3.26 -0.12 0.00 -0.04 0.00 0.00 63.50 60.15 1nlb n PRO 149 Cb 0.53 0.14 -0.11 0.00 -0.04 0.00 0.00 33.50 34.03 1nlb n PRO 149 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1nlb s VAL 150 N -2.63 0.44 0.02 0.52 -7.23 -1.26 -4.31 120.40 105.96 1nlb s VAL 150 Ca 0.41 -1.06 0.06 0.00 -1.81 0.00 0.00 61.98 59.59 1nlb s VAL 150 Cb -0.03 -0.55 -0.03 0.00 0.56 0.00 0.00 36.38 36.33 1nlb s VAL 150 CO 0.26 -0.42 -0.17 0.42 -0.31 0.00 0.00 175.10 174.88 1nlb s THR 151 N -1.44 2.88 -0.05 5.32 -4.23 -0.38 -4.95 115.64 112.79 1nlb s THR 151 Ca -0.11 -1.06 -0.01 0.00 -1.18 0.00 0.00 61.69 59.33 1nlb s THR 151 Cb -0.10 -2.19 0.03 0.00 1.34 0.00 0.00 72.50 71.58 1nlb s THR 151 CO -0.00 0.40 0.02 -0.69 -0.54 0.00 0.00 174.62 173.81 1nlb s VAL 152 N -0.88 0.17 0.28 2.29 1.01 -1.26 -1.64 120.40 120.37 1nlb s VAL 152 Ca 0.14 0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.34 1nlb s VAL 152 Cb -0.11 -0.33 -0.05 0.00 0.00 0.00 0.00 36.38 35.89 1nlb s VAL 152 CO 0.04 0.20 0.11 0.42 0.00 0.00 0.00 175.10 175.87 1nlb s THR 153 N 1.71 0.58 -0.08 3.92 -4.23 -0.54 -4.97 115.64 112.03 1nlb s THR 153 Ca 0.00 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.55 1nlb s THR 153 Cb -0.13 -2.62 -0.00 0.00 1.34 0.00 0.00 72.50 71.10 1nlb s THR 153 CO -0.03 0.00 -0.21 0.26 -0.54 0.00 0.00 174.62 174.10 1nlb s TRP 154 N -3.66 2.22 -1.39 3.99 0.52 -1.26 -0.49 118.94 118.88 1nlb s TRP 154 Ca 0.37 -0.82 -0.01 0.00 0.02 0.00 0.00 56.10 55.66 1nlb s TRP 154 Cb 0.07 -1.50 0.01 0.00 -1.15 0.00 0.00 33.47 30.90 1nlb s TRP 154 CO 0.15 -0.32 0.54 0.09 0.02 0.00 0.00 176.95 177.42 1nlb n ASN 155 N 3.41 -0.80 -1.89 2.95 4.13 0.16 -0.71 115.26 122.51 1nlb n ASN 155 Ca -0.19 -0.94 -0.16 0.00 1.68 0.00 0.00 54.58 54.97 1nlb n ASN 155 Cb 0.53 -3.40 -0.04 0.00 -1.54 0.00 0.00 39.78 35.33 1nlb n ASN 155 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1nlb n SER 156 N -3.00 -4.41 0.00 6.41 7.64 -1.26 -1.24 113.62 117.76 1nlb n SER 156 Ca -0.29 0.26 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1nlb n SER 156 Cb 0.67 -3.87 0.00 0.00 -1.01 0.00 0.00 64.21 60.00 1nlb n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nlb n GLY 157 N -0.56 1.33 0.23 0.23 0.00 0.12 -4.93 105.19 101.60 1nlb n GLY 157 Ca -0.17 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.92 1nlb n GLY 157 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1nlb h SER 158 N 0.00 0.00 -3.23 1.61 4.64 -1.07 -3.34 113.55 112.16 1nlb h SER 158 Ca 0.00 0.00 -0.75 0.00 -0.47 0.00 0.00 61.79 60.57 1nlb h SER 158 Cb 0.00 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 61.86 1nlb h SER 158 CO 0.00 0.20 -0.30 -0.76 -0.87 0.00 0.00 176.83 175.10 1nlb s LEU 159 N -8.13 5.82 -0.02 5.97 1.43 -1.01 -4.85 118.68 117.88 1nlb s LEU 159 Ca -0.03 -1.53 0.02 0.00 -1.03 0.00 0.00 54.13 51.56 1nlb s LEU 159 Cb 0.15 -2.18 -0.03 0.00 0.03 0.00 0.00 46.19 44.16 1nlb s LEU 159 CO 0.67 -0.72 0.00 -1.54 0.23 0.00 0.00 176.35 174.99 1nlb n SER 160 N 5.20 4.32 -4.83 2.29 3.41 -1.26 -4.15 113.62 118.60 1nlb n SER 160 Ca -0.13 -0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.14 1nlb n SER 160 Cb 0.42 0.48 -0.06 0.00 -0.26 0.00 0.00 64.21 64.79 1nlb n SER 160 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1nlb s SER 161 N -3.42 6.92 -0.12 4.04 1.04 -1.26 -3.72 113.70 117.17 1nlb s SER 161 Ca -0.02 1.40 0.00 0.00 0.48 0.00 0.00 55.95 57.82 1nlb s SER 161 Cb 0.01 -2.42 0.00 0.00 0.10 0.00 0.00 66.02 63.71 1nlb s SER 161 CO 0.10 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.80 1nlb n GLY 162 N 0.05 0.49 3.65 7.32 0.00 -1.26 -4.75 105.19 110.69 1nlb n GLY 162 Ca 0.02 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 45.00 1nlb n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nlb s VAL 163 N -2.02 4.20 -0.07 1.61 1.01 -1.24 -1.42 120.40 122.48 1nlb s VAL 163 Ca 0.00 -0.28 -0.00 0.00 0.00 0.00 0.00 61.98 61.69 1nlb s VAL 163 Cb 0.00 -2.77 0.03 0.00 0.00 0.00 0.00 36.38 33.64 1nlb s VAL 163 CO 0.00 0.59 -0.02 -1.00 0.00 0.00 0.00 175.10 174.67 1nlb s HIS 164 N -0.75 0.75 -0.21 5.22 3.76 -0.23 -4.99 115.29 118.84 1nlb s HIS 164 Ca 0.12 -0.22 -0.02 0.00 -0.15 0.00 0.00 55.06 54.78 1nlb s HIS 164 Cb -0.11 -0.78 0.00 0.00 1.11 0.00 0.00 32.58 32.80 1nlb s HIS 164 CO 0.02 -0.30 -0.10 0.99 -0.85 0.00 0.00 174.74 174.51 1nlb s THR 165 N 1.60 2.91 0.09 1.30 2.01 -1.26 0.02 115.64 122.31 1nlb s THR 165 Ca -0.00 -0.67 -0.26 0.00 0.31 0.00 0.00 61.69 61.07 1nlb s THR 165 Cb -0.13 -2.30 -0.06 0.00 0.01 0.00 0.00 72.50 70.01 1nlb s THR 165 CO -0.04 0.45 0.80 -0.36 -0.69 0.00 0.00 174.62 174.78 1nlb s PHE 166 N 1.41 3.80 0.23 4.92 0.40 -0.07 -5.00 117.98 123.67 1nlb s PHE 166 Ca 0.05 1.57 -0.31 0.00 -0.60 0.00 0.00 56.93 57.64 1nlb s PHE 166 Cb -0.14 -2.84 -0.14 0.00 0.51 0.00 0.00 43.02 40.41 1nlb s PHE 166 CO -0.07 0.34 1.24 -2.30 0.70 0.00 0.00 175.22 175.13 1nlb n PRO 167 N 2.41 1.59 -2.00 0.24 -0.02 -1.26 -4.11 135.00 131.85 1nlb n PRO 167 Ca -0.03 0.57 -0.37 0.00 -2.02 0.00 0.00 63.50 61.65 1nlb n PRO 167 Cb 0.50 -2.11 0.03 0.00 -0.02 0.00 0.00 33.50 31.90 1nlb n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nlb s ALA 168 N -0.35 2.64 -0.04 3.55 0.00 -1.26 -4.85 121.76 121.45 1nlb s ALA 168 Ca 0.68 1.07 0.06 0.00 0.00 0.00 0.00 51.96 53.76 1nlb s ALA 168 Cb -0.73 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 18.91 1nlb s ALA 168 CO 0.53 -1.15 -0.21 0.08 0.00 0.00 0.00 175.76 175.01 1nlb s VAL 169 N -1.53 1.74 -0.08 0.00 1.01 -0.55 -4.93 120.40 116.06 1nlb s VAL 169 Ca 0.75 -0.90 -0.17 0.00 0.00 0.00 0.00 61.98 61.66 1nlb s VAL 169 Cb -0.32 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 1nlb s VAL 169 CO 0.36 0.49 0.46 -0.22 0.00 0.00 0.00 175.10 176.19 1nlb s LEU 170 N -0.15 4.34 -0.13 3.92 2.96 -1.26 -1.74 118.68 126.62 1nlb s LEU 170 Ca -0.01 0.86 -0.05 0.00 -0.22 0.00 0.00 54.13 54.71 1nlb s LEU 170 Cb -0.12 -2.67 0.06 0.00 0.50 0.00 0.00 46.19 43.97 1nlb s LEU 170 CO 0.02 0.10 0.26 -1.10 -1.32 0.00 0.00 176.35 174.31 1nlb s GLN 171 N 0.11 0.14 -1.26 1.98 -0.21 0.65 -4.94 119.66 116.13 1nlb s GLN 171 Ca 0.25 0.73 -0.13 0.00 0.02 0.00 0.00 55.36 56.23 1nlb s GLN 171 Cb -0.16 -0.05 -0.00 0.00 1.00 0.00 0.00 33.01 33.80 1nlb s GLN 171 CO 0.11 -0.28 0.62 0.43 -2.12 0.00 0.00 175.29 174.05 1nlb n SER 172 N 5.30 -3.04 0.00 5.90 7.64 -1.26 -1.29 113.62 126.87 1nlb n SER 172 Ca -0.07 -1.04 0.00 0.00 1.01 0.00 0.00 58.87 58.77 1nlb n SER 172 Cb 0.50 -3.09 0.00 0.00 -1.01 0.00 0.00 64.21 60.60 1nlb n SER 172 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1nlb n ASP 173 N -2.76 -3.14 -4.05 6.43 8.00 -1.26 -4.98 116.55 114.79 1nlb n ASP 173 Ca -0.19 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.12 1nlb n ASP 173 Cb 0.63 -1.93 -0.15 0.00 -0.02 0.00 0.00 41.12 39.65 1nlb n ASP 173 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1nlb s LEU 174 N 0.00 2.04 0.16 0.64 1.43 -0.41 -4.77 118.68 117.77 1nlb s LEU 174 Ca 0.00 -0.21 -0.04 0.00 -1.03 0.00 0.00 54.13 52.85 1nlb s LEU 174 Cb 0.00 -0.50 -0.05 0.00 0.03 0.00 0.00 46.19 45.66 1nlb s LEU 174 CO 0.00 0.10 0.38 -0.31 0.23 0.00 0.00 176.35 176.76 1nlb s TYR 175 N -0.32 3.48 -0.02 0.29 2.02 0.58 -0.25 117.35 123.12 1nlb s TYR 175 Ca 0.03 0.52 0.01 0.00 -0.37 0.00 0.00 57.07 57.26 1nlb s TYR 175 Cb -0.04 -1.98 0.01 0.00 -0.40 0.00 0.00 41.96 39.55 1nlb s TYR 175 CO -0.00 0.41 -0.02 0.99 -1.57 0.00 0.00 175.55 175.36 1nlb s THR 176 N -1.71 0.28 0.04 -0.71 2.01 -0.71 -1.43 115.64 113.41 1nlb s THR 176 Ca 0.41 -0.06 -0.00 0.00 0.31 0.00 0.00 61.69 62.35 1nlb s THR 176 Cb -0.12 -0.30 -0.03 0.00 0.01 0.00 0.00 72.50 72.06 1nlb s THR 176 CO 0.26 0.12 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.06 1nlb s LEU 177 N 0.47 2.40 0.07 4.42 0.20 0.04 -1.49 118.68 124.80 1nlb s LEU 177 Ca -0.05 -0.83 -0.03 0.00 0.69 0.00 0.00 54.13 53.91 1nlb s LEU 177 Cb -0.08 0.13 -0.03 0.00 -0.43 0.00 0.00 46.19 45.78 1nlb s LEU 177 CO -0.01 -0.48 0.04 -0.94 -0.29 0.00 0.00 176.35 174.68 1nlb s SER 178 N -2.42 0.37 -0.05 3.68 1.04 -1.26 -0.37 113.70 114.69 1nlb s SER 178 Ca -0.00 -0.92 -0.05 0.00 0.48 0.00 0.00 55.95 55.46 1nlb s SER 178 Cb 0.01 0.25 0.01 0.00 0.10 0.00 0.00 66.02 66.40 1nlb s SER 178 CO -0.06 -0.65 0.15 -0.55 0.98 0.00 0.00 173.24 173.11 1nlb s SER 179 N -2.91 -0.14 0.15 7.02 0.15 -0.54 -0.89 113.70 116.53 1nlb s SER 179 Ca 0.08 0.27 0.09 0.00 0.70 0.00 0.00 55.95 57.08 1nlb s SER 179 Cb 0.07 0.30 -0.04 0.00 -1.71 0.00 0.00 66.02 64.64 1nlb s SER 179 CO -0.09 -0.08 -0.20 -0.94 1.20 0.00 0.00 173.24 173.13 1nlb s SER 180 N -0.03 2.80 -0.01 5.45 1.04 0.10 -1.43 113.70 121.61 1nlb s SER 180 Ca -0.01 -0.81 0.01 0.00 0.48 0.00 0.00 55.95 55.62 1nlb s SER 180 Cb -0.02 -0.17 0.01 0.00 0.10 0.00 0.00 66.02 65.94 1nlb s SER 180 CO 0.00 0.03 -0.03 0.68 0.98 0.00 0.00 173.24 174.90 1nlb s VAL 181 N -1.70 0.27 -0.14 5.02 -7.23 -0.26 -1.07 120.40 115.28 1nlb s VAL 181 Ca 0.14 -0.08 0.02 0.00 -1.81 0.00 0.00 61.98 60.25 1nlb s VAL 181 Cb -0.07 -0.27 0.00 0.00 0.56 0.00 0.00 36.38 36.60 1nlb s VAL 181 CO 0.06 0.11 -0.19 -0.89 -0.31 0.00 0.00 175.10 173.89 1nlb s THR 182 N 0.31 2.39 0.15 5.32 2.01 -0.51 -0.09 115.64 125.22 1nlb s THR 182 Ca -0.03 -0.87 0.02 0.00 0.31 0.00 0.00 61.69 61.12 1nlb s THR 182 Cb -0.06 -1.98 -0.04 0.00 0.01 0.00 0.00 72.50 70.43 1nlb s THR 182 CO -0.01 0.53 -0.03 0.68 -0.69 0.00 0.00 174.62 175.11 1nlb s VAL 183 N 0.73 0.74 0.50 3.82 -7.23 -0.36 -4.70 120.40 113.89 1nlb s VAL 183 Ca -0.08 -1.97 -0.23 0.00 -1.81 0.00 0.00 61.98 57.88 1nlb s VAL 183 Cb -0.16 -1.94 -0.06 0.00 0.56 0.00 0.00 36.38 34.77 1nlb s VAL 183 CO 0.01 -0.64 1.36 -2.84 -0.31 0.00 0.00 175.10 172.68 1nlb s PRO 184 N -3.87 3.43 0.52 4.82 0.02 -1.26 -0.63 135.00 138.02 1nlb s PRO 184 Ca 0.19 2.25 0.35 0.00 0.02 0.00 0.00 61.00 63.81 1nlb s PRO 184 Cb 0.05 -2.44 1.84 0.00 0.02 0.00 0.00 34.50 33.97 1nlb s PRO 184 CO 0.01 -0.96 2.06 0.77 -0.33 0.00 0.00 177.00 178.55 1nlb h SER 185 N 1.89 0.00 0.13 2.53 0.02 -0.98 -0.30 113.55 116.83 1nlb h SER 185 Ca -0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 1nlb h SER 185 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1nlb h SER 185 CO 0.59 0.00 -0.04 -1.54 -1.14 0.00 0.00 176.83 174.70 1nlb n SER 186 N -2.75 0.61 -0.07 3.07 3.41 -1.26 -3.79 113.62 112.85 1nlb n SER 186 Ca -0.02 -0.98 -0.07 0.00 -0.26 0.00 0.00 58.87 57.54 1nlb n SER 186 Cb 0.08 -0.03 -0.11 0.00 -0.26 0.00 0.00 64.21 63.90 1nlb n SER 186 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1nlb n THR 187 N -0.64 0.97 -4.89 6.66 -2.24 -0.13 -4.82 114.28 109.18 1nlb n THR 187 Ca 0.19 -0.60 -0.26 0.00 -2.27 0.00 0.00 64.05 61.11 1nlb n THR 187 Cb 0.24 -0.63 -0.15 0.00 -2.10 0.00 0.00 70.33 67.69 1nlb n THR 187 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1nlb s TRP 188 N -2.34 1.74 -2.10 4.78 -0.00 -1.20 0.52 118.94 120.34 1nlb s TRP 188 Ca -0.07 -0.34 0.16 0.00 -0.00 0.00 0.00 56.10 55.85 1nlb s TRP 188 Cb 0.04 -1.11 0.76 0.00 -0.00 0.00 0.00 33.47 33.17 1nlb s TRP 188 CO 0.58 -0.01 1.52 -0.35 -0.00 0.00 0.00 176.95 178.69 1nlb n PRO 189 N 2.48 1.34 0.16 5.86 -0.04 -1.26 -4.71 135.00 138.83 1nlb n PRO 189 Ca -0.15 -0.51 0.05 0.00 -0.04 0.00 0.00 63.50 62.84 1nlb n PRO 189 Cb 0.53 -1.29 0.50 0.00 -0.04 0.00 0.00 33.50 33.21 1nlb n PRO 189 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1nlb h SER 190 N 0.99 0.16 -3.91 3.54 4.64 -1.88 -3.40 113.55 113.69 1nlb h SER 190 Ca 0.00 -0.02 -0.69 0.00 -0.47 0.00 0.00 61.79 60.62 1nlb h SER 190 Cb 0.22 -0.04 -0.22 0.00 -0.31 0.00 0.00 62.40 62.04 1nlb h SER 190 CO 0.00 0.21 -0.75 -1.61 -0.87 0.00 0.00 176.83 173.81 1nlb s GLU 191 N -4.99 2.60 0.35 4.77 2.02 0.18 -5.10 118.70 118.52 1nlb s GLU 191 Ca -0.06 -0.66 -0.26 0.00 0.02 0.00 0.00 54.97 54.02 1nlb s GLU 191 Cb 0.16 -2.44 -0.09 0.00 0.10 0.00 0.00 34.13 31.86 1nlb s GLU 191 CO 0.70 0.62 1.05 -0.08 0.02 0.00 0.00 175.26 177.57 1nlb s THR 192 N -0.71 3.71 -0.08 3.63 -1.32 -1.26 -4.44 115.64 115.16 1nlb s THR 192 Ca 0.11 1.46 0.00 0.00 -1.21 0.00 0.00 61.69 62.06 1nlb s THR 192 Cb -0.11 -3.83 0.02 0.00 -1.51 0.00 0.00 72.50 67.07 1nlb s THR 192 CO 0.01 0.16 -0.07 -0.69 -2.21 0.00 0.00 174.62 171.82 1nlb s VAL 193 N -1.47 0.86 0.01 5.08 1.01 -1.26 -4.98 120.40 119.64 1nlb s VAL 193 Ca 0.52 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.26 1nlb s VAL 193 Cb -0.25 -0.87 -0.01 0.00 0.00 0.00 0.00 36.38 35.25 1nlb s VAL 193 CO 0.32 0.32 -0.03 0.42 0.00 0.00 0.00 175.10 176.12 1nlb s THR 194 N 1.29 0.23 -0.16 3.92 -4.23 -1.26 -0.53 115.64 114.90 1nlb s THR 194 Ca -0.04 -0.39 -0.11 0.00 -1.18 0.00 0.00 61.69 59.98 1nlb s THR 194 Cb -0.14 -0.25 -0.05 0.00 1.34 0.00 0.00 72.50 73.40 1nlb s THR 194 CO -0.03 -0.10 0.19 0.00 -0.54 0.00 0.00 174.62 174.15 1nlb s ASN 196 N -0.06 5.66 0.02 0.00 0.01 0.35 -1.05 114.94 119.87 1nlb s ASN 196 Ca 0.13 -0.44 0.07 0.00 -0.71 0.00 0.00 52.86 51.92 1nlb s ASN 196 Cb -0.12 -2.03 -0.02 0.00 0.41 0.00 0.00 41.25 39.48 1nlb s ASN 196 CO 0.02 -0.18 -0.22 0.68 -1.51 0.00 0.00 177.10 175.89 1nlb s VAL 197 N 1.65 1.75 0.00 1.60 -7.23 -0.29 -1.47 120.40 116.40 1nlb s VAL 197 Ca 0.05 -1.10 0.02 0.00 -1.81 0.00 0.00 61.98 59.14 1nlb s VAL 197 Cb -0.17 -1.49 -0.01 0.00 0.56 0.00 0.00 36.38 35.28 1nlb s VAL 197 CO 0.07 0.36 -0.06 0.00 -0.31 0.00 0.00 175.10 175.16 1nlb s ALA 198 N -0.66 0.47 -0.45 1.32 0.00 -0.65 -1.38 121.76 120.41 1nlb s ALA 198 Ca 0.08 -0.29 0.02 0.00 0.00 0.00 0.00 51.96 51.78 1nlb s ALA 198 Cb -0.09 -0.10 0.13 0.00 0.00 0.00 0.00 23.12 23.06 1nlb s ALA 198 CO 0.01 0.10 0.23 -1.58 0.00 0.00 0.00 175.76 174.52 1nlb s HIS 199 N -0.25 2.31 0.31 0.00 2.46 -0.29 -1.24 115.29 118.59 1nlb s HIS 199 Ca 0.01 -2.59 0.06 0.00 0.47 0.00 0.00 55.06 53.01 1nlb s HIS 199 Cb -0.03 -2.14 0.83 0.00 -0.13 0.00 0.00 32.58 31.11 1nlb s HIS 199 CO -0.00 -0.78 1.65 -1.35 -2.47 0.00 0.00 174.74 171.79 1nlb h PRO 200 N 6.77 0.25 -0.55 2.88 0.11 -1.81 -1.24 132.00 138.41 1nlb h PRO 200 Ca -0.04 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 66.14 1nlb h PRO 200 Cb 0.93 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.95 1nlb h PRO 200 CO 0.53 0.17 0.37 0.00 -0.21 0.00 0.00 178.00 178.86 1nlb h ALA 201 N 1.80 1.98 -0.29 -0.75 0.00 -1.92 -1.61 119.26 118.48 1nlb h ALA 201 Ca 0.61 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.51 1nlb h ALA 201 Cb 1.28 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1nlb h ALA 201 CO -0.64 -0.10 0.00 -1.13 0.00 0.00 0.00 179.25 177.39 1nlb n SER 202 N -4.47 2.75 -2.46 0.00 3.41 -0.70 -4.96 113.62 107.19 1nlb n SER 202 Ca 0.08 -1.91 -0.16 0.00 -0.26 0.00 0.00 58.87 56.62 1nlb n SER 202 Cb 0.32 -0.19 -0.01 0.00 -0.26 0.00 0.00 64.21 64.08 1nlb n SER 202 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1nlb n SER 203 N 0.52 -4.76 -4.73 4.04 7.64 -0.55 -4.93 113.62 110.85 1nlb n SER 203 Ca 0.11 0.09 -0.41 0.00 1.01 0.00 0.00 58.87 59.66 1nlb n SER 203 Cb 0.40 -3.99 -0.04 0.00 -1.01 0.00 0.00 64.21 59.56 1nlb n SER 203 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1nlb s THR 204 N -2.80 4.44 -0.16 0.44 2.01 -0.86 -4.92 115.64 113.79 1nlb s THR 204 Ca 0.02 2.05 -0.04 0.00 0.31 0.00 0.00 61.69 64.02 1nlb s THR 204 Cb -0.01 -4.31 0.08 0.00 0.01 0.00 0.00 72.50 68.27 1nlb s THR 204 CO 0.02 0.32 0.24 -0.75 -0.69 0.00 0.00 174.62 173.76 1nlb s LYS 205 N -0.08 0.16 -0.02 4.92 2.20 -1.26 -1.13 119.74 124.53 1nlb s LYS 205 Ca 0.47 0.49 0.01 0.00 -0.36 0.00 0.00 55.97 56.58 1nlb s LYS 205 Cb -0.24 -0.56 0.01 0.00 -1.51 0.00 0.00 37.83 35.52 1nlb s LYS 205 CO 0.30 -0.45 -0.04 0.14 -0.36 0.00 0.00 175.35 174.94 1nlb s VAL 206 N 2.37 0.37 -0.50 4.02 -7.23 -0.48 -5.01 120.40 113.94 1nlb s VAL 206 Ca 0.04 -0.13 -0.02 0.00 -1.81 0.00 0.00 61.98 60.06 1nlb s VAL 206 Cb -0.14 -0.36 0.13 0.00 0.56 0.00 0.00 36.38 36.58 1nlb s VAL 206 CO -0.10 0.14 0.30 -1.81 -0.31 0.00 0.00 175.10 173.32 1nlb s ASP 207 N 0.32 5.20 -0.43 4.85 1.01 -1.26 -1.14 116.67 125.23 1nlb s ASP 207 Ca -0.03 -2.40 -0.21 0.00 0.71 0.00 0.00 52.55 50.61 1nlb s ASP 207 Cb -0.07 -1.83 0.02 0.00 1.01 0.00 0.00 42.92 42.05 1nlb s ASP 207 CO -0.00 -0.46 0.68 -0.75 0.21 0.00 0.00 175.17 174.85 1nlb s LYS 208 N 0.60 3.36 0.08 8.23 2.47 -0.22 -4.90 119.74 129.37 1nlb s LYS 208 Ca 0.12 -0.25 -0.30 0.00 -1.56 0.00 0.00 55.97 53.98 1nlb s LYS 208 Cb -0.22 -3.93 -0.05 0.00 -1.46 0.00 0.00 37.83 32.17 1nlb s LYS 208 CO -0.04 -1.00 1.05 0.21 0.16 0.00 0.00 175.35 175.73 1nlb s LYS 209 N 2.93 4.58 -0.29 4.03 2.20 -1.26 -1.13 119.74 130.79 1nlb s LYS 209 Ca 0.25 1.58 -0.23 0.00 -0.36 0.00 0.00 55.97 57.20 1nlb s LYS 209 Cb -0.14 -3.37 -0.00 0.00 -1.51 0.00 0.00 37.83 32.81 1nlb s LYS 209 CO 0.19 0.00 0.77 0.42 -0.36 0.00 0.00 175.35 176.38 1nlb s ILE 210 N 0.46 4.82 0.04 5.43 -1.09 0.31 -4.96 121.20 126.22 1nlb s ILE 210 Ca 0.52 1.21 0.09 0.00 -2.23 0.00 0.00 60.65 60.24 1nlb s ILE 210 Cb -0.25 -4.11 -0.03 0.00 -1.58 0.00 0.00 42.46 36.48 1nlb s ILE 210 CO 0.30 -0.19 -0.26 -0.69 -1.23 0.00 0.00 174.94 172.87 1nlb s VAL 211 N 2.88 2.12 0.46 2.92 1.01 -1.26 -4.59 120.40 123.93 1nlb s VAL 211 Ca 0.32 -1.37 -0.24 0.00 0.00 0.00 0.00 61.98 60.69 1nlb s VAL 211 Cb -0.14 -1.81 -0.09 0.00 0.00 0.00 0.00 36.38 34.33 1nlb s VAL 211 CO 0.11 0.37 1.11 -2.65 0.00 0.00 0.00 175.10 174.05 1nlb n PRO 212 N 1.80 1.50 0.00 2.72 -0.02 -1.26 -4.86 135.00 134.88 1nlb n PRO 212 Ca -0.17 0.54 0.12 0.00 -2.02 0.00 0.00 63.50 61.97 1nlb n PRO 212 Cb 0.52 -2.21 0.70 0.00 -0.02 0.00 0.00 33.50 32.49 1nlb n PRO 212 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02