#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b66 s ARG 8 N 0.00 1.75 0.39 1.47 0.52 -1.26 -5.12 118.95 116.70 1b66 s ARG 8 Ca 0.00 -1.04 -0.26 0.00 -0.52 0.00 0.00 55.73 53.91 1b66 s ARG 8 Cb 0.00 -1.87 -0.09 0.00 0.52 0.00 0.00 34.95 33.51 1b66 s ARG 8 CO 0.00 0.49 1.24 1.03 0.02 0.00 0.00 175.30 178.07 1b66 s ARG 9 N -1.11 4.06 -0.02 3.54 0.52 -1.26 -4.82 118.95 119.86 1b66 s ARG 9 Ca 0.10 2.01 0.01 0.00 -0.52 0.00 0.00 55.73 57.34 1b66 s ARG 9 Cb -0.10 -2.77 -0.03 0.00 0.52 0.00 0.00 34.95 32.57 1b66 s ARG 9 CO 0.01 -0.36 -0.02 1.03 0.02 0.00 0.00 175.30 175.98 1b66 s ARG 10 N -2.19 2.76 0.21 3.54 0.52 -1.26 -0.15 118.95 122.38 1b66 s ARG 10 Ca 0.56 -0.60 -0.06 0.00 -0.52 0.00 0.00 55.73 55.10 1b66 s ARG 10 Cb -0.35 -2.64 -0.02 0.00 0.52 0.00 0.00 34.95 32.46 1b66 s ARG 10 CO 0.44 0.64 0.28 0.00 0.02 0.00 0.00 175.30 176.68 1b66 s ALA 11 N -1.01 0.49 -0.12 2.13 0.00 -0.31 -4.92 121.76 118.02 1b66 s ALA 11 Ca 0.17 -1.29 -0.01 0.00 0.00 0.00 0.00 51.96 50.83 1b66 s ALA 11 Cb -0.11 1.20 -0.02 0.00 0.00 0.00 0.00 23.12 24.18 1b66 s ALA 11 CO 0.07 -0.70 -0.09 1.03 0.00 0.00 0.00 175.76 176.08 1b66 s ARG 12 N -4.08 3.30 -0.13 0.00 0.52 -1.26 -2.23 118.95 115.07 1b66 s ARG 12 Ca 0.30 -0.60 0.03 0.00 -0.52 0.00 0.00 55.73 54.93 1b66 s ARG 12 Cb 0.04 -2.70 0.01 0.00 0.52 0.00 0.00 34.95 32.81 1b66 s ARG 12 CO 0.09 0.34 -0.22 -1.17 0.02 0.00 0.00 175.30 174.36 1b66 s LEU 13 N 0.06 2.12 0.07 2.53 2.96 0.19 -4.97 118.68 121.64 1b66 s LEU 13 Ca -0.03 -0.59 0.09 0.00 -0.22 0.00 0.00 54.13 53.38 1b66 s LEU 13 Cb -0.14 -1.44 -0.03 0.00 0.50 0.00 0.00 46.19 45.08 1b66 s LEU 13 CO 0.04 0.09 -0.23 -0.44 -1.32 0.00 0.00 176.35 174.49 1b66 s SER 14 N 0.74 2.81 -0.00 3.68 0.01 -1.26 -0.68 113.70 119.00 1b66 s SER 14 Ca -0.09 -0.60 0.02 0.00 1.31 0.00 0.00 55.95 56.59 1b66 s SER 14 Cb -0.16 -0.22 -0.01 0.00 0.21 0.00 0.00 66.02 65.84 1b66 s SER 14 CO -0.00 0.18 -0.07 -0.60 0.41 0.00 0.00 173.24 173.15 1b66 s ARG 15 N -1.44 0.59 0.04 12.44 3.52 -0.81 -4.98 118.95 128.30 1b66 s ARG 15 Ca 0.10 -0.28 0.04 0.00 -0.13 0.00 0.00 55.73 55.46 1b66 s ARG 15 Cb -0.10 -0.56 -0.04 0.00 -1.56 0.00 0.00 34.95 32.70 1b66 s ARG 15 CO 0.03 0.15 -0.05 -1.17 -0.81 0.00 0.00 175.30 173.45 1b66 s LEU 16 N -0.22 3.23 0.05 -0.88 0.20 -1.26 -1.52 118.68 118.28 1b66 s LEU 16 Ca 0.02 -0.18 -0.12 0.00 0.69 0.00 0.00 54.13 54.54 1b66 s LEU 16 Cb -0.03 -1.91 0.01 0.00 -0.43 0.00 0.00 46.19 43.84 1b66 s LEU 16 CO -0.00 0.24 0.26 0.68 -0.29 0.00 0.00 176.35 177.24 1b66 s VAL 17 N -1.10 0.10 0.04 1.68 -7.23 -0.52 -4.99 120.40 108.37 1b66 s VAL 17 Ca 0.20 -0.79 0.05 0.00 -1.81 0.00 0.00 61.98 59.63 1b66 s VAL 17 Cb -0.11 -0.95 -0.02 0.00 0.56 0.00 0.00 36.38 35.86 1b66 s VAL 17 CO 0.11 -0.43 -0.13 -0.94 -0.31 0.00 0.00 175.10 173.39 1b66 s SER 18 N -2.12 1.55 0.07 4.85 1.04 -1.26 -0.22 113.70 117.62 1b66 s SER 18 Ca -0.04 -0.46 0.02 0.00 0.48 0.00 0.00 55.95 55.95 1b66 s SER 18 Cb -0.01 -0.09 -0.03 0.00 0.10 0.00 0.00 66.02 65.99 1b66 s SER 18 CO -0.04 0.01 -0.08 0.72 0.98 0.00 0.00 173.24 174.83 1b66 s PHE 19 N -0.89 0.81 -0.17 5.02 -0.71 -0.45 -4.97 117.98 116.62 1b66 s PHE 19 Ca 0.00 -0.67 -0.06 0.00 -1.04 0.00 0.00 56.93 55.16 1b66 s PHE 19 Cb -0.08 -0.47 -0.04 0.00 -1.21 0.00 0.00 43.02 41.22 1b66 s PHE 19 CO 0.01 -0.09 0.03 -1.12 -1.34 0.00 0.00 175.22 172.71 1b66 s SER 20 N -2.21 5.40 0.04 1.98 0.01 -1.26 -0.13 113.70 117.53 1b66 s SER 20 Ca -0.00 0.03 -0.21 0.00 1.31 0.00 0.00 55.95 57.08 1b66 s SER 20 Cb -0.04 -1.90 0.04 0.00 0.21 0.00 0.00 66.02 64.33 1b66 s SER 20 CO -0.01 0.18 0.47 0.00 0.41 0.00 0.00 173.24 174.29 1b66 s ALA 21 N 0.32 -1.19 0.26 1.44 0.00 -0.82 0.75 121.76 122.52 1b66 s ALA 21 Ca 0.01 0.49 0.09 0.00 0.00 0.00 0.00 51.96 52.55 1b66 s ALA 21 Cb -0.13 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.30 1b66 s ALA 21 CO 0.01 -0.47 0.04 -1.54 0.00 0.00 0.00 175.76 173.79 1b66 s SER 22 N -1.94 4.76 0.11 0.00 1.04 -0.59 -0.81 113.70 116.28 1b66 s SER 22 Ca -0.06 -0.55 -0.25 0.00 0.48 0.00 0.00 55.95 55.58 1b66 s SER 22 Cb -0.01 -0.97 0.08 0.00 0.10 0.00 0.00 66.02 65.22 1b66 s SER 22 CO -0.01 -0.00 1.11 -1.38 0.98 0.00 0.00 173.24 173.93 1b66 s HIS 23 N -2.24 0.01 -0.09 5.02 -0.00 -0.14 -0.63 115.29 117.21 1b66 s HIS 23 Ca 0.31 -0.30 -0.05 0.00 -0.00 0.00 0.00 55.06 55.02 1b66 s HIS 23 Cb -0.07 0.64 0.04 0.00 -0.00 0.00 0.00 32.58 33.20 1b66 s HIS 23 CO 0.21 -0.70 0.22 0.50 -0.00 0.00 0.00 174.74 174.97 1b66 s ARG 24 N -2.37 0.19 -0.35 -0.38 3.52 -1.26 -1.76 118.95 116.54 1b66 s ARG 24 Ca 0.20 0.48 -0.25 0.00 -0.13 0.00 0.00 55.73 56.03 1b66 s ARG 24 Cb -0.01 -0.11 0.01 0.00 -1.56 0.00 0.00 34.95 33.28 1b66 s ARG 24 CO 0.02 -0.15 0.88 -0.51 -0.81 0.00 0.00 175.30 174.73 1b66 s LEU 25 N 1.14 4.04 -0.28 -0.88 1.43 -0.60 -4.65 118.68 118.88 1b66 s LEU 25 Ca -0.08 0.59 -0.18 0.00 -1.03 0.00 0.00 54.13 53.43 1b66 s LEU 25 Cb -0.10 -3.20 0.09 0.00 0.03 0.00 0.00 46.19 43.01 1b66 s LEU 25 CO -0.07 -0.78 0.75 -2.28 0.23 0.00 0.00 176.35 174.19 1b66 s HIS 26 N 3.30 -0.94 -0.15 0.29 2.46 -1.26 -4.17 115.29 114.82 1b66 s HIS 26 Ca 0.36 1.94 0.01 0.00 0.47 0.00 0.00 55.06 57.83 1b66 s HIS 26 Cb -0.13 0.53 -0.00 0.00 -0.13 0.00 0.00 32.58 32.85 1b66 s HIS 26 CO 0.17 -0.46 -0.17 0.45 -2.47 0.00 0.00 174.74 172.26 1b66 s SER 27 N 1.35 3.55 0.00 9.88 0.15 -1.26 -4.77 113.70 122.60 1b66 s SER 27 Ca -0.08 -0.49 0.19 0.00 0.70 0.00 0.00 55.95 56.27 1b66 s SER 27 Cb -0.05 -1.54 1.14 0.00 -1.71 0.00 0.00 66.02 63.87 1b66 s SER 27 CO -0.16 0.09 1.55 -0.81 1.20 0.00 0.00 173.24 175.11 1b66 n PRO 28 N 4.02 0.66 0.07 5.44 -0.04 -1.26 -1.47 135.00 142.41 1b66 n PRO 28 Ca -0.19 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.39 1b66 n PRO 28 Cb 0.52 -1.46 0.20 0.00 -0.04 0.00 0.00 33.50 32.72 1b66 n PRO 28 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1b66 h SER 29 N 0.00 0.00 -3.16 3.54 0.02 -2.02 -3.46 113.55 108.47 1b66 h SER 29 Ca 0.00 -0.17 -0.63 0.00 -0.84 0.00 0.00 61.79 60.15 1b66 h SER 29 Cb 0.00 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 62.44 1b66 h SER 29 CO 0.00 0.08 -0.62 -0.76 -1.14 0.00 0.00 176.83 174.39 1b66 s LEU 30 N -4.37 3.66 0.94 5.07 1.02 -0.54 -5.12 118.68 119.34 1b66 s LEU 30 Ca 0.07 -0.10 -0.12 0.00 0.02 0.00 0.00 54.13 53.99 1b66 s LEU 30 Cb 0.13 -2.35 0.15 0.00 0.02 0.00 0.00 46.19 44.14 1b66 s LEU 30 CO 0.70 0.16 1.11 -0.94 0.02 0.00 0.00 176.35 177.40 1b66 s SER 31 N -2.48 3.18 0.22 2.29 1.04 -1.26 -4.75 113.70 111.94 1b66 s SER 31 Ca 0.28 1.12 -0.08 0.00 0.48 0.00 0.00 55.95 57.75 1b66 s SER 31 Cb -0.12 -1.76 0.27 0.00 0.10 0.00 0.00 66.02 64.51 1b66 s SER 31 CO 0.21 -2.77 1.82 0.00 0.98 0.00 0.00 173.24 173.47 1b66 h ALA 32 N -1.65 0.96 -0.11 5.32 0.00 -1.99 -1.32 119.26 120.47 1b66 h ALA 32 Ca -0.52 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.22 1b66 h ALA 32 Cb 1.32 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1b66 h ALA 32 CO 0.59 0.09 -0.70 1.49 0.00 0.00 0.00 179.25 180.73 1b66 h GLU 33 N 0.74 0.51 -0.53 0.00 4.81 -2.00 -2.77 114.58 115.34 1b66 h GLU 33 Ca 0.32 -0.39 -0.09 0.00 -0.13 0.00 0.00 59.36 59.06 1b66 h GLU 33 Cb 0.19 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1b66 h GLU 33 CO -0.18 1.02 -0.04 0.93 -0.73 0.00 0.00 179.01 180.00 1b66 h GLU 34 N 0.36 0.96 -0.90 1.92 5.08 -1.82 -1.78 114.58 118.39 1b66 h GLU 34 Ca -0.03 -0.32 0.07 0.00 -1.00 0.00 0.00 59.36 58.08 1b66 h GLU 34 Cb 1.28 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 30.38 1b66 h GLU 34 CO 0.13 0.99 0.56 -0.91 -1.00 0.00 0.00 179.01 178.78 1b66 h ASN 35 N 0.83 0.88 -0.27 1.42 2.35 -1.23 0.86 115.58 120.42 1b66 h ASN 35 Ca 0.14 0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 55.88 1b66 h ASN 35 Cb 0.58 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 1b66 h ASN 35 CO 0.03 0.55 0.04 0.25 -1.65 0.00 0.00 177.43 176.66 1b66 h LEU 36 N 1.01 0.44 -0.17 1.61 6.46 -1.24 0.62 115.31 124.04 1b66 h LEU 36 Ca 0.40 -0.26 -0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1b66 h LEU 36 Cb 0.22 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.03 1b66 h LEU 36 CO -0.19 0.59 0.10 0.50 -0.62 0.00 0.00 178.44 178.81 1b66 h LYS 37 N 0.27 0.23 -0.04 1.25 3.64 -0.77 0.18 116.57 121.33 1b66 h LYS 37 Ca 0.08 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 1b66 h LYS 37 Cb 0.34 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1b66 h LYS 37 CO 0.01 0.22 -0.12 0.28 -2.27 0.00 0.00 179.45 177.57 1b66 h VAL 38 N 0.18 1.45 0.00 2.00 2.07 -0.83 -3.35 116.25 117.77 1b66 h VAL 38 Ca 0.06 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 66.07 1b66 h VAL 38 Cb 0.05 2.33 0.00 0.00 -1.52 0.00 0.00 31.29 32.16 1b66 h VAL 38 CO -0.01 0.41 -0.81 0.49 0.02 0.00 0.00 177.57 177.68 1b66 n PHE 39 N -4.64 0.01 -1.02 1.57 3.72 0.21 -5.04 117.46 112.27 1b66 n PHE 39 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 1b66 n PHE 39 Cb 0.38 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.79 1b66 n PHE 39 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b66 n GLY 40 N 1.49 2.67 0.38 1.37 0.00 0.63 -1.58 105.19 110.16 1b66 n GLY 40 Ca 0.04 -0.16 0.20 0.00 0.00 0.00 0.00 46.02 46.10 1b66 n GLY 40 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1b66 h LYS 41 N 0.00 0.02 0.00 1.61 2.10 -1.96 0.16 116.57 118.50 1b66 h LYS 41 Ca 0.00 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1b66 h LYS 41 Cb 0.00 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1b66 h LYS 41 CO 0.00 0.01 0.00 0.00 -2.00 0.00 0.00 179.45 177.46 1b66 n ASN 43 N -1.52 0.87 -3.72 0.00 2.85 0.55 -1.55 115.26 112.74 1b66 n ASN 43 Ca 0.03 -0.85 -0.53 0.00 -0.11 0.00 0.00 54.58 53.11 1b66 n ASN 43 Cb 0.13 0.05 -0.08 0.00 1.24 0.00 0.00 39.78 41.11 1b66 n ASN 43 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1b66 n ASN 44 N -0.66 0.94 -0.32 1.20 5.15 -0.76 -4.78 115.26 116.02 1b66 n ASN 44 Ca 0.14 0.93 0.16 0.00 -0.60 0.00 0.00 54.58 55.21 1b66 n ASN 44 Cb 0.32 -0.69 0.35 0.00 -0.53 0.00 0.00 39.78 39.23 1b66 n ASN 44 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1b66 h PRO 45 N 3.98 0.46 -0.12 1.20 0.11 -1.92 -0.71 132.00 135.00 1b66 h PRO 45 Ca -0.34 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1b66 h PRO 45 Cb 1.08 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1b66 h PRO 45 CO 0.77 0.30 0.00 0.09 -0.21 0.00 0.00 178.00 178.95 1b66 n ASN 46 N -4.98 1.17 0.00 -2.05 3.02 -1.26 -5.04 115.26 106.12 1b66 n ASN 46 Ca 0.25 -1.63 0.00 0.00 -0.03 0.00 0.00 54.58 53.17 1b66 n ASN 46 Cb 0.72 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.81 1b66 n ASN 46 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1b66 n GLY 47 N 1.03 -0.75 1.84 7.41 0.00 -0.27 -5.02 105.19 109.42 1b66 n GLY 47 Ca 0.15 -1.72 -0.05 0.00 0.00 0.00 0.00 46.02 44.40 1b66 n GLY 47 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1b66 n HIS 48 N -0.72 -1.48 -4.03 1.61 1.44 -0.72 -4.89 115.22 106.43 1b66 n HIS 48 Ca 0.00 -1.01 -0.12 0.00 -2.01 0.00 0.00 57.72 54.58 1b66 n HIS 48 Cb 0.00 0.41 -0.04 0.00 0.12 0.00 0.00 29.99 30.48 1b66 n HIS 48 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 1b66 s GLY 49 N -2.06 0.98 0.07 -1.39 0.00 -1.26 -0.97 107.32 102.69 1b66 s GLY 49 Ca 0.10 -1.19 -0.13 0.00 0.00 0.00 0.00 44.72 43.50 1b66 s GLY 49 CO 0.07 -0.81 0.28 0.30 0.00 0.00 0.00 173.10 172.95 1b66 s HIS 50 N -3.47 -0.04 -0.67 1.90 3.76 0.01 -4.99 115.29 111.79 1b66 s HIS 50 Ca 0.26 -0.21 -0.11 0.00 -0.15 0.00 0.00 55.06 54.85 1b66 s HIS 50 Cb -0.00 0.08 0.17 0.00 1.11 0.00 0.00 32.58 33.94 1b66 s HIS 50 CO 0.14 -0.55 0.58 -0.80 -0.85 0.00 0.00 174.74 173.26 1b66 s ASN 51 N -2.43 6.14 0.28 1.40 0.01 -1.26 -1.95 114.94 117.14 1b66 s ASN 51 Ca -0.01 -2.45 -0.29 0.00 -0.71 0.00 0.00 52.86 49.40 1b66 s ASN 51 Cb 0.01 -2.09 -0.10 0.00 0.41 0.00 0.00 41.25 39.48 1b66 s ASN 51 CO -0.07 -0.59 1.16 -0.31 -1.51 0.00 0.00 177.10 175.78 1b66 s TYR 52 N 0.54 3.43 -0.15 2.20 1.51 0.82 -4.77 117.35 120.93 1b66 s TYR 52 Ca 0.13 1.60 -0.00 0.00 -1.01 0.00 0.00 57.07 57.79 1b66 s TYR 52 Cb -0.18 -3.40 -0.01 0.00 -0.11 0.00 0.00 41.96 38.26 1b66 s TYR 52 CO -0.04 -0.95 -0.13 0.15 -1.11 0.00 0.00 175.55 173.46 1b66 s LYS 53 N -1.43 3.31 -0.11 -0.62 1.02 -0.61 -1.34 119.74 119.96 1b66 s LYS 53 Ca 0.46 -0.71 0.03 0.00 0.02 0.00 0.00 55.97 55.78 1b66 s LYS 53 Cb -0.34 -2.68 0.00 0.00 -0.52 0.00 0.00 37.83 34.29 1b66 s LYS 53 CO 0.44 0.07 -0.23 0.08 -0.92 0.00 0.00 175.35 174.79 1b66 s VAL 54 N 0.72 2.02 -0.21 3.17 1.01 0.70 -0.40 120.40 127.40 1b66 s VAL 54 Ca -0.06 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 60.91 1b66 s VAL 54 Cb -0.15 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.47 1b66 s VAL 54 CO 0.02 0.55 -0.09 -0.69 0.00 0.00 0.00 175.10 174.89 1b66 s VAL 55 N 0.49 3.00 -0.19 2.92 1.01 0.18 -1.44 120.40 126.37 1b66 s VAL 55 Ca -0.15 -0.63 -0.06 0.00 0.00 0.00 0.00 61.98 61.14 1b66 s VAL 55 Cb -0.17 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.83 1b66 s VAL 55 CO 0.06 0.45 0.02 -0.69 0.00 0.00 0.00 175.10 174.94 1b66 s VAL 56 N 1.42 4.25 -0.13 2.92 1.01 -0.57 -0.87 120.40 128.43 1b66 s VAL 56 Ca 0.05 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.83 1b66 s VAL 56 Cb -0.14 -2.92 -0.01 0.00 0.00 0.00 0.00 36.38 33.31 1b66 s VAL 56 CO -0.06 0.44 -0.16 -0.89 0.00 0.00 0.00 175.10 174.44 1b66 s THR 57 N 0.73 2.79 0.25 3.92 2.01 -0.11 -1.92 115.64 123.32 1b66 s THR 57 Ca 0.01 -0.75 0.11 0.00 0.31 0.00 0.00 61.69 61.37 1b66 s THR 57 Cb -0.14 -2.16 -0.05 0.00 0.01 0.00 0.00 72.50 70.17 1b66 s THR 57 CO 0.02 0.53 -0.11 0.27 -0.69 0.00 0.00 174.62 174.64 1b66 s ILE 58 N 0.43 2.96 0.08 1.82 -0.00 0.15 -0.41 121.20 126.23 1b66 s ILE 58 Ca -0.12 -2.08 0.02 0.00 -0.00 0.00 0.00 60.65 58.48 1b66 s ILE 58 Cb -0.16 -2.55 -0.04 0.00 -0.00 0.00 0.00 42.46 39.72 1b66 s ILE 58 CO 0.05 -0.33 -0.07 -1.38 -0.00 0.00 0.00 174.94 173.21 1b66 s HIS 59 N -2.27 0.85 -2.79 1.37 -3.43 -0.47 -0.64 115.29 107.91 1b66 s HIS 59 Ca 0.29 -0.74 0.00 0.00 -0.80 0.00 0.00 55.06 53.81 1b66 s HIS 59 Cb -0.06 -0.49 0.00 0.00 -1.43 0.00 0.00 32.58 30.60 1b66 s HIS 59 CO 0.17 -0.11 0.00 0.41 -2.00 0.00 0.00 174.74 173.21 1b66 n GLY 60 N 0.53 -1.63 3.82 -1.38 0.00 -0.95 -4.61 105.19 100.97 1b66 n GLY 60 Ca -0.16 -1.10 -0.34 0.00 0.00 0.00 0.00 46.02 44.43 1b66 n GLY 60 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1b66 s GLU 61 N -1.45 4.27 -0.19 1.61 2.02 -1.26 -1.17 118.70 122.54 1b66 s GLU 61 Ca 0.00 1.11 -0.28 0.00 0.02 0.00 0.00 54.97 55.82 1b66 s GLU 61 Cb 0.00 -2.33 -0.00 0.00 0.10 0.00 0.00 34.13 31.90 1b66 s GLU 61 CO 0.00 0.05 0.96 0.42 0.02 0.00 0.00 175.26 176.71 1b66 s ILE 62 N -2.05 4.77 0.20 -1.63 1.01 0.79 -4.26 121.20 120.03 1b66 s ILE 62 Ca 0.59 1.89 -0.33 0.00 0.00 0.00 0.00 60.65 62.80 1b66 s ILE 62 Cb -0.11 -4.25 -0.13 0.00 0.01 0.00 0.00 42.46 37.98 1b66 s ILE 62 CO 0.15 -0.07 1.56 -0.67 0.00 0.00 0.00 174.94 175.91 1b66 n ASP 63 N 5.69 3.20 0.25 3.58 -0.08 -0.73 -4.67 116.55 123.80 1b66 n ASP 63 Ca 0.09 1.10 0.13 0.00 -1.51 0.00 0.00 54.79 54.59 1b66 n ASP 63 Cb 0.48 -1.46 0.60 0.00 2.34 0.00 0.00 41.12 43.08 1b66 n ASP 63 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1b66 h PRO 64 N 5.53 0.00 0.00 -0.67 0.13 -1.94 -0.86 132.00 134.19 1b66 h PRO 64 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 1b66 h PRO 64 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 1b66 h PRO 64 CO 0.86 0.14 -0.69 0.28 -0.23 0.00 0.00 178.00 178.37 1b66 n VAL 65 N -3.37 1.44 0.22 1.56 0.31 -1.26 -4.63 118.33 112.60 1b66 n VAL 65 Ca -0.00 0.18 0.11 0.00 -0.01 0.00 0.00 64.34 64.62 1b66 n VAL 65 Cb 0.34 -2.37 0.23 0.00 -0.91 0.00 0.00 33.84 31.14 1b66 n VAL 65 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 1b66 h THR 66 N -1.00 0.13 -0.09 2.52 1.35 -1.98 -3.47 112.91 110.37 1b66 h THR 66 Ca -0.02 -1.10 -0.04 0.00 -0.55 0.00 0.00 66.41 64.71 1b66 h THR 66 Cb 0.68 1.98 -0.02 0.00 -1.73 0.00 0.00 68.15 69.06 1b66 h THR 66 CO -0.01 0.07 -0.04 0.61 -0.25 0.00 0.00 175.52 175.91 1b66 n GLY 67 N 0.94 0.54 3.61 5.82 0.00 -0.33 -4.98 105.19 110.78 1b66 n GLY 67 Ca 0.03 -0.35 -0.34 0.00 0.00 0.00 0.00 46.02 45.36 1b66 n GLY 67 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1b66 s MET 68 N -1.26 3.05 0.07 1.61 -1.94 -1.26 -4.66 119.30 114.92 1b66 s MET 68 Ca 0.00 -0.48 -0.15 0.00 -1.71 0.00 0.00 55.69 53.35 1b66 s MET 68 Cb 0.00 -2.75 -0.19 0.00 2.01 0.00 0.00 34.83 33.90 1b66 s MET 68 CO 0.00 0.59 1.23 0.28 -0.01 0.00 0.00 175.02 177.12 1b66 h VAL 69 N 4.40 1.30 -2.40 -6.03 2.07 -1.92 -1.94 116.25 111.73 1b66 h VAL 69 Ca -0.46 -2.05 -0.08 0.00 0.82 0.00 0.00 66.70 64.93 1b66 h VAL 69 Cb 1.18 2.20 -0.23 0.00 -1.52 0.00 0.00 31.29 32.93 1b66 h VAL 69 CO 0.55 0.64 -0.08 -0.32 0.02 0.00 0.00 177.57 178.38 1b66 s MET 70 N -3.54 0.63 -0.03 1.57 1.75 -1.26 -4.79 119.30 113.62 1b66 s MET 70 Ca -0.11 0.79 -0.30 0.00 -1.25 0.00 0.00 55.69 54.83 1b66 s MET 70 Cb 0.07 0.28 -0.07 0.00 2.84 0.00 0.00 34.83 37.95 1b66 s MET 70 CO 0.89 -0.09 1.81 1.21 -0.65 0.00 0.00 175.02 178.19 1b66 s ASN 71 N 0.45 6.52 0.56 1.11 3.84 -1.26 -4.86 114.94 121.29 1b66 s ASN 71 Ca -0.01 2.39 0.32 0.00 0.21 0.00 0.00 52.86 55.76 1b66 s ASN 71 Cb -0.04 -2.53 1.47 0.00 -0.55 0.00 0.00 41.25 39.60 1b66 s ASN 71 CO -0.01 -1.03 1.84 -0.07 -2.79 0.00 0.00 177.10 175.03 1b66 h LEU 72 N 10.63 0.00 -0.63 3.21 3.38 -1.99 0.27 115.31 130.18 1b66 h LEU 72 Ca -0.44 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.52 1b66 h LEU 72 Cb 1.20 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 1b66 h LEU 72 CO 0.95 0.00 0.35 0.74 0.09 0.00 0.00 178.44 180.57 1b66 h THR 73 N 0.00 1.20 -0.51 0.22 2.02 -2.00 -0.26 112.91 113.58 1b66 h THR 73 Ca 0.41 -0.47 -0.10 0.00 0.77 0.00 0.00 66.41 67.02 1b66 h THR 73 Cb 1.78 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 68.54 1b66 h THR 73 CO -0.00 0.21 -0.06 0.44 0.37 0.00 0.00 175.52 176.48 1b66 h ASP 74 N 0.85 0.93 -0.65 4.18 3.32 -0.85 -2.18 116.42 122.01 1b66 h ASP 74 Ca 0.22 -0.33 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 1b66 h ASP 74 Cb 0.02 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.29 1b66 h ASP 74 CO -0.04 1.04 0.34 0.25 -1.72 0.00 0.00 179.24 179.12 1b66 h LEU 75 N 0.79 0.82 -0.27 1.55 5.85 -1.05 -0.33 115.31 122.68 1b66 h LEU 75 Ca 0.14 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.79 1b66 h LEU 75 Cb 0.60 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1b66 h LEU 75 CO 0.04 0.70 0.04 0.11 -0.34 0.00 0.00 178.44 178.98 1b66 h LYS 76 N 0.89 0.13 -0.32 1.25 1.57 -0.88 0.19 116.57 119.41 1b66 h LYS 76 Ca 0.23 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 59.00 1b66 h LYS 76 Cb 0.07 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1b66 h LYS 76 CO -0.03 0.09 0.20 0.93 -0.57 0.00 0.00 179.45 180.07 1b66 h GLU 77 N 0.13 0.40 -0.68 3.15 5.08 -1.02 0.15 114.58 121.80 1b66 h GLU 77 Ca 0.13 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1b66 h GLU 77 Cb 0.14 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1b66 h GLU 77 CO -0.18 0.27 0.40 1.88 -1.00 0.00 0.00 179.01 180.38 1b66 h TYR 78 N 0.42 0.90 -0.14 4.33 0.05 -0.62 -1.67 116.97 120.24 1b66 h TYR 78 Ca 0.12 -0.01 -0.12 0.00 0.05 0.00 0.00 58.73 58.77 1b66 h TYR 78 Cb -0.04 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 37.39 1b66 h TYR 78 CO -0.06 0.62 -0.43 0.52 -1.05 0.00 0.00 178.16 177.75 1b66 h MET 79 N 0.92 0.32 -0.15 4.88 2.86 -0.68 0.16 114.93 123.24 1b66 h MET 79 Ca 0.24 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1b66 h MET 79 Cb -0.02 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 1b66 h MET 79 CO -0.04 0.70 0.09 1.49 1.06 0.00 0.00 176.91 180.20 1b66 h GLU 80 N 0.26 0.21 -0.40 1.72 4.57 -0.35 0.10 114.58 120.69 1b66 h GLU 80 Ca 0.02 -0.02 -0.11 0.00 -1.18 0.00 0.00 59.36 58.07 1b66 h GLU 80 Cb 0.88 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.41 1b66 h GLU 80 CO 0.07 0.20 -0.16 1.49 -1.18 0.00 0.00 179.01 179.43 1b66 h GLU 81 N 0.16 0.82 0.00 1.92 4.57 -1.15 -0.39 114.58 120.50 1b66 h GLU 81 Ca 0.05 -0.35 -0.10 0.00 -1.18 0.00 0.00 59.36 57.79 1b66 h GLU 81 Cb 0.05 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.59 1b66 h GLU 81 CO -0.01 0.98 -0.84 0.00 -1.18 0.00 0.00 179.01 177.96 1b66 h ALA 82 N 0.82 0.67 0.00 2.92 0.00 -0.60 -3.41 119.26 119.67 1b66 h ALA 82 Ca 0.09 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1b66 h ALA 82 Cb 0.71 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1b66 h ALA 82 CO 0.05 0.57 -0.13 -0.89 0.00 0.00 0.00 179.25 178.85 1b66 n ILE 83 N -3.02 1.06 0.25 0.00 5.41 0.32 -4.78 119.36 118.60 1b66 n ILE 83 Ca -0.02 0.35 -0.16 0.00 1.00 0.00 0.00 62.75 63.92 1b66 n ILE 83 Cb 0.72 -1.56 -0.08 0.00 -0.71 0.00 0.00 39.64 38.01 1b66 n ILE 83 CO 0.00 0.00 0.00 0.24 0.00 0.00 0.00 176.55 176.79 1b66 h MET 84 N 0.00 -0.58 -0.44 0.38 2.86 -1.20 -0.19 114.93 115.76 1b66 h MET 84 Ca 0.00 0.04 0.06 0.00 -2.06 0.00 0.00 59.70 57.74 1b66 h MET 84 Cb 0.13 0.13 -0.06 0.00 0.06 0.00 0.00 31.60 31.87 1b66 h MET 84 CO 0.00 -0.34 0.11 0.87 1.06 0.00 0.00 176.91 178.61 1b66 h LYS 85 N -0.69 0.25 0.00 1.72 1.57 -1.30 -0.63 116.57 117.49 1b66 h LYS 85 Ca -0.06 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.60 1b66 h LYS 85 Cb 0.51 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.75 1b66 h LYS 85 CO 0.10 0.17 -0.91 -1.00 -0.57 0.00 0.00 179.45 177.24 1b66 h PRO 86 N 0.26 0.00 0.00 3.15 0.13 -1.78 -3.41 132.00 130.34 1b66 h PRO 86 Ca 0.21 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 65.07 1b66 h PRO 86 Cb 0.24 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.32 1b66 h PRO 86 CO -0.25 0.27 -2.01 1.28 -0.23 0.00 0.00 178.00 177.06 1b66 n LEU 87 N -2.98 0.90 -4.71 1.56 4.77 -0.09 -4.86 117.00 111.60 1b66 n LEU 87 Ca -0.03 -0.03 -0.42 0.00 -0.03 0.00 0.00 56.01 55.50 1b66 n LEU 87 Cb 0.72 0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.83 1b66 n LEU 87 CO 0.41 0.49 1.18 -0.62 -1.33 0.00 0.00 177.39 177.52 1b66 s ASP 88 N -5.08 6.68 -1.31 -1.43 2.15 -0.25 -2.93 116.67 114.50 1b66 s ASP 88 Ca -0.12 2.48 -0.04 0.00 0.43 0.00 0.00 52.55 55.30 1b66 s ASP 88 Cb 0.05 -2.59 0.01 0.00 -0.30 0.00 0.00 42.92 40.10 1b66 s ASP 88 CO 0.54 -0.77 0.95 1.41 -0.17 0.00 0.00 175.17 177.14 1b66 n HIS 89 N 4.21 -2.28 -4.31 -5.34 8.25 0.23 -4.92 115.22 111.07 1b66 n HIS 89 Ca 0.13 0.92 -0.16 0.00 -0.26 0.00 0.00 57.72 58.35 1b66 n HIS 89 Cb 0.40 -4.74 -0.10 0.00 1.12 0.00 0.00 29.99 26.67 1b66 n HIS 89 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1b66 s LYS 90 N -5.90 1.28 -0.40 -0.41 -0.14 -1.15 -5.02 119.74 107.99 1b66 s LYS 90 Ca 0.21 -1.63 -0.11 0.00 -1.36 0.00 0.00 55.97 53.09 1b66 s LYS 90 Cb -0.10 -0.61 0.05 0.00 -1.68 0.00 0.00 37.83 35.49 1b66 s LYS 90 CO 0.77 -0.06 0.24 1.21 -0.76 0.00 0.00 175.35 176.75 1b66 s ASN 91 N -3.27 5.75 0.20 2.83 3.84 -1.26 -1.55 114.94 121.47 1b66 s ASN 91 Ca 0.26 -1.18 -0.13 0.00 0.21 0.00 0.00 52.86 52.02 1b66 s ASN 91 Cb 0.05 -2.03 0.23 0.00 -0.55 0.00 0.00 41.25 38.95 1b66 s ASN 91 CO 0.07 -0.46 1.65 -0.07 -2.79 0.00 0.00 177.10 175.51 1b66 h LEU 92 N 8.46 -0.38 -0.94 3.21 3.38 -1.23 0.47 115.31 128.27 1b66 h LEU 92 Ca -0.25 0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1b66 h LEU 92 Cb 1.10 0.30 -0.01 0.00 0.09 0.00 0.00 40.66 42.13 1b66 h LEU 92 CO 0.71 -0.14 -0.41 0.44 0.09 0.00 0.00 178.44 179.13 1b66 h ASP 93 N 0.06 0.00 0.00 -0.43 3.32 -1.85 -1.89 116.42 115.62 1b66 h ASP 93 Ca 0.28 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.26 1b66 h ASP 93 Cb 0.45 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 1b66 h ASP 93 CO -0.53 0.41 -1.80 0.18 -1.72 0.00 0.00 179.24 175.79 1b66 n LEU 94 N -3.62 0.00 -0.35 1.55 4.77 -1.01 -4.35 117.00 113.99 1b66 n LEU 94 Ca -0.01 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.06 1b66 n LEU 94 Cb 0.52 0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.69 1b66 n LEU 94 CO 0.38 0.10 0.24 0.47 -1.33 0.00 0.00 177.39 177.24 1b66 n ASP 95 N -2.18 1.59 -4.03 -1.43 8.00 0.16 -4.86 116.55 113.80 1b66 n ASP 95 Ca -0.09 -1.30 -0.31 0.00 0.71 0.00 0.00 54.79 53.80 1b66 n ASP 95 Cb 0.56 0.52 -0.15 0.00 -0.02 0.00 0.00 41.12 42.04 1b66 n ASP 95 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1b66 s VAL 96 N -2.04 2.12 0.31 2.53 1.01 -0.71 -4.97 120.40 118.64 1b66 s VAL 96 Ca 0.13 -1.83 0.06 0.00 0.00 0.00 0.00 61.98 60.34 1b66 s VAL 96 Cb 0.14 -2.36 0.33 0.00 0.00 0.00 0.00 36.38 34.49 1b66 s VAL 96 CO 0.45 -0.24 1.63 -0.65 0.00 0.00 0.00 175.10 176.29 1b66 h PRO 97 N 7.74 0.18 -0.71 2.72 0.11 -1.89 0.14 132.00 140.29 1b66 h PRO 97 Ca -0.14 -0.01 0.17 0.00 0.11 0.00 0.00 66.00 66.13 1b66 h PRO 97 Cb 1.04 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.06 1b66 h PRO 97 CO 0.48 0.12 0.49 -0.92 -0.21 0.00 0.00 178.00 177.95 1b66 h TYR 98 N 0.19 0.27 -0.41 0.65 5.03 -1.94 -0.92 116.97 119.84 1b66 h TYR 98 Ca 0.62 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.94 1b66 h TYR 98 Cb 1.35 -0.08 0.00 0.00 1.55 0.00 0.00 36.73 39.55 1b66 h TYR 98 CO -0.22 0.10 0.00 1.19 -1.32 0.00 0.00 178.16 177.91 1b66 n PHE 99 N -4.42 0.54 -0.03 -3.82 3.72 0.48 -3.72 117.46 110.21 1b66 n PHE 99 Ca 0.14 -0.27 -0.05 0.00 -0.05 0.00 0.00 57.45 57.22 1b66 n PHE 99 Cb 0.62 0.00 0.16 0.00 -0.94 0.00 0.00 39.48 39.32 1b66 n PHE 99 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1b66 h ALA 100 N 3.99 1.01 -0.06 4.37 0.00 -1.19 -3.27 119.26 124.12 1b66 h ALA 100 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1b66 h ALA 100 Cb 0.65 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1b66 h ALA 100 CO 0.00 0.59 0.00 -0.40 0.00 0.00 0.00 179.25 179.44 1b66 n ASP 101 N -4.12 1.92 -4.16 0.00 5.68 -1.26 -4.99 116.55 109.62 1b66 n ASP 101 Ca -0.00 -1.74 -0.27 0.00 -0.50 0.00 0.00 54.79 52.28 1b66 n ASP 101 Cb 0.42 -0.04 -0.16 0.00 -1.14 0.00 0.00 41.12 40.20 1b66 n ASP 101 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1b66 s VAL 102 N -0.77 1.52 0.16 2.12 1.01 -1.23 -5.10 120.40 118.11 1b66 s VAL 102 Ca 0.05 -0.78 -0.31 0.00 0.00 0.00 0.00 61.98 60.94 1b66 s VAL 102 Cb 0.03 -1.30 -0.08 0.00 0.00 0.00 0.00 36.38 35.02 1b66 s VAL 102 CO 0.03 0.43 1.35 -0.69 0.00 0.00 0.00 175.10 176.23 1b66 s VAL 103 N -0.08 3.24 -0.02 2.92 1.01 -1.26 -4.62 120.40 121.58 1b66 s VAL 103 Ca -0.02 0.96 -0.05 0.00 0.00 0.00 0.00 61.98 62.87 1b66 s VAL 103 Cb -0.11 -3.61 -0.23 0.00 0.00 0.00 0.00 36.38 32.43 1b66 s VAL 103 CO 0.02 0.11 3.44 -1.54 0.00 0.00 0.00 175.10 177.13 1b66 n SER 104 N 3.20 5.30 -4.68 3.32 3.41 -1.26 -4.67 113.62 118.23 1b66 n SER 104 Ca 0.08 -2.50 -0.29 0.00 -0.26 0.00 0.00 58.87 55.90 1b66 n SER 104 Cb 0.42 -1.39 0.17 0.00 -0.26 0.00 0.00 64.21 63.15 1b66 n SER 104 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1b66 s THR 105 N 0.79 2.31 0.28 6.66 -4.23 -1.26 -4.79 115.64 115.39 1b66 s THR 105 Ca 0.60 0.10 -0.03 0.00 -1.18 0.00 0.00 61.69 61.18 1b66 s THR 105 Cb 0.29 -2.55 0.27 0.00 1.34 0.00 0.00 72.50 71.85 1b66 s THR 105 CO -0.01 -0.13 1.94 0.74 -0.54 0.00 0.00 174.62 176.62 1b66 h THR 106 N -1.80 1.19 -0.14 3.99 2.02 -1.98 -1.65 112.91 114.54 1b66 h THR 106 Ca -0.53 -0.41 0.04 0.00 0.77 0.00 0.00 66.41 66.28 1b66 h THR 106 Cb 1.31 -0.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 1b66 h THR 106 CO 0.56 0.22 -0.11 -0.33 0.37 0.00 0.00 175.52 176.23 1b66 h GLU 107 N 1.19 -0.11 0.00 6.66 3.07 -1.95 -1.07 114.58 122.37 1b66 h GLU 107 Ca 0.35 0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 59.18 1b66 h GLU 107 Cb -0.05 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.88 1b66 h GLU 107 CO -0.09 -0.07 -0.19 -0.91 -1.40 0.00 0.00 179.01 176.34 1b66 h ASN 108 N -0.11 0.00 -0.13 1.42 2.35 -1.68 -1.05 115.58 116.38 1b66 h ASN 108 Ca 0.09 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.65 1b66 h ASN 108 Cb 0.25 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.63 1b66 h ASN 108 CO -0.21 0.19 -0.67 0.58 -1.65 0.00 0.00 177.43 175.66 1b66 h VAL 109 N 0.00 1.31 -0.29 2.81 2.07 -0.98 -0.46 116.25 120.72 1b66 h VAL 109 Ca -0.00 -1.92 -0.00 0.00 0.82 0.00 0.00 66.70 65.60 1b66 h VAL 109 Cb 0.74 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.58 1b66 h VAL 109 CO 0.02 0.60 0.16 0.00 0.02 0.00 0.00 177.57 178.37 1b66 h ALA 110 N 0.51 0.37 -0.18 1.67 0.00 -0.81 -1.35 119.26 119.47 1b66 h ALA 110 Ca -0.05 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.81 1b66 h ALA 110 Cb 1.31 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 1b66 h ALA 110 CO 0.14 -0.11 0.07 0.28 0.00 0.00 0.00 179.25 179.63 1b66 h VAL 111 N 0.35 0.98 -0.60 0.00 2.07 -1.16 -0.42 116.25 117.47 1b66 h VAL 111 Ca 0.10 -0.06 0.08 0.00 0.82 0.00 0.00 66.70 67.64 1b66 h VAL 111 Cb 0.05 0.80 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 1b66 h VAL 111 CO -0.02 0.03 0.27 0.22 0.02 0.00 0.00 177.57 178.10 1b66 h TYR 112 N 0.17 0.49 -0.40 1.57 3.20 -0.94 -0.06 116.97 121.01 1b66 h TYR 112 Ca 0.07 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.88 1b66 h TYR 112 Cb 0.03 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 1b66 h TYR 112 CO -0.10 0.19 -0.11 0.82 -1.64 0.00 0.00 178.16 177.32 1b66 h ILE 113 N 0.50 1.28 0.07 1.81 2.04 -1.03 -1.21 117.51 120.97 1b66 h ILE 113 Ca 0.29 -1.20 0.02 0.00 1.00 0.00 0.00 64.86 64.97 1b66 h ILE 113 Cb 0.28 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 1b66 h ILE 113 CO -0.24 0.40 -0.25 -0.25 0.00 0.00 0.00 178.15 177.81 1b66 h TRP 114 N 0.58 -0.67 -0.27 1.37 2.91 -0.62 -0.63 115.95 118.62 1b66 h TRP 114 Ca 0.10 0.02 0.05 0.00 1.13 0.00 0.00 58.89 60.18 1b66 h TRP 114 Cb 0.63 0.29 -0.04 0.00 -0.51 0.00 0.00 29.16 29.53 1b66 h TRP 114 CO 0.05 -0.35 -0.01 0.93 -1.03 0.00 0.00 178.44 178.04 1b66 h GLU 115 N -0.43 0.07 -0.48 2.65 5.08 -0.93 -0.50 114.58 120.05 1b66 h GLU 115 Ca 0.04 -0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.46 1b66 h GLU 115 Cb 0.48 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 1b66 h GLU 115 CO -0.18 0.05 0.17 -0.91 -1.00 0.00 0.00 179.01 177.14 1b66 h ASN 116 N 0.08 0.18 -0.70 1.42 4.21 -0.95 -2.07 115.58 117.75 1b66 h ASN 116 Ca 0.13 0.06 -0.04 0.00 1.21 0.00 0.00 56.30 57.66 1b66 h ASN 116 Cb 0.17 0.04 -0.03 0.00 -1.12 0.00 0.00 38.32 37.38 1b66 h ASN 116 CO -0.22 0.13 0.29 -0.07 -1.29 0.00 0.00 177.43 176.27 1b66 h LEU 117 N 0.35 0.97 -1.51 1.61 3.38 -0.66 -2.93 115.31 116.52 1b66 h LEU 117 Ca 0.23 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1b66 h LEU 117 Cb 0.23 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1b66 h LEU 117 CO -0.23 0.86 0.24 1.56 0.09 0.00 0.00 178.44 180.96 1b66 h GLN 118 N 1.03 0.57 0.00 1.13 1.08 -0.39 0.13 115.11 118.66 1b66 h GLN 118 Ca 0.24 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.37 1b66 h GLN 118 Cb 0.19 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 27.50 1b66 h GLN 118 CO -0.02 0.41 -0.11 0.00 -0.95 0.00 0.00 178.83 178.17 1b66 h ARG 119 N 0.58 0.00 0.00 1.46 3.08 -1.29 -3.33 114.38 114.88 1b66 h ARG 119 Ca 0.15 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.93 1b66 h ARG 119 Cb -0.00 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.00 1b66 h ARG 119 CO -0.03 0.11 -2.02 1.28 -1.07 0.00 0.00 179.97 178.24 1b66 n LEU 120 N -3.71 2.62 -4.79 3.04 4.32 -0.59 -5.04 117.00 112.85 1b66 n LEU 120 Ca -0.02 -0.09 -0.34 0.00 -0.02 0.00 0.00 56.01 55.54 1b66 n LEU 120 Cb 0.22 -0.51 -0.02 0.00 -1.62 0.00 0.00 43.42 41.49 1b66 n LEU 120 CO 0.30 0.75 0.73 -0.76 -1.22 0.00 0.00 177.39 177.19 1b66 s LEU 121 N -5.93 3.77 0.62 2.23 1.43 0.37 -5.01 118.68 116.17 1b66 s LEU 121 Ca -0.22 1.98 -0.18 0.00 -1.03 0.00 0.00 54.13 54.68 1b66 s LEU 121 Cb 0.06 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 41.69 1b66 s LEU 121 CO 0.43 -0.95 1.12 -2.65 0.23 0.00 0.00 176.35 174.53 1b66 n PRO 122 N -1.20 1.02 -1.75 1.29 -0.02 -1.26 -4.89 135.00 128.20 1b66 n PRO 122 Ca 0.10 0.40 -0.42 0.00 -2.02 0.00 0.00 63.50 61.56 1b66 n PRO 122 Cb 0.52 -2.35 -0.01 0.00 -0.02 0.00 0.00 33.50 31.65 1b66 n PRO 122 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1b66 n VAL 123 N -1.79 1.59 -0.71 -1.45 0.31 -1.26 -2.25 118.33 112.76 1b66 n VAL 123 Ca 0.15 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1b66 n VAL 123 Cb 0.48 -1.88 0.00 0.00 -0.91 0.00 0.00 33.84 31.53 1b66 n VAL 123 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1b66 n GLY 124 N 1.20 1.22 0.12 2.92 0.00 -1.26 -4.91 105.19 104.49 1b66 n GLY 124 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.91 1b66 n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b66 h ALA 125 N 0.00 0.08 -2.55 4.61 0.00 -1.70 -3.44 119.26 116.26 1b66 h ALA 125 Ca 0.00 -0.49 -0.53 0.00 0.00 0.00 0.00 54.91 53.89 1b66 h ALA 125 Cb 0.00 0.01 0.03 0.00 0.00 0.00 0.00 17.79 17.83 1b66 h ALA 125 CO 0.00 0.20 0.75 -1.17 0.00 0.00 0.00 179.25 179.03 1b66 s LEU 126 N -8.54 4.37 -0.10 0.00 2.96 -1.26 -1.37 118.68 114.75 1b66 s LEU 126 Ca -0.14 2.36 -0.02 0.00 -0.22 0.00 0.00 54.13 56.11 1b66 s LEU 126 Cb 0.03 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 43.08 1b66 s LEU 126 CO 0.78 -0.68 -0.10 0.00 -1.32 0.00 0.00 176.35 175.03 1b66 n TYR 127 N 3.96 0.00 -3.57 5.38 9.36 0.46 -4.84 117.16 127.91 1b66 n TYR 127 Ca 0.12 0.00 -0.16 0.00 3.32 0.00 0.00 57.90 61.18 1b66 n TYR 127 Cb 0.42 -0.37 -0.06 0.00 -0.63 0.00 0.00 39.34 38.70 1b66 n TYR 127 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 1b66 s LYS 128 N -2.19 1.00 -0.15 2.98 2.20 -0.88 -4.66 119.74 118.05 1b66 s LYS 128 Ca -0.13 0.01 -0.00 0.00 -0.36 0.00 0.00 55.97 55.48 1b66 s LYS 128 Cb 0.04 0.46 0.03 0.00 -1.51 0.00 0.00 37.83 36.86 1b66 s LYS 128 CO 0.20 -0.33 -0.08 0.08 -0.36 0.00 0.00 175.35 174.86 1b66 s VAL 129 N -1.70 1.20 -0.18 4.02 1.01 -0.67 -0.93 120.40 123.15 1b66 s VAL 129 Ca -0.09 -0.54 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 1b66 s VAL 129 Cb -0.01 -1.26 -0.00 0.00 0.00 0.00 0.00 36.38 35.10 1b66 s VAL 129 CO 0.05 0.27 -0.11 -0.75 0.00 0.00 0.00 175.10 174.56 1b66 s LYS 130 N 1.62 3.30 -0.18 2.72 2.20 -0.05 -1.09 119.74 128.25 1b66 s LYS 130 Ca 0.03 -0.69 0.01 0.00 -0.36 0.00 0.00 55.97 54.96 1b66 s LYS 130 Cb -0.14 -2.77 0.02 0.00 -1.51 0.00 0.00 37.83 33.43 1b66 s LYS 130 CO -0.08 -0.04 -0.20 0.08 -0.36 0.00 0.00 175.35 174.75 1b66 s VAL 131 N 1.00 2.08 -0.37 4.02 1.01 0.06 -0.65 120.40 127.55 1b66 s VAL 131 Ca -0.01 -0.94 -0.14 0.00 0.00 0.00 0.00 61.98 60.89 1b66 s VAL 131 Cb -0.15 -1.87 0.00 0.00 0.00 0.00 0.00 36.38 34.37 1b66 s VAL 131 CO -0.02 0.54 0.28 -0.31 0.00 0.00 0.00 175.10 175.60 1b66 s TYR 132 N 1.23 3.23 0.06 5.22 1.51 0.46 -1.05 117.35 128.02 1b66 s TYR 132 Ca 0.04 -0.37 -0.15 0.00 -1.01 0.00 0.00 57.07 55.58 1b66 s TYR 132 Cb -0.13 -2.56 -0.25 0.00 -0.11 0.00 0.00 41.96 38.91 1b66 s TYR 132 CO -0.12 -0.48 1.16 1.49 -1.11 0.00 0.00 175.55 176.50 1b66 h GLU 133 N 8.56 0.67 -4.65 -0.62 4.81 -1.40 -1.61 114.58 120.34 1b66 h GLU 133 Ca -0.29 -0.76 -0.41 0.00 -0.13 0.00 0.00 59.36 57.77 1b66 h GLU 133 Cb 1.14 0.23 -0.11 0.00 0.63 0.00 0.00 28.75 30.63 1b66 h GLU 133 CO 0.69 1.33 -0.39 0.95 -0.73 0.00 0.00 179.01 180.86 1b66 s THR 134 N -3.22 0.00 0.36 0.32 -4.23 -1.23 -4.45 115.64 103.19 1b66 s THR 134 Ca -0.10 -1.87 0.28 0.00 -1.18 0.00 0.00 61.69 58.82 1b66 s THR 134 Cb 0.06 -2.55 0.30 0.00 1.34 0.00 0.00 72.50 71.65 1b66 s THR 134 CO 0.92 0.00 2.04 0.44 -0.54 0.00 0.00 174.62 177.48 1b66 h ASP 135 N 2.13 0.00 0.18 3.99 3.32 -1.94 -3.14 116.42 120.96 1b66 h ASP 135 Ca -0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.79 1b66 h ASP 135 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1b66 h ASP 135 CO 0.37 0.12 -0.94 0.59 -1.72 0.00 0.00 179.24 177.67 1b66 n ASN 136 N -3.54 0.78 -4.01 6.45 4.13 -1.26 -4.87 115.26 112.94 1b66 n ASN 136 Ca -0.01 -0.66 -0.31 0.00 1.68 0.00 0.00 54.58 55.28 1b66 n ASN 136 Cb 0.26 0.85 -0.16 0.00 -1.54 0.00 0.00 39.78 39.19 1b66 n ASN 136 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1b66 s ASN 137 N -3.20 3.41 0.00 6.41 0.01 -1.19 -5.09 114.94 115.30 1b66 s ASN 137 Ca 0.07 -0.89 0.03 0.00 -0.71 0.00 0.00 52.86 51.37 1b66 s ASN 137 Cb 0.16 -1.26 -0.01 0.00 0.41 0.00 0.00 41.25 40.55 1b66 s ASN 137 CO 0.82 -0.14 -0.10 -0.63 -1.51 0.00 0.00 177.10 175.55 1b66 s ILE 138 N 1.38 0.76 -0.05 0.60 1.01 -1.26 -1.08 121.20 122.56 1b66 s ILE 138 Ca -0.01 -0.51 0.04 0.00 0.00 0.00 0.00 60.65 60.17 1b66 s ILE 138 Cb -0.16 -0.66 -0.00 0.00 0.01 0.00 0.00 42.46 41.65 1b66 s ILE 138 CO -0.08 0.14 -0.17 -0.69 0.00 0.00 0.00 174.94 174.13 1b66 s VAL 139 N -0.37 1.48 -0.18 2.92 1.01 -0.21 -4.98 120.40 120.06 1b66 s VAL 139 Ca 0.02 -0.73 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 1b66 s VAL 139 Cb -0.04 -1.28 -0.00 0.00 0.00 0.00 0.00 36.38 35.06 1b66 s VAL 139 CO -0.00 0.43 -0.11 -0.69 0.00 0.00 0.00 175.10 174.72 1b66 s VAL 140 N 0.13 2.90 -0.09 2.92 1.01 -1.26 -0.76 120.40 125.25 1b66 s VAL 140 Ca -0.06 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 61.28 1b66 s VAL 140 Cb -0.13 -2.27 0.00 0.00 0.00 0.00 0.00 36.38 33.99 1b66 s VAL 140 CO 0.03 0.48 -0.22 -0.47 0.00 0.00 0.00 175.10 174.93 1b66 s TYR 141 N 1.10 2.36 -0.15 5.22 5.04 -0.25 -5.01 117.35 125.66 1b66 s TYR 141 Ca 0.00 -0.96 0.15 0.00 -2.44 0.00 0.00 57.07 53.83 1b66 s TYR 141 Cb -0.14 -1.59 0.33 0.00 0.35 0.00 0.00 41.96 40.90 1b66 s TYR 141 CO -0.03 -0.40 1.17 1.63 -1.34 0.00 0.00 175.55 176.58 1b66 n LYS 142 N 3.59 1.31 -0.96 4.97 5.02 -1.26 -1.67 118.16 129.15 1b66 n LYS 142 Ca -0.20 -2.77 0.00 0.00 -2.02 0.00 0.00 58.31 53.32 1b66 n LYS 142 Cb 0.53 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.07 1b66 n LYS 142 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1b66 n GLY 143 N -1.21 0.48 0.72 0.72 0.00 -1.26 -4.93 105.19 99.71 1b66 n GLY 143 Ca 0.16 -0.37 0.13 0.00 0.00 0.00 0.00 46.02 45.94 1b66 n GLY 143 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50