#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 -0.20 0.26 1.61 0.15 -1.26 -5.16 113.70 109.10 2yst s SER 2 Ca 0.00 0.68 0.11 0.00 0.70 0.00 0.00 55.95 57.45 2yst s SER 2 Cb 0.00 0.66 -0.05 0.00 -1.71 0.00 0.00 66.02 64.92 2yst s SER 2 CO 0.00 -0.20 -0.16 -0.44 1.20 0.00 0.00 173.24 173.64 2yst s SER 3 N 1.68 3.79 0.00 5.45 0.01 -1.26 -5.05 113.70 118.33 2yst s SER 3 Ca -0.06 -0.90 0.00 0.00 1.31 0.00 0.00 55.95 56.30 2yst s SER 3 Cb -0.10 -0.43 0.00 0.00 0.21 0.00 0.00 66.02 65.70 2yst s SER 3 CO -0.10 0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.21 2yst n GLY 4 N -0.48 -1.52 3.60 3.44 0.00 -1.26 -5.03 105.19 103.94 2yst n GLY 4 Ca -0.07 -1.18 -0.29 0.00 0.00 0.00 0.00 46.02 44.48 2yst n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yst s SER 5 N -0.93 1.60 -0.43 1.61 1.04 -1.26 -5.02 113.70 110.31 2yst s SER 5 Ca 0.00 1.02 0.03 0.00 0.48 0.00 0.00 55.95 57.48 2yst s SER 5 Cb 0.00 -1.55 0.12 0.00 0.10 0.00 0.00 66.02 64.68 2yst s SER 5 CO 0.00 -3.75 0.16 -0.94 0.98 0.00 0.00 173.24 169.69 2yst s SER 6 N -3.46 4.65 0.14 7.02 1.04 -1.26 -4.98 113.70 116.85 2yst s SER 6 Ca 0.68 -2.52 0.00 0.00 0.48 0.00 0.00 55.95 54.59 2yst s SER 6 Cb -0.16 -1.66 0.00 0.00 0.10 0.00 0.00 66.02 64.30 2yst s SER 6 CO 0.58 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 175.08 2yst n GLY 7 N 3.79 -4.97 3.54 7.32 0.00 -1.26 -4.67 105.19 108.93 2yst n GLY 7 Ca 0.04 -0.32 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 2yst n GLY 7 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2yst n ASN 8 N 1.41 1.83 -4.74 1.61 4.13 -1.26 -4.88 115.26 113.36 2yst n ASN 8 Ca 0.00 -0.40 -0.42 0.00 1.68 0.00 0.00 54.58 55.45 2yst n ASN 8 Cb 0.00 -1.44 -0.02 0.00 -1.54 0.00 0.00 39.78 36.78 2yst n ASN 8 CO 0.00 0.00 0.00 1.51 0.28 0.00 0.00 177.26 179.05 2yst s ASP 9 N 11.42 6.61 -0.49 6.41 1.47 -1.26 -4.98 116.67 135.85 2yst s ASP 9 Ca 1.06 2.67 0.03 0.00 1.18 0.00 0.00 52.55 57.49 2yst s ASP 9 Cb -0.41 -2.61 0.14 0.00 -0.34 0.00 0.00 42.92 39.69 2yst s ASP 9 CO 0.31 -0.76 0.28 0.54 0.68 0.00 0.00 175.17 176.22 2yst s ASN 10 N 0.64 3.81 0.15 2.11 2.20 -1.26 -5.10 114.94 117.48 2yst s ASN 10 Ca 0.63 -2.88 0.10 0.00 -0.94 0.00 0.00 52.86 49.77 2yst s ASN 10 Cb -0.43 -1.21 -0.04 0.00 -2.00 0.00 0.00 41.25 37.57 2yst s ASN 10 CO 0.40 -0.23 -0.19 -0.44 -2.94 0.00 0.00 177.10 173.69 2yst s SER 11 N -0.02 3.78 -0.94 3.54 0.01 -1.26 -5.06 113.70 113.76 2yst s SER 11 Ca 0.19 -0.65 -0.24 0.00 1.31 0.00 0.00 55.95 56.56 2yst s SER 11 Cb -0.21 -0.47 -0.05 0.00 0.21 0.00 0.00 66.02 65.50 2yst s SER 11 CO -0.03 0.15 1.94 -2.16 0.41 0.00 0.00 173.24 173.56 2yst s PRO 12 N -2.37 2.55 -0.15 12.44 0.04 -1.26 -4.93 135.00 141.31 2yst s PRO 12 Ca 0.19 -0.39 -0.00 0.00 0.04 0.00 0.00 61.00 60.84 2yst s PRO 12 Cb -0.10 -5.08 -0.00 0.00 0.04 0.00 0.00 34.50 29.36 2yst s PRO 12 CO 0.10 -3.45 -0.14 1.03 0.04 0.00 0.00 177.00 174.59 2yst s ARG 13 N 6.94 3.26 1.08 4.56 0.52 -1.26 -3.88 118.95 130.16 2yst s ARG 13 Ca 0.70 -0.73 -0.18 0.00 -0.52 0.00 0.00 55.73 55.00 2yst s ARG 13 Cb -0.06 -2.65 0.08 0.00 0.52 0.00 0.00 34.95 32.84 2yst s ARG 13 CO 0.01 0.04 0.06 1.19 0.02 0.00 0.00 175.30 176.61 2yst n PHE 14 N 4.01 -1.47 0.01 -0.53 3.72 -1.25 -4.38 117.46 117.57 2yst n PHE 14 Ca -0.19 0.17 -0.18 0.00 -0.05 0.00 0.00 57.45 57.19 2yst n PHE 14 Cb 0.52 -1.61 -0.14 0.00 -0.94 0.00 0.00 39.48 37.31 2yst n PHE 14 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2yst h GLU 15 N -1.93 0.21 -5.42 -1.08 5.08 -1.35 -3.46 114.58 106.63 2yst h GLU 15 Ca -0.51 -0.35 -0.64 0.00 -1.00 0.00 0.00 59.36 56.85 2yst h GLU 15 Cb 1.34 0.13 -0.21 0.00 0.50 0.00 0.00 28.75 30.52 2yst h GLU 15 CO 0.37 1.17 -0.67 0.15 -1.00 0.00 0.00 179.01 179.03 2yst s LYS 16 N -2.37 3.54 0.25 2.33 1.02 -1.26 -5.01 119.74 118.24 2yst s LYS 16 Ca -0.16 -0.51 -0.05 0.00 0.02 0.00 0.00 55.97 55.27 2yst s LYS 16 Cb 0.00 -2.88 0.36 0.00 -0.52 0.00 0.00 37.83 34.79 2yst s LYS 16 CO 0.78 0.31 1.86 0.77 -0.92 0.00 0.00 175.35 178.15 2yst h SER 17 N 6.46 0.88 -3.30 2.83 0.02 -1.95 -3.36 113.55 115.13 2yst h SER 17 Ca -0.34 0.02 -0.60 0.00 -0.84 0.00 0.00 61.79 60.03 2yst h SER 17 Cb 1.19 -0.17 -0.40 0.00 0.14 0.00 0.00 62.40 63.16 2yst h SER 17 CO 0.61 0.56 -0.75 -0.69 -1.14 0.00 0.00 176.83 175.42 2yst s VAL 18 N -6.05 1.21 -0.45 2.27 1.01 -1.26 -3.17 120.40 113.95 2yst s VAL 18 Ca -0.13 -1.70 -0.27 0.00 0.00 0.00 0.00 61.98 59.88 2yst s VAL 18 Cb 0.19 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 2yst s VAL 18 CO 0.80 -0.68 1.98 -0.31 0.00 0.00 0.00 175.10 176.88 2yst s TYR 19 N 1.35 1.55 -0.27 5.22 1.51 -0.55 -4.82 117.35 121.35 2yst s TYR 19 Ca 0.11 0.86 -0.07 0.00 -1.01 0.00 0.00 57.07 56.96 2yst s TYR 19 Cb -0.18 -3.99 -0.01 0.00 -0.11 0.00 0.00 41.96 37.67 2yst s TYR 19 CO -0.19 -2.73 0.07 -2.00 -1.11 0.00 0.00 175.55 169.58 2yst s GLU 20 N 6.73 3.40 0.20 -0.62 2.12 -1.26 -1.13 118.70 128.13 2yst s GLU 20 Ca 0.80 -0.65 0.02 0.00 0.36 0.00 0.00 54.97 55.51 2yst s GLU 20 Cb -0.19 -3.33 -0.05 0.00 0.26 0.00 0.00 34.13 30.82 2yst s GLU 20 CO 0.27 -0.30 0.01 0.00 -0.54 0.00 0.00 175.26 174.70 2yst s ALA 21 N 1.56 1.53 -0.22 6.30 0.00 -1.08 -5.00 121.76 124.85 2yst s ALA 21 Ca 0.05 -1.67 -0.11 0.00 0.00 0.00 0.00 51.96 50.23 2yst s ALA 21 Cb -0.16 0.57 -0.05 0.00 0.00 0.00 0.00 23.12 23.48 2yst s ALA 21 CO 0.03 -0.31 0.18 -0.51 0.00 0.00 0.00 175.76 175.15 2yst s ASP 22 N -3.23 6.20 -0.10 0.00 1.11 -1.26 -2.29 116.67 117.10 2yst s ASP 22 Ca 0.27 0.22 0.02 0.00 0.18 0.00 0.00 52.55 53.23 2yst s ASP 22 Cb 0.06 -2.12 -0.01 0.00 1.07 0.00 0.00 42.92 41.92 2yst s ASP 22 CO 0.06 0.09 -0.17 -0.22 1.18 0.00 0.00 175.17 176.12 2yst s LEU 23 N 0.81 2.52 -0.26 1.23 1.98 -1.09 -4.95 118.68 118.91 2yst s LEU 23 Ca 0.09 -0.37 -0.29 0.00 -2.89 0.00 0.00 54.13 50.67 2yst s LEU 23 Cb -0.13 -1.53 0.00 0.00 0.66 0.00 0.00 46.19 45.19 2yst s LEU 23 CO 0.03 0.20 1.23 0.00 -1.89 0.00 0.00 176.35 175.92 2yst s ALA 24 N 0.11 3.49 0.54 5.97 0.00 -1.26 0.33 121.76 130.95 2yst s ALA 24 Ca -0.08 0.17 0.35 0.00 0.00 0.00 0.00 51.96 52.40 2yst s ALA 24 Cb -0.15 -3.70 1.53 0.00 0.00 0.00 0.00 23.12 20.80 2yst s ALA 24 CO 0.05 -1.51 1.83 1.05 0.00 0.00 0.00 175.76 177.19 2yst h GLU 25 N 8.64 0.00 -1.39 0.00 9.09 -1.78 0.19 114.58 129.32 2yst h GLU 25 Ca -0.25 0.00 -0.66 0.00 0.05 0.00 0.00 59.36 58.51 2yst h GLU 25 Cb 1.09 0.00 -0.34 0.00 -1.65 0.00 0.00 28.75 27.84 2yst h GLU 25 CO 1.01 0.00 0.19 -1.71 0.05 0.00 0.00 179.01 178.55 2yst n ASN 26 N -4.20 6.34 -4.61 3.06 5.15 -1.26 -4.03 115.26 115.71 2yst n ASN 26 Ca 0.23 -3.78 -0.40 0.00 -0.60 0.00 0.00 54.58 50.04 2yst n ASN 26 Cb 1.16 -0.75 -0.08 0.00 -0.53 0.00 0.00 39.78 39.58 2yst n ASN 26 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2yst s SER 27 N -2.39 6.36 1.00 1.20 1.04 0.66 -5.05 113.70 116.52 2yst s SER 27 Ca 0.54 0.42 -0.19 0.00 0.48 0.00 0.00 55.95 57.20 2yst s SER 27 Cb 0.44 -2.25 -0.14 0.00 0.10 0.00 0.00 66.02 64.17 2yst s SER 27 CO -0.17 -0.24 -0.89 0.00 0.98 0.00 0.00 173.24 172.91 2yst n ALA 28 N 5.45 -5.38 0.97 5.32 0.00 -1.26 -4.44 120.51 121.18 2yst n ALA 28 Ca -0.06 -0.87 0.00 0.00 0.00 0.00 0.00 53.44 52.52 2yst n ALA 28 Cb 0.50 -1.11 0.02 0.00 0.00 0.00 0.00 19.45 18.87 2yst n ALA 28 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2yst n PRO 29 N 2.13 0.49 0.00 0.00 -0.04 -1.26 -2.27 135.00 134.04 2yst n PRO 29 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 2yst n PRO 29 Cb 0.61 -1.02 0.00 0.00 -0.04 0.00 0.00 33.50 33.04 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 -0.01 0.65 3.69 0.55 0.00 -1.20 -2.90 105.19 105.97 2yst n GLY 30 Ca 0.01 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.47 2yst n GLY 30 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2yst n THR 31 N -0.55 0.28 -2.26 2.61 -1.04 -0.96 -4.44 114.28 107.91 2yst n THR 31 Ca 0.00 -0.05 -0.38 0.00 -2.04 0.00 0.00 64.05 61.58 2yst n THR 31 Cb 0.00 -1.22 -0.02 0.00 -1.82 0.00 0.00 70.33 67.27 2yst n THR 31 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2yst s PRO 32 N 3.05 4.03 -0.01 -2.82 0.04 -1.26 -1.02 135.00 137.01 2yst s PRO 32 Ca 0.95 1.88 -0.01 0.00 0.04 0.00 0.00 61.00 63.86 2yst s PRO 32 Cb -1.01 -2.68 -0.00 0.00 0.04 0.00 0.00 34.50 30.85 2yst s PRO 32 CO 0.61 -0.36 -0.02 -0.89 0.04 0.00 0.00 177.00 176.38 2yst n ILE 33 N 0.06 0.13 -3.56 0.56 5.41 0.02 -4.87 119.36 117.11 2yst n ILE 33 Ca 0.04 0.34 -0.06 0.00 1.00 0.00 0.00 62.75 64.07 2yst n ILE 33 Cb 0.46 -1.43 -0.02 0.00 -0.71 0.00 0.00 39.64 37.94 2yst n ILE 33 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 2yst s LEU 34 N -5.25 -0.24 -0.37 1.39 0.05 -0.23 -5.02 118.68 109.01 2yst s LEU 34 Ca -0.02 0.05 -0.07 0.00 0.05 0.00 0.00 54.13 54.14 2yst s LEU 34 Cb 0.00 1.66 0.06 0.00 -2.05 0.00 0.00 46.19 45.86 2yst s LEU 34 CO 0.03 -0.38 0.16 -1.58 -0.55 0.00 0.00 176.35 174.03 2yst s GLN 35 N -2.46 2.55 0.19 1.48 0.74 -1.26 -0.06 119.66 120.83 2yst s GLN 35 Ca 0.06 -1.33 -0.33 0.00 0.05 0.00 0.00 55.36 53.81 2yst s GLN 35 Cb -0.01 -3.56 -0.14 0.00 1.10 0.00 0.00 33.01 30.40 2yst s GLN 35 CO -0.06 -0.79 1.45 1.28 -0.55 0.00 0.00 175.29 176.62 2yst n LEU 36 N 4.82 2.81 -4.39 3.68 4.77 -0.50 -4.96 117.00 123.23 2yst n LEU 36 Ca -0.11 1.12 -0.28 0.00 -0.03 0.00 0.00 56.01 56.71 2yst n LEU 36 Cb 0.44 -1.38 -0.12 0.00 -2.33 0.00 0.00 43.42 40.02 2yst n LEU 36 CO 0.34 -0.54 -0.55 -0.13 -1.33 0.00 0.00 177.39 175.18 2yst s ARG 37 N 0.22 1.41 -0.14 3.23 0.52 -1.26 -4.79 118.95 118.13 2yst s ARG 37 Ca 0.75 -1.39 -0.19 0.00 -0.52 0.00 0.00 55.73 54.37 2yst s ARG 37 Cb -0.71 -1.82 -0.25 0.00 0.52 0.00 0.00 34.95 32.70 2yst s ARG 37 CO 0.45 0.42 0.49 0.00 0.02 0.00 0.00 175.30 176.67 2yst h ALA 38 N 3.67 0.18 -1.95 2.13 0.00 -1.91 -2.95 119.26 118.42 2yst h ALA 38 Ca -0.49 -1.03 0.32 0.00 0.00 0.00 0.00 54.91 53.71 2yst h ALA 38 Cb 1.18 0.48 -0.08 0.00 0.00 0.00 0.00 17.79 19.38 2yst h ALA 38 CO 0.42 0.66 0.86 0.00 0.00 0.00 0.00 179.25 181.19 2yst s ALA 39 N -2.40 -2.33 -1.17 0.00 0.00 -1.26 -2.81 121.76 111.79 2yst s ALA 39 Ca -0.22 0.20 -0.13 0.00 0.00 0.00 0.00 51.96 51.81 2yst s ALA 39 Cb 0.04 0.72 -0.07 0.00 0.00 0.00 0.00 23.12 23.81 2yst s ALA 39 CO 0.70 -1.11 2.28 -0.40 0.00 0.00 0.00 175.76 177.23 2yst n ASP 40 N -0.91 4.94 -3.66 0.00 5.75 -1.26 -4.75 116.55 116.66 2yst n ASP 40 Ca -0.01 -2.59 -0.06 0.00 -0.01 0.00 0.00 54.79 52.12 2yst n ASP 40 Cb 0.60 -1.34 -0.08 0.00 -1.03 0.00 0.00 41.12 39.28 2yst n ASP 40 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2yst s LEU 41 N 0.87 -0.74 -1.25 -2.12 1.43 -1.26 -4.95 118.68 110.66 2yst s LEU 41 Ca 0.53 1.21 -0.10 0.00 -1.03 0.00 0.00 54.13 54.74 2yst s LEU 41 Cb 0.14 1.75 -0.01 0.00 0.03 0.00 0.00 46.19 48.10 2yst s LEU 41 CO -0.01 -0.22 0.67 -0.90 0.23 0.00 0.00 176.35 176.11 2yst n ASP 42 N 5.10 -3.00 -1.73 2.29 5.75 -1.26 -4.80 116.55 118.89 2yst n ASP 42 Ca -0.13 -0.96 -0.05 0.00 -0.01 0.00 0.00 54.79 53.64 2yst n ASP 42 Cb 0.51 -3.51 -0.07 0.00 -1.03 0.00 0.00 41.12 37.02 2yst n ASP 42 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 2yst n VAL 43 N -4.23 2.35 0.00 2.12 0.24 -1.26 -3.31 118.33 114.23 2yst n VAL 43 Ca -0.20 -0.90 0.00 0.00 -2.04 0.00 0.00 64.34 61.20 2yst n VAL 43 Cb 0.64 -1.70 0.00 0.00 -1.47 0.00 0.00 33.84 31.31 2yst n VAL 43 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2yst n GLY 44 N 1.94 0.12 3.29 7.63 0.00 -1.26 -5.14 105.19 111.77 2yst n GLY 44 Ca 0.18 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 2yst n GLY 44 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2yst n VAL 45 N -0.84 0.00 -0.20 1.61 0.31 -1.21 -4.67 118.33 113.33 2yst n VAL 45 Ca 0.00 -0.28 0.19 0.00 -0.01 0.00 0.00 64.34 64.25 2yst n VAL 45 Cb 0.00 -0.44 0.34 0.00 -0.91 0.00 0.00 33.84 32.83 2yst n VAL 45 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2yst n ASN 46 N 0.03 0.17 0.00 4.52 4.13 -1.26 -4.72 115.26 118.12 2yst n ASN 46 Ca 0.04 0.87 0.00 0.00 1.68 0.00 0.00 54.58 57.17 2yst n ASN 46 Cb 0.55 -0.42 0.00 0.00 -1.54 0.00 0.00 39.78 38.36 2yst n ASN 46 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2yst n GLY 47 N -1.19 3.67 2.39 7.41 0.00 -1.26 -4.43 105.19 111.78 2yst n GLY 47 Ca 0.21 -0.77 -0.18 0.00 0.00 0.00 0.00 46.02 45.29 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 0.00 -1.69 -4.06 1.61 1.13 -1.26 -4.95 117.38 108.16 2yst n GLN 48 Ca 0.00 0.94 -0.09 0.00 -1.94 0.00 0.00 57.00 55.91 2yst n GLN 48 Cb 0.00 -5.46 -0.10 0.00 0.11 0.00 0.00 30.24 24.79 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 -2.74 0.30 -0.59 5.09 -1.09 -1.26 -4.64 121.20 116.26 2yst s ILE 49 Ca 0.00 -1.46 0.04 0.00 -2.23 0.00 0.00 60.65 57.00 2yst s ILE 49 Cb 0.00 -1.04 0.15 0.00 -1.58 0.00 0.00 42.46 39.99 2yst s ILE 49 CO 0.00 -0.75 0.36 -1.61 -1.23 0.00 0.00 174.94 171.71 2yst s GLU 50 N -2.85 2.15 -1.37 2.79 8.01 0.17 -4.30 118.70 123.30 2yst s GLU 50 Ca -0.02 -2.90 -0.16 0.00 0.01 0.00 0.00 54.97 51.90 2yst s GLU 50 Cb -0.00 -3.32 0.06 0.00 -4.31 0.00 0.00 34.13 26.56 2yst s GLU 50 CO -0.05 -1.19 1.94 0.66 0.01 0.00 0.00 175.26 176.64 2yst n TYR 51 N 2.65 4.16 -2.57 1.61 4.02 -1.22 -2.84 117.16 122.97 2yst n TYR 51 Ca 0.11 -2.91 -0.23 0.00 -0.01 0.00 0.00 57.90 54.86 2yst n TYR 51 Cb 0.33 -2.58 0.10 0.00 -0.02 0.00 0.00 39.34 37.17 2yst n TYR 51 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2yst s VAL 52 N 3.64 2.23 -0.95 -0.72 -7.23 0.15 -4.10 120.40 113.42 2yst s VAL 52 Ca 0.50 -0.58 -0.23 0.00 -1.81 0.00 0.00 61.98 59.86 2yst s VAL 52 Cb 0.08 -2.65 0.05 0.00 0.56 0.00 0.00 36.38 34.43 2yst s VAL 52 CO 0.00 0.00 1.38 -0.36 -0.31 0.00 0.00 175.10 175.81 2yst s PHE 53 N -3.09 2.54 0.01 2.82 0.08 -1.26 -1.43 117.98 117.64 2yst s PHE 53 Ca 0.65 -0.73 -0.04 0.00 0.12 0.00 0.00 56.93 56.92 2yst s PHE 53 Cb -0.06 -4.64 -0.02 0.00 -0.57 0.00 0.00 43.02 37.72 2yst s PHE 53 CO 0.43 -1.92 1.06 0.78 -0.10 0.00 0.00 175.22 175.47 2yst h GLY 54 N 12.60 -0.29 -6.94 4.36 0.00 -1.13 -3.39 103.07 108.27 2yst h GLY 54 Ca 0.10 0.12 -0.61 0.00 0.00 0.00 0.00 47.33 46.93 2yst h GLY 54 CO 1.37 -0.11 -0.65 0.00 0.00 0.00 0.00 176.54 177.15 2yst n ALA 55 N -2.13 3.32 -2.56 3.60 0.00 -0.58 -4.95 120.51 117.22 2yst n ALA 55 Ca -0.02 -4.27 -0.28 0.00 0.00 0.00 0.00 53.44 48.88 2yst n ALA 55 Cb 0.05 -0.98 -0.08 0.00 0.00 0.00 0.00 19.45 18.45 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 -1.20 3.70 0.49 0.00 0.00 -1.26 -1.83 121.76 121.66 2yst s ALA 56 Ca 0.27 -1.66 0.05 0.00 0.00 0.00 0.00 51.96 50.62 2yst s ALA 56 Cb -0.02 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.91 2yst s ALA 56 CO -0.18 -0.15 0.22 0.95 0.00 0.00 0.00 175.76 176.60 2yst s THR 57 N -2.72 1.76 0.21 0.00 -4.23 -1.26 -4.93 115.64 104.47 2yst s THR 57 Ca 0.30 -1.70 -0.03 0.00 -1.18 0.00 0.00 61.69 59.09 2yst s THR 57 Cb 0.04 -2.45 -0.01 0.00 1.34 0.00 0.00 72.50 71.42 2yst s THR 57 CO 0.17 0.00 1.57 -0.33 -0.54 0.00 0.00 174.62 175.49 2yst h GLU 58 N 1.15 0.60 -0.09 3.99 4.39 -2.01 0.12 114.58 122.72 2yst h GLU 58 Ca -0.41 -0.31 -0.17 0.00 0.34 0.00 0.00 59.36 58.81 2yst h GLU 58 Cb 1.29 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.94 2yst h GLU 58 CO 0.66 0.91 -0.68 0.77 -1.16 0.00 0.00 179.01 179.51 2yst h SER 59 N 0.49 0.44 0.02 1.42 0.02 -1.99 -3.17 113.55 110.79 2yst h SER 59 Ca 0.04 -0.27 -0.00 0.00 -0.84 0.00 0.00 61.79 60.72 2yst h SER 59 Cb 0.93 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.34 2yst h SER 59 CO 0.08 0.99 -0.01 0.58 -1.14 0.00 0.00 176.83 177.33 2yst h VAL 60 N 0.27 0.00 -0.87 2.27 2.07 -1.93 -0.99 116.25 117.07 2yst h VAL 60 Ca -0.02 -0.74 0.25 0.00 0.82 0.00 0.00 66.70 67.02 2yst h VAL 60 Cb 1.23 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 2yst h VAL 60 CO 0.11 0.00 1.15 0.08 0.02 0.00 0.00 177.57 178.93 2yst h ARG 61 N -0.77 0.00 0.00 1.57 -0.00 -0.91 2.00 114.38 116.27 2yst h ARG 61 Ca -0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 59.98 59.62 2yst h ARG 61 Cb 0.02 0.00 -0.07 0.00 -0.00 0.00 0.00 29.97 29.93 2yst h ARG 61 CO 0.01 0.00 -2.35 2.89 -0.00 0.00 0.00 179.97 180.51 2yst n ARG 62 N -3.17 0.69 -0.03 0.08 1.85 -1.20 -4.43 116.66 110.44 2yst n ARG 62 Ca 0.19 0.00 -0.16 0.00 -1.00 0.00 0.00 57.85 56.88 2yst n ARG 62 Cb 1.41 -1.53 -0.07 0.00 -1.05 0.00 0.00 32.46 31.22 2yst n ARG 62 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 2yst h LEU 63 N 0.00 0.84 -8.80 2.89 5.85 0.44 -3.38 115.31 113.16 2yst h LEU 63 Ca -0.53 -0.61 -0.69 0.00 0.84 0.00 0.00 57.88 56.88 2yst h LEU 63 Cb 2.22 -0.25 -0.25 0.00 0.37 0.00 0.00 40.66 42.75 2yst h LEU 63 CO 0.03 1.32 -0.86 -0.76 -0.34 0.00 0.00 178.44 177.83 2yst s LEU 64 N -8.54 2.30 -0.20 2.25 1.43 0.95 -0.98 118.68 115.90 2yst s LEU 64 Ca -0.11 -0.52 -0.05 0.00 -1.03 0.00 0.00 54.13 52.42 2yst s LEU 64 Cb 0.08 -1.37 -0.02 0.00 0.03 0.00 0.00 46.19 44.91 2yst s LEU 64 CO 0.88 0.27 -0.01 -0.60 0.23 0.00 0.00 176.35 177.12 2yst s ARG 65 N -1.22 3.61 0.08 1.70 6.06 -0.59 -4.52 118.95 124.08 2yst s ARG 65 Ca 0.12 -0.53 0.08 0.00 -2.50 0.00 0.00 55.73 52.91 2yst s ARG 65 Cb -0.10 -3.06 -0.04 0.00 0.06 0.00 0.00 34.95 31.82 2yst s ARG 65 CO 0.03 0.03 -0.19 -1.17 -2.50 0.00 0.00 175.30 171.49 2yst s LEU 66 N 0.95 2.59 0.45 -0.88 2.96 -1.26 -2.33 118.68 121.17 2yst s LEU 66 Ca 0.01 -0.51 0.07 0.00 -0.22 0.00 0.00 54.13 53.48 2yst s LEU 66 Cb -0.14 -1.49 -0.01 0.00 0.50 0.00 0.00 46.19 45.04 2yst s LEU 66 CO 0.02 0.22 0.33 -1.81 -1.32 0.00 0.00 176.35 173.79 2yst s ASP 67 N -1.74 4.74 0.00 3.68 1.01 -1.22 -4.98 116.67 118.16 2yst s ASP 67 Ca 0.16 -1.00 0.00 0.00 0.71 0.00 0.00 52.55 52.42 2yst s ASP 67 Cb -0.10 -0.24 0.00 0.00 1.01 0.00 0.00 42.92 43.58 2yst s ASP 67 CO 0.07 -0.76 0.00 -1.84 0.21 0.00 0.00 175.17 172.85 2yst n GLU 68 N -1.52 2.22 0.19 8.23 0.00 -1.26 -3.89 120.64 124.61 2yst n GLU 68 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 57.16 57.24 2yst n GLU 68 Cb 0.63 -0.80 0.30 0.00 0.00 0.00 0.00 31.44 31.57 2yst n GLU 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2yst h THR 69 N 0.00 0.70 0.00 3.84 1.03 -1.90 -3.31 112.91 113.27 2yst h THR 69 Ca 0.00 -1.52 0.00 0.00 -0.01 0.00 0.00 66.41 64.88 2yst h THR 69 Cb 0.60 2.00 0.00 0.00 -1.07 0.00 0.00 68.15 69.68 2yst h THR 69 CO 0.00 0.32 -0.46 -1.54 -0.01 0.00 0.00 175.52 173.83 2yst n SER 70 N -3.36 2.22 -0.21 0.00 3.41 -1.26 -4.27 113.62 110.15 2yst n SER 70 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2yst n SER 70 Cb 0.54 0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.68 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 1.77 0.71 3.55 5.00 0.00 -1.25 -4.80 105.19 110.17 2yst n GLY 71 Ca 0.00 -0.73 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 2yst n GLY 71 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2yst s TRP 72 N -2.41 3.02 -0.24 1.61 0.52 -1.26 -1.40 118.94 118.77 2yst s TRP 72 Ca 0.00 0.22 -0.14 0.00 0.02 0.00 0.00 56.10 56.20 2yst s TRP 72 Cb 0.00 -3.58 -0.04 0.00 -1.15 0.00 0.00 33.47 28.70 2yst s TRP 72 CO 0.00 -0.92 0.31 -1.17 0.02 0.00 0.00 176.95 175.19 2yst s LEU 73 N 3.20 4.09 0.31 2.99 0.20 0.91 -3.37 118.68 127.01 2yst s LEU 73 Ca 0.29 0.28 -0.01 0.00 0.69 0.00 0.00 54.13 55.38 2yst s LEU 73 Cb -0.12 -2.34 -0.01 0.00 -0.43 0.00 0.00 46.19 43.28 2yst s LEU 73 CO 0.21 -0.08 0.39 -0.94 -0.29 0.00 0.00 176.35 175.64 2yst s SER 74 N 1.34 0.85 0.35 3.68 1.04 -0.98 -0.80 113.70 119.17 2yst s SER 74 Ca 0.14 -1.46 -0.25 0.00 0.48 0.00 0.00 55.95 54.85 2yst s SER 74 Cb -0.15 0.59 -0.10 0.00 0.10 0.00 0.00 66.02 66.46 2yst s SER 74 CO 0.08 -1.17 0.97 -0.69 0.98 0.00 0.00 173.24 173.42 2yst s VAL 75 N -3.40 4.10 -0.04 5.02 1.01 -0.19 -1.54 120.40 125.37 2yst s VAL 75 Ca 0.33 1.67 0.02 0.00 0.00 0.00 0.00 61.98 64.00 2yst s VAL 75 Cb 0.01 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 2yst s VAL 75 CO 0.19 0.07 -0.01 -0.11 0.00 0.00 0.00 175.10 175.24 2yst n LEU 76 N 0.31 1.47 -4.05 3.92 7.94 -0.15 -3.24 117.00 123.19 2yst n LEU 76 Ca 0.03 -0.01 -0.14 0.00 -1.11 0.00 0.00 56.01 54.78 2yst n LEU 76 Cb 0.50 -0.03 -0.12 0.00 0.53 0.00 0.00 43.42 44.30 2yst n LEU 76 CO 0.44 0.32 -0.41 -1.00 -1.11 0.00 0.00 177.39 175.64 2yst s HIS 77 N -2.09 0.68 0.52 1.96 3.76 -0.55 -4.68 115.29 114.89 2yst s HIS 77 Ca -0.04 -0.43 -0.18 0.00 -0.15 0.00 0.00 55.06 54.26 2yst s HIS 77 Cb 0.01 -0.41 -0.12 0.00 1.11 0.00 0.00 32.58 33.17 2yst s HIS 77 CO 0.12 -0.06 0.19 0.54 -0.85 0.00 0.00 174.74 174.68 2yst n ARG 78 N 1.71 0.24 -4.40 1.40 1.74 -1.26 -4.70 116.66 111.39 2yst n ARG 78 Ca -0.21 0.09 -0.26 0.00 -0.77 0.00 0.00 57.85 56.71 2yst n ARG 78 Cb 0.55 -1.32 -0.13 0.00 -1.02 0.00 0.00 32.46 30.54 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 -1.84 1.85 -0.19 0.55 1.01 -1.26 -5.04 121.20 116.28 2yst s ILE 79 Ca 0.62 -1.53 -0.04 0.00 0.00 0.00 0.00 60.65 59.70 2yst s ILE 79 Cb -0.49 -1.65 0.07 0.00 0.01 0.00 0.00 42.46 40.39 2yst s ILE 79 CO 0.61 0.04 0.08 -0.62 0.00 0.00 0.00 174.94 175.05 2yst s ASP 80 N -1.78 2.68 0.39 3.58 -1.08 -1.26 -4.47 116.67 114.72 2yst s ASP 80 Ca 0.09 -0.77 0.27 0.00 -0.52 0.00 0.00 52.55 51.61 2yst s ASP 80 Cb -0.10 -0.37 1.32 0.00 -1.46 0.00 0.00 42.92 42.32 2yst s ASP 80 CO 0.04 -0.35 1.41 -1.14 0.52 0.00 0.00 175.17 175.66 2yst n ARG 81 N 5.20 -0.04 0.30 4.34 0.00 -1.25 -0.25 116.66 124.97 2yst n ARG 81 Ca -0.07 1.16 -0.14 0.00 -0.00 0.00 0.00 57.85 58.80 2yst n ARG 81 Cb 0.48 -2.24 -0.07 0.00 0.00 0.00 0.00 32.46 30.63 2yst n ARG 81 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 2yst h GLU 82 N 0.00 -0.81 -0.68 -0.14 4.81 -1.98 -2.45 114.58 113.33 2yst h GLU 82 Ca 0.79 0.06 0.17 0.00 -0.13 0.00 0.00 59.36 60.25 2yst h GLU 82 Cb 2.46 0.18 -0.04 0.00 0.63 0.00 0.00 28.75 31.99 2yst h GLU 82 CO -0.48 -0.54 0.47 1.05 -0.73 0.00 0.00 179.01 178.79 2yst h GLU 83 N -0.84 0.16 -2.62 1.92 4.11 -1.05 -3.40 114.58 112.86 2yst h GLU 83 Ca -0.07 -0.01 -0.11 0.00 0.07 0.00 0.00 59.36 59.24 2yst h GLU 83 Cb 0.68 -0.04 -0.26 0.00 0.50 0.00 0.00 28.75 29.63 2yst h GLU 83 CO 0.06 0.11 -0.28 0.14 0.07 0.00 0.00 179.01 179.11 2yst s VAL 84 N -5.17 -0.02 -0.13 -1.06 -7.23 -0.74 -5.04 120.40 101.01 2yst s VAL 84 Ca -0.06 0.09 0.09 0.00 -1.81 0.00 0.00 61.98 60.28 2yst s VAL 84 Cb 0.21 -0.63 -0.23 0.00 0.56 0.00 0.00 36.38 36.28 2yst s VAL 84 CO 0.75 0.04 0.34 -0.46 -0.31 0.00 0.00 175.10 175.46 2yst n ASN 85 N 4.25 1.04 -3.49 4.85 6.94 -1.07 -3.75 115.26 124.04 2yst n ASN 85 Ca -0.23 0.20 -0.01 0.00 -0.02 0.00 0.00 54.58 54.51 2yst n ASN 85 Cb 0.55 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.93 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 0.52 0.74 -3.83 0.74 -1.26 -3.18 119.66 110.84 2yst s GLN 86 Ca -0.13 1.20 -0.11 0.00 0.05 0.00 0.00 55.36 56.37 2yst s GLN 86 Cb 0.07 0.61 0.05 0.00 1.10 0.00 0.00 33.01 34.84 2yst s GLN 86 CO 0.79 -0.36 1.11 -0.51 -0.55 0.00 0.00 175.29 175.77 2yst s LEU 87 N 2.82 2.75 -0.30 3.68 1.43 -1.21 -5.00 118.68 122.85 2yst s LEU 87 Ca 0.04 0.89 -0.12 0.00 -1.03 0.00 0.00 54.13 53.90 2yst s LEU 87 Cb -0.13 -3.54 0.14 0.00 0.03 0.00 0.00 46.19 42.69 2yst s LEU 87 CO -0.18 -1.58 0.77 -0.60 0.23 0.00 0.00 176.35 174.98 2yst s ARG 88 N -5.41 0.48 0.31 1.70 3.52 -1.26 -3.71 118.95 114.57 2yst s ARG 88 Ca 0.60 1.21 -0.06 0.00 -0.13 0.00 0.00 55.73 57.35 2yst s ARG 88 Cb -0.11 0.73 -0.00 0.00 -1.56 0.00 0.00 34.95 34.01 2yst s ARG 88 CO 0.49 -0.17 0.46 -0.59 -0.81 0.00 0.00 175.30 174.69 2yst s PHE 89 N 2.75 0.84 0.03 5.12 -0.12 -1.20 -4.91 117.98 120.49 2yst s PHE 89 Ca -0.05 -1.12 0.06 0.00 -0.05 0.00 0.00 56.93 55.77 2yst s PHE 89 Cb -0.10 -0.01 -0.02 0.00 -0.63 0.00 0.00 43.02 42.26 2yst s PHE 89 CO -0.18 -1.07 -0.18 0.99 -0.05 0.00 0.00 175.22 174.72 2yst s THR 90 N -3.38 1.45 -0.07 -4.49 2.01 -0.76 -0.64 115.64 109.76 2yst s THR 90 Ca 0.28 -1.03 0.05 0.00 0.31 0.00 0.00 61.69 61.31 2yst s THR 90 Cb -0.00 -1.26 -0.01 0.00 0.01 0.00 0.00 72.50 71.25 2yst s THR 90 CO 0.16 0.20 -0.24 0.68 -0.69 0.00 0.00 174.62 174.73 2yst s VAL 91 N -0.71 2.01 -0.09 3.82 -7.23 -0.47 -0.59 120.40 117.14 2yst s VAL 91 Ca 0.06 -1.03 -0.02 0.00 -1.81 0.00 0.00 61.98 59.18 2yst s VAL 91 Cb -0.08 -1.71 -0.03 0.00 0.56 0.00 0.00 36.38 35.11 2yst s VAL 91 CO 0.01 0.56 0.01 -0.04 -0.31 0.00 0.00 175.10 175.33 2yst s MET 92 N 0.01 3.07 -0.46 4.82 -1.94 -0.51 -1.51 119.30 122.77 2yst s MET 92 Ca -0.08 -0.38 0.03 0.00 -1.71 0.00 0.00 55.69 53.54 2yst s MET 92 Cb -0.15 -2.84 0.13 0.00 2.01 0.00 0.00 34.83 33.98 2yst s MET 92 CO 0.05 0.68 0.22 0.00 -0.01 0.00 0.00 175.02 175.97 2yst s ALA 93 N -0.82 2.71 0.14 3.03 0.00 -1.23 -0.67 121.76 124.93 2yst s ALA 93 Ca 0.13 -2.85 0.03 0.00 0.00 0.00 0.00 51.96 49.26 2yst s ALA 93 Cb -0.11 -2.01 -0.04 0.00 0.00 0.00 0.00 23.12 20.96 2yst s ALA 93 CO 0.02 -1.99 0.25 -0.98 0.00 0.00 0.00 175.76 173.07 2yst s ARG 94 N 0.18 3.35 0.00 0.00 1.70 -1.13 -3.96 118.95 119.09 2yst s ARG 94 Ca 0.16 -0.63 0.00 0.00 -0.47 0.00 0.00 55.73 54.79 2yst s ARG 94 Cb -0.24 -2.92 0.00 0.00 -0.57 0.00 0.00 34.95 31.22 2yst s ARG 94 CO -0.02 0.52 0.00 -0.40 -1.08 0.00 0.00 175.30 174.32 2yst n ASP 95 N -0.45 0.00 -3.15 -2.89 5.75 -1.26 -0.65 116.55 113.90 2yst n ASP 95 Ca -0.07 0.00 0.06 0.00 -0.01 0.00 0.00 54.79 54.76 2yst n ASP 95 Cb 0.54 -0.28 -0.01 0.00 -1.03 0.00 0.00 41.12 40.34 2yst n ASP 95 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2yst s ARG 96 N -0.75 0.14 0.00 0.11 1.70 -1.26 -4.89 118.95 113.99 2yst s ARG 96 Ca 0.00 0.22 0.00 0.00 -0.47 0.00 0.00 55.73 55.48 2yst s ARG 96 Cb 0.00 0.12 0.00 0.00 -0.57 0.00 0.00 34.95 34.50 2yst s ARG 96 CO 0.00 -0.17 0.00 0.41 -1.08 0.00 0.00 175.30 174.46 2yst n GLY 97 N 5.41 3.10 2.77 3.88 0.00 -1.26 -4.94 105.19 114.15 2yst n GLY 97 Ca -0.05 -1.14 -0.23 0.00 0.00 0.00 0.00 46.02 44.61 2yst n GLY 97 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2yst s GLN 98 N -2.18 0.59 0.26 1.61 -0.21 -1.26 -0.02 119.66 118.46 2yst s GLN 98 Ca 0.00 0.11 -0.29 0.00 0.02 0.00 0.00 55.36 55.20 2yst s GLN 98 Cb 0.00 -0.96 -0.09 0.00 1.00 0.00 0.00 33.01 32.95 2yst s GLN 98 CO 0.00 -0.30 1.26 -1.25 -2.12 0.00 0.00 175.29 172.88 2yst s PRO 99 N 1.98 4.43 -0.01 2.91 0.04 -1.26 -5.10 135.00 137.98 2yst s PRO 99 Ca 0.05 2.05 -0.30 0.00 0.04 0.00 0.00 61.00 62.84 2yst s PRO 99 Cb -0.12 -3.15 -0.05 0.00 0.04 0.00 0.00 34.50 31.21 2yst s PRO 99 CO -0.05 -0.13 1.46 -1.25 0.04 0.00 0.00 177.00 177.07 2yst s PRO 100 N -0.99 4.25 -0.81 0.56 0.04 0.97 -4.89 135.00 134.13 2yst s PRO 100 Ca 0.51 2.02 -0.25 0.00 0.04 0.00 0.00 61.00 63.33 2yst s PRO 100 Cb -0.37 -3.66 -0.16 0.00 0.04 0.00 0.00 34.50 30.36 2yst s PRO 100 CO 0.44 -0.65 2.40 1.63 0.04 0.00 0.00 177.00 180.86 2yst n LYS 101 N 5.78 0.51 -4.11 4.56 4.76 -1.26 -4.89 118.16 123.51 2yst n LYS 101 Ca 0.14 -0.80 -0.35 0.00 -2.87 0.00 0.00 58.31 54.43 2yst n LYS 101 Cb 0.43 -3.50 -0.12 0.00 -1.84 0.00 0.00 35.03 30.00 2yst n LYS 101 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2yst s THR 102 N 13.81 4.25 -0.94 -0.18 -4.23 -1.26 -4.01 115.64 123.08 2yst s THR 102 Ca 0.96 -0.22 -0.03 0.00 -1.18 0.00 0.00 61.69 61.22 2yst s THR 102 Cb -0.18 -2.91 0.24 0.00 1.34 0.00 0.00 72.50 70.98 2yst s THR 102 CO 0.12 0.45 0.88 -0.67 -0.54 0.00 0.00 174.62 174.85 2yst n ASP 103 N 3.89 4.54 -4.58 3.99 2.03 -1.25 -4.87 116.55 120.30 2yst n ASP 103 Ca -0.17 -3.14 -0.47 0.00 0.52 0.00 0.00 54.79 51.53 2yst n ASP 103 Cb 0.52 -1.11 -0.03 0.00 -0.72 0.00 0.00 41.12 39.78 2yst n ASP 103 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2yst n LYS 104 N 2.27 1.24 -3.77 -0.67 5.02 -1.26 -4.42 118.16 116.57 2yst n LYS 104 Ca 0.23 0.44 -0.20 0.00 -2.02 0.00 0.00 58.31 56.75 2yst n LYS 104 Cb 0.37 -1.90 -0.17 0.00 -0.02 0.00 0.00 35.03 33.31 2yst n LYS 104 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2yst s ALA 105 N -0.44 0.44 -0.18 7.82 0.00 -0.57 -4.91 121.76 123.91 2yst s ALA 105 Ca 0.69 0.06 -0.29 0.00 0.00 0.00 0.00 51.96 52.41 2yst s ALA 105 Cb -0.80 -0.60 0.00 0.00 0.00 0.00 0.00 23.12 21.72 2yst s ALA 105 CO 0.54 -0.38 1.02 0.99 0.00 0.00 0.00 175.76 177.93 2yst s THR 106 N 1.82 4.73 -0.32 0.00 2.01 -1.19 -1.36 115.64 121.33 2yst s THR 106 Ca 0.02 2.02 -0.09 0.00 0.31 0.00 0.00 61.69 63.94 2yst s THR 106 Cb -0.12 -4.30 0.00 0.00 0.01 0.00 0.00 72.50 68.08 2yst s THR 106 CO -0.04 -0.11 0.14 -0.69 -0.69 0.00 0.00 174.62 173.24 2yst s VAL 107 N 2.74 4.45 -0.42 3.82 1.01 0.19 -1.48 120.40 130.70 2yst s VAL 107 Ca 0.45 -0.55 -0.12 0.00 0.00 0.00 0.00 61.98 61.76 2yst s VAL 107 Cb -0.16 -3.31 0.06 0.00 0.00 0.00 0.00 36.38 32.97 2yst s VAL 107 CO 0.10 0.02 0.28 -0.69 0.00 0.00 0.00 175.10 174.82 2yst s VAL 108 N 1.58 4.68 -0.41 2.92 1.01 -0.29 -3.26 120.40 126.62 2yst s VAL 108 Ca 0.04 -1.10 -0.15 0.00 0.00 0.00 0.00 61.98 60.77 2yst s VAL 108 Cb -0.17 -3.75 0.02 0.00 0.00 0.00 0.00 36.38 32.48 2yst s VAL 108 CO 0.05 -0.43 0.30 -0.76 0.00 0.00 0.00 175.10 174.26 2yst s LEU 109 N 1.54 5.11 -0.54 3.92 1.43 -1.24 -2.65 118.68 126.24 2yst s LEU 109 Ca 0.03 -0.94 -0.28 0.00 -1.03 0.00 0.00 54.13 51.91 2yst s LEU 109 Cb -0.22 -2.15 0.03 0.00 0.03 0.00 0.00 46.19 43.88 2yst s LEU 109 CO 0.05 -0.46 1.23 0.20 0.23 0.00 0.00 176.35 177.60 2yst s ASN 110 N 1.72 6.44 -0.75 2.29 0.01 -0.97 -3.33 114.94 120.35 2yst s ASN 110 Ca 0.05 0.26 -0.25 0.00 -0.71 0.00 0.00 52.86 52.21 2yst s ASN 110 Cb -0.19 -2.55 -0.14 0.00 0.41 0.00 0.00 41.25 38.78 2yst s ASN 110 CO 0.09 -1.46 2.41 -0.38 -1.51 0.00 0.00 177.10 176.25 2yst n ILE 111 N 6.77 -0.02 -1.16 0.60 2.08 -1.19 -2.68 119.36 123.77 2yst n ILE 111 Ca 0.10 -0.55 -0.30 0.00 0.56 0.00 0.00 62.75 62.56 2yst n ILE 111 Cb 0.49 -2.01 0.23 0.00 -0.75 0.00 0.00 39.64 37.59 2yst n ILE 111 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 2yst s LYS 112 N 8.70 -0.88 -0.21 0.38 -0.14 0.15 -4.78 119.74 122.97 2yst s LYS 112 Ca 0.97 -0.02 0.00 0.00 -1.36 0.00 0.00 55.97 55.56 2yst s LYS 112 Cb -0.20 -1.63 0.05 0.00 -1.68 0.00 0.00 37.83 34.37 2yst s LYS 112 CO 0.15 -3.49 -0.07 0.34 -0.76 0.00 0.00 175.35 171.52 2yst s ASP 113 N -3.91 3.46 -0.04 2.83 2.15 -1.26 -2.40 116.67 117.50 2yst s ASP 113 Ca 0.70 -0.96 -0.17 0.00 0.43 0.00 0.00 52.55 52.55 2yst s ASP 113 Cb -0.10 -1.14 -0.11 0.00 -0.30 0.00 0.00 42.92 41.27 2yst s ASP 113 CO 0.56 -0.19 0.73 -0.33 -0.17 0.00 0.00 175.17 175.77 2yst h GLU 114 N 8.00 -0.44 -0.89 4.34 4.39 -1.95 -3.26 114.58 124.76 2yst h GLU 114 Ca -0.23 0.03 0.29 0.00 0.34 0.00 0.00 59.36 59.79 2yst h GLU 114 Cb 1.09 0.10 -0.16 0.00 -0.10 0.00 0.00 28.75 29.68 2yst h GLU 114 CO 0.43 -0.19 0.18 -1.71 -1.16 0.00 0.00 179.01 176.57 2yst n ASN 115 N -5.08 0.04 -3.56 1.42 2.85 -1.26 -4.47 115.26 105.20 2yst n ASN 115 Ca -0.07 1.50 -0.50 0.00 -0.11 0.00 0.00 54.58 55.39 2yst n ASN 115 Cb 0.23 -0.61 -0.10 0.00 1.24 0.00 0.00 39.78 40.55 2yst n ASN 115 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 2yst n ASP 116 N -5.20 0.68 -4.48 1.20 2.03 -1.23 -4.80 116.55 104.74 2yst n ASP 116 Ca 0.25 0.63 -0.43 0.00 0.52 0.00 0.00 54.79 55.77 2yst n ASP 116 Cb 0.85 -0.74 -0.03 0.00 -0.72 0.00 0.00 41.12 40.48 2yst n ASP 116 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2yst s ASN 117 N 4.49 6.23 0.26 1.67 -0.87 -1.26 -5.02 114.94 120.43 2yst s ASN 117 Ca 0.96 -0.98 -0.16 0.00 -1.57 0.00 0.00 52.86 51.11 2yst s ASN 117 Cb -1.23 -2.46 -0.08 0.00 -0.02 0.00 0.00 41.25 37.46 2yst s ASN 117 CO 0.56 -1.51 0.68 0.68 -2.57 0.00 0.00 177.10 174.95 2yst s VAL 118 N 4.39 4.70 -2.00 1.60 -7.23 -1.26 -5.27 120.40 115.33 2yst s VAL 118 Ca 0.27 0.98 0.16 0.00 -1.81 0.00 0.00 61.98 61.58 2yst s VAL 118 Cb -0.13 -3.71 0.45 0.00 0.56 0.00 0.00 36.38 33.55 2yst s VAL 118 CO 0.08 0.01 1.35 -0.81 -0.31 0.00 0.00 175.10 175.42