#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yst s SER 2 N 0.00 3.29 -1.71 1.61 1.04 -1.26 -4.71 113.70 111.97 2yst s SER 2 Ca 0.00 -0.74 -0.17 0.00 0.48 0.00 0.00 55.95 55.51 2yst s SER 2 Cb 0.00 -0.22 0.17 0.00 0.10 0.00 0.00 66.02 66.07 2yst s SER 2 CO 0.00 0.18 0.43 -0.24 0.98 0.00 0.00 173.24 174.59 2yst n SER 3 N 0.94 -1.10 -2.73 7.02 2.88 -1.26 -4.82 113.62 114.55 2yst n SER 3 Ca -0.18 -1.19 -0.17 0.00 -1.33 0.00 0.00 58.87 56.00 2yst n SER 3 Cb 0.53 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.49 2yst n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yst n GLY 4 N -1.38 3.45 3.57 0.46 0.00 -1.26 -5.05 105.19 104.97 2yst n GLY 4 Ca 0.01 -1.89 -0.41 0.00 0.00 0.00 0.00 46.02 43.73 2yst n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yst s SER 5 N -3.14 6.00 -0.15 1.61 0.01 -1.26 -4.97 113.70 111.80 2yst s SER 5 Ca 0.37 0.20 -0.29 0.00 1.31 0.00 0.00 55.95 57.53 2yst s SER 5 Cb 0.41 -2.55 -0.02 0.00 0.21 0.00 0.00 66.02 64.07 2yst s SER 5 CO -0.06 -1.83 1.33 -0.94 0.41 0.00 0.00 173.24 172.15 2yst s SER 6 N 4.89 6.89 0.17 2.44 1.04 -1.26 -4.81 113.70 123.06 2yst s SER 6 Ca 0.52 1.77 0.00 0.00 0.48 0.00 0.00 55.95 58.72 2yst s SER 6 Cb -0.11 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.47 2yst s SER 6 CO 0.23 -0.79 0.00 0.61 0.98 0.00 0.00 173.24 174.26 2yst n GLY 7 N 3.71 -1.80 3.32 7.32 0.00 -1.26 -4.98 105.19 111.50 2yst n GLY 7 Ca 0.14 -1.36 -0.21 0.00 0.00 0.00 0.00 46.02 44.59 2yst n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yst s ASN 8 N -4.85 2.60 0.03 1.61 4.22 -1.26 -5.16 114.94 112.13 2yst s ASN 8 Ca 0.00 -0.85 0.01 0.00 -2.14 0.00 0.00 52.86 49.88 2yst s ASN 8 Cb 0.00 -0.15 -0.02 0.00 1.28 0.00 0.00 41.25 42.36 2yst s ASN 8 CO 0.00 -0.05 -0.05 -1.81 -2.04 0.00 0.00 177.10 173.15 2yst s ASP 9 N -2.62 0.51 -1.09 3.54 1.01 -1.26 -5.07 116.67 111.68 2yst s ASP 9 Ca 0.15 -0.51 -0.23 0.00 0.71 0.00 0.00 52.55 52.67 2yst s ASP 9 Cb -0.06 0.07 -0.06 0.00 1.01 0.00 0.00 42.92 43.88 2yst s ASP 9 CO 0.06 -0.25 1.91 0.20 0.21 0.00 0.00 175.17 177.30 2yst s ASN 10 N -1.48 5.22 0.04 0.27 0.01 -1.26 -4.83 114.94 112.91 2yst s ASN 10 Ca -0.13 -1.38 -0.27 0.00 -0.71 0.00 0.00 52.86 50.37 2yst s ASN 10 Cb -0.10 -2.58 0.09 0.00 0.41 0.00 0.00 41.25 39.07 2yst s ASN 10 CO -0.00 -2.81 0.78 -0.44 -1.51 0.00 0.00 177.10 173.12 2yst s SER 11 N 6.81 -0.45 0.07 -1.22 0.01 -1.26 -5.12 113.70 112.54 2yst s SER 11 Ca 0.67 0.08 -0.31 0.00 1.31 0.00 0.00 55.95 57.70 2yst s SER 11 Cb -0.02 0.46 -0.07 0.00 0.21 0.00 0.00 66.02 66.60 2yst s SER 11 CO 0.08 -0.72 1.39 -2.16 0.41 0.00 0.00 173.24 172.24 2yst s PRO 12 N -3.07 4.31 -0.01 12.44 0.04 -1.26 -4.94 135.00 142.51 2yst s PRO 12 Ca 0.02 2.03 -0.01 0.00 0.04 0.00 0.00 61.00 63.08 2yst s PRO 12 Cb -0.01 -3.38 -0.00 0.00 0.04 0.00 0.00 34.50 31.15 2yst s PRO 12 CO -0.08 -0.48 0.03 1.03 0.04 0.00 0.00 177.00 177.53 2yst s ARG 13 N 1.59 0.11 0.60 4.56 1.81 -1.26 -4.58 118.95 121.78 2yst s ARG 13 Ca 0.64 -0.07 -0.14 0.00 -1.72 0.00 0.00 55.73 54.44 2yst s ARG 13 Cb -0.35 0.04 -0.04 0.00 -0.45 0.00 0.00 34.95 34.16 2yst s ARG 13 CO 0.29 -0.02 1.03 -0.06 -0.68 0.00 0.00 175.30 175.87 2yst s PHE 14 N -0.28 3.25 0.21 -0.53 0.08 -1.26 -4.12 117.98 115.33 2yst s PHE 14 Ca -0.03 1.44 -0.08 0.00 0.12 0.00 0.00 56.93 58.37 2yst s PHE 14 Cb -0.02 -2.87 0.16 0.00 -0.57 0.00 0.00 43.02 39.72 2yst s PHE 14 CO -0.00 -0.88 1.81 0.93 -0.10 0.00 0.00 175.22 176.98 2yst h GLU 15 N 0.14 1.14 -6.22 0.44 5.08 -1.79 -3.43 114.58 109.94 2yst h GLU 15 Ca -0.46 -0.16 -0.63 0.00 -1.00 0.00 0.00 59.36 57.11 2yst h GLU 15 Cb 1.20 -0.21 -0.28 0.00 0.50 0.00 0.00 28.75 29.96 2yst h GLU 15 CO 0.59 0.88 -0.86 0.15 -1.00 0.00 0.00 179.01 178.77 2yst s LYS 16 N -5.72 1.70 0.14 2.33 1.02 -1.26 -5.04 119.74 112.91 2yst s LYS 16 Ca -0.13 -0.86 -0.14 0.00 0.02 0.00 0.00 55.97 54.86 2yst s LYS 16 Cb 0.15 -1.71 0.01 0.00 -0.52 0.00 0.00 37.83 35.76 2yst s LYS 16 CO 0.82 0.46 1.63 0.77 -0.92 0.00 0.00 175.35 178.11 2yst h SER 17 N 5.33 0.72 -3.34 2.83 0.02 -1.93 -3.39 113.55 113.80 2yst h SER 17 Ca -0.41 -0.25 -0.60 0.00 -0.84 0.00 0.00 61.79 59.68 2yst h SER 17 Cb 1.14 -0.19 -0.40 0.00 0.14 0.00 0.00 62.40 63.09 2yst h SER 17 CO 0.46 0.79 -0.75 -0.69 -1.14 0.00 0.00 176.83 175.51 2yst s VAL 18 N -5.22 1.19 -0.42 2.27 1.01 -1.26 -2.38 120.40 115.59 2yst s VAL 18 Ca -0.13 -2.05 -0.27 0.00 0.00 0.00 0.00 61.98 59.54 2yst s VAL 18 Cb 0.11 -1.86 -0.06 0.00 0.00 0.00 0.00 36.38 34.57 2yst s VAL 18 CO 0.79 -0.80 2.34 -0.31 0.00 0.00 0.00 175.10 177.12 2yst s TYR 19 N 0.92 1.12 -0.40 5.22 1.51 0.79 -4.80 117.35 121.70 2yst s TYR 19 Ca 0.14 1.26 -0.14 0.00 -1.01 0.00 0.00 57.07 57.31 2yst s TYR 19 Cb -0.21 -3.70 0.02 0.00 -0.11 0.00 0.00 41.96 37.96 2yst s TYR 19 CO -0.10 -2.96 0.29 -2.00 -1.11 0.00 0.00 175.55 169.66 2yst s GLU 20 N 7.68 2.98 -0.02 -0.62 2.12 -1.26 -1.72 118.70 127.87 2yst s GLU 20 Ca 0.97 -1.01 0.00 0.00 0.36 0.00 0.00 54.97 55.30 2yst s GLU 20 Cb -0.21 -3.94 0.02 0.00 0.26 0.00 0.00 34.13 30.25 2yst s GLU 20 CO 0.28 -0.73 0.00 0.00 -0.54 0.00 0.00 175.26 174.28 2yst s ALA 21 N 1.67 0.20 -0.22 6.30 0.00 -1.01 -5.02 121.76 123.67 2yst s ALA 21 Ca 0.05 0.15 -0.24 0.00 0.00 0.00 0.00 51.96 51.91 2yst s ALA 21 Cb -0.19 -0.22 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 2yst s ALA 21 CO 0.10 -0.05 0.79 0.16 0.00 0.00 0.00 175.76 176.75 2yst s ASP 22 N 0.75 6.82 -0.13 0.00 -4.77 -1.26 -2.83 116.67 115.25 2yst s ASP 22 Ca -0.07 1.01 -0.01 0.00 -3.30 0.00 0.00 52.55 50.18 2yst s ASP 22 Cb -0.10 -2.42 -0.02 0.00 -1.09 0.00 0.00 42.92 39.29 2yst s ASP 22 CO -0.02 -0.45 -0.08 -0.22 0.70 0.00 0.00 175.17 175.11 2yst s LEU 23 N 2.53 3.02 -0.13 2.11 1.98 -0.69 -4.92 118.68 122.58 2yst s LEU 23 Ca 0.34 -0.18 -0.29 0.00 -2.89 0.00 0.00 54.13 51.10 2yst s LEU 23 Cb -0.16 -1.70 -0.04 0.00 0.66 0.00 0.00 46.19 44.96 2yst s LEU 23 CO 0.09 0.21 1.56 0.00 -1.89 0.00 0.00 176.35 176.32 2yst s ALA 24 N 0.10 3.51 0.45 5.97 0.00 -1.26 -2.19 121.76 128.35 2yst s ALA 24 Ca -0.03 0.68 0.23 0.00 0.00 0.00 0.00 51.96 52.84 2yst s ALA 24 Cb -0.14 -3.75 1.22 0.00 0.00 0.00 0.00 23.12 20.45 2yst s ALA 24 CO 0.04 -1.53 1.85 1.05 0.00 0.00 0.00 175.76 177.16 2yst h GLU 25 N 9.66 0.26 0.00 0.00 -0.00 -1.71 0.69 114.58 123.47 2yst h GLU 25 Ca -0.35 -0.02 -0.07 0.00 -0.00 0.00 0.00 59.36 58.93 2yst h GLU 25 Cb 1.15 -0.06 -0.01 0.00 -0.00 0.00 0.00 28.75 29.83 2yst h GLU 25 CO 0.97 0.17 -0.33 -0.91 -0.00 0.00 0.00 179.01 178.92 2yst h ASN 26 N 0.27 0.00 -0.68 3.06 2.35 -1.81 -3.33 115.58 115.44 2yst h ASN 26 Ca 0.49 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.69 2yst h ASN 26 Cb 1.44 0.00 0.03 0.00 0.05 0.00 0.00 38.32 39.84 2yst h ASN 26 CO -0.15 0.33 0.12 -1.20 -1.65 0.00 0.00 177.43 174.88 2yst n SER 27 N -3.44 0.15 -4.74 5.81 7.64 0.24 -4.86 113.62 114.41 2yst n SER 27 Ca 0.00 0.79 -0.30 0.00 1.01 0.00 0.00 58.87 60.37 2yst n SER 27 Cb 0.50 -0.62 0.12 0.00 -1.01 0.00 0.00 64.21 63.20 2yst n SER 27 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2yst s ALA 28 N 0.38 1.87 -1.19 -0.43 0.00 -1.26 -4.32 121.76 116.82 2yst s ALA 28 Ca 0.63 0.10 -0.23 0.00 0.00 0.00 0.00 51.96 52.46 2yst s ALA 28 Cb -0.89 -3.23 -0.09 0.00 0.00 0.00 0.00 23.12 18.91 2yst s ALA 28 CO 0.42 -2.09 1.93 -0.35 0.00 0.00 0.00 175.76 175.68 2yst n PRO 29 N -3.72 1.60 0.00 0.00 -0.04 -1.26 -2.38 135.00 129.20 2yst n PRO 29 Ca 0.08 -2.47 0.00 0.00 -0.04 0.00 0.00 63.50 61.07 2yst n PRO 29 Cb 0.54 -3.73 0.00 0.00 -0.04 0.00 0.00 33.50 30.27 2yst n PRO 29 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2yst n GLY 30 N 5.77 0.03 3.72 0.55 0.00 -1.06 -4.76 105.19 109.43 2yst n GLY 30 Ca 0.45 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.05 2yst n GLY 30 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2yst s THR 31 N 0.00 2.08 0.04 2.61 2.01 -1.00 -4.46 115.64 116.92 2yst s THR 31 Ca 0.00 0.04 -0.30 0.00 0.31 0.00 0.00 61.69 61.74 2yst s THR 31 Cb 0.00 -3.03 -0.06 0.00 0.01 0.00 0.00 72.50 69.42 2yst s THR 31 CO 0.00 0.00 1.42 -2.16 -0.69 0.00 0.00 174.62 173.19 2yst s PRO 32 N 1.27 4.29 -0.03 4.92 0.04 -1.26 -1.52 135.00 142.70 2yst s PRO 32 Ca 0.75 2.03 -0.01 0.00 0.04 0.00 0.00 61.00 63.81 2yst s PRO 32 Cb -0.49 -3.49 -0.00 0.00 0.04 0.00 0.00 34.50 30.56 2yst s PRO 32 CO 0.32 -0.55 -0.02 0.82 0.04 0.00 0.00 177.00 177.61 2yst h ILE 33 N 4.73 0.00 -3.37 0.56 2.04 -0.68 -3.48 117.51 117.31 2yst h ILE 33 Ca -0.40 -0.23 -0.11 0.00 1.00 0.00 0.00 64.86 65.12 2yst h ILE 33 Cb 1.19 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 2yst h ILE 33 CO 0.89 0.00 0.13 -1.48 0.00 0.00 0.00 178.15 177.69 2yst s LEU 34 N -5.19 0.36 -0.06 1.44 0.05 -1.06 -5.02 118.68 109.21 2yst s LEU 34 Ca -0.02 -1.30 0.04 0.00 0.05 0.00 0.00 54.13 52.91 2yst s LEU 34 Cb 0.00 2.41 0.00 0.00 -2.05 0.00 0.00 46.19 46.55 2yst s LEU 34 CO 0.02 -1.59 -0.19 -1.58 -0.55 0.00 0.00 176.35 172.46 2yst s GLN 35 N -2.44 2.20 -0.28 1.48 2.00 -1.26 0.46 119.66 121.82 2yst s GLN 35 Ca 0.21 -0.68 -0.14 0.00 -2.00 0.00 0.00 55.36 52.75 2yst s GLN 35 Cb -0.04 -1.80 -0.04 0.00 0.80 0.00 0.00 33.01 31.94 2yst s GLN 35 CO 0.15 0.20 0.34 -0.51 -0.50 0.00 0.00 175.29 174.97 2yst s LEU 36 N 0.22 4.08 0.04 3.68 1.43 -1.22 -4.98 118.68 121.94 2yst s LEU 36 Ca -0.10 0.17 0.05 0.00 -1.03 0.00 0.00 54.13 53.21 2yst s LEU 36 Cb -0.14 -2.36 -0.04 0.00 0.03 0.00 0.00 46.19 43.68 2yst s LEU 36 CO 0.04 -0.18 -0.07 -0.13 0.23 0.00 0.00 176.35 176.24 2yst s ARG 37 N 2.01 2.43 -0.65 1.70 1.81 -1.26 -4.68 118.95 120.30 2yst s ARG 37 Ca 0.13 -0.82 -0.01 0.00 -1.72 0.00 0.00 55.73 53.31 2yst s ARG 37 Cb -0.16 -2.45 0.44 0.00 -0.45 0.00 0.00 34.95 32.34 2yst s ARG 37 CO 0.10 0.57 1.95 0.00 -0.68 0.00 0.00 175.30 177.24 2yst n ALA 38 N 1.23 6.23 -1.77 2.13 0.00 -1.26 -2.93 120.51 124.14 2yst n ALA 38 Ca -0.14 -3.58 -0.23 0.00 0.00 0.00 0.00 53.44 49.48 2yst n ALA 38 Cb 0.52 -1.65 -0.05 0.00 0.00 0.00 0.00 19.45 18.26 2yst n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yst s ALA 39 N -3.83 1.28 0.00 0.00 0.00 -1.26 -4.42 121.76 113.53 2yst s ALA 39 Ca 0.62 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.69 2yst s ALA 39 Cb 0.49 -4.51 0.00 0.00 0.00 0.00 0.00 23.12 19.10 2yst s ALA 39 CO -0.05 -5.17 0.00 -3.47 0.00 0.00 0.00 175.76 167.08 2yst n ASP 40 N 16.22 0.61 0.07 0.00 -0.08 -1.26 -4.62 116.55 127.50 2yst n ASP 40 Ca 0.41 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.69 2yst n ASP 40 Cb 0.47 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.93 2yst n ASP 40 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2yst n LEU 41 N -2.40 0.08 -3.87 -2.67 4.77 -1.26 -4.95 117.00 106.71 2yst n LEU 41 Ca 0.00 0.24 -0.39 0.00 -0.03 0.00 0.00 56.01 55.83 2yst n LEU 41 Cb 0.20 0.14 -0.01 0.00 -2.33 0.00 0.00 43.42 41.42 2yst n LEU 41 CO 0.00 -0.62 0.85 0.47 -1.33 0.00 0.00 177.39 176.76 2yst n ASP 42 N -3.13 5.70 0.30 -1.43 9.92 -1.26 -4.83 116.55 121.82 2yst n ASP 42 Ca 0.00 -3.41 0.19 0.00 -0.53 0.00 0.00 54.79 51.04 2yst n ASP 42 Cb 0.05 -1.12 1.01 0.00 -0.64 0.00 0.00 41.12 40.43 2yst n ASP 42 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 2yst h VAL 43 N 3.38 0.00 0.00 2.53 2.07 -1.92 -3.21 116.25 119.09 2yst h VAL 43 Ca 0.20 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.72 2yst h VAL 43 Cb 0.63 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 2yst h VAL 43 CO 1.20 0.00 0.00 0.61 0.02 0.00 0.00 177.57 179.40 2yst n GLY 44 N -1.15 0.26 2.18 2.17 0.00 -1.26 -4.88 105.19 102.51 2yst n GLY 44 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2yst n GLY 44 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2yst n VAL 45 N -1.22 0.40 -0.27 1.61 3.14 -1.21 -4.66 118.33 116.11 2yst n VAL 45 Ca 0.00 -0.10 0.22 0.00 -2.96 0.00 0.00 64.34 61.50 2yst n VAL 45 Cb 0.00 0.00 0.41 0.00 -1.06 0.00 0.00 33.84 33.19 2yst n VAL 45 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 2yst n ASN 46 N 1.04 0.17 0.00 6.55 3.02 -1.26 -4.80 115.26 119.98 2yst n ASN 46 Ca 0.12 1.36 0.00 0.00 -0.03 0.00 0.00 54.58 56.03 2yst n ASN 46 Cb 0.08 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 38.64 2yst n ASN 46 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2yst n GLY 47 N -1.27 1.03 1.81 7.41 0.00 -1.26 -4.93 105.19 107.97 2yst n GLY 47 Ca 0.27 -0.74 -0.06 0.00 0.00 0.00 0.00 46.02 45.49 2yst n GLY 47 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2yst n GLN 48 N 0.32 1.44 -4.36 1.61 1.13 -1.26 -4.78 117.38 111.48 2yst n GLN 48 Ca 0.00 -0.51 -0.31 0.00 -1.94 0.00 0.00 57.00 54.23 2yst n GLN 48 Cb 0.00 -1.55 -0.16 0.00 0.11 0.00 0.00 30.24 28.64 2yst n GLN 48 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2yst s ILE 49 N 0.69 1.87 0.39 5.09 -1.09 -1.26 -4.32 121.20 122.57 2yst s ILE 49 Ca 0.34 -0.84 -0.23 0.00 -2.23 0.00 0.00 60.65 57.69 2yst s ILE 49 Cb 0.16 -1.68 -0.11 0.00 -1.58 0.00 0.00 42.46 39.25 2yst s ILE 49 CO 0.00 0.51 0.95 -1.83 -1.23 0.00 0.00 174.94 173.34 2yst s GLU 50 N 1.10 4.35 -0.43 2.79 -1.05 -0.05 -4.86 118.70 120.56 2yst s GLU 50 Ca -0.01 1.20 0.04 0.00 -0.15 0.00 0.00 54.97 56.04 2yst s GLU 50 Cb -0.14 -2.40 0.12 0.00 -0.44 0.00 0.00 34.13 31.27 2yst s GLU 50 CO -0.07 0.08 0.16 0.71 0.95 0.00 0.00 175.26 177.09 2yst s TYR 51 N -1.98 3.22 0.43 4.83 1.51 -1.12 -2.91 117.35 121.33 2yst s TYR 51 Ca 0.58 -2.95 0.08 0.00 -1.01 0.00 0.00 57.07 53.76 2yst s TYR 51 Cb -0.12 -2.71 -0.01 0.00 -0.11 0.00 0.00 41.96 39.00 2yst s TYR 51 CO 0.17 -0.84 0.38 0.14 -1.11 0.00 0.00 175.55 174.29 2yst s VAL 52 N 0.37 2.53 -0.64 0.71 -7.23 -1.02 -3.89 120.40 111.23 2yst s VAL 52 Ca 0.14 -1.37 -0.27 0.00 -1.81 0.00 0.00 61.98 58.67 2yst s VAL 52 Cb -0.22 -2.90 0.03 0.00 0.56 0.00 0.00 36.38 33.85 2yst s VAL 52 CO -0.05 0.00 1.20 -0.36 -0.31 0.00 0.00 175.10 175.59 2yst s PHE 53 N -2.51 2.50 0.00 2.82 0.08 -1.26 -0.78 117.98 118.83 2yst s PHE 53 Ca 0.47 0.19 0.00 0.00 0.12 0.00 0.00 56.93 57.70 2yst s PHE 53 Cb -0.03 -4.53 0.00 0.00 -0.57 0.00 0.00 43.02 37.90 2yst s PHE 53 CO 0.27 -1.76 0.00 0.41 -0.10 0.00 0.00 175.22 174.04 2yst n GLY 54 N 5.19 0.49 3.54 4.36 0.00 -0.76 -4.62 105.19 113.38 2yst n GLY 54 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 2yst n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yst n ALA 55 N -3.00 3.68 -2.23 4.61 0.00 -1.25 -4.92 120.51 117.40 2yst n ALA 55 Ca 0.00 -3.99 -0.13 0.00 0.00 0.00 0.00 53.44 49.31 2yst n ALA 55 Cb 0.00 -3.41 -0.10 0.00 0.00 0.00 0.00 19.45 15.94 2yst n ALA 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yst s ALA 56 N 3.25 1.30 0.30 0.00 0.00 -1.26 -2.22 121.76 123.14 2yst s ALA 56 Ca 0.50 -1.74 0.08 0.00 0.00 0.00 0.00 51.96 50.80 2yst s ALA 56 Cb 0.02 1.31 -0.04 0.00 0.00 0.00 0.00 23.12 24.41 2yst s ALA 56 CO 0.05 -0.56 0.16 -0.08 0.00 0.00 0.00 175.76 175.33 2yst s THR 57 N -4.06 3.58 0.14 0.00 -1.32 -1.26 -4.99 115.64 107.72 2yst s THR 57 Ca 0.39 -1.60 -0.23 0.00 -1.21 0.00 0.00 61.69 59.04 2yst s THR 57 Cb 0.07 -3.10 -0.01 0.00 -1.51 0.00 0.00 72.50 67.95 2yst s THR 57 CO 0.12 -0.26 1.64 -0.08 -2.21 0.00 0.00 174.62 173.83 2yst h GLU 58 N 1.54 -0.27 -1.28 7.08 4.57 -2.02 -0.18 114.58 124.01 2yst h GLU 58 Ca -0.45 0.02 0.37 0.00 -1.18 0.00 0.00 59.36 58.12 2yst h GLU 58 Cb 1.25 0.06 -0.07 0.00 -0.16 0.00 0.00 28.75 29.83 2yst h GLU 58 CO 0.61 -0.18 0.89 0.77 -1.18 0.00 0.00 179.01 179.92 2yst h SER 59 N -0.28 0.14 0.00 1.04 0.02 -1.97 0.12 113.55 112.62 2yst h SER 59 Ca 0.10 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2yst h SER 59 Cb 0.43 0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.99 2yst h SER 59 CO -0.30 -0.01 0.00 0.52 -1.14 0.00 0.00 176.83 175.91 2yst n VAL 60 N -4.32 0.00 -0.62 2.27 0.31 -0.13 -1.11 118.33 114.73 2yst n VAL 60 Ca 0.30 0.41 0.49 0.00 -0.01 0.00 0.00 64.34 65.53 2yst n VAL 60 Cb 1.30 -0.97 0.79 0.00 -0.91 0.00 0.00 33.84 34.05 2yst n VAL 60 CO 0.00 0.00 0.00 0.08 -1.32 0.00 0.00 176.83 175.59 2yst h ARG 61 N 0.00 0.01 0.12 5.55 0.11 -1.16 1.87 114.38 120.87 2yst h ARG 61 Ca 0.00 -0.00 -0.29 0.00 0.10 0.00 0.00 59.98 59.79 2yst h ARG 61 Cb 0.00 -0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.08 2yst h ARG 61 CO 0.00 0.01 -1.40 0.07 0.10 0.00 0.00 179.97 178.75 2yst h ARG 62 N 0.01 0.26 0.00 0.08 0.11 -0.87 -3.31 114.38 110.66 2yst h ARG 62 Ca 0.88 -0.44 -0.13 0.00 0.10 0.00 0.00 59.98 60.39 2yst h ARG 62 Cb 3.42 0.16 -0.02 0.00 1.11 0.00 0.00 29.97 34.64 2yst h ARG 62 CO -0.08 1.15 -0.64 1.25 0.10 0.00 0.00 179.97 181.75 2yst h LEU 63 N 0.07 0.00 -8.27 0.08 5.85 0.43 -3.32 115.31 110.15 2yst h LEU 63 Ca -0.19 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.22 2yst h LEU 63 Cb 2.00 0.00 -0.20 0.00 0.37 0.00 0.00 40.66 42.82 2yst h LEU 63 CO 0.18 0.64 -0.74 -0.76 -0.34 0.00 0.00 178.44 177.42 2yst s LEU 64 N -7.10 2.30 -0.10 2.25 1.43 0.12 -1.88 118.68 115.70 2yst s LEU 64 Ca 0.00 -0.63 0.01 0.00 -1.03 0.00 0.00 54.13 52.49 2yst s LEU 64 Cb 0.11 -0.24 -0.02 0.00 0.03 0.00 0.00 46.19 46.07 2yst s LEU 64 CO 0.76 -0.20 -0.13 -0.60 0.23 0.00 0.00 176.35 176.40 2yst s ARG 65 N -1.92 3.08 -0.07 1.70 3.52 0.99 -4.33 118.95 121.93 2yst s ARG 65 Ca -0.05 -0.68 0.05 0.00 -0.13 0.00 0.00 55.73 54.92 2yst s ARG 65 Cb -0.08 -2.55 -0.01 0.00 -1.56 0.00 0.00 34.95 30.75 2yst s ARG 65 CO 0.00 0.36 -0.24 -1.17 -0.81 0.00 0.00 175.30 173.45 2yst s LEU 66 N -0.04 2.12 0.19 -0.88 2.96 -1.26 -1.21 118.68 120.56 2yst s LEU 66 Ca -0.03 -0.51 -0.30 0.00 -0.22 0.00 0.00 54.13 53.07 2yst s LEU 66 Cb -0.14 -1.40 -0.08 0.00 0.50 0.00 0.00 46.19 45.07 2yst s LEU 66 CO 0.04 0.22 0.96 -1.81 -1.32 0.00 0.00 176.35 174.43 2yst s ASP 67 N -0.00 7.57 -0.16 3.68 1.01 0.42 -4.96 116.67 124.22 2yst s ASP 67 Ca -0.08 1.90 0.17 0.00 0.71 0.00 0.00 52.55 55.25 2yst s ASP 67 Cb -0.15 -2.60 -0.25 0.00 1.01 0.00 0.00 42.92 40.93 2yst s ASP 67 CO 0.05 0.05 0.19 1.21 0.21 0.00 0.00 175.17 176.88 2yst n GLU 68 N 2.05 0.68 0.07 8.23 2.13 -1.25 -2.41 120.64 130.14 2yst n GLU 68 Ca -0.00 0.03 -0.22 0.00 0.66 0.00 0.00 57.16 57.63 2yst n GLU 68 Cb 0.48 -1.57 -0.15 0.00 0.27 0.00 0.00 31.44 30.47 2yst n GLU 68 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2yst h THR 69 N 0.00 1.23 0.00 6.31 1.03 -1.89 -2.96 112.91 116.63 2yst h THR 69 Ca -0.48 -2.55 -0.43 0.00 -0.01 0.00 0.00 66.41 62.94 2yst h THR 69 Cb 2.16 2.97 -0.07 0.00 -1.07 0.00 0.00 68.15 72.14 2yst h THR 69 CO 0.04 0.77 -2.50 -1.54 -0.01 0.00 0.00 175.52 172.27 2yst n SER 70 N -3.87 1.97 0.00 0.00 3.41 -1.26 -4.93 113.62 108.93 2yst n SER 70 Ca -0.19 0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 2yst n SER 70 Cb 0.97 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 2yst n SER 70 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yst n GLY 71 N 1.67 2.06 3.46 5.00 0.00 -1.01 -4.85 105.19 111.52 2yst n GLY 71 Ca -0.51 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.14 2yst n GLY 71 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2yst n TRP 72 N -1.06 -0.80 -4.86 1.61 7.02 -1.26 -3.39 117.44 114.70 2yst n TRP 72 Ca 0.00 0.37 -0.26 0.00 -1.02 0.00 0.00 57.50 56.59 2yst n TRP 72 Cb 0.00 -1.92 -0.16 0.00 -2.42 0.00 0.00 31.31 26.81 2yst n TRP 72 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 2yst s LEU 73 N 0.16 1.96 0.30 -0.99 2.96 0.17 -0.44 118.68 122.81 2yst s LEU 73 Ca 0.66 -0.35 -0.09 0.00 -0.22 0.00 0.00 54.13 54.13 2yst s LEU 73 Cb -0.38 -0.97 0.01 0.00 0.50 0.00 0.00 46.19 45.35 2yst s LEU 73 CO 0.57 0.18 0.52 -0.94 -1.32 0.00 0.00 176.35 175.36 2yst s SER 74 N -0.13 0.32 0.41 3.68 1.04 -0.35 0.07 113.70 118.76 2yst s SER 74 Ca -0.00 -1.19 -0.18 0.00 0.48 0.00 0.00 55.95 55.07 2yst s SER 74 Cb -0.10 0.65 -0.10 0.00 0.10 0.00 0.00 66.02 66.58 2yst s SER 74 CO 0.01 -1.28 0.88 -0.69 0.98 0.00 0.00 173.24 173.14 2yst s VAL 75 N -3.39 4.53 -0.04 5.02 1.01 -0.58 -0.00 120.40 126.95 2yst s VAL 75 Ca 0.25 1.22 -0.00 0.00 0.00 0.00 0.00 61.98 63.44 2yst s VAL 75 Cb -0.01 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 2yst s VAL 75 CO 0.14 -0.36 -0.03 -0.11 0.00 0.00 0.00 175.10 174.73 2yst n LEU 76 N -0.77 2.49 -4.27 3.92 7.94 -0.79 -2.56 117.00 122.95 2yst n LEU 76 Ca 0.06 -0.01 -0.16 0.00 -1.11 0.00 0.00 56.01 54.79 2yst n LEU 76 Cb 0.54 -0.12 -0.10 0.00 0.53 0.00 0.00 43.42 44.26 2yst n LEU 76 CO 0.41 0.47 -0.43 -1.00 -1.11 0.00 0.00 177.39 175.73 2yst s HIS 77 N -2.07 1.42 0.35 1.96 3.76 -0.98 -4.71 115.29 115.02 2yst s HIS 77 Ca -0.05 -0.66 -0.24 0.00 -0.15 0.00 0.00 55.06 53.96 2yst s HIS 77 Cb 0.01 -0.71 -0.14 0.00 1.11 0.00 0.00 32.58 32.86 2yst s HIS 77 CO 0.08 0.18 0.59 0.54 -0.85 0.00 0.00 174.74 175.27 2yst n ARG 78 N -0.07 0.56 -3.85 1.40 1.74 -1.26 -4.67 116.66 110.51 2yst n ARG 78 Ca -0.11 0.20 -0.36 0.00 -0.77 0.00 0.00 57.85 56.81 2yst n ARG 78 Cb 0.60 -1.42 -0.13 0.00 -1.02 0.00 0.00 32.46 30.48 2yst n ARG 78 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2yst s ILE 79 N -1.32 3.72 -0.12 0.55 1.01 -1.25 -5.02 121.20 118.77 2yst s ILE 79 Ca 0.62 -0.39 -0.01 0.00 0.00 0.00 0.00 60.65 60.87 2yst s ILE 79 Cb -0.69 -2.72 -0.02 0.00 0.01 0.00 0.00 42.46 39.04 2yst s ILE 79 CO 0.58 0.38 -0.08 -0.62 0.00 0.00 0.00 174.94 175.21 2yst s ASP 80 N 1.53 4.49 0.03 3.58 2.15 -1.26 -4.35 116.67 122.85 2yst s ASP 80 Ca 0.06 -0.16 -0.17 0.00 0.43 0.00 0.00 52.55 52.70 2yst s ASP 80 Cb -0.15 -1.54 -0.25 0.00 -0.30 0.00 0.00 42.92 40.69 2yst s ASP 80 CO -0.01 0.22 1.12 -0.09 -0.17 0.00 0.00 175.17 176.25 2yst h ARG 81 N 6.28 0.54 -0.10 4.34 1.12 -1.89 -3.08 114.38 121.58 2yst h ARG 81 Ca -0.34 -0.61 0.04 0.00 -1.11 0.00 0.00 59.98 57.96 2yst h ARG 81 Cb 1.19 0.18 -0.06 0.00 -0.01 0.00 0.00 29.97 31.27 2yst h ARG 81 CO 0.58 1.23 -0.42 0.93 -3.11 0.00 0.00 179.97 179.17 2yst h GLU 82 N 0.11 -0.49 -0.56 0.20 5.08 -1.99 -1.86 114.58 115.07 2yst h GLU 82 Ca -0.11 0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.34 2yst h GLU 82 Cb 1.54 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 30.85 2yst h GLU 82 CO 0.17 -0.33 0.25 1.05 -1.00 0.00 0.00 179.01 179.15 2yst h GLU 83 N -0.51 0.47 -3.92 2.33 4.11 -2.01 -3.42 114.58 111.63 2yst h GLU 83 Ca 0.07 -0.03 -0.34 0.00 0.07 0.00 0.00 59.36 59.13 2yst h GLU 83 Cb 0.63 -0.11 -0.32 0.00 0.50 0.00 0.00 28.75 29.46 2yst h GLU 83 CO -0.38 0.31 -0.75 0.14 0.07 0.00 0.00 179.01 178.40 2yst s VAL 84 N -6.11 0.29 -0.13 -1.06 -7.23 -0.71 -5.03 120.40 100.42 2yst s VAL 84 Ca -0.13 -0.03 0.11 0.00 -1.81 0.00 0.00 61.98 60.12 2yst s VAL 84 Cb 0.15 -0.33 -0.24 0.00 0.56 0.00 0.00 36.38 36.53 2yst s VAL 84 CO 0.74 0.14 0.33 -0.46 -0.31 0.00 0.00 175.10 175.54 2yst n ASN 85 N 3.77 0.85 -3.41 4.85 6.94 -1.16 -3.99 115.26 123.11 2yst n ASN 85 Ca -0.23 0.19 -0.08 0.00 -0.02 0.00 0.00 54.58 54.44 2yst n ASN 85 Cb 0.53 0.17 -0.08 0.00 -2.36 0.00 0.00 39.78 38.04 2yst n ASN 85 CO 0.00 0.00 0.00 -1.58 -1.03 0.00 0.00 177.26 174.65 2yst s GLN 86 N -2.55 0.36 0.73 -3.83 0.74 -1.26 -3.54 119.66 110.31 2yst s GLN 86 Ca -0.12 0.68 -0.11 0.00 0.05 0.00 0.00 55.36 55.86 2yst s GLN 86 Cb 0.07 -0.23 0.04 0.00 1.10 0.00 0.00 33.01 33.99 2yst s GLN 86 CO 0.80 -0.55 1.10 -0.51 -0.55 0.00 0.00 175.29 175.57 2yst s LEU 87 N 2.58 2.80 -0.30 3.68 1.43 -1.20 -5.02 118.68 122.65 2yst s LEU 87 Ca 0.10 0.94 -0.14 0.00 -1.03 0.00 0.00 54.13 54.00 2yst s LEU 87 Cb -0.15 -3.63 0.15 0.00 0.03 0.00 0.00 46.19 42.59 2yst s LEU 87 CO -0.15 -1.51 0.89 -0.60 0.23 0.00 0.00 176.35 175.20 2yst s ARG 88 N -5.39 0.40 0.24 1.70 3.00 -1.26 -3.67 118.95 113.97 2yst s ARG 88 Ca 0.59 0.93 0.00 0.00 -1.00 0.00 0.00 55.73 56.25 2yst s ARG 88 Cb -0.11 0.48 -0.00 0.00 0.00 0.00 0.00 34.95 35.32 2yst s ARG 88 CO 0.50 -0.12 0.30 1.97 0.00 0.00 0.00 175.30 177.95 2yst n PHE 89 N 4.86 -1.00 -4.13 5.12 -1.74 -1.18 -4.87 117.46 114.52 2yst n PHE 89 Ca -0.12 -1.69 -0.12 0.00 -0.56 0.00 0.00 57.45 54.96 2yst n PHE 89 Cb 0.53 0.34 -0.11 0.00 1.52 0.00 0.00 39.48 41.76 2yst n PHE 89 CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 2yst s THR 90 N -2.75 0.68 -0.03 1.97 2.01 -0.94 -0.97 115.64 115.61 2yst s THR 90 Ca 0.22 -1.57 0.04 0.00 0.31 0.00 0.00 61.69 60.69 2yst s THR 90 Cb -0.00 -1.23 -0.00 0.00 0.01 0.00 0.00 72.50 71.28 2yst s THR 90 CO 0.16 -0.64 -0.14 0.68 -0.69 0.00 0.00 174.62 173.99 2yst s VAL 91 N -2.59 1.14 0.11 3.82 -7.23 -0.46 -1.84 120.40 113.35 2yst s VAL 91 Ca 0.03 -0.57 -0.01 0.00 -1.81 0.00 0.00 61.98 59.62 2yst s VAL 91 Cb -0.02 -0.98 -0.04 0.00 0.56 0.00 0.00 36.38 35.90 2yst s VAL 91 CO -0.02 0.33 0.29 -0.04 -0.31 0.00 0.00 175.10 175.36 2yst s MET 92 N 0.02 3.50 -0.36 4.82 -1.94 0.04 -0.45 119.30 124.94 2yst s MET 92 Ca -0.02 -0.34 -0.00 0.00 -1.71 0.00 0.00 55.69 53.62 2yst s MET 92 Cb -0.09 -2.95 0.12 0.00 2.01 0.00 0.00 34.83 33.92 2yst s MET 92 CO 0.01 0.53 0.17 0.00 -0.01 0.00 0.00 175.02 175.72 2yst s ALA 93 N -1.63 1.47 0.37 3.03 0.00 -0.73 -2.44 121.76 121.82 2yst s ALA 93 Ca 0.37 -1.93 0.08 0.00 0.00 0.00 0.00 51.96 50.48 2yst s ALA 93 Cb -0.12 -1.67 -0.05 0.00 0.00 0.00 0.00 23.12 21.27 2yst s ALA 93 CO 0.27 -1.90 0.09 -0.98 0.00 0.00 0.00 175.76 173.25 2yst s ARG 94 N 1.16 2.16 0.44 0.00 1.70 -1.15 -2.81 118.95 120.45 2yst s ARG 94 Ca 0.14 -1.80 0.02 0.00 -0.47 0.00 0.00 55.73 53.62 2yst s ARG 94 Cb -0.21 -1.95 -0.01 0.00 -0.57 0.00 0.00 34.95 32.22 2yst s ARG 94 CO -0.12 0.02 0.07 -0.40 -1.08 0.00 0.00 175.30 173.78 2yst n ASP 95 N -1.09 2.33 -1.62 -2.89 5.75 -1.26 -0.87 116.55 116.90 2yst n ASP 95 Ca -0.03 -3.10 -0.04 0.00 -0.01 0.00 0.00 54.79 51.61 2yst n ASP 95 Cb 0.64 0.65 -0.02 0.00 -1.03 0.00 0.00 41.12 41.36 2yst n ASP 95 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2yst n ARG 96 N -1.05 1.22 -4.32 0.11 1.74 -1.26 -4.81 116.66 108.29 2yst n ARG 96 Ca -0.13 -0.32 -0.27 0.00 -0.77 0.00 0.00 57.85 56.36 2yst n ARG 96 Cb 0.60 -1.20 -0.07 0.00 -1.02 0.00 0.00 32.46 30.77 2yst n ARG 96 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2yst s GLY 97 N 1.79 2.51 -0.17 -0.13 0.00 -1.26 -5.08 107.32 104.98 2yst s GLY 97 Ca 0.12 -1.73 -0.07 0.00 0.00 0.00 0.00 44.72 43.05 2yst s GLY 97 CO -0.00 -2.01 0.36 1.20 0.00 0.00 0.00 173.10 172.65 2yst s GLN 98 N -3.91 0.28 0.26 2.90 -0.21 -1.26 -2.34 119.66 115.38 2yst s GLN 98 Ca 0.32 0.86 -0.29 0.00 0.02 0.00 0.00 55.36 56.27 2yst s GLN 98 Cb 0.04 0.11 -0.09 0.00 1.00 0.00 0.00 33.01 34.07 2yst s GLN 98 CO 0.18 -0.23 1.26 -1.25 -2.12 0.00 0.00 175.29 173.13 2yst s PRO 99 N 2.16 4.43 0.05 2.91 0.04 -1.26 -5.11 135.00 138.23 2yst s PRO 99 Ca -0.03 2.05 -0.31 0.00 0.04 0.00 0.00 61.00 62.75 2yst s PRO 99 Cb -0.11 -3.15 -0.07 0.00 0.04 0.00 0.00 34.50 31.21 2yst s PRO 99 CO -0.11 -0.13 1.41 -1.25 0.04 0.00 0.00 177.00 176.96 2yst s PRO 100 N -0.98 4.30 -0.45 0.56 0.04 -0.99 -4.98 135.00 132.50 2yst s PRO 100 Ca 0.51 2.03 -0.24 0.00 0.04 0.00 0.00 61.00 63.35 2yst s PRO 100 Cb -0.37 -3.43 0.02 0.00 0.04 0.00 0.00 34.50 30.77 2yst s PRO 100 CO 0.44 -0.52 0.81 0.15 0.04 0.00 0.00 177.00 177.93 2yst s LYS 101 N 1.83 3.46 -0.19 4.56 -0.14 -1.26 -4.95 119.74 123.04 2yst s LYS 101 Ca 0.65 -0.02 -0.09 0.00 -1.36 0.00 0.00 55.97 55.15 2yst s LYS 101 Cb -0.34 -3.93 -0.05 0.00 -1.68 0.00 0.00 37.83 31.84 2yst s LYS 101 CO 0.29 -1.12 0.10 0.95 -0.76 0.00 0.00 175.35 174.80 2yst s THR 102 N 3.37 5.08 -0.22 2.17 -4.23 -1.26 -3.78 115.64 116.77 2yst s THR 102 Ca 0.31 0.07 -0.01 0.00 -1.18 0.00 0.00 61.69 60.89 2yst s THR 102 Cb -0.12 -3.31 0.02 0.00 1.34 0.00 0.00 72.50 70.44 2yst s THR 102 CO 0.23 0.45 -0.11 -1.81 -0.54 0.00 0.00 174.62 172.83 2yst s ASP 103 N 0.41 3.89 -0.06 3.99 1.11 -1.12 -4.81 116.67 120.07 2yst s ASP 103 Ca 0.05 -0.74 -0.24 0.00 0.18 0.00 0.00 52.55 51.81 2yst s ASP 103 Cb -0.12 -1.60 -0.04 0.00 1.07 0.00 0.00 42.92 42.23 2yst s ASP 103 CO -0.01 -0.06 0.71 -0.54 1.18 0.00 0.00 175.17 176.45 2yst s LYS 104 N 1.33 4.44 -0.11 8.23 1.02 -1.25 -1.78 119.74 131.62 2yst s LYS 104 Ca 0.02 0.90 0.02 0.00 0.02 0.00 0.00 55.97 56.93 2yst s LYS 104 Cb -0.15 -3.45 0.01 0.00 -0.52 0.00 0.00 37.83 33.73 2yst s LYS 104 CO -0.07 0.07 -0.16 0.00 -0.92 0.00 0.00 175.35 174.26 2yst s ALA 105 N 0.79 1.76 0.21 5.17 0.00 0.41 -4.89 121.76 125.20 2yst s ALA 105 Ca 0.38 -0.78 -0.30 0.00 0.00 0.00 0.00 51.96 51.26 2yst s ALA 105 Cb -0.18 -0.86 -0.08 0.00 0.00 0.00 0.00 23.12 22.00 2yst s ALA 105 CO 0.18 -0.08 1.21 0.99 0.00 0.00 0.00 175.76 178.06 2yst s THR 106 N 0.99 3.44 -0.35 0.00 2.01 -1.00 -1.36 115.64 119.36 2yst s THR 106 Ca -0.06 1.25 0.02 0.00 0.31 0.00 0.00 61.69 63.21 2yst s THR 106 Cb -0.15 -3.80 0.11 0.00 0.01 0.00 0.00 72.50 68.67 2yst s THR 106 CO -0.02 0.21 0.10 -0.69 -0.69 0.00 0.00 174.62 173.54 2yst s VAL 107 N -0.21 1.75 -0.48 3.82 1.01 -0.14 -0.15 120.40 126.00 2yst s VAL 107 Ca 0.52 -2.13 -0.20 0.00 0.00 0.00 0.00 61.98 60.17 2yst s VAL 107 Cb -0.34 -2.29 0.04 0.00 0.00 0.00 0.00 36.38 33.79 2yst s VAL 107 CO 0.38 -0.67 0.66 -0.69 0.00 0.00 0.00 175.10 174.79 2yst s VAL 108 N 0.99 4.80 -0.42 2.92 1.01 -0.70 -3.13 120.40 125.88 2yst s VAL 108 Ca 0.12 -0.14 -0.11 0.00 0.00 0.00 0.00 61.98 61.84 2yst s VAL 108 Cb -0.19 -4.28 0.07 0.00 0.00 0.00 0.00 36.38 31.97 2yst s VAL 108 CO -0.12 -0.74 0.29 -0.76 0.00 0.00 0.00 175.10 173.76 2yst s LEU 109 N 2.85 5.20 -0.15 3.92 1.43 -1.24 -2.40 118.68 128.29 2yst s LEU 109 Ca 0.20 -1.35 -0.29 0.00 -1.03 0.00 0.00 54.13 51.65 2yst s LEU 109 Cb -0.16 -2.05 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 2yst s LEU 109 CO 0.16 -0.54 1.26 0.20 0.23 0.00 0.00 176.35 177.66 2yst s ASN 110 N 2.13 6.95 -0.77 2.29 0.01 -1.13 -3.26 114.94 121.17 2yst s ASN 110 Ca 0.03 1.71 -0.26 0.00 -0.71 0.00 0.00 52.86 53.63 2yst s ASN 110 Cb -0.23 -2.54 0.02 0.00 0.41 0.00 0.00 41.25 38.92 2yst s ASN 110 CO 0.04 -0.74 1.43 -0.63 -1.51 0.00 0.00 177.10 175.69 2yst s ILE 111 N 3.35 3.68 0.65 0.60 -1.09 -1.23 -1.70 121.20 125.46 2yst s ILE 111 Ca 0.55 0.15 -0.08 0.00 -2.23 0.00 0.00 60.65 59.03 2yst s ILE 111 Cb -0.22 -4.74 0.01 0.00 -1.58 0.00 0.00 42.46 35.93 2yst s ILE 111 CO 0.15 -1.68 0.99 -0.54 -1.23 0.00 0.00 174.94 172.64 2yst s LYS 112 N 5.88 2.87 -0.18 2.79 -0.14 -0.93 -4.84 119.74 125.19 2yst s LYS 112 Ca 0.44 0.20 0.01 0.00 -1.36 0.00 0.00 55.97 55.25 2yst s LYS 112 Cb -0.07 -2.16 0.04 0.00 -1.68 0.00 0.00 37.83 33.96 2yst s LYS 112 CO 0.11 -0.87 -0.10 -0.51 -0.76 0.00 0.00 175.35 173.22 2yst s ASP 113 N -4.34 3.18 -0.23 2.83 1.11 -1.26 -2.05 116.67 115.91 2yst s ASP 113 Ca 0.56 -0.78 -0.18 0.00 0.18 0.00 0.00 52.55 52.33 2yst s ASP 113 Cb -0.11 -1.17 -0.15 0.00 1.07 0.00 0.00 42.92 42.57 2yst s ASP 113 CO 0.48 -0.14 -0.05 1.21 1.18 0.00 0.00 175.17 177.85 2yst n GLU 114 N 4.73 0.56 0.00 8.23 4.07 -1.26 -4.50 120.64 132.48 2yst n GLU 114 Ca -0.15 0.44 -0.09 0.00 -0.06 0.00 0.00 57.16 57.30 2yst n GLU 114 Cb 0.47 -1.63 -0.03 0.00 -0.06 0.00 0.00 31.44 30.19 2yst n GLU 114 CO 0.00 0.00 0.00 -0.97 -0.06 0.00 0.00 177.13 176.10 2yst h ASN 115 N -1.00 -0.64 -2.33 4.31 -1.24 -1.94 -3.42 115.58 109.33 2yst h ASN 115 Ca -0.44 0.11 -0.55 0.00 0.71 0.00 0.00 56.30 56.13 2yst h ASN 115 Cb 1.35 0.29 0.23 0.00 0.73 0.00 0.00 38.32 40.91 2yst h ASN 115 CO -0.27 -0.26 -1.49 -0.90 -1.29 0.00 0.00 177.43 173.23 2yst n ASP 116 N -5.34 -4.85 -4.49 1.15 5.75 -1.26 -4.59 116.55 102.91 2yst n ASP 116 Ca -0.03 0.27 -0.44 0.00 -0.01 0.00 0.00 54.79 54.58 2yst n ASP 116 Cb 0.26 -0.88 -0.07 0.00 -1.03 0.00 0.00 41.12 39.40 2yst n ASP 116 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2yst n ASN 117 N 2.31 1.91 -3.30 -1.12 2.85 -1.26 -4.85 115.26 111.80 2yst n ASN 117 Ca 0.01 0.09 0.03 0.00 -0.11 0.00 0.00 54.58 54.60 2yst n ASN 117 Cb 0.54 -1.31 -0.03 0.00 1.24 0.00 0.00 39.78 40.22 2yst n ASN 117 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2yst s VAL 118 N 9.09 -0.49 -2.00 3.44 0.11 -1.26 -5.11 120.40 124.18 2yst s VAL 118 Ca 1.11 0.00 0.16 0.00 -2.93 0.00 0.00 61.98 60.31 2yst s VAL 118 Cb -0.71 -1.00 0.44 0.00 -1.53 0.00 0.00 36.38 33.59 2yst s VAL 118 CO 0.42 0.00 1.34 -0.81 -3.33 0.00 0.00 175.10 172.72