#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1na1 s LEU 2 N 0.00 4.15 0.10 0.99 2.96 -1.26 -4.97 118.68 120.65 1na1 s LEU 2 Ca 0.00 1.70 -0.31 0.00 -0.22 0.00 0.00 54.13 55.31 1na1 s LEU 2 Cb 0.00 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 43.06 1na1 s LEU 2 CO 0.00 -0.85 1.74 -2.84 -1.32 0.00 0.00 176.35 173.08 1na1 s PRO 3 N 3.72 4.17 0.28 0.98 0.02 -1.26 -5.00 135.00 137.92 1na1 s PRO 3 Ca 0.58 2.47 0.03 0.00 0.02 0.00 0.00 61.00 64.10 1na1 s PRO 3 Cb -0.23 -3.60 -0.06 0.00 0.02 0.00 0.00 34.50 30.64 1na1 s PRO 3 CO 0.18 -0.79 0.06 0.95 -0.33 0.00 0.00 177.00 177.08 1na1 s THR 4 N 2.70 0.92 -0.12 0.99 -4.23 -1.26 -5.14 115.64 109.49 1na1 s THR 4 Ca 0.77 -2.01 -0.04 0.00 -1.18 0.00 0.00 61.69 59.24 1na1 s THR 4 Cb -0.43 -2.66 0.05 0.00 1.34 0.00 0.00 72.50 70.80 1na1 s THR 4 CO 0.34 -0.05 0.09 -0.89 -0.54 0.00 0.00 174.62 173.57 1na1 s THR 5 N -3.50 -0.12 0.17 3.99 2.01 -1.26 -5.13 115.64 111.80 1na1 s THR 5 Ca 0.36 0.07 -0.30 0.00 0.31 0.00 0.00 61.69 62.12 1na1 s THR 5 Cb 0.08 -0.42 -0.08 0.00 0.01 0.00 0.00 72.50 72.09 1na1 s THR 5 CO 0.14 -0.10 1.19 0.42 -0.69 0.00 0.00 174.62 175.58 1na1 s THR 6 N 2.17 3.66 0.41 -0.82 -4.23 -1.26 -5.03 115.64 110.55 1na1 s THR 6 Ca 0.03 1.37 0.01 0.00 -1.18 0.00 0.00 61.69 61.92 1na1 s THR 6 Cb -0.14 -3.87 -0.01 0.00 1.34 0.00 0.00 72.50 69.81 1na1 s THR 6 CO -0.07 0.20 0.62 -0.76 -0.54 0.00 0.00 174.62 174.07 1na1 s LEU 7 N -0.05 3.77 0.27 4.79 1.43 -1.26 -5.02 118.68 122.62 1na1 s LEU 7 Ca 0.53 0.25 -0.30 0.00 -1.03 0.00 0.00 54.13 53.58 1na1 s LEU 7 Cb -0.32 -3.13 -0.11 0.00 0.03 0.00 0.00 46.19 42.66 1na1 s LEU 7 CO 0.35 -0.58 1.58 -2.16 0.23 0.00 0.00 176.35 175.78 1na1 s PRO 8 N -4.45 4.15 0.00 1.29 0.04 -1.26 -2.08 135.00 132.69 1na1 s PRO 8 Ca 0.46 2.53 0.00 0.00 0.04 0.00 0.00 61.00 64.03 1na1 s PRO 8 Cb -0.10 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 31.39 1na1 s PRO 8 CO 0.36 -0.61 0.00 0.41 0.04 0.00 0.00 177.00 177.20 1na1 n GLY 9 N 2.46 2.33 3.66 0.56 0.00 -1.26 -5.07 105.19 107.88 1na1 n GLY 9 Ca 0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.67 1na1 n GLY 9 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1na1 n SER 10 N 0.00 2.48 0.00 1.61 7.64 -0.88 -1.01 113.62 123.47 1na1 n SER 10 Ca 0.00 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.04 1na1 n SER 10 Cb 0.00 -1.41 0.00 0.00 -1.01 0.00 0.00 64.21 61.79 1na1 n SER 10 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1na1 n GLY 11 N 1.66 2.22 3.81 0.23 0.00 -1.26 -5.03 105.19 106.82 1na1 n GLY 11 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1na1 n GLY 11 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1na1 s GLN 12 N -0.29 3.43 -0.42 1.61 -2.07 -0.18 -5.02 119.66 116.72 1na1 s GLN 12 Ca 0.00 1.14 0.01 0.00 -1.82 0.00 0.00 55.36 54.69 1na1 s GLN 12 Cb 0.00 -2.05 0.11 0.00 -1.09 0.00 0.00 33.01 29.98 1na1 s GLN 12 CO 0.00 -0.71 0.17 0.12 -1.32 0.00 0.00 175.29 173.55 1na1 s PHE 13 N -2.52 3.58 -0.43 9.60 5.36 -1.26 -5.06 117.98 127.26 1na1 s PHE 13 Ca 0.62 -2.82 -0.21 0.00 -0.96 0.00 0.00 56.93 53.57 1na1 s PHE 13 Cb -0.15 -3.04 0.02 0.00 -0.34 0.00 0.00 43.02 39.52 1na1 s PHE 13 CO 0.37 -0.91 0.65 -1.17 -1.46 0.00 0.00 175.22 172.69 1na1 s LEU 14 N 0.69 4.47 0.46 6.12 2.96 -1.26 -4.91 118.68 127.20 1na1 s LEU 14 Ca 0.12 -0.29 0.24 0.00 -0.22 0.00 0.00 54.13 53.97 1na1 s LEU 14 Cb -0.21 -2.74 1.31 0.00 0.50 0.00 0.00 46.19 45.04 1na1 s LEU 14 CO -0.05 -0.77 1.70 0.71 -1.32 0.00 0.00 176.35 176.62 1na1 h THR 15 N 5.87 0.00 0.00 3.68 1.35 -2.07 -0.92 112.91 120.82 1na1 h THR 15 Ca -0.25 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 1na1 h THR 15 Cb 1.10 0.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.05 1na1 h THR 15 CO 0.89 0.00 -1.37 0.41 -0.25 0.00 0.00 175.52 175.20 1na1 n THR 16 N -2.46 0.00 -1.99 6.82 -1.04 -1.26 -4.98 114.28 109.36 1na1 n THR 16 Ca -0.02 -0.19 -0.37 0.00 -2.04 0.00 0.00 64.05 61.44 1na1 n THR 16 Cb 0.22 0.62 0.03 0.00 -1.82 0.00 0.00 70.33 69.39 1na1 n THR 16 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1na1 s ASP 17 N -3.57 5.33 -0.52 8.00 3.68 -0.35 -5.01 116.67 124.23 1na1 s ASP 17 Ca 0.02 2.46 0.04 0.00 2.13 0.00 0.00 52.55 57.20 1na1 s ASP 17 Cb 0.15 -2.61 0.14 0.00 -1.45 0.00 0.00 42.92 39.15 1na1 s ASP 17 CO 0.88 -1.51 0.28 -0.62 0.13 0.00 0.00 175.17 174.34 1na1 s ASP 18 N -1.42 4.13 0.44 -0.34 3.68 -1.26 -5.02 116.67 116.88 1na1 s ASP 18 Ca 0.74 -3.01 0.03 0.00 2.13 0.00 0.00 52.55 52.44 1na1 s ASP 18 Cb -0.32 -1.45 -0.03 0.00 -1.45 0.00 0.00 42.92 39.66 1na1 s ASP 18 CO 0.36 -0.22 0.06 -0.13 0.13 0.00 0.00 175.17 175.37 1na1 s ARG 19 N -0.25 2.00 0.53 4.34 1.81 -1.26 -5.14 118.95 120.97 1na1 s ARG 19 Ca 0.18 -2.22 -0.08 0.00 -1.72 0.00 0.00 55.73 51.89 1na1 s ARG 19 Cb -0.22 -1.12 -0.04 0.00 -0.45 0.00 0.00 34.95 33.12 1na1 s ARG 19 CO -0.02 -0.34 0.88 -0.65 -0.68 0.00 0.00 175.30 174.48 1na1 s GLN 20 N -3.80 3.59 -0.12 3.54 -0.21 -1.26 -5.09 119.66 116.31 1na1 s GLN 20 Ca 0.20 0.44 -0.23 0.00 0.02 0.00 0.00 55.36 55.80 1na1 s GLN 20 Cb 0.04 -2.26 0.05 0.00 1.00 0.00 0.00 33.01 31.84 1na1 s GLN 20 CO 0.11 -0.33 0.55 -1.54 -2.12 0.00 0.00 175.29 171.96 1na1 s SER 21 N -4.04 -0.53 0.60 5.90 1.04 -1.26 -5.15 113.70 110.25 1na1 s SER 21 Ca 0.51 0.79 -0.20 0.00 0.48 0.00 0.00 55.95 57.53 1na1 s SER 21 Cb -0.11 0.79 -0.03 0.00 0.10 0.00 0.00 66.02 66.77 1na1 s SER 21 CO 0.47 -0.39 1.30 -2.16 0.98 0.00 0.00 173.24 173.45 1na1 s PRO 22 N -0.53 2.87 -0.12 4.02 0.04 -1.26 -4.96 135.00 135.06 1na1 s PRO 22 Ca -0.06 2.09 -0.24 0.00 0.04 0.00 0.00 61.00 62.83 1na1 s PRO 22 Cb -0.03 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 1na1 s PRO 22 CO 0.05 -1.36 0.74 0.45 0.04 0.00 0.00 177.00 176.91 1na1 s SER 23 N -1.25 6.93 0.37 6.66 0.15 -1.26 -4.94 113.70 120.37 1na1 s SER 23 Ca 0.77 1.13 0.27 0.00 0.70 0.00 0.00 55.95 58.82 1na1 s SER 23 Cb -0.38 -2.42 1.05 0.00 -1.71 0.00 0.00 66.02 62.57 1na1 s SER 23 CO 0.42 -0.24 1.81 0.00 1.20 0.00 0.00 173.24 176.43 1na1 h ALA 24 N 7.08 1.00 -2.60 5.45 0.00 -2.07 -3.33 119.26 124.79 1na1 h ALA 24 Ca -0.35 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 53.95 1na1 h ALA 24 Cb 1.17 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 18.54 1na1 h ALA 24 CO 0.78 0.00 -0.65 1.28 0.00 0.00 0.00 179.25 180.66 1na1 n LEU 25 N -2.61 2.82 -4.77 0.00 4.77 -1.26 -5.09 117.00 110.86 1na1 n LEU 25 Ca 0.02 -5.20 -0.40 0.00 -0.03 0.00 0.00 56.01 50.41 1na1 n LEU 25 Cb 0.30 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1na1 n LEU 25 CO 0.25 1.90 1.00 -2.16 -1.33 0.00 0.00 177.39 177.05 1na1 s PRO 26 N -1.72 3.85 -0.42 3.23 0.04 -1.25 -2.80 135.00 135.93 1na1 s PRO 26 Ca 0.32 2.25 0.00 0.00 0.04 0.00 0.00 61.00 63.61 1na1 s PRO 26 Cb 0.05 -2.71 0.00 0.00 0.04 0.00 0.00 34.50 31.89 1na1 s PRO 26 CO -0.11 -0.63 0.00 0.09 0.04 0.00 0.00 177.00 176.40 1na1 n ASN 27 N -0.02 -5.06 -4.76 6.66 5.03 -1.26 -4.98 115.26 110.88 1na1 n ASN 27 Ca 0.04 0.10 -0.40 0.00 0.87 0.00 0.00 54.58 55.19 1na1 n ASN 27 Cb 0.43 -2.91 -0.04 0.00 -1.02 0.00 0.00 39.78 36.24 1na1 n ASN 27 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1na1 s TYR 28 N -1.62 3.58 -0.39 3.10 5.04 -1.12 -5.01 117.35 120.93 1na1 s TYR 28 Ca 0.00 1.71 -0.03 0.00 -2.44 0.00 0.00 57.07 56.31 1na1 s TYR 28 Cb 0.00 -3.25 0.10 0.00 0.35 0.00 0.00 41.96 39.16 1na1 s TYR 28 CO 0.00 -0.49 0.18 -1.21 -1.34 0.00 0.00 175.55 172.69 1na1 s GLU 29 N -1.52 2.12 0.89 4.97 2.02 -1.26 -5.09 118.70 120.83 1na1 s GLU 29 Ca 0.45 -1.70 -0.11 0.00 0.02 0.00 0.00 54.97 53.63 1na1 s GLU 29 Cb -0.31 -3.54 0.12 0.00 0.10 0.00 0.00 34.13 30.50 1na1 s GLU 29 CO 0.39 -0.99 1.09 -0.35 0.02 0.00 0.00 175.26 175.42 1na1 n PRO 30 N 4.63 -0.28 -1.98 0.39 -0.04 -1.26 -4.93 135.00 131.53 1na1 n PRO 30 Ca -0.05 -0.01 -0.40 0.00 -0.04 0.00 0.00 63.50 63.00 1na1 n PRO 30 Cb 0.42 -2.34 -0.01 0.00 -0.04 0.00 0.00 33.50 31.53 1na1 n PRO 30 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1na1 s THR 31 N -2.48 2.43 0.69 0.52 2.01 -1.26 -4.96 115.64 112.61 1na1 s THR 31 Ca 0.68 0.43 -0.16 0.00 0.31 0.00 0.00 61.69 62.94 1na1 s THR 31 Cb -0.25 -3.27 -0.00 0.00 0.01 0.00 0.00 72.50 68.99 1na1 s THR 31 CO 0.57 0.09 1.00 -2.65 -0.69 0.00 0.00 174.62 172.94 1na1 n PRO 32 N 0.49 0.63 -3.04 4.92 -0.02 -1.26 -4.98 135.00 131.74 1na1 n PRO 32 Ca 0.01 0.27 -0.37 0.00 -2.02 0.00 0.00 63.50 61.39 1na1 n PRO 32 Cb 0.41 -2.24 -0.06 0.00 -0.02 0.00 0.00 33.50 31.59 1na1 n PRO 32 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1na1 s ARG 33 N -3.24 4.39 0.34 -0.52 0.52 -1.26 -5.07 118.95 114.11 1na1 s ARG 33 Ca 0.75 1.00 0.06 0.00 -0.52 0.00 0.00 55.73 57.02 1na1 s ARG 33 Cb -0.36 -3.03 -0.07 0.00 0.52 0.00 0.00 34.95 32.01 1na1 s ARG 33 CO 0.49 0.46 -0.00 0.96 0.02 0.00 0.00 175.30 177.23 1na1 s ILE 34 N -1.37 1.65 0.04 1.52 -4.36 -1.26 -5.10 121.20 112.32 1na1 s ILE 34 Ca 0.40 -2.05 -0.30 0.00 -0.26 0.00 0.00 60.65 58.44 1na1 s ILE 34 Cb -0.19 -2.76 -0.04 0.00 1.25 0.00 0.00 42.46 40.72 1na1 s ILE 34 CO 0.23 -0.10 1.09 -2.28 0.24 0.00 0.00 174.94 174.12 1na1 s HIS 35 N -2.98 3.55 -0.12 1.37 5.65 -1.26 -5.01 115.29 116.50 1na1 s HIS 35 Ca 0.34 1.51 -0.01 0.00 0.25 0.00 0.00 55.06 57.15 1na1 s HIS 35 Cb 0.07 -3.27 0.03 0.00 -1.18 0.00 0.00 32.58 28.24 1na1 s HIS 35 CO 0.15 -0.64 -0.04 0.42 -0.65 0.00 0.00 174.74 173.99 1na1 s ILE 36 N 0.98 0.78 0.85 0.89 1.01 -1.26 -5.14 121.20 119.31 1na1 s ILE 36 Ca 0.55 -0.24 -0.11 0.00 0.00 0.00 0.00 60.65 60.86 1na1 s ILE 36 Cb -0.25 -0.91 0.10 0.00 0.01 0.00 0.00 42.46 41.40 1na1 s ILE 36 CO 0.29 0.24 1.10 -2.16 0.00 0.00 0.00 174.94 174.41 1na1 s PRO 37 N 1.80 1.63 -0.08 2.79 0.04 -1.26 -4.22 135.00 135.70 1na1 s PRO 37 Ca 0.04 1.15 -0.00 0.00 0.04 0.00 0.00 61.00 62.23 1na1 s PRO 37 Cb -0.13 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1na1 s PRO 37 CO -0.07 -2.08 0.02 0.41 0.04 0.00 0.00 177.00 175.32 1na1 n GLY 38 N -0.82 0.53 3.74 0.56 0.00 -1.26 -5.02 105.19 102.92 1na1 n GLY 38 Ca 0.09 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 1na1 n GLY 38 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1na1 s LYS 39 N -4.41 4.41 -0.15 1.61 2.20 -1.26 -5.02 119.74 117.13 1na1 s LYS 39 Ca 0.01 2.02 -0.03 0.00 -0.36 0.00 0.00 55.97 57.62 1na1 s LYS 39 Cb -0.00 -3.20 -0.02 0.00 -1.51 0.00 0.00 37.83 33.10 1na1 s LYS 39 CO 0.01 -0.21 -0.07 0.08 -0.36 0.00 0.00 175.35 174.81 1na1 s VAL 40 N -0.02 3.55 -0.15 4.02 1.01 -1.26 -4.99 120.40 122.56 1na1 s VAL 40 Ca 0.55 -0.48 0.08 0.00 0.00 0.00 0.00 61.98 62.14 1na1 s VAL 40 Cb -0.36 -2.54 -0.15 0.00 0.00 0.00 0.00 36.38 33.33 1na1 s VAL 40 CO 0.39 0.49 -0.02 1.41 0.00 0.00 0.00 175.10 177.37 1na1 n HIS 41 N 3.68 0.00 -3.92 5.22 -0.00 -1.26 -5.03 115.22 113.92 1na1 n HIS 41 Ca -0.18 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.43 1na1 n HIS 41 Cb 0.52 -0.66 -0.13 0.00 -0.00 0.00 0.00 29.99 29.72 1na1 n HIS 41 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1na1 s ASN 42 N -5.01 0.10 0.47 0.41 2.47 -1.26 -5.01 114.94 107.11 1na1 s ASN 42 Ca -0.13 -0.19 0.24 0.00 0.42 0.00 0.00 52.86 53.21 1na1 s ASN 42 Cb 0.05 0.04 1.16 0.00 -1.45 0.00 0.00 41.25 41.04 1na1 s ASN 42 CO 0.50 -0.11 1.95 -0.07 -3.72 0.00 0.00 177.10 175.65 1na1 h LEU 43 N 5.60 0.00 -1.53 3.21 3.38 -2.01 -0.01 115.31 123.94 1na1 h LEU 43 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1na1 h LEU 43 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1na1 h LEU 43 CO 0.47 0.20 0.00 -0.07 0.09 0.00 0.00 178.44 179.13 1na1 h LEU 44 N 0.00 0.00 0.23 1.67 3.38 -1.98 -2.39 115.31 116.21 1na1 h LEU 44 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1na1 h LEU 44 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1na1 h LEU 44 CO 0.03 0.00 -0.11 -0.33 0.09 0.00 0.00 178.44 178.12 1na1 h GLU 45 N 0.00 -0.29 0.00 1.13 5.08 -1.40 -3.36 114.58 115.74 1na1 h GLU 45 Ca 0.00 0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 1na1 h GLU 45 Cb 0.25 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1na1 h GLU 45 CO 0.00 0.08 -0.40 -0.84 -1.00 0.00 0.00 179.01 176.86 1na1 h ILE 46 N -0.86 0.96 0.00 3.13 3.07 -1.51 -3.03 117.51 119.26 1na1 h ILE 46 Ca -0.03 -1.55 0.00 0.00 1.55 0.00 0.00 64.86 64.83 1na1 h ILE 46 Cb 0.51 1.92 0.00 0.00 -0.27 0.00 0.00 36.82 38.98 1na1 h ILE 46 CO 0.05 0.39 0.00 2.30 -1.05 0.00 0.00 178.15 179.84 1na1 n ILE 47 N -3.60 0.06 1.17 0.16 -5.35 -0.94 -1.54 119.36 109.33 1na1 n ILE 47 Ca -0.00 0.02 0.13 0.00 -0.27 0.00 0.00 62.75 62.62 1na1 n ILE 47 Cb 0.51 -0.66 0.46 0.00 -1.74 0.00 0.00 39.64 38.20 1na1 n ILE 47 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1na1 n GLN 48 N -1.05 0.36 -3.20 6.28 6.02 -1.14 -0.74 117.38 123.91 1na1 n GLN 48 Ca 0.16 -0.16 -0.39 0.00 -0.01 0.00 0.00 57.00 56.60 1na1 n GLN 48 Cb 0.09 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.80 1na1 n GLN 48 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1na1 s VAL 49 N -2.75 5.10 0.26 5.09 1.01 -0.59 -4.59 120.40 123.94 1na1 s VAL 49 Ca 0.20 1.09 -0.12 0.00 0.00 0.00 0.00 61.98 63.15 1na1 s VAL 49 Cb 0.19 -3.89 -0.08 0.00 0.00 0.00 0.00 36.38 32.60 1na1 s VAL 49 CO 0.57 0.21 0.62 1.51 0.00 0.00 0.00 175.10 178.01 1na1 s ASP 50 N 0.97 6.69 0.35 3.32 1.47 -1.26 -4.75 116.67 123.45 1na1 s ASP 50 Ca 0.28 1.06 0.05 0.00 1.18 0.00 0.00 52.55 55.12 1na1 s ASP 50 Cb -0.16 -2.28 -0.07 0.00 -0.34 0.00 0.00 42.92 40.07 1na1 s ASP 50 CO 0.11 -0.12 0.04 0.42 0.68 0.00 0.00 175.17 176.31 1na1 s THR 51 N -1.87 1.43 0.31 2.11 -4.23 -1.10 -4.91 115.64 107.38 1na1 s THR 51 Ca 0.50 -2.00 -0.28 0.00 -1.18 0.00 0.00 61.69 58.73 1na1 s THR 51 Cb -0.11 -2.86 -0.09 0.00 1.34 0.00 0.00 72.50 70.78 1na1 s THR 51 CO 0.20 -0.00 1.03 -0.76 -0.54 0.00 0.00 174.62 174.54 1na1 s LEU 52 N -3.55 4.44 -0.19 4.79 1.43 -1.26 -1.98 118.68 122.35 1na1 s LEU 52 Ca 0.36 2.08 -0.09 0.00 -1.03 0.00 0.00 54.13 55.45 1na1 s LEU 52 Cb 0.09 -3.82 -0.05 0.00 0.03 0.00 0.00 46.19 42.45 1na1 s LEU 52 CO 0.16 -0.15 0.10 -0.63 0.23 0.00 0.00 176.35 176.06 1na1 s ILE 53 N -1.36 5.14 -1.55 -0.59 1.01 -0.19 -4.79 121.20 118.88 1na1 s ILE 53 Ca 0.48 0.09 -0.10 0.00 0.00 0.00 0.00 60.65 61.12 1na1 s ILE 53 Cb -0.26 -3.34 -0.03 0.00 0.01 0.00 0.00 42.46 38.84 1na1 s ILE 53 CO 0.33 0.45 2.71 -0.81 0.00 0.00 0.00 174.94 177.61 1na1 n PRO 54 N 3.55 3.61 -0.13 2.79 -0.04 -1.26 -4.58 135.00 138.95 1na1 n PRO 54 Ca -0.16 -2.47 0.14 0.00 -0.04 0.00 0.00 63.50 60.97 1na1 n PRO 54 Cb 0.52 -2.89 0.51 0.00 -0.04 0.00 0.00 33.50 31.59 1na1 n PRO 54 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 1na1 h MET 55 N 5.20 0.39 -2.82 0.54 4.05 -1.78 -3.20 114.93 117.31 1na1 h MET 55 Ca 0.78 -0.02 -0.74 0.00 -0.28 0.00 0.00 59.70 59.43 1na1 h MET 55 Cb 0.37 -0.09 -0.11 0.00 -0.80 0.00 0.00 31.60 30.97 1na1 h MET 55 CO 1.77 0.26 2.49 -1.71 0.23 0.00 0.00 176.91 179.95 1na1 n ASN 56 N -4.47 7.56 -0.32 1.39 4.05 0.20 -4.76 115.26 118.91 1na1 n ASN 56 Ca 0.12 -3.08 0.11 0.00 0.45 0.00 0.00 54.58 52.18 1na1 n ASN 56 Cb 0.47 -1.40 0.28 0.00 1.23 0.00 0.00 39.78 40.35 1na1 n ASN 56 CO 0.00 0.00 0.00 0.78 -3.05 0.00 0.00 177.26 174.99 1na1 h ASN 57 N 4.85 0.58 0.00 1.20 2.35 -1.75 -3.35 115.58 119.46 1na1 h ASN 57 Ca 0.66 0.11 0.00 0.00 -0.55 0.00 0.00 56.30 56.52 1na1 h ASN 57 Cb 0.36 0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.75 1na1 h ASN 57 CO 1.54 0.19 0.00 0.35 -1.65 0.00 0.00 177.43 177.86 1na1 n THR 58 N -4.87 0.00 -2.40 2.81 -2.24 -1.26 -4.63 114.28 101.69 1na1 n THR 58 Ca 0.21 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.65 1na1 n THR 58 Cb 0.54 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.75 1na1 n THR 58 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1na1 s HIS 59 N -1.95 3.05 0.14 4.78 3.76 -1.26 -4.96 115.29 118.86 1na1 s HIS 59 Ca 0.00 1.55 0.32 0.00 -0.15 0.00 0.00 55.06 56.78 1na1 s HIS 59 Cb 0.00 -3.01 1.31 0.00 1.11 0.00 0.00 32.58 31.99 1na1 s HIS 59 CO 0.00 -0.83 1.97 0.00 -0.85 0.00 0.00 174.74 175.03 1na1 h THR 60 N 1.19 0.14 -3.86 1.30 1.03 -1.98 -3.45 112.91 107.29 1na1 h THR 60 Ca -0.48 -0.63 -0.09 0.00 -0.01 0.00 0.00 66.41 65.20 1na1 h THR 60 Cb 1.21 1.54 -0.14 0.00 -1.07 0.00 0.00 68.15 69.70 1na1 h THR 60 CO 0.59 0.05 -0.41 -1.59 -0.01 0.00 0.00 175.52 174.15 1na1 s LYS 61 N -3.70 0.81 0.11 0.00 -2.85 -1.26 -5.11 119.74 107.73 1na1 s LYS 61 Ca 0.01 -0.98 -0.31 0.00 -1.00 0.00 0.00 55.97 53.68 1na1 s LYS 61 Cb 0.09 0.32 -0.11 0.00 -2.06 0.00 0.00 37.83 36.08 1na1 s LYS 61 CO 0.56 -0.24 1.85 -0.25 0.10 0.00 0.00 175.35 177.36 1na1 n ASP 62 N -0.01 4.00 -3.90 0.03 10.43 -1.26 -4.96 116.55 120.88 1na1 n ASP 62 Ca -0.15 0.98 -0.09 0.00 2.57 0.00 0.00 54.79 58.10 1na1 n ASP 62 Cb 0.62 -1.53 -0.09 0.00 1.84 0.00 0.00 41.12 41.96 1na1 n ASP 62 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 1na1 s GLU 63 N 2.88 0.66 0.35 -1.24 2.02 -1.26 -5.00 118.70 117.12 1na1 s GLU 63 Ca 0.83 -0.79 0.11 0.00 0.02 0.00 0.00 54.97 55.14 1na1 s GLU 63 Cb -0.49 0.26 0.88 0.00 0.10 0.00 0.00 34.13 34.88 1na1 s GLU 63 CO 0.38 -0.18 1.82 0.28 0.02 0.00 0.00 175.26 177.58 1na1 h VAL 64 N 3.40 0.71 0.00 2.63 2.07 -2.02 0.12 116.25 123.17 1na1 h VAL 64 Ca -0.33 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1na1 h VAL 64 Cb 1.19 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1na1 h VAL 64 CO 0.52 0.11 0.22 0.78 0.02 0.00 0.00 177.57 179.23 1na1 h ASN 65 N 0.63 0.00 0.71 0.57 2.35 -1.95 -0.77 115.58 117.11 1na1 h ASN 65 Ca 0.52 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.27 1na1 h ASN 65 Cb 0.99 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.36 1na1 h ASN 65 CO -0.28 0.00 0.00 -1.20 -1.65 0.00 0.00 177.43 174.30 1na1 n SER 66 N -2.79 0.00 -0.44 5.81 7.64 0.42 -2.22 113.62 122.04 1na1 n SER 66 Ca -0.02 0.41 0.11 0.00 1.01 0.00 0.00 58.87 60.38 1na1 n SER 66 Cb 0.27 -0.46 0.04 0.00 -1.01 0.00 0.00 64.21 63.05 1na1 n SER 66 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1na1 n TYR 67 N -1.46 0.00 -3.58 1.43 4.01 -0.30 -0.63 117.16 116.63 1na1 n TYR 67 Ca 0.06 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.41 1na1 n TYR 67 Cb 0.25 -0.02 -0.11 0.00 -0.31 0.00 0.00 39.34 39.15 1na1 n TYR 67 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1na1 s LEU 68 N -2.51 4.31 -0.40 7.72 1.43 -0.94 -4.50 118.68 123.79 1na1 s LEU 68 Ca 0.19 -0.37 -0.21 0.00 -1.03 0.00 0.00 54.13 52.71 1na1 s LEU 68 Cb 0.18 -2.10 0.01 0.00 0.03 0.00 0.00 46.19 44.32 1na1 s LEU 68 CO 0.58 -0.19 0.67 -0.63 0.23 0.00 0.00 176.35 177.01 1na1 s ILE 69 N 1.70 4.82 0.46 -0.59 1.01 -0.45 -4.66 121.20 123.49 1na1 s ILE 69 Ca 0.06 0.40 -0.23 0.00 0.00 0.00 0.00 60.65 60.88 1na1 s ILE 69 Cb -0.17 -4.17 -0.07 0.00 0.01 0.00 0.00 42.46 38.05 1na1 s ILE 69 CO 0.09 -0.50 1.22 -2.16 0.00 0.00 0.00 174.94 173.60 1na1 s PRO 70 N 2.87 3.69 -0.05 2.79 0.04 -1.26 -0.69 135.00 142.38 1na1 s PRO 70 Ca 0.25 1.92 0.02 0.00 0.04 0.00 0.00 61.00 63.23 1na1 s PRO 70 Cb -0.14 -2.44 0.02 0.00 0.04 0.00 0.00 34.50 31.98 1na1 s PRO 70 CO 0.18 -0.65 -0.08 -1.17 0.04 0.00 0.00 177.00 175.32 1na1 s LEU 71 N -3.00 1.47 -0.11 -3.56 2.96 -0.88 -4.89 118.68 110.65 1na1 s LEU 71 Ca 0.64 -0.20 -0.02 0.00 -0.22 0.00 0.00 54.13 54.32 1na1 s LEU 71 Cb -0.32 -0.61 -0.03 0.00 0.50 0.00 0.00 46.19 45.73 1na1 s LEU 71 CO 0.39 -0.02 -0.02 0.20 -1.32 0.00 0.00 176.35 175.58 1na1 s ASN 72 N 0.80 4.97 0.69 3.68 0.01 -1.26 -3.87 114.94 119.97 1na1 s ASN 72 Ca -0.13 0.00 -0.15 0.00 -0.71 0.00 0.00 52.86 51.87 1na1 s ASN 72 Cb -0.15 -1.56 0.02 0.00 0.41 0.00 0.00 41.25 39.97 1na1 s ASN 72 CO 0.02 0.28 1.17 0.00 -1.51 0.00 0.00 177.10 177.06 1na1 s ALA 73 N -0.32 2.28 -1.47 0.60 0.00 -1.26 -4.00 121.76 117.59 1na1 s ALA 73 Ca 0.06 0.76 -0.05 0.00 0.00 0.00 0.00 51.96 52.72 1na1 s ALA 73 Cb -0.12 -3.41 0.01 0.00 0.00 0.00 0.00 23.12 19.59 1na1 s ALA 73 CO 0.02 -1.59 0.18 0.09 0.00 0.00 0.00 175.76 174.46 1na1 n ASN 74 N -2.52 -0.11 -4.36 0.00 4.13 -0.73 -4.92 115.26 106.75 1na1 n ASN 74 Ca 0.12 -1.23 -0.30 0.00 1.68 0.00 0.00 54.58 54.85 1na1 n ASN 74 Cb 0.51 -1.88 -0.14 0.00 -1.54 0.00 0.00 39.78 36.73 1na1 n ASN 74 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1na1 s ARG 75 N -7.23 1.77 0.16 3.52 1.81 -1.26 -5.04 118.95 112.69 1na1 s ARG 75 Ca 0.08 -1.13 0.09 0.00 -1.72 0.00 0.00 55.73 53.05 1na1 s ARG 75 Cb -0.04 -1.98 -0.04 0.00 -0.45 0.00 0.00 34.95 32.43 1na1 s ARG 75 CO 0.98 0.51 -0.20 -1.14 -0.68 0.00 0.00 175.30 174.77 1na1 s GLN 76 N -1.35 1.30 0.00 3.54 0.74 -1.26 -4.39 119.66 118.24 1na1 s GLN 76 Ca 0.12 -1.40 0.00 0.00 0.05 0.00 0.00 55.36 54.13 1na1 s GLN 76 Cb -0.10 -1.44 0.00 0.00 1.10 0.00 0.00 33.01 32.57 1na1 s GLN 76 CO 0.03 0.30 0.00 0.09 -0.55 0.00 0.00 175.29 175.16 1na1 n ASN 77 N 0.38 0.00 -3.70 6.67 4.13 -1.26 -4.88 115.26 116.61 1na1 n ASN 77 Ca -0.14 0.00 -0.33 0.00 1.68 0.00 0.00 54.58 55.79 1na1 n ASN 77 Cb 0.56 0.00 0.03 0.00 -1.54 0.00 0.00 39.78 38.84 1na1 n ASN 77 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1na1 n GLU 78 N 0.00 0.00 -3.60 3.52 1.02 -1.26 -4.20 120.64 116.11 1na1 n GLU 78 Ca 0.00 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.77 1na1 n GLU 78 Cb 0.00 -0.92 -0.07 0.00 -0.02 0.00 0.00 31.44 30.44 1na1 n GLU 78 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1na1 s GLN 79 N -1.72 4.00 -0.08 3.49 0.74 -1.26 -1.70 119.66 123.14 1na1 s GLN 79 Ca 0.39 0.12 -0.11 0.00 0.05 0.00 0.00 55.36 55.81 1na1 s GLN 79 Cb -0.20 -3.33 -0.29 0.00 1.10 0.00 0.00 33.01 30.29 1na1 s GLN 79 CO 0.74 0.46 0.56 0.28 -0.55 0.00 0.00 175.29 176.79 1na1 h VAL 80 N 4.30 0.87 -2.24 1.34 2.07 -0.79 -3.49 116.25 118.30 1na1 h VAL 80 Ca -0.47 -2.44 0.20 0.00 0.82 0.00 0.00 66.70 64.81 1na1 h VAL 80 Cb 1.19 2.68 -0.08 0.00 -1.52 0.00 0.00 31.29 33.57 1na1 h VAL 80 CO 0.68 0.84 0.56 0.72 0.02 0.00 0.00 177.57 180.39 1na1 s PHE 81 N -2.55 -0.08 0.06 1.57 -0.71 -1.22 -4.90 117.98 110.16 1na1 s PHE 81 Ca -0.19 -0.22 -0.26 0.00 -1.04 0.00 0.00 56.93 55.22 1na1 s PHE 81 Cb 0.06 0.64 0.09 0.00 -1.21 0.00 0.00 43.02 42.59 1na1 s PHE 81 CO 0.81 -0.76 0.76 0.20 -1.34 0.00 0.00 175.22 174.89 1na1 s GLY 82 N -3.04 -0.53 -0.24 1.99 0.00 -1.26 -2.04 107.32 102.19 1na1 s GLY 82 Ca 0.14 0.80 -0.30 0.00 0.00 0.00 0.00 44.72 45.37 1na1 s GLY 82 CO 0.02 0.28 1.22 -1.08 0.00 0.00 0.00 173.10 173.54 1na1 s THR 83 N -3.34 0.00 0.96 0.90 -1.32 -0.54 -5.00 115.64 107.30 1na1 s THR 83 Ca 0.03 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.36 1na1 s THR 83 Cb -0.01 -1.00 0.18 0.00 -1.51 0.00 0.00 72.50 70.16 1na1 s THR 83 CO -0.10 0.00 1.23 0.54 -2.21 0.00 0.00 174.62 174.07 1na1 s ASN 84 N -1.05 3.10 -0.65 8.08 4.22 -1.26 -1.04 114.94 126.34 1na1 s ASN 84 Ca 0.05 0.56 0.03 0.00 -2.14 0.00 0.00 52.86 51.35 1na1 s ASN 84 Cb -0.01 -0.82 0.37 0.00 1.28 0.00 0.00 41.25 42.07 1na1 s ASN 84 CO -0.04 -2.77 1.39 0.18 -2.04 0.00 0.00 177.10 173.82 1na1 n LEU 85 N -3.84 5.69 -4.38 3.54 4.77 -0.63 -4.72 117.00 117.43 1na1 n LEU 85 Ca 0.12 -5.26 -0.45 0.00 -0.03 0.00 0.00 56.01 50.39 1na1 n LEU 85 Cb 0.60 -0.72 -0.01 0.00 -2.33 0.00 0.00 43.42 40.95 1na1 n LEU 85 CO 0.50 2.13 0.81 -0.36 -1.33 0.00 0.00 177.39 179.14 1na1 s PHE 86 N -3.76 3.74 -0.65 -1.77 0.08 -1.26 -4.20 117.98 110.16 1na1 s PHE 86 Ca 0.48 -2.11 0.04 0.00 0.12 0.00 0.00 56.93 55.46 1na1 s PHE 86 Cb 0.36 -4.00 0.21 0.00 -0.57 0.00 0.00 43.02 39.01 1na1 s PHE 86 CO -0.23 -1.15 1.03 0.44 -0.10 0.00 0.00 175.22 175.22 1na1 n ILE 87 N 4.01 1.44 -0.43 0.64 -5.35 -1.26 -0.89 119.36 117.52 1na1 n ILE 87 Ca 0.23 0.55 0.11 0.00 -0.27 0.00 0.00 62.75 63.37 1na1 n ILE 87 Cb 0.44 -1.55 0.33 0.00 -1.74 0.00 0.00 39.64 37.12 1na1 n ILE 87 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1na1 n GLY 88 N -1.38 2.58 0.00 3.28 0.00 -1.25 -4.22 105.19 104.21 1na1 n GLY 88 Ca -0.00 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1na1 n GLY 88 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1na1 n ASP 89 N 1.49 0.00 0.00 1.61 4.64 -0.07 -4.68 116.55 119.54 1na1 n ASP 89 Ca 0.24 -0.62 0.00 0.00 -1.38 0.00 0.00 54.79 53.03 1na1 n ASP 89 Cb 0.68 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.76 1na1 n ASP 89 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1na1 n GLY 90 N 0.00 1.55 0.31 0.27 0.00 -1.26 -1.69 105.19 104.37 1na1 n GLY 90 Ca 0.00 -0.44 0.07 0.00 0.00 0.00 0.00 46.02 45.65 1na1 n GLY 90 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1na1 h VAL 91 N 0.00 0.71 0.00 1.61 -1.51 -1.90 -2.46 116.25 112.70 1na1 h VAL 91 Ca 0.00 -0.21 -0.04 0.00 -1.23 0.00 0.00 66.70 65.22 1na1 h VAL 91 Cb 0.00 0.06 -0.01 0.00 -2.13 0.00 0.00 31.29 29.21 1na1 h VAL 91 CO 0.00 0.11 -0.21 -0.26 -1.23 0.00 0.00 177.57 175.98 1na1 h PHE 92 N 0.60 0.00 -1.28 5.19 -1.00 -1.77 -3.34 116.94 115.34 1na1 h PHE 92 Ca 0.47 0.00 0.37 0.00 2.81 0.00 0.00 57.97 61.62 1na1 h PHE 92 Cb 0.68 0.00 -0.08 0.00 3.61 0.00 0.00 35.95 40.15 1na1 h PHE 92 CO -0.10 0.21 0.87 -0.22 -1.61 0.00 0.00 178.31 177.46 1na1 h LYS 93 N 0.00 0.13 -0.02 1.51 3.64 -0.82 -0.71 116.57 120.31 1na1 h LYS 93 Ca -0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1na1 h LYS 93 Cb 0.41 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1na1 h LYS 93 CO 0.03 0.08 -0.44 0.25 -2.27 0.00 0.00 179.45 177.11 1na1 n THR 94 N -4.40 0.00 -1.47 1.00 -2.24 -1.25 -3.72 114.28 102.19 1na1 n THR 94 Ca 0.31 -0.27 -0.29 0.00 -2.27 0.00 0.00 64.05 61.52 1na1 n THR 94 Cb 1.29 1.23 0.12 0.00 -2.10 0.00 0.00 70.33 70.87 1na1 n THR 94 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1na1 s THR 95 N -2.45 2.48 0.20 4.28 -4.23 -0.27 -4.74 115.64 110.91 1na1 s THR 95 Ca 0.19 0.15 -0.11 0.00 -1.18 0.00 0.00 61.69 60.75 1na1 s THR 95 Cb 0.18 -2.85 0.13 0.00 1.34 0.00 0.00 72.50 71.31 1na1 s THR 95 CO 0.55 -0.20 1.83 0.25 -0.54 0.00 0.00 174.62 176.51 1na1 h LEU 96 N -1.39 0.85 0.87 4.79 5.85 -1.90 0.27 115.31 124.64 1na1 h LEU 96 Ca -0.50 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.12 1na1 h LEU 96 Cb 1.30 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.12 1na1 h LEU 96 CO 0.60 0.67 -0.49 0.25 -0.34 0.00 0.00 178.44 179.13 1na1 h LEU 97 N 0.96 -1.22 -0.66 2.25 5.85 -1.87 -0.79 115.31 119.84 1na1 h LEU 97 Ca 0.25 0.06 0.08 0.00 0.84 0.00 0.00 57.88 59.11 1na1 h LEU 97 Cb -0.02 0.34 -0.07 0.00 0.37 0.00 0.00 40.66 41.29 1na1 h LEU 97 CO -0.05 -0.78 0.32 1.23 -0.34 0.00 0.00 178.44 178.82 1na1 h GLY 98 N -1.26 0.96 0.59 3.75 0.00 -1.57 0.28 103.07 105.81 1na1 h GLY 98 Ca -0.12 -0.20 0.03 0.00 0.00 0.00 0.00 47.33 47.04 1na1 h GLY 98 CO 0.15 0.06 -0.13 -2.09 0.00 0.00 0.00 176.54 174.53 1na1 h GLU 99 N 0.56 -0.18 -0.20 4.80 4.57 -0.27 -1.28 114.58 122.58 1na1 h GLU 99 Ca 0.32 0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.44 1na1 h GLU 99 Cb 0.31 0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.94 1na1 h GLU 99 CO -0.25 -0.12 -0.13 0.82 -1.18 0.00 0.00 179.01 178.15 1na1 h ILE 100 N -0.19 1.32 -1.02 2.32 2.04 -0.65 -2.99 117.51 118.34 1na1 h ILE 100 Ca 0.07 -1.23 0.25 0.00 1.00 0.00 0.00 64.86 64.95 1na1 h ILE 100 Cb 0.29 1.69 -0.12 0.00 -0.74 0.00 0.00 36.82 37.94 1na1 h ILE 100 CO -0.18 0.37 0.62 0.58 0.00 0.00 0.00 178.15 179.54 1na1 h VAL 101 N 0.13 0.53 0.00 1.67 2.07 -0.26 0.23 116.25 120.62 1na1 h VAL 101 Ca 0.04 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1na1 h VAL 101 Cb 0.64 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1na1 h VAL 101 CO 0.04 0.10 0.00 0.00 0.02 0.00 0.00 177.57 177.72 1na1 n GLN 102 N -4.82 0.53 -0.07 1.57 6.02 -0.50 -1.39 117.38 118.72 1na1 n GLN 102 Ca 0.27 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.38 1na1 n GLN 102 Cb 0.78 -1.37 0.23 0.00 1.02 0.00 0.00 30.24 30.90 1na1 n GLN 102 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1na1 n TYR 103 N -0.87 0.19 -4.16 1.08 4.02 0.82 -4.16 117.16 114.08 1na1 n TYR 103 Ca 0.09 -0.09 -0.12 0.00 -0.01 0.00 0.00 57.90 57.77 1na1 n TYR 103 Cb 0.04 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.26 1na1 n TYR 103 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1na1 s TYR 104 N -1.81 0.91 -0.06 -0.72 1.51 -0.48 -0.44 117.35 116.26 1na1 s TYR 104 Ca 0.33 -0.79 -0.04 0.00 -1.01 0.00 0.00 57.07 55.57 1na1 s TYR 104 Cb 0.21 -0.52 -0.27 0.00 -0.11 0.00 0.00 41.96 41.27 1na1 s TYR 104 CO 0.31 -0.09 0.62 1.15 -1.11 0.00 0.00 175.55 176.42 1na1 h THR 105 N 3.32 0.88 -3.75 -0.71 2.02 0.33 -3.42 112.91 111.58 1na1 h THR 105 Ca -0.36 -2.56 -0.68 0.00 0.77 0.00 0.00 66.41 63.59 1na1 h THR 105 Cb 1.18 2.63 -0.19 0.00 -1.74 0.00 0.00 68.15 70.03 1na1 h THR 105 CO 0.58 0.82 -0.78 -1.00 0.37 0.00 0.00 175.52 175.51 1na1 s HIS 106 N -2.59 2.63 0.05 3.16 3.76 -0.27 -1.17 115.29 120.87 1na1 s HIS 106 Ca -0.15 -0.21 -0.03 0.00 -0.15 0.00 0.00 55.06 54.52 1na1 s HIS 106 Cb 0.06 -1.43 -0.03 0.00 1.11 0.00 0.00 32.58 32.30 1na1 s HIS 106 CO 0.82 0.35 0.02 1.67 -0.85 0.00 0.00 174.74 176.75 1na1 s TRP 107 N -1.08 0.41 -0.08 1.40 1.48 0.42 -1.56 118.94 119.93 1na1 s TRP 107 Ca 0.18 -0.90 -0.30 0.00 -1.06 0.00 0.00 56.10 54.02 1na1 s TRP 107 Cb -0.11 -0.30 0.10 0.00 -1.16 0.00 0.00 33.47 32.01 1na1 s TRP 107 CO 0.09 -0.39 0.86 0.45 -4.06 0.00 0.00 176.95 173.90 1na1 s SER 108 N -2.74 -0.47 0.00 -2.66 0.15 -0.80 -0.73 113.70 106.46 1na1 s SER 108 Ca 0.04 0.40 0.00 0.00 0.70 0.00 0.00 55.95 57.09 1na1 s SER 108 Cb 0.05 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.77 1na1 s SER 108 CO -0.09 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 174.45 1na1 n GLY 109 N 0.55 0.65 3.63 9.45 0.00 -1.26 -0.46 105.19 117.75 1na1 n GLY 109 Ca -0.13 -2.12 -0.32 0.00 0.00 0.00 0.00 46.02 43.45 1na1 n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1na1 s SER 110 N -3.33 4.82 0.07 1.61 0.01 -1.26 -3.77 113.70 111.84 1na1 s SER 110 Ca 0.00 -0.09 0.02 0.00 1.31 0.00 0.00 55.95 57.19 1na1 s SER 110 Cb 0.00 -1.18 -0.04 0.00 0.21 0.00 0.00 66.02 65.01 1na1 s SER 110 CO 0.00 0.28 0.12 -0.76 0.41 0.00 0.00 173.24 173.29 1na1 s LEU 111 N -1.47 3.97 -0.29 2.44 1.43 -1.05 -1.56 118.68 122.15 1na1 s LEU 111 Ca 0.18 0.08 -0.04 0.00 -1.03 0.00 0.00 54.13 53.32 1na1 s LEU 111 Cb -0.11 -2.61 0.03 0.00 0.03 0.00 0.00 46.19 43.52 1na1 s LEU 111 CO 0.09 0.18 0.01 -0.60 0.23 0.00 0.00 176.35 176.26 1na1 s ARG 112 N -2.39 2.77 -0.23 1.70 3.52 0.33 -0.40 118.95 124.24 1na1 s ARG 112 Ca 0.31 -1.05 -0.03 0.00 -0.13 0.00 0.00 55.73 54.83 1na1 s ARG 112 Cb -0.12 -3.20 0.00 0.00 -1.56 0.00 0.00 34.95 30.07 1na1 s ARG 112 CO 0.23 -0.50 -0.05 0.12 -0.81 0.00 0.00 175.30 174.29 1na1 s PHE 113 N 1.36 2.98 0.23 5.12 2.19 -0.21 -1.18 117.98 128.48 1na1 s PHE 113 Ca -0.01 -1.13 0.10 0.00 0.33 0.00 0.00 56.93 56.23 1na1 s PHE 113 Cb -0.18 -2.09 -0.04 0.00 -1.31 0.00 0.00 43.02 39.39 1na1 s PHE 113 CO -0.01 -0.61 -0.14 -1.12 1.83 0.00 0.00 175.22 175.17 1na1 s SER 114 N 1.43 3.94 -0.07 6.13 0.01 -0.69 -0.37 113.70 124.08 1na1 s SER 114 Ca 0.04 -0.79 -0.02 0.00 1.31 0.00 0.00 55.95 56.50 1na1 s SER 114 Cb -0.15 -0.52 0.03 0.00 0.21 0.00 0.00 66.02 65.59 1na1 s SER 114 CO -0.04 0.07 0.02 -0.76 0.41 0.00 0.00 173.24 172.94 1na1 s LEU 115 N -3.17 0.47 -0.20 2.44 1.02 -0.55 -0.70 118.68 117.99 1na1 s LEU 115 Ca 0.27 -0.09 -0.05 0.00 0.02 0.00 0.00 54.13 54.28 1na1 s LEU 115 Cb -0.07 -0.35 -0.02 0.00 0.02 0.00 0.00 46.19 45.76 1na1 s LEU 115 CO 0.15 -0.22 0.00 -0.32 0.02 0.00 0.00 176.35 175.98 1na1 s MET 116 N 2.03 3.62 0.16 1.70 -2.45 0.66 -1.68 119.30 123.34 1na1 s MET 116 Ca 0.05 -0.52 -0.28 0.00 -1.25 0.00 0.00 55.69 53.69 1na1 s MET 116 Cb -0.13 -3.09 -0.07 0.00 1.25 0.00 0.00 34.83 32.79 1na1 s MET 116 CO -0.05 0.00 0.86 -0.47 1.05 0.00 0.00 175.02 176.41 1na1 s TYR 117 N 1.02 3.89 0.00 4.11 6.14 -1.07 -1.41 117.35 130.03 1na1 s TYR 117 Ca 0.02 1.72 0.00 0.00 0.64 0.00 0.00 57.07 59.45 1na1 s TYR 117 Cb -0.14 -2.89 0.00 0.00 0.42 0.00 0.00 41.96 39.34 1na1 s TYR 117 CO 0.02 0.40 0.77 0.25 0.64 0.00 0.00 175.55 177.63 1na1 n THR 118 N 1.98 0.57 -1.19 4.34 -2.24 -0.96 -4.94 114.28 111.85 1na1 n THR 118 Ca -0.03 -0.76 -0.31 0.00 -2.27 0.00 0.00 64.05 60.69 1na1 n THR 118 Cb 0.49 0.74 0.11 0.00 -2.10 0.00 0.00 70.33 69.57 1na1 n THR 118 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1na1 s GLY 119 N -0.57 1.66 0.52 3.38 0.00 -1.26 -4.77 107.32 106.28 1na1 s GLY 119 Ca 0.00 0.18 -0.19 0.00 0.00 0.00 0.00 44.72 44.71 1na1 s GLY 119 CO 0.00 0.58 0.50 -1.55 0.00 0.00 0.00 173.10 172.63 1na1 n PRO 120 N -3.71 0.52 -0.25 2.90 -0.04 -1.26 -4.87 135.00 128.28 1na1 n PRO 120 Ca 0.08 0.20 0.01 0.00 -0.04 0.00 0.00 63.50 63.76 1na1 n PRO 120 Cb 0.54 -1.61 0.14 0.00 -0.04 0.00 0.00 33.50 32.52 1na1 n PRO 120 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1na1 h ALA 121 N 0.40 1.01 0.00 0.55 0.00 -2.01 -1.64 119.26 117.57 1na1 h ALA 121 Ca -0.44 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1na1 h ALA 121 Cb 1.40 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1na1 h ALA 121 CO 0.48 -0.01 0.00 1.28 0.00 0.00 0.00 179.25 181.00 1na1 n LEU 122 N -4.83 0.00 -5.00 0.00 4.77 -1.26 -4.78 117.00 105.90 1na1 n LEU 122 Ca 0.11 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.90 1na1 n LEU 122 Cb 0.26 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.39 1na1 n LEU 122 CO 0.26 0.00 0.30 -0.94 -1.33 0.00 0.00 177.39 175.68 1na1 s SER 123 N -1.35 5.29 0.17 -1.43 1.04 -0.62 -4.31 113.70 112.49 1na1 s SER 123 Ca 0.07 -0.32 -0.09 0.00 0.48 0.00 0.00 55.95 56.10 1na1 s SER 123 Cb 0.03 -0.54 -0.01 0.00 0.10 0.00 0.00 66.02 65.61 1na1 s SER 123 CO 0.06 -1.11 0.28 -0.94 0.98 0.00 0.00 173.24 172.51 1na1 s SER 124 N -4.47 0.05 0.00 7.02 1.04 -0.73 -4.98 113.70 111.63 1na1 s SER 124 Ca 0.58 -0.90 0.00 0.00 0.48 0.00 0.00 55.95 56.11 1na1 s SER 124 Cb -0.09 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1na1 s SER 124 CO 0.37 -0.90 0.00 0.00 0.98 0.00 0.00 173.24 173.69 1na1 n ALA 125 N -0.22 0.00 -3.67 5.32 0.00 -1.26 -1.12 120.51 119.56 1na1 n ALA 125 Ca -0.07 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.12 1na1 n ALA 125 Cb 0.63 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.91 1na1 n ALA 125 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1na1 s LYS 126 N -2.00 0.24 0.48 0.00 1.02 -1.26 -1.67 119.74 116.55 1na1 s LYS 126 Ca 0.00 -0.06 0.07 0.00 0.02 0.00 0.00 55.97 56.00 1na1 s LYS 126 Cb 0.00 -1.56 0.01 0.00 -0.52 0.00 0.00 37.83 35.75 1na1 s LYS 126 CO 0.00 -0.56 0.39 -0.51 -0.92 0.00 0.00 175.35 173.75 1na1 s LEU 127 N 2.06 3.04 -0.05 3.17 1.43 -0.86 0.63 118.68 128.10 1na1 s LEU 127 Ca 0.02 -1.01 -0.02 0.00 -1.03 0.00 0.00 54.13 52.09 1na1 s LEU 127 Cb -0.15 -1.58 0.03 0.00 0.03 0.00 0.00 46.19 44.53 1na1 s LEU 127 CO -0.07 -0.87 0.07 -0.51 0.23 0.00 0.00 176.35 175.20 1na1 s ILE 128 N -2.63 -0.13 -0.10 -0.59 2.07 -0.36 -1.07 121.20 118.39 1na1 s ILE 128 Ca 0.42 0.42 -0.12 0.00 -1.41 0.00 0.00 60.65 59.96 1na1 s ILE 128 Cb -0.02 -0.17 -0.05 0.00 0.13 0.00 0.00 42.46 42.35 1na1 s ILE 128 CO 0.25 0.18 0.28 -0.76 -1.91 0.00 0.00 174.94 172.98 1na1 s LEU 129 N 2.18 4.35 -0.00 8.50 1.02 -0.43 -1.18 118.68 133.13 1na1 s LEU 129 Ca 0.05 0.63 0.03 0.00 0.02 0.00 0.00 54.13 54.86 1na1 s LEU 129 Cb -0.12 -2.35 -0.01 0.00 0.02 0.00 0.00 46.19 43.73 1na1 s LEU 129 CO -0.03 0.25 -0.10 0.00 0.02 0.00 0.00 176.35 176.49 1na1 s ALA 130 N -0.41 0.82 -0.23 4.21 0.00 0.16 -0.49 121.76 125.83 1na1 s ALA 130 Ca 0.18 -0.47 -0.01 0.00 0.00 0.00 0.00 51.96 51.66 1na1 s ALA 130 Cb -0.14 -0.19 0.02 0.00 0.00 0.00 0.00 23.12 22.81 1na1 s ALA 130 CO 0.07 0.19 -0.09 -0.47 0.00 0.00 0.00 175.76 175.45 1na1 s TYR 131 N -0.34 2.98 -0.40 0.00 5.04 0.23 -1.48 117.35 123.38 1na1 s TYR 131 Ca 0.03 -1.48 -0.13 0.00 -2.44 0.00 0.00 57.07 53.05 1na1 s TYR 131 Cb -0.04 -2.03 0.03 0.00 0.35 0.00 0.00 41.96 40.27 1na1 s TYR 131 CO -0.00 -0.72 0.26 0.99 -1.34 0.00 0.00 175.55 174.74 1na1 s THR 132 N 1.34 4.91 0.65 4.34 2.01 0.17 -3.17 115.64 125.88 1na1 s THR 132 Ca 0.02 -0.80 -0.17 0.00 0.31 0.00 0.00 61.69 61.05 1na1 s THR 132 Cb -0.15 -3.75 -0.01 0.00 0.01 0.00 0.00 72.50 68.60 1na1 s THR 132 CO -0.06 -0.29 1.20 -2.16 -0.69 0.00 0.00 174.62 172.61 1na1 s PRO 133 N 1.61 2.66 0.67 4.92 0.04 -1.26 -0.39 135.00 143.25 1na1 s PRO 133 Ca 0.03 1.77 -0.17 0.00 0.04 0.00 0.00 61.00 62.67 1na1 s PRO 133 Cb -0.19 -1.90 -0.06 0.00 0.04 0.00 0.00 34.50 32.39 1na1 s PRO 133 CO 0.08 -1.44 0.46 -0.35 0.04 0.00 0.00 177.00 175.79 1na1 n PRO 134 N -2.07 0.35 0.00 0.56 -0.04 -1.26 -4.19 135.00 128.34 1na1 n PRO 134 Ca 0.13 0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 1na1 n PRO 134 Cb 0.50 -1.73 0.00 0.00 -0.04 0.00 0.00 33.50 32.23 1na1 n PRO 134 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1na1 n GLY 135 N 1.78 1.76 1.48 0.55 0.00 -1.26 -5.03 105.19 104.47 1na1 n GLY 135 Ca 0.10 -0.39 -0.12 0.00 0.00 0.00 0.00 46.02 45.61 1na1 n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1na1 n ALA 136 N 0.00 0.22 -1.95 4.61 0.00 -1.26 -5.16 120.51 116.97 1na1 n ALA 136 Ca 0.00 -0.92 -0.25 0.00 0.00 0.00 0.00 53.44 52.27 1na1 n ALA 136 Cb 0.00 0.57 0.08 0.00 0.00 0.00 0.00 19.45 20.10 1na1 n ALA 136 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1na1 s ARG 137 N -2.71 2.06 0.18 0.00 1.70 -1.26 -5.02 118.95 113.91 1na1 s ARG 137 Ca 0.05 -0.50 -0.30 0.00 -0.47 0.00 0.00 55.73 54.50 1na1 s ARG 137 Cb 0.00 -2.23 -0.09 0.00 -0.57 0.00 0.00 34.95 32.06 1na1 s ARG 137 CO 0.04 -1.26 1.34 0.20 -1.08 0.00 0.00 175.30 174.53 1na1 s GLY 138 N -4.56 2.34 0.32 3.88 0.00 -1.26 -4.92 107.32 103.11 1na1 s GLY 138 Ca 0.62 1.13 -0.28 0.00 0.00 0.00 0.00 44.72 46.18 1na1 s GLY 138 CO 0.44 2.15 1.27 -1.55 0.00 0.00 0.00 173.10 175.41 1na1 n PRO 139 N 2.90 2.01 0.00 2.90 -0.04 -1.26 -4.93 135.00 136.57 1na1 n PRO 139 Ca 0.07 0.70 0.10 0.00 -0.04 0.00 0.00 63.50 64.34 1na1 n PRO 139 Cb 0.42 -2.27 -0.01 0.00 -0.04 0.00 0.00 33.50 31.60 1na1 n PRO 139 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1na1 n GLN 140 N 0.79 1.28 -3.53 0.54 6.02 -1.26 -4.91 117.38 116.32 1na1 n GLN 140 Ca 0.06 -0.88 -0.11 0.00 -0.01 0.00 0.00 57.00 56.06 1na1 n GLN 140 Cb 0.35 -1.42 -0.03 0.00 1.02 0.00 0.00 30.24 30.16 1na1 n GLN 140 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 177.06 176.21 1na1 s ASP 141 N -2.36 -0.44 0.17 1.08 3.84 -1.26 -5.04 116.67 112.65 1na1 s ASP 141 Ca 0.16 -0.16 -0.16 0.00 -0.00 0.00 0.00 52.55 52.40 1na1 s ASP 141 Cb 0.17 0.58 0.11 0.00 -1.38 0.00 0.00 42.92 42.39 1na1 s ASP 141 CO 0.55 -0.97 1.69 -0.09 -0.00 0.00 0.00 175.17 176.34 1na1 h ARG 142 N 2.11 0.07 -0.69 2.11 2.43 -1.93 -2.20 114.38 116.27 1na1 h ARG 142 Ca -0.33 -0.00 0.14 0.00 -0.81 0.00 0.00 59.98 58.98 1na1 h ARG 142 Cb 1.29 -0.02 -0.13 0.00 -0.42 0.00 0.00 29.97 30.69 1na1 h ARG 142 CO 0.39 0.05 -0.15 -0.09 -1.51 0.00 0.00 179.97 178.66 1na1 h ARG 143 N 0.07 0.01 -0.22 0.20 2.43 -1.97 0.23 114.38 115.13 1na1 h ARG 143 Ca 0.20 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1na1 h ARG 143 Cb 0.29 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 1na1 h ARG 143 CO -0.36 0.01 0.09 1.49 -1.51 0.00 0.00 179.97 179.69 1na1 h GLU 144 N 0.01 0.33 -0.43 0.20 4.81 -1.83 -3.08 114.58 114.59 1na1 h GLU 144 Ca 0.34 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.49 1na1 h GLU 144 Cb 0.53 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 1na1 h GLU 144 CO -0.70 0.37 0.18 0.00 -0.73 0.00 0.00 179.01 178.13 1na1 h ALA 145 N 0.94 0.55 -0.26 2.92 0.00 -0.73 -2.83 119.26 119.86 1na1 h ALA 145 Ca 0.07 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 54.93 1na1 h ALA 145 Cb 0.16 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1na1 h ALA 145 CO -0.01 0.15 0.34 1.98 0.00 0.00 0.00 179.25 181.71 1na1 h MET 146 N 0.55 0.00 0.00 0.00 1.85 -0.51 -1.84 114.93 114.98 1na1 h MET 146 Ca 0.14 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.23 1na1 h MET 146 Cb 0.17 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.20 1na1 h MET 146 CO -0.01 0.00 0.00 1.28 -0.40 0.00 0.00 176.91 177.78 1na1 n LEU 147 N -3.57 0.00 0.00 3.39 4.77 -1.07 -4.80 117.00 115.72 1na1 n LEU 147 Ca 0.04 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.99 1na1 n LEU 147 Cb 0.48 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.56 1na1 n LEU 147 CO 0.25 0.00 -0.02 0.61 -1.33 0.00 0.00 177.39 176.90 1na1 n GLY 148 N 0.14 4.07 3.68 -0.72 0.00 -0.69 -5.06 105.19 106.61 1na1 n GLY 148 Ca 0.14 -2.06 -0.51 0.00 0.00 0.00 0.00 46.02 43.59 1na1 n GLY 148 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1na1 n THR 149 N -0.11 0.50 -4.02 2.61 -1.04 -1.19 -4.80 114.28 106.22 1na1 n THR 149 Ca -0.01 -0.11 -0.11 0.00 -2.04 0.00 0.00 64.05 61.78 1na1 n THR 149 Cb 0.06 -1.73 -0.04 0.00 -1.82 0.00 0.00 70.33 66.81 1na1 n THR 149 CO 0.00 0.00 0.00 -1.38 -0.64 0.00 0.00 175.07 173.05 1na1 s HIS 150 N 4.21 0.65 -0.06 -1.42 -0.00 -1.26 0.76 115.29 118.16 1na1 s HIS 150 Ca 0.95 -0.99 -0.03 0.00 -0.00 0.00 0.00 55.06 55.00 1na1 s HIS 150 Cb -0.78 0.13 0.04 0.00 -0.00 0.00 0.00 32.58 31.96 1na1 s HIS 150 CO 0.55 -1.10 0.13 0.08 -0.00 0.00 0.00 174.74 174.40 1na1 s VAL 151 N -3.44 -0.05 -0.39 -5.38 1.01 0.36 -4.99 120.40 107.53 1na1 s VAL 151 Ca 0.26 0.17 -0.17 0.00 0.00 0.00 0.00 61.98 62.23 1na1 s VAL 151 Cb -0.01 -0.22 0.01 0.00 0.00 0.00 0.00 36.38 36.16 1na1 s VAL 151 CO 0.14 0.07 0.45 -0.69 0.00 0.00 0.00 175.10 175.07 1na1 s VAL 152 N 1.07 5.07 -0.25 2.92 1.01 -1.26 -1.31 120.40 127.65 1na1 s VAL 152 Ca -0.08 -0.07 -0.15 0.00 0.00 0.00 0.00 61.98 61.68 1na1 s VAL 152 Cb -0.11 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 1na1 s VAL 152 CO -0.05 -0.32 0.36 0.86 0.00 0.00 0.00 175.10 175.95 1na1 s TRP 153 N 2.23 3.28 -0.31 5.22 -0.00 -0.23 -5.00 118.94 124.13 1na1 s TRP 153 Ca 0.14 0.44 -0.12 0.00 -0.00 0.00 0.00 56.10 56.56 1na1 s TRP 153 Cb -0.16 -2.54 -0.03 0.00 -0.00 0.00 0.00 33.47 30.73 1na1 s TRP 153 CO 0.14 -0.16 0.21 0.34 -0.00 0.00 0.00 176.95 177.47 1na1 s ASP 154 N 1.48 6.02 0.21 5.86 3.68 -1.26 -2.03 116.67 130.62 1na1 s ASP 154 Ca 0.15 -0.23 -0.30 0.00 2.13 0.00 0.00 52.55 54.30 1na1 s ASP 154 Cb -0.15 -2.12 -0.08 0.00 -1.45 0.00 0.00 42.92 39.11 1na1 s ASP 154 CO 0.09 -0.14 1.12 -0.63 0.13 0.00 0.00 175.17 175.74 1na1 s ILE 155 N 1.74 3.70 -0.44 4.11 1.01 -0.67 -4.94 121.20 125.71 1na1 s ILE 155 Ca 0.06 1.52 0.00 0.00 0.00 0.00 0.00 60.65 62.23 1na1 s ILE 155 Cb -0.17 -3.97 0.00 0.00 0.01 0.00 0.00 42.46 38.34 1na1 s ILE 155 CO 0.11 0.28 0.00 0.61 0.00 0.00 0.00 174.94 175.94 1na1 n GLY 156 N 1.86 -0.67 0.31 6.18 0.00 -1.26 -4.60 105.19 107.01 1na1 n GLY 156 Ca 0.02 -0.47 0.04 0.00 0.00 0.00 0.00 46.02 45.61 1na1 n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1na1 n LEU 157 N 0.00 -0.34 -4.56 0.99 0.00 -1.26 -3.52 117.00 108.31 1na1 n LEU 157 Ca 0.00 1.47 -0.43 0.00 0.00 0.00 0.00 56.01 57.05 1na1 n LEU 157 Cb 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 43.42 42.96 1na1 n LEU 157 CO 0.00 -1.40 0.91 -1.10 0.00 0.00 0.00 177.39 175.80 1na1 s GLN 158 N -6.04 3.49 0.30 1.96 1.11 -1.26 -4.92 119.66 114.30 1na1 s GLN 158 Ca -0.13 0.12 -0.01 0.00 0.01 0.00 0.00 55.36 55.35 1na1 s GLN 158 Cb 0.22 -4.00 0.47 0.00 -1.01 0.00 0.00 33.01 28.70 1na1 s GLN 158 CO 0.66 -1.50 1.94 0.66 0.01 0.00 0.00 175.29 177.06 1na1 h SER 159 N 9.35 0.86 -3.10 5.90 4.64 -1.93 -3.45 113.55 125.81 1na1 h SER 159 Ca -0.25 -0.06 -0.66 0.00 -0.47 0.00 0.00 61.79 60.36 1na1 h SER 159 Cb 1.07 -0.22 -0.10 0.00 -0.31 0.00 0.00 62.40 62.84 1na1 h SER 159 CO 1.12 0.68 -0.58 -0.89 -0.87 0.00 0.00 176.83 176.29 1na1 s THR 160 N -5.69 4.72 -0.11 2.95 2.01 -1.26 -2.60 115.64 115.66 1na1 s THR 160 Ca -0.11 -0.39 0.02 0.00 0.31 0.00 0.00 61.69 61.52 1na1 s THR 160 Cb 0.17 -3.15 -0.01 0.00 0.01 0.00 0.00 72.50 69.52 1na1 s THR 160 CO 0.79 0.37 -0.16 -0.51 -0.69 0.00 0.00 174.62 174.41 1na1 s ILE 161 N -1.18 2.78 -0.35 1.82 1.10 -0.68 -4.96 121.20 119.74 1na1 s ILE 161 Ca 0.22 -0.77 -0.04 0.00 -0.51 0.00 0.00 60.65 59.55 1na1 s ILE 161 Cb -0.12 -2.13 0.06 0.00 0.15 0.00 0.00 42.46 40.42 1na1 s ILE 161 CO 0.13 0.54 0.10 -0.69 -2.11 0.00 0.00 174.94 172.91 1na1 s VAL 162 N 0.20 3.39 -0.14 4.00 1.01 -1.26 -1.49 120.40 126.11 1na1 s VAL 162 Ca -0.10 -1.46 -0.06 0.00 0.00 0.00 0.00 61.98 60.36 1na1 s VAL 162 Cb -0.16 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 1na1 s VAL 162 CO 0.06 -0.29 0.07 -0.32 0.00 0.00 0.00 175.10 174.62 1na1 s MET 163 N 1.29 3.60 0.10 2.72 1.75 0.50 -4.96 119.30 124.30 1na1 s MET 163 Ca -0.00 -0.30 -0.09 0.00 -1.25 0.00 0.00 55.69 54.05 1na1 s MET 163 Cb -0.21 -3.12 -0.06 0.00 2.84 0.00 0.00 34.83 34.29 1na1 s MET 163 CO -0.00 0.52 0.41 0.99 -0.65 0.00 0.00 175.02 176.28 1na1 s THR 164 N -0.31 5.09 -0.87 10.11 2.01 -1.26 -1.05 115.64 129.36 1na1 s THR 164 Ca 0.09 0.40 -0.00 0.00 0.31 0.00 0.00 61.69 62.48 1na1 s THR 164 Cb -0.12 -3.64 0.22 0.00 0.01 0.00 0.00 72.50 68.97 1na1 s THR 164 CO 0.02 0.22 0.76 -0.38 -0.69 0.00 0.00 174.62 174.55 1na1 n ILE 165 N 0.69 2.87 -1.66 1.82 5.41 0.46 -4.94 119.36 124.01 1na1 n ILE 165 Ca -0.06 -5.10 -0.51 0.00 1.00 0.00 0.00 62.75 58.07 1na1 n ILE 165 Cb 0.52 -2.34 -0.06 0.00 -0.71 0.00 0.00 39.64 37.06 1na1 n ILE 165 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 1na1 n PRO 166 N 2.18 1.58 -1.48 0.38 -0.04 -1.26 -2.53 135.00 133.83 1na1 n PRO 166 Ca 0.22 0.58 -0.44 0.00 -0.04 0.00 0.00 63.50 63.82 1na1 n PRO 166 Cb 0.37 -2.30 -0.09 0.00 -0.04 0.00 0.00 33.50 31.43 1na1 n PRO 166 CO 0.00 0.00 0.00 1.87 -0.04 0.00 0.00 175.50 177.33 1na1 n TRP 167 N 4.28 1.11 -3.92 0.54 -0.00 -1.25 -4.86 117.44 113.35 1na1 n TRP 167 Ca 0.21 0.32 -0.32 0.00 -0.00 0.00 0.00 57.50 57.71 1na1 n TRP 167 Cb 0.22 -2.48 -0.13 0.00 -0.00 0.00 0.00 31.31 28.91 1na1 n TRP 167 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 1na1 s THR 168 N 9.19 2.72 0.12 5.87 2.01 -1.26 -5.00 115.64 129.29 1na1 s THR 168 Ca 1.18 -2.86 -0.18 0.00 0.31 0.00 0.00 61.69 60.14 1na1 s THR 168 Cb -0.89 -2.90 0.04 0.00 0.01 0.00 0.00 72.50 68.77 1na1 s THR 168 CO 0.44 -0.74 0.44 -0.55 -0.69 0.00 0.00 174.62 173.52 1na1 s SER 169 N 0.40 -0.30 -0.05 3.53 0.15 -1.26 -4.79 113.70 111.38 1na1 s SER 169 Ca 0.14 -0.22 -0.02 0.00 0.70 0.00 0.00 55.95 56.56 1na1 s SER 169 Cb -0.23 0.49 -0.01 0.00 -1.71 0.00 0.00 66.02 64.57 1na1 s SER 169 CO -0.03 -0.85 -0.03 1.23 1.20 0.00 0.00 173.24 174.75 1na1 h GLY 170 N 2.38 0.00 -3.37 9.45 0.00 -1.99 -3.45 103.07 106.09 1na1 h GLY 170 Ca -0.34 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.47 1na1 h GLY 170 CO 0.45 0.00 0.62 0.54 0.00 0.00 0.00 176.54 178.15 1na1 s VAL 171 N -1.36 2.57 -2.00 4.60 0.11 -1.26 -4.90 120.40 118.16 1na1 s VAL 171 Ca -0.03 0.50 0.16 0.00 -2.93 0.00 0.00 61.98 59.68 1na1 s VAL 171 Cb 0.00 -3.29 0.44 0.00 -1.53 0.00 0.00 36.38 32.01 1na1 s VAL 171 CO 0.04 0.07 1.56 0.00 -3.33 0.00 0.00 175.10 173.44 1na1 n GLN 172 N 0.04 0.94 -3.68 1.54 0.00 -1.26 -4.81 117.38 110.14 1na1 n GLN 172 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 57.00 56.90 1na1 n GLN 172 Cb 0.44 -1.26 -0.08 0.00 0.00 0.00 0.00 30.24 29.33 1na1 n GLN 172 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 1na1 s PHE 173 N -2.00 -0.49 0.29 2.61 0.08 -1.26 -4.76 117.98 112.45 1na1 s PHE 173 Ca 0.23 1.08 0.11 0.00 0.12 0.00 0.00 56.93 58.48 1na1 s PHE 173 Cb 0.11 0.21 -0.05 0.00 -0.57 0.00 0.00 43.02 42.71 1na1 s PHE 173 CO 0.18 -0.35 -0.16 1.03 -0.10 0.00 0.00 175.22 175.82 1na1 s ARG 174 N -0.31 1.77 0.16 0.44 0.52 0.10 -4.93 118.95 116.69 1na1 s ARG 174 Ca -0.05 -1.77 -0.18 0.00 -0.52 0.00 0.00 55.73 53.22 1na1 s ARG 174 Cb -0.03 -1.80 -0.07 0.00 0.52 0.00 0.00 34.95 33.56 1na1 s ARG 174 CO 0.03 0.29 0.63 0.71 0.02 0.00 0.00 175.30 176.99 1na1 s TYR 175 N -2.51 3.68 0.20 -0.53 1.51 -1.26 -0.43 117.35 118.00 1na1 s TYR 175 Ca 0.31 1.26 -0.03 0.00 -1.01 0.00 0.00 57.07 57.60 1na1 s TYR 175 Cb -0.04 -2.51 0.13 0.00 -0.11 0.00 0.00 41.96 39.43 1na1 s TYR 175 CO 0.16 0.43 1.52 1.79 -1.11 0.00 0.00 175.55 178.34 1na1 h THR 176 N 2.95 1.32 -3.31 -0.71 1.35 -1.39 -3.43 112.91 109.69 1na1 h THR 176 Ca -0.48 -1.76 -0.53 0.00 -0.55 0.00 0.00 66.41 63.09 1na1 h THR 176 Cb 1.20 1.73 0.02 0.00 -1.73 0.00 0.00 68.15 69.38 1na1 h THR 176 CO 0.65 0.55 0.63 -0.62 -0.25 0.00 0.00 175.52 176.48 1na1 s ASP 177 N -6.91 6.94 -0.18 5.36 3.68 -1.26 -3.77 116.67 120.54 1na1 s ASP 177 Ca -0.07 2.31 -0.33 0.00 2.13 0.00 0.00 52.55 56.59 1na1 s ASP 177 Cb 0.11 -2.60 -0.10 0.00 -1.45 0.00 0.00 42.92 38.88 1na1 s ASP 177 CO 0.84 -0.51 2.04 -2.65 0.13 0.00 0.00 175.17 175.02 1na1 n PRO 178 N 2.99 1.90 -4.13 4.34 -0.02 -1.26 -4.93 135.00 133.88 1na1 n PRO 178 Ca 0.07 0.63 -0.18 0.00 -2.02 0.00 0.00 63.50 62.00 1na1 n PRO 178 Cb 0.43 -2.75 -0.16 0.00 -0.02 0.00 0.00 33.50 31.01 1na1 n PRO 178 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1na1 s ASP 179 N 5.85 0.73 0.07 2.55 -1.08 -1.26 -5.09 116.67 118.44 1na1 s ASP 179 Ca 0.99 -0.10 -0.24 0.00 -0.52 0.00 0.00 52.55 52.68 1na1 s ASP 179 Cb -0.64 -0.28 -0.16 0.00 -1.46 0.00 0.00 42.92 40.38 1na1 s ASP 179 CO 0.47 -0.02 1.65 0.74 0.52 0.00 0.00 175.17 178.53 1na1 h THR 180 N 5.81 1.02 0.00 1.71 2.02 -1.99 -2.42 112.91 119.05 1na1 h THR 180 Ca -0.36 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.64 1na1 h THR 180 Cb 1.16 1.14 0.00 0.00 -1.74 0.00 0.00 68.15 68.71 1na1 h THR 180 CO 0.48 0.05 0.00 0.22 0.37 0.00 0.00 175.52 176.64 1na1 h TYR 181 N -0.13 0.00 -0.50 3.16 5.03 -2.01 -1.59 116.97 120.92 1na1 h TYR 181 Ca -0.01 0.00 -0.11 0.00 2.58 0.00 0.00 58.73 61.19 1na1 h TYR 181 Cb 0.12 0.00 -0.07 0.00 1.55 0.00 0.00 36.73 38.33 1na1 h TYR 181 CO -0.05 0.00 0.10 -2.37 -1.32 0.00 0.00 178.16 174.52 1na1 n THR 182 N -3.03 2.65 -2.01 1.81 5.66 -0.94 -5.02 114.28 113.40 1na1 n THR 182 Ca -0.03 -1.85 -0.38 0.00 -3.05 0.00 0.00 64.05 58.75 1na1 n THR 182 Cb 0.08 -0.31 0.02 0.00 -1.55 0.00 0.00 70.33 68.57 1na1 n THR 182 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1na1 s SER 183 N -1.52 5.68 0.02 1.09 1.04 -0.60 -4.58 113.70 114.82 1na1 s SER 183 Ca 0.49 2.54 0.22 0.00 0.48 0.00 0.00 55.95 59.68 1na1 s SER 183 Cb 0.40 -2.62 -0.05 0.00 0.10 0.00 0.00 66.02 63.85 1na1 s SER 183 CO 0.10 -1.27 0.95 0.00 0.98 0.00 0.00 173.24 174.00 1na1 n ALA 184 N -0.80 3.81 0.00 5.32 0.00 -1.26 -4.73 120.51 122.85 1na1 n ALA 184 Ca 0.09 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1na1 n ALA 184 Cb 0.47 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 19.03 1na1 n ALA 184 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1na1 n GLY 185 N 1.41 0.18 3.01 0.00 0.00 -1.26 -4.17 105.19 104.36 1na1 n GLY 185 Ca 0.02 -2.07 -0.10 0.00 0.00 0.00 0.00 46.02 43.88 1na1 n GLY 185 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1na1 s PHE 186 N 0.00 0.39 -0.08 1.61 0.08 0.48 -1.60 117.98 118.87 1na1 s PHE 186 Ca 0.00 -0.56 0.04 0.00 0.12 0.00 0.00 56.93 56.53 1na1 s PHE 186 Cb 0.00 -0.26 0.00 0.00 -0.57 0.00 0.00 43.02 42.19 1na1 s PHE 186 CO 0.00 -0.17 -0.20 -1.17 -0.10 0.00 0.00 175.22 173.57 1na1 s LEU 187 N -1.60 1.95 0.07 -0.37 2.96 -0.21 0.41 118.68 121.89 1na1 s LEU 187 Ca -0.13 -0.46 -0.07 0.00 -0.22 0.00 0.00 54.13 53.26 1na1 s LEU 187 Cb -0.09 -1.20 -0.01 0.00 0.50 0.00 0.00 46.19 45.40 1na1 s LEU 187 CO -0.01 0.14 0.13 -0.94 -1.32 0.00 0.00 176.35 174.36 1na1 s SER 188 N 0.28 0.19 0.00 3.68 1.04 -0.55 -1.46 113.70 116.88 1na1 s SER 188 Ca -0.13 -0.68 0.02 0.00 0.48 0.00 0.00 55.95 55.64 1na1 s SER 188 Cb -0.16 0.29 -0.01 0.00 0.10 0.00 0.00 66.02 66.25 1na1 s SER 188 CO 0.06 -0.66 -0.05 0.00 0.98 0.00 0.00 173.24 173.56 1na1 s TRP 190 N -0.25 1.52 -0.20 0.00 0.52 -0.33 -0.06 118.94 120.16 1na1 s TRP 190 Ca 0.01 -1.32 -0.22 0.00 0.02 0.00 0.00 56.10 54.59 1na1 s TRP 190 Cb -0.03 -0.83 -0.02 0.00 -1.15 0.00 0.00 33.47 31.45 1na1 s TRP 190 CO -0.00 -0.49 0.69 0.71 0.02 0.00 0.00 176.95 177.88 1na1 s TYR 191 N -3.72 3.37 -0.02 -1.98 1.51 -0.69 -1.22 117.35 114.60 1na1 s TYR 191 Ca 0.37 1.01 -0.20 0.00 -1.01 0.00 0.00 57.07 57.23 1na1 s TYR 191 Cb 0.06 -2.87 -0.32 0.00 -0.11 0.00 0.00 41.96 38.72 1na1 s TYR 191 CO 0.16 -0.22 0.94 0.37 -1.11 0.00 0.00 175.55 175.69 1na1 h GLN 192 N 7.50 0.38 0.00 -0.62 5.75 -0.06 -3.34 115.11 124.72 1na1 h GLN 192 Ca -0.30 -0.63 0.00 0.00 -0.15 0.00 0.00 58.65 57.57 1na1 h GLN 192 Cb 1.13 0.23 0.00 0.00 1.07 0.00 0.00 27.48 29.91 1na1 h GLN 192 CO 0.79 1.29 0.00 0.25 -2.65 0.00 0.00 178.83 178.52 1na1 n THR 193 N -4.02 0.00 0.00 2.39 -2.24 -0.90 -4.87 114.28 104.65 1na1 n THR 193 Ca -0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1na1 n THR 193 Cb 0.89 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 1na1 n THR 193 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1na1 n SER 194 N -0.68 0.00 -4.71 3.42 3.41 -1.26 -4.51 113.62 109.29 1na1 n SER 194 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 1na1 n SER 194 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1na1 n SER 194 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1na1 s LEU 195 N 0.00 4.36 -0.10 1.04 2.96 -1.26 -4.36 118.68 121.33 1na1 s LEU 195 Ca 0.00 1.97 0.04 0.00 -0.22 0.00 0.00 54.13 55.92 1na1 s LEU 195 Cb 0.00 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.11 1na1 s LEU 195 CO 0.00 -0.46 -0.24 -0.63 -1.32 0.00 0.00 176.35 173.70 1na1 s ILE 196 N 1.15 2.02 0.23 6.68 -1.09 -0.27 -1.78 121.20 128.13 1na1 s ILE 196 Ca 0.58 -1.00 0.06 0.00 -2.23 0.00 0.00 60.65 58.06 1na1 s ILE 196 Cb -0.28 -1.74 -0.03 0.00 -1.58 0.00 0.00 42.46 38.82 1na1 s ILE 196 CO 0.29 0.55 0.23 -0.76 -1.23 0.00 0.00 174.94 174.02 1na1 s LEU 197 N 0.33 3.97 0.76 2.97 1.43 -1.26 -1.77 118.68 125.09 1na1 s LEU 197 Ca -0.18 -0.13 -0.06 0.00 -1.03 0.00 0.00 54.13 52.73 1na1 s LEU 197 Cb -0.18 -2.52 0.11 0.00 0.03 0.00 0.00 46.19 43.64 1na1 s LEU 197 CO 0.08 -0.02 1.06 -2.16 0.23 0.00 0.00 176.35 175.54 1na1 s PRO 198 N -3.70 1.68 0.89 1.29 0.04 -1.26 -4.98 135.00 128.95 1na1 s PRO 198 Ca 0.33 -0.65 -0.10 0.00 0.04 0.00 0.00 61.00 60.62 1na1 s PRO 198 Cb -0.09 -2.18 0.13 0.00 0.04 0.00 0.00 34.50 32.40 1na1 s PRO 198 CO 0.26 -1.54 1.13 -2.14 0.04 0.00 0.00 177.00 174.75 1na1 s PRO 199 N -5.32 1.27 -0.73 0.56 0.02 -1.26 -2.60 135.00 126.95 1na1 s PRO 199 Ca 0.65 1.46 0.00 0.00 0.02 0.00 0.00 61.00 63.13 1na1 s PRO 199 Cb -0.07 -1.76 0.00 0.00 0.02 0.00 0.00 34.50 32.69 1na1 s PRO 199 CO 0.46 -2.43 0.00 0.39 -0.33 0.00 0.00 177.00 175.09 1na1 n GLU 200 N -4.09 -1.73 -4.56 5.54 -0.58 -1.26 -4.92 120.64 109.05 1na1 n GLU 200 Ca 0.11 0.63 -0.33 0.00 -0.42 0.00 0.00 57.16 57.15 1na1 n GLU 200 Cb 0.52 -4.78 -0.15 0.00 -0.57 0.00 0.00 31.44 26.47 1na1 n GLU 200 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1na1 s THR 201 N -1.45 2.94 0.10 2.62 2.01 -1.07 -5.11 115.64 115.67 1na1 s THR 201 Ca 0.00 -0.68 0.03 0.00 0.31 0.00 0.00 61.69 61.34 1na1 s THR 201 Cb 0.00 -2.25 -0.04 0.00 0.01 0.00 0.00 72.50 70.22 1na1 s THR 201 CO 0.00 0.51 -0.08 0.28 -0.69 0.00 0.00 174.62 174.64 1na1 s THR 202 N 0.68 0.80 0.00 -0.82 -1.32 -1.26 -4.74 115.64 108.98 1na1 s THR 202 Ca -0.06 -1.76 0.00 0.00 -1.21 0.00 0.00 61.69 58.66 1na1 s THR 202 Cb -0.15 -1.48 0.00 0.00 -1.51 0.00 0.00 72.50 69.36 1na1 s THR 202 CO 0.02 -0.71 0.00 0.61 -2.21 0.00 0.00 174.62 172.33 1na1 n GLY 203 N 0.30 0.94 3.39 6.08 0.00 -1.26 -4.99 105.19 109.65 1na1 n GLY 203 Ca -0.14 -1.61 -0.32 0.00 0.00 0.00 0.00 46.02 43.94 1na1 n GLY 203 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1na1 s GLN 204 N 0.00 2.77 0.07 1.61 0.74 -1.26 -4.73 119.66 118.87 1na1 s GLN 204 Ca 0.00 -0.75 0.04 0.00 0.05 0.00 0.00 55.36 54.70 1na1 s GLN 204 Cb 0.00 -2.39 -0.04 0.00 1.10 0.00 0.00 33.01 31.68 1na1 s GLN 204 CO 0.00 0.44 0.00 0.14 -0.55 0.00 0.00 175.29 175.32 1na1 s VAL 205 N -0.25 4.05 0.26 1.34 -7.23 -1.25 -5.02 120.40 112.29 1na1 s VAL 205 Ca 0.01 -0.91 0.11 0.00 -1.81 0.00 0.00 61.98 59.37 1na1 s VAL 205 Cb -0.13 -2.91 -0.05 0.00 0.56 0.00 0.00 36.38 33.85 1na1 s VAL 205 CO 0.03 0.17 -0.18 -0.31 -0.31 0.00 0.00 175.10 174.50 1na1 s TYR 206 N -1.27 2.14 0.02 2.82 1.51 -1.26 -2.08 117.35 119.23 1na1 s TYR 206 Ca 0.25 -0.41 0.08 0.00 -1.01 0.00 0.00 57.07 55.97 1na1 s TYR 206 Cb -0.12 -0.97 -0.03 0.00 -0.11 0.00 0.00 41.96 40.74 1na1 s TYR 206 CO 0.17 0.61 -0.23 -0.51 -1.11 0.00 0.00 175.55 174.48 1na1 s LEU 207 N -3.46 2.35 -0.14 -1.29 1.43 0.13 -2.25 118.68 115.44 1na1 s LEU 207 Ca 0.28 -0.48 -0.02 0.00 -1.03 0.00 0.00 54.13 52.88 1na1 s LEU 207 Cb -0.03 -1.40 -0.02 0.00 0.03 0.00 0.00 46.19 44.77 1na1 s LEU 207 CO 0.13 0.28 -0.07 -0.76 0.23 0.00 0.00 176.35 176.15 1na1 s LEU 208 N -1.16 3.06 -0.01 1.79 1.02 -0.50 -1.34 118.68 121.54 1na1 s LEU 208 Ca 0.12 -0.19 0.03 0.00 0.02 0.00 0.00 54.13 54.12 1na1 s LEU 208 Cb -0.10 -1.72 -0.03 0.00 0.02 0.00 0.00 46.19 44.36 1na1 s LEU 208 CO 0.02 0.19 -0.08 -0.94 0.02 0.00 0.00 176.35 175.56 1na1 s SER 209 N 0.24 4.49 0.18 2.29 1.04 -1.26 -0.24 113.70 120.45 1na1 s SER 209 Ca -0.05 -0.16 0.08 0.00 0.48 0.00 0.00 55.95 56.30 1na1 s SER 209 Cb -0.14 -1.02 -0.04 0.00 0.10 0.00 0.00 66.02 64.91 1na1 s SER 209 CO 0.04 0.30 -0.17 -0.36 0.98 0.00 0.00 173.24 174.03 1na1 s PHE 210 N -0.94 1.77 -0.01 5.02 0.40 0.12 -1.02 117.98 123.33 1na1 s PHE 210 Ca 0.16 -0.51 0.01 0.00 -0.60 0.00 0.00 56.93 55.98 1na1 s PHE 210 Cb -0.11 -0.86 0.00 0.00 0.51 0.00 0.00 43.02 42.57 1na1 s PHE 210 CO 0.06 0.35 -0.01 -1.50 0.70 0.00 0.00 175.22 174.81 1na1 s ILE 211 N -2.44 0.15 0.18 0.64 1.10 -0.84 -1.71 121.20 118.28 1na1 s ILE 211 Ca 0.19 -0.05 -0.23 0.00 -0.51 0.00 0.00 60.65 60.05 1na1 s ILE 211 Cb -0.04 -0.15 0.06 0.00 0.15 0.00 0.00 42.46 42.48 1na1 s ILE 211 CO 0.07 0.06 0.63 -0.94 -2.11 0.00 0.00 174.94 172.65 1na1 s SER 212 N 0.13 -0.50 0.19 4.50 1.04 -0.32 -2.71 113.70 116.03 1na1 s SER 212 Ca -0.01 -0.14 -0.02 0.00 0.48 0.00 0.00 55.95 56.26 1na1 s SER 212 Cb -0.03 0.62 -0.05 0.00 0.10 0.00 0.00 66.02 66.67 1na1 s SER 212 CO -0.00 -1.05 0.40 0.00 0.98 0.00 0.00 173.24 173.57 1na1 s ALA 213 N -3.77 3.80 0.51 5.32 0.00 0.09 0.12 121.76 127.83 1na1 s ALA 213 Ca 0.03 -0.71 -0.02 0.00 0.00 0.00 0.00 51.96 51.26 1na1 s ALA 213 Cb -0.02 -2.07 0.00 0.00 0.00 0.00 0.00 23.12 21.04 1na1 s ALA 213 CO -0.08 0.50 0.77 0.00 0.00 0.00 0.00 175.76 176.94 1na1 n PRO 215 N -2.30 0.04 -0.10 0.00 -0.04 -1.26 -1.34 135.00 130.00 1na1 n PRO 215 Ca 0.03 0.28 -0.09 0.00 -0.04 0.00 0.00 63.50 63.67 1na1 n PRO 215 Cb 0.58 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.52 1na1 n PRO 215 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1na1 h ASP 216 N 0.00 0.40 -1.02 3.54 3.58 -1.91 -3.47 116.42 117.55 1na1 h ASP 216 Ca 0.00 -0.08 -0.66 0.00 0.42 0.00 0.00 57.03 56.71 1na1 h ASP 216 Cb 0.03 -0.10 0.11 0.00 1.72 0.00 0.00 39.33 41.09 1na1 h ASP 216 CO 0.00 0.36 -0.54 0.33 -2.88 0.00 0.00 179.24 176.51 1na1 n PHE 217 N -4.80 -0.54 -3.91 0.28 7.35 -0.45 -4.64 117.46 110.74 1na1 n PHE 217 Ca -0.01 0.95 -0.11 0.00 -0.76 0.00 0.00 57.45 57.52 1na1 n PHE 217 Cb 0.07 -1.94 -0.12 0.00 0.35 0.00 0.00 39.48 37.84 1na1 n PHE 217 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 1na1 s LYS 218 N -0.99 0.21 -0.03 -4.13 1.02 0.39 -4.96 119.74 111.24 1na1 s LYS 218 Ca 0.63 -0.29 -0.04 0.00 0.02 0.00 0.00 55.97 56.30 1na1 s LYS 218 Cb -0.91 0.08 0.01 0.00 -0.52 0.00 0.00 37.83 36.48 1na1 s LYS 218 CO 0.56 -0.04 0.10 -0.51 -0.92 0.00 0.00 175.35 174.54 1na1 s LEU 219 N -0.78 1.64 0.16 3.17 1.02 -1.26 -1.90 118.68 120.73 1na1 s LEU 219 Ca -0.09 0.14 -0.21 0.00 0.02 0.00 0.00 54.13 53.99 1na1 s LEU 219 Cb -0.05 0.36 0.06 0.00 0.02 0.00 0.00 46.19 46.58 1na1 s LEU 219 CO -0.00 -0.08 0.57 0.00 0.02 0.00 0.00 176.35 176.86 1na1 s ARG 220 N -0.14 1.29 -0.21 1.70 1.70 -0.60 -5.00 118.95 117.68 1na1 s ARG 220 Ca -0.02 -0.56 -0.07 0.00 -0.47 0.00 0.00 55.73 54.61 1na1 s ARG 220 Cb -0.02 0.57 0.01 0.00 -0.57 0.00 0.00 34.95 34.94 1na1 s ARG 220 CO 0.00 -0.56 0.27 -0.11 -1.08 0.00 0.00 175.30 173.82 1na1 n LEU 221 N -0.36 -5.08 -4.76 -1.89 0.00 -1.26 -1.11 117.00 102.54 1na1 n LEU 221 Ca -0.16 0.34 -0.39 0.00 0.00 0.00 0.00 56.01 55.80 1na1 n LEU 221 Cb 0.64 -2.24 0.03 0.00 0.00 0.00 0.00 43.42 41.86 1na1 n LEU 221 CO 0.13 -1.28 1.04 -0.32 0.00 0.00 0.00 177.39 176.96 1na1 s MET 222 N -1.70 3.43 0.21 1.96 -2.45 -1.26 0.13 119.30 119.62 1na1 s MET 222 Ca 0.11 2.36 -0.20 0.00 -1.25 0.00 0.00 55.69 56.71 1na1 s MET 222 Cb -0.03 -2.48 0.04 0.00 1.25 0.00 0.00 34.83 33.61 1na1 s MET 222 CO 0.40 -1.00 0.61 -1.59 1.05 0.00 0.00 175.02 174.48 1na1 s LYS 223 N -2.66 1.48 0.56 4.11 0.00 0.42 -4.81 119.74 118.84 1na1 s LYS 223 Ca 0.66 -0.79 -0.18 0.00 0.00 0.00 0.00 55.97 55.66 1na1 s LYS 223 Cb -0.43 0.57 -0.05 0.00 0.00 0.00 0.00 37.83 37.92 1na1 s LYS 223 CO 0.53 -0.65 1.09 -0.51 0.00 0.00 0.00 175.35 175.80 1na1 s ASP 224 N -2.85 5.81 0.12 0.03 1.11 -1.26 -4.39 116.67 115.24 1na1 s ASP 224 Ca 0.07 2.00 0.00 0.00 0.18 0.00 0.00 52.55 54.81 1na1 s ASP 224 Cb -0.03 -2.56 -0.04 0.00 1.07 0.00 0.00 42.92 41.36 1na1 s ASP 224 CO -0.03 -1.15 0.27 0.28 1.18 0.00 0.00 175.17 175.73 1na1 s THR 225 N -2.06 5.32 -1.84 -1.27 -1.32 -1.26 -4.87 115.64 108.34 1na1 s THR 225 Ca 0.68 -0.47 0.09 0.00 -1.21 0.00 0.00 61.69 60.79 1na1 s THR 225 Cb -0.20 -3.69 0.27 0.00 -1.51 0.00 0.00 72.50 67.38 1na1 s THR 225 CO 0.29 0.00 1.19 0.00 -2.21 0.00 0.00 174.62 173.90 1na1 n GLN 226 N -0.17 1.79 -0.63 7.08 6.02 -1.26 -4.08 117.38 126.13 1na1 n GLN 226 Ca -0.05 -1.08 0.09 0.00 -0.01 0.00 0.00 57.00 55.95 1na1 n GLN 226 Cb 0.53 -1.30 0.36 0.00 1.02 0.00 0.00 30.24 30.85 1na1 n GLN 226 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1na1 n THR 227 N 0.35 1.84 -3.58 5.09 -2.24 -1.26 -4.97 114.28 109.51 1na1 n THR 227 Ca 0.10 -1.17 -0.16 0.00 -2.27 0.00 0.00 64.05 60.55 1na1 n THR 227 Cb 0.29 0.10 -0.07 0.00 -2.10 0.00 0.00 70.33 68.56 1na1 n THR 227 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1na1 s ILE 228 N -1.87 0.00 0.14 2.28 -1.16 -1.26 -5.18 121.20 114.16 1na1 s ILE 228 Ca 0.51 -0.01 -0.25 0.00 -0.51 0.00 0.00 60.65 60.39 1na1 s ILE 228 Cb 0.33 -0.98 0.07 0.00 0.61 0.00 0.00 42.46 42.49 1na1 s ILE 228 CO 0.24 -0.01 0.99 -0.94 -2.81 0.00 0.00 174.94 172.42 1na1 s SER 229 N -0.51 -0.16 0.04 4.50 1.04 -1.26 -4.97 113.70 112.39 1na1 s SER 229 Ca -0.06 -0.40 -0.23 0.00 0.48 0.00 0.00 55.95 55.74 1na1 s SER 229 Cb -0.02 0.46 0.05 0.00 0.10 0.00 0.00 66.02 66.61 1na1 s SER 229 CO 0.06 -0.86 0.54 0.00 0.98 0.00 0.00 173.24 173.96 1na1 s GLN 230 N -3.17 1.05 -0.22 4.02 -2.07 -1.26 -5.07 119.66 112.94 1na1 s GLN 230 Ca 0.13 -0.20 0.13 0.00 -1.82 0.00 0.00 55.36 53.60 1na1 s GLN 230 Cb -0.01 0.48 -0.23 0.00 -1.09 0.00 0.00 33.01 32.16 1na1 s GLN 230 CO 0.02 -0.38 -0.02 0.25 -1.32 0.00 0.00 175.29 173.84 1na1 n THR 231 N 0.42 1.42 -4.06 3.63 -2.24 -1.26 -5.00 114.28 107.19 1na1 n THR 231 Ca -0.18 -0.77 -0.09 0.00 -2.27 0.00 0.00 64.05 60.74 1na1 n THR 231 Cb 0.60 -0.74 -0.10 0.00 -2.10 0.00 0.00 70.33 67.99 1na1 n THR 231 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1na1 s VAL 232 N -2.50 0.26 0.34 2.28 -7.23 -1.26 -5.13 120.40 107.17 1na1 s VAL 232 Ca -0.17 -1.44 -0.29 0.00 -1.81 0.00 0.00 61.98 58.27 1na1 s VAL 232 Cb 0.07 -1.01 -0.11 0.00 0.56 0.00 0.00 36.38 35.88 1na1 s VAL 232 CO 0.76 -0.76 1.53 0.00 -0.31 0.00 0.00 175.10 176.32 1na1 n ALA 233 N 0.73 2.45 -1.60 1.32 0.00 -1.26 -4.95 120.51 117.21 1na1 n ALA 233 Ca -0.18 0.35 -0.33 0.00 0.00 0.00 0.00 53.44 53.28 1na1 n ALA 233 Cb 0.58 -2.44 0.03 0.00 0.00 0.00 0.00 19.45 17.62 1na1 n ALA 233 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1na1 s LEU 234 N -1.43 3.47 0.14 0.00 1.43 -1.26 -5.06 118.68 115.97 1na1 s LEU 234 Ca 0.57 1.96 0.06 0.00 -1.03 0.00 0.00 54.13 55.69 1na1 s LEU 234 Cb -0.48 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.15 1na1 s LEU 234 CO 0.58 -1.42 -0.13 0.42 0.23 0.00 0.00 176.35 176.03 1na1 s THR 235 N -2.30 1.31 -2.00 5.49 -4.23 -1.26 -5.28 115.64 107.38 1na1 s THR 235 Ca 0.67 -1.89 0.20 0.00 -1.18 0.00 0.00 61.69 59.49 1na1 s THR 235 Cb -0.19 -1.69 0.58 0.00 1.34 0.00 0.00 72.50 72.53 1na1 s THR 235 CO 0.38 -0.55 1.59 1.21 -0.54 0.00 0.00 174.62 176.71