#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f90 n VAL 2 N 0.00 0.00 0.00 1.61 0.24 -1.26 -4.66 118.33 114.26 1f90 n VAL 2 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1f90 n VAL 2 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1f90 n VAL 2 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1f90 n GLN 3 N 4.19 0.00 -4.92 7.34 7.27 -1.26 -4.79 117.38 125.20 1f90 n GLN 3 Ca 0.00 0.00 -0.26 0.00 0.07 0.00 0.00 57.00 56.81 1f90 n GLN 3 Cb 0.00 -0.77 -0.16 0.00 2.41 0.00 0.00 30.24 31.72 1f90 n GLN 3 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1f90 s LEU 4 N -5.40 2.01 -0.03 1.69 1.02 -1.26 -0.14 118.68 116.57 1f90 s LEU 4 Ca 0.00 -0.35 -0.00 0.00 0.02 0.00 0.00 54.13 53.79 1f90 s LEU 4 Cb 0.00 -1.00 0.03 0.00 0.02 0.00 0.00 46.19 45.24 1f90 s LEU 4 CO 0.00 0.22 0.03 -1.10 0.02 0.00 0.00 176.35 175.51 1f90 s GLN 5 N -0.33 0.08 -0.10 1.70 -1.52 -0.74 -4.22 119.66 114.53 1f90 s GLN 5 Ca 0.04 0.20 -0.11 0.00 -1.95 0.00 0.00 55.36 53.55 1f90 s GLN 5 Cb -0.09 -0.42 -0.05 0.00 -0.22 0.00 0.00 33.01 32.24 1f90 s GLN 5 CO 0.00 -0.21 0.25 -1.21 -0.25 0.00 0.00 175.29 173.87 1f90 s GLU 6 N 1.39 3.81 0.01 2.91 8.01 -1.26 -0.56 118.70 133.01 1f90 s GLU 6 Ca -0.05 0.06 0.00 0.00 0.01 0.00 0.00 54.97 55.00 1f90 s GLU 6 Cb -0.13 -3.27 -0.01 0.00 -4.31 0.00 0.00 34.13 26.41 1f90 s GLU 6 CO -0.03 0.60 -0.02 -1.54 0.01 0.00 0.00 175.26 174.28 1f90 s SER 7 N -0.61 0.15 0.00 -0.19 1.04 0.11 -4.84 113.70 109.36 1f90 s SER 7 Ca 0.17 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.29 1f90 s SER 7 Cb -0.13 0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.05 1f90 s SER 7 CO 0.06 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.71 1f90 n GLY 8 N 2.16 0.92 3.70 7.32 0.00 -1.26 -1.41 105.19 116.62 1f90 n GLY 8 Ca -0.19 -1.16 -0.35 0.00 0.00 0.00 0.00 46.02 44.31 1f90 n GLY 8 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1f90 n PRO 9 N -0.93 0.63 0.00 1.61 -0.04 -1.26 -4.92 135.00 130.09 1f90 n PRO 9 Ca 0.00 0.28 0.08 0.00 -0.04 0.00 0.00 63.50 63.82 1f90 n PRO 9 Cb 0.00 -2.45 -0.08 0.00 -0.04 0.00 0.00 33.50 30.92 1f90 n PRO 9 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1f90 n GLY 10 N 0.78 -0.51 2.91 0.55 0.00 -1.26 -4.78 105.19 102.88 1f90 n GLY 10 Ca 0.15 -0.49 -0.17 0.00 0.00 0.00 0.00 46.02 45.51 1f90 n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1f90 s LEU 11 N -2.71 1.66 -0.08 0.99 2.96 -1.26 -1.84 118.68 118.40 1f90 s LEU 11 Ca 0.08 -0.09 -0.03 0.00 -0.22 0.00 0.00 54.13 53.86 1f90 s LEU 11 Cb 0.13 -0.31 0.05 0.00 0.50 0.00 0.00 46.19 46.55 1f90 s LEU 11 CO 0.66 0.00 0.16 -0.69 -1.32 0.00 0.00 176.35 175.16 1f90 s VAL 12 N 0.38 -0.21 0.31 1.68 1.01 -0.87 -4.98 120.40 117.72 1f90 s VAL 12 Ca -0.04 0.30 -0.29 0.00 0.00 0.00 0.00 61.98 61.95 1f90 s VAL 12 Cb -0.08 -0.29 -0.10 0.00 0.00 0.00 0.00 36.38 35.91 1f90 s VAL 12 CO -0.00 0.13 1.28 -0.54 0.00 0.00 0.00 175.10 175.97 1f90 s LYS 13 N 1.97 4.40 0.68 2.72 3.01 -1.26 -2.45 119.74 128.81 1f90 s LYS 13 Ca -0.01 2.14 -0.17 0.00 -1.01 0.00 0.00 55.97 56.93 1f90 s LYS 13 Cb -0.12 -3.10 -0.06 0.00 -1.01 0.00 0.00 37.83 33.54 1f90 s LYS 13 CO -0.06 -0.15 0.45 -2.30 0.51 0.00 0.00 175.35 173.81 1f90 n PRO 14 N 1.11 0.34 0.00 -1.68 -0.02 -1.26 -2.43 135.00 131.05 1f90 n PRO 14 Ca 0.01 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 1f90 n PRO 14 Cb 0.42 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 1f90 n PRO 14 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1f90 n SER 15 N 0.19 0.00 -4.41 2.55 2.88 0.17 -4.95 113.62 110.06 1f90 n SER 15 Ca 0.10 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.38 1f90 n SER 15 Cb 0.49 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 64.10 1f90 n SER 15 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 1f90 s GLN 16 N -0.07 1.13 -0.17 -1.46 -0.21 -1.02 -4.13 119.66 113.73 1f90 s GLN 16 Ca 0.00 -1.00 -0.06 0.00 0.02 0.00 0.00 55.36 54.32 1f90 s GLN 16 Cb 0.00 -2.15 -0.04 0.00 1.00 0.00 0.00 33.01 31.82 1f90 s GLN 16 CO 0.00 -1.91 0.02 -1.54 -2.12 0.00 0.00 175.29 169.74 1f90 s SER 17 N -4.86 5.31 0.41 5.90 1.04 -1.26 -1.13 113.70 119.11 1f90 s SER 17 Ca 0.71 0.00 -0.22 0.00 0.48 0.00 0.00 55.95 56.92 1f90 s SER 17 Cb -0.03 -1.89 -0.11 0.00 0.10 0.00 0.00 66.02 64.08 1f90 s SER 17 CO 0.48 0.17 0.95 -0.22 0.98 0.00 0.00 173.24 175.60 1f90 s LEU 18 N 0.36 4.03 -0.18 2.42 2.96 0.28 -4.91 118.68 123.64 1f90 s LEU 18 Ca 0.00 1.72 -0.04 0.00 -0.22 0.00 0.00 54.13 55.59 1f90 s LEU 18 Cb -0.13 -4.42 0.08 0.00 0.50 0.00 0.00 46.19 42.22 1f90 s LEU 18 CO 0.01 -0.29 0.20 -0.55 -1.32 0.00 0.00 176.35 174.40 1f90 s SER 19 N -2.05 1.33 0.16 3.68 0.15 -1.26 -1.62 113.70 114.09 1f90 s SER 19 Ca 0.59 -0.13 0.08 0.00 0.70 0.00 0.00 55.95 57.19 1f90 s SER 19 Cb -0.11 0.31 -0.04 0.00 -1.71 0.00 0.00 66.02 64.47 1f90 s SER 19 CO 0.15 -0.31 -0.10 -0.76 1.20 0.00 0.00 173.24 173.43 1f90 s LEU 20 N 2.30 2.99 -0.02 3.45 1.43 -0.33 -4.48 118.68 124.03 1f90 s LEU 20 Ca 0.05 -0.53 0.06 0.00 -1.03 0.00 0.00 54.13 52.69 1f90 s LEU 20 Cb -0.15 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.35 1f90 s LEU 20 CO -0.11 0.12 -0.19 -0.89 0.23 0.00 0.00 176.35 175.52 1f90 s THR 21 N -1.57 1.51 -0.25 5.49 2.01 -0.50 -1.13 115.64 121.21 1f90 s THR 21 Ca 0.24 -0.81 0.02 0.00 0.31 0.00 0.00 61.69 61.45 1f90 s THR 21 Cb -0.09 -1.26 0.06 0.00 0.01 0.00 0.00 72.50 71.21 1f90 s THR 21 CO 0.15 0.43 -0.10 0.00 -0.69 0.00 0.00 174.62 174.40 1f90 s THR 23 N 1.20 5.14 -0.20 0.00 2.01 0.28 -2.17 115.64 121.90 1f90 s THR 23 Ca -0.07 0.88 -0.09 0.00 0.31 0.00 0.00 61.69 62.73 1f90 s THR 23 Cb -0.19 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.47 1f90 s THR 23 CO -0.06 0.21 0.09 -0.69 -0.69 0.00 0.00 174.62 173.49 1f90 s VAL 24 N 1.44 5.00 -0.04 3.82 1.01 -0.99 -1.79 120.40 128.85 1f90 s VAL 24 Ca 0.23 0.05 0.07 0.00 0.00 0.00 0.00 61.98 62.32 1f90 s VAL 24 Cb -0.15 -3.28 -0.01 0.00 0.00 0.00 0.00 36.38 32.94 1f90 s VAL 24 CO 0.09 0.43 -0.24 -0.89 0.00 0.00 0.00 175.10 174.49 1f90 s THR 25 N 0.54 1.93 0.00 3.92 2.01 0.80 -4.76 115.64 120.08 1f90 s THR 25 Ca 0.05 -1.02 0.00 0.00 0.31 0.00 0.00 61.69 61.03 1f90 s THR 25 Cb -0.12 -1.62 0.00 0.00 0.01 0.00 0.00 72.50 70.77 1f90 s THR 25 CO 0.00 0.54 0.00 0.61 -0.69 0.00 0.00 174.62 175.09 1f90 n GLY 26 N 2.77 0.81 3.40 4.40 0.00 -1.26 -4.54 105.19 110.77 1f90 n GLY 26 Ca -0.17 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 1f90 n GLY 26 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1f90 s TYR 27 N -2.22 -0.48 -0.10 1.61 5.04 -1.26 -5.14 117.35 114.80 1f90 s TYR 27 Ca 0.00 0.92 -0.30 0.00 -2.44 0.00 0.00 57.07 55.26 1f90 s TYR 27 Cb 0.00 0.25 -0.01 0.00 0.35 0.00 0.00 41.96 42.55 1f90 s TYR 27 CO 0.00 -0.45 1.01 0.45 -1.34 0.00 0.00 175.55 175.22 1f90 s SER 28 N -0.85 7.25 0.00 4.32 0.15 -1.26 -4.92 113.70 118.39 1f90 s SER 28 Ca -0.09 1.55 0.03 0.00 0.70 0.00 0.00 55.95 58.14 1f90 s SER 28 Cb -0.03 -2.56 0.18 0.00 -1.71 0.00 0.00 66.02 61.90 1f90 s SER 28 CO 0.06 -0.44 0.83 0.00 1.20 0.00 0.00 173.24 174.88 1f90 n ILE 29 N 4.51 0.00 0.27 6.45 3.06 -1.26 -2.09 119.36 130.30 1f90 n ILE 29 Ca 0.09 0.00 0.04 0.00 -2.50 0.00 0.00 62.75 60.38 1f90 n ILE 29 Cb 0.49 -0.22 -0.05 0.00 0.54 0.00 0.00 39.64 40.40 1f90 n ILE 29 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 1f90 n THR 30 N -0.57 0.00 0.19 9.51 -2.24 -1.26 -4.35 114.28 115.56 1f90 n THR 30 Ca 0.02 -0.28 -0.11 0.00 -2.27 0.00 0.00 64.05 61.41 1f90 n THR 30 Cb 0.01 0.82 -0.06 0.00 -2.10 0.00 0.00 70.33 68.99 1f90 n THR 30 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1f90 h SER 31 N 0.00 -0.46 -5.05 3.42 0.02 -1.69 -3.43 113.55 106.36 1f90 h SER 31 Ca 0.00 -0.10 0.01 0.00 -0.84 0.00 0.00 61.79 60.87 1f90 h SER 31 Cb 0.24 0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 1f90 h SER 31 CO 0.00 -0.02 0.31 -0.62 -1.14 0.00 0.00 176.83 175.35 1f90 s ASP 32 N -4.97 -0.03 0.15 3.07 2.15 -1.26 -5.00 116.67 110.79 1f90 s ASP 32 Ca -0.12 -1.02 0.00 0.00 0.43 0.00 0.00 52.55 51.84 1f90 s ASP 32 Cb 0.01 0.79 0.00 0.00 -0.30 0.00 0.00 42.92 43.43 1f90 s ASP 32 CO 0.39 -1.57 0.00 -1.22 -0.17 0.00 0.00 175.17 172.61 1f90 n TYR 33 N -0.54 -1.13 -4.40 -5.34 4.01 -1.26 -4.52 117.16 103.98 1f90 n TYR 33 Ca -0.07 0.60 -0.34 0.00 -0.16 0.00 0.00 57.90 57.93 1f90 n TYR 33 Cb 0.60 -1.03 -0.12 0.00 -0.31 0.00 0.00 39.34 38.48 1f90 n TYR 33 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1f90 s ALA 34 N -2.53 3.03 -0.41 -0.72 0.00 -1.17 -1.76 121.76 118.20 1f90 s ALA 34 Ca 0.00 -0.82 -0.07 0.00 0.00 0.00 0.00 51.96 51.07 1f90 s ALA 34 Cb 0.00 -1.54 0.09 0.00 0.00 0.00 0.00 23.12 21.67 1f90 s ALA 34 CO 0.00 0.27 0.23 -1.58 0.00 0.00 0.00 175.76 174.68 1f90 s TRP 35 N 0.19 3.40 0.61 0.00 0.52 -0.77 -2.84 118.94 120.04 1f90 s TRP 35 Ca -0.02 -1.80 0.05 0.00 0.02 0.00 0.00 56.10 54.35 1f90 s TRP 35 Cb -0.14 -3.00 0.09 0.00 -1.15 0.00 0.00 33.47 29.28 1f90 s TRP 35 CO 0.03 -0.89 0.84 -0.80 0.02 0.00 0.00 176.95 176.14 1f90 s ASN 35 N 2.03 4.91 -0.06 2.95 0.02 0.31 -1.94 114.94 123.16 1f90 s ASN 35 Ca 0.04 -0.57 -0.01 0.00 -1.02 0.00 0.00 52.86 51.30 1f90 s ASN 35 Cb -0.23 -0.01 0.03 0.00 0.02 0.00 0.00 41.25 41.05 1f90 s ASN 35 CO 0.00 -1.44 -0.01 0.26 0.02 0.00 0.00 177.10 175.93 1f90 s TRP 36 N -2.80 0.66 0.09 2.20 0.52 -0.28 -2.19 118.94 117.14 1f90 s TRP 36 Ca 0.62 -0.17 0.08 0.00 0.02 0.00 0.00 56.10 56.65 1f90 s TRP 36 Cb -0.06 -0.75 -0.03 0.00 -1.15 0.00 0.00 33.47 31.47 1f90 s TRP 36 CO 0.40 -0.29 -0.21 0.42 0.02 0.00 0.00 176.95 177.29 1f90 s ILE 37 N 1.70 1.69 0.01 2.03 -1.09 0.20 -0.14 121.20 125.60 1f90 s ILE 37 Ca 0.01 -1.49 0.02 0.00 -2.23 0.00 0.00 60.65 56.96 1f90 s ILE 37 Cb -0.13 -1.53 -0.01 0.00 -1.58 0.00 0.00 42.46 39.22 1f90 s ILE 37 CO -0.04 -0.03 -0.08 0.00 -1.23 0.00 0.00 174.94 173.56 1f90 s ARG 38 N -1.80 0.60 -0.21 2.79 1.70 -0.66 0.67 118.95 122.02 1f90 s ARG 38 Ca 0.06 -0.40 -0.03 0.00 -0.47 0.00 0.00 55.73 54.90 1f90 s ARG 38 Cb -0.10 -0.54 -0.00 0.00 -0.57 0.00 0.00 34.95 33.74 1f90 s ARG 38 CO 0.04 0.14 -0.07 -1.14 -1.08 0.00 0.00 175.30 173.19 1f90 s GLN 39 N -0.53 3.27 0.56 3.89 0.74 0.20 -1.54 119.66 126.25 1f90 s GLN 39 Ca 0.00 -0.69 -0.09 0.00 0.05 0.00 0.00 55.36 54.63 1f90 s GLN 39 Cb -0.05 -2.93 -0.04 0.00 1.10 0.00 0.00 33.01 31.10 1f90 s GLN 39 CO 0.00 -0.21 0.94 -0.06 -0.55 0.00 0.00 175.29 175.40 1f90 s PHE 40 N 1.43 3.59 -0.83 1.67 0.08 -0.63 -0.46 117.98 122.84 1f90 s PHE 40 Ca 0.05 1.13 -0.25 0.00 0.12 0.00 0.00 56.93 57.98 1f90 s PHE 40 Cb -0.14 -2.57 -0.11 0.00 -0.57 0.00 0.00 43.02 39.63 1f90 s PHE 40 CO -0.05 -0.52 2.25 -2.14 -0.10 0.00 0.00 175.22 174.66 1f90 s PRO 41 N -4.94 1.92 0.00 0.24 0.02 -1.26 -2.37 135.00 128.60 1f90 s PRO 41 Ca 0.52 0.20 0.00 0.00 0.02 0.00 0.00 61.00 61.75 1f90 s PRO 41 Cb -0.11 -4.88 0.00 0.00 0.02 0.00 0.00 34.50 29.53 1f90 s PRO 41 CO 0.49 -4.11 0.00 0.41 -0.33 0.00 0.00 177.00 173.47 1f90 n GLY 42 N 6.82 -0.12 2.91 0.52 0.00 -1.26 -4.90 105.19 109.15 1f90 n GLY 42 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 1f90 n GLY 42 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1f90 n ASN 43 N 0.00 0.00 -4.64 1.61 4.13 -1.00 -4.99 115.26 110.36 1f90 n ASN 43 Ca 0.00 0.00 -0.43 0.00 1.68 0.00 0.00 54.58 55.83 1f90 n ASN 43 Cb 0.00 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.21 1f90 n ASN 43 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 1f90 s LYS 44 N -0.03 3.98 -0.11 3.52 -2.85 -1.25 -4.89 119.74 118.11 1f90 s LYS 44 Ca 0.00 1.87 -0.08 0.00 -1.00 0.00 0.00 55.97 56.76 1f90 s LYS 44 Cb 0.00 -3.99 -0.04 0.00 -2.06 0.00 0.00 37.83 31.73 1f90 s LYS 44 CO 0.00 -1.08 0.17 -0.51 0.10 0.00 0.00 175.35 174.03 1f90 s LEU 45 N 4.63 4.39 -0.08 2.77 1.43 -1.26 -1.60 118.68 128.96 1f90 s LEU 45 Ca 0.71 0.52 -0.02 0.00 -1.03 0.00 0.00 54.13 54.31 1f90 s LEU 45 Cb -0.28 -2.13 0.03 0.00 0.03 0.00 0.00 46.19 43.84 1f90 s LEU 45 CO 0.28 0.39 0.02 -0.70 0.23 0.00 0.00 176.35 176.57 1f90 s GLU 46 N -0.99 0.42 0.05 1.70 2.12 -0.59 -5.00 118.70 116.42 1f90 s GLU 46 Ca 0.16 0.13 -0.30 0.00 0.36 0.00 0.00 54.97 55.31 1f90 s GLU 46 Cb -0.13 -0.98 -0.05 0.00 0.26 0.00 0.00 34.13 33.23 1f90 s GLU 46 CO 0.05 -0.35 1.10 -0.46 -0.54 0.00 0.00 175.26 175.06 1f90 s TRP 47 N 2.02 3.55 -0.24 5.30 -0.00 -1.26 -1.66 118.94 126.64 1f90 s TRP 47 Ca 0.04 1.49 -0.17 0.00 -0.00 0.00 0.00 56.10 57.46 1f90 s TRP 47 Cb -0.13 -3.29 -0.15 0.00 -0.00 0.00 0.00 33.47 29.91 1f90 s TRP 47 CO -0.05 -0.71 -0.11 -1.33 -0.00 0.00 0.00 176.95 174.75 1f90 n MET 48 N 3.71 0.57 0.00 5.86 2.81 0.80 -4.69 117.12 126.19 1f90 n MET 48 Ca 0.07 0.40 0.00 0.00 -1.81 0.00 0.00 57.70 56.36 1f90 n MET 48 Cb 0.48 -1.60 0.00 0.00 -0.71 0.00 0.00 33.22 31.39 1f90 n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1f90 n GLY 49 N 1.34 0.05 3.30 3.03 0.00 -1.21 -0.56 105.19 111.15 1f90 n GLY 49 Ca -0.43 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.52 1f90 n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1f90 s TYR 50 N -2.00 1.16 -0.06 1.61 -0.85 -0.15 -1.13 117.35 115.94 1f90 s TYR 50 Ca 0.00 -1.34 -0.02 0.00 -0.52 0.00 0.00 57.07 55.19 1f90 s TYR 50 Cb 0.00 -0.43 0.04 0.00 0.38 0.00 0.00 41.96 41.94 1f90 s TYR 50 CO 0.00 -0.79 0.11 -1.50 -1.52 0.00 0.00 175.55 171.85 1f90 s ILE 51 N -3.87 -0.16 0.75 -3.49 2.07 -0.82 -2.08 121.20 113.60 1f90 s ILE 51 Ca 0.36 0.33 -0.11 0.00 -1.41 0.00 0.00 60.65 59.81 1f90 s ILE 51 Cb 0.04 -0.22 0.04 0.00 0.13 0.00 0.00 42.46 42.45 1f90 s ILE 51 CO 0.16 0.14 1.10 0.42 -1.91 0.00 0.00 174.94 174.84 1f90 s THR 52 N 1.90 3.28 -0.20 4.00 -4.23 0.19 -1.84 115.64 118.74 1f90 s THR 52 Ca -0.00 0.42 0.16 0.00 -1.18 0.00 0.00 61.69 61.08 1f90 s THR 52 Cb -0.12 -3.28 0.16 0.00 1.34 0.00 0.00 72.50 70.60 1f90 s THR 52 CO -0.05 -0.54 1.44 0.00 -0.54 0.00 0.00 174.62 174.92 1f90 n TYR 53 N -3.23 0.54 0.38 3.99 4.11 -0.73 -0.36 117.16 121.87 1f90 n TYR 53 Ca 0.07 0.28 0.11 0.00 -0.00 0.00 0.00 57.90 58.36 1f90 n TYR 53 Cb 0.57 -0.87 0.19 0.00 -0.00 0.00 0.00 39.34 39.23 1f90 n TYR 53 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 1f90 n SER 54 N -2.08 3.33 0.00 9.48 3.41 -1.26 -4.42 113.62 122.08 1f90 n SER 54 Ca -0.01 -1.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.63 1f90 n SER 54 Cb 0.14 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 1f90 n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f90 n GLY 55 N 1.41 0.81 3.77 5.00 0.00 0.51 -5.05 105.19 111.64 1f90 n GLY 55 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1f90 n GLY 55 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1f90 s SER 56 N -2.65 6.79 0.19 1.61 0.15 -1.26 -4.71 113.70 113.82 1f90 s SER 56 Ca 0.00 2.30 0.10 0.00 0.70 0.00 0.00 55.95 59.05 1f90 s SER 56 Cb 0.00 -2.62 -0.04 0.00 -1.71 0.00 0.00 66.02 61.65 1f90 s SER 56 CO 0.00 -0.49 -0.21 0.42 1.20 0.00 0.00 173.24 174.16 1f90 s THR 57 N -1.37 2.15 -0.01 6.45 -4.23 -1.26 0.56 115.64 117.93 1f90 s THR 57 Ca 0.53 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 1f90 s THR 57 Cb -0.30 -2.02 0.01 0.00 1.34 0.00 0.00 72.50 71.53 1f90 s THR 57 CO 0.38 -0.21 0.01 -0.83 -0.54 0.00 0.00 174.62 173.43 1f90 s GLY 58 N -2.72 0.09 0.12 3.99 0.00 -0.88 -4.99 107.32 102.93 1f90 s GLY 58 Ca 0.19 0.11 0.07 0.00 0.00 0.00 0.00 44.72 45.10 1f90 s GLY 58 CO 0.09 0.31 -0.18 -0.19 0.00 0.00 0.00 173.10 173.13 1f90 s TYR 59 N 0.51 1.65 -0.17 1.90 2.02 -1.26 -0.97 117.35 121.02 1f90 s TYR 59 Ca -0.04 -0.46 -0.29 0.00 -0.37 0.00 0.00 57.07 55.90 1f90 s TYR 59 Cb -0.07 -0.88 -0.01 0.00 -0.40 0.00 0.00 41.96 40.60 1f90 s TYR 59 CO -0.01 0.20 1.22 1.21 -1.57 0.00 0.00 175.55 176.61 1f90 s ASN 60 N -2.16 6.97 0.38 2.29 3.84 0.28 -4.83 114.94 121.71 1f90 s ASN 60 Ca 0.08 1.65 0.21 0.00 0.21 0.00 0.00 52.86 55.00 1f90 s ASN 60 Cb -0.08 -2.54 1.25 0.00 -0.55 0.00 0.00 41.25 39.33 1f90 s ASN 60 CO 0.04 -0.74 1.63 -0.65 -2.79 0.00 0.00 177.10 174.60 1f90 h PRO 61 N 8.06 0.17 0.00 0.43 0.11 -1.96 1.46 132.00 140.26 1f90 h PRO 61 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1f90 h PRO 61 Cb 1.10 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1f90 h PRO 61 CO 0.97 0.11 0.00 -1.13 -0.21 0.00 0.00 178.00 177.74 1f90 n SER 62 N -4.99 0.00 0.00 -2.05 3.41 -1.26 -2.95 113.62 105.78 1f90 n SER 62 Ca 0.35 0.28 0.00 0.00 -0.26 0.00 0.00 58.87 59.24 1f90 n SER 62 Cb 1.19 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 1f90 n SER 62 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1f90 n LEU 63 N -1.33 0.00 -0.26 1.04 4.77 0.49 -4.90 117.00 116.81 1f90 n LEU 63 Ca 0.02 -0.10 0.23 0.00 -0.03 0.00 0.00 56.01 56.13 1f90 n LEU 63 Cb 0.04 0.00 0.43 0.00 -2.33 0.00 0.00 43.42 41.55 1f90 n LEU 63 CO 0.03 0.00 0.81 2.29 -1.33 0.00 0.00 177.39 179.19 1f90 n LYS 64 N -0.63 -0.05 -0.09 3.23 2.85 -0.53 -1.20 118.16 121.74 1f90 n LYS 64 Ca 0.00 1.11 -0.09 0.00 -1.05 0.00 0.00 58.31 58.28 1f90 n LYS 64 Cb 0.00 -1.96 -0.02 0.00 -0.65 0.00 0.00 35.03 32.40 1f90 n LYS 64 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1f90 h SER 65 N 0.00 0.37 -0.40 -5.58 4.64 -1.90 -3.29 113.55 107.39 1f90 h SER 65 Ca 0.64 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.89 1f90 h SER 65 Cb 1.65 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.65 1f90 h SER 65 CO -0.64 0.33 0.00 -2.11 -0.87 0.00 0.00 176.83 173.55 1f90 n ARG 66 N -4.83 3.01 -4.14 4.77 1.85 -0.34 -5.00 116.66 111.99 1f90 n ARG 66 Ca -0.02 -2.41 -0.28 0.00 -1.00 0.00 0.00 57.85 54.15 1f90 n ARG 66 Cb 0.06 -1.52 -0.07 0.00 -1.05 0.00 0.00 32.46 29.88 1f90 n ARG 66 CO 0.00 0.00 0.00 -1.50 -0.01 0.00 0.00 177.63 176.12 1f90 s ILE 67 N -1.56 4.08 -0.26 8.89 2.07 -0.82 -1.23 121.20 132.37 1f90 s ILE 67 Ca 0.34 -1.16 -0.18 0.00 -1.41 0.00 0.00 60.65 58.23 1f90 s ILE 67 Cb 0.21 -3.03 0.07 0.00 0.13 0.00 0.00 42.46 39.85 1f90 s ILE 67 CO 0.17 -0.03 0.66 -0.55 -1.91 0.00 0.00 174.94 173.27 1f90 s SER 68 N -2.78 -0.82 -0.10 4.50 0.15 -0.58 -4.92 113.70 109.15 1f90 s SER 68 Ca 0.28 1.40 0.01 0.00 0.70 0.00 0.00 55.95 58.35 1f90 s SER 68 Cb -0.10 1.33 0.02 0.00 -1.71 0.00 0.00 66.02 65.55 1f90 s SER 68 CO 0.20 -0.23 -0.14 -0.63 1.20 0.00 0.00 173.24 173.64 1f90 s ILE 69 N 1.13 1.37 0.38 6.45 1.01 -1.26 -0.91 121.20 129.37 1f90 s ILE 69 Ca -0.06 -0.56 0.04 0.00 0.00 0.00 0.00 60.65 60.06 1f90 s ILE 69 Cb -0.05 -1.27 -0.01 0.00 0.01 0.00 0.00 42.46 41.13 1f90 s ILE 69 CO -0.11 0.42 0.14 0.35 0.00 0.00 0.00 174.94 175.73 1f90 n THR 70 N 4.28 0.00 -3.86 2.92 -2.24 -0.78 -4.95 114.28 109.64 1f90 n THR 70 Ca -0.19 -2.20 -0.09 0.00 -2.27 0.00 0.00 64.05 59.30 1f90 n THR 70 Cb 0.51 0.79 -0.05 0.00 -2.10 0.00 0.00 70.33 69.48 1f90 n THR 70 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1f90 s ARG 71 N -3.44 1.38 -0.43 -0.78 1.70 -1.26 0.58 118.95 116.70 1f90 s ARG 71 Ca 0.19 -1.04 0.02 0.00 -0.47 0.00 0.00 55.73 54.43 1f90 s ARG 71 Cb 0.01 0.47 0.14 0.00 -0.57 0.00 0.00 34.95 35.00 1f90 s ARG 71 CO 0.14 -0.57 0.23 0.34 -1.08 0.00 0.00 175.30 174.36 1f90 s ASP 72 N -2.93 3.60 0.56 -2.89 -1.08 0.12 -4.95 116.67 109.09 1f90 s ASP 72 Ca 0.14 -2.58 0.35 0.00 -0.52 0.00 0.00 52.55 49.95 1f90 s ASP 72 Cb 0.00 -0.99 1.93 0.00 -1.46 0.00 0.00 42.92 42.41 1f90 s ASP 72 CO 0.01 -0.27 2.08 0.71 0.52 0.00 0.00 175.17 178.22 1f90 h THR 73 N 5.24 0.00 0.04 1.71 1.35 -1.96 0.93 112.91 120.23 1f90 h THR 73 Ca -0.01 0.00 -0.15 0.00 -0.55 0.00 0.00 66.41 65.71 1f90 h THR 73 Cb 0.93 0.79 0.01 0.00 -1.73 0.00 0.00 68.15 68.15 1f90 h THR 73 CO 0.47 0.00 -0.60 0.77 -0.25 0.00 0.00 175.52 175.90 1f90 h SER 74 N 0.00 0.46 -0.28 5.36 4.64 -1.94 -3.22 113.55 118.56 1f90 h SER 74 Ca 0.00 -0.83 0.00 0.00 -0.47 0.00 0.00 61.79 60.49 1f90 h SER 74 Cb 0.09 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1f90 h SER 74 CO 0.00 1.24 0.00 0.29 -0.87 0.00 0.00 176.83 177.49 1f90 n LYS 75 N -4.24 1.90 -3.80 4.77 5.02 -0.84 -4.96 118.16 116.01 1f90 n LYS 75 Ca -0.11 -1.37 -0.36 0.00 -2.02 0.00 0.00 58.31 54.44 1f90 n LYS 75 Cb 0.69 -1.38 0.04 0.00 -0.02 0.00 0.00 35.03 34.36 1f90 n LYS 75 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1f90 n ASN 76 N 0.60 -4.87 -3.73 4.39 5.15 0.26 -4.79 115.26 112.27 1f90 n ASN 76 Ca 0.16 -1.10 -0.12 0.00 -0.60 0.00 0.00 54.58 52.91 1f90 n ASN 76 Cb 0.37 -2.88 -0.07 0.00 -0.53 0.00 0.00 39.78 36.66 1f90 n ASN 76 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1f90 s GLN 77 N -6.41 0.82 0.15 1.20 -2.07 -1.08 -2.35 119.66 109.91 1f90 s GLN 77 Ca 0.47 -0.41 0.08 0.00 -1.82 0.00 0.00 55.36 53.68 1f90 s GLN 77 Cb -0.20 0.36 -0.04 0.00 -1.09 0.00 0.00 33.01 32.04 1f90 s GLN 77 CO 0.89 -0.26 -0.19 -0.59 -1.32 0.00 0.00 175.29 173.83 1f90 s PHE 78 N -2.33 1.78 0.27 9.60 -0.71 -0.92 0.13 117.98 125.81 1f90 s PHE 78 Ca -0.06 -0.46 0.12 0.00 -1.04 0.00 0.00 56.93 55.48 1f90 s PHE 78 Cb -0.01 -0.91 -0.05 0.00 -1.21 0.00 0.00 43.02 40.83 1f90 s PHE 78 CO -0.02 0.29 -0.20 -0.06 -1.34 0.00 0.00 175.22 173.89 1f90 s PHE 79 N -1.83 2.30 -0.07 3.49 0.08 0.20 -1.41 117.98 120.74 1f90 s PHE 79 Ca 0.13 -0.33 0.04 0.00 0.12 0.00 0.00 56.93 56.88 1f90 s PHE 79 Cb -0.07 -1.00 0.00 0.00 -0.57 0.00 0.00 43.02 41.38 1f90 s PHE 79 CO 0.06 0.70 -0.18 -1.17 -0.10 0.00 0.00 175.22 174.54 1f90 s LEU 80 N -3.46 1.87 -0.15 -0.37 2.96 -0.28 -1.87 118.68 117.38 1f90 s LEU 80 Ca 0.29 -0.40 -0.00 0.00 -0.22 0.00 0.00 54.13 53.81 1f90 s LEU 80 Cb -0.05 -1.06 0.03 0.00 0.50 0.00 0.00 46.19 45.61 1f90 s LEU 80 CO 0.15 0.12 -0.09 -1.58 -1.32 0.00 0.00 176.35 173.62 1f90 s GLN 81 N 0.33 1.81 -0.19 1.98 0.74 -0.08 -1.18 119.66 123.07 1f90 s GLN 81 Ca -0.12 -0.50 -0.01 0.00 0.05 0.00 0.00 55.36 54.79 1f90 s GLN 81 Cb -0.15 -1.97 0.01 0.00 1.10 0.00 0.00 33.01 32.00 1f90 s GLN 81 CO 0.05 -0.32 -0.14 -1.17 -0.55 0.00 0.00 175.29 173.15 1f90 s LEU 82 N 1.58 2.42 0.14 3.68 2.96 -0.64 -1.52 118.68 127.29 1f90 s LEU 82 Ca 0.03 -0.54 0.03 0.00 -0.22 0.00 0.00 54.13 53.43 1f90 s LEU 82 Cb -0.14 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 44.94 1f90 s LEU 82 CO -0.09 0.01 0.24 0.20 -1.32 0.00 0.00 176.35 175.39 1f90 s ASN 82 N 1.27 6.16 -1.24 3.68 0.01 -0.36 0.99 114.94 125.43 1f90 s ASN 82 Ca 0.03 0.12 -0.00 0.00 -0.71 0.00 0.00 52.86 52.30 1f90 s ASN 82 Cb -0.14 -1.81 0.00 0.00 0.41 0.00 0.00 41.25 39.71 1f90 s ASN 82 CO -0.08 0.07 0.90 -1.20 -1.51 0.00 0.00 177.10 175.29 1f90 n SER 82 N -0.40 -1.89 -4.73 -1.22 7.64 -1.09 -4.85 113.62 107.08 1f90 n SER 82 Ca -0.07 -0.69 -0.31 0.00 1.01 0.00 0.00 58.87 58.82 1f90 n SER 82 Cb 0.54 -4.76 0.12 0.00 -1.01 0.00 0.00 64.21 59.11 1f90 n SER 82 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1f90 s VAL 82 N -3.46 2.86 0.24 0.44 -7.23 -0.28 -4.66 120.40 108.31 1f90 s VAL 82 Ca 0.02 0.28 -0.01 0.00 -1.81 0.00 0.00 61.98 60.46 1f90 s VAL 82 Cb -0.01 -2.63 -0.03 0.00 0.56 0.00 0.00 36.38 34.27 1f90 s VAL 82 CO 0.76 -0.36 0.24 0.42 -0.31 0.00 0.00 175.10 175.84 1f90 s THR 83 N -2.83 0.00 0.07 5.32 -4.23 -1.26 0.45 115.64 113.16 1f90 s THR 83 Ca 0.63 -1.88 0.30 0.00 -1.18 0.00 0.00 61.69 59.56 1f90 s THR 83 Cb -0.19 -2.47 0.30 0.00 1.34 0.00 0.00 72.50 71.48 1f90 s THR 83 CO 0.57 0.00 1.92 0.71 -0.54 0.00 0.00 174.62 177.28 1f90 h THR 84 N 2.43 0.00 0.00 3.99 1.35 -1.95 0.11 112.91 118.84 1f90 h THR 84 Ca -0.32 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1f90 h THR 84 Cb 1.25 0.76 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 1f90 h THR 84 CO 0.46 0.00 0.00 -0.33 -0.25 0.00 0.00 175.52 175.40 1f90 h GLU 85 N 0.00 0.00 -0.00 4.72 5.08 -1.95 -2.53 114.58 119.89 1f90 h GLU 85 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1f90 h GLU 85 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1f90 h GLU 85 CO 0.00 0.00 -0.01 -0.25 -1.00 0.00 0.00 179.01 177.75 1f90 n ASP 86 N -2.88 0.35 -4.75 1.42 8.00 0.40 -4.84 116.55 114.25 1f90 n ASP 86 Ca 0.02 -1.02 -0.41 0.00 0.71 0.00 0.00 54.79 54.09 1f90 n ASP 86 Cb 0.38 -0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.44 1f90 n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1f90 s THR 87 N -2.07 2.38 0.00 -3.53 2.01 -0.95 -4.85 115.64 108.62 1f90 s THR 87 Ca 0.43 0.33 0.00 0.00 0.31 0.00 0.00 61.69 62.76 1f90 s THR 87 Cb 0.22 -3.21 0.00 0.00 0.01 0.00 0.00 72.50 69.52 1f90 s THR 87 CO 0.38 0.06 0.00 0.00 -0.69 0.00 0.00 174.62 174.36 1f90 n ALA 88 N 2.06 0.00 -2.66 7.40 0.00 -0.64 -4.74 120.51 121.93 1f90 n ALA 88 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.13 1f90 n ALA 88 Cb 0.39 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.76 1f90 n ALA 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1f90 s THR 89 N -2.00 5.23 -0.21 0.00 2.01 0.39 -1.44 115.64 119.62 1f90 s THR 89 Ca 0.00 0.59 -0.08 0.00 0.31 0.00 0.00 61.69 62.51 1f90 s THR 89 Cb 0.00 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.79 1f90 s THR 89 CO 0.00 0.26 0.09 -0.31 -0.69 0.00 0.00 174.62 173.97 1f90 s TYR 90 N 1.34 3.23 0.05 4.92 1.51 0.74 0.58 117.35 129.73 1f90 s TYR 90 Ca 0.16 0.01 0.09 0.00 -1.01 0.00 0.00 57.07 56.33 1f90 s TYR 90 Cb -0.15 -2.16 -0.03 0.00 -0.11 0.00 0.00 41.96 39.52 1f90 s TYR 90 CO 0.07 0.03 -0.25 0.71 -1.11 0.00 0.00 175.55 175.01 1f90 s TYR 91 N 0.79 2.37 -0.06 2.71 2.02 0.21 -0.95 117.35 124.45 1f90 s TYR 91 Ca 0.05 -0.38 0.03 0.00 -0.37 0.00 0.00 57.07 56.40 1f90 s TYR 91 Cb -0.13 -1.39 -0.03 0.00 -0.40 0.00 0.00 41.96 40.01 1f90 s TYR 91 CO 0.02 0.18 -0.12 0.00 -1.57 0.00 0.00 175.55 174.05 1f90 s ALA 93 N -0.68 -0.20 -0.04 0.00 0.00 -0.93 -1.25 121.76 118.66 1f90 s ALA 93 Ca 0.10 -0.46 0.03 0.00 0.00 0.00 0.00 51.96 51.63 1f90 s ALA 93 Cb -0.11 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.31 1f90 s ALA 93 CO 0.01 -0.37 -0.14 0.45 0.00 0.00 0.00 175.76 175.71 1f90 s SER 94 N -2.24 1.82 -0.06 0.00 0.15 0.26 -0.53 113.70 113.09 1f90 s SER 94 Ca -0.03 -0.30 -0.32 0.00 0.70 0.00 0.00 55.95 56.01 1f90 s SER 94 Cb 0.00 -0.57 0.12 0.00 -1.71 0.00 0.00 66.02 63.86 1f90 s SER 94 CO -0.05 0.10 1.25 -0.72 1.20 0.00 0.00 173.24 175.02 1f90 s TYR 95 N 0.22 -0.07 0.00 3.44 -0.85 -1.13 -1.04 117.35 117.91 1f90 s TYR 95 Ca -0.06 -0.02 0.00 0.00 -0.52 0.00 0.00 57.07 56.47 1f90 s TYR 95 Cb -0.12 0.54 0.00 0.00 0.38 0.00 0.00 41.96 42.76 1f90 s TYR 95 CO 0.02 -0.27 0.40 -0.40 -1.52 0.00 0.00 175.55 173.77 1f90 n ASP 96 N -0.36 0.73 0.00 -0.18 5.68 -1.25 -3.03 116.55 118.13 1f90 n ASP 96 Ca -0.06 -1.11 0.00 0.00 -0.50 0.00 0.00 54.79 53.13 1f90 n ASP 96 Cb 0.61 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.59 1f90 n ASP 96 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1f90 n ASP 97 N -0.05 0.00 0.00 -1.12 8.00 -1.26 -4.73 116.55 117.38 1f90 n ASP 97 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1f90 n ASP 97 Cb 0.14 -0.76 0.00 0.00 -0.02 0.00 0.00 41.12 40.48 1f90 n ASP 97 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1f90 n TYR 98 N -2.00 0.00 -4.62 1.24 4.11 -1.26 -5.10 117.16 109.52 1f90 n TYR 98 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.90 57.58 1f90 n TYR 98 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.27 1f90 n TYR 98 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.86 177.81 1f90 s THR 99 N -0.37 1.25 0.39 -3.48 -4.23 -1.26 -5.04 115.64 102.90 1f90 s THR 99 Ca 0.00 -1.92 0.33 0.00 -1.18 0.00 0.00 61.69 58.92 1f90 s THR 99 Cb 0.00 -2.17 0.35 0.00 1.34 0.00 0.00 72.50 72.02 1f90 s THR 99 CO 0.00 0.00 2.12 4.11 -0.54 0.00 0.00 174.62 180.31 1f90 h TRP 100 N 1.27 0.00 -2.50 3.99 5.08 -2.02 -3.45 115.95 118.32 1f90 h TRP 100 Ca -0.43 0.00 -0.57 0.00 1.08 0.00 0.00 58.89 58.97 1f90 h TRP 100 Cb 1.31 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 27.46 1f90 h TRP 100 CO 1.43 0.06 1.28 0.12 -1.28 0.00 0.00 178.44 180.05 1f90 s PHE 100 N -4.05 1.68 -0.25 0.12 2.19 -1.26 -4.96 117.98 111.46 1f90 s PHE 100 Ca -0.02 0.46 -0.06 0.00 0.33 0.00 0.00 56.93 57.64 1f90 s PHE 100 Cb 0.12 -4.05 0.12 0.00 -1.31 0.00 0.00 43.02 37.90 1f90 s PHE 100 CO 0.53 -3.51 0.50 -0.08 1.83 0.00 0.00 175.22 174.50 1f90 s THR 101 N 6.47 -0.78 -0.03 0.12 -1.32 -1.26 -3.93 115.64 114.92 1f90 s THR 101 Ca 0.83 0.06 -0.01 0.00 -1.21 0.00 0.00 61.69 61.37 1f90 s THR 101 Cb -0.28 -0.82 0.03 0.00 -1.51 0.00 0.00 72.50 69.92 1f90 s THR 101 CO 0.34 0.01 0.06 -0.31 -2.21 0.00 0.00 174.62 172.51 1f90 s TYR 102 N 2.71 -0.04 0.20 9.09 2.02 -0.21 -5.00 117.35 126.13 1f90 s TYR 102 Ca 0.02 0.22 0.08 0.00 -0.37 0.00 0.00 57.07 57.02 1f90 s TYR 102 Cb -0.13 -0.15 -0.04 0.00 -0.40 0.00 0.00 41.96 41.24 1f90 s TYR 102 CO -0.16 -0.10 0.00 -1.58 -1.57 0.00 0.00 175.55 172.14 1f90 s TRP 103 N 0.91 2.81 0.00 2.71 0.52 -1.26 -0.58 118.94 124.05 1f90 s TRP 103 Ca -0.07 -0.16 0.00 0.00 0.02 0.00 0.00 56.10 55.88 1f90 s TRP 103 Cb -0.10 -1.33 0.00 0.00 -1.15 0.00 0.00 33.47 30.89 1f90 s TRP 103 CO -0.03 0.54 0.00 0.41 0.02 0.00 0.00 176.95 177.89 1f90 n GLY 104 N -0.34 0.17 0.06 0.98 0.00 -0.38 -4.71 105.19 100.97 1f90 n GLY 104 Ca -0.09 -1.85 0.11 0.00 0.00 0.00 0.00 46.02 44.20 1f90 n GLY 104 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1f90 n GLN 105 N -0.83 0.39 0.00 1.61 6.02 -1.26 -4.90 117.38 118.41 1f90 n GLN 105 Ca 0.00 0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 1f90 n GLN 105 Cb 0.00 -1.67 0.00 0.00 1.02 0.00 0.00 30.24 29.59 1f90 n GLN 105 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1f90 n GLY 106 N 1.31 -2.59 3.18 1.08 0.00 -1.26 -5.02 105.19 101.88 1f90 n GLY 106 Ca 0.01 -1.35 -0.23 0.00 0.00 0.00 0.00 46.02 44.45 1f90 n GLY 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1f90 s THR 107 N -3.72 1.36 -0.14 2.61 -4.23 -0.12 -4.91 115.64 106.49 1f90 s THR 107 Ca 0.00 -0.92 -0.25 0.00 -1.18 0.00 0.00 61.69 59.33 1f90 s THR 107 Cb 0.00 -1.17 -0.02 0.00 1.34 0.00 0.00 72.50 72.65 1f90 s THR 107 CO 0.00 0.23 0.82 -0.22 -0.54 0.00 0.00 174.62 174.91 1f90 s LEU 108 N -0.81 4.21 -0.23 4.79 2.96 -1.26 -0.18 118.68 128.16 1f90 s LEU 108 Ca 0.05 1.21 0.01 0.00 -0.22 0.00 0.00 54.13 55.19 1f90 s LEU 108 Cb -0.07 -3.24 0.06 0.00 0.50 0.00 0.00 46.19 43.43 1f90 s LEU 108 CO 0.01 -0.35 -0.07 -0.69 -1.32 0.00 0.00 176.35 173.93 1f90 s VAL 109 N 1.87 1.59 -0.14 1.68 1.01 -0.52 -4.53 120.40 121.36 1f90 s VAL 109 Ca 0.39 -1.21 -0.04 0.00 0.00 0.00 0.00 61.98 61.13 1f90 s VAL 109 Cb -0.17 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 1f90 s VAL 109 CO 0.14 -0.05 -0.00 0.28 0.00 0.00 0.00 175.10 175.48 1f90 s THR 110 N 1.38 4.24 -0.33 3.92 -1.32 -0.77 -1.61 115.64 121.15 1f90 s THR 110 Ca -0.05 -0.25 -0.11 0.00 -1.21 0.00 0.00 61.69 60.08 1f90 s THR 110 Cb -0.18 -2.85 -0.00 0.00 -1.51 0.00 0.00 72.50 67.96 1f90 s THR 110 CO -0.06 0.52 0.18 -0.69 -2.21 0.00 0.00 174.62 172.36 1f90 s VAL 111 N -0.04 4.73 -0.18 5.08 1.01 -1.26 -2.06 120.40 127.69 1f90 s VAL 111 Ca 0.03 -0.47 -0.28 0.00 0.00 0.00 0.00 61.98 61.26 1f90 s VAL 111 Cb -0.13 -3.47 0.09 0.00 0.00 0.00 0.00 36.38 32.88 1f90 s VAL 111 CO 0.02 -0.01 0.83 -0.55 0.00 0.00 0.00 175.10 175.39 1f90 s SER 112 N 1.62 -0.58 0.30 3.32 0.15 -1.02 -4.14 113.70 113.35 1f90 s SER 112 Ca 0.04 0.87 0.26 0.00 0.70 0.00 0.00 55.95 57.82 1f90 s SER 112 Cb -0.18 0.79 0.89 0.00 -1.71 0.00 0.00 66.02 65.82 1f90 s SER 112 CO 0.07 -0.37 1.76 0.00 1.20 0.00 0.00 173.24 175.90 1f90 h ALA 113 N 3.65 1.00 -2.36 5.45 0.00 -1.95 -3.38 119.26 121.67 1f90 h ALA 113 Ca -0.26 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.10 1f90 h ALA 113 Cb 1.16 0.00 0.20 0.00 0.00 0.00 0.00 17.79 19.14 1f90 h ALA 113 CO 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 179.25 179.09 1f90 n ALA 114 N -1.86 -1.77 -2.72 0.00 0.00 -1.26 -4.98 120.51 107.92 1f90 n ALA 114 Ca 0.03 -0.39 -0.34 0.00 0.00 0.00 0.00 53.44 52.75 1f90 n ALA 114 Cb 0.35 -1.87 -0.05 0.00 0.00 0.00 0.00 19.45 17.88 1f90 n ALA 114 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1f90 s LYS 115 N -3.23 3.61 0.27 0.00 2.20 -1.26 -5.04 119.74 116.29 1f90 s LYS 115 Ca 0.63 -0.06 -0.30 0.00 -0.36 0.00 0.00 55.97 55.88 1f90 s LYS 115 Cb -0.29 -3.01 -0.10 0.00 -1.51 0.00 0.00 37.83 32.92 1f90 s LYS 115 CO 0.61 0.59 1.36 0.99 -0.36 0.00 0.00 175.35 178.53 1f90 s THR 116 N -1.42 2.82 -0.10 3.43 2.01 -1.26 -4.79 115.64 116.33 1f90 s THR 116 Ca 0.32 0.73 -0.06 0.00 0.31 0.00 0.00 61.69 62.99 1f90 s THR 116 Cb -0.13 -3.46 0.04 0.00 0.01 0.00 0.00 72.50 68.96 1f90 s THR 116 CO 0.19 0.13 0.25 0.28 -0.69 0.00 0.00 174.62 174.79 1f90 s THR 117 N -0.38 -0.03 0.84 -0.82 -1.32 0.11 -4.97 115.64 109.06 1f90 s THR 117 Ca 0.55 0.12 -0.14 0.00 -1.21 0.00 0.00 61.69 61.01 1f90 s THR 117 Cb -0.40 -0.38 0.05 0.00 -1.51 0.00 0.00 72.50 70.26 1f90 s THR 117 CO 0.45 0.05 0.82 -2.65 -2.21 0.00 0.00 174.62 171.08 1f90 n PRO 118 N 3.98 0.03 -3.53 7.08 -0.02 -1.26 -2.04 135.00 139.23 1f90 n PRO 118 Ca -0.23 0.07 -0.34 0.00 -2.02 0.00 0.00 63.50 60.99 1f90 n PRO 118 Cb 0.54 -2.12 -0.05 0.00 -0.02 0.00 0.00 33.50 31.84 1f90 n PRO 118 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1f90 s PRO 119 N -3.69 3.77 -0.19 0.52 0.04 -1.26 -4.43 135.00 129.76 1f90 s PRO 119 Ca 0.66 0.18 -0.11 0.00 0.04 0.00 0.00 61.00 61.78 1f90 s PRO 119 Cb -0.28 -2.89 -0.05 0.00 0.04 0.00 0.00 34.50 31.32 1f90 s PRO 119 CO 0.58 0.48 0.17 -1.54 0.04 0.00 0.00 177.00 176.73 1f90 s SER 120 N -2.01 6.27 -0.17 6.66 1.04 -0.58 -4.92 113.70 119.98 1f90 s SER 120 Ca 0.38 0.30 -0.02 0.00 0.48 0.00 0.00 55.95 57.09 1f90 s SER 120 Cb -0.13 -2.11 -0.01 0.00 0.10 0.00 0.00 66.02 63.86 1f90 s SER 120 CO 0.20 0.17 -0.08 -0.69 0.98 0.00 0.00 173.24 173.83 1f90 s VAL 121 N 0.32 3.34 0.02 5.02 1.01 -1.26 -0.05 120.40 128.80 1f90 s VAL 121 Ca 0.10 -0.53 0.08 0.00 0.00 0.00 0.00 61.98 61.63 1f90 s VAL 121 Cb -0.11 -2.47 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 1f90 s VAL 121 CO -0.00 0.48 -0.25 -0.36 0.00 0.00 0.00 175.10 174.96 1f90 s PHE 122 N 0.85 2.20 0.18 5.22 0.08 0.07 -4.99 117.98 121.59 1f90 s PHE 122 Ca -0.02 -0.41 -0.24 0.00 0.12 0.00 0.00 56.93 56.38 1f90 s PHE 122 Cb -0.15 -1.36 -0.08 0.00 -0.57 0.00 0.00 43.02 40.86 1f90 s PHE 122 CO 0.01 0.05 0.78 -1.25 -0.10 0.00 0.00 175.22 174.71 1f90 s PRO 123 N -0.94 4.51 -0.45 0.24 0.04 -1.26 -1.47 135.00 135.68 1f90 s PRO 123 Ca 0.10 1.12 -0.01 0.00 0.04 0.00 0.00 61.00 62.24 1f90 s PRO 123 Cb -0.10 -3.17 0.12 0.00 0.04 0.00 0.00 34.50 31.40 1f90 s PRO 123 CO 0.01 0.52 0.23 -0.51 0.04 0.00 0.00 177.00 177.29 1f90 s LEU 124 N -1.35 5.13 -0.02 -3.56 1.43 0.16 -4.91 118.68 115.56 1f90 s LEU 124 Ca 0.38 -2.27 -0.02 0.00 -1.03 0.00 0.00 54.13 51.19 1f90 s LEU 124 Cb -0.22 -1.79 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 1f90 s LEU 124 CO 0.25 -0.47 0.15 0.00 0.23 0.00 0.00 176.35 176.51 1f90 s ALA 125 N 0.79 3.85 0.26 4.21 0.00 -1.26 -1.09 121.76 128.52 1f90 s ALA 125 Ca 0.11 -0.78 -0.31 0.00 0.00 0.00 0.00 51.96 50.98 1f90 s ALA 125 Cb -0.22 -1.81 -0.12 0.00 0.00 0.00 0.00 23.12 20.97 1f90 s ALA 125 CO -0.04 0.72 1.66 -1.25 0.00 0.00 0.00 175.76 176.85 1f90 s PRO 126 N -1.81 4.11 -1.09 0.00 0.04 -1.26 -4.91 135.00 130.09 1f90 s PRO 126 Ca 0.25 2.61 -0.14 0.00 0.04 0.00 0.00 61.00 63.76 1f90 s PRO 126 Cb -0.12 -3.04 0.18 0.00 0.04 0.00 0.00 34.50 31.56 1f90 s PRO 126 CO 0.16 -0.70 1.25 0.20 0.04 0.00 0.00 177.00 177.95 1f90 s GLY 127 N 0.80 2.43 0.00 0.56 0.00 -1.26 -4.27 107.32 105.58 1f90 s GLY 127 Ca 0.69 -3.27 0.00 0.00 0.00 0.00 0.00 44.72 42.13 1f90 s GLY 127 CO 0.41 1.87 0.00 1.44 0.00 0.00 0.00 173.10 176.82 1f90 n SER 128 N 5.31 0.00 0.00 1.64 7.64 -1.23 -4.98 113.62 122.00 1f90 n SER 128 Ca 0.29 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.17 1f90 n SER 128 Cb 0.44 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 1f90 n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1f90 n ALA 129 N 0.00 0.00 -3.60 -0.43 0.00 -1.26 -4.63 120.51 110.59 1f90 n ALA 129 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1f90 n ALA 129 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 1f90 n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f90 s ALA 130 N -1.21 -0.29 -0.17 0.00 0.00 -1.26 -5.04 121.76 113.79 1f90 s ALA 130 Ca 0.00 0.64 -0.16 0.00 0.00 0.00 0.00 51.96 52.44 1f90 s ALA 130 Cb 0.00 -0.42 -0.22 0.00 0.00 0.00 0.00 23.12 22.48 1f90 s ALA 130 CO 0.00 -0.14 0.27 1.04 0.00 0.00 0.00 175.76 176.93 1f90 n GLN 133 N 3.98 0.64 -2.11 0.00 3.00 -1.26 -4.34 117.38 117.29 1f90 n GLN 133 Ca -0.24 0.45 -0.41 0.00 -0.01 0.00 0.00 57.00 56.79 1f90 n GLN 133 Cb 0.53 -1.73 -0.00 0.00 0.00 0.00 0.00 30.24 29.04 1f90 n GLN 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 1f90 n THR 134 N -4.06 4.98 -4.13 5.09 -1.04 -1.26 -4.74 114.28 109.13 1f90 n THR 134 Ca -0.32 -4.37 -0.11 0.00 -2.04 0.00 0.00 64.05 57.20 1f90 n THR 134 Cb 0.83 -2.16 -0.10 0.00 -1.82 0.00 0.00 70.33 67.08 1f90 n THR 134 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1f90 s ASN 135 N 0.47 1.02 0.06 8.00 2.47 -1.26 -5.08 114.94 120.62 1f90 s ASN 135 Ca 0.49 -0.86 -0.16 0.00 0.42 0.00 0.00 52.86 52.76 1f90 s ASN 135 Cb 0.16 0.08 -0.06 0.00 -1.45 0.00 0.00 41.25 39.98 1f90 s ASN 135 CO -0.06 -0.39 1.26 0.77 -3.72 0.00 0.00 177.10 174.96 1f90 h SER 136 N 3.48 -0.84 -1.43 -4.21 4.64 -1.94 -3.30 113.55 109.94 1f90 h SER 136 Ca -0.35 0.11 -0.64 0.00 -0.47 0.00 0.00 61.79 60.44 1f90 h SER 136 Cb 1.18 0.34 -0.13 0.00 -0.31 0.00 0.00 62.40 63.47 1f90 h SER 136 CO 0.57 -0.20 -0.58 -0.04 -0.87 0.00 0.00 176.83 175.70 1f90 s MET 137 N -4.24 2.00 -0.14 4.77 -1.94 -1.26 -2.72 119.30 115.77 1f90 s MET 137 Ca -0.07 -2.17 -0.07 0.00 -1.71 0.00 0.00 55.69 51.67 1f90 s MET 137 Cb 0.04 -1.58 0.05 0.00 2.01 0.00 0.00 34.83 35.35 1f90 s MET 137 CO 0.28 -0.13 0.32 0.08 -0.01 0.00 0.00 175.02 175.57 1f90 s VAL 138 N -2.77 -0.03 -0.17 -6.03 1.01 0.08 -4.60 120.40 107.89 1f90 s VAL 138 Ca 0.28 0.12 -0.07 0.00 0.00 0.00 0.00 61.98 62.31 1f90 s VAL 138 Cb 0.08 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 1f90 s VAL 138 CO 0.14 0.05 0.05 0.42 0.00 0.00 0.00 175.10 175.76 1f90 s THR 139 N 1.28 4.71 0.42 3.92 -4.23 -1.26 -0.71 115.64 119.77 1f90 s THR 139 Ca -0.09 -0.07 0.03 0.00 -1.18 0.00 0.00 61.69 60.38 1f90 s THR 139 Cb -0.09 -3.10 0.03 0.00 1.34 0.00 0.00 72.50 70.67 1f90 s THR 139 CO -0.10 0.49 0.23 0.18 -0.54 0.00 0.00 174.62 174.87 1f90 n LEU 140 N 3.31 0.00 -3.60 4.79 4.77 0.22 -4.52 117.00 121.97 1f90 n LEU 140 Ca -0.17 -2.29 -0.08 0.00 -0.03 0.00 0.00 56.01 53.44 1f90 n LEU 140 Cb 0.52 0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.65 1f90 n LEU 140 CO 0.34 -0.47 0.58 -0.83 -1.33 0.00 0.00 177.39 175.68 1f90 s GLY 141 N -3.50 -0.39 -0.05 -0.72 0.00 -0.25 -2.67 107.32 99.76 1f90 s GLY 141 Ca 0.17 0.42 -0.02 0.00 0.00 0.00 0.00 44.72 45.30 1f90 s GLY 141 CO 0.11 0.13 0.09 0.00 0.00 0.00 0.00 173.10 173.43 1f90 s LEU 143 N 1.48 3.27 -0.50 0.00 2.96 -0.54 -1.57 118.68 123.79 1f90 s LEU 143 Ca -0.05 -0.18 -0.03 0.00 -0.22 0.00 0.00 54.13 53.65 1f90 s LEU 143 Cb -0.12 -1.82 0.13 0.00 0.50 0.00 0.00 46.19 44.88 1f90 s LEU 143 CO -0.04 0.09 0.30 -0.69 -1.32 0.00 0.00 176.35 174.69 1f90 s VAL 144 N 0.85 3.50 0.12 1.68 1.01 0.11 -0.75 120.40 126.92 1f90 s VAL 144 Ca 0.00 -2.40 -0.13 0.00 0.00 0.00 0.00 61.98 59.46 1f90 s VAL 144 Cb -0.14 -3.35 -0.07 0.00 0.00 0.00 0.00 36.38 32.82 1f90 s VAL 144 CO 0.02 -0.77 0.50 -0.75 0.00 0.00 0.00 175.10 174.10 1f90 s LYS 145 N 0.68 3.93 -0.56 2.72 2.47 0.93 -1.39 119.74 128.52 1f90 s LYS 145 Ca 0.11 0.41 -0.07 0.00 -1.56 0.00 0.00 55.97 54.86 1f90 s LYS 145 Cb -0.22 -2.97 0.01 0.00 -1.46 0.00 0.00 37.83 33.19 1f90 s LYS 145 CO -0.04 0.52 0.47 0.41 0.16 0.00 0.00 175.35 176.87 1f90 n GLY 146 N 0.91 -0.72 3.61 5.54 0.00 -0.31 -1.53 105.19 112.70 1f90 n GLY 146 Ca -0.07 0.56 -0.28 0.00 0.00 0.00 0.00 46.02 46.24 1f90 n GLY 146 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1f90 s TYR 147 N -2.35 2.33 -0.29 1.61 1.13 -0.72 -4.59 117.35 114.47 1f90 s TYR 147 Ca 0.07 -0.77 -0.22 0.00 -1.41 0.00 0.00 57.07 54.74 1f90 s TYR 147 Cb -0.01 -1.66 0.15 0.00 -1.10 0.00 0.00 41.96 39.33 1f90 s TYR 147 CO 0.68 0.33 1.11 0.12 -2.51 0.00 0.00 175.55 175.28 1f90 s PHE 148 N -2.84 -0.40 0.00 -3.49 5.36 -0.87 0.18 117.98 115.93 1f90 s PHE 148 Ca 0.31 0.91 0.00 0.00 -0.96 0.00 0.00 56.93 57.19 1f90 s PHE 148 Cb 0.08 0.36 0.00 0.00 -0.34 0.00 0.00 43.02 43.13 1f90 s PHE 148 CO 0.15 -0.19 0.00 -0.35 -1.46 0.00 0.00 175.22 173.37 1f90 n PRO 149 N 2.50 2.53 -2.51 10.12 -0.04 -1.26 -0.71 135.00 145.62 1f90 n PRO 149 Ca -0.14 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.05 1f90 n PRO 149 Cb 0.56 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.04 1f90 n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1f90 s GLU 150 N 2.26 3.25 0.51 0.54 0.41 -1.26 -4.78 118.70 119.63 1f90 s GLU 150 Ca 0.00 0.11 0.09 0.00 -0.41 0.00 0.00 54.97 54.75 1f90 s GLU 150 Cb 0.00 -2.32 0.05 0.00 -1.78 0.00 0.00 34.13 30.07 1f90 s GLU 150 CO 0.00 -0.44 0.66 -1.25 -0.49 0.00 0.00 175.26 173.74 1f90 s PRO 151 N -4.86 2.51 0.10 0.39 0.04 -1.26 -4.94 135.00 126.98 1f90 s PRO 151 Ca 0.51 -1.51 0.08 0.00 0.04 0.00 0.00 61.00 60.12 1f90 s PRO 151 Cb -0.10 -2.64 -0.03 0.00 0.04 0.00 0.00 34.50 31.76 1f90 s PRO 151 CO 0.45 -0.59 -0.20 0.08 0.04 0.00 0.00 177.00 176.78 1f90 s VAL 152 N -2.54 1.66 -0.06 -0.36 1.01 -1.26 -4.46 120.40 114.39 1f90 s VAL 152 Ca 0.57 -1.56 0.06 0.00 0.00 0.00 0.00 61.98 61.05 1f90 s VAL 152 Cb -0.07 -1.54 -0.01 0.00 0.00 0.00 0.00 36.38 34.76 1f90 s VAL 152 CO 0.35 -0.10 -0.25 -0.89 0.00 0.00 0.00 175.10 174.21 1f90 s THR 153 N -1.26 2.10 -0.05 3.92 2.01 -0.84 -4.97 115.64 116.55 1f90 s THR 153 Ca 0.06 -1.05 0.01 0.00 0.31 0.00 0.00 61.69 61.02 1f90 s THR 153 Cb -0.10 -1.76 0.02 0.00 0.01 0.00 0.00 72.50 70.68 1f90 s THR 153 CO 0.04 0.57 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.80 1f90 s VAL 154 N -0.20 0.62 0.03 3.82 1.01 -1.26 -1.20 120.40 123.21 1f90 s VAL 154 Ca -0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 1f90 s VAL 154 Cb -0.13 -0.63 -0.02 0.00 0.00 0.00 0.00 36.38 35.59 1f90 s VAL 154 CO 0.03 0.25 -0.00 0.42 0.00 0.00 0.00 175.10 175.80 1f90 s THR 156 N 0.94 0.13 -0.21 3.92 -4.23 0.02 -5.01 115.64 111.21 1f90 s THR 156 Ca -0.11 -1.10 -0.06 0.00 -1.18 0.00 0.00 61.69 59.24 1f90 s THR 156 Cb -0.14 -0.61 -0.03 0.00 1.34 0.00 0.00 72.50 73.06 1f90 s THR 156 CO 0.00 -0.61 0.02 0.26 -0.54 0.00 0.00 174.62 173.75 1f90 s TRP 157 N -2.10 3.06 -1.97 3.99 0.52 -1.26 -0.53 118.94 120.65 1f90 s TRP 157 Ca -0.10 -0.41 0.00 0.00 0.02 0.00 0.00 56.10 55.61 1f90 s TRP 157 Cb -0.05 -2.11 0.00 0.00 -1.15 0.00 0.00 33.47 30.16 1f90 s TRP 157 CO -0.03 -0.22 0.00 0.09 0.02 0.00 0.00 176.95 176.80 1f90 n ASN 162 N 4.29 -5.71 0.00 2.95 3.02 0.47 -2.02 115.26 118.26 1f90 n ASN 162 Ca -0.17 0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 1f90 n ASN 162 Cb 0.52 -4.86 0.00 0.00 -0.61 0.00 0.00 39.78 34.82 1f90 n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1f90 n SER 163 N -1.69 -0.84 0.00 6.41 7.64 -1.26 -3.28 113.62 120.60 1f90 n SER 163 Ca -0.23 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.65 1f90 n SER 163 Cb 0.68 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 1f90 n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1f90 n GLY 164 N -2.10 1.06 0.24 0.23 0.00 -0.86 -5.01 105.19 98.76 1f90 n GLY 164 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1f90 n GLY 164 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1f90 h SER 165 N 0.00 -0.64 -3.63 1.61 0.02 -1.53 -3.38 113.55 105.99 1f90 h SER 165 Ca 0.00 0.12 -0.62 0.00 -0.84 0.00 0.00 61.79 60.45 1f90 h SER 165 Cb 0.00 0.31 -0.13 0.00 0.14 0.00 0.00 62.40 62.72 1f90 h SER 165 CO 0.00 -0.24 -0.19 -0.76 -1.14 0.00 0.00 176.83 174.49 1f90 s LEU 166 N -10.49 4.07 0.00 5.07 1.02 -1.18 -4.89 118.68 112.28 1f90 s LEU 166 Ca -0.15 0.39 0.00 0.00 0.02 0.00 0.00 54.13 54.39 1f90 s LEU 166 Cb 0.12 -2.48 0.00 0.00 0.02 0.00 0.00 46.19 43.85 1f90 s LEU 166 CO 0.68 -0.17 0.00 -1.54 0.02 0.00 0.00 176.35 175.35 1f90 n SER 167 N 5.11 3.49 -4.76 2.29 3.41 -1.26 -4.44 113.62 117.45 1f90 n SER 167 Ca -0.08 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.14 1f90 n SER 167 Cb 0.51 0.24 -0.06 0.00 -0.26 0.00 0.00 64.21 64.64 1f90 n SER 167 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1f90 s SER 168 N -2.94 7.35 0.00 4.04 1.04 -1.26 -3.47 113.70 118.45 1f90 s SER 168 Ca 0.00 1.60 0.00 0.00 0.48 0.00 0.00 55.95 58.03 1f90 s SER 168 Cb 0.00 -2.50 0.00 0.00 0.10 0.00 0.00 66.02 63.62 1f90 s SER 168 CO 0.00 0.12 0.00 0.61 0.98 0.00 0.00 173.24 174.95 1f90 n GLY 169 N 1.92 0.65 3.60 7.32 0.00 -1.26 -4.67 105.19 112.76 1f90 n GLY 169 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 1f90 n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f90 s VAL 171 N -2.14 4.76 -0.10 1.61 1.01 -1.23 -1.05 120.40 123.25 1f90 s VAL 171 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 61.98 61.94 1f90 s VAL 171 Cb 0.00 -3.17 0.02 0.00 0.00 0.00 0.00 36.38 33.23 1f90 s VAL 171 CO 0.00 0.42 -0.08 -1.00 0.00 0.00 0.00 175.10 174.44 1f90 s HIS 172 N 0.69 1.42 -0.24 5.22 3.76 -0.09 -5.00 115.29 121.05 1f90 s HIS 172 Ca 0.04 -0.66 -0.03 0.00 -0.15 0.00 0.00 55.06 54.26 1f90 s HIS 172 Cb -0.13 -1.17 0.01 0.00 1.11 0.00 0.00 32.58 32.40 1f90 s HIS 172 CO 0.02 -0.45 -0.04 0.99 -0.85 0.00 0.00 174.74 174.40 1f90 s THR 173 N 1.51 3.20 0.28 1.30 2.01 -1.26 -0.38 115.64 122.30 1f90 s THR 173 Ca 0.01 -0.73 -0.24 0.00 0.31 0.00 0.00 61.69 61.05 1f90 s THR 173 Cb -0.13 -2.53 -0.09 0.00 0.01 0.00 0.00 72.50 69.75 1f90 s THR 173 CO -0.06 0.31 0.86 -0.36 -0.69 0.00 0.00 174.62 174.68 1f90 s PHE 174 N 1.42 3.69 0.22 4.92 0.08 -0.63 -5.01 117.98 122.67 1f90 s PHE 174 Ca 0.03 1.63 -0.32 0.00 0.12 0.00 0.00 56.93 58.40 1f90 s PHE 174 Cb -0.15 -2.80 -0.13 0.00 -0.57 0.00 0.00 43.02 39.36 1f90 s PHE 174 CO -0.04 0.27 1.54 -2.30 -0.10 0.00 0.00 175.22 174.59 1f90 n PRO 175 N 0.66 2.29 -2.06 0.24 -0.02 -1.26 -4.40 135.00 130.45 1f90 n PRO 175 Ca 0.00 0.82 -0.39 0.00 -2.02 0.00 0.00 63.50 61.92 1f90 n PRO 175 Cb 0.50 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1f90 n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1f90 s ALA 176 N 0.43 3.09 -0.12 3.55 0.00 -1.26 -4.88 121.76 122.56 1f90 s ALA 176 Ca 0.72 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.84 1f90 s ALA 176 Cb -0.61 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.02 1f90 s ALA 176 CO 0.43 -0.88 -0.14 0.08 0.00 0.00 0.00 175.76 175.25 1f90 s VAL 177 N -1.35 2.99 -0.17 0.00 1.01 -0.37 -4.96 120.40 117.56 1f90 s VAL 177 Ca 0.62 -0.69 -0.15 0.00 0.00 0.00 0.00 61.98 61.76 1f90 s VAL 177 Cb -0.36 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 1f90 s VAL 177 CO 0.44 0.53 0.35 -0.22 0.00 0.00 0.00 175.10 176.20 1f90 s LEU 178 N 0.28 4.22 -0.08 3.92 2.96 -1.26 -1.61 118.68 127.11 1f90 s LEU 178 Ca -0.10 0.55 -0.01 0.00 -0.22 0.00 0.00 54.13 54.35 1f90 s LEU 178 Cb -0.16 -2.46 0.03 0.00 0.50 0.00 0.00 46.19 44.10 1f90 s LEU 178 CO 0.06 0.04 -0.01 0.00 -1.32 0.00 0.00 176.35 175.11 1f90 s GLN 179 N 0.72 0.75 1.05 1.98 -2.07 -0.07 -4.96 119.66 117.06 1f90 s GLN 179 Ca 0.19 0.05 0.00 0.00 -1.82 0.00 0.00 55.36 53.78 1f90 s GLN 179 Cb -0.14 -1.07 0.00 0.00 -1.09 0.00 0.00 33.01 30.71 1f90 s GLN 179 CO 0.06 -0.30 0.00 0.43 -1.32 0.00 0.00 175.29 174.16 1f90 n SER 180 N 5.12 0.00 -0.85 12.60 7.64 -1.26 -2.36 113.62 134.51 1f90 n SER 180 Ca -0.08 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.77 1f90 n SER 180 Cb 0.50 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.67 1f90 n SER 180 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1f90 n ASP 183 N 4.85 -0.41 -4.12 6.43 8.00 -1.26 -5.12 116.55 124.92 1f90 n ASP 183 Ca 0.00 -1.66 -0.10 0.00 0.71 0.00 0.00 54.79 53.73 1f90 n ASP 183 Cb 0.00 0.11 -0.10 0.00 -0.02 0.00 0.00 41.12 41.11 1f90 n ASP 183 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1f90 s LEU 184 N 0.00 2.44 -0.09 0.64 1.43 -1.00 -4.77 118.68 117.32 1f90 s LEU 184 Ca 0.03 -0.88 0.01 0.00 -1.03 0.00 0.00 54.13 52.26 1f90 s LEU 184 Cb 0.04 -0.04 -0.02 0.00 0.03 0.00 0.00 46.19 46.20 1f90 s LEU 184 CO -0.02 -0.42 -0.10 -0.31 0.23 0.00 0.00 176.35 175.73 1f90 s TYR 185 N -3.08 2.85 -0.07 0.29 2.02 0.13 -0.89 117.35 118.60 1f90 s TYR 185 Ca 0.05 -0.27 0.05 0.00 -0.37 0.00 0.00 57.07 56.53 1f90 s TYR 185 Cb 0.02 -1.77 -0.00 0.00 -0.40 0.00 0.00 41.96 39.81 1f90 s TYR 185 CO -0.04 0.08 -0.23 0.99 -1.57 0.00 0.00 175.55 174.77 1f90 s THR 186 N -0.27 1.95 0.00 -0.71 2.01 -0.63 -1.16 115.64 116.83 1f90 s THR 186 Ca 0.03 -0.98 -0.08 0.00 0.31 0.00 0.00 61.69 60.96 1f90 s THR 186 Cb -0.13 -1.67 0.00 0.00 0.01 0.00 0.00 72.50 70.71 1f90 s THR 186 CO 0.03 0.54 0.15 -0.22 -0.69 0.00 0.00 174.62 174.43 1f90 s LEU 187 N 0.10 1.50 0.28 4.42 0.20 -0.49 -1.24 118.68 123.46 1f90 s LEU 187 Ca -0.10 -0.20 0.02 0.00 0.69 0.00 0.00 54.13 54.53 1f90 s LEU 187 Cb -0.15 0.72 -0.05 0.00 -0.43 0.00 0.00 46.19 46.28 1f90 s LEU 187 CO 0.06 -0.39 0.10 -0.94 -0.29 0.00 0.00 176.35 174.89 1f90 s SER 188 N -1.42 1.47 -0.19 3.68 1.04 -1.26 0.09 113.70 117.12 1f90 s SER 188 Ca -0.14 -1.41 -0.13 0.00 0.48 0.00 0.00 55.95 54.75 1f90 s SER 188 Cb -0.07 0.15 0.06 0.00 0.10 0.00 0.00 66.02 66.25 1f90 s SER 188 CO 0.02 -0.73 0.47 -0.55 0.98 0.00 0.00 173.24 173.42 1f90 s SER 189 N -3.36 -0.56 0.23 7.02 0.15 -0.61 -1.60 113.70 114.98 1f90 s SER 189 Ca 0.37 0.99 0.11 0.00 0.70 0.00 0.00 55.95 58.12 1f90 s SER 189 Cb 0.08 0.92 -0.05 0.00 -1.71 0.00 0.00 66.02 65.26 1f90 s SER 189 CO 0.14 -0.19 -0.19 -0.94 1.20 0.00 0.00 173.24 173.26 1f90 s SER 190 N 0.96 3.65 -0.08 5.45 1.04 0.48 -0.94 113.70 124.27 1f90 s SER 190 Ca -0.06 -0.90 -0.06 0.00 0.48 0.00 0.00 55.95 55.42 1f90 s SER 190 Cb -0.06 -0.35 0.03 0.00 0.10 0.00 0.00 66.02 65.73 1f90 s SER 190 CO -0.08 0.08 0.19 0.54 0.98 0.00 0.00 173.24 174.95 1f90 s VAL 191 N -2.07 -0.01 -0.18 5.02 0.11 -1.09 -0.92 120.40 121.26 1f90 s VAL 191 Ca 0.26 0.05 -0.04 0.00 -2.93 0.00 0.00 61.98 59.32 1f90 s VAL 191 Cb -0.07 -0.29 -0.02 0.00 -1.53 0.00 0.00 36.38 34.47 1f90 s VAL 191 CO 0.13 0.02 -0.04 -0.89 -3.33 0.00 0.00 175.10 171.00 1f90 s THR 192 N 0.48 3.71 0.03 5.04 2.01 -0.22 -0.61 115.64 126.08 1f90 s THR 192 Ca -0.03 -0.41 0.04 0.00 0.31 0.00 0.00 61.69 61.60 1f90 s THR 192 Cb -0.05 -2.65 -0.02 0.00 0.01 0.00 0.00 72.50 69.80 1f90 s THR 192 CO -0.02 0.46 -0.11 0.68 -0.69 0.00 0.00 174.62 174.93 1f90 s VAL 193 N 0.79 0.88 0.61 3.82 -7.23 0.11 -4.67 120.40 114.71 1f90 s VAL 193 Ca -0.01 -0.85 -0.19 0.00 -1.81 0.00 0.00 61.98 59.11 1f90 s VAL 193 Cb -0.15 -0.81 -0.03 0.00 0.56 0.00 0.00 36.38 35.96 1f90 s VAL 193 CO 0.02 -0.03 1.31 -2.16 -0.31 0.00 0.00 175.10 173.93 1f90 s PRO 194 N -0.99 2.80 0.64 4.82 0.04 -1.26 -0.74 135.00 140.31 1f90 s PRO 194 Ca -0.00 2.11 0.30 0.00 0.04 0.00 0.00 61.00 63.44 1f90 s PRO 194 Cb -0.07 -2.00 1.63 0.00 0.04 0.00 0.00 34.50 34.10 1f90 s PRO 194 CO 0.01 -1.41 1.95 0.77 0.04 0.00 0.00 177.00 178.35 1f90 h SER 195 N 0.91 0.00 0.44 6.66 0.02 -1.60 -2.66 113.55 117.33 1f90 h SER 195 Ca -0.51 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.43 1f90 h SER 195 Cb 1.32 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.84 1f90 h SER 195 CO 0.55 0.00 -0.43 0.28 -1.14 0.00 0.00 176.83 176.09 1f90 h SER 196 N 0.00 -1.17 0.00 3.07 0.02 -1.86 -3.39 113.55 110.23 1f90 h SER 196 Ca 0.06 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1f90 h SER 196 Cb 0.74 0.38 0.00 0.00 0.14 0.00 0.00 62.40 63.66 1f90 h SER 196 CO -0.00 -0.57 0.00 -2.65 -1.14 0.00 0.00 176.83 172.47 1f90 n PRO 199 N -5.01 0.00 -1.98 3.45 -0.02 -1.00 -4.46 135.00 125.98 1f90 n PRO 199 Ca -0.10 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 60.99 1f90 n PRO 199 Cb 0.39 -0.40 0.02 0.00 -0.02 0.00 0.00 33.50 33.49 1f90 n PRO 199 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1f90 s ARG 200 N 0.00 3.52 0.00 -0.52 1.81 -1.26 0.47 118.95 122.97 1f90 s ARG 200 Ca 0.00 2.09 0.19 0.00 -1.72 0.00 0.00 55.73 56.29 1f90 s ARG 200 Cb 0.00 -2.42 0.96 0.00 -0.45 0.00 0.00 34.95 33.04 1f90 s ARG 200 CO 0.00 -0.84 1.64 -0.35 -0.68 0.00 0.00 175.30 175.07 1f90 n PRO 202 N -0.59 1.26 0.00 3.54 -0.04 -1.26 -4.59 135.00 133.32 1f90 n PRO 202 Ca 0.08 -0.39 0.00 0.00 -0.04 0.00 0.00 63.50 63.15 1f90 n PRO 202 Cb 0.45 -1.32 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 1f90 n PRO 202 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1f90 n SER 203 N -0.39 0.00 -4.76 3.54 7.64 0.18 -4.83 113.62 114.99 1f90 n SER 203 Ca 0.14 0.50 -0.33 0.00 1.01 0.00 0.00 58.87 60.19 1f90 n SER 203 Cb 0.16 -0.16 0.06 0.00 -1.01 0.00 0.00 64.21 63.25 1f90 n SER 203 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1f90 s GLU 204 N -1.22 2.67 0.12 1.43 2.12 -0.23 -4.99 118.70 118.61 1f90 s GLU 204 Ca 0.00 1.44 -0.30 0.00 0.36 0.00 0.00 54.97 56.47 1f90 s GLU 204 Cb 0.00 -1.93 -0.06 0.00 0.26 0.00 0.00 34.13 32.40 1f90 s GLU 204 CO 0.00 -1.36 1.02 0.99 -0.54 0.00 0.00 175.26 175.38 1f90 s THR 205 N -2.30 4.29 -0.22 -1.70 2.01 -1.26 -4.20 115.64 112.26 1f90 s THR 205 Ca 0.68 1.88 0.01 0.00 0.31 0.00 0.00 61.69 64.57 1f90 s THR 205 Cb -0.22 -4.20 0.05 0.00 0.01 0.00 0.00 72.50 68.15 1f90 s THR 205 CO 0.42 0.28 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.88 1f90 s VAL 206 N 0.07 1.53 0.00 3.82 1.01 -1.26 -5.01 120.40 120.57 1f90 s VAL 206 Ca 0.49 -1.14 0.04 0.00 0.00 0.00 0.00 61.98 61.37 1f90 s VAL 206 Cb -0.26 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 1f90 s VAL 206 CO 0.31 -0.03 -0.11 -0.89 0.00 0.00 0.00 175.10 174.38 1f90 s THR 207 N 1.41 3.31 -0.30 3.92 2.01 -1.26 -0.71 115.64 124.01 1f90 s THR 207 Ca -0.04 -0.87 -0.09 0.00 0.31 0.00 0.00 61.69 60.99 1f90 s THR 207 Cb -0.18 -2.40 -0.01 0.00 0.01 0.00 0.00 72.50 69.92 1f90 s THR 207 CO -0.07 0.42 0.14 0.00 -0.69 0.00 0.00 174.62 174.42 1f90 s ASN 209 N 1.62 5.13 0.01 0.00 0.02 0.31 0.30 114.94 122.32 1f90 s ASN 209 Ca 0.05 -0.63 0.07 0.00 -1.02 0.00 0.00 52.86 51.33 1f90 s ASN 209 Cb -0.17 -1.89 -0.02 0.00 0.02 0.00 0.00 41.25 39.20 1f90 s ASN 209 CO 0.06 -0.17 -0.22 0.54 0.02 0.00 0.00 177.10 177.33 1f90 s VAL 210 N 1.52 1.74 0.01 1.60 0.11 -0.23 -0.80 120.40 124.35 1f90 s VAL 210 Ca 0.03 -1.04 0.05 0.00 -2.93 0.00 0.00 61.98 58.09 1f90 s VAL 210 Cb -0.17 -1.46 -0.02 0.00 -1.53 0.00 0.00 36.38 33.20 1f90 s VAL 210 CO 0.03 0.40 -0.16 0.00 -3.33 0.00 0.00 175.10 172.03 1f90 s ALA 211 N -0.61 1.33 -0.66 1.54 0.00 -0.34 -0.89 121.76 122.12 1f90 s ALA 211 Ca 0.08 -0.76 0.05 0.00 0.00 0.00 0.00 51.96 51.34 1f90 s ALA 211 Cb -0.09 -0.30 0.16 0.00 0.00 0.00 0.00 23.12 22.90 1f90 s ALA 211 CO 0.00 0.31 0.44 -1.58 0.00 0.00 0.00 175.76 174.93 1f90 s HIS 212 N -0.53 3.37 0.18 0.00 2.46 0.22 -1.98 115.29 119.01 1f90 s HIS 212 Ca 0.05 -3.25 -0.19 0.00 0.47 0.00 0.00 55.06 52.14 1f90 s HIS 212 Cb -0.07 -2.63 0.12 0.00 -0.13 0.00 0.00 32.58 29.87 1f90 s HIS 212 CO 0.00 -0.59 1.33 -2.30 -2.47 0.00 0.00 174.74 170.71 1f90 n PRO 213 N 2.22 -0.26 -0.27 2.88 -0.02 -1.26 -0.72 135.00 137.56 1f90 n PRO 213 Ca 0.18 1.32 0.33 0.00 -2.02 0.00 0.00 63.50 63.30 1f90 n PRO 213 Cb 0.35 -1.95 0.73 0.00 -0.02 0.00 0.00 33.50 32.62 1f90 n PRO 213 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1f90 h ALA 214 N 0.93 3.00 -0.14 3.55 0.00 -1.92 0.21 119.26 124.90 1f90 h ALA 214 Ca 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1f90 h ALA 214 Cb 0.46 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1f90 h ALA 214 CO -0.84 -1.32 0.00 -1.13 0.00 0.00 0.00 179.25 175.97 1f90 n SER 215 N -4.22 2.30 -2.23 0.00 3.41 0.10 -4.96 113.62 108.01 1f90 n SER 215 Ca 0.23 -1.89 -0.18 0.00 -0.26 0.00 0.00 58.87 56.77 1f90 n SER 215 Cb 1.14 -0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.97 1f90 n SER 215 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1f90 n SER 216 N 0.02 -5.21 -4.84 4.04 2.88 0.06 -4.94 113.62 105.63 1f90 n SER 216 Ca 0.05 0.13 -0.37 0.00 -1.33 0.00 0.00 58.87 57.35 1f90 n SER 216 Cb 0.31 -4.42 -0.06 0.00 -0.75 0.00 0.00 64.21 59.29 1f90 n SER 216 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1f90 s THR 217 N -2.84 5.00 -0.15 2.46 2.01 -1.06 -4.95 115.64 116.12 1f90 s THR 217 Ca 0.00 0.80 -0.08 0.00 0.31 0.00 0.00 61.69 62.73 1f90 s THR 217 Cb 0.00 -3.72 0.06 0.00 0.01 0.00 0.00 72.50 68.85 1f90 s THR 217 CO 0.00 0.50 0.36 -0.75 -0.69 0.00 0.00 174.62 174.04 1f90 s LYS 218 N -1.30 0.33 -0.04 4.92 2.20 -1.26 0.71 119.74 125.29 1f90 s LYS 218 Ca 0.27 0.72 -0.06 0.00 -0.36 0.00 0.00 55.97 56.54 1f90 s LYS 218 Cb -0.16 -0.04 0.01 0.00 -1.51 0.00 0.00 37.83 36.13 1f90 s LYS 218 CO 0.15 -0.17 0.14 0.54 -0.36 0.00 0.00 175.35 175.66 1f90 s VAL 219 N 1.44 0.03 -0.14 4.02 0.11 -0.07 -5.01 120.40 120.78 1f90 s VAL 219 Ca -0.09 -0.22 -0.00 0.00 -2.93 0.00 0.00 61.98 58.74 1f90 s VAL 219 Cb -0.09 -0.28 -0.01 0.00 -1.53 0.00 0.00 36.38 34.46 1f90 s VAL 219 CO -0.11 -0.12 -0.13 -1.81 -3.33 0.00 0.00 175.10 169.60 1f90 s ASP 220 N -0.37 4.02 -0.14 3.54 1.01 -1.26 -1.06 116.67 122.41 1f90 s ASP 220 Ca -0.05 -0.33 0.01 0.00 0.71 0.00 0.00 52.55 52.89 1f90 s ASP 220 Cb -0.03 -1.62 0.02 0.00 1.01 0.00 0.00 42.92 42.30 1f90 s ASP 220 CO 0.01 0.15 -0.15 -0.75 0.21 0.00 0.00 175.17 174.64 1f90 s LYS 221 N 0.43 2.35 -0.06 8.23 2.47 0.15 -4.92 119.74 128.38 1f90 s LYS 221 Ca -0.10 -0.59 -0.21 0.00 -1.56 0.00 0.00 55.97 53.51 1f90 s LYS 221 Cb -0.16 -2.08 -0.04 0.00 -1.46 0.00 0.00 37.83 34.09 1f90 s LYS 221 CO 0.05 -0.17 0.60 -1.59 0.16 0.00 0.00 175.35 174.40 1f90 s LYS 222 N 1.28 4.37 -0.80 4.03 0.00 -1.26 0.14 119.74 127.49 1f90 s LYS 222 Ca 0.01 0.70 -0.26 0.00 0.00 0.00 0.00 55.97 56.42 1f90 s LYS 222 Cb -0.14 -3.41 0.04 0.00 0.00 0.00 0.00 37.83 34.32 1f90 s LYS 222 CO -0.07 0.19 1.30 0.42 0.00 0.00 0.00 175.35 177.19 1f90 s ILE 223 N 0.42 3.82 -0.05 3.79 -1.09 0.11 -4.93 121.20 123.26 1f90 s ILE 223 Ca 0.32 0.06 -0.09 0.00 -2.23 0.00 0.00 60.65 58.71 1f90 s ILE 223 Cb -0.17 -4.94 -0.05 0.00 -1.58 0.00 0.00 42.46 35.73 1f90 s ILE 223 CO 0.15 -1.85 0.25 0.68 -1.23 0.00 0.00 174.94 172.94 1f90 s VAL 226 N 5.41 5.32 0.00 2.92 -7.23 -1.26 -4.72 120.40 120.85 1f90 s VAL 226 Ca 0.37 0.38 0.00 0.00 -1.81 0.00 0.00 61.98 60.92 1f90 s VAL 226 Cb -0.07 -3.53 0.00 0.00 0.56 0.00 0.00 36.38 33.34 1f90 s VAL 226 CO 0.08 0.55 0.00 -2.65 -0.31 0.00 0.00 175.10 172.77 1f90 n PRO 227 N 1.72 0.75 0.00 4.82 -0.02 -1.26 -4.75 135.00 136.27 1f90 n PRO 227 Ca -0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 1f90 n PRO 227 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.02 1f90 n PRO 227 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1f90 n ARG 228 N -0.18 0.00 0.00 -0.52 1.85 -1.26 -5.06 116.66 111.50 1f90 n ARG 228 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1f90 n ARG 228 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1f90 n ARG 228 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1f90 n ASP 229 N 0.00 0.00 0.00 2.89 2.03 -1.26 -4.99 116.55 115.22 1f90 n ASP 229 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1f90 n ASP 229 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1f90 n ASP 229 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28