#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 -0.58 -0.19 1.61 0.01 -1.26 -5.15 113.70 108.14 2yst s SER 2 Ca 0.00 1.08 -0.14 0.00 1.31 0.00 0.00 55.95 58.20 2yst s SER 2 Cb 0.00 1.07 -0.04 0.00 0.21 0.00 0.00 66.02 67.26 2yst s SER 2 CO 0.00 -0.19 0.31 -0.55 0.41 0.00 0.00 173.24 173.22 2yst s SER 3 N 0.51 6.38 0.00 2.44 0.15 -1.26 -4.87 113.70 117.05 2yst s SER 3 Ca -0.02 0.44 0.00 0.00 0.70 0.00 0.00 55.95 57.07 2yst s SER 3 Cb -0.04 -2.19 0.00 0.00 -1.71 0.00 0.00 66.02 62.08 2yst s SER 3 CO -0.02 0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.04 2yst n GLY 4 N 3.78 0.85 2.78 9.45 0.00 -1.26 -4.92 105.19 115.87 2yst n GLY 4 Ca -0.11 -1.25 -0.15 0.00 0.00 0.00 0.00 46.02 44.51 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 -4.00 0.07 0.12 1.61 0.15 -1.26 -5.06 113.70 105.33 2yst s SER 5 Ca 0.00 0.03 -0.33 0.00 0.70 0.00 0.00 55.95 56.35 2yst s SER 5 Cb 0.00 -0.06 -0.12 0.00 -1.71 0.00 0.00 66.02 64.13 2yst s SER 5 CO 0.00 -0.12 1.55 0.28 1.20 0.00 0.00 173.24 176.16 2yst h SER 6 N 7.17 -1.79 -4.73 5.45 0.02 -1.95 -3.43 113.55 114.29 2yst h SER 6 Ca -0.44 0.22 -0.28 0.00 -0.84 0.00 0.00 61.79 60.46 2yst h SER 6 Cb 1.13 0.72 -0.21 0.00 0.14 0.00 0.00 62.40 64.18 2yst h SER 6 CO 0.48 -0.44 -0.73 -0.83 -1.14 0.00 0.00 176.83 174.16 2yst s GLY 7 N -2.33 0.56 0.28 -3.77 0.00 -1.26 -5.15 107.32 95.65 2yst s GLY 7 Ca -0.15 -0.83 -0.10 0.00 0.00 0.00 0.00 44.72 43.63 2yst s GLY 7 CO 0.61 -0.89 0.62 -1.31 0.00 0.00 0.00 173.10 172.14 2yst s ASN 8 N -1.72 6.63 -0.54 1.64 -0.87 -1.26 -5.01 114.94 113.80 2yst s ASN 8 Ca -0.08 1.00 0.03 0.00 -1.57 0.00 0.00 52.86 52.25 2yst s ASN 8 Cb -0.09 -2.26 0.41 0.00 -0.02 0.00 0.00 41.25 39.29 2yst s ASN 8 CO 0.00 -0.16 1.46 0.47 -2.57 0.00 0.00 177.10 176.31 2yst n ASP 9 N -0.42 5.81 -1.79 -1.22 8.00 -1.26 -4.84 116.55 120.83 2yst n ASP 9 Ca 0.01 -3.76 -0.07 0.00 0.71 0.00 0.00 54.79 51.67 2yst n ASP 9 Cb 0.53 -0.65 -0.08 0.00 -0.02 0.00 0.00 41.12 40.90 2yst n ASP 9 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2yst n ASN 10 N -0.59 5.38 -4.32 -2.24 3.02 -1.26 -4.84 115.26 110.41 2yst n ASN 10 Ca 0.46 -2.49 -0.23 0.00 -0.03 0.00 0.00 54.58 52.29 2yst n ASN 10 Cb 0.61 -1.27 -0.12 0.00 -0.61 0.00 0.00 39.78 38.39 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 1.88 2.71 -0.18 6.41 0.01 -1.26 -5.10 113.70 118.16 2yst s SER 11 Ca 0.36 -0.78 -0.29 0.00 1.31 0.00 0.00 55.95 56.54 2yst s SER 11 Cb 0.18 -0.16 -0.03 0.00 0.21 0.00 0.00 66.02 66.22 2yst s SER 11 CO -0.01 0.03 1.59 -2.16 0.41 0.00 0.00 173.24 173.09 2yst s PRO 12 N -2.38 3.92 -0.07 12.44 0.04 -1.26 -5.00 135.00 142.68 2yst s PRO 12 Ca 0.12 1.76 0.02 0.00 0.04 0.00 0.00 61.00 62.95 2yst s PRO 12 Cb -0.08 -4.00 0.01 0.00 0.04 0.00 0.00 34.50 30.48 2yst s PRO 12 CO 0.06 -1.14 -0.13 0.50 0.04 0.00 0.00 177.00 176.32 2yst s ARG 13 N 4.43 1.78 0.79 4.56 6.06 -1.26 -4.28 118.95 131.03 2yst s ARG 13 Ca 0.70 -0.44 -0.12 0.00 -2.50 0.00 0.00 55.73 53.37 2yst s ARG 13 Cb -0.26 -1.46 0.07 0.00 0.06 0.00 0.00 34.95 33.36 2yst s ARG 13 CO 0.28 0.03 1.15 -0.06 -2.50 0.00 0.00 175.30 174.20 2yst s PHE 14 N 0.65 2.11 0.12 5.12 0.08 -1.26 -3.91 117.98 120.89 2yst s PHE 14 Ca -0.15 1.65 -0.16 0.00 0.12 0.00 0.00 56.93 58.39 2yst s PHE 14 Cb -0.16 -3.29 -0.02 0.00 -0.57 0.00 0.00 43.02 38.98 2yst s PHE 14 CO 0.04 -2.36 1.64 0.93 -0.10 0.00 0.00 175.22 175.36 2yst h GLU 15 N -0.98 0.59 -5.62 0.44 5.08 -1.61 -3.43 114.58 109.05 2yst h GLU 15 Ca -0.45 -0.13 -0.68 0.00 -1.00 0.00 0.00 59.36 57.10 2yst h GLU 15 Cb 1.26 -0.08 -0.31 0.00 0.50 0.00 0.00 28.75 30.12 2yst h GLU 15 CO 0.48 0.60 -0.87 0.15 -1.00 0.00 0.00 179.01 178.38 2yst s LYS 16 N -5.37 2.88 0.23 2.33 1.02 -1.26 -5.02 119.74 114.54 2yst s LYS 16 Ca -0.13 -0.86 -0.07 0.00 0.02 0.00 0.00 55.97 54.92 2yst s LYS 16 Cb 0.10 -2.29 0.29 0.00 -0.52 0.00 0.00 37.83 35.41 2yst s LYS 16 CO 0.76 0.27 1.83 0.77 -0.92 0.00 0.00 175.35 178.06 2yst h SER 17 N 6.42 0.70 -3.41 2.83 0.02 -1.93 -3.36 113.55 114.82 2yst h SER 17 Ca -0.25 0.02 -0.61 0.00 -0.84 0.00 0.00 61.79 60.11 2yst h SER 17 Cb 1.21 -0.12 -0.40 0.00 0.14 0.00 0.00 62.40 63.23 2yst h SER 17 CO 0.48 0.45 -0.74 -0.69 -1.14 0.00 0.00 176.83 175.19 2yst s VAL 18 N -6.08 1.37 -0.51 2.27 1.01 -1.26 -2.67 120.40 114.54 2yst s VAL 18 Ca -0.13 -2.01 -0.26 0.00 0.00 0.00 0.00 61.98 59.58 2yst s VAL 18 Cb 0.17 -2.00 -0.06 0.00 0.00 0.00 0.00 36.38 34.49 2yst s VAL 18 CO 0.78 -0.74 2.30 -0.31 0.00 0.00 0.00 175.10 177.13 2yst s TYR 19 N 1.01 1.19 -0.42 5.22 1.51 0.22 -4.82 117.35 121.27 2yst s TYR 19 Ca 0.13 1.40 -0.12 0.00 -1.01 0.00 0.00 57.07 57.47 2yst s TYR 19 Cb -0.20 -3.69 0.06 0.00 -0.11 0.00 0.00 41.96 38.02 2yst s TYR 19 CO -0.13 -2.51 0.29 -2.00 -1.11 0.00 0.00 175.55 170.08 2yst s GLU 20 N 8.00 2.81 0.33 -0.62 2.12 -1.26 -1.29 118.70 128.79 2yst s GLU 20 Ca 0.92 -1.27 0.08 0.00 0.36 0.00 0.00 54.97 55.05 2yst s GLU 20 Cb -0.16 -3.88 -0.06 0.00 0.26 0.00 0.00 34.13 30.28 2yst s GLU 20 CO 0.25 -0.88 -0.06 0.00 -0.54 0.00 0.00 175.26 174.04 2yst s ALA 21 N 1.55 2.74 -0.30 6.30 0.00 -0.87 -5.01 121.76 126.17 2yst s ALA 21 Ca 0.03 -2.06 -0.06 0.00 0.00 0.00 0.00 51.96 49.87 2yst s ALA 21 Cb -0.22 0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.04 2yst s ALA 21 CO 0.05 -0.03 0.07 0.16 0.00 0.00 0.00 175.76 176.01 2yst s ASP 22 N -3.56 5.06 -0.02 0.00 -4.77 -1.26 -2.65 116.67 109.46 2yst s ASP 22 Ca 0.32 -0.82 0.01 0.00 -3.30 0.00 0.00 52.55 48.77 2yst s ASP 22 Cb 0.04 -1.85 -0.03 0.00 -1.09 0.00 0.00 42.92 39.99 2yst s ASP 22 CO 0.15 -0.21 -0.02 -0.22 0.70 0.00 0.00 175.17 175.57 2yst s LEU 23 N 1.46 3.42 -0.29 2.11 1.98 -0.99 -4.97 118.68 121.40 2yst s LEU 23 Ca 0.01 -0.01 -0.21 0.00 -2.89 0.00 0.00 54.13 51.03 2yst s LEU 23 Cb -0.18 -1.90 -0.01 0.00 0.66 0.00 0.00 46.19 44.76 2yst s LEU 23 CO 0.02 0.31 0.67 0.00 -1.89 0.00 0.00 176.35 175.46 2yst s ALA 24 N -1.00 3.56 0.40 5.97 0.00 -1.26 -0.70 121.76 128.73 2yst s ALA 24 Ca 0.17 -0.52 0.24 0.00 0.00 0.00 0.00 51.96 51.85 2yst s ALA 24 Cb -0.11 -3.14 1.32 0.00 0.00 0.00 0.00 23.12 21.19 2yst s ALA 24 CO 0.07 -1.03 1.64 1.05 0.00 0.00 0.00 175.76 177.49 2yst h GLU 25 N 8.08 0.15 -1.93 0.00 4.11 -1.62 0.30 114.58 123.67 2yst h GLU 25 Ca -0.26 -0.01 -0.51 0.00 0.07 0.00 0.00 59.36 58.65 2yst h GLU 25 Cb 1.11 -0.03 -0.18 0.00 0.50 0.00 0.00 28.75 30.15 2yst h GLU 25 CO 0.82 0.10 0.46 -1.71 0.07 0.00 0.00 179.01 178.74 2yst n ASN 26 N -4.84 6.59 -4.59 3.06 5.15 -1.26 -3.82 115.26 115.54 2yst n ASN 26 Ca 0.35 -3.26 -0.39 0.00 -0.60 0.00 0.00 54.58 50.68 2yst n ASN 26 Cb 1.27 -1.19 -0.09 0.00 -0.53 0.00 0.00 39.78 39.23 2yst n ASN 26 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2yst s SER 27 N 0.16 6.20 1.02 1.20 0.01 0.11 -5.04 113.70 117.35 2yst s SER 27 Ca 0.56 0.15 -0.19 0.00 1.31 0.00 0.00 55.95 57.78 2yst s SER 27 Cb 0.38 -2.19 -0.05 0.00 0.21 0.00 0.00 66.02 64.37 2yst s SER 27 CO -0.21 -0.18 -0.45 0.00 0.41 0.00 0.00 173.24 172.81 2yst n ALA 28 N 5.29 -4.47 0.92 1.44 0.00 -1.26 -4.25 120.51 118.18 2yst n ALA 28 Ca -0.10 -0.97 0.00 0.00 0.00 0.00 0.00 53.44 52.38 2yst n ALA 28 Cb 0.51 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.62 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 0.25 0.49 0.00 0.00 -0.04 -1.26 -2.58 135.00 131.85 2yst n PRO 29 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 2yst n PRO 29 Cb 0.61 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 33.05 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 0.00 3.59 0.55 0.00 -1.11 -3.41 105.19 104.83 2yst n GLY 30 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.66 0.04 -1.34 2.61 -1.04 -1.07 -4.28 114.28 108.55 2yst n THR 31 Ca 0.00 -0.01 -0.31 0.00 -2.04 0.00 0.00 64.05 61.69 2yst n THR 31 Cb 0.05 -0.58 0.08 0.00 -1.82 0.00 0.00 70.33 68.07 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 0.96 2.34 0.03 -2.82 0.04 -1.26 -0.23 135.00 134.05 2yst s PRO 32 Ca 0.90 1.21 -0.01 0.00 0.04 0.00 0.00 61.00 63.14 2yst s PRO 32 Cb -1.12 -1.90 -0.00 0.00 0.04 0.00 0.00 34.50 31.51 2yst s PRO 32 CO 0.56 -1.59 -0.02 -0.89 0.04 0.00 0.00 177.00 175.10 2yst n ILE 33 N -3.35 0.50 -3.70 0.56 5.41 0.11 -4.76 119.36 114.13 2yst n ILE 33 Ca 0.09 0.18 -0.07 0.00 1.00 0.00 0.00 62.75 63.96 2yst n ILE 33 Cb 0.53 -1.30 -0.02 0.00 -0.71 0.00 0.00 39.64 38.14 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 -5.83 -0.31 -0.20 1.39 0.05 -0.94 -4.94 118.68 107.89 2yst s LEU 34 Ca -0.01 -0.36 -0.02 0.00 0.05 0.00 0.00 54.13 53.79 2yst s LEU 34 Cb 0.00 2.47 0.00 0.00 -2.05 0.00 0.00 46.19 46.62 2yst s LEU 34 CO 0.02 -1.07 -0.12 -1.58 -0.55 0.00 0.00 176.35 173.05 2yst s GLN 35 N -3.63 3.21 0.43 1.48 0.74 -1.26 -0.25 119.66 120.39 2yst s GLN 35 Ca 0.09 -0.72 -0.20 0.00 0.05 0.00 0.00 55.36 54.58 2yst s GLN 35 Cb -0.03 -2.80 -0.10 0.00 1.10 0.00 0.00 33.01 31.18 2yst s GLN 35 CO -0.00 -0.18 0.93 -0.51 -0.55 0.00 0.00 175.29 174.98 2yst s LEU 36 N 1.33 3.90 -0.24 3.68 1.43 0.58 -4.99 118.68 124.37 2yst s LEU 36 Ca 0.04 1.62 -0.17 0.00 -1.03 0.00 0.00 54.13 54.59 2yst s LEU 36 Cb -0.14 -4.48 0.07 0.00 0.03 0.00 0.00 46.19 41.67 2yst s LEU 36 CO -0.07 -0.38 0.62 -0.13 0.23 0.00 0.00 176.35 176.62 2yst s ARG 37 N -3.30 0.67 -0.62 1.70 0.52 -1.26 -4.74 118.95 111.92 2yst s ARG 37 Ca 0.61 1.00 0.01 0.00 -0.52 0.00 0.00 55.73 56.83 2yst s ARG 37 Cb -0.09 0.21 0.40 0.00 0.52 0.00 0.00 34.95 35.99 2yst s ARG 37 CO 0.16 -0.12 1.64 0.00 0.02 0.00 0.00 175.30 177.00 2yst n ALA 38 N 3.62 5.85 -1.79 2.13 0.00 -1.26 -1.69 120.51 127.36 2yst n ALA 38 Ca -0.18 -4.02 -0.41 0.00 0.00 0.00 0.00 53.44 48.83 2yst n ALA 38 Cb 0.57 -1.29 -0.01 0.00 0.00 0.00 0.00 19.45 18.72 2yst n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yst s ALA 39 N -3.81 3.63 -0.47 0.00 0.00 -1.25 -4.26 121.76 115.60 2yst s ALA 39 Ca 0.53 1.48 0.09 0.00 0.00 0.00 0.00 51.96 54.07 2yst s ALA 39 Cb 0.44 -3.59 -0.10 0.00 0.00 0.00 0.00 23.12 19.86 2yst s ALA 39 CO -0.21 -0.91 0.41 -0.40 0.00 0.00 0.00 175.76 174.65 2yst n ASP 40 N 1.43 0.48 -1.98 0.00 5.68 -1.26 -4.70 116.55 116.19 2yst n ASP 40 Ca 0.04 -0.74 -0.19 0.00 -0.50 0.00 0.00 54.79 53.41 2yst n ASP 40 Cb 0.39 0.98 -0.03 0.00 -1.14 0.00 0.00 41.12 41.33 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 -1.19 -1.74 -1.14 -2.12 4.77 -1.26 -4.86 117.00 109.46 2yst n LEU 41 Ca 0.02 0.10 0.06 0.00 -0.03 0.00 0.00 56.01 56.16 2yst n LEU 41 Cb 0.15 -2.68 0.24 0.00 -2.33 0.00 0.00 43.42 38.80 2yst n LEU 41 CO 0.19 -0.39 0.68 0.47 -1.33 0.00 0.00 177.39 177.01 2yst n ASP 42 N -1.46 3.32 -3.91 -1.43 8.00 -1.26 -4.92 116.55 114.88 2yst n ASP 42 Ca -0.21 -2.27 -0.26 0.00 0.71 0.00 0.00 54.79 52.75 2yst n ASP 42 Cb 0.66 -0.46 -0.00 0.00 -0.02 0.00 0.00 41.12 41.29 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 0.71 -3.11 0.15 2.53 0.31 -1.26 -4.76 118.33 112.91 2yst n VAL 43 Ca 0.17 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 2yst n VAL 43 Cb 0.62 -2.85 0.00 0.00 -0.91 0.00 0.00 33.84 30.70 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 -1.80 -1.30 3.04 2.92 0.00 -1.26 -5.12 105.19 101.66 2yst n GLY 44 Ca -0.24 0.26 -0.44 0.00 0.00 0.00 0.00 46.02 45.59 2yst n GLY 44 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2yst n VAL 45 N -3.19 1.44 -1.66 1.61 3.14 -1.26 -4.85 118.33 113.54 2yst n VAL 45 Ca 0.00 -0.36 -0.32 0.00 -2.96 0.00 0.00 64.34 60.70 2yst n VAL 45 Cb 0.00 0.00 0.05 0.00 -1.06 0.00 0.00 33.84 32.83 2yst n VAL 45 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 2yst n ASN 46 N 1.69 6.71 -4.27 6.55 4.13 -1.26 -4.92 115.26 123.89 2yst n ASN 46 Ca 0.16 -3.78 -0.30 0.00 1.68 0.00 0.00 54.58 52.34 2yst n ASN 46 Cb 0.19 -0.77 -0.09 0.00 -1.54 0.00 0.00 39.78 37.57 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 -0.79 -0.14 2.91 7.41 0.00 -1.26 -4.89 105.19 108.43 2yst n GLY 47 Ca 0.55 0.17 -0.28 0.00 0.00 0.00 0.00 46.02 46.46 2yst n GLY 47 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2yst s GLN 48 N -7.28 2.37 -0.08 1.61 -0.21 -1.26 -5.00 119.66 109.81 2yst s GLN 48 Ca 0.01 -3.21 0.01 0.00 0.02 0.00 0.00 55.36 52.18 2yst s GLN 48 Cb -0.01 -3.40 0.02 0.00 1.00 0.00 0.00 33.01 30.63 2yst s GLN 48 CO 0.99 -1.25 -0.08 0.42 -2.12 0.00 0.00 175.29 173.24 2yst s ILE 49 N -1.24 0.91 -0.58 1.08 -1.09 -1.26 -4.73 121.20 114.29 2yst s ILE 49 Ca 0.23 -0.29 -0.27 0.00 -2.23 0.00 0.00 60.65 58.09 2yst s ILE 49 Cb -0.08 -0.90 -0.00 0.00 -1.58 0.00 0.00 42.46 39.89 2yst s ILE 49 CO -0.14 0.32 1.63 -0.70 -1.23 0.00 0.00 174.94 174.82 2yst s GLU 50 N 1.19 3.02 -0.74 2.79 2.12 -1.04 -4.76 118.70 121.27 2yst s GLU 50 Ca -0.05 0.55 -0.22 0.00 0.36 0.00 0.00 54.97 55.60 2yst s GLU 50 Cb -0.14 -4.25 0.08 0.00 0.26 0.00 0.00 34.13 30.08 2yst s GLU 50 CO -0.02 -2.28 1.05 0.71 -0.54 0.00 0.00 175.26 174.19 2yst s TYR 51 N 7.35 2.73 0.41 5.30 2.02 -1.25 -2.32 117.35 131.58 2yst s TYR 51 Ca 0.59 -0.71 0.08 0.00 -0.37 0.00 0.00 57.07 56.66 2yst s TYR 51 Cb -0.13 -4.34 -0.01 0.00 -0.40 0.00 0.00 41.96 37.08 2yst s TYR 51 CO 0.23 -1.67 0.44 0.14 -1.57 0.00 0.00 175.55 173.12 2yst s VAL 52 N 3.96 2.82 -0.75 0.71 -7.23 -0.94 -4.01 120.40 114.96 2yst s VAL 52 Ca 0.27 -1.23 -0.26 0.00 -1.81 0.00 0.00 61.98 58.94 2yst s VAL 52 Cb -0.13 -3.01 0.02 0.00 0.56 0.00 0.00 36.38 33.82 2yst s VAL 52 CO 0.05 -0.01 1.41 -0.36 -0.31 0.00 0.00 175.10 175.88 2yst s PHE 53 N -2.42 2.19 0.00 2.82 0.08 -1.26 -1.30 117.98 118.09 2yst s PHE 53 Ca 0.50 0.02 0.00 0.00 0.12 0.00 0.00 56.93 57.57 2yst s PHE 53 Cb -0.05 -4.54 0.00 0.00 -0.57 0.00 0.00 43.02 37.86 2yst s PHE 53 CO 0.29 -2.09 0.00 0.41 -0.10 0.00 0.00 175.22 173.73 2yst n GLY 54 N 5.62 -1.00 3.25 4.36 0.00 -0.73 -4.58 105.19 112.11 2yst n GLY 54 Ca 0.10 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 4.22 -2.50 4.61 0.00 -1.24 -4.89 120.51 117.70 2yst n ALA 55 Ca 0.00 -3.81 -0.25 0.00 0.00 0.00 0.00 53.44 49.38 2yst n ALA 55 Cb 0.00 -3.58 -0.08 0.00 0.00 0.00 0.00 19.45 15.79 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 4.15 2.87 0.15 0.00 0.00 -1.26 -2.70 121.76 124.96 2yst s ALA 56 Ca 0.52 -1.28 0.09 0.00 0.00 0.00 0.00 51.96 51.29 2yst s ALA 56 Cb 0.08 0.78 -0.04 0.00 0.00 0.00 0.00 23.12 23.94 2yst s ALA 56 CO 0.02 -0.35 -0.16 -0.08 0.00 0.00 0.00 175.76 175.18 2yst s THR 57 N -3.22 2.86 0.16 0.00 -1.32 -1.26 -5.03 115.64 107.83 2yst s THR 57 Ca 0.25 -1.65 -0.26 0.00 -1.21 0.00 0.00 61.69 58.81 2yst s THR 57 Cb 0.03 -2.36 0.02 0.00 -1.51 0.00 0.00 72.50 68.68 2yst s THR 57 CO 0.15 -0.01 1.57 -0.08 -2.21 0.00 0.00 174.62 174.04 2yst h GLU 58 N 3.37 -0.23 -0.98 7.08 4.81 -2.01 0.19 114.58 126.80 2yst h GLU 58 Ca -0.48 0.02 0.33 0.00 -0.13 0.00 0.00 59.36 59.09 2yst h GLU 58 Cb 1.19 0.05 -0.17 0.00 0.63 0.00 0.00 28.75 30.45 2yst h GLU 58 CO 0.49 -0.16 0.33 0.66 -0.73 0.00 0.00 179.01 179.61 2yst h SER 59 N -0.24 0.04 0.41 1.04 4.64 -1.98 1.65 113.55 119.11 2yst h SER 59 Ca 0.17 0.25 -0.13 0.00 -0.47 0.00 0.00 61.79 61.60 2yst h SER 59 Cb 0.56 0.32 -0.01 0.00 -0.31 0.00 0.00 62.40 62.96 2yst h SER 59 CO -0.68 -0.33 -0.57 0.58 -0.87 0.00 0.00 176.83 174.96 2yst h VAL 60 N 0.08 1.39 -0.09 0.95 2.07 -1.05 0.32 116.25 119.92 2yst h VAL 60 Ca 0.71 -1.93 -0.07 0.00 0.82 0.00 0.00 66.70 66.23 2yst h VAL 60 Cb 1.67 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 33.43 2yst h VAL 60 CO -0.78 0.56 -0.22 0.03 0.02 0.00 0.00 177.57 177.18 2yst h ARG 61 N 0.13 0.31 0.00 1.57 3.08 0.33 0.33 114.38 120.12 2yst h ARG 61 Ca -0.00 -0.21 -0.13 0.00 0.07 0.00 0.00 59.98 59.70 2yst h ARG 61 Cb 1.05 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.11 2yst h ARG 61 CO 0.08 0.82 -0.64 0.07 -1.07 0.00 0.00 179.97 179.24 2yst h ARG 62 N -0.16 0.00 0.15 0.04 0.11 -0.59 -3.22 114.38 110.71 2yst h ARG 62 Ca -0.00 0.00 -0.31 0.00 0.10 0.00 0.00 59.98 59.77 2yst h ARG 62 Cb 0.83 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.92 2yst h ARG 62 CO 0.05 0.64 -1.45 1.25 0.10 0.00 0.00 179.97 180.55 2yst h LEU 63 N 0.00 0.50 -8.25 0.08 5.85 -0.94 -3.36 115.31 109.19 2yst h LEU 63 Ca -0.01 -0.61 -0.61 0.00 0.84 0.00 0.00 57.88 57.49 2yst h LEU 63 Cb 1.20 -0.16 -0.32 0.00 0.37 0.00 0.00 40.66 41.74 2yst h LEU 63 CO 0.08 1.50 -0.85 -0.76 -0.34 0.00 0.00 178.44 178.07 2yst s LEU 64 N -7.17 1.94 -0.19 2.25 1.43 0.11 -0.78 118.68 116.28 2yst s LEU 64 Ca -0.08 -0.44 -0.08 0.00 -1.03 0.00 0.00 54.13 52.50 2yst s LEU 64 Cb 0.06 -1.16 -0.04 0.00 0.03 0.00 0.00 46.19 45.08 2yst s LEU 64 CO 0.88 0.14 0.08 -0.60 0.23 0.00 0.00 176.35 177.08 2yst s ARG 65 N 0.27 4.00 -0.05 1.70 3.52 -0.51 -4.22 118.95 123.66 2yst s ARG 65 Ca -0.12 -0.33 0.06 0.00 -0.13 0.00 0.00 55.73 55.21 2yst s ARG 65 Cb -0.15 -3.26 -0.01 0.00 -1.56 0.00 0.00 34.95 29.97 2yst s ARG 65 CO 0.05 0.26 -0.24 -1.17 -0.81 0.00 0.00 175.30 173.39 2yst s LEU 66 N 0.43 2.05 0.38 -0.88 2.96 -1.26 -1.66 118.68 120.70 2yst s LEU 66 Ca 0.04 -0.49 0.05 0.00 -0.22 0.00 0.00 54.13 53.52 2yst s LEU 66 Cb -0.12 -1.32 -0.00 0.00 0.50 0.00 0.00 46.19 45.25 2yst s LEU 66 CO 0.00 0.24 0.53 -1.81 -1.32 0.00 0.00 176.35 173.99 2yst s ASP 67 N -0.18 5.87 0.00 3.68 1.01 -1.25 -4.97 116.67 120.83 2yst s ASP 67 Ca -0.02 -0.14 0.00 0.00 0.71 0.00 0.00 52.55 53.10 2yst s ASP 67 Cb -0.13 -1.18 0.00 0.00 1.01 0.00 0.00 42.92 42.62 2yst s ASP 67 CO 0.03 -0.56 0.00 -1.84 0.21 0.00 0.00 175.17 173.01 2yst n GLU 68 N -1.78 2.31 0.25 8.23 0.00 -1.26 -3.96 120.64 124.43 2yst n GLU 68 Ca 0.02 0.00 0.13 0.00 0.00 0.00 0.00 57.16 57.31 2yst n GLU 68 Cb 0.58 -0.81 0.62 0.00 0.00 0.00 0.00 31.44 31.83 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 0.41 0.00 3.84 1.03 -1.92 -3.35 112.91 112.92 2yst h THR 69 Ca 0.00 -0.78 0.00 0.00 -0.01 0.00 0.00 66.41 65.62 2yst h THR 69 Cb 0.61 1.56 0.00 0.00 -1.07 0.00 0.00 68.15 69.26 2yst h THR 69 CO 0.00 0.13 -0.61 -1.54 -0.01 0.00 0.00 175.52 173.50 2yst n SER 70 N -3.37 1.52 -0.13 0.00 3.41 -1.26 -4.97 113.62 108.81 2yst n SER 70 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2yst n SER 70 Cb 0.34 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 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 2.60 0.95 3.14 5.00 0.00 -1.25 -4.86 105.19 110.77 2yst n GLY 71 Ca 0.00 -0.16 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.19 3.50 0.05 1.61 0.52 -1.26 -0.31 118.94 120.86 2yst s TRP 72 Ca 0.00 -2.22 -0.27 0.00 0.02 0.00 0.00 56.10 53.62 2yst s TRP 72 Cb 0.00 -2.91 -0.05 0.00 -1.15 0.00 0.00 33.47 29.36 2yst s TRP 72 CO 0.00 -0.92 0.86 -1.17 0.02 0.00 0.00 176.95 175.74 2yst s LEU 73 N 1.18 4.44 0.25 2.99 0.20 0.66 -3.81 118.68 124.60 2yst s LEU 73 Ca 0.05 1.57 -0.05 0.00 0.69 0.00 0.00 54.13 56.39 2yst s LEU 73 Cb -0.22 -3.39 -0.02 0.00 -0.43 0.00 0.00 46.19 42.13 2yst s LEU 73 CO -0.03 -0.07 0.33 -0.94 -0.29 0.00 0.00 176.35 175.35 2yst s SER 74 N 0.22 0.32 0.31 3.68 1.04 -0.66 0.05 113.70 118.66 2yst s SER 74 Ca 0.43 -1.27 -0.27 0.00 0.48 0.00 0.00 55.95 55.32 2yst s SER 74 Cb -0.21 0.52 -0.09 0.00 0.10 0.00 0.00 66.02 66.33 2yst s SER 74 CO 0.26 -1.05 1.03 -0.69 0.98 0.00 0.00 173.24 173.77 2yst s VAL 75 N -3.85 3.76 -0.18 5.02 1.01 0.68 -1.42 120.40 125.43 2yst s VAL 75 Ca 0.32 1.60 -0.02 0.00 0.00 0.00 0.00 61.98 63.87 2yst s VAL 75 Cb 0.03 -3.95 -0.10 0.00 0.00 0.00 0.00 36.38 32.36 2yst s VAL 75 CO 0.14 0.25 -0.18 -0.11 0.00 0.00 0.00 175.10 175.20 2yst n LEU 76 N 0.79 2.37 -4.24 3.92 7.94 0.04 -2.76 117.00 125.06 2yst n LEU 76 Ca 0.01 0.02 -0.15 0.00 -1.11 0.00 0.00 56.01 54.78 2yst n LEU 76 Cb 0.47 -0.58 -0.10 0.00 0.53 0.00 0.00 43.42 43.74 2yst n LEU 76 CO 0.49 0.64 -0.42 -1.00 -1.11 0.00 0.00 177.39 175.99 2yst s HIS 77 N -2.34 1.28 0.36 1.96 3.76 -0.66 -4.54 115.29 115.11 2yst s HIS 77 Ca -0.24 -0.69 -0.24 0.00 -0.15 0.00 0.00 55.06 53.74 2yst s HIS 77 Cb 0.07 -0.66 -0.14 0.00 1.11 0.00 0.00 32.58 32.97 2yst s HIS 77 CO 0.37 0.10 0.60 0.54 -0.85 0.00 0.00 174.74 175.50 2yst n ARG 78 N 0.05 0.59 -5.16 1.40 1.74 -1.26 -4.64 116.66 109.38 2yst n ARG 78 Ca -0.12 0.21 -0.31 0.00 -0.77 0.00 0.00 57.85 56.86 2yst n ARG 78 Cb 0.59 -1.46 -0.15 0.00 -1.02 0.00 0.00 32.46 30.43 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 -1.33 2.32 0.06 0.55 1.01 -1.25 -5.05 121.20 117.51 2yst s ILE 79 Ca 0.62 -1.04 0.08 0.00 0.00 0.00 0.00 60.65 60.31 2yst s ILE 79 Cb -0.68 -1.84 -0.03 0.00 0.01 0.00 0.00 42.46 39.92 2yst s ILE 79 CO 0.58 0.56 -0.23 -0.62 0.00 0.00 0.00 174.94 175.24 2yst s ASP 80 N -0.71 2.72 -0.08 3.58 -1.08 -1.26 -4.31 116.67 115.54 2yst s ASP 80 Ca 0.11 -0.59 -0.22 0.00 -0.52 0.00 0.00 52.55 51.32 2yst s ASP 80 Cb -0.10 -0.21 -0.30 0.00 -1.46 0.00 0.00 42.92 40.85 2yst s ASP 80 CO -0.00 0.16 0.81 -0.09 0.52 0.00 0.00 175.17 176.57 2yst h ARG 81 N 4.60 0.23 -0.34 4.34 2.43 -1.87 -3.15 114.38 120.62 2yst h ARG 81 Ca -0.45 -0.40 0.07 0.00 -0.81 0.00 0.00 59.98 58.39 2yst h ARG 81 Cb 1.16 0.15 -0.07 0.00 -0.42 0.00 0.00 29.97 30.79 2yst h ARG 81 CO 0.42 1.19 -0.09 0.93 -1.51 0.00 0.00 179.97 180.92 2yst h GLU 82 N -0.49 -0.00 -0.85 0.20 4.39 -1.98 -1.18 114.58 114.67 2yst h GLU 82 Ca -0.15 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.56 2yst h GLU 82 Cb 1.54 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 30.15 2yst h GLU 82 CO 0.10 -0.00 0.56 1.05 -1.16 0.00 0.00 179.01 179.56 2yst h GLU 83 N -0.00 1.11 -3.20 2.33 4.11 -2.01 -3.42 114.58 113.50 2yst h GLU 83 Ca 0.16 -0.07 -0.24 0.00 0.07 0.00 0.00 59.36 59.29 2yst h GLU 83 Cb 0.25 -0.25 -0.31 0.00 0.50 0.00 0.00 28.75 28.94 2yst h GLU 83 CO -0.35 0.73 -0.58 0.14 0.07 0.00 0.00 179.01 179.03 2yst s VAL 84 N -5.95 -0.05 -0.00 -1.06 -7.23 -0.45 -5.03 120.40 100.62 2yst s VAL 84 Ca -0.12 0.18 0.03 0.00 -1.81 0.00 0.00 61.98 60.26 2yst s VAL 84 Cb 0.18 -0.27 -0.25 0.00 0.56 0.00 0.00 36.38 36.60 2yst s VAL 84 CO 0.80 0.07 0.82 -0.55 -0.31 0.00 0.00 175.10 175.93 2yst h ASN 85 N 7.27 0.21 -1.42 4.85 -1.07 -1.80 -3.36 115.58 120.26 2yst h ASN 85 Ca -0.42 -0.32 0.10 0.00 0.07 0.00 0.00 56.30 55.73 2yst h ASN 85 Cb 1.14 -0.07 -0.21 0.00 -2.07 0.00 0.00 38.32 37.12 2yst h ASN 85 CO 0.41 1.27 -0.16 -1.58 0.07 0.00 0.00 177.43 177.44 2yst s GLN 86 N -2.62 0.54 0.65 4.14 0.74 -1.26 -3.46 119.66 118.39 2yst s GLN 86 Ca -0.07 1.17 -0.11 0.00 0.05 0.00 0.00 55.36 56.39 2yst s GLN 86 Cb 0.08 0.68 -0.02 0.00 1.10 0.00 0.00 33.01 34.85 2yst s GLN 86 CO 0.83 -0.38 1.04 -0.51 -0.55 0.00 0.00 175.29 175.72 2yst s LEU 87 N 2.86 3.21 -0.24 3.68 1.43 -1.20 -4.99 118.68 123.44 2yst s LEU 87 Ca 0.07 1.53 -0.09 0.00 -1.03 0.00 0.00 54.13 54.61 2yst s LEU 87 Cb -0.13 -4.49 0.10 0.00 0.03 0.00 0.00 46.19 41.71 2yst s LEU 87 CO -0.19 -1.15 0.51 -0.60 0.23 0.00 0.00 176.35 175.15 2yst s ARG 88 N -5.04 0.44 0.29 1.70 3.00 -1.26 -3.26 118.95 114.82 2yst s ARG 88 Ca 0.57 1.17 -0.05 0.00 -1.00 0.00 0.00 55.73 56.42 2yst s ARG 88 Cb -0.13 0.47 -0.01 0.00 0.00 0.00 0.00 34.95 35.29 2yst s ARG 88 CO 0.53 -0.22 0.40 -0.59 0.00 0.00 0.00 175.30 175.42 2yst s PHE 89 N 2.54 0.90 0.10 5.12 -0.12 -1.19 -4.91 117.98 120.43 2yst s PHE 89 Ca -0.04 -1.16 0.07 0.00 -0.05 0.00 0.00 56.93 55.76 2yst s PHE 89 Cb -0.11 -0.12 -0.03 0.00 -0.63 0.00 0.00 43.02 42.12 2yst s PHE 89 CO -0.15 -0.98 -0.19 0.99 -0.05 0.00 0.00 175.22 174.83 2yst s THR 90 N -3.58 1.58 -0.04 -4.49 2.01 -1.10 -0.51 115.64 109.52 2yst s THR 90 Ca 0.30 -1.53 0.04 0.00 0.31 0.00 0.00 61.69 60.81 2yst s THR 90 Cb 0.01 -1.48 -0.00 0.00 0.01 0.00 0.00 72.50 71.04 2yst s THR 90 CO 0.16 -0.13 -0.16 0.68 -0.69 0.00 0.00 174.62 174.47 2yst s VAL 91 N -1.30 1.36 0.17 3.82 -7.23 -0.21 -1.77 120.40 115.23 2yst s VAL 91 Ca 0.06 -0.68 0.01 0.00 -1.81 0.00 0.00 61.98 59.56 2yst s VAL 91 Cb -0.09 -1.17 -0.04 0.00 0.56 0.00 0.00 36.38 35.64 2yst s VAL 91 CO 0.04 0.39 0.33 -0.04 -0.31 0.00 0.00 175.10 175.51 2yst s MET 92 N 0.02 3.47 -0.37 4.82 -1.94 -0.42 -0.18 119.30 124.71 2yst s MET 92 Ca -0.03 -0.49 0.01 0.00 -1.71 0.00 0.00 55.69 53.47 2yst s MET 92 Cb -0.11 -2.91 0.11 0.00 2.01 0.00 0.00 34.83 33.93 2yst s MET 92 CO 0.02 0.47 0.14 0.00 -0.01 0.00 0.00 175.02 175.64 2yst s ALA 93 N -1.80 2.07 0.34 3.03 0.00 -1.26 -2.22 121.76 121.93 2yst s ALA 93 Ca 0.36 -2.20 -0.21 0.00 0.00 0.00 0.00 51.96 49.91 2yst s ALA 93 Cb -0.11 -1.80 -0.10 0.00 0.00 0.00 0.00 23.12 21.11 2yst s ALA 93 CO 0.29 -1.81 0.87 1.03 0.00 0.00 0.00 175.76 176.14 2yst s ARG 94 N 1.00 4.30 0.40 0.00 0.52 -0.98 -3.47 118.95 120.72 2yst s ARG 94 Ca 0.13 1.06 0.08 0.00 -0.52 0.00 0.00 55.73 56.48 2yst s ARG 94 Cb -0.20 -2.53 -0.06 0.00 0.52 0.00 0.00 34.95 32.67 2yst s ARG 94 CO -0.13 0.17 0.08 0.34 0.02 0.00 0.00 175.30 175.78 2yst s ASP 95 N -1.94 4.14 -1.04 0.23 2.15 -1.14 -2.51 116.67 116.58 2yst s ASP 95 Ca 0.54 -1.19 -0.24 0.00 0.43 0.00 0.00 52.55 52.09 2yst s ASP 95 Cb -0.13 -0.45 -0.08 0.00 -0.30 0.00 0.00 42.92 41.95 2yst s ASP 95 CO 0.18 -0.45 1.98 -0.13 -0.17 0.00 0.00 175.17 176.59 2yst s ARG 96 N -3.79 2.38 -0.06 4.34 0.52 -1.26 -4.59 118.95 116.49 2yst s ARG 96 Ca 0.37 -0.65 -0.32 0.00 -0.52 0.00 0.00 55.73 54.62 2yst s ARG 96 Cb 0.06 -5.12 0.13 0.00 0.52 0.00 0.00 34.95 30.54 2yst s ARG 96 CO 0.20 -3.86 1.38 0.20 0.02 0.00 0.00 175.30 173.24 2yst s GLY 97 N 7.54 -0.45 -0.10 -3.53 0.00 -1.26 -5.07 107.32 104.46 2yst s GLY 97 Ca 0.71 0.81 -0.04 0.00 0.00 0.00 0.00 44.72 46.20 2yst s GLY 97 CO 0.07 0.55 0.19 -0.86 0.00 0.00 0.00 173.10 173.06 2yst s GLN 98 N -2.17 0.07 0.36 2.90 0.00 -1.26 -1.79 119.66 117.76 2yst s GLN 98 Ca 0.16 0.60 -0.27 0.00 -0.00 0.00 0.00 55.36 55.85 2yst s GLN 98 Cb 0.06 -0.25 -0.09 0.00 0.00 0.00 0.00 33.01 32.73 2yst s GLN 98 CO -0.05 -0.31 1.20 -1.25 0.00 0.00 0.00 175.29 174.88 2yst s PRO 99 N 2.33 4.22 -0.29 9.60 0.04 -1.26 -5.09 135.00 144.55 2yst s PRO 99 Ca 0.03 1.96 -0.29 0.00 0.04 0.00 0.00 61.00 62.74 2yst s PRO 99 Cb -0.12 -2.87 -0.02 0.00 0.04 0.00 0.00 34.50 31.54 2yst s PRO 99 CO -0.07 -0.21 1.66 -1.25 0.04 0.00 0.00 177.00 177.17 2yst s PRO 100 N -2.03 3.58 0.27 0.56 0.04 -0.74 -4.96 135.00 131.72 2yst s PRO 100 Ca 0.53 1.46 -0.30 0.00 0.04 0.00 0.00 61.00 62.73 2yst s PRO 100 Cb -0.34 -4.10 -0.11 0.00 0.04 0.00 0.00 34.50 29.99 2yst s PRO 100 CO 0.43 -1.56 1.61 0.21 0.04 0.00 0.00 177.00 177.74 2yst s LYS 101 N 5.11 4.13 -0.05 4.56 2.47 -1.26 -4.67 119.74 130.03 2yst s LYS 101 Ca 0.73 2.57 0.05 0.00 -1.56 0.00 0.00 55.97 57.76 2yst s LYS 101 Cb -0.22 -3.04 -0.01 0.00 -1.46 0.00 0.00 37.83 33.10 2yst s LYS 101 CO 0.32 -0.65 -0.19 0.95 0.16 0.00 0.00 175.35 175.93 2yst s THR 102 N 0.23 1.60 -0.71 3.43 -4.23 -1.25 -2.87 115.64 111.85 2yst s THR 102 Ca 0.65 -0.81 0.04 0.00 -1.18 0.00 0.00 61.69 60.39 2yst s THR 102 Cb -0.48 -1.37 0.17 0.00 1.34 0.00 0.00 72.50 72.16 2yst s THR 102 CO 0.45 0.46 0.50 -0.62 -0.54 0.00 0.00 174.62 174.86 2yst s ASP 103 N -0.02 4.92 0.44 3.99 2.15 -1.23 -4.83 116.67 122.10 2yst s ASP 103 Ca -0.04 -3.72 -0.21 0.00 0.43 0.00 0.00 52.55 49.01 2yst s ASP 103 Cb -0.12 -1.68 -0.14 0.00 -0.30 0.00 0.00 42.92 40.68 2yst s ASP 103 CO 0.03 -0.12 0.24 0.29 -0.17 0.00 0.00 175.17 175.43 2yst n LYS 104 N 2.18 0.21 -3.69 4.34 5.02 -1.26 -4.19 118.16 120.77 2yst n LYS 104 Ca 0.18 0.08 -0.15 0.00 -2.02 0.00 0.00 58.31 56.40 2yst n LYS 104 Cb 0.35 -1.22 -0.14 0.00 -0.02 0.00 0.00 35.03 34.00 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 -1.66 -0.34 0.23 7.82 0.00 0.75 -4.92 121.76 123.65 2yst s ALA 105 Ca 0.61 0.74 -0.30 0.00 0.00 0.00 0.00 51.96 53.01 2yst s ALA 105 Cb -0.59 -0.75 -0.09 0.00 0.00 0.00 0.00 23.12 21.69 2yst s ALA 105 CO 0.61 -0.43 1.28 0.99 0.00 0.00 0.00 175.76 178.21 2yst s THR 106 N 1.89 3.16 -0.33 0.00 2.01 -1.09 -1.04 115.64 120.24 2yst s THR 106 Ca -0.02 1.02 0.01 0.00 0.31 0.00 0.00 61.69 63.01 2yst s THR 106 Cb -0.12 -3.65 0.10 0.00 0.01 0.00 0.00 72.50 68.85 2yst s THR 106 CO -0.07 0.18 0.09 -0.69 -0.69 0.00 0.00 174.62 173.45 2yst s VAL 107 N -0.29 1.46 -0.26 3.82 1.01 0.34 0.71 120.40 127.19 2yst s VAL 107 Ca 0.53 -1.87 -0.17 0.00 0.00 0.00 0.00 61.98 60.48 2yst s VAL 107 Cb -0.36 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 2yst s VAL 107 CO 0.41 -0.67 0.47 -0.69 0.00 0.00 0.00 175.10 174.63 2yst s VAL 108 N 1.22 5.10 -0.33 2.92 1.01 -0.41 -3.14 120.40 126.78 2yst s VAL 108 Ca 0.11 0.79 -0.01 0.00 0.00 0.00 0.00 61.98 62.87 2yst s VAL 108 Cb -0.19 -3.79 0.07 0.00 0.00 0.00 0.00 36.38 32.47 2yst s VAL 108 CO -0.17 0.11 0.05 -0.76 0.00 0.00 0.00 175.10 174.34 2yst s LEU 109 N 2.19 4.28 0.02 3.92 1.43 -1.20 -2.05 118.68 127.25 2yst s LEU 109 Ca 0.20 -1.52 -0.30 0.00 -1.03 0.00 0.00 54.13 51.47 2yst s LEU 109 Cb -0.16 -1.73 -0.05 0.00 0.03 0.00 0.00 46.19 44.28 2yst s LEU 109 CO 0.09 -0.34 1.24 0.20 0.23 0.00 0.00 176.35 177.77 2yst s ASN 110 N 1.36 7.03 -0.84 2.29 0.01 -1.08 -3.21 114.94 120.50 2yst s ASN 110 Ca -0.01 1.98 -0.25 0.00 -0.71 0.00 0.00 52.86 53.87 2yst s ASN 110 Cb -0.20 -2.57 0.01 0.00 0.41 0.00 0.00 41.25 38.90 2yst s ASN 110 CO -0.02 -0.55 1.55 -0.63 -1.51 0.00 0.00 177.10 175.94 2yst s ILE 111 N 1.63 3.67 0.54 0.60 -1.09 -1.22 -2.34 121.20 122.99 2yst s ILE 111 Ca 0.59 -0.14 -0.12 0.00 -2.23 0.00 0.00 60.65 58.75 2yst s ILE 111 Cb -0.29 -4.64 -0.05 0.00 -1.58 0.00 0.00 42.46 35.90 2yst s ILE 111 CO 0.27 -1.56 0.95 -0.54 -1.23 0.00 0.00 174.94 172.82 2yst s LYS 112 N 5.94 3.72 -0.26 2.79 -0.14 0.12 -4.81 119.74 127.10 2yst s LYS 112 Ca 0.50 0.70 -0.09 0.00 -1.36 0.00 0.00 55.97 55.72 2yst s LYS 112 Cb -0.06 -2.18 -0.04 0.00 -1.68 0.00 0.00 37.83 33.87 2yst s LYS 112 CO 0.05 -0.36 0.13 0.34 -0.76 0.00 0.00 175.35 174.75 2yst s ASP 113 N -3.69 5.58 0.28 2.83 -1.08 -1.26 -1.63 116.67 117.70 2yst s ASP 113 Ca 0.55 -0.10 0.00 0.00 -0.52 0.00 0.00 52.55 52.48 2yst s ASP 113 Cb -0.10 -2.02 0.40 0.00 -1.46 0.00 0.00 42.92 39.74 2yst s ASP 113 CO 0.43 -0.04 1.78 1.05 0.52 0.00 0.00 175.17 178.91 2yst h GLU 114 N 8.26 0.68 0.05 4.34 -0.00 -1.97 -3.32 114.58 122.62 2yst h GLU 114 Ca -0.37 -0.19 -0.00 0.00 -0.00 0.00 0.00 59.36 58.80 2yst h GLU 114 Cb 1.18 -0.08 0.00 0.00 -0.00 0.00 0.00 28.75 29.86 2yst h GLU 114 CO 0.57 0.73 -0.03 -0.97 -0.00 0.00 0.00 179.01 179.31 2yst h ASN 115 N 0.63 -0.06 -1.85 3.06 -0.73 -2.03 -3.47 115.58 111.14 2yst h ASN 115 Ca 0.12 0.00 -0.26 0.00 1.87 0.00 0.00 56.30 58.04 2yst h ASN 115 Cb 0.47 0.02 0.14 0.00 0.27 0.00 0.00 38.32 39.21 2yst h ASN 115 CO 0.02 0.15 -0.56 -0.67 -0.37 0.00 0.00 177.43 176.00 2yst n ASP 116 N -3.25 -2.83 0.03 1.15 -0.08 -1.25 -5.01 116.55 105.32 2yst n ASP 116 Ca -0.01 -0.29 0.00 0.00 -1.51 0.00 0.00 54.79 52.98 2yst n ASP 116 Cb 0.03 -0.75 0.00 0.00 2.34 0.00 0.00 41.12 42.74 2yst n ASP 116 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 2yst n ASN 117 N -0.58 0.41 -4.08 1.67 2.85 -1.26 -4.88 115.26 109.39 2yst n ASN 117 Ca 0.04 0.10 -0.35 0.00 -0.11 0.00 0.00 54.58 54.26 2yst n ASN 117 Cb 0.39 -0.09 -0.12 0.00 1.24 0.00 0.00 39.78 41.21 2yst n ASN 117 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2yst s VAL 118 N -2.00 3.22 -2.00 3.44 0.11 -1.26 -5.03 120.40 116.87 2yst s VAL 118 Ca 0.00 -2.54 0.16 0.00 -2.93 0.00 0.00 61.98 56.66 2yst s VAL 118 Cb 0.00 -3.19 0.44 0.00 -1.53 0.00 0.00 36.38 32.11 2yst s VAL 118 CO 0.00 -0.75 1.34 -0.81 -3.33 0.00 0.00 175.10 171.55