#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1srd s THR 2 N 0.00 -0.00 0.13 0.00 -1.32 -1.26 -1.65 115.64 111.53 1srd s THR 2 Ca 0.00 0.01 0.09 0.00 -1.21 0.00 0.00 61.69 60.58 1srd s THR 2 Cb 0.00 -0.73 -0.04 0.00 -1.51 0.00 0.00 72.50 70.22 1srd s THR 2 CO 0.00 0.01 -0.21 -0.75 -2.21 0.00 0.00 174.62 171.45 1srd s LYS 3 N 0.57 1.24 0.04 7.08 2.20 0.17 -4.99 119.74 126.04 1srd s LYS 3 Ca -0.02 -1.29 -0.03 0.00 -0.36 0.00 0.00 55.97 54.27 1srd s LYS 3 Cb -0.04 -1.48 -0.02 0.00 -1.51 0.00 0.00 37.83 34.77 1srd s LYS 3 CO -0.03 0.33 0.04 0.15 -0.36 0.00 0.00 175.35 175.48 1srd s LYS 4 N -2.24 0.52 0.07 4.03 1.02 -1.26 0.32 119.74 122.20 1srd s LYS 4 Ca 0.11 -0.82 -0.17 0.00 0.02 0.00 0.00 55.97 55.11 1srd s LYS 4 Cb -0.09 0.20 0.03 0.00 -0.52 0.00 0.00 37.83 37.45 1srd s LYS 4 CO 0.06 -0.11 0.40 0.00 -0.92 0.00 0.00 175.35 174.77 1srd s ALA 5 N -2.62 -0.96 0.25 5.17 0.00 -0.11 -3.09 121.76 120.40 1srd s ALA 5 Ca -0.05 0.17 0.06 0.00 0.00 0.00 0.00 51.96 52.14 1srd s ALA 5 Cb -0.01 0.45 -0.05 0.00 0.00 0.00 0.00 23.12 23.51 1srd s ALA 5 CO -0.05 -0.51 -0.07 0.54 0.00 0.00 0.00 175.76 175.67 1srd s VAL 6 N -2.91 1.53 -0.20 0.00 0.11 -0.86 -0.18 120.40 117.89 1srd s VAL 6 Ca -0.03 -2.12 -0.05 0.00 -2.93 0.00 0.00 61.98 56.86 1srd s VAL 6 Cb 0.00 -2.33 0.10 0.00 -1.53 0.00 0.00 36.38 32.62 1srd s VAL 6 CO -0.05 -0.38 0.35 0.00 -3.33 0.00 0.00 175.10 171.69 1srd s ALA 7 N -3.09 -0.91 -0.51 1.54 0.00 0.88 -1.84 121.76 117.83 1srd s ALA 7 Ca 0.27 1.03 -0.17 0.00 0.00 0.00 0.00 51.96 53.10 1srd s ALA 7 Cb 0.03 -1.39 0.08 0.00 0.00 0.00 0.00 23.12 21.85 1srd s ALA 7 CO 0.10 -0.96 0.52 0.08 0.00 0.00 0.00 175.76 175.50 1srd s VAL 8 N 2.52 5.07 -0.08 0.00 1.01 -1.26 -1.42 120.40 126.23 1srd s VAL 8 Ca 0.05 -0.95 -0.30 0.00 0.00 0.00 0.00 61.98 60.79 1srd s VAL 8 Cb -0.14 -4.26 -0.03 0.00 0.00 0.00 0.00 36.38 31.96 1srd s VAL 8 CO -0.13 -0.76 1.22 -0.76 0.00 0.00 0.00 175.10 174.68 1srd s LEU 9 N 2.07 4.25 -0.11 3.92 1.02 -0.01 -4.34 118.68 125.48 1srd s LEU 9 Ca 0.08 1.79 -0.09 0.00 0.02 0.00 0.00 54.13 55.93 1srd s LEU 9 Cb -0.24 -3.55 0.03 0.00 0.02 0.00 0.00 46.19 42.45 1srd s LEU 9 CO 0.08 -0.64 0.28 -0.54 0.02 0.00 0.00 176.35 175.55 1srd s LYS 10 N 2.58 0.30 0.00 1.70 1.02 -0.77 -3.05 119.74 121.52 1srd s LYS 10 Ca 0.56 0.43 0.00 0.00 0.02 0.00 0.00 55.97 56.98 1srd s LYS 10 Cb -0.24 0.09 0.00 0.00 -0.52 0.00 0.00 37.83 37.16 1srd s LYS 10 CO 0.20 -0.07 0.00 0.41 -0.92 0.00 0.00 175.35 174.97 1srd n GLY 11 N 3.25 5.17 1.47 -3.33 0.00 -1.25 -3.69 105.19 106.82 1srd n GLY 11 Ca -0.16 -1.75 -0.03 0.00 0.00 0.00 0.00 46.02 44.08 1srd n GLY 11 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1srd n THR 12 N 0.00 2.67 -4.53 2.61 -1.04 -1.26 -4.91 114.28 107.82 1srd n THR 12 Ca 0.00 -2.04 -0.25 0.00 -2.04 0.00 0.00 64.05 59.72 1srd n THR 12 Cb 0.00 -0.33 -0.10 0.00 -1.82 0.00 0.00 70.33 68.08 1srd n THR 12 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1srd s SER 13 N -1.73 3.02 0.00 8.00 0.01 -1.26 -5.02 113.70 116.72 1srd s SER 13 Ca 0.49 -1.41 0.00 0.00 1.31 0.00 0.00 55.95 56.34 1srd s SER 13 Cb 0.41 -0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.51 1srd s SER 13 CO 0.08 -0.58 0.72 0.59 0.41 0.00 0.00 173.24 174.46 1srd n ASN 14 N -0.85 1.91 -4.68 2.44 4.13 -1.26 -4.80 115.26 112.15 1srd n ASN 14 Ca -0.04 -1.98 -0.39 0.00 1.68 0.00 0.00 54.58 53.85 1srd n ASN 14 Cb 0.67 -0.50 -0.07 0.00 -1.54 0.00 0.00 39.78 38.35 1srd n ASN 14 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1srd s VAL 15 N -0.53 5.14 0.00 2.41 1.01 -1.26 -4.22 120.40 122.95 1srd s VAL 15 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 61.98 62.91 1srd s VAL 15 Cb 0.00 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1srd s VAL 15 CO 0.00 0.24 0.00 1.21 0.00 0.00 0.00 175.10 176.55 1srd n GLU 16 N 4.37 0.29 0.00 2.72 4.07 -0.76 -3.93 120.64 127.40 1srd n GLU 16 Ca -0.06 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.04 1srd n GLU 16 Cb 0.51 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.89 1srd n GLU 16 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1srd n GLY 17 N 5.00 2.80 3.63 8.31 0.00 -1.17 -4.28 105.19 119.49 1srd n GLY 17 Ca 0.00 -1.92 -0.11 0.00 0.00 0.00 0.00 46.02 43.99 1srd n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1srd s VAL 18 N -2.86 0.00 -0.03 1.61 0.11 -0.71 -0.83 120.40 117.69 1srd s VAL 18 Ca 0.00 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 1srd s VAL 18 Cb 0.00 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.87 1srd s VAL 18 CO 0.00 0.00 -0.00 0.54 -3.33 0.00 0.00 175.10 172.31 1srd s VAL 19 N 0.82 0.17 -0.11 2.04 0.11 -0.51 -1.96 120.40 120.97 1srd s VAL 19 Ca -0.03 0.07 -0.01 0.00 -2.93 0.00 0.00 61.98 59.07 1srd s VAL 19 Cb -0.05 -0.25 -0.03 0.00 -1.53 0.00 0.00 36.38 34.52 1srd s VAL 19 CO -0.07 0.13 -0.05 0.42 -3.33 0.00 0.00 175.10 172.21 1srd s THR 20 N 0.90 3.86 -0.11 5.04 -4.23 -0.93 -0.08 115.64 120.09 1srd s THR 20 Ca -0.09 -0.40 0.02 0.00 -1.18 0.00 0.00 61.69 60.05 1srd s THR 20 Cb -0.12 -2.63 -0.01 0.00 1.34 0.00 0.00 72.50 71.08 1srd s THR 20 CO -0.02 0.56 -0.20 -0.76 -0.54 0.00 0.00 174.62 173.66 1srd s LEU 21 N -0.33 2.34 0.07 4.79 1.02 0.75 -1.60 118.68 125.73 1srd s LEU 21 Ca 0.05 -0.47 0.08 0.00 0.02 0.00 0.00 54.13 53.82 1srd s LEU 21 Cb -0.12 -1.49 -0.03 0.00 0.02 0.00 0.00 46.19 44.57 1srd s LEU 21 CO 0.02 0.17 -0.21 -0.89 0.02 0.00 0.00 176.35 175.45 1srd s THR 22 N 0.32 1.75 -0.18 5.49 2.01 0.37 -0.94 115.64 124.47 1srd s THR 22 Ca -0.15 -1.36 -0.11 0.00 0.31 0.00 0.00 61.69 60.37 1srd s THR 22 Cb -0.17 -1.54 0.06 0.00 0.01 0.00 0.00 72.50 70.85 1srd s THR 22 CO 0.08 0.12 0.44 -1.58 -0.69 0.00 0.00 174.62 172.98 1srd s GLN 23 N -1.49 0.44 -0.11 4.92 0.74 0.15 -0.60 119.66 123.71 1srd s GLN 23 Ca 0.08 0.78 -0.01 0.00 0.05 0.00 0.00 55.36 56.25 1srd s GLN 23 Cb -0.09 0.05 -0.03 0.00 1.10 0.00 0.00 33.01 34.04 1srd s GLN 23 CO 0.03 -0.13 -0.06 -1.21 -0.55 0.00 0.00 175.29 173.36 1srd s GLU 24 N 1.13 3.19 0.31 1.67 2.02 -1.25 0.42 118.70 126.19 1srd s GLU 24 Ca -0.07 -0.55 0.00 0.00 0.02 0.00 0.00 54.97 54.37 1srd s GLU 24 Cb -0.07 -2.72 0.00 0.00 0.10 0.00 0.00 34.13 31.44 1srd s GLU 24 CO -0.10 0.45 0.00 -0.25 0.02 0.00 0.00 175.26 175.38 1srd n ASP 25 N 2.88 0.00 0.00 -0.19 8.00 -0.66 -1.77 116.55 124.81 1srd n ASP 25 Ca -0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1srd n ASP 25 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 1srd n ASP 25 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1srd n ASP 26 N 2.01 0.00 0.00 -2.24 5.75 -1.26 -4.88 116.55 115.93 1srd n ASP 26 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1srd n ASP 26 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1srd n ASP 26 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1srd n GLY 27 N 0.00 4.57 3.89 6.12 0.00 -0.73 -5.14 105.19 113.90 1srd n GLY 27 Ca 0.00 -1.71 -0.29 0.00 0.00 0.00 0.00 46.02 44.02 1srd n GLY 27 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1srd s PRO 28 N 3.89 2.75 -0.02 1.61 0.05 -1.26 -4.84 135.00 137.18 1srd s PRO 28 Ca 0.00 0.32 0.05 0.00 0.05 0.00 0.00 61.00 61.42 1srd s PRO 28 Cb 0.00 -2.06 -0.03 0.00 0.05 0.00 0.00 34.50 32.46 1srd s PRO 28 CO 0.00 -1.05 -0.15 0.95 0.05 0.00 0.00 177.00 176.80 1srd s THR 29 N -3.32 3.00 -0.18 1.26 -4.23 -1.04 -3.85 115.64 107.27 1srd s THR 29 Ca 0.58 -0.85 -0.06 0.00 -1.18 0.00 0.00 61.69 60.18 1srd s THR 29 Cb -0.11 -2.20 -0.03 0.00 1.34 0.00 0.00 72.50 71.50 1srd s THR 29 CO 0.50 0.52 0.03 -0.89 -0.54 0.00 0.00 174.62 174.24 1srd s THR 30 N -0.79 4.36 -0.17 3.99 2.01 0.23 -1.10 115.64 124.17 1srd s THR 30 Ca 0.13 -0.18 0.01 0.00 0.31 0.00 0.00 61.69 61.95 1srd s THR 30 Cb -0.11 -2.96 0.02 0.00 0.01 0.00 0.00 72.50 69.46 1srd s THR 30 CO 0.02 0.45 -0.18 0.54 -0.69 0.00 0.00 174.62 174.76 1srd s VAL 31 N 0.59 1.91 -0.23 3.82 0.11 0.11 -0.48 120.40 126.23 1srd s VAL 31 Ca 0.01 -0.85 -0.08 0.00 -2.93 0.00 0.00 61.98 58.13 1srd s VAL 31 Cb -0.14 -1.74 -0.04 0.00 -1.53 0.00 0.00 36.38 32.93 1srd s VAL 31 CO 0.02 0.51 0.09 0.20 -3.33 0.00 0.00 175.10 172.59 1srd s ASN 32 N 1.35 5.56 -0.08 3.54 -0.87 -0.63 -1.17 114.94 122.65 1srd s ASN 32 Ca 0.05 -0.03 0.03 0.00 -1.57 0.00 0.00 52.86 51.34 1srd s ASN 32 Cb -0.13 -1.99 0.00 0.00 -0.02 0.00 0.00 41.25 39.12 1srd s ASN 32 CO -0.12 0.06 -0.19 0.68 -2.57 0.00 0.00 177.10 174.96 1srd s VAL 33 N 1.07 1.66 -0.08 1.60 -7.23 0.77 -2.18 120.40 116.01 1srd s VAL 33 Ca 0.05 -0.79 -0.02 0.00 -1.81 0.00 0.00 61.98 59.41 1srd s VAL 33 Cb -0.14 -1.45 0.03 0.00 0.56 0.00 0.00 36.38 35.38 1srd s VAL 33 CO 0.04 0.47 0.04 -0.60 -0.31 0.00 0.00 175.10 174.73 1srd s ARG 34 N 0.42 0.27 0.00 4.82 3.52 -0.83 -1.35 118.95 125.81 1srd s ARG 34 Ca -0.16 0.16 0.01 0.00 -0.13 0.00 0.00 55.73 55.61 1srd s ARG 34 Cb -0.17 -0.97 -0.01 0.00 -1.56 0.00 0.00 34.95 32.25 1srd s ARG 34 CO 0.06 -0.38 -0.04 0.42 -0.81 0.00 0.00 175.30 174.56 1srd s ILE 35 N 2.06 0.27 0.09 4.11 1.01 -0.62 -1.74 121.20 126.39 1srd s ILE 35 Ca 0.04 -0.30 0.06 0.00 0.00 0.00 0.00 60.65 60.45 1srd s ILE 35 Cb -0.13 -0.26 -0.03 0.00 0.01 0.00 0.00 42.46 42.05 1srd s ILE 35 CO -0.05 -0.02 -0.15 -0.44 0.00 0.00 0.00 174.94 174.28 1srd s SER 36 N -0.34 1.88 0.00 3.58 0.01 -1.25 0.88 113.70 118.46 1srd s SER 36 Ca -0.01 -0.70 0.00 0.00 1.31 0.00 0.00 55.95 56.55 1srd s SER 36 Cb -0.03 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.14 1srd s SER 36 CO -0.00 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.17 1srd n GLY 37 N 0.98 0.91 3.76 3.44 0.00 0.19 -1.82 105.19 112.64 1srd n GLY 37 Ca -0.19 -0.12 -0.25 0.00 0.00 0.00 0.00 46.02 45.46 1srd n GLY 37 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1srd s LEU 38 N 0.00 3.63 0.24 0.99 2.96 -1.19 -4.27 118.68 121.04 1srd s LEU 38 Ca 0.00 -0.26 -0.30 0.00 -0.22 0.00 0.00 54.13 53.35 1srd s LEU 38 Cb 0.00 -2.23 -0.09 0.00 0.50 0.00 0.00 46.19 44.37 1srd s LEU 38 CO 0.00 0.05 0.98 0.00 -1.32 0.00 0.00 176.35 176.06 1srd s ALA 39 N -1.85 3.35 0.29 5.97 0.00 -1.26 -4.19 121.76 124.07 1srd s ALA 39 Ca 0.30 0.68 -0.29 0.00 0.00 0.00 0.00 51.96 52.66 1srd s ALA 39 Cb -0.09 -3.24 -0.14 0.00 0.00 0.00 0.00 23.12 19.65 1srd s ALA 39 CO 0.22 0.12 1.15 -0.35 0.00 0.00 0.00 175.76 176.90 1srd n PRO 40 N 1.47 1.66 0.00 0.00 -0.04 -1.26 -4.68 135.00 132.15 1srd n PRO 40 Ca -0.02 0.58 0.00 0.00 -0.04 0.00 0.00 63.50 64.03 1srd n PRO 40 Cb 0.47 -2.06 0.00 0.00 -0.04 0.00 0.00 33.50 31.86 1srd n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1srd n GLY 41 N 1.25 0.59 3.69 0.55 0.00 -0.47 -4.89 105.19 105.91 1srd n GLY 41 Ca 0.09 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.58 1srd n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1srd s LYS 42 N -0.92 4.38 0.00 1.61 1.02 -1.26 0.41 119.74 124.97 1srd s LYS 42 Ca 0.00 0.96 0.00 0.00 0.02 0.00 0.00 55.97 56.95 1srd s LYS 42 Cb 0.00 -3.51 0.00 0.00 -0.52 0.00 0.00 37.83 33.80 1srd s LYS 42 CO 0.00 -0.12 0.00 0.72 -0.92 0.00 0.00 175.35 175.03 1srd n HIS 43 N 4.45 0.00 0.00 3.18 8.25 -0.89 -2.57 115.22 127.65 1srd n HIS 43 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 1srd n HIS 43 Cb 0.50 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.61 1srd n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1srd n GLY 44 N 4.43 3.20 2.73 -1.41 0.00 -1.26 -1.91 105.19 110.97 1srd n GLY 44 Ca 0.00 0.02 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 1srd n GLY 44 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1srd s PHE 45 N 0.00 -0.20 0.26 1.61 5.36 -0.14 0.10 117.98 124.97 1srd s PHE 45 Ca 0.00 0.15 0.06 0.00 -0.96 0.00 0.00 56.93 56.18 1srd s PHE 45 Cb 0.00 -0.41 -0.05 0.00 -0.34 0.00 0.00 43.02 42.21 1srd s PHE 45 CO 0.00 -0.58 -0.05 -1.01 -1.46 0.00 0.00 175.22 172.13 1srd s HIS 46 N 2.30 1.80 -0.46 10.12 3.76 -0.38 -2.81 115.29 129.62 1srd s HIS 46 Ca 0.06 -0.77 -0.12 0.00 -0.15 0.00 0.00 55.06 54.08 1srd s HIS 46 Cb -0.16 -1.02 0.09 0.00 1.11 0.00 0.00 32.58 32.60 1srd s HIS 46 CO -0.11 0.18 0.34 -1.17 -0.85 0.00 0.00 174.74 173.13 1srd s LEU 47 N -3.39 5.52 0.41 0.89 1.98 0.96 -0.06 118.68 125.00 1srd s LEU 47 Ca 0.28 -1.56 -0.18 0.00 -2.89 0.00 0.00 54.13 49.78 1srd s LEU 47 Cb 0.04 -2.08 -0.10 0.00 0.66 0.00 0.00 46.19 44.72 1srd s LEU 47 CO 0.10 -0.64 0.89 -1.00 -1.89 0.00 0.00 176.35 173.81 1srd s HIS 48 N 1.50 3.36 0.00 5.38 3.76 0.22 -1.40 115.29 128.10 1srd s HIS 48 Ca 0.04 1.45 0.00 0.00 -0.15 0.00 0.00 55.06 56.40 1srd s HIS 48 Cb -0.25 -2.73 0.00 0.00 1.11 0.00 0.00 32.58 30.71 1srd s HIS 48 CO 0.03 -0.09 0.56 -1.91 -0.85 0.00 0.00 174.74 172.48 1srd n GLU 49 N -0.74 0.00 -2.07 1.40 2.13 0.20 -3.03 120.64 118.53 1srd n GLU 49 Ca 0.06 0.41 -0.29 0.00 0.66 0.00 0.00 57.16 58.00 1srd n GLU 49 Cb 0.54 -1.06 0.04 0.00 0.27 0.00 0.00 31.44 31.22 1srd n GLU 49 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 1srd s PHE 50 N -1.25 3.31 -2.41 4.31 0.08 -0.13 -4.33 117.98 117.56 1srd s PHE 50 Ca 0.00 0.92 0.24 0.00 0.12 0.00 0.00 56.93 58.20 1srd s PHE 50 Cb 0.00 -2.94 0.20 0.00 -0.57 0.00 0.00 43.02 39.71 1srd s PHE 50 CO 0.00 -1.03 1.24 0.41 -0.10 0.00 0.00 175.22 175.73 1srd n GLY 51 N -2.85 0.34 0.00 4.36 0.00 -1.20 -3.26 105.19 102.59 1srd n GLY 51 Ca 0.06 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.45 1srd n GLY 51 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1srd n ASP 52 N 0.46 0.00 0.00 1.61 9.92 -1.26 -4.78 116.55 122.49 1srd n ASP 52 Ca 0.12 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.38 1srd n ASP 52 Cb 0.50 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.98 1srd n ASP 52 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1srd n THR 53 N 0.00 0.00 -0.20 -3.53 -1.04 -1.24 -4.91 114.28 103.35 1srd n THR 53 Ca 0.00 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 62.03 1srd n THR 53 Cb 0.00 0.00 0.27 0.00 -1.82 0.00 0.00 70.33 68.78 1srd n THR 53 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 1srd h THR 54 N 0.00 1.15 -2.29 12.58 1.35 -1.95 -2.44 112.91 121.32 1srd h THR 54 Ca 0.00 -0.33 -0.62 0.00 -0.55 0.00 0.00 66.41 64.91 1srd h THR 54 Cb 0.00 0.12 -0.40 0.00 -1.73 0.00 0.00 68.15 66.14 1srd h THR 54 CO 0.00 0.17 -0.40 -3.20 -0.25 0.00 0.00 175.52 171.84 1srd n ASN 55 N -4.44 4.49 0.00 5.36 4.05 -1.26 -5.05 115.26 118.41 1srd n ASN 55 Ca 0.09 -3.56 0.00 0.00 0.45 0.00 0.00 54.58 51.56 1srd n ASN 55 Cb 0.07 -0.70 0.00 0.00 1.23 0.00 0.00 39.78 40.38 1srd n ASN 55 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1srd n GLY 56 N 0.39 2.57 0.27 8.20 0.00 -0.92 -1.47 105.19 114.22 1srd n GLY 56 Ca 0.31 -0.13 0.13 0.00 0.00 0.00 0.00 46.02 46.33 1srd n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1srd n MET 58 N -0.60 1.75 0.00 0.00 2.00 -0.54 -3.38 117.12 116.35 1srd n MET 58 Ca 0.11 -0.64 0.00 0.00 0.00 0.00 0.00 57.70 57.17 1srd n MET 58 Cb 0.37 -1.58 0.00 0.00 0.00 0.00 0.00 33.22 32.01 1srd n MET 58 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1srd n SER 59 N 0.10 0.19 0.00 7.83 3.41 -1.23 -4.69 113.62 119.24 1srd n SER 59 Ca 0.06 -1.02 0.15 0.00 -0.26 0.00 0.00 58.87 57.79 1srd n SER 59 Cb 0.40 0.00 0.83 0.00 -0.26 0.00 0.00 64.21 65.18 1srd n SER 59 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1srd n THR 60 N -0.01 0.02 -4.79 6.66 -2.24 -1.22 -4.30 114.28 108.42 1srd n THR 60 Ca 0.00 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1srd n THR 60 Cb 0.24 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 67.93 1srd n THR 60 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1srd n GLY 61 N 0.96 0.88 0.44 3.38 0.00 -1.26 -0.95 105.19 108.63 1srd n GLY 61 Ca 0.19 -0.69 -0.03 0.00 0.00 0.00 0.00 46.02 45.49 1srd n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1srd n PRO 62 N 1.20 -0.56 -2.53 1.61 -0.04 -1.26 -4.57 135.00 128.85 1srd n PRO 62 Ca 0.00 -0.23 -0.38 0.00 -0.04 0.00 0.00 63.50 62.85 1srd n PRO 62 Cb 0.00 -0.17 -0.04 0.00 -0.04 0.00 0.00 33.50 33.25 1srd n PRO 62 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1srd s HIS 63 N -1.30 3.40 0.00 0.54 3.76 -1.26 0.60 115.29 121.03 1srd s HIS 63 Ca 0.09 1.67 -0.30 0.00 -0.15 0.00 0.00 55.06 56.37 1srd s HIS 63 Cb -0.00 -3.17 -0.08 0.00 1.11 0.00 0.00 32.58 30.44 1srd s HIS 63 CO 0.06 -0.56 1.84 0.12 -0.85 0.00 0.00 174.74 175.35 1srd s PHE 64 N -1.48 1.58 -0.43 1.40 5.36 -0.49 -4.37 117.98 119.56 1srd s PHE 64 Ca 0.53 -0.19 0.07 0.00 -0.96 0.00 0.00 56.93 56.38 1srd s PHE 64 Cb -0.25 -4.11 0.24 0.00 -0.34 0.00 0.00 43.02 38.56 1srd s PHE 64 CO 0.32 -4.86 0.63 -1.71 -1.46 0.00 0.00 175.22 168.14 1srd n ASN 65 N 7.34 -0.93 0.22 6.13 5.15 -1.26 -2.07 115.26 129.85 1srd n ASN 65 Ca 0.19 -2.87 0.09 0.00 -0.60 0.00 0.00 54.58 51.39 1srd n ASN 65 Cb 0.42 0.20 0.50 0.00 -0.53 0.00 0.00 39.78 40.37 1srd n ASN 65 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1srd h PRO 66 N 4.13 0.00 0.00 1.20 0.13 -1.92 -3.05 132.00 132.49 1srd h PRO 66 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1srd h PRO 66 Cb 0.93 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.06 1srd h PRO 66 CO 0.40 0.25 -0.31 -0.25 -0.23 0.00 0.00 178.00 177.86 1srd n ASP 67 N -3.59 0.44 -2.63 1.44 8.00 -1.26 -4.96 116.55 113.99 1srd n ASP 67 Ca -0.01 0.18 -0.03 0.00 0.71 0.00 0.00 54.79 55.64 1srd n ASP 67 Cb 0.39 -0.15 0.00 0.00 -0.02 0.00 0.00 41.12 41.34 1srd n ASP 67 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1srd n LYS 68 N -1.75 -1.46 -2.00 -1.24 5.02 -1.16 -5.06 118.16 110.51 1srd n LYS 68 Ca 0.05 1.54 -0.00 0.00 -2.02 0.00 0.00 58.31 57.88 1srd n LYS 68 Cb 0.37 -4.80 -0.00 0.00 -0.02 0.00 0.00 35.03 30.59 1srd n LYS 68 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1srd n LYS 69 N -0.95 0.53 -2.54 1.97 5.02 -1.26 -5.15 118.16 115.79 1srd n LYS 69 Ca 0.05 -0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.09 1srd n LYS 69 Cb 0.43 0.00 0.12 0.00 -0.02 0.00 0.00 35.03 35.56 1srd n LYS 69 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1srd s THR 70 N -1.73 2.07 0.06 -0.18 2.01 -0.60 -4.82 115.64 112.44 1srd s THR 70 Ca 0.00 -0.55 -0.21 0.00 0.31 0.00 0.00 61.69 61.24 1srd s THR 70 Cb 0.00 -2.52 -0.06 0.00 0.01 0.00 0.00 72.50 69.93 1srd s THR 70 CO 0.00 0.00 0.62 -2.28 -0.69 0.00 0.00 174.62 172.27 1srd s HIS 71 N -3.24 3.78 0.00 4.92 2.46 -0.19 -1.60 115.29 121.42 1srd s HIS 71 Ca 0.68 1.31 0.00 0.00 0.47 0.00 0.00 55.06 57.52 1srd s HIS 71 Cb -0.04 -2.59 0.00 0.00 -0.13 0.00 0.00 32.58 29.82 1srd s HIS 71 CO 0.46 0.49 0.00 0.41 -2.47 0.00 0.00 174.74 173.63 1srd n GLY 72 N 1.96 4.62 3.90 1.59 0.00 -1.26 -4.10 105.19 111.90 1srd n GLY 72 Ca -0.08 -1.20 -0.21 0.00 0.00 0.00 0.00 46.02 44.52 1srd n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1srd s ALA 73 N -1.72 3.83 0.38 4.61 0.00 -1.25 -4.65 121.76 122.96 1srd s ALA 73 Ca 0.00 -1.42 0.06 0.00 0.00 0.00 0.00 51.96 50.61 1srd s ALA 73 Cb 0.00 -1.46 0.78 0.00 0.00 0.00 0.00 23.12 22.45 1srd s ALA 73 CO 0.00 0.16 1.99 -1.00 0.00 0.00 0.00 175.76 176.91 1srd h PRO 74 N 1.26 0.67 -3.08 0.00 0.13 -1.90 -2.61 132.00 126.48 1srd h PRO 74 Ca -0.48 -0.04 -0.80 0.00 -0.87 0.00 0.00 66.00 63.81 1srd h PRO 74 Cb 1.24 -0.15 -0.25 0.00 0.13 0.00 0.00 31.00 31.97 1srd h PRO 74 CO 0.59 0.44 1.09 -0.85 -0.23 0.00 0.00 178.00 179.05 1srd n GLU 75 N -4.47 4.26 -3.92 0.86 -0.00 -1.26 -4.91 120.64 111.19 1srd n GLU 75 Ca 0.08 -4.30 -0.10 0.00 -0.00 0.00 0.00 57.16 52.85 1srd n GLU 75 Cb 0.18 -2.62 -0.06 0.00 -0.00 0.00 0.00 31.44 28.95 1srd n GLU 75 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1srd s ASP 76 N -1.08 -0.04 -0.10 -1.84 1.01 -0.99 -5.07 116.67 108.56 1srd s ASP 76 Ca 0.33 -0.80 0.20 0.00 0.71 0.00 0.00 52.55 52.99 1srd s ASP 76 Cb 0.06 0.49 -0.30 0.00 1.01 0.00 0.00 42.92 44.18 1srd s ASP 76 CO 0.08 -0.97 0.31 1.21 0.21 0.00 0.00 175.17 176.01 1srd n GLU 77 N -0.27 0.67 0.00 8.23 0.00 -1.26 -4.46 120.64 123.55 1srd n GLU 77 Ca -0.07 -0.11 0.13 0.00 0.00 0.00 0.00 57.16 57.11 1srd n GLU 77 Cb 0.63 -1.53 0.41 0.00 0.00 0.00 0.00 31.44 30.96 1srd n GLU 77 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1srd n VAL 78 N -2.49 0.00 -0.91 6.31 0.31 -1.26 -4.99 118.33 115.30 1srd n VAL 78 Ca -0.17 -0.06 -0.34 0.00 -0.01 0.00 0.00 64.34 63.75 1srd n VAL 78 Cb 0.83 0.17 0.08 0.00 -0.91 0.00 0.00 33.84 34.01 1srd n VAL 78 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1srd n ARG 79 N -1.04 -0.13 0.00 5.55 0.63 -1.25 -1.56 116.66 118.86 1srd n ARG 79 Ca 0.10 -0.01 0.00 0.00 -0.92 0.00 0.00 57.85 57.02 1srd n ARG 79 Cb 0.33 -1.49 0.00 0.00 0.45 0.00 0.00 32.46 31.75 1srd n ARG 79 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1srd n HIS 80 N -3.04 0.00 0.00 -0.14 8.25 -0.63 -4.46 115.22 115.20 1srd n HIS 80 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 1srd n HIS 80 Cb 0.54 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.65 1srd n HIS 80 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1srd n ALA 81 N -0.61 0.00 1.43 -1.41 0.00 -1.16 -4.54 120.51 114.23 1srd n ALA 81 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1srd n ALA 81 Cb 0.00 0.00 0.47 0.00 0.00 0.00 0.00 19.45 19.92 1srd n ALA 81 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1srd n GLY 82 N 0.00 0.12 3.71 0.00 0.00 -0.88 -4.62 105.19 103.53 1srd n GLY 82 Ca 0.00 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 1srd n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1srd s ASP 83 N -1.98 7.10 -0.00 1.61 1.01 -1.26 -0.03 116.67 123.12 1srd s ASP 83 Ca 0.37 1.98 0.00 0.00 0.71 0.00 0.00 52.55 55.61 1srd s ASP 83 Cb 0.21 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.56 1srd s ASP 83 CO 0.33 -0.46 0.58 -0.11 0.21 0.00 0.00 175.17 175.72 1srd n LEU 84 N 3.98 0.17 0.00 1.23 7.94 -1.12 -4.55 117.00 124.64 1srd n LEU 84 Ca 0.09 -0.25 0.00 0.00 -1.11 0.00 0.00 56.01 54.73 1srd n LEU 84 Cb 0.47 -0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.41 1srd n LEU 84 CO 0.55 0.06 0.00 0.61 -1.11 0.00 0.00 177.39 177.51 1srd n GLY 85 N -0.05 -0.23 3.60 -3.96 0.00 -1.25 -4.78 105.19 98.52 1srd n GLY 85 Ca 0.00 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.66 1srd n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1srd s ASN 86 N -4.00 4.70 -0.15 1.61 -0.87 -1.26 -0.97 114.94 114.00 1srd s ASN 86 Ca 0.00 -0.06 -0.07 0.00 -1.57 0.00 0.00 52.86 51.16 1srd s ASN 86 Cb 0.00 -1.16 -0.04 0.00 -0.02 0.00 0.00 41.25 40.03 1srd s ASN 86 CO 0.00 0.32 0.09 0.27 -2.57 0.00 0.00 177.10 175.21 1srd s ILE 87 N -0.91 5.06 -0.03 0.60 -4.36 -1.26 -4.88 121.20 115.41 1srd s ILE 87 Ca 0.15 0.05 -0.23 0.00 -0.26 0.00 0.00 60.65 60.36 1srd s ILE 87 Cb -0.11 -3.24 -0.05 0.00 1.25 0.00 0.00 42.46 40.31 1srd s ILE 87 CO 0.05 0.52 0.68 -0.69 0.24 0.00 0.00 174.94 175.73 1srd s VAL 88 N -0.20 4.95 -0.20 8.37 1.01 -1.26 -2.09 120.40 130.97 1srd s VAL 88 Ca 0.09 1.41 -0.15 0.00 0.00 0.00 0.00 61.98 63.33 1srd s VAL 88 Cb -0.12 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 1srd s VAL 88 CO 0.01 0.32 0.34 0.00 0.00 0.00 0.00 175.10 175.77 1srd s ALA 89 N 0.34 3.57 0.85 5.51 0.00 0.17 -4.43 121.76 127.76 1srd s ALA 89 Ca 0.36 -0.57 -0.11 0.00 0.00 0.00 0.00 51.96 51.64 1srd s ALA 89 Cb -0.18 -2.53 0.10 0.00 0.00 0.00 0.00 23.12 20.50 1srd s ALA 89 CO 0.19 -0.20 1.09 0.54 0.00 0.00 0.00 175.76 177.38 1srd s ASN 90 N 0.92 3.88 0.47 0.00 2.20 0.12 -1.37 114.94 121.16 1srd s ASN 90 Ca 0.17 1.64 0.14 0.00 -0.94 0.00 0.00 52.86 53.87 1srd s ASN 90 Cb -0.14 -2.32 0.78 0.00 -2.00 0.00 0.00 41.25 37.57 1srd s ASN 90 CO 0.07 -2.41 1.36 0.00 -2.94 0.00 0.00 177.10 173.18 1srd h THR 91 N -1.39 0.00 -0.01 0.54 1.03 -1.97 0.25 112.91 111.37 1srd h THR 91 Ca -0.47 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.93 1srd h THR 91 Cb 1.26 0.32 0.00 0.00 -1.07 0.00 0.00 68.15 68.66 1srd h THR 91 CO 0.53 0.00 -0.40 0.47 -0.01 0.00 0.00 175.52 176.11 1srd n ASP 92 N -2.32 1.53 0.00 0.00 8.00 -1.26 -4.83 116.55 117.67 1srd n ASP 92 Ca -0.01 -1.27 0.00 0.00 0.71 0.00 0.00 54.79 54.22 1srd n ASP 92 Cb 0.49 0.54 0.00 0.00 -0.02 0.00 0.00 41.12 42.14 1srd n ASP 92 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1srd n GLY 93 N 1.20 0.53 3.78 0.44 0.00 0.88 -4.71 105.19 107.29 1srd n GLY 93 Ca 0.06 -0.84 -0.35 0.00 0.00 0.00 0.00 46.02 44.88 1srd n GLY 93 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1srd s VAL 94 N -2.00 4.87 -0.11 1.61 -7.23 -1.26 -0.64 120.40 115.64 1srd s VAL 94 Ca 0.00 -0.09 0.00 0.00 -1.81 0.00 0.00 61.98 60.08 1srd s VAL 94 Cb 0.00 -3.11 0.02 0.00 0.56 0.00 0.00 36.38 33.85 1srd s VAL 94 CO 0.00 0.57 -0.09 0.00 -0.31 0.00 0.00 175.10 175.27 1srd s ALA 95 N -1.00 1.40 -0.22 1.32 0.00 0.25 0.12 121.76 123.64 1srd s ALA 95 Ca 0.16 -0.59 0.02 0.00 0.00 0.00 0.00 51.96 51.55 1srd s ALA 95 Cb -0.12 -0.89 0.04 0.00 0.00 0.00 0.00 23.12 22.15 1srd s ALA 95 CO 0.05 -0.35 -0.14 -1.21 0.00 0.00 0.00 175.76 174.11 1srd s GLU 96 N 1.55 2.47 0.08 0.00 2.02 -1.24 -1.59 118.70 121.99 1srd s GLU 96 Ca 0.03 -1.07 -0.00 0.00 0.02 0.00 0.00 54.97 53.94 1srd s GLU 96 Cb -0.13 -2.69 -0.04 0.00 0.10 0.00 0.00 34.13 31.37 1srd s GLU 96 CO -0.07 -0.42 -0.02 0.00 0.02 0.00 0.00 175.26 174.77 1srd s ALA 97 N 1.22 0.72 -0.05 5.21 0.00 -0.45 -4.94 121.76 123.47 1srd s ALA 97 Ca -0.03 -1.31 -0.01 0.00 0.00 0.00 0.00 51.96 50.61 1srd s ALA 97 Cb -0.17 0.38 0.03 0.00 0.00 0.00 0.00 23.12 23.36 1srd s ALA 97 CO -0.08 -0.36 0.02 0.99 0.00 0.00 0.00 175.76 176.33 1srd s THR 98 N -3.87 0.12 0.00 0.00 2.01 -1.26 -0.16 115.64 112.49 1srd s THR 98 Ca 0.12 0.22 0.04 0.00 0.31 0.00 0.00 61.69 62.39 1srd s THR 98 Cb 0.07 -0.30 -0.01 0.00 0.01 0.00 0.00 72.50 72.27 1srd s THR 98 CO -0.06 0.19 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.31 1srd s ILE 99 N 1.72 0.96 -0.23 1.82 -1.09 -0.32 -4.97 121.20 119.10 1srd s ILE 99 Ca -0.00 -0.62 0.01 0.00 -2.23 0.00 0.00 60.65 57.81 1srd s ILE 99 Cb -0.13 -0.82 0.04 0.00 -1.58 0.00 0.00 42.46 39.97 1srd s ILE 99 CO -0.03 0.19 -0.13 -0.69 -1.23 0.00 0.00 174.94 173.05 1srd s VAL 100 N -0.42 2.28 -0.03 2.92 1.01 -1.26 0.08 120.40 124.97 1srd s VAL 100 Ca 0.04 -1.24 0.04 0.00 0.00 0.00 0.00 61.98 60.81 1srd s VAL 100 Cb -0.05 -2.16 -0.00 0.00 0.00 0.00 0.00 36.38 34.16 1srd s VAL 100 CO -0.00 0.23 -0.16 -0.62 0.00 0.00 0.00 175.10 174.56 1srd s ASP 101 N 1.22 1.96 -0.30 3.32 2.15 -0.26 -4.95 116.67 119.81 1srd s ASP 101 Ca -0.02 -0.31 0.08 0.00 0.43 0.00 0.00 52.55 52.73 1srd s ASP 101 Cb -0.17 -0.48 0.65 0.00 -0.30 0.00 0.00 42.92 42.62 1srd s ASP 101 CO -0.08 0.15 1.69 -3.20 -0.17 0.00 0.00 175.17 173.55 1srd n ASN 102 N 3.09 4.39 0.00 -0.34 4.05 -1.26 -2.49 115.26 122.70 1srd n ASN 102 Ca -0.17 -3.09 0.00 0.00 0.45 0.00 0.00 54.58 51.76 1srd n ASN 102 Cb 0.53 -0.73 0.00 0.00 1.23 0.00 0.00 39.78 40.82 1srd n ASN 102 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1srd n GLN 103 N -0.18 0.34 -3.43 1.20 6.02 -1.26 -4.86 117.38 115.20 1srd n GLN 103 Ca 0.38 -0.31 -0.28 0.00 -0.01 0.00 0.00 57.00 56.78 1srd n GLN 103 Cb 1.29 -0.79 -0.08 0.00 1.02 0.00 0.00 30.24 31.69 1srd n GLN 103 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 1srd n ILE 104 N -0.14 2.44 -1.99 5.09 -5.35 -1.26 -4.90 119.36 113.25 1srd n ILE 104 Ca 0.00 -5.23 -0.33 0.00 -0.27 0.00 0.00 62.75 56.92 1srd n ILE 104 Cb 0.05 -2.11 0.02 0.00 -1.74 0.00 0.00 39.64 35.87 1srd n ILE 104 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 1srd s PRO 105 N -2.44 3.17 0.00 6.28 0.04 -1.26 -4.79 135.00 136.00 1srd s PRO 105 Ca 0.39 1.31 0.25 0.00 0.04 0.00 0.00 61.00 62.98 1srd s PRO 105 Cb 0.14 -2.01 0.52 0.00 0.04 0.00 0.00 34.50 33.19 1srd s PRO 105 CO -0.02 -0.94 1.45 1.28 0.04 0.00 0.00 177.00 178.81 1srd n LEU 106 N -2.04 2.53 -3.95 -3.56 4.77 -1.26 -0.22 117.00 113.27 1srd n LEU 106 Ca 0.10 -0.92 -0.09 0.00 -0.03 0.00 0.00 56.01 55.07 1srd n LEU 106 Cb 0.52 -0.05 -0.09 0.00 -2.33 0.00 0.00 43.42 41.46 1srd n LEU 106 CO 0.47 0.46 -0.24 0.42 -1.33 0.00 0.00 177.39 177.16 1srd s THR 107 N -1.89 0.14 0.00 -5.08 -4.23 -1.26 -4.80 115.64 98.52 1srd s THR 107 Ca 0.33 -1.17 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 1srd s THR 107 Cb 0.20 -0.93 0.00 0.00 1.34 0.00 0.00 72.50 73.11 1srd s THR 107 CO 0.31 -0.65 0.00 0.61 -0.54 0.00 0.00 174.62 174.35 1srd n GLY 108 N 0.73 -1.48 3.70 3.99 0.00 -1.26 -4.27 105.19 106.60 1srd n GLY 108 Ca -0.19 -1.29 -0.35 0.00 0.00 0.00 0.00 46.02 44.20 1srd n GLY 108 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1srd n PRO 109 N -0.18 0.54 -0.14 1.61 -0.04 -1.26 -1.40 135.00 134.13 1srd n PRO 109 Ca 0.00 0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 1srd n PRO 109 Cb 0.00 -2.47 0.00 0.00 -0.04 0.00 0.00 33.50 30.99 1srd n PRO 109 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1srd n ASN 110 N -2.73 0.00 -4.60 3.54 4.13 -1.26 -4.98 115.26 109.36 1srd n ASN 110 Ca 0.14 0.00 -0.38 0.00 1.68 0.00 0.00 54.58 56.03 1srd n ASN 110 Cb 0.49 -0.18 0.05 0.00 -1.54 0.00 0.00 39.78 38.61 1srd n ASN 110 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1srd n SER 111 N 0.00 0.56 -2.48 6.41 2.88 -0.49 -4.39 113.62 116.11 1srd n SER 111 Ca 0.00 0.80 -0.31 0.00 -1.33 0.00 0.00 58.87 58.03 1srd n SER 111 Cb 0.00 -1.36 0.03 0.00 -0.75 0.00 0.00 64.21 62.13 1srd n SER 111 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1srd n VAL 112 N -1.70 2.99 -3.93 2.46 0.24 0.69 -4.95 118.33 114.12 1srd n VAL 112 Ca 0.13 -4.23 -0.36 0.00 -2.04 0.00 0.00 64.34 57.84 1srd n VAL 112 Cb 0.47 -1.21 -0.08 0.00 -1.47 0.00 0.00 33.84 31.55 1srd n VAL 112 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1srd s VAL 113 N -5.08 5.21 -0.22 3.34 1.01 -1.26 -4.32 120.40 119.08 1srd s VAL 113 Ca 0.53 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.61 1srd s VAL 113 Cb 0.43 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 33.52 1srd s VAL 113 CO -0.17 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.09 1srd n GLY 114 N 2.62 0.55 1.58 4.51 0.00 0.16 -4.98 105.19 109.63 1srd n GLY 114 Ca -0.18 -0.48 -0.09 0.00 0.00 0.00 0.00 46.02 45.27 1srd n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1srd n ARG 115 N -2.60 0.94 -4.23 1.61 1.74 -1.26 -3.20 116.66 109.65 1srd n ARG 115 Ca -0.02 -1.31 -0.19 0.00 -0.77 0.00 0.00 57.85 55.56 1srd n ARG 115 Cb 0.11 -0.02 -0.12 0.00 -1.02 0.00 0.00 32.46 31.41 1srd n ARG 115 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1srd s ALA 116 N -2.30 1.47 -0.11 7.54 0.00 -1.17 -0.21 121.76 126.98 1srd s ALA 116 Ca 0.21 -1.20 -0.04 0.00 0.00 0.00 0.00 51.96 50.93 1srd s ALA 116 Cb -0.02 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 1srd s ALA 116 CO 0.13 0.17 0.06 -0.51 0.00 0.00 0.00 175.76 175.61 1srd s LEU 117 N -2.15 3.90 -0.05 0.00 1.43 -0.90 0.70 118.68 121.61 1srd s LEU 117 Ca 0.05 0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.44 1srd s LEU 117 Cb -0.07 -1.93 0.00 0.00 0.03 0.00 0.00 46.19 44.22 1srd s LEU 117 CO 0.03 0.36 -0.15 -0.69 0.23 0.00 0.00 176.35 176.14 1srd s VAL 118 N -0.77 1.26 -0.12 -1.59 1.01 0.92 -2.95 120.40 118.15 1srd s VAL 118 Ca 0.12 -0.60 -0.13 0.00 0.00 0.00 0.00 61.98 61.37 1srd s VAL 118 Cb -0.12 -1.11 -0.05 0.00 0.00 0.00 0.00 36.38 35.11 1srd s VAL 118 CO 0.03 0.37 0.30 0.54 0.00 0.00 0.00 175.10 176.34 1srd s VAL 119 N 0.27 5.27 0.05 2.92 0.11 0.24 -1.24 120.40 128.01 1srd s VAL 119 Ca -0.08 0.58 0.02 0.00 -2.93 0.00 0.00 61.98 59.58 1srd s VAL 119 Cb -0.13 -3.62 -0.04 0.00 -1.53 0.00 0.00 36.38 31.06 1srd s VAL 119 CO 0.03 0.47 0.07 -1.00 -3.33 0.00 0.00 175.10 171.33 1srd s HIS 120 N -0.11 3.19 0.00 1.54 3.76 0.28 -1.95 115.29 122.01 1srd s HIS 120 Ca 0.18 0.10 -0.11 0.00 -0.15 0.00 0.00 55.06 55.09 1srd s HIS 120 Cb -0.14 -1.65 -0.06 0.00 1.11 0.00 0.00 32.58 31.84 1srd s HIS 120 CO 0.06 0.52 0.85 1.05 -0.85 0.00 0.00 174.74 176.38 1srd h GLU 121 N 3.57 -0.38 -6.78 1.40 4.11 0.04 -3.36 114.58 113.18 1srd h GLU 121 Ca -0.47 0.03 -0.49 0.00 0.07 0.00 0.00 59.36 58.50 1srd h GLU 121 Cb 1.17 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.48 1srd h GLU 121 CO 0.64 -0.25 0.19 -0.51 0.07 0.00 0.00 179.01 179.15 1srd s LEU 122 N -6.31 4.16 0.22 3.06 1.02 -0.76 -4.62 118.68 115.46 1srd s LEU 122 Ca -0.06 1.50 -0.32 0.00 0.02 0.00 0.00 54.13 55.27 1srd s LEU 122 Cb 0.01 -4.02 -0.12 0.00 0.02 0.00 0.00 46.19 42.07 1srd s LEU 122 CO 0.17 -0.15 1.64 -1.84 0.02 0.00 0.00 176.35 176.19 1srd n GLU 123 N 0.04 2.56 -2.10 1.70 0.28 -1.06 -4.27 120.64 117.79 1srd n GLU 123 Ca 0.02 0.92 -0.41 0.00 -0.16 0.00 0.00 57.16 57.53 1srd n GLU 123 Cb 0.52 -2.72 -0.03 0.00 1.43 0.00 0.00 31.44 30.65 1srd n GLU 123 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1srd s ASP 124 N 0.88 6.76 0.38 -1.84 -1.08 -0.80 -4.42 116.67 116.55 1srd s ASP 124 Ca 0.73 2.57 0.28 0.00 -0.52 0.00 0.00 52.55 55.61 1srd s ASP 124 Cb -0.55 -2.62 1.22 0.00 -1.46 0.00 0.00 42.92 39.50 1srd s ASP 124 CO 0.39 -0.62 1.83 0.44 0.52 0.00 0.00 175.17 177.73 1srd h ASP 125 N 4.96 0.00 -0.11 -0.34 3.32 -0.64 -3.46 116.42 120.15 1srd h ASP 125 Ca -0.46 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.54 1srd h ASP 125 Cb 1.22 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.75 1srd h ASP 125 CO 0.76 0.00 -0.04 0.18 -1.72 0.00 0.00 179.24 178.42 1srd n LEU 126 N -2.55 0.34 0.00 1.55 4.32 -1.26 -1.63 117.00 117.77 1srd n LEU 126 Ca 0.01 0.06 0.00 0.00 -0.02 0.00 0.00 56.01 56.06 1srd n LEU 126 Cb 0.22 -1.81 0.00 0.00 -1.62 0.00 0.00 43.42 40.21 1srd n LEU 126 CO 0.21 -0.65 0.00 0.61 -1.22 0.00 0.00 177.39 176.34 1srd n GLY 127 N -0.62 0.64 0.11 -0.72 0.00 -1.26 -3.78 105.19 99.57 1srd n GLY 127 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.98 1srd n GLY 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1srd h LYS 128 N 1.80 0.00 -7.34 1.61 1.79 -1.64 -3.43 116.57 109.36 1srd h LYS 128 Ca 0.00 0.00 -0.42 0.00 -2.18 0.00 0.00 60.65 58.05 1srd h LYS 128 Cb 0.00 0.00 0.19 0.00 -1.58 0.00 0.00 32.23 30.84 1srd h LYS 128 CO 0.00 0.70 0.11 0.20 -1.08 0.00 0.00 179.45 179.38 1srd s GLY 129 N -4.55 1.56 -0.31 3.86 0.00 -1.26 -4.96 107.32 101.65 1srd s GLY 129 Ca 0.02 -0.84 0.11 0.00 0.00 0.00 0.00 44.72 44.01 1srd s GLY 129 CO 0.77 0.02 1.14 0.61 0.00 0.00 0.00 173.10 175.64 1srd n GLY 130 N -0.64 4.87 0.08 0.20 0.00 -1.26 -4.85 105.19 103.58 1srd n GLY 130 Ca 0.12 -2.21 -0.13 0.00 0.00 0.00 0.00 46.02 43.80 1srd n GLY 130 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1srd h HIS 131 N 2.42 -0.04 0.00 1.61 6.17 -1.95 -3.48 115.15 119.87 1srd h HIS 131 Ca 0.20 -0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.28 1srd h HIS 131 Cb 1.33 0.01 0.00 0.00 2.52 0.00 0.00 27.41 31.28 1srd h HIS 131 CO 0.74 0.55 0.00 -0.85 0.71 0.00 0.00 177.93 179.07 1srd n GLU 132 N -4.82 0.00 0.09 5.26 0.28 -1.26 -4.78 120.64 115.42 1srd n GLU 132 Ca -0.09 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 56.99 1srd n GLU 132 Cb 0.30 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.16 1srd n GLU 132 CO 0.00 0.00 0.00 1.37 -0.16 0.00 0.00 177.13 178.34 1srd h LEU 133 N 0.00 0.00 -0.78 -1.84 -0.00 -2.00 -3.37 115.31 107.32 1srd h LEU 133 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 57.88 57.95 1srd h LEU 133 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 40.66 40.57 1srd h LEU 133 CO 0.00 0.18 -0.46 -1.20 -0.00 0.00 0.00 178.44 176.96 1srd n SER 134 N -2.78 -0.82 0.09 0.17 7.64 -1.26 0.90 113.62 117.56 1srd n SER 134 Ca -0.02 1.59 0.07 0.00 1.01 0.00 0.00 58.87 61.51 1srd n SER 134 Cb 0.64 -0.28 0.35 0.00 -1.01 0.00 0.00 64.21 63.91 1srd n SER 134 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1srd n PRO 135 N -4.76 0.09 -0.02 1.43 -0.04 -1.26 -2.56 135.00 127.87 1srd n PRO 135 Ca 0.02 0.53 -0.03 0.00 -0.04 0.00 0.00 63.50 63.98 1srd n PRO 135 Cb 0.20 -1.75 -0.03 0.00 -0.04 0.00 0.00 33.50 31.89 1srd n PRO 135 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1srd n THR 136 N -1.93 0.27 0.00 0.52 -2.24 0.26 -1.03 114.28 110.14 1srd n THR 136 Ca -0.00 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1srd n THR 136 Cb 0.06 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 67.52 1srd n THR 136 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1srd n THR 137 N -2.43 0.00 -0.65 4.28 -1.04 0.92 -4.79 114.28 110.57 1srd n THR 137 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 1srd n THR 137 Cb 0.61 -0.24 0.00 0.00 -1.82 0.00 0.00 70.33 68.87 1srd n THR 137 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1srd n GLY 138 N 2.31 0.70 2.96 3.41 0.00 -1.06 -3.60 105.19 109.91 1srd n GLY 138 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1srd n GLY 138 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1srd n ASN 139 N 0.00 -4.31 -0.04 1.61 5.15 -1.26 0.11 115.26 116.52 1srd n ASN 139 Ca 0.00 -0.16 0.14 0.00 -0.60 0.00 0.00 54.58 53.96 1srd n ASN 139 Cb 0.00 -3.58 0.69 0.00 -0.53 0.00 0.00 39.78 36.36 1srd n ASN 139 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1srd n ALA 140 N -3.04 2.61 0.00 5.20 0.00 -1.24 -4.73 120.51 119.32 1srd n ALA 140 Ca -0.09 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1srd n ALA 140 Cb 0.58 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1srd n ALA 140 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1srd n GLY 141 N 1.30 0.00 0.00 0.00 0.00 -1.26 -1.82 105.19 103.40 1srd n GLY 141 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1srd n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1srd n GLY 142 N 0.00 1.99 3.51 -0.02 0.00 -1.26 -4.44 105.19 104.98 1srd n GLY 142 Ca 0.00 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 1srd n GLY 142 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1srd s ARG 143 N -0.20 3.19 0.09 1.61 0.52 -1.26 0.37 118.95 123.28 1srd s ARG 143 Ca 0.00 -0.43 -0.10 0.00 -0.52 0.00 0.00 55.73 54.68 1srd s ARG 143 Cb 0.00 -4.18 -0.19 0.00 0.52 0.00 0.00 34.95 31.11 1srd s ARG 143 CO 0.00 -1.94 1.22 -0.07 0.02 0.00 0.00 175.30 174.53 1srd h LEU 144 N 12.17 0.75 -7.00 2.53 3.38 -1.72 -3.46 115.31 121.96 1srd h LEU 144 Ca -0.28 -0.62 -0.00 0.00 0.09 0.00 0.00 57.88 57.07 1srd h LEU 144 Cb 1.06 -0.23 -0.22 0.00 0.09 0.00 0.00 40.66 41.36 1srd h LEU 144 CO 1.22 1.42 0.28 0.00 0.09 0.00 0.00 178.44 181.45 1srd s ALA 145 N -3.24 -1.85 0.33 1.53 0.00 -1.22 -4.21 121.76 113.09 1srd s ALA 145 Ca -0.08 1.80 0.03 0.00 0.00 0.00 0.00 51.96 53.70 1srd s ALA 145 Cb 0.07 -0.96 -0.02 0.00 0.00 0.00 0.00 23.12 22.21 1srd s ALA 145 CO 0.90 -0.31 0.36 0.00 0.00 0.00 0.00 175.76 176.70 1srd s GLY 147 N -3.31 -0.21 0.08 0.00 0.00 -1.15 -1.86 107.32 100.87 1srd s GLY 147 Ca 0.36 1.88 -0.20 0.00 0.00 0.00 0.00 44.72 46.77 1srd s GLY 147 CO 0.24 0.68 0.58 0.14 0.00 0.00 0.00 173.10 174.74 1srd s VAL 148 N -2.04 4.72 -0.17 1.40 1.01 -1.26 -2.11 120.40 121.95 1srd s VAL 148 Ca 0.09 1.23 -0.29 0.00 0.00 0.00 0.00 61.98 63.01 1srd s VAL 148 Cb -0.01 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 1srd s VAL 148 CO -0.04 0.54 1.39 -0.69 0.00 0.00 0.00 175.10 176.30 1srd s VAL 149 N -1.12 4.05 0.41 2.92 1.01 0.71 -4.56 120.40 123.82 1srd s VAL 149 Ca 0.30 1.25 0.06 0.00 0.00 0.00 0.00 61.98 63.59 1srd s VAL 149 Cb -0.20 -3.88 -0.07 0.00 0.00 0.00 0.00 36.38 32.24 1srd s VAL 149 CO 0.19 -0.19 0.02 -0.83 0.00 0.00 0.00 175.10 174.29 1srd s GLY 150 N 2.63 2.51 0.09 4.51 0.00 -0.77 -0.66 107.32 115.63 1srd s GLY 150 Ca 0.61 -1.97 -0.30 0.00 0.00 0.00 0.00 44.72 43.05 1srd s GLY 150 CO 0.20 -2.06 0.96 1.08 0.00 0.00 0.00 173.10 173.29 1srd s LEU 151 N -3.69 4.48 0.06 0.66 1.43 -1.26 -2.03 118.68 118.32 1srd s LEU 151 Ca 0.31 1.76 0.07 0.00 -1.03 0.00 0.00 54.13 55.24 1srd s LEU 151 Cb 0.08 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.70 1srd s LEU 151 CO 0.15 -0.10 -0.18 0.28 0.23 0.00 0.00 176.35 176.73 1srd s THR 152 N 0.17 1.48 0.00 5.49 -1.32 -1.18 -4.86 115.64 115.42 1srd s THR 152 Ca 0.48 -1.22 0.00 0.00 -1.21 0.00 0.00 61.69 59.74 1srd s THR 152 Cb -0.23 -1.32 0.00 0.00 -1.51 0.00 0.00 72.50 69.44 1srd s THR 152 CO 0.29 0.06 0.00 -2.65 -2.21 0.00 0.00 174.62 170.12 1srd n PRO 153 N 1.67 0.00 0.00 7.08 -0.02 -1.26 -4.54 135.00 137.93 1srd n PRO 153 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 1srd n PRO 153 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.02 1srd n PRO 153 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03