#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 -0.86 0.02 1.61 1.04 -1.26 -5.17 113.70 109.09 2yst s SER 2 Ca 0.00 1.38 -0.16 0.00 0.48 0.00 0.00 55.95 57.65 2yst s SER 2 Cb 0.00 1.38 0.03 0.00 0.10 0.00 0.00 66.02 67.53 2yst s SER 2 CO 0.00 -0.23 0.35 -0.44 0.98 0.00 0.00 173.24 173.90 2yst s SER 3 N 1.79 -0.21 0.00 7.02 0.01 -1.26 -5.17 113.70 115.88 2yst s SER 3 Ca -0.09 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.15 2yst s SER 3 Cb -0.07 0.37 0.00 0.00 0.21 0.00 0.00 66.02 66.53 2yst s SER 3 CO -0.18 -0.58 0.00 0.61 0.41 0.00 0.00 173.24 173.50 2yst n GLY 4 N 0.76 -1.10 2.96 3.44 0.00 -1.26 -5.15 105.19 104.84 2yst n GLY 4 Ca -0.19 -1.01 -0.27 0.00 0.00 0.00 0.00 46.02 44.55 2yst n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yst s SER 5 N -0.10 2.12 -0.00 1.61 0.15 -1.26 -5.12 113.70 111.10 2yst s SER 5 Ca 0.00 -0.33 -0.25 0.00 0.70 0.00 0.00 55.95 56.08 2yst s SER 5 Cb 0.00 -0.88 -0.05 0.00 -1.71 0.00 0.00 66.02 63.38 2yst s SER 5 CO 0.00 -0.06 0.76 -0.94 1.20 0.00 0.00 173.24 174.19 2yst s SER 6 N 1.34 7.14 0.00 5.45 1.04 -1.26 -5.01 113.70 122.40 2yst s SER 6 Ca -0.01 1.36 0.00 0.00 0.48 0.00 0.00 55.95 57.78 2yst s SER 6 Cb -0.14 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2yst s SER 6 CO -0.05 -0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.73 2yst n GLY 7 N 2.69 3.09 3.55 7.32 0.00 -1.26 -5.07 105.19 115.50 2yst n GLY 7 Ca -0.01 -0.56 -0.33 0.00 0.00 0.00 0.00 46.02 45.12 2yst n GLY 7 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2yst n ASN 8 N 0.00 2.21 -4.56 1.61 0.23 -1.26 -4.87 115.26 108.63 2yst n ASN 8 Ca 0.00 -0.62 -0.38 0.00 -0.53 0.00 0.00 54.58 53.05 2yst n ASN 8 Cb 0.00 -1.58 -0.03 0.00 -2.08 0.00 0.00 39.78 36.08 2yst n ASN 8 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 2yst s ASP 9 N 12.05 6.21 -0.22 0.53 1.11 -1.26 -4.90 116.67 130.18 2yst s ASP 9 Ca 0.98 -1.20 -0.04 0.00 0.18 0.00 0.00 52.55 52.47 2yst s ASP 9 Cb -0.19 -2.57 0.08 0.00 1.07 0.00 0.00 42.92 41.31 2yst s ASP 9 CO 0.24 -1.77 0.10 0.20 1.18 0.00 0.00 175.17 175.12 2yst s ASN 10 N 5.48 2.91 -0.11 0.27 0.01 -1.26 -4.80 114.94 117.45 2yst s ASN 10 Ca 0.50 -0.92 -0.15 0.00 -0.71 0.00 0.00 52.86 51.57 2yst s ASN 10 Cb -0.02 -0.34 0.04 0.00 0.41 0.00 0.00 41.25 41.34 2yst s ASN 10 CO -0.06 -0.38 0.40 -0.44 -1.51 0.00 0.00 177.10 175.11 2yst s SER 11 N 2.08 -0.37 0.34 -1.22 0.01 -1.26 -4.88 113.70 108.40 2yst s SER 11 Ca 0.05 0.60 -0.28 0.00 1.31 0.00 0.00 55.95 57.62 2yst s SER 11 Cb -0.16 0.66 -0.09 0.00 0.21 0.00 0.00 66.02 66.63 2yst s SER 11 CO -0.20 -0.26 1.22 -2.16 0.41 0.00 0.00 173.24 172.24 2yst s PRO 12 N -0.33 4.32 -0.21 12.44 0.04 -1.26 -4.72 135.00 145.28 2yst s PRO 12 Ca -0.05 2.00 -0.04 0.00 0.04 0.00 0.00 61.00 62.96 2yst s PRO 12 Cb -0.03 -2.97 0.10 0.00 0.04 0.00 0.00 34.50 31.63 2yst s PRO 12 CO 0.02 -0.14 0.22 0.50 0.04 0.00 0.00 177.00 177.64 2yst s ARG 13 N -1.87 0.20 0.95 4.56 6.06 -1.26 -4.59 118.95 122.99 2yst s ARG 13 Ca 0.50 0.15 -0.12 0.00 -2.50 0.00 0.00 55.73 53.77 2yst s ARG 13 Cb -0.35 -1.18 0.11 0.00 0.06 0.00 0.00 34.95 33.59 2yst s ARG 13 CO 0.46 -0.70 0.78 1.19 -2.50 0.00 0.00 175.30 174.53 2yst n PHE 14 N 5.32 -0.33 -0.07 5.12 3.72 -1.26 -4.53 117.46 125.43 2yst n PHE 14 Ca -0.05 0.29 -0.13 0.00 -0.05 0.00 0.00 57.45 57.51 2yst n PHE 14 Cb 0.49 -1.88 -0.06 0.00 -0.94 0.00 0.00 39.48 37.10 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 -1.81 0.50 -4.91 -1.08 4.39 -1.89 -3.41 114.58 106.37 2yst h GLU 15 Ca -0.44 -0.25 -0.67 0.00 0.34 0.00 0.00 59.36 58.34 2yst h GLU 15 Cb 1.28 0.00 -0.37 0.00 -0.10 0.00 0.00 28.75 29.57 2yst h GLU 15 CO 0.38 0.82 -0.81 0.15 -1.16 0.00 0.00 179.01 178.39 2yst s LYS 16 N -4.42 2.41 0.57 2.33 1.02 -1.26 -4.98 119.74 115.41 2yst s LYS 16 Ca -0.13 -1.23 0.41 0.00 0.02 0.00 0.00 55.97 55.04 2yst s LYS 16 Cb 0.07 -2.82 1.53 0.00 -0.52 0.00 0.00 37.83 36.09 2yst s LYS 16 CO 0.78 -0.49 1.61 0.77 -0.92 0.00 0.00 175.35 177.10 2yst h SER 17 N 7.81 0.00 -2.46 2.83 0.02 -1.94 -3.29 113.55 116.53 2yst h SER 17 Ca -0.25 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.35 2yst h SER 17 Cb 1.06 0.00 -0.36 0.00 0.14 0.00 0.00 62.40 63.25 2yst h SER 17 CO 0.50 0.00 -0.65 -0.69 -1.14 0.00 0.00 176.83 174.85 2yst s VAL 18 N -4.80 -0.31 -0.52 2.27 1.01 -1.26 -2.99 120.40 113.80 2yst s VAL 18 Ca -0.05 -0.30 -0.28 0.00 0.00 0.00 0.00 61.98 61.35 2yst s VAL 18 Cb 0.23 -0.80 0.02 0.00 0.00 0.00 0.00 36.38 35.82 2yst s VAL 18 CO 0.78 -0.35 1.36 -0.31 0.00 0.00 0.00 175.10 176.58 2yst s TYR 19 N 2.30 2.41 -0.35 5.22 1.51 0.08 -4.92 117.35 123.61 2yst s TYR 19 Ca 0.08 0.54 -0.12 0.00 -1.01 0.00 0.00 57.07 56.56 2yst s TYR 19 Cb -0.15 -4.40 0.00 0.00 -0.11 0.00 0.00 41.96 37.31 2yst s TYR 19 CO -0.21 -1.85 0.22 -2.00 -1.11 0.00 0.00 175.55 170.60 2yst s GLU 20 N 5.18 3.20 0.10 -0.62 2.12 -1.26 -1.94 118.70 125.48 2yst s GLU 20 Ca 0.53 -0.84 0.03 0.00 0.36 0.00 0.00 54.97 55.06 2yst s GLU 20 Cb -0.11 -3.77 -0.04 0.00 0.26 0.00 0.00 34.13 30.48 2yst s GLU 20 CO 0.28 -0.56 -0.09 0.00 -0.54 0.00 0.00 175.26 174.35 2yst s ALA 21 N 1.65 1.13 -0.43 6.30 0.00 -0.94 -5.02 121.76 124.45 2yst s ALA 21 Ca 0.05 -1.26 -0.12 0.00 0.00 0.00 0.00 51.96 50.62 2yst s ALA 21 Cb -0.18 0.06 0.07 0.00 0.00 0.00 0.00 23.12 23.07 2yst s ALA 21 CO 0.08 -0.09 0.30 -0.51 0.00 0.00 0.00 175.76 175.55 2yst s ASP 22 N -2.67 5.85 -0.24 0.00 1.11 -1.26 -2.52 116.67 116.94 2yst s ASP 22 Ca 0.08 -1.34 -0.10 0.00 0.18 0.00 0.00 52.55 51.37 2yst s ASP 22 Cb -0.00 -2.07 -0.05 0.00 1.07 0.00 0.00 42.92 41.87 2yst s ASP 22 CO -0.01 -0.55 0.15 -0.22 1.18 0.00 0.00 175.17 175.72 2yst s LEU 23 N 1.53 4.05 0.42 1.23 1.98 -0.92 -4.92 118.68 122.05 2yst s LEU 23 Ca 0.03 0.08 -0.24 0.00 -2.89 0.00 0.00 54.13 51.11 2yst s LEU 23 Cb -0.23 -2.09 -0.08 0.00 0.66 0.00 0.00 46.19 44.45 2yst s LEU 23 CO 0.05 0.06 1.13 0.00 -1.89 0.00 0.00 176.35 175.70 2yst s ALA 24 N 1.11 3.07 -1.43 5.97 0.00 -1.26 -1.51 121.76 127.72 2yst s ALA 24 Ca 0.07 0.88 0.22 0.00 0.00 0.00 0.00 51.96 53.13 2yst s ALA 24 Cb -0.14 -3.35 1.10 0.00 0.00 0.00 0.00 23.12 20.73 2yst s ALA 24 CO 0.05 -0.48 1.70 -0.85 0.00 0.00 0.00 175.76 176.18 2yst n GLU 25 N -0.15 0.31 -0.00 0.00 0.28 -0.45 -2.36 120.64 118.26 2yst n GLU 25 Ca 0.05 0.08 0.10 0.00 -0.16 0.00 0.00 57.16 57.24 2yst n GLU 25 Cb 0.48 -1.50 -0.14 0.00 1.43 0.00 0.00 31.44 31.71 2yst n GLU 25 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2yst n ASN 26 N -1.29 0.60 -4.45 -1.84 5.15 -1.26 -4.25 115.26 107.92 2yst n ASN 26 Ca 0.10 -0.59 -0.50 0.00 -0.60 0.00 0.00 54.58 52.99 2yst n ASN 26 Cb 0.17 1.40 -0.04 0.00 -0.53 0.00 0.00 39.78 40.79 2yst n ASN 26 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2yst n SER 27 N -1.81 -0.53 -4.68 1.20 7.64 -0.99 -4.90 113.62 109.55 2yst n SER 27 Ca 0.01 1.14 -0.29 0.00 1.01 0.00 0.00 58.87 60.74 2yst n SER 27 Cb 0.43 -1.00 0.17 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 -0.74 1.09 -2.00 -0.43 0.00 -1.26 -4.16 121.76 114.25 2yst s ALA 28 Ca 0.70 -0.21 0.09 0.00 0.00 0.00 0.00 51.96 52.54 2yst s ALA 28 Cb -0.97 -3.16 0.56 0.00 0.00 0.00 0.00 23.12 19.56 2yst s ALA 28 CO 0.56 -2.72 1.01 -0.35 0.00 0.00 0.00 175.76 174.26 2yst n PRO 29 N -4.12 0.49 -2.74 0.00 -0.04 -1.26 -3.01 135.00 124.31 2yst n PRO 29 Ca 0.06 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.48 2yst n PRO 29 Cb 0.56 -1.30 0.07 0.00 -0.04 0.00 0.00 33.50 32.79 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 -0.02 1.73 3.80 0.55 0.00 -1.17 -1.98 105.19 108.10 2yst n GLY 30 Ca 0.07 -0.81 -0.36 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.31 5.23 -0.04 2.61 2.01 -1.16 -4.79 115.64 117.19 2yst s THR 31 Ca 0.22 0.11 -0.30 0.00 0.31 0.00 0.00 61.69 62.04 2yst s THR 31 Cb 0.39 -3.29 -0.05 0.00 0.01 0.00 0.00 72.50 69.56 2yst s THR 31 CO -0.05 0.57 1.49 -2.16 -0.69 0.00 0.00 174.62 173.78 2yst s PRO 32 N -0.65 4.23 0.00 4.92 0.04 -1.26 -0.22 135.00 142.05 2yst s PRO 32 Ca 0.12 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.18 2yst s PRO 32 Cb -0.12 -3.75 0.00 0.00 0.04 0.00 0.00 34.50 30.67 2yst s PRO 32 CO 0.02 -0.71 0.00 -0.89 0.04 0.00 0.00 177.00 175.47 2yst n ILE 33 N 5.08 0.00 -4.04 0.56 5.41 0.14 -4.94 119.36 121.58 2yst n ILE 33 Ca 0.15 0.33 -0.14 0.00 1.00 0.00 0.00 62.75 64.09 2yst n ILE 33 Cb 0.43 -1.11 -0.03 0.00 -0.71 0.00 0.00 39.64 38.22 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 -3.48 0.85 -0.13 1.39 0.05 -1.13 -5.02 118.68 111.21 2yst s LEU 34 Ca 0.00 -1.45 0.02 0.00 0.05 0.00 0.00 54.13 52.75 2yst s LEU 34 Cb 0.00 1.74 0.01 0.00 -2.05 0.00 0.00 46.19 45.89 2yst s LEU 34 CO 0.00 -1.39 -0.20 -1.58 -0.55 0.00 0.00 176.35 172.63 2yst s GLN 35 N -2.84 2.77 -0.28 1.48 2.00 -1.26 -0.86 119.66 120.67 2yst s GLN 35 Ca 0.28 -0.76 -0.17 0.00 -2.00 0.00 0.00 55.36 52.70 2yst s GLN 35 Cb -0.01 -2.27 -0.02 0.00 0.80 0.00 0.00 33.01 31.51 2yst s GLN 35 CO 0.19 -0.03 0.49 -0.51 -0.50 0.00 0.00 175.29 174.93 2yst s LEU 36 N 0.87 4.11 0.24 3.68 1.43 0.18 -5.01 118.68 124.18 2yst s LEU 36 Ca -0.07 0.37 0.09 0.00 -1.03 0.00 0.00 54.13 53.50 2yst s LEU 36 Cb -0.15 -2.61 -0.04 0.00 0.03 0.00 0.00 46.19 43.42 2yst s LEU 36 CO -0.02 -0.31 -0.03 -0.13 0.23 0.00 0.00 176.35 176.09 2yst s ARG 37 N 2.29 2.24 -0.31 1.70 1.81 -1.26 -4.64 118.95 120.78 2yst s ARG 37 Ca 0.20 -1.36 0.15 0.00 -1.72 0.00 0.00 55.73 52.99 2yst s ARG 37 Cb -0.16 -2.17 0.47 0.00 -0.45 0.00 0.00 34.95 32.65 2yst s ARG 37 CO 0.10 0.39 1.09 0.00 -0.68 0.00 0.00 175.30 176.20 2yst n ALA 38 N -0.61 3.78 -0.89 2.13 0.00 -1.26 -2.81 120.51 120.85 2yst n ALA 38 Ca -0.08 -3.35 -0.28 0.00 0.00 0.00 0.00 53.44 49.73 2yst n ALA 38 Cb 0.58 -0.71 0.01 0.00 0.00 0.00 0.00 19.45 19.33 2yst n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yst n ALA 39 N -0.47 -3.03 -1.12 0.00 0.00 -1.26 -4.30 120.51 110.32 2yst n ALA 39 Ca 0.22 -0.12 -0.42 0.00 0.00 0.00 0.00 53.44 53.12 2yst n ALA 39 Cb 0.82 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.20 2yst n ALA 39 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2yst n ASP 40 N 1.97 2.25 0.03 0.00 5.68 -1.22 -4.50 116.55 120.76 2yst n ASP 40 Ca 0.05 -2.64 -0.06 0.00 -0.50 0.00 0.00 54.79 51.63 2yst n ASP 40 Cb 0.36 -1.06 -0.11 0.00 -1.14 0.00 0.00 41.12 39.16 2yst n ASP 40 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 2yst h LEU 41 N 15.14 0.00 -3.26 -2.12 3.38 -1.81 -3.30 115.31 123.33 2yst h LEU 41 Ca 0.36 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 58.01 2yst h LEU 41 Cb 0.71 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.26 2yst h LEU 41 CO 1.89 0.92 0.41 0.47 0.09 0.00 0.00 178.44 182.22 2yst n ASP 42 N -3.18 3.50 -4.31 -0.43 8.00 -1.26 -4.89 116.55 113.98 2yst n ASP 42 Ca -0.07 -3.02 -0.31 0.00 0.71 0.00 0.00 54.79 52.10 2yst n ASP 42 Cb 0.96 -0.71 -0.10 0.00 -0.02 0.00 0.00 41.12 41.24 2yst n ASP 42 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2yst n VAL 43 N -0.53 -1.05 0.00 2.53 0.31 -1.24 -4.58 118.33 113.77 2yst n VAL 43 Ca 0.38 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2yst n VAL 43 Cb 1.24 -1.04 0.00 0.00 -0.91 0.00 0.00 33.84 33.13 2yst n VAL 43 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2yst n GLY 44 N -2.57 -1.98 3.63 2.92 0.00 -1.26 -5.02 105.19 100.91 2yst n GLY 44 Ca -0.33 0.59 -0.52 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.23 0.10 0.14 1.61 0.31 -1.26 -4.88 118.33 113.11 2yst n VAL 45 Ca 0.00 -0.02 -0.23 0.00 -0.01 0.00 0.00 64.34 64.08 2yst n VAL 45 Cb 0.00 -1.04 -0.15 0.00 -0.91 0.00 0.00 33.84 31.74 2yst n VAL 45 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 2yst h ASN 46 N 5.52 0.79 0.00 4.52 -1.24 -1.92 -3.24 115.58 120.01 2yst h ASN 46 Ca -0.47 -0.84 0.00 0.00 0.71 0.00 0.00 56.30 55.70 2yst h ASN 46 Cb 1.32 -0.26 0.00 0.00 0.73 0.00 0.00 38.32 40.11 2yst h ASN 46 CO 0.84 1.65 0.00 0.61 -1.29 0.00 0.00 177.43 179.24 2yst n GLY 47 N 1.66 0.63 3.23 1.57 0.00 -1.26 -4.33 105.19 106.68 2yst n GLY 47 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 2yst n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yst n GLN 48 N 0.00 1.31 -4.71 1.61 10.64 -1.26 -4.67 117.38 120.31 2yst n GLN 48 Ca 0.00 -1.83 -0.33 0.00 -1.83 0.00 0.00 57.00 53.00 2yst n GLN 48 Cb 0.00 -3.00 -0.12 0.00 -0.86 0.00 0.00 30.24 26.26 2yst n GLN 48 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 2yst s ILE 49 N 6.34 3.49 -0.73 -0.39 -1.09 -1.26 -4.79 121.20 122.77 2yst s ILE 49 Ca 0.61 -0.56 -0.27 0.00 -2.23 0.00 0.00 60.65 58.20 2yst s ILE 49 Cb 0.12 -2.41 0.03 0.00 -1.58 0.00 0.00 42.46 38.61 2yst s ILE 49 CO 0.15 0.59 1.34 -0.70 -1.23 0.00 0.00 174.94 175.09 2yst s GLU 50 N -0.71 3.15 -0.98 2.79 2.12 -0.86 -4.75 118.70 119.46 2yst s GLU 50 Ca 0.11 -0.18 -0.21 0.00 0.36 0.00 0.00 54.97 55.05 2yst s GLU 50 Cb -0.11 -4.22 0.08 0.00 0.26 0.00 0.00 34.13 30.14 2yst s GLU 50 CO 0.01 -2.20 1.32 0.71 -0.54 0.00 0.00 175.26 174.56 2yst s TYR 51 N 6.03 2.77 0.42 5.30 2.02 -1.25 -2.50 117.35 130.15 2yst s TYR 51 Ca 0.38 -1.06 0.08 0.00 -0.37 0.00 0.00 57.07 56.10 2yst s TYR 51 Cb -0.08 -4.53 -0.01 0.00 -0.40 0.00 0.00 41.96 36.93 2yst s TYR 51 CO 0.15 -1.76 0.42 0.14 -1.57 0.00 0.00 175.55 172.93 2yst s VAL 52 N 4.06 2.68 -0.27 0.71 -7.23 -0.99 -3.50 120.40 115.86 2yst s VAL 52 Ca 0.41 -1.28 -0.29 0.00 -1.81 0.00 0.00 61.98 59.00 2yst s VAL 52 Cb -0.02 -2.96 0.00 0.00 0.56 0.00 0.00 36.38 33.96 2yst s VAL 52 CO -0.10 0.00 1.19 -0.36 -0.31 0.00 0.00 175.10 175.52 2yst s PHE 53 N -2.46 2.94 0.00 2.82 0.08 -1.26 -0.83 117.98 119.26 2yst s PHE 53 Ca 0.49 1.07 0.00 0.00 0.12 0.00 0.00 56.93 58.61 2yst s PHE 53 Cb -0.04 -3.69 0.00 0.00 -0.57 0.00 0.00 43.02 38.72 2yst s PHE 53 CO 0.29 -1.27 0.00 0.41 -0.10 0.00 0.00 175.22 174.54 2yst n GLY 54 N 3.92 1.27 2.10 4.36 0.00 -0.94 -4.70 105.19 111.20 2yst n GLY 54 Ca 0.13 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.95 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 6.74 -2.86 4.61 0.00 -1.24 -4.86 120.51 119.89 2yst n ALA 55 Ca 0.00 -2.35 -0.38 0.00 0.00 0.00 0.00 53.44 50.71 2yst n ALA 55 Cb 0.00 -2.63 -0.12 0.00 0.00 0.00 0.00 19.45 16.70 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 1.29 3.31 0.42 0.00 0.00 -1.26 -3.80 121.76 121.73 2yst s ALA 56 Ca 0.68 -1.20 -0.24 0.00 0.00 0.00 0.00 51.96 51.20 2yst s ALA 56 Cb 0.28 -2.29 -0.11 0.00 0.00 0.00 0.00 23.12 21.00 2yst s ALA 56 CO -0.02 -0.63 0.93 -2.37 0.00 0.00 0.00 175.76 173.67 2yst n THR 57 N 4.98 2.39 -0.24 0.00 5.66 -1.26 -4.61 114.28 121.21 2yst n THR 57 Ca -0.15 -0.50 0.01 0.00 -3.05 0.00 0.00 64.05 60.36 2yst n THR 57 Cb 0.51 -1.05 0.08 0.00 -1.55 0.00 0.00 70.33 68.32 2yst n THR 57 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 2yst h GLU 58 N 1.38 0.00 -1.01 1.09 4.81 -1.98 0.36 114.58 119.23 2yst h GLU 58 Ca -0.44 -0.00 0.25 0.00 -0.13 0.00 0.00 59.36 59.04 2yst h GLU 58 Cb 1.35 -0.00 -0.12 0.00 0.63 0.00 0.00 28.75 30.61 2yst h GLU 58 CO 0.56 0.00 0.61 0.77 -0.73 0.00 0.00 179.01 180.22 2yst h SER 59 N 0.00 0.63 1.87 1.04 0.02 -2.00 0.78 113.55 115.89 2yst h SER 59 Ca 0.33 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.41 2yst h SER 59 Cb 0.51 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.07 2yst h SER 59 CO -0.71 0.11 -0.11 0.58 -1.14 0.00 0.00 176.83 175.56 2yst h VAL 60 N 0.55 0.00 0.00 2.27 2.07 -0.70 -2.34 116.25 118.11 2yst h VAL 60 Ca 0.63 -0.98 -0.12 0.00 0.82 0.00 0.00 66.70 67.05 2yst h VAL 60 Cb 1.27 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 32.94 2yst h VAL 60 CO -0.43 0.00 -0.58 0.03 0.02 0.00 0.00 177.57 176.60 2yst h ARG 61 N 0.00 0.00 0.00 1.57 3.08 0.23 -1.71 114.38 117.56 2yst h ARG 61 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 2yst h ARG 61 Cb 0.99 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.04 2yst h ARG 61 CO 0.00 0.58 -1.89 2.89 -1.07 0.00 0.00 179.97 180.49 2yst n ARG 62 N -3.73 0.65 0.08 0.04 0.00 -0.73 -4.25 116.66 108.73 2yst n ARG 62 Ca -0.01 -0.15 -0.03 0.00 -0.00 0.00 0.00 57.85 57.67 2yst n ARG 62 Cb 0.61 -1.56 -0.06 0.00 -0.00 0.00 0.00 32.46 31.45 2yst n ARG 62 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2yst h LEU 63 N 0.00 0.00 -8.07 2.89 5.85 -1.39 -3.35 115.31 111.24 2yst h LEU 63 Ca -0.02 0.00 -0.46 0.00 0.84 0.00 0.00 57.88 58.24 2yst h LEU 63 Cb 1.06 0.00 -0.30 0.00 0.37 0.00 0.00 40.66 41.78 2yst h LEU 63 CO 0.00 0.75 -0.80 -0.76 -0.34 0.00 0.00 178.44 177.29 2yst s LEU 64 N -6.41 1.88 -0.15 2.25 1.43 -0.65 -1.91 118.68 115.12 2yst s LEU 64 Ca 0.01 -0.23 -0.05 0.00 -1.03 0.00 0.00 54.13 52.84 2yst s LEU 64 Cb 0.09 -0.65 -0.03 0.00 0.03 0.00 0.00 46.19 45.62 2yst s LEU 64 CO 0.79 0.11 -0.00 -0.60 0.23 0.00 0.00 176.35 176.88 2yst s ARG 65 N 0.03 3.68 0.20 1.70 3.52 -0.40 -4.58 118.95 123.10 2yst s ARG 65 Ca -0.01 -0.45 0.11 0.00 -0.13 0.00 0.00 55.73 55.26 2yst s ARG 65 Cb -0.08 -2.99 -0.04 0.00 -1.56 0.00 0.00 34.95 30.27 2yst s ARG 65 CO 0.00 0.32 -0.24 -1.17 -0.81 0.00 0.00 175.30 173.41 2yst s LEU 66 N 0.19 2.45 0.17 -0.88 2.96 -1.26 -2.15 118.68 120.16 2yst s LEU 66 Ca 0.00 -0.89 0.11 0.00 -0.22 0.00 0.00 54.13 53.13 2yst s LEU 66 Cb -0.13 -1.16 -0.04 0.00 0.50 0.00 0.00 46.19 45.35 2yst s LEU 66 CO 0.02 0.11 -0.21 -1.81 -1.32 0.00 0.00 176.35 173.14 2yst s ASP 67 N -2.77 3.61 -0.01 3.68 1.11 -0.78 -5.00 116.67 116.50 2yst s ASP 67 Ca 0.22 -0.76 0.02 0.00 0.18 0.00 0.00 52.55 52.22 2yst s ASP 67 Cb -0.08 -0.36 -0.03 0.00 1.07 0.00 0.00 42.92 43.52 2yst s ASP 67 CO 0.10 0.14 0.04 -1.84 1.18 0.00 0.00 175.17 174.79 2yst n GLU 68 N 0.43 1.42 0.11 8.23 0.28 -1.23 -3.53 120.64 126.34 2yst n GLU 68 Ca -0.14 -0.01 -0.02 0.00 -0.16 0.00 0.00 57.16 56.83 2yst n GLU 68 Cb 0.55 -1.06 0.01 0.00 1.43 0.00 0.00 31.44 32.38 2yst n GLU 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2yst h THR 69 N 0.00 1.34 0.00 3.84 1.03 -1.90 -3.31 112.91 113.91 2yst h THR 69 Ca -0.02 -2.69 -0.07 0.00 -0.01 0.00 0.00 66.41 63.62 2yst h THR 69 Cb 0.50 2.53 -0.01 0.00 -1.07 0.00 0.00 68.15 70.09 2yst h THR 69 CO 0.00 0.72 -1.28 -1.54 -0.01 0.00 0.00 175.52 173.41 2yst n SER 70 N -3.40 3.76 -0.02 0.00 3.41 -1.26 -5.02 113.62 111.09 2yst n SER 70 Ca 0.00 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 2yst n SER 70 Cb 0.79 0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.89 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 3.09 1.14 3.92 5.00 0.00 -1.23 -4.91 105.19 112.20 2yst n GLY 71 Ca -0.08 -0.45 -0.21 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.04 3.29 -0.03 1.61 0.52 -1.26 0.48 118.94 121.50 2yst s TRP 72 Ca 0.00 -0.08 0.02 0.00 0.02 0.00 0.00 56.10 56.06 2yst s TRP 72 Cb 0.00 -1.55 0.01 0.00 -1.15 0.00 0.00 33.47 30.78 2yst s TRP 72 CO 0.00 0.43 -0.08 -1.17 0.02 0.00 0.00 176.95 176.15 2yst s LEU 73 N -3.95 1.70 0.22 2.99 2.96 -0.04 -1.87 118.68 120.70 2yst s LEU 73 Ca 0.35 -0.17 -0.14 0.00 -0.22 0.00 0.00 54.13 53.94 2yst s LEU 73 Cb -0.08 -0.52 0.01 0.00 0.50 0.00 0.00 46.19 46.09 2yst s LEU 73 CO 0.28 0.04 0.48 -0.94 -1.32 0.00 0.00 176.35 174.88 2yst s SER 74 N 0.34 -0.13 0.46 3.68 1.04 -0.91 0.27 113.70 118.44 2yst s SER 74 Ca -0.05 -0.77 -0.21 0.00 0.48 0.00 0.00 55.95 55.40 2yst s SER 74 Cb -0.10 0.57 -0.09 0.00 0.10 0.00 0.00 66.02 66.50 2yst s SER 74 CO 0.01 -1.09 1.01 -0.69 0.98 0.00 0.00 173.24 173.45 2yst s VAL 75 N -3.96 3.97 -0.08 5.02 1.01 0.69 -1.28 120.40 125.77 2yst s VAL 75 Ca 0.17 1.26 -0.00 0.00 0.00 0.00 0.00 61.98 63.40 2yst s VAL 75 Cb -0.01 -3.52 -0.05 0.00 0.00 0.00 0.00 36.38 32.81 2yst s VAL 75 CO 0.04 -0.24 -0.07 -0.11 0.00 0.00 0.00 175.10 174.72 2yst n LEU 76 N -0.77 2.59 -4.17 3.92 7.94 -0.80 -3.05 117.00 122.65 2yst n LEU 76 Ca 0.08 -0.02 -0.18 0.00 -1.11 0.00 0.00 56.01 54.79 2yst n LEU 76 Cb 0.53 -0.27 -0.12 0.00 0.53 0.00 0.00 43.42 44.09 2yst n LEU 76 CO 0.39 0.55 -0.45 -1.00 -1.11 0.00 0.00 177.39 175.78 2yst s HIS 77 N -2.15 1.19 0.51 1.96 3.76 -1.02 -4.58 115.29 114.95 2yst s HIS 77 Ca -0.11 -0.49 -0.15 0.00 -0.15 0.00 0.00 55.06 54.16 2yst s HIS 77 Cb 0.03 -0.66 -0.13 0.00 1.11 0.00 0.00 32.58 32.93 2yst s HIS 77 CO 0.17 0.05 -0.23 0.54 -0.85 0.00 0.00 174.74 174.43 2yst n ARG 78 N 1.13 0.00 -5.27 1.40 1.74 -1.26 -4.59 116.66 109.81 2yst n ARG 78 Ca -0.20 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.57 2yst n ARG 78 Cb 0.55 -0.84 -0.16 0.00 -1.02 0.00 0.00 32.46 30.99 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 -1.68 2.02 -0.04 0.55 1.01 -1.26 -4.98 121.20 116.82 2yst s ILE 79 Ca 0.45 -1.08 0.03 0.00 0.00 0.00 0.00 60.65 60.05 2yst s ILE 79 Cb -0.36 -1.69 0.00 0.00 0.01 0.00 0.00 42.46 40.43 2yst s ILE 79 CO 0.59 0.57 -0.12 -0.62 0.00 0.00 0.00 174.94 175.35 2yst s ASP 80 N -0.43 1.61 -0.01 3.58 2.15 -1.26 -4.51 116.67 117.80 2yst s ASP 80 Ca 0.05 -0.26 -0.22 0.00 0.43 0.00 0.00 52.55 52.55 2yst s ASP 80 Cb -0.11 -0.52 -0.21 0.00 -0.30 0.00 0.00 42.92 41.77 2yst s ASP 80 CO 0.01 0.08 1.12 -0.09 -0.17 0.00 0.00 175.17 176.12 2yst h ARG 81 N 6.50 0.31 -0.66 4.34 1.12 -1.84 -3.02 114.38 121.14 2yst h ARG 81 Ca -0.33 -0.29 0.14 0.00 -1.11 0.00 0.00 59.98 58.39 2yst h ARG 81 Cb 1.17 0.07 -0.12 0.00 -0.01 0.00 0.00 29.97 31.09 2yst h ARG 81 CO 0.48 0.96 -0.04 0.93 -3.11 0.00 0.00 179.97 179.19 2yst h GLU 82 N -0.23 0.08 -0.05 0.20 5.08 -1.99 0.37 114.58 118.03 2yst h GLU 82 Ca -0.04 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 2yst h GLU 82 Cb 1.06 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 2yst h GLU 82 CO 0.07 0.05 -0.26 1.05 -1.00 0.00 0.00 179.01 178.92 2yst h GLU 83 N 0.08 0.08 -2.44 2.33 4.11 -2.00 -3.43 114.58 113.31 2yst h GLU 83 Ca 0.35 -0.02 -0.07 0.00 0.07 0.00 0.00 59.36 59.68 2yst h GLU 83 Cb 0.57 -0.01 -0.25 0.00 0.50 0.00 0.00 28.75 29.56 2yst h GLU 83 CO -0.60 0.35 -0.22 0.14 0.07 0.00 0.00 179.01 178.74 2yst s VAL 84 N -4.44 -0.15 -0.79 -1.06 -7.23 0.13 -5.02 120.40 101.84 2yst s VAL 84 Ca -0.04 0.08 0.23 0.00 -1.81 0.00 0.00 61.98 60.44 2yst s VAL 84 Cb 0.15 -0.73 -0.07 0.00 0.56 0.00 0.00 36.38 36.29 2yst s VAL 84 CO 0.72 0.03 1.17 -0.46 -0.31 0.00 0.00 175.10 176.25 2yst n ASN 85 N 4.49 0.64 -3.45 4.85 6.94 -1.11 -3.99 115.26 123.62 2yst n ASN 85 Ca -0.20 -0.29 0.01 0.00 -0.02 0.00 0.00 54.58 54.08 2yst n ASN 85 Cb 0.55 0.58 -0.05 0.00 -2.36 0.00 0.00 39.78 38.50 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 -3.11 0.26 -0.08 -3.83 0.74 -1.26 -3.59 119.66 108.80 2yst s GLN 86 Ca 0.07 0.58 -0.13 0.00 0.05 0.00 0.00 55.36 55.93 2yst s GLN 86 Cb 0.15 0.27 -0.05 0.00 1.10 0.00 0.00 33.01 34.48 2yst s GLN 86 CO 0.77 -0.08 0.31 -0.51 -0.55 0.00 0.00 175.29 175.23 2yst s LEU 87 N 2.02 4.38 -0.29 3.68 1.43 -1.19 -5.01 118.68 123.70 2yst s LEU 87 Ca -0.04 0.71 -0.01 0.00 -1.03 0.00 0.00 54.13 53.75 2yst s LEU 87 Cb -0.04 -2.40 0.09 0.00 0.03 0.00 0.00 46.19 43.87 2yst s LEU 87 CO -0.16 0.28 0.09 -0.60 0.23 0.00 0.00 176.35 176.18 2yst s ARG 88 N -0.59 0.71 0.44 1.70 3.52 -1.26 -2.61 118.95 120.85 2yst s ARG 88 Ca 0.20 -0.98 0.02 0.00 -0.13 0.00 0.00 55.73 54.84 2yst s ARG 88 Cb -0.14 -1.97 -0.01 0.00 -1.56 0.00 0.00 34.95 31.26 2yst s ARG 88 CO 0.08 -0.94 0.09 1.97 -0.81 0.00 0.00 175.30 175.69 2yst n PHE 89 N 4.88 0.52 -4.13 5.12 1.16 -1.25 -4.90 117.46 118.86 2yst n PHE 89 Ca -0.03 -2.53 -0.12 0.00 -1.87 0.00 0.00 57.45 52.90 2yst n PHE 89 Cb 0.43 -0.13 -0.11 0.00 -1.61 0.00 0.00 39.48 38.06 2yst n PHE 89 CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 2yst s THR 90 N -2.96 0.66 -0.02 1.97 2.01 -1.25 -1.96 115.64 114.09 2yst s THR 90 Ca 0.13 -1.62 0.05 0.00 0.31 0.00 0.00 61.69 60.55 2yst s THR 90 Cb 0.01 -1.30 -0.01 0.00 0.01 0.00 0.00 72.50 71.21 2yst s THR 90 CO 0.09 -0.68 -0.17 0.68 -0.69 0.00 0.00 174.62 173.85 2yst s VAL 91 N -2.77 1.35 0.34 3.82 -7.23 0.11 -2.22 120.40 113.79 2yst s VAL 91 Ca 0.04 -0.71 0.05 0.00 -1.81 0.00 0.00 61.98 59.55 2yst s VAL 91 Cb -0.01 -1.14 -0.01 0.00 0.56 0.00 0.00 36.38 35.79 2yst s VAL 91 CO -0.03 0.39 0.49 -0.04 -0.31 0.00 0.00 175.10 175.60 2yst s MET 92 N -0.23 3.16 -0.24 4.82 -1.94 -0.01 -0.53 119.30 124.33 2yst s MET 92 Ca 0.03 -0.87 -0.03 0.00 -1.71 0.00 0.00 55.69 53.11 2yst s MET 92 Cb -0.08 -2.78 0.11 0.00 2.01 0.00 0.00 34.83 34.09 2yst s MET 92 CO 0.00 0.06 0.25 0.00 -0.01 0.00 0.00 175.02 175.32 2yst s ALA 93 N -2.22 -0.33 0.32 3.03 0.00 -0.78 -2.34 121.76 119.44 2yst s ALA 93 Ca 0.44 -0.01 -0.04 0.00 0.00 0.00 0.00 51.96 52.36 2yst s ALA 93 Cb -0.10 -1.53 -0.05 0.00 0.00 0.00 0.00 23.12 21.45 2yst s ALA 93 CO 0.32 -1.43 0.57 1.03 0.00 0.00 0.00 175.76 176.25 2yst s ARG 94 N 2.34 3.59 0.29 0.00 0.52 -1.04 -2.56 118.95 122.08 2yst s ARG 94 Ca 0.08 -0.07 0.02 0.00 -0.52 0.00 0.00 55.73 55.25 2yst s ARG 94 Cb -0.15 -2.63 -0.05 0.00 0.52 0.00 0.00 34.95 32.64 2yst s ARG 94 CO -0.22 0.16 0.11 0.34 0.02 0.00 0.00 175.30 175.72 2yst s ASP 95 N -3.47 1.51 -1.23 0.23 2.15 -1.26 -2.02 116.67 112.58 2yst s ASP 95 Ca 0.43 -1.45 -0.19 0.00 0.43 0.00 0.00 52.55 51.77 2yst s ASP 95 Cb -0.10 0.22 -0.01 0.00 -0.30 0.00 0.00 42.92 42.73 2yst s ASP 95 CO 0.33 -0.77 1.89 -2.11 -0.17 0.00 0.00 175.17 174.33 2yst n ARG 96 N -0.55 2.46 -3.85 4.34 1.85 -1.26 -4.74 116.66 114.92 2yst n ARG 96 Ca -0.00 -2.78 -0.08 0.00 -1.00 0.00 0.00 57.85 53.99 2yst n ARG 96 Cb 0.66 -3.49 -0.00 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 4.89 0.13 -0.18 2.89 0.00 -1.26 -5.09 107.32 108.70 2yst s GLY 97 Ca 0.58 -0.51 -0.05 0.00 0.00 0.00 0.00 44.72 44.73 2yst s GLY 97 CO 0.08 -0.20 0.34 -0.86 0.00 0.00 0.00 173.10 172.46 2yst s GLN 98 N -3.28 0.25 0.48 2.90 -2.07 -1.26 -2.64 119.66 114.03 2yst s GLN 98 Ca 0.13 0.84 -0.22 0.00 -1.82 0.00 0.00 55.36 54.29 2yst s GLN 98 Cb -0.05 0.04 -0.07 0.00 -1.09 0.00 0.00 33.01 31.84 2yst s GLN 98 CO 0.09 -0.32 1.16 -1.25 -1.32 0.00 0.00 175.29 173.65 2yst s PRO 99 N 2.52 3.68 -0.31 9.60 0.04 -1.26 -5.08 135.00 144.18 2yst s PRO 99 Ca 0.01 1.74 -0.29 0.00 0.04 0.00 0.00 61.00 62.51 2yst s PRO 99 Cb -0.13 -2.33 -0.02 0.00 0.04 0.00 0.00 34.50 32.07 2yst s PRO 99 CO -0.11 -0.61 1.67 -1.25 0.04 0.00 0.00 177.00 176.74 2yst s PRO 100 N -2.81 3.51 -0.21 0.56 0.04 -1.08 -4.95 135.00 130.06 2yst s PRO 100 Ca 0.65 1.41 -0.29 0.00 0.04 0.00 0.00 61.00 62.81 2yst s PRO 100 Cb -0.28 -4.12 -0.03 0.00 0.04 0.00 0.00 34.50 30.12 2yst s PRO 100 CO 0.33 -1.64 1.62 0.15 0.04 0.00 0.00 177.00 177.51 2yst s LYS 101 N 5.24 3.80 -0.45 4.56 -0.14 -1.26 -4.86 119.74 126.63 2yst s LYS 101 Ca 0.74 1.69 -0.11 0.00 -1.36 0.00 0.00 55.97 56.92 2yst s LYS 101 Cb -0.22 -4.04 0.08 0.00 -1.68 0.00 0.00 37.83 31.98 2yst s LYS 101 CO 0.32 -1.29 0.32 0.95 -0.76 0.00 0.00 175.35 174.90 2yst s THR 102 N 5.19 4.59 -0.08 2.17 -4.23 -1.26 -4.01 115.64 118.01 2yst s THR 102 Ca 0.72 -1.34 -0.25 0.00 -1.18 0.00 0.00 61.69 59.64 2yst s THR 102 Cb -0.25 -3.81 -0.03 0.00 1.34 0.00 0.00 72.50 69.75 2yst s THR 102 CO 0.29 -0.57 0.79 -0.62 -0.54 0.00 0.00 174.62 173.97 2yst s ASP 103 N 2.40 7.06 -0.05 3.99 2.15 -1.06 -4.73 116.67 126.44 2yst s ASP 103 Ca 0.04 1.29 -0.14 0.00 0.43 0.00 0.00 52.55 54.16 2yst s ASP 103 Cb -0.24 -2.46 -0.05 0.00 -0.30 0.00 0.00 42.92 39.87 2yst s ASP 103 CO 0.03 -0.22 0.38 -0.54 -0.17 0.00 0.00 175.17 174.65 2yst s LYS 104 N 1.20 3.97 -0.06 4.34 1.02 -1.26 -1.87 119.74 127.08 2yst s LYS 104 Ca 0.41 0.32 0.00 0.00 0.02 0.00 0.00 55.97 56.73 2yst s LYS 104 Cb -0.18 -3.27 0.02 0.00 -0.52 0.00 0.00 37.83 33.88 2yst s LYS 104 CO 0.19 0.58 -0.05 0.00 -0.92 0.00 0.00 175.35 175.15 2yst s ALA 105 N -0.66 0.84 0.27 5.17 0.00 0.31 -4.93 121.76 122.75 2yst s ALA 105 Ca 0.22 -0.18 -0.29 0.00 0.00 0.00 0.00 51.96 51.71 2yst s ALA 105 Cb -0.16 -0.59 -0.09 0.00 0.00 0.00 0.00 23.12 22.28 2yst s ALA 105 CO 0.11 -0.17 0.96 0.99 0.00 0.00 0.00 175.76 177.65 2yst s THR 106 N 1.28 4.03 -0.32 0.00 2.01 -1.16 -0.72 115.64 120.76 2yst s THR 106 Ca -0.05 1.93 -0.00 0.00 0.31 0.00 0.00 61.69 63.88 2yst s THR 106 Cb -0.14 -4.18 0.10 0.00 0.01 0.00 0.00 72.50 68.29 2yst s THR 106 CO -0.02 0.37 0.10 -0.69 -0.69 0.00 0.00 174.62 173.70 2yst s VAL 107 N -1.31 0.93 -0.36 3.82 1.01 -0.83 -0.74 120.40 122.93 2yst s VAL 107 Ca 0.44 -1.49 -0.26 0.00 0.00 0.00 0.00 61.98 60.68 2yst s VAL 107 Cb -0.25 -1.71 0.01 0.00 0.00 0.00 0.00 36.38 34.44 2yst s VAL 107 CO 0.31 -0.69 0.91 -0.69 0.00 0.00 0.00 175.10 174.94 2yst s VAL 108 N 1.53 4.61 -0.59 2.92 1.01 -0.82 -3.81 120.40 125.25 2yst s VAL 108 Ca 0.10 1.21 -0.06 0.00 0.00 0.00 0.00 61.98 63.24 2yst s VAL 108 Cb -0.18 -4.31 0.15 0.00 0.00 0.00 0.00 36.38 32.04 2yst s VAL 108 CO -0.23 -0.50 0.44 -0.76 0.00 0.00 0.00 175.10 174.05 2yst s LEU 109 N 3.41 5.58 -0.19 3.92 1.43 -1.07 -2.22 118.68 129.54 2yst s LEU 109 Ca 0.38 -2.51 -0.29 0.00 -1.03 0.00 0.00 54.13 50.68 2yst s LEU 109 Cb -0.12 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.12 2yst s LEU 109 CO 0.18 -0.50 1.67 0.20 0.23 0.00 0.00 176.35 178.12 2yst s ASN 110 N 1.52 6.37 -0.79 2.29 0.01 -1.05 -3.15 114.94 120.15 2yst s ASN 110 Ca 0.13 1.76 -0.25 0.00 -0.71 0.00 0.00 52.86 53.79 2yst s ASN 110 Cb -0.20 -2.53 -0.03 0.00 0.41 0.00 0.00 41.25 38.90 2yst s ASN 110 CO -0.04 -1.24 1.84 -0.63 -1.51 0.00 0.00 177.10 175.52 2yst s ILE 111 N 5.18 3.46 0.57 0.60 -1.09 -1.24 -2.16 121.20 126.53 2yst s ILE 111 Ca 0.74 -0.13 -0.13 0.00 -2.23 0.00 0.00 60.65 58.90 2yst s ILE 111 Cb -0.27 -4.11 -0.05 0.00 -1.58 0.00 0.00 42.46 36.44 2yst s ILE 111 CO 0.30 -1.06 1.01 -0.54 -1.23 0.00 0.00 174.94 173.41 2yst s LYS 112 N 6.80 3.73 -0.45 2.79 -0.14 -0.57 -4.81 119.74 127.09 2yst s LYS 112 Ca 0.65 0.81 -0.02 0.00 -1.36 0.00 0.00 55.97 56.06 2yst s LYS 112 Cb -0.09 -2.11 0.12 0.00 -1.68 0.00 0.00 37.83 34.07 2yst s LYS 112 CO 0.08 -0.44 0.24 -0.51 -0.76 0.00 0.00 175.35 173.95 2yst s ASP 113 N -3.75 5.15 0.31 2.83 1.01 -1.26 -1.34 116.67 119.61 2yst s ASP 113 Ca 0.56 -2.26 0.04 0.00 0.71 0.00 0.00 52.55 51.60 2yst s ASP 113 Cb -0.11 -1.80 0.64 0.00 1.01 0.00 0.00 42.92 42.66 2yst s ASP 113 CO 0.45 -0.47 1.85 1.05 0.21 0.00 0.00 175.17 178.25 2yst h GLU 114 N 7.71 0.87 0.11 8.23 -0.00 -1.97 -3.13 114.58 126.41 2yst h GLU 114 Ca -0.09 -0.05 -0.01 0.00 -0.00 0.00 0.00 59.36 59.21 2yst h GLU 114 Cb 1.02 -0.20 0.00 0.00 -0.00 0.00 0.00 28.75 29.57 2yst h GLU 114 CO 0.68 0.58 -0.05 -0.97 -0.00 0.00 0.00 179.01 179.24 2yst h ASN 115 N 0.90 -0.12 -2.31 3.06 -1.24 -2.03 -3.44 115.58 110.39 2yst h ASN 115 Ca 0.48 0.00 -0.57 0.00 0.71 0.00 0.00 56.30 56.93 2yst h ASN 115 Cb 0.56 0.03 0.04 0.00 0.73 0.00 0.00 38.32 39.68 2yst h ASN 115 CO -0.25 0.07 1.01 -0.67 -1.29 0.00 0.00 177.43 176.30 2yst n ASP 116 N -3.27 3.59 0.16 1.15 2.03 -1.18 -4.87 116.55 114.16 2yst n ASP 116 Ca -0.02 1.01 0.05 0.00 0.52 0.00 0.00 54.79 56.36 2yst n ASP 116 Cb 0.06 -1.46 0.08 0.00 -0.72 0.00 0.00 41.12 39.07 2yst n ASP 116 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2yst h ASN 117 N 7.86 0.00 -3.31 1.67 -0.00 -1.86 -3.43 115.58 116.51 2yst h ASN 117 Ca -0.46 0.00 -0.28 0.00 -0.00 0.00 0.00 56.30 55.55 2yst h ASN 117 Cb 1.24 0.00 -0.34 0.00 -0.00 0.00 0.00 38.32 39.22 2yst h ASN 117 CO 0.93 0.36 -0.64 -0.69 -0.00 0.00 0.00 177.43 177.39 2yst s VAL 118 N -3.04 -0.13 -2.00 6.14 1.01 -1.26 -5.12 120.40 115.99 2yst s VAL 118 Ca 0.05 0.27 0.16 0.00 0.00 0.00 0.00 61.98 62.46 2yst s VAL 118 Cb 0.07 -0.23 0.44 0.00 0.00 0.00 0.00 36.38 36.66 2yst s VAL 118 CO 0.72 0.11 1.34 -0.81 0.00 0.00 0.00 175.10 176.47