#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 4.23 0.62 1.61 0.15 -1.26 -5.10 113.70 113.96 2yst s SER 2 Ca 0.00 -0.50 -0.19 0.00 0.70 0.00 0.00 55.95 55.96 2yst s SER 2 Cb 0.00 -1.71 -0.03 0.00 -1.71 0.00 0.00 66.02 62.57 2yst s SER 2 CO 0.00 -0.04 1.17 -0.24 1.20 0.00 0.00 173.24 175.33 2yst n SER 3 N 4.77 1.62 0.00 5.45 2.88 -1.26 -4.63 113.62 122.45 2yst n SER 3 Ca -0.18 0.83 0.00 0.00 -1.33 0.00 0.00 58.87 58.19 2yst n SER 3 Cb 0.50 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.47 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 1.05 0.34 3.64 0.46 0.00 -1.26 -5.10 105.19 104.33 2yst n GLY 4 Ca 0.15 -0.16 -0.62 0.00 0.00 0.00 0.00 46.02 45.39 2yst n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yst n SER 5 N 0.00 0.99 -4.34 1.61 7.64 -1.26 -4.87 113.62 113.39 2yst n SER 5 Ca 0.00 1.16 -0.46 0.00 1.01 0.00 0.00 58.87 60.58 2yst n SER 5 Cb 0.00 -0.96 -0.03 0.00 -1.01 0.00 0.00 64.21 62.21 2yst n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yst s SER 6 N 1.80 6.47 0.00 6.43 0.01 -1.26 -4.93 113.70 122.23 2yst s SER 6 Ca 0.97 -2.13 0.00 0.00 1.31 0.00 0.00 55.95 56.10 2yst s SER 6 Cb -1.31 -2.24 0.00 0.00 0.21 0.00 0.00 66.02 62.67 2yst s SER 6 CO 0.68 -0.80 0.00 0.61 0.41 0.00 0.00 173.24 174.14 2yst n GLY 7 N 4.74 -0.71 3.05 3.44 0.00 -1.26 -5.17 105.19 109.28 2yst n GLY 7 Ca 0.02 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.51 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 -4.00 0.08 -1.24 1.61 4.22 -1.26 -4.89 114.94 109.47 2yst s ASN 8 Ca 0.00 -0.26 -0.05 0.00 -2.14 0.00 0.00 52.86 50.41 2yst s ASN 8 Cb 0.00 0.17 0.01 0.00 1.28 0.00 0.00 41.25 42.71 2yst s ASN 8 CO 0.00 -0.31 1.06 -0.67 -2.04 0.00 0.00 177.10 175.14 2yst n ASP 9 N 1.66 -4.60 -0.10 3.54 2.03 -1.26 -4.90 116.55 112.92 2yst n ASP 9 Ca -0.22 -0.54 0.04 0.00 0.52 0.00 0.00 54.79 54.59 2yst n ASP 9 Cb 0.56 -4.86 -0.02 0.00 -0.72 0.00 0.00 41.12 36.08 2yst n ASP 9 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2yst n ASN 10 N -2.89 0.77 -4.08 1.67 3.02 -1.26 -4.96 115.26 107.54 2yst n ASN 10 Ca -0.10 -0.89 -0.29 0.00 -0.03 0.00 0.00 54.58 53.27 2yst n ASN 10 Cb 0.60 0.73 -0.17 0.00 -0.61 0.00 0.00 39.78 40.33 2yst n ASN 10 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2yst s SER 11 N -1.51 2.53 0.09 6.41 0.01 -1.26 -4.86 113.70 115.11 2yst s SER 11 Ca 0.05 -0.45 -0.31 0.00 1.31 0.00 0.00 55.95 56.55 2yst s SER 11 Cb 0.07 -1.14 -0.07 0.00 0.21 0.00 0.00 66.02 65.08 2yst s SER 11 CO 0.28 0.03 1.38 -2.16 0.41 0.00 0.00 173.24 173.18 2yst s PRO 12 N 0.91 4.33 -0.03 12.44 0.04 -1.26 -5.03 135.00 146.39 2yst s PRO 12 Ca -0.08 2.03 0.03 0.00 0.04 0.00 0.00 61.00 63.02 2yst s PRO 12 Cb -0.15 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.08 2yst s PRO 12 CO -0.01 -0.44 -0.12 1.03 0.04 0.00 0.00 177.00 177.51 2yst s ARG 13 N 1.29 1.26 0.77 4.56 1.81 -1.26 -4.51 118.95 122.87 2yst s ARG 13 Ca 0.64 -0.40 -0.12 0.00 -1.72 0.00 0.00 55.73 54.13 2yst s ARG 13 Cb -0.35 -1.14 0.05 0.00 -0.45 0.00 0.00 34.95 33.06 2yst s ARG 13 CO 0.30 0.15 1.12 -0.06 -0.68 0.00 0.00 175.30 176.12 2yst s PHE 14 N 0.19 3.04 -0.01 -0.53 0.08 -1.26 -4.07 117.98 115.42 2yst s PHE 14 Ca -0.04 1.00 -0.25 0.00 0.12 0.00 0.00 56.93 57.76 2yst s PHE 14 Cb -0.10 -3.20 -0.19 0.00 -0.57 0.00 0.00 43.02 38.96 2yst s PHE 14 CO 0.01 -1.57 1.30 0.93 -0.10 0.00 0.00 175.22 175.80 2yst h GLU 15 N -0.93 0.04 -5.70 0.44 4.39 -1.75 -3.44 114.58 107.62 2yst h GLU 15 Ca -0.46 -0.02 -0.68 0.00 0.34 0.00 0.00 59.36 58.54 2yst h GLU 15 Cb 1.28 -0.00 -0.29 0.00 -0.10 0.00 0.00 28.75 29.64 2yst h GLU 15 CO 0.63 0.48 -0.82 0.15 -1.16 0.00 0.00 179.01 178.29 2yst s LYS 16 N -4.38 2.93 0.26 2.33 1.02 -1.26 -5.02 119.74 115.62 2yst s LYS 16 Ca -0.16 -0.79 -0.03 0.00 0.02 0.00 0.00 55.97 55.02 2yst s LYS 16 Cb 0.02 -2.39 0.44 0.00 -0.52 0.00 0.00 37.83 35.38 2yst s LYS 16 CO 0.68 0.33 1.83 1.03 -0.92 0.00 0.00 175.35 178.29 2yst h SER 17 N 6.28 0.79 -3.31 2.83 0.87 -1.95 -3.35 113.55 115.72 2yst h SER 17 Ca -0.30 0.04 -0.60 0.00 -1.23 0.00 0.00 61.79 59.71 2yst h SER 17 Cb 1.20 -0.11 -0.40 0.00 -0.44 0.00 0.00 62.40 62.64 2yst h SER 17 CO 0.51 0.45 -0.75 -0.69 -0.53 0.00 0.00 176.83 175.81 2yst s VAL 18 N -6.01 1.16 -0.37 2.23 1.01 -1.26 -3.29 120.40 113.87 2yst s VAL 18 Ca -0.12 -1.91 -0.27 0.00 0.00 0.00 0.00 61.98 59.68 2yst s VAL 18 Cb 0.20 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.69 2yst s VAL 18 CO 0.79 -0.76 2.16 -0.31 0.00 0.00 0.00 175.10 176.98 2yst s TYR 19 N 1.08 1.31 -0.38 5.22 1.51 -0.23 -4.77 117.35 121.09 2yst s TYR 19 Ca 0.13 0.91 -0.08 0.00 -1.01 0.00 0.00 57.07 57.02 2yst s TYR 19 Cb -0.20 -3.87 0.06 0.00 -0.11 0.00 0.00 41.96 37.83 2yst s TYR 19 CO -0.14 -3.17 0.20 -2.00 -1.11 0.00 0.00 175.55 169.33 2yst s GLU 20 N 6.91 2.63 0.13 -0.62 2.12 -1.26 -0.85 118.70 127.76 2yst s GLU 20 Ca 0.92 -1.31 0.10 0.00 0.36 0.00 0.00 54.97 55.05 2yst s GLU 20 Cb -0.24 -3.66 -0.04 0.00 0.26 0.00 0.00 34.13 30.45 2yst s GLU 20 CO 0.30 -0.81 -0.25 0.00 -0.54 0.00 0.00 175.26 173.96 2yst s ALA 21 N 1.43 2.26 -0.57 6.30 0.00 -0.99 -4.99 121.76 125.21 2yst s ALA 21 Ca 0.01 -1.44 -0.18 0.00 0.00 0.00 0.00 51.96 50.35 2yst s ALA 21 Cb -0.21 -0.34 0.11 0.00 0.00 0.00 0.00 23.12 22.68 2yst s ALA 21 CO 0.03 0.48 0.62 0.16 0.00 0.00 0.00 175.76 177.04 2yst s ASP 22 N -2.13 6.19 -0.24 0.00 -4.77 -1.26 -2.71 116.67 111.74 2yst s ASP 22 Ca 0.13 -1.56 -0.16 0.00 -3.30 0.00 0.00 52.55 47.66 2yst s ASP 22 Cb -0.10 -2.26 -0.04 0.00 -1.09 0.00 0.00 42.92 39.44 2yst s ASP 22 CO 0.06 -1.00 0.42 -0.22 0.70 0.00 0.00 175.17 175.13 2yst s LEU 23 N 2.24 4.09 -0.01 2.11 1.98 -1.16 -4.94 118.68 123.00 2yst s LEU 23 Ca 0.08 0.44 -0.30 0.00 -2.89 0.00 0.00 54.13 51.46 2yst s LEU 23 Cb -0.26 -2.52 -0.06 0.00 0.66 0.00 0.00 46.19 44.01 2yst s LEU 23 CO 0.05 -0.17 1.45 0.00 -1.89 0.00 0.00 176.35 175.80 2yst s ALA 24 N 1.83 3.60 0.39 5.97 0.00 -1.26 -2.50 121.76 129.79 2yst s ALA 24 Ca 0.18 0.90 0.15 0.00 0.00 0.00 0.00 51.96 53.19 2yst s ALA 24 Cb -0.15 -3.63 0.99 0.00 0.00 0.00 0.00 23.12 20.33 2yst s ALA 24 CO 0.09 -1.01 1.83 1.05 0.00 0.00 0.00 175.76 177.72 2yst h GLU 25 N 8.12 0.49 0.00 0.00 4.11 -1.82 0.60 114.58 126.07 2yst h GLU 25 Ca -0.38 -0.03 -0.02 0.00 0.07 0.00 0.00 59.36 59.01 2yst h GLU 25 Cb 1.18 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 2yst h GLU 25 CO 0.92 0.32 -0.08 -0.91 0.07 0.00 0.00 179.01 179.33 2yst h ASN 26 N 0.50 0.00 -0.78 3.06 2.35 -1.84 -3.34 115.58 115.53 2yst h ASN 26 Ca 0.50 0.00 -0.80 0.00 -0.55 0.00 0.00 56.30 55.45 2yst h ASN 26 Cb 1.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.48 2yst h ASN 26 CO -0.23 0.08 0.73 -1.20 -1.65 0.00 0.00 177.43 175.16 2yst n SER 27 N -3.34 1.06 -4.70 5.81 7.64 0.21 -4.83 113.62 115.47 2yst n SER 27 Ca -0.01 1.03 -0.30 0.00 1.01 0.00 0.00 58.87 60.61 2yst n SER 27 Cb 0.26 -0.82 0.15 0.00 -1.01 0.00 0.00 64.21 62.79 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 3.22 1.36 -1.16 -0.43 0.00 -1.26 -3.64 121.76 119.85 2yst s ALA 28 Ca 1.00 -0.07 -0.23 0.00 0.00 0.00 0.00 51.96 52.66 2yst s ALA 28 Cb -1.39 -3.20 -0.08 0.00 0.00 0.00 0.00 23.12 18.44 2yst s ALA 28 CO 0.74 -2.51 1.94 -1.25 0.00 0.00 0.00 175.76 174.67 2yst s PRO 29 N -4.90 2.50 0.00 0.00 0.04 -1.26 -2.45 135.00 128.93 2yst s PRO 29 Ca 0.64 -1.09 0.00 0.00 0.04 0.00 0.00 61.00 60.59 2yst s PRO 29 Cb -0.19 -5.23 0.00 0.00 0.04 0.00 0.00 34.50 29.13 2yst s PRO 29 CO 0.57 -3.94 0.00 0.41 0.04 0.00 0.00 177.00 174.09 2yst n GLY 30 N 5.90 0.24 3.70 0.56 0.00 -0.12 -4.73 105.19 110.73 2yst n GLY 30 Ca 0.44 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 0.15 -2.25 2.61 -1.04 -1.03 -4.27 114.28 108.45 2yst n THR 31 Ca 0.00 -0.04 -0.39 0.00 -2.04 0.00 0.00 64.05 61.58 2yst n THR 31 Cb 0.00 -1.76 -0.02 0.00 -1.82 0.00 0.00 70.33 66.73 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 0.81 4.21 -0.10 -2.82 0.04 -1.26 -0.76 135.00 135.12 2yst s PRO 32 Ca 0.75 1.96 -0.09 0.00 0.04 0.00 0.00 61.00 63.66 2yst s PRO 32 Cb -0.59 -2.86 -0.03 0.00 0.04 0.00 0.00 34.50 31.06 2yst s PRO 32 CO 0.37 -0.22 -0.18 -0.89 0.04 0.00 0.00 177.00 176.12 2yst n ILE 33 N 0.43 0.85 -3.74 0.56 5.41 0.63 -4.88 119.36 118.63 2yst n ILE 33 Ca 0.02 0.30 -0.06 0.00 1.00 0.00 0.00 62.75 64.01 2yst n ILE 33 Cb 0.45 -1.99 -0.02 0.00 -0.71 0.00 0.00 39.64 37.37 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 -6.67 -0.26 -0.22 1.39 0.05 -1.09 -5.04 118.68 106.84 2yst s LEU 34 Ca -0.15 -0.40 -0.01 0.00 0.05 0.00 0.00 54.13 53.61 2yst s LEU 34 Cb 0.02 2.40 0.01 0.00 -2.05 0.00 0.00 46.19 46.57 2yst s LEU 34 CO 0.22 -1.05 -0.10 -1.58 -0.55 0.00 0.00 176.35 173.29 2yst s GLN 35 N -3.55 3.04 0.28 1.48 0.74 -1.26 -0.90 119.66 119.48 2yst s GLN 35 Ca 0.10 -0.83 -0.29 0.00 0.05 0.00 0.00 55.36 54.39 2yst s GLN 35 Cb -0.03 -2.85 -0.10 0.00 1.10 0.00 0.00 33.01 31.13 2yst s GLN 35 CO 0.01 -0.28 1.27 -0.51 -0.55 0.00 0.00 175.29 175.23 2yst s LEU 36 N 1.35 4.45 -0.03 3.68 1.43 -0.69 -5.02 118.68 123.86 2yst s LEU 36 Ca 0.03 2.51 0.02 0.00 -1.03 0.00 0.00 54.13 55.66 2yst s LEU 36 Cb -0.15 -3.63 0.01 0.00 0.03 0.00 0.00 46.19 42.45 2yst s LEU 36 CO -0.07 -0.45 -0.07 -0.13 0.23 0.00 0.00 176.35 175.86 2yst s ARG 37 N -1.15 0.92 -0.37 1.70 0.52 -1.26 -4.88 118.95 114.43 2yst s ARG 37 Ca 0.51 -0.22 -0.01 0.00 -0.52 0.00 0.00 55.73 55.48 2yst s ARG 37 Cb -0.37 -0.87 0.23 0.00 0.52 0.00 0.00 34.95 34.45 2yst s ARG 37 CO 0.45 0.03 2.08 0.00 0.02 0.00 0.00 175.30 177.89 2yst n ALA 38 N 3.61 5.36 -1.71 2.13 0.00 -1.26 -3.18 120.51 125.45 2yst n ALA 38 Ca -0.21 -1.96 -0.41 0.00 0.00 0.00 0.00 53.44 50.86 2yst n ALA 38 Cb 0.53 -1.48 -0.03 0.00 0.00 0.00 0.00 19.45 18.47 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 -2.02 2.52 0.00 0.00 0.00 -1.26 -4.67 121.76 116.33 2yst s ALA 39 Ca 0.37 0.44 0.00 0.00 0.00 0.00 0.00 51.96 52.77 2yst s ALA 39 Cb 0.28 -4.13 0.00 0.00 0.00 0.00 0.00 23.12 19.28 2yst s ALA 39 CO -0.02 -3.14 0.00 -0.40 0.00 0.00 0.00 175.76 172.20 2yst n ASP 40 N 12.26 0.01 0.12 0.00 5.68 -1.26 -4.41 116.55 128.94 2yst n ASP 40 Ca 0.29 0.01 0.00 0.00 -0.50 0.00 0.00 54.79 54.59 2yst n ASP 40 Cb 0.48 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 2yst n ASP 40 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2yst n LEU 41 N -2.76 0.15 -3.87 -2.12 4.77 -1.26 -4.96 117.00 106.95 2yst n LEU 41 Ca 0.00 0.39 -0.38 0.00 -0.03 0.00 0.00 56.01 56.00 2yst n LEU 41 Cb 0.24 0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 41.52 2yst n LEU 41 CO 0.00 -0.77 0.71 0.47 -1.33 0.00 0.00 177.39 176.48 2yst n ASP 42 N -3.46 5.34 0.02 -1.43 8.00 -1.26 -4.83 116.55 118.93 2yst n ASP 42 Ca 0.00 -3.37 0.03 0.00 0.71 0.00 0.00 54.79 52.15 2yst n ASP 42 Cb 0.01 -1.08 0.12 0.00 -0.02 0.00 0.00 41.12 40.15 2yst n ASP 42 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 2yst n VAL 43 N 1.37 1.71 -0.78 2.53 3.14 -1.26 -3.43 118.33 121.61 2yst n VAL 43 Ca 0.27 0.48 -0.08 0.00 -2.96 0.00 0.00 64.34 62.04 2yst n VAL 43 Cb 0.36 -1.43 -0.11 0.00 -1.06 0.00 0.00 33.84 31.60 2yst n VAL 43 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2yst n GLY 44 N -1.20 2.66 3.23 7.55 0.00 -1.26 -4.80 105.19 111.38 2yst n GLY 44 Ca 0.00 -0.79 -0.10 0.00 0.00 0.00 0.00 46.02 45.14 2yst n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yst s VAL 45 N 0.93 0.09 0.00 1.61 0.11 -1.22 -5.03 120.40 116.88 2yst s VAL 45 Ca 0.44 -1.67 -0.03 0.00 -2.93 0.00 0.00 61.98 57.79 2yst s VAL 45 Cb 0.21 -1.94 -0.15 0.00 -1.53 0.00 0.00 36.38 32.96 2yst s VAL 45 CO 0.00 -0.39 2.91 0.59 -3.33 0.00 0.00 175.10 174.87 2yst n ASN 46 N -0.15 5.27 -2.59 3.54 3.02 -1.26 -4.83 115.26 118.26 2yst n ASN 46 Ca -0.06 -2.45 -0.12 0.00 -0.03 0.00 0.00 54.58 51.92 2yst n ASN 46 Cb 0.63 -1.29 0.01 0.00 -0.61 0.00 0.00 39.78 38.53 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 2.06 0.06 1.67 7.41 0.00 -1.26 -4.70 105.19 110.44 2yst n GLY 47 Ca 0.24 0.34 -0.04 0.00 0.00 0.00 0.00 46.02 46.55 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 0.59 1.34 -3.97 1.61 6.02 -1.26 -4.76 117.38 116.95 2yst n GLN 48 Ca -0.03 -0.38 -0.25 0.00 -0.01 0.00 0.00 57.00 56.33 2yst n GLN 48 Cb 0.41 -1.33 -0.17 0.00 1.02 0.00 0.00 30.24 30.18 2yst n GLN 48 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2yst s ILE 49 N 0.18 0.83 0.85 5.09 -1.09 -1.26 -4.79 121.20 121.01 2yst s ILE 49 Ca 0.21 -0.19 -0.11 0.00 -2.23 0.00 0.00 60.65 58.34 2yst s ILE 49 Cb 0.11 -0.87 0.11 0.00 -1.58 0.00 0.00 42.46 40.23 2yst s ILE 49 CO -0.00 0.33 1.14 -1.61 -1.23 0.00 0.00 174.94 173.56 2yst s GLU 50 N 1.58 1.50 -0.38 2.79 0.41 -0.55 -4.88 118.70 119.18 2yst s GLU 50 Ca 0.01 1.49 0.01 0.00 -0.41 0.00 0.00 54.97 56.07 2yst s GLU 50 Cb -0.13 -1.79 0.13 0.00 -1.78 0.00 0.00 34.13 30.57 2yst s GLU 50 CO -0.05 -2.26 0.20 0.71 -0.49 0.00 0.00 175.26 173.37 2yst s TYR 51 N -2.61 1.33 0.43 1.61 2.02 -1.25 -3.42 117.35 115.46 2yst s TYR 51 Ca 0.66 -1.93 0.08 0.00 -0.37 0.00 0.00 57.07 55.51 2yst s TYR 51 Cb -0.22 -1.41 -0.01 0.00 -0.40 0.00 0.00 41.96 39.91 2yst s TYR 51 CO 0.55 -0.82 0.39 0.14 -1.57 0.00 0.00 175.55 174.25 2yst s VAL 52 N 0.89 2.58 -0.51 0.71 -7.23 -0.91 -3.85 120.40 112.09 2yst s VAL 52 Ca 0.16 -1.34 -0.28 0.00 -1.81 0.00 0.00 61.98 58.71 2yst s VAL 52 Cb -0.23 -2.92 0.02 0.00 0.56 0.00 0.00 36.38 33.81 2yst s VAL 52 CO -0.04 0.00 1.29 -0.36 -0.31 0.00 0.00 175.10 175.68 2yst s PHE 53 N -2.50 2.52 0.00 2.82 0.08 -1.26 -1.43 117.98 118.21 2yst s PHE 53 Ca 0.48 0.57 0.00 0.00 0.12 0.00 0.00 56.93 58.10 2yst s PHE 53 Cb -0.03 -4.42 0.00 0.00 -0.57 0.00 0.00 43.02 38.00 2yst s PHE 53 CO 0.28 -1.71 0.00 0.41 -0.10 0.00 0.00 175.22 174.10 2yst n GLY 54 N 5.07 0.24 2.37 4.36 0.00 -0.76 -4.58 105.19 111.89 2yst n GLY 54 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 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 6.10 -2.46 4.61 0.00 -1.18 -4.95 120.51 119.64 2yst n ALA 55 Ca 0.00 -2.87 -0.27 0.00 0.00 0.00 0.00 53.44 50.30 2yst n ALA 55 Cb 0.00 -1.88 -0.02 0.00 0.00 0.00 0.00 19.45 17.55 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 -2.28 3.55 0.15 0.00 0.00 -1.25 -4.14 121.76 117.80 2yst s ALA 56 Ca 0.51 -0.61 -0.01 0.00 0.00 0.00 0.00 51.96 51.85 2yst s ALA 56 Cb 0.37 -2.37 -0.05 0.00 0.00 0.00 0.00 23.12 21.08 2yst s ALA 56 CO -0.17 -0.02 0.34 -0.08 0.00 0.00 0.00 175.76 175.83 2yst s THR 57 N -2.36 5.24 0.59 0.00 -1.32 -1.26 -4.96 115.64 111.57 2yst s THR 57 Ca 0.44 -0.28 0.29 0.00 -1.21 0.00 0.00 61.69 60.94 2yst s THR 57 Cb -0.10 -3.68 0.40 0.00 -1.51 0.00 0.00 72.50 67.61 2yst s THR 57 CO 0.36 -0.04 1.68 1.05 -2.21 0.00 0.00 174.62 175.46 2yst h GLU 58 N 2.47 0.00 -0.04 7.08 4.11 -1.99 0.98 114.58 127.18 2yst h GLU 58 Ca -0.47 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 58.78 2yst h GLU 58 Cb 1.18 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2yst h GLU 58 CO 0.71 0.00 -0.74 0.77 0.07 0.00 0.00 179.01 179.81 2yst h SER 59 N 0.00 0.34 -0.12 3.06 0.02 -1.98 -1.45 113.55 113.42 2yst h SER 59 Ca 0.35 -0.23 -0.21 0.00 -0.84 0.00 0.00 61.79 60.86 2yst h SER 59 Cb 1.90 -0.10 0.01 0.00 0.14 0.00 0.00 62.40 64.35 2yst h SER 59 CO -0.00 0.96 -0.75 0.58 -1.14 0.00 0.00 176.83 176.48 2yst h VAL 60 N 0.18 1.30 -0.27 2.27 2.07 0.61 -0.28 116.25 122.13 2yst h VAL 60 Ca -0.03 -1.98 -0.16 0.00 0.82 0.00 0.00 66.70 65.35 2yst h VAL 60 Cb 1.32 2.11 -0.00 0.00 -1.52 0.00 0.00 31.29 33.19 2yst h VAL 60 CO 0.12 0.62 -0.44 0.08 0.02 0.00 0.00 177.57 177.96 2yst h ARG 61 N 0.40 0.79 -0.14 1.57 0.11 -1.44 0.58 114.38 116.24 2yst h ARG 61 Ca -0.06 -0.48 -0.18 0.00 0.10 0.00 0.00 59.98 59.36 2yst h ARG 61 Cb 1.39 0.05 -0.00 0.00 1.11 0.00 0.00 29.97 32.51 2yst h ARG 61 CO 0.15 1.11 -0.64 0.07 0.10 0.00 0.00 179.97 180.76 2yst h ARG 62 N 0.54 0.53 0.10 0.08 0.11 -1.32 -3.23 114.38 111.19 2yst h ARG 62 Ca 0.02 -0.38 -0.27 0.00 0.10 0.00 0.00 59.98 59.45 2yst h ARG 62 Cb 1.04 0.06 -0.00 0.00 1.11 0.00 0.00 29.97 32.18 2yst h ARG 62 CO 0.10 1.00 -1.27 1.25 0.10 0.00 0.00 179.97 181.15 2yst h LEU 63 N 0.39 0.34 -8.33 0.08 5.85 -1.03 -3.37 115.31 109.24 2yst h LEU 63 Ca -0.01 -0.39 -0.52 0.00 0.84 0.00 0.00 57.88 57.79 2yst h LEU 63 Cb 1.21 -0.11 -0.28 0.00 0.37 0.00 0.00 40.66 41.85 2yst h LEU 63 CO 0.12 1.31 -0.82 -0.76 -0.34 0.00 0.00 178.44 177.94 2yst s LEU 64 N -7.02 2.07 -0.15 2.25 1.43 0.20 -1.45 118.68 116.02 2yst s LEU 64 Ca -0.04 -0.36 -0.03 0.00 -1.03 0.00 0.00 54.13 52.67 2yst s LEU 64 Cb 0.07 -0.83 -0.02 0.00 0.03 0.00 0.00 46.19 45.44 2yst s LEU 64 CO 0.87 0.17 -0.06 -0.60 0.23 0.00 0.00 176.35 176.96 2yst s ARG 65 N -0.63 3.61 0.03 1.70 3.52 -0.59 -3.95 118.95 122.65 2yst s ARG 65 Ca 0.06 -0.55 0.07 0.00 -0.13 0.00 0.00 55.73 55.18 2yst s ARG 65 Cb -0.07 -2.85 -0.03 0.00 -1.56 0.00 0.00 34.95 30.44 2yst s ARG 65 CO 0.00 0.24 -0.20 -1.17 -0.81 0.00 0.00 175.30 173.36 2yst s LEU 66 N 0.35 2.51 0.28 -0.88 2.96 -1.26 -2.06 118.68 120.58 2yst s LEU 66 Ca -0.06 -0.45 0.07 0.00 -0.22 0.00 0.00 54.13 53.48 2yst s LEU 66 Cb -0.15 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 45.05 2yst s LEU 66 CO 0.04 0.26 0.26 -1.81 -1.32 0.00 0.00 176.35 173.78 2yst s ASP 67 N -1.33 5.56 0.00 3.68 1.01 -1.09 -5.00 116.67 119.50 2yst s ASP 67 Ca 0.14 -0.29 0.00 0.00 0.71 0.00 0.00 52.55 53.11 2yst s ASP 67 Cb -0.10 -1.30 0.00 0.00 1.01 0.00 0.00 42.92 42.53 2yst s ASP 67 CO 0.04 -0.17 0.00 -1.84 0.21 0.00 0.00 175.17 173.41 2yst n GLU 68 N -1.30 2.98 -0.14 8.23 0.00 -1.25 -3.97 120.64 125.20 2yst n GLU 68 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 57.16 56.99 2yst n GLU 68 Cb 0.58 -0.92 0.00 0.00 0.00 0.00 0.00 31.44 31.10 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 1.27 0.00 3.84 1.03 -1.94 -3.34 112.91 113.77 2yst h THR 69 Ca 0.00 -1.46 -0.25 0.00 -0.01 0.00 0.00 66.41 64.70 2yst h THR 69 Cb 0.85 1.24 -0.04 0.00 -1.07 0.00 0.00 68.15 69.12 2yst h THR 69 CO 0.00 0.49 -1.90 -1.54 -0.01 0.00 0.00 175.52 172.57 2yst n SER 70 N -4.09 2.23 -0.03 0.00 3.41 -1.26 -5.05 113.62 108.83 2yst n SER 70 Ca -0.01 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2yst n SER 70 Cb 0.49 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 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 2.48 1.47 3.55 5.00 0.00 -1.25 -4.95 105.19 111.49 2yst n GLY 71 Ca -0.29 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.05 3.14 -0.15 1.61 0.52 -1.26 -1.70 118.94 119.04 2yst s TRP 72 Ca 0.00 -0.14 -0.07 0.00 0.02 0.00 0.00 56.10 55.91 2yst s TRP 72 Cb 0.00 -2.05 -0.04 0.00 -1.15 0.00 0.00 33.47 30.23 2yst s TRP 72 CO 0.00 0.01 0.07 -1.17 0.02 0.00 0.00 176.95 175.88 2yst s LEU 73 N 0.52 3.91 0.28 2.99 0.20 -0.08 -2.68 118.68 123.82 2yst s LEU 73 Ca 0.00 0.18 -0.03 0.00 0.69 0.00 0.00 54.13 54.97 2yst s LEU 73 Cb -0.13 -1.97 -0.01 0.00 -0.43 0.00 0.00 46.19 43.64 2yst s LEU 73 CO 0.02 0.25 0.37 -0.94 -0.29 0.00 0.00 176.35 175.76 2yst s SER 74 N -0.11 0.58 0.20 3.68 1.04 -0.87 -0.27 113.70 117.95 2yst s SER 74 Ca 0.07 -1.36 -0.21 0.00 0.48 0.00 0.00 55.95 54.93 2yst s SER 74 Cb -0.12 0.56 -0.08 0.00 0.10 0.00 0.00 66.02 66.48 2yst s SER 74 CO 0.01 -1.12 0.72 -0.69 0.98 0.00 0.00 173.24 173.14 2yst s VAL 75 N -3.60 4.54 -0.17 5.02 1.01 0.06 -1.54 120.40 125.72 2yst s VAL 75 Ca 0.32 1.36 -0.02 0.00 0.00 0.00 0.00 61.98 63.64 2yst s VAL 75 Cb 0.02 -3.92 -0.10 0.00 0.00 0.00 0.00 36.38 32.38 2yst s VAL 75 CO 0.17 0.30 -0.18 -0.11 0.00 0.00 0.00 175.10 175.28 2yst n LEU 76 N 0.97 2.41 -4.21 3.92 7.94 -0.53 -0.95 117.00 126.56 2yst n LEU 76 Ca -0.04 0.01 -0.27 0.00 -1.11 0.00 0.00 56.01 54.61 2yst n LEU 76 Cb 0.51 -0.56 -0.16 0.00 0.53 0.00 0.00 43.42 43.74 2yst n LEU 76 CO 0.44 0.64 -0.52 -1.00 -1.11 0.00 0.00 177.39 175.84 2yst s HIS 77 N -2.33 1.80 0.35 1.96 3.76 -0.81 -4.49 115.29 115.54 2yst s HIS 77 Ca -0.23 -0.35 -0.24 0.00 -0.15 0.00 0.00 55.06 54.09 2yst s HIS 77 Cb 0.07 -1.16 -0.15 0.00 1.11 0.00 0.00 32.58 32.45 2yst s HIS 77 CO 0.36 -0.04 0.44 2.89 -0.85 0.00 0.00 174.74 177.55 2yst n ARG 78 N 2.62 0.34 -4.49 1.40 0.00 -1.26 -4.60 116.66 110.66 2yst n ARG 78 Ca -0.15 0.12 -0.33 0.00 -0.00 0.00 0.00 57.85 57.49 2yst n ARG 78 Cb 0.53 -1.27 -0.10 0.00 -0.00 0.00 0.00 32.46 31.62 2yst n ARG 78 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2yst s ILE 79 N -1.39 3.74 -0.27 8.89 1.01 -1.24 -4.94 121.20 127.00 2yst s ILE 79 Ca 0.62 -0.64 -0.02 0.00 0.00 0.00 0.00 60.65 60.61 2yst s ILE 79 Cb -0.70 -2.60 0.09 0.00 0.01 0.00 0.00 42.46 39.26 2yst s ILE 79 CO 0.59 0.47 0.08 -0.62 0.00 0.00 0.00 174.94 175.46 2yst s ASP 80 N -1.21 3.58 0.30 3.58 2.15 -1.26 -4.35 116.67 119.46 2yst s ASP 80 Ca 0.16 -1.31 0.21 0.00 0.43 0.00 0.00 52.55 52.04 2yst s ASP 80 Cb -0.11 -0.70 1.01 0.00 -0.30 0.00 0.00 42.92 42.82 2yst s ASP 80 CO 0.06 -0.38 1.07 -1.14 -0.17 0.00 0.00 175.17 174.60 2yst n ARG 81 N 4.98 -0.03 0.43 4.34 0.00 -1.24 0.60 116.66 125.74 2yst n ARG 81 Ca -0.05 0.86 -0.17 0.00 -0.00 0.00 0.00 57.85 58.50 2yst n ARG 81 Cb 0.44 -1.69 -0.08 0.00 0.00 0.00 0.00 32.46 31.13 2yst n ARG 81 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2yst h GLU 82 N 0.00 -1.04 -0.77 -0.14 5.08 -1.98 -2.97 114.58 112.76 2yst h GLU 82 Ca 0.60 0.07 0.07 0.00 -1.00 0.00 0.00 59.36 59.10 2yst h GLU 82 Cb 1.90 0.24 -0.05 0.00 0.50 0.00 0.00 28.75 31.34 2yst h GLU 82 CO -0.34 -0.70 0.50 1.05 -1.00 0.00 0.00 179.01 178.53 2yst h GLU 83 N -1.11 0.76 -3.45 2.33 4.11 -0.26 -3.41 114.58 113.55 2yst h GLU 83 Ca -0.11 -0.05 -0.29 0.00 0.07 0.00 0.00 59.36 58.99 2yst h GLU 83 Cb 0.83 -0.17 -0.34 0.00 0.50 0.00 0.00 28.75 29.57 2yst h GLU 83 CO 0.18 0.50 -0.70 0.14 0.07 0.00 0.00 179.01 179.21 2yst s VAL 84 N -5.70 -0.06 -0.16 -1.06 -7.23 -0.46 -5.03 120.40 100.70 2yst s VAL 84 Ca -0.10 0.22 0.08 0.00 -1.81 0.00 0.00 61.98 60.37 2yst s VAL 84 Cb 0.20 -0.12 -0.23 0.00 0.56 0.00 0.00 36.38 36.79 2yst s VAL 84 CO 0.78 0.09 0.22 -0.46 -0.31 0.00 0.00 175.10 175.41 2yst n ASN 85 N 4.22 1.09 -3.90 4.85 6.94 -1.16 -3.63 115.26 123.67 2yst n ASN 85 Ca -0.27 0.12 -0.11 0.00 -0.02 0.00 0.00 54.58 54.30 2yst n ASN 85 Cb 0.50 0.04 -0.11 0.00 -2.36 0.00 0.00 39.78 37.85 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 -2.54 0.32 -0.30 -3.83 0.74 -1.26 -3.37 119.66 109.41 2yst s GLN 86 Ca -0.17 -0.34 0.02 0.00 0.05 0.00 0.00 55.36 54.92 2yst s GLN 86 Cb 0.07 0.13 0.09 0.00 1.10 0.00 0.00 33.01 34.40 2yst s GLN 86 CO 0.76 -0.06 0.03 -0.51 -0.55 0.00 0.00 175.29 174.96 2yst s LEU 87 N -1.03 3.42 -0.17 3.68 1.43 -1.04 -5.01 118.68 119.94 2yst s LEU 87 Ca -0.11 -1.73 -0.01 0.00 -1.03 0.00 0.00 54.13 51.25 2yst s LEU 87 Cb -0.07 -1.29 -0.00 0.00 0.03 0.00 0.00 46.19 44.87 2yst s LEU 87 CO 0.00 -0.35 -0.13 -0.13 0.23 0.00 0.00 176.35 175.97 2yst s ARG 88 N 1.25 3.23 0.31 1.70 0.52 -1.26 -1.60 118.95 123.09 2yst s ARG 88 Ca 0.06 -0.73 -0.01 0.00 -0.52 0.00 0.00 55.73 54.53 2yst s ARG 88 Cb -0.18 -2.72 -0.01 0.00 0.52 0.00 0.00 34.95 32.56 2yst s ARG 88 CO -0.13 -0.07 0.39 -0.59 0.02 0.00 0.00 175.30 174.93 2yst s PHE 89 N 1.04 1.15 0.01 -0.53 -0.71 -1.18 -4.90 117.98 112.86 2yst s PHE 89 Ca -0.01 -1.32 0.04 0.00 -1.04 0.00 0.00 56.93 54.60 2yst s PHE 89 Cb -0.15 -0.24 -0.01 0.00 -1.21 0.00 0.00 43.02 41.41 2yst s PHE 89 CO -0.03 -1.01 -0.14 0.99 -1.34 0.00 0.00 175.22 173.69 2yst s THR 90 N -3.36 1.10 0.02 -4.49 2.01 -1.26 -0.33 115.64 109.33 2yst s THR 90 Ca 0.33 -0.72 0.09 0.00 0.31 0.00 0.00 61.69 61.69 2yst s THR 90 Cb 0.01 -0.94 -0.03 0.00 0.01 0.00 0.00 72.50 71.55 2yst s THR 90 CO 0.20 0.21 -0.26 0.68 -0.69 0.00 0.00 174.62 174.75 2yst s VAL 91 N -0.49 2.11 0.22 3.82 -7.23 -1.00 -1.82 120.40 116.00 2yst s VAL 91 Ca 0.04 -1.29 0.07 0.00 -1.81 0.00 0.00 61.98 59.00 2yst s VAL 91 Cb -0.06 -1.78 -0.04 0.00 0.56 0.00 0.00 36.38 35.06 2yst s VAL 91 CO 0.00 0.45 0.09 -0.04 -0.31 0.00 0.00 175.10 175.29 2yst s MET 92 N -1.01 2.67 -0.18 4.82 -1.94 -0.52 -1.49 119.30 121.65 2yst s MET 92 Ca 0.11 -1.10 -0.05 0.00 -1.71 0.00 0.00 55.69 52.94 2yst s MET 92 Cb -0.10 -2.45 0.07 0.00 2.01 0.00 0.00 34.83 34.36 2yst s MET 92 CO 0.01 0.43 0.11 0.00 -0.01 0.00 0.00 175.02 175.55 2yst s ALA 93 N -1.99 0.36 0.20 3.03 0.00 -1.10 -2.13 121.76 120.13 2yst s ALA 93 Ca 0.31 -0.30 0.10 0.00 0.00 0.00 0.00 51.96 52.07 2yst s ALA 93 Cb -0.08 -1.09 -0.04 0.00 0.00 0.00 0.00 23.12 21.90 2yst s ALA 93 CO 0.22 -1.21 -0.20 -0.98 0.00 0.00 0.00 175.76 173.59 2yst s ARG 94 N 2.16 1.44 0.40 0.00 1.70 -1.22 -3.04 118.95 120.38 2yst s ARG 94 Ca 0.03 -1.54 0.05 0.00 -0.47 0.00 0.00 55.73 53.80 2yst s ARG 94 Cb -0.16 -1.56 -0.06 0.00 -0.57 0.00 0.00 34.95 32.60 2yst s ARG 94 CO -0.11 0.32 0.03 0.34 -1.08 0.00 0.00 175.30 174.79 2yst s ASP 95 N -2.90 3.35 -0.81 -2.89 2.15 -1.26 -1.48 116.67 112.83 2yst s ASP 95 Ca 0.21 -1.44 -0.26 0.00 0.43 0.00 0.00 52.55 51.49 2yst s ASP 95 Cb -0.06 -0.09 -0.23 0.00 -0.30 0.00 0.00 42.92 42.23 2yst s ASP 95 CO 0.09 -0.60 1.93 -2.11 -0.17 0.00 0.00 175.17 174.32 2yst n ARG 96 N -0.92 0.55 -3.62 4.34 1.85 -1.26 -4.73 116.66 112.87 2yst n ARG 96 Ca -0.06 -1.72 -0.13 0.00 -1.00 0.00 0.00 57.85 54.94 2yst n ARG 96 Cb 0.67 -3.44 -0.06 0.00 -1.05 0.00 0.00 32.46 28.58 2yst n ARG 96 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2yst s GLY 97 N 7.35 -0.35 -0.05 2.89 0.00 -1.26 -5.08 107.32 110.82 2yst s GLY 97 Ca 0.73 0.43 -0.02 0.00 0.00 0.00 0.00 44.72 45.87 2yst s GLY 97 CO 0.21 0.16 0.04 -0.86 0.00 0.00 0.00 173.10 172.64 2yst s GLN 98 N -2.54 0.13 0.23 2.90 -2.07 -1.26 -0.50 119.66 116.55 2yst s GLN 98 Ca -0.05 0.28 -0.30 0.00 -1.82 0.00 0.00 55.36 53.48 2yst s GLN 98 Cb -0.01 -0.63 -0.09 0.00 -1.09 0.00 0.00 33.01 31.19 2yst s GLN 98 CO -0.03 -0.31 1.28 -1.25 -1.32 0.00 0.00 175.29 173.66 2yst s PRO 99 N 2.02 4.42 -0.30 9.60 0.04 -1.26 -5.09 135.00 144.42 2yst s PRO 99 Ca 0.04 2.05 -0.29 0.00 0.04 0.00 0.00 61.00 62.84 2yst s PRO 99 Cb -0.12 -3.17 -0.02 0.00 0.04 0.00 0.00 34.50 31.23 2yst s PRO 99 CO -0.04 -0.18 1.67 -1.25 0.04 0.00 0.00 177.00 177.24 2yst s PRO 100 N -0.62 3.55 0.06 0.56 0.04 0.34 -4.97 135.00 133.96 2yst s PRO 100 Ca 0.53 1.43 -0.31 0.00 0.04 0.00 0.00 61.00 62.70 2yst s PRO 100 Cb -0.36 -4.11 -0.07 0.00 0.04 0.00 0.00 34.50 30.00 2yst s PRO 100 CO 0.41 -1.60 1.40 0.21 0.04 0.00 0.00 177.00 177.47 2yst s LYS 101 N 5.17 4.30 0.07 4.56 2.47 -1.26 -4.90 119.74 130.15 2yst s LYS 101 Ca 0.74 2.03 0.09 0.00 -1.56 0.00 0.00 55.97 57.26 2yst s LYS 101 Cb -0.22 -3.42 -0.03 0.00 -1.46 0.00 0.00 37.83 32.70 2yst s LYS 101 CO 0.32 -0.51 -0.24 0.95 0.16 0.00 0.00 175.35 176.03 2yst s THR 102 N 1.76 1.98 -0.09 3.43 -4.23 -1.25 -3.92 115.64 113.32 2yst s THR 102 Ca 0.65 -1.42 0.01 0.00 -1.18 0.00 0.00 61.69 59.74 2yst s THR 102 Cb -0.34 -1.72 0.02 0.00 1.34 0.00 0.00 72.50 71.79 2yst s THR 102 CO 0.29 0.22 -0.10 1.51 -0.54 0.00 0.00 174.62 176.00 2yst s ASP 103 N -1.45 1.95 0.16 3.99 -4.77 -1.17 -4.86 116.67 110.52 2yst s ASP 103 Ca 0.10 -0.30 -0.16 0.00 -3.30 0.00 0.00 52.55 48.89 2yst s ASP 103 Cb -0.10 -0.84 -0.07 0.00 -1.09 0.00 0.00 42.92 40.82 2yst s ASP 103 CO 0.03 -0.03 0.60 -0.54 0.70 0.00 0.00 175.17 175.92 2yst s LYS 104 N 1.13 4.07 -0.15 2.11 1.02 -1.25 -2.72 119.74 123.95 2yst s LYS 104 Ca -0.06 0.61 -0.04 0.00 0.02 0.00 0.00 55.97 56.50 2yst s LYS 104 Cb -0.14 -2.94 0.06 0.00 -0.52 0.00 0.00 37.83 34.29 2yst s LYS 104 CO -0.02 0.47 0.13 0.00 -0.92 0.00 0.00 175.35 175.01 2yst s ALA 105 N -1.45 0.13 -0.04 5.17 0.00 -0.56 -4.92 121.76 120.10 2yst s ALA 105 Ca 0.38 0.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.09 2yst s ALA 105 Cb -0.16 -1.01 -0.05 0.00 0.00 0.00 0.00 23.12 21.90 2yst s ALA 105 CO 0.20 -0.99 1.52 0.99 0.00 0.00 0.00 175.76 177.48 2yst s THR 106 N 2.22 3.65 -0.45 0.00 2.01 -1.21 -2.38 115.64 119.48 2yst s THR 106 Ca 0.04 0.91 -0.09 0.00 0.31 0.00 0.00 61.69 62.86 2yst s THR 106 Cb -0.15 -3.59 0.10 0.00 0.01 0.00 0.00 72.50 68.88 2yst s THR 106 CO -0.08 -0.05 0.30 -0.69 -0.69 0.00 0.00 174.62 173.41 2yst s VAL 107 N 3.28 4.20 -0.59 3.82 1.01 0.55 -1.06 120.40 131.61 2yst s VAL 107 Ca 0.68 -1.61 -0.22 0.00 0.00 0.00 0.00 61.98 60.83 2yst s VAL 107 Cb -0.32 -3.68 0.06 0.00 0.00 0.00 0.00 36.38 32.44 2yst s VAL 107 CO 0.27 -0.65 0.88 -0.69 0.00 0.00 0.00 175.10 174.91 2yst s VAL 108 N 1.39 4.47 -0.53 2.92 1.01 -0.03 -3.12 120.40 126.51 2yst s VAL 108 Ca 0.04 -0.18 -0.14 0.00 0.00 0.00 0.00 61.98 61.71 2yst s VAL 108 Cb -0.25 -4.55 0.13 0.00 0.00 0.00 0.00 36.38 31.71 2yst s VAL 108 CO 0.00 -1.19 0.46 -0.76 0.00 0.00 0.00 175.10 173.61 2yst s LEU 109 N 3.69 6.06 -0.16 3.92 1.43 -0.63 -2.35 118.68 130.64 2yst s LEU 109 Ca 0.23 -1.88 -0.29 0.00 -1.03 0.00 0.00 54.13 51.16 2yst s LEU 109 Cb -0.16 -2.15 -0.01 0.00 0.03 0.00 0.00 46.19 43.90 2yst s LEU 109 CO 0.14 -0.79 1.23 0.20 0.23 0.00 0.00 176.35 177.36 2yst s ASN 110 N 3.22 6.97 -0.58 2.29 0.01 -1.10 -2.49 114.94 123.27 2yst s ASN 110 Ca 0.05 1.68 -0.27 0.00 -0.71 0.00 0.00 52.86 53.61 2yst s ASN 110 Cb -0.28 -2.54 -0.00 0.00 0.41 0.00 0.00 41.25 38.84 2yst s ASN 110 CO 0.01 -0.73 1.65 -0.63 -1.51 0.00 0.00 177.10 175.90 2yst s ILE 111 N 3.28 3.54 0.63 0.60 -1.09 -1.22 -2.96 121.20 123.99 2yst s ILE 111 Ca 0.54 0.39 -0.11 0.00 -2.23 0.00 0.00 60.65 59.24 2yst s ILE 111 Cb -0.21 -4.18 -0.03 0.00 -1.58 0.00 0.00 42.46 36.46 2yst s ILE 111 CO 0.15 -1.05 1.04 -0.54 -1.23 0.00 0.00 174.94 173.30 2yst s LYS 112 N 6.28 3.49 -0.57 2.79 -0.14 -1.04 -4.86 119.74 125.68 2yst s LYS 112 Ca 0.60 0.75 0.01 0.00 -1.36 0.00 0.00 55.97 55.97 2yst s LYS 112 Cb -0.13 -2.07 0.15 0.00 -1.68 0.00 0.00 37.83 34.10 2yst s LYS 112 CO 0.23 -0.65 0.35 -0.51 -0.76 0.00 0.00 175.35 174.00 2yst s ASP 113 N -4.16 4.74 0.06 2.83 1.11 -1.26 -2.67 116.67 117.32 2yst s ASP 113 Ca 0.55 -2.96 -0.38 0.00 0.18 0.00 0.00 52.55 49.95 2yst s ASP 113 Cb -0.11 -1.74 -0.21 0.00 1.07 0.00 0.00 42.92 41.93 2yst s ASP 113 CO 0.54 -0.29 1.57 -0.33 1.18 0.00 0.00 175.17 177.84 2yst h GLU 114 N 6.72 -1.28 -0.82 8.23 4.39 -1.97 -3.08 114.58 126.76 2yst h GLU 114 Ca -0.05 0.09 0.12 0.00 0.34 0.00 0.00 59.36 59.86 2yst h GLU 114 Cb 0.92 0.29 -0.13 0.00 -0.10 0.00 0.00 28.75 29.73 2yst h GLU 114 CO 0.70 -0.86 -0.35 -1.71 -1.16 0.00 0.00 179.01 175.64 2yst n ASN 115 N -5.66 -0.59 -4.59 1.42 2.85 -1.26 -4.43 115.26 103.00 2yst n ASN 115 Ca -0.16 1.43 -0.31 0.00 -0.11 0.00 0.00 54.58 55.43 2yst n ASN 115 Cb 0.53 -0.31 0.16 0.00 1.24 0.00 0.00 39.78 41.41 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 -5.18 -0.40 -4.17 1.20 -0.08 -1.17 -5.04 116.55 101.72 2yst n ASP 116 Ca 0.07 0.37 -0.18 0.00 -1.51 0.00 0.00 54.79 53.54 2yst n ASP 116 Cb 0.31 -1.39 -0.12 0.00 2.34 0.00 0.00 41.12 42.26 2yst n ASP 116 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2yst s ASN 117 N -2.46 1.61 0.01 1.67 2.20 -1.26 -5.00 114.94 111.71 2yst s ASN 117 Ca 0.64 -0.63 0.01 0.00 -0.94 0.00 0.00 52.86 51.94 2yst s ASN 117 Cb -0.22 -0.04 -0.01 0.00 -2.00 0.00 0.00 41.25 38.98 2yst s ASN 117 CO 0.61 -0.10 -0.03 0.68 -2.94 0.00 0.00 177.10 175.32 2yst s VAL 118 N -1.39 0.19 -2.00 3.54 -7.23 -1.26 -5.21 120.40 107.04 2yst s VAL 118 Ca -0.02 -0.36 0.16 0.00 -1.81 0.00 0.00 61.98 59.95 2yst s VAL 118 Cb -0.09 -0.22 0.44 0.00 0.56 0.00 0.00 36.38 37.08 2yst s VAL 118 CO 0.02 -0.11 1.34 -0.81 -0.31 0.00 0.00 175.10 175.23