#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 6.25 0.22 1.61 1.04 -1.26 -4.98 113.70 116.58 2yst s SER 2 Ca 0.00 -0.81 -0.30 0.00 0.48 0.00 0.00 55.95 55.31 2yst s SER 2 Cb 0.00 -2.53 -0.15 0.00 0.10 0.00 0.00 66.02 63.44 2yst s SER 2 CO 0.00 -1.67 1.00 -1.54 0.98 0.00 0.00 173.24 172.02 2yst n SER 3 N 8.83 0.94 0.00 7.02 3.41 -1.26 -4.96 113.62 127.60 2yst n SER 3 Ca 0.08 1.16 0.00 0.00 -0.26 0.00 0.00 58.87 59.85 2yst n SER 3 Cb 0.49 -1.21 0.00 0.00 -0.26 0.00 0.00 64.21 63.23 2yst n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yst n GLY 4 N 1.65 2.75 2.66 5.00 0.00 -1.26 -4.99 105.19 110.99 2yst n GLY 4 Ca 0.13 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.83 2yst n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yst n SER 5 N 0.00 -3.43 -3.93 1.61 2.88 -1.26 -5.03 113.62 104.46 2yst n SER 5 Ca 0.00 -0.36 -0.25 0.00 -1.33 0.00 0.00 58.87 56.93 2yst n SER 5 Cb 0.00 -3.34 -0.17 0.00 -0.75 0.00 0.00 64.21 59.95 2yst n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yst s SER 6 N -3.51 1.94 0.36 -3.46 0.15 -1.26 -5.07 113.70 102.85 2yst s SER 6 Ca 0.19 -0.28 0.00 0.00 0.70 0.00 0.00 55.95 56.56 2yst s SER 6 Cb -0.08 -0.79 0.00 0.00 -1.71 0.00 0.00 66.02 63.44 2yst s SER 6 CO 0.45 -0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.43 2yst n GLY 7 N 4.54 -3.59 3.22 9.45 0.00 -1.26 -4.99 105.19 112.57 2yst n GLY 7 Ca -0.16 -1.02 -0.29 0.00 0.00 0.00 0.00 46.02 44.54 2yst n GLY 7 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2yst s ASN 8 N -4.41 2.71 0.28 1.61 3.84 -1.26 -5.14 114.94 112.57 2yst s ASN 8 Ca 0.00 -0.44 0.06 0.00 0.21 0.00 0.00 52.86 52.68 2yst s ASN 8 Cb 0.00 -0.67 -0.02 0.00 -0.55 0.00 0.00 41.25 40.01 2yst s ASN 8 CO 0.00 0.22 0.40 -1.81 -2.79 0.00 0.00 177.10 173.12 2yst s ASP 9 N -0.17 6.13 -0.89 -4.21 1.11 -1.26 -5.06 116.67 112.33 2yst s ASP 9 Ca -0.01 -0.06 -0.00 0.00 0.18 0.00 0.00 52.55 52.66 2yst s ASP 9 Cb -0.12 -1.57 0.26 0.00 1.07 0.00 0.00 42.92 42.56 2yst s ASP 9 CO 0.02 -0.22 1.01 -0.46 1.18 0.00 0.00 175.17 176.70 2yst n ASN 10 N -1.50 4.83 -4.38 0.27 0.23 -1.26 -5.04 115.26 108.41 2yst n ASN 10 Ca -0.05 -3.32 -0.27 0.00 -0.53 0.00 0.00 54.58 50.41 2yst n ASN 10 Cb 0.58 -1.01 -0.12 0.00 -2.08 0.00 0.00 39.78 37.14 2yst n ASN 10 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 2yst s SER 11 N -1.35 3.22 -0.73 0.53 0.01 -1.26 -5.04 113.70 109.07 2yst s SER 11 Ca 0.33 -0.79 -0.26 0.00 1.31 0.00 0.00 55.95 56.54 2yst s SER 11 Cb 0.03 -0.22 -0.03 0.00 0.21 0.00 0.00 66.02 66.02 2yst s SER 11 CO -0.02 0.13 1.89 -2.16 0.41 0.00 0.00 173.24 173.50 2yst s PRO 12 N -2.29 2.60 0.02 12.44 0.04 -1.26 -4.97 135.00 141.58 2yst s PRO 12 Ca 0.15 0.25 0.01 0.00 0.04 0.00 0.00 61.00 61.45 2yst s PRO 12 Cb -0.09 -4.65 -0.04 0.00 0.04 0.00 0.00 34.50 29.76 2yst s PRO 12 CO 0.07 -2.98 0.09 1.03 0.04 0.00 0.00 177.00 175.25 2yst s ARG 13 N 7.02 3.04 0.51 4.56 1.81 -1.26 -4.38 118.95 130.25 2yst s ARG 13 Ca 0.68 -0.54 -0.09 0.00 -1.72 0.00 0.00 55.73 54.06 2yst s ARG 13 Cb -0.10 -2.84 -0.05 0.00 -0.45 0.00 0.00 34.95 31.51 2yst s ARG 13 CO 0.12 0.62 0.87 -0.06 -0.68 0.00 0.00 175.30 176.18 2yst s PHE 14 N -1.27 3.55 0.14 -0.53 0.08 -1.26 -4.06 117.98 114.63 2yst s PHE 14 Ca 0.26 1.08 -0.12 0.00 0.12 0.00 0.00 56.93 58.26 2yst s PHE 14 Cb -0.12 -2.51 -0.01 0.00 -0.57 0.00 0.00 43.02 39.81 2yst s PHE 14 CO 0.17 -0.37 1.54 0.93 -0.10 0.00 0.00 175.22 177.40 2yst h GLU 15 N 0.39 0.87 -5.19 0.44 5.08 -1.93 -3.43 114.58 110.82 2yst h GLU 15 Ca -0.46 -0.35 -0.64 0.00 -1.00 0.00 0.00 59.36 56.91 2yst h GLU 15 Cb 1.19 -0.04 -0.33 0.00 0.50 0.00 0.00 28.75 30.07 2yst h GLU 15 CO 0.62 0.99 -0.87 0.15 -1.00 0.00 0.00 179.01 178.90 2yst s LYS 16 N -4.76 2.74 0.19 2.33 1.02 -1.26 -5.03 119.74 114.97 2yst s LYS 16 Ca -0.12 -0.78 -0.12 0.00 0.02 0.00 0.00 55.97 54.97 2yst s LYS 16 Cb 0.11 -2.10 0.18 0.00 -0.52 0.00 0.00 37.83 35.50 2yst s LYS 16 CO 0.84 0.15 1.75 0.77 -0.92 0.00 0.00 175.35 177.94 2yst h SER 17 N 6.75 0.21 -3.43 2.83 0.02 -1.94 -3.36 113.55 114.63 2yst h SER 17 Ca -0.22 0.06 -0.61 0.00 -0.84 0.00 0.00 61.79 60.18 2yst h SER 17 Cb 1.23 0.03 -0.40 0.00 0.14 0.00 0.00 62.40 63.40 2yst h SER 17 CO 0.47 0.15 -0.74 -0.69 -1.14 0.00 0.00 176.83 174.88 2yst s VAL 18 N -6.12 1.48 -0.53 2.27 1.01 -1.26 -3.00 120.40 114.24 2yst s VAL 18 Ca -0.13 -1.94 -0.26 0.00 0.00 0.00 0.00 61.98 59.64 2yst s VAL 18 Cb 0.15 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.39 2yst s VAL 18 CO 0.73 -0.69 2.15 -0.31 0.00 0.00 0.00 175.10 176.99 2yst s TYR 19 N 1.14 1.35 -0.37 5.22 1.51 0.11 -4.83 117.35 121.48 2yst s TYR 19 Ca 0.12 1.18 -0.11 0.00 -1.01 0.00 0.00 57.07 57.25 2yst s TYR 19 Cb -0.19 -3.82 0.03 0.00 -0.11 0.00 0.00 41.96 37.86 2yst s TYR 19 CO -0.15 -2.49 0.20 -2.00 -1.11 0.00 0.00 175.55 170.00 2yst s GLU 20 N 7.61 2.83 0.06 -0.62 2.12 -1.26 -1.50 118.70 127.94 2yst s GLU 20 Ca 0.84 -1.08 0.04 0.00 0.36 0.00 0.00 54.97 55.14 2yst s GLU 20 Cb -0.16 -3.73 -0.03 0.00 0.26 0.00 0.00 34.13 30.48 2yst s GLU 20 CO 0.24 -0.69 -0.13 0.00 -0.54 0.00 0.00 175.26 174.14 2yst s ALA 21 N 1.55 1.04 -0.24 6.30 0.00 -0.91 -5.01 121.76 124.50 2yst s ALA 21 Ca 0.02 -0.93 -0.22 0.00 0.00 0.00 0.00 51.96 50.83 2yst s ALA 21 Cb -0.19 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 2yst s ALA 21 CO 0.07 0.13 0.72 0.16 0.00 0.00 0.00 175.76 176.85 2yst s ASP 22 N -1.62 6.72 -0.22 0.00 -4.77 -1.26 -2.98 116.67 112.53 2yst s ASP 22 Ca -0.03 0.88 -0.04 0.00 -3.30 0.00 0.00 52.55 50.06 2yst s ASP 22 Cb -0.10 -2.39 -0.01 0.00 -1.09 0.00 0.00 42.92 39.33 2yst s ASP 22 CO 0.02 -0.42 -0.03 -0.22 0.70 0.00 0.00 175.17 175.22 2yst s LEU 23 N 2.58 3.02 -0.29 2.11 1.98 -1.19 -4.97 118.68 121.91 2yst s LEU 23 Ca 0.31 -0.33 -0.29 0.00 -2.89 0.00 0.00 54.13 50.93 2yst s LEU 23 Cb -0.15 -1.77 -0.02 0.00 0.66 0.00 0.00 46.19 44.91 2yst s LEU 23 CO 0.08 0.00 1.65 0.00 -1.89 0.00 0.00 176.35 176.20 2yst s ALA 24 N 1.35 3.08 0.44 5.97 0.00 -1.26 -1.90 121.76 129.45 2yst s ALA 24 Ca 0.04 0.29 0.33 0.00 0.00 0.00 0.00 51.96 52.62 2yst s ALA 24 Cb -0.14 -3.93 1.50 0.00 0.00 0.00 0.00 23.12 20.55 2yst s ALA 24 CO -0.01 -2.28 1.57 -0.85 0.00 0.00 0.00 175.76 174.19 2yst n GLU 25 N 8.02 -0.04 -0.60 0.00 -0.00 -1.13 0.15 120.64 127.05 2yst n GLU 25 Ca 0.20 1.26 -0.08 0.00 -0.00 0.00 0.00 57.16 58.53 2yst n GLU 25 Cb 0.46 -2.48 0.03 0.00 -0.00 0.00 0.00 31.44 29.45 2yst n GLU 25 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2yst n ASN 26 N -4.71 5.16 -4.67 -1.84 5.03 -1.26 -3.90 115.26 109.06 2yst n ASN 26 Ca 0.41 -2.67 -0.41 0.00 0.87 0.00 0.00 54.58 52.78 2yst n ASN 26 Cb 1.58 -0.94 -0.04 0.00 -1.02 0.00 0.00 39.78 39.36 2yst n ASN 26 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2yst s SER 27 N 0.82 6.93 1.15 6.41 0.01 0.40 -5.02 113.70 124.39 2yst s SER 27 Ca 0.16 1.14 -0.14 0.00 1.31 0.00 0.00 55.95 58.42 2yst s SER 27 Cb 0.13 -2.44 0.23 0.00 0.21 0.00 0.00 66.02 64.16 2yst s SER 27 CO 0.01 -0.35 0.76 0.00 0.41 0.00 0.00 173.24 174.07 2yst n ALA 28 N 5.05 -3.12 0.98 1.44 0.00 -1.26 -4.00 120.51 119.60 2yst n ALA 28 Ca 0.03 -1.17 0.04 0.00 0.00 0.00 0.00 53.44 52.35 2yst n ALA 28 Cb 0.49 -1.89 0.27 0.00 0.00 0.00 0.00 19.45 18.32 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 -4.16 0.49 -2.52 0.00 -0.04 -1.26 -2.85 135.00 124.66 2yst n PRO 29 Ca 0.03 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.49 2yst n PRO 29 Cb 0.56 -1.29 0.06 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 1.67 3.77 0.55 0.00 -1.11 -2.62 105.19 107.43 2yst n GLY 30 Ca 0.07 -0.77 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.17 5.17 0.17 2.61 2.01 -1.13 -4.81 115.64 117.48 2yst s THR 31 Ca 0.22 0.79 -0.30 0.00 0.31 0.00 0.00 61.69 62.71 2yst s THR 31 Cb 0.34 -3.72 -0.08 0.00 0.01 0.00 0.00 72.50 69.05 2yst s THR 31 CO -0.08 0.44 1.32 -2.16 -0.69 0.00 0.00 174.62 173.46 2yst s PRO 32 N -0.08 4.37 -0.07 4.92 0.04 -1.26 -0.15 135.00 142.77 2yst s PRO 32 Ca 0.22 2.05 -0.08 0.00 0.04 0.00 0.00 61.00 63.23 2yst s PRO 32 Cb -0.15 -3.21 -0.03 0.00 0.04 0.00 0.00 34.50 31.15 2yst s PRO 32 CO 0.10 -0.30 -0.16 -0.89 0.04 0.00 0.00 177.00 175.79 2yst n ILE 33 N 2.99 0.84 -3.83 0.56 5.41 0.01 -4.91 119.36 120.44 2yst n ILE 33 Ca 0.07 0.28 -0.06 0.00 1.00 0.00 0.00 62.75 64.04 2yst n ILE 33 Cb 0.43 -1.85 0.02 0.00 -0.71 0.00 0.00 39.64 37.52 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 -6.58 -0.03 -0.18 1.39 0.05 -1.08 -5.01 118.68 107.24 2yst s LEU 34 Ca -0.13 -0.89 0.00 0.00 0.05 0.00 0.00 54.13 53.16 2yst s LEU 34 Cb 0.02 2.53 0.04 0.00 -2.05 0.00 0.00 46.19 46.74 2yst s LEU 34 CO 0.20 -1.37 -0.07 -1.58 -0.55 0.00 0.00 176.35 172.97 2yst s GLN 35 N -2.46 1.68 0.26 1.48 0.74 -1.26 -0.13 119.66 119.98 2yst s GLN 35 Ca 0.17 -0.67 -0.30 0.00 0.05 0.00 0.00 55.36 54.62 2yst s GLN 35 Cb -0.04 -2.20 -0.09 0.00 1.10 0.00 0.00 33.01 31.78 2yst s GLN 35 CO 0.08 -0.44 1.06 -0.51 -0.55 0.00 0.00 175.29 174.93 2yst s LEU 36 N 1.53 4.58 0.18 3.68 1.02 0.11 -4.98 118.68 124.79 2yst s LEU 36 Ca -0.00 2.18 0.06 0.00 0.02 0.00 0.00 54.13 56.39 2yst s LEU 36 Cb -0.16 -3.62 -0.05 0.00 0.02 0.00 0.00 46.19 42.39 2yst s LEU 36 CO -0.08 -0.06 -0.13 -0.13 0.02 0.00 0.00 176.35 175.97 2yst s ARG 37 N -1.33 1.21 -0.30 1.70 0.52 -1.26 -4.70 118.95 114.79 2yst s ARG 37 Ca 0.44 -1.51 0.15 0.00 -0.52 0.00 0.00 55.73 54.28 2yst s ARG 37 Cb -0.30 -0.92 0.48 0.00 0.52 0.00 0.00 34.95 34.72 2yst s ARG 37 CO 0.38 0.14 1.11 0.00 0.02 0.00 0.00 175.30 176.96 2yst n ALA 38 N -0.25 3.77 -0.97 2.13 0.00 -1.26 -3.34 120.51 120.60 2yst n ALA 38 Ca -0.09 -3.33 -0.31 0.00 0.00 0.00 0.00 53.44 49.71 2yst n ALA 38 Cb 0.60 -0.68 -0.00 0.00 0.00 0.00 0.00 19.45 19.37 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 -0.53 -2.54 0.59 0.00 0.00 -1.26 -4.58 120.51 112.19 2yst n ALA 39 Ca 0.23 0.12 0.06 0.00 0.00 0.00 0.00 53.44 53.85 2yst n ALA 39 Cb 0.84 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 19.16 2yst n ALA 39 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2yst n ASP 40 N 1.69 1.11 -1.98 0.00 9.92 -1.26 -4.61 116.55 121.41 2yst n ASP 40 Ca 0.09 -1.06 -0.18 0.00 -0.53 0.00 0.00 54.79 53.12 2yst n ASP 40 Cb 0.28 0.67 -0.04 0.00 -0.64 0.00 0.00 41.12 41.39 2yst n ASP 40 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2yst n LEU 41 N -0.61 -1.47 -0.36 0.64 4.77 -1.26 -4.81 117.00 113.91 2yst n LEU 41 Ca 0.04 0.24 0.07 0.00 -0.03 0.00 0.00 56.01 56.34 2yst n LEU 41 Cb 0.25 -2.57 0.15 0.00 -2.33 0.00 0.00 43.42 38.92 2yst n LEU 41 CO 0.20 -0.54 0.60 -0.67 -1.33 0.00 0.00 177.39 175.66 2yst n ASP 42 N -1.48 2.79 -4.21 -1.43 -0.08 -1.26 -4.98 116.55 105.90 2yst n ASP 42 Ca -0.19 -2.74 -0.33 0.00 -1.51 0.00 0.00 54.79 50.01 2yst n ASP 42 Cb 0.62 -0.36 -0.04 0.00 2.34 0.00 0.00 41.12 43.67 2yst n ASP 42 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 2yst n VAL 43 N -0.77 -1.46 0.00 5.18 0.31 -1.26 -4.70 118.33 115.63 2yst n VAL 43 Ca 0.14 -0.22 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 2yst n VAL 43 Cb 0.62 -1.69 0.00 0.00 -0.91 0.00 0.00 33.84 31.86 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 -1.71 -1.02 3.71 2.92 0.00 -1.26 -5.09 105.19 102.74 2yst n GLY 44 Ca -0.09 0.28 -0.59 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.21 0.27 -0.05 1.61 0.31 -1.26 -4.84 118.33 113.15 2yst n VAL 45 Ca 0.00 -0.05 -0.13 0.00 -0.01 0.00 0.00 64.34 64.15 2yst n VAL 45 Cb 0.00 -1.14 -0.01 0.00 -0.91 0.00 0.00 33.84 31.78 2yst n VAL 45 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2yst h ASN 46 N 7.07 0.86 0.00 4.52 -1.07 -1.98 -3.40 115.58 121.58 2yst h ASN 46 Ca -0.45 -0.47 0.00 0.00 0.07 0.00 0.00 56.30 55.44 2yst h ASN 46 Cb 1.33 -0.25 0.00 0.00 -2.07 0.00 0.00 38.32 37.33 2yst h ASN 46 CO 0.97 1.25 0.00 0.61 0.07 0.00 0.00 177.43 180.32 2yst n GLY 47 N 0.36 -0.09 3.04 9.14 0.00 -1.26 -4.81 105.19 111.56 2yst n GLY 47 Ca -0.04 -0.39 -0.43 0.00 0.00 0.00 0.00 46.02 45.16 2yst n GLY 47 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2yst n GLN 48 N 0.00 3.87 -5.01 1.61 6.02 -1.26 -4.84 117.38 117.77 2yst n GLN 48 Ca 0.00 -4.01 -0.28 0.00 -0.01 0.00 0.00 57.00 52.70 2yst n GLN 48 Cb 0.00 -2.76 -0.16 0.00 1.02 0.00 0.00 30.24 28.34 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 -0.70 1.67 -0.66 5.09 -1.09 -1.26 -4.76 121.20 119.49 2yst s ILE 49 Ca 0.36 -0.87 -0.26 0.00 -2.23 0.00 0.00 60.65 57.65 2yst s ILE 49 Cb 0.04 -1.41 0.04 0.00 -1.58 0.00 0.00 42.46 39.55 2yst s ILE 49 CO 0.03 0.47 1.17 -0.70 -1.23 0.00 0.00 174.94 174.69 2yst s GLU 50 N -0.16 3.29 -0.43 2.79 2.12 -1.05 -4.73 118.70 120.52 2yst s GLU 50 Ca -0.00 -0.19 -0.23 0.00 0.36 0.00 0.00 54.97 54.90 2yst s GLU 50 Cb -0.11 -4.13 0.02 0.00 0.26 0.00 0.00 34.13 30.17 2yst s GLU 50 CO 0.02 -1.90 0.80 0.71 -0.54 0.00 0.00 175.26 174.36 2yst s TYR 51 N 5.08 3.02 0.53 5.30 2.02 -1.26 -2.52 117.35 129.52 2yst s TYR 51 Ca 0.35 0.30 0.01 0.00 -0.37 0.00 0.00 57.07 57.36 2yst s TYR 51 Cb -0.10 -3.63 0.01 0.00 -0.40 0.00 0.00 41.96 37.84 2yst s TYR 51 CO 0.18 -0.93 0.05 1.33 -1.57 0.00 0.00 175.55 174.60 2yst n VAL 52 N 6.08 0.00 -2.82 0.71 0.24 -1.01 -3.82 118.33 117.72 2yst n VAL 52 Ca 0.03 -2.47 -0.43 0.00 -2.04 0.00 0.00 64.34 59.43 2yst n VAL 52 Cb 0.48 0.44 -0.04 0.00 -1.47 0.00 0.00 33.84 33.26 2yst n VAL 52 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2yst s PHE 53 N -2.90 2.89 0.00 6.34 0.08 -1.26 -1.96 117.98 121.17 2yst s PHE 53 Ca 0.03 0.29 0.00 0.00 0.12 0.00 0.00 56.93 57.38 2yst s PHE 53 Cb -0.00 -4.00 0.00 0.00 -0.57 0.00 0.00 43.02 38.45 2yst s PHE 53 CO 0.02 -1.16 0.00 0.41 -0.10 0.00 0.00 175.22 174.39 2yst n GLY 54 N 4.98 1.84 3.26 4.36 0.00 -0.78 -4.74 105.19 114.11 2yst n GLY 54 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 2yst n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yst n ALA 55 N -3.00 4.37 -2.58 4.61 0.00 -1.20 -4.93 120.51 117.78 2yst n ALA 55 Ca 0.00 -4.15 -0.19 0.00 0.00 0.00 0.00 53.44 49.11 2yst n ALA 55 Cb 0.00 -3.20 -0.12 0.00 0.00 0.00 0.00 19.45 16.14 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 1.97 1.40 0.52 0.00 0.00 -1.26 -2.52 121.76 121.86 2yst s ALA 56 Ca 0.45 -1.18 -0.18 0.00 0.00 0.00 0.00 51.96 51.05 2yst s ALA 56 Cb 0.04 -0.10 -0.07 0.00 0.00 0.00 0.00 23.12 22.98 2yst s ALA 56 CO 0.01 0.15 1.01 -0.08 0.00 0.00 0.00 175.76 176.84 2yst s THR 57 N -1.72 4.21 -1.29 0.00 -1.32 -1.26 -4.91 115.64 109.35 2yst s THR 57 Ca 0.05 1.16 0.05 0.00 -1.21 0.00 0.00 61.69 61.73 2yst s THR 57 Cb -0.07 -3.57 0.07 0.00 -1.51 0.00 0.00 72.50 67.42 2yst s THR 57 CO 0.03 -0.51 1.06 -1.84 -2.21 0.00 0.00 174.62 171.14 2yst n GLU 58 N -1.44 0.05 0.08 7.08 0.00 -1.26 -0.86 120.64 124.29 2yst n GLU 58 Ca 0.08 0.29 0.12 0.00 0.00 0.00 0.00 57.16 57.65 2yst n GLU 58 Cb 0.53 -1.50 0.03 0.00 0.00 0.00 0.00 31.44 30.51 2yst n GLU 58 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 2yst n SER 59 N -1.36 0.76 -0.08 -1.84 7.64 -1.26 -3.93 113.62 113.56 2yst n SER 59 Ca 0.02 0.21 -0.06 0.00 1.01 0.00 0.00 58.87 60.05 2yst n SER 59 Cb 0.05 0.49 -0.02 0.00 -1.01 0.00 0.00 64.21 63.71 2yst n SER 59 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2yst n VAL 60 N -2.46 1.44 -0.36 0.44 0.31 -0.04 -2.91 118.33 114.75 2yst n VAL 60 Ca 0.01 0.19 0.37 0.00 -0.01 0.00 0.00 64.34 64.90 2yst n VAL 60 Cb 0.51 -2.37 0.74 0.00 -0.91 0.00 0.00 33.84 31.81 2yst n VAL 60 CO 0.00 0.00 0.00 0.08 -1.32 0.00 0.00 176.83 175.59 2yst h ARG 61 N -1.00 0.00 0.16 5.55 0.11 -1.71 1.01 114.38 118.49 2yst h ARG 61 Ca -0.02 0.00 -0.35 0.00 0.10 0.00 0.00 59.98 59.71 2yst h ARG 61 Cb 0.64 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.71 2yst h ARG 61 CO -0.01 0.00 -1.79 0.07 0.10 0.00 0.00 179.97 178.34 2yst h ARG 62 N 0.00 0.33 0.00 0.08 0.11 -1.74 -3.33 114.38 109.83 2yst h ARG 62 Ca 0.61 -0.56 0.00 0.00 0.10 0.00 0.00 59.98 60.13 2yst h ARG 62 Cb 2.58 0.21 0.00 0.00 1.11 0.00 0.00 29.97 33.87 2yst h ARG 62 CO -0.01 1.24 0.00 -0.11 0.10 0.00 0.00 179.97 181.19 2yst n LEU 63 N -3.52 0.72 -3.83 0.08 7.94 0.16 -4.26 117.00 114.30 2yst n LEU 63 Ca -0.25 0.60 -0.13 0.00 -1.11 0.00 0.00 56.01 55.11 2yst n LEU 63 Cb 1.06 -0.41 -0.14 0.00 0.53 0.00 0.00 43.42 44.46 2yst n LEU 63 CO 0.49 -0.29 -0.32 -0.76 -1.11 0.00 0.00 177.39 175.40 2yst s LEU 64 N -4.42 1.57 -0.07 -1.96 1.43 0.30 -2.32 118.68 113.21 2yst s LEU 64 Ca 0.09 0.08 -0.04 0.00 -1.03 0.00 0.00 54.13 53.23 2yst s LEU 64 Cb 0.12 0.08 -0.04 0.00 0.03 0.00 0.00 46.19 46.38 2yst s LEU 64 CO 0.53 -0.05 0.10 -0.60 0.23 0.00 0.00 176.35 176.55 2yst s ARG 65 N 0.39 3.25 -0.02 1.70 3.52 0.24 -4.33 118.95 123.70 2yst s ARG 65 Ca -0.03 -0.30 0.02 0.00 -0.13 0.00 0.00 55.73 55.29 2yst s ARG 65 Cb -0.04 -3.01 0.00 0.00 -1.56 0.00 0.00 34.95 30.34 2yst s ARG 65 CO -0.01 0.72 -0.08 -1.17 -0.81 0.00 0.00 175.30 173.95 2yst s LEU 66 N -1.25 1.79 0.25 -0.88 2.96 -1.26 -1.79 118.68 118.51 2yst s LEU 66 Ca 0.18 -0.16 0.06 0.00 -0.22 0.00 0.00 54.13 53.98 2yst s LEU 66 Cb -0.12 -0.48 -0.03 0.00 0.50 0.00 0.00 46.19 46.06 2yst s LEU 66 CO 0.07 0.06 0.33 -1.81 -1.32 0.00 0.00 176.35 173.68 2yst s ASP 67 N 0.18 6.07 0.00 3.68 1.01 -1.13 -4.98 116.67 121.50 2yst s ASP 67 Ca -0.02 -0.04 0.00 0.00 0.71 0.00 0.00 52.55 53.19 2yst s ASP 67 Cb -0.08 -1.68 0.00 0.00 1.01 0.00 0.00 42.92 42.18 2yst s ASP 67 CO 0.00 -0.10 0.00 -1.84 0.21 0.00 0.00 175.17 173.45 2yst n GLU 68 N -1.37 2.74 0.04 8.23 -0.00 -1.25 -3.76 120.64 125.28 2yst n GLU 68 Ca -0.08 0.00 -0.04 0.00 -0.00 0.00 0.00 57.16 57.04 2yst n GLU 68 Cb 0.57 -0.99 0.18 0.00 -0.00 0.00 0.00 31.44 31.21 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 1.30 0.00 3.84 1.03 -1.91 -3.35 112.91 113.82 2yst h THR 69 Ca 0.00 -1.48 -0.10 0.00 -0.01 0.00 0.00 66.41 64.82 2yst h THR 69 Cb 0.67 1.57 -0.02 0.00 -1.07 0.00 0.00 68.15 69.31 2yst h THR 69 CO 0.00 0.46 -1.35 -1.54 -0.01 0.00 0.00 175.52 173.08 2yst n SER 70 N -4.05 2.36 0.00 0.00 3.41 -1.26 -4.95 113.62 109.13 2yst n SER 70 Ca -0.01 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2yst n SER 70 Cb 0.48 -0.13 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 2.98 1.36 3.68 5.00 0.00 -1.25 -4.89 105.19 112.07 2yst n GLY 71 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.00 3.37 -0.13 1.61 0.52 -1.26 0.05 118.94 121.10 2yst s TRP 72 Ca 0.00 0.47 -0.06 0.00 0.02 0.00 0.00 56.10 56.54 2yst s TRP 72 Cb 0.00 -2.40 -0.04 0.00 -1.15 0.00 0.00 33.47 29.88 2yst s TRP 72 CO 0.00 0.06 0.08 -1.17 0.02 0.00 0.00 176.95 175.95 2yst s LEU 73 N 1.06 4.01 0.12 2.99 0.20 0.82 -2.86 118.68 125.02 2yst s LEU 73 Ca 0.14 0.27 -0.14 0.00 0.69 0.00 0.00 54.13 55.10 2yst s LEU 73 Cb -0.14 -1.97 0.02 0.00 -0.43 0.00 0.00 46.19 43.67 2yst s LEU 73 CO 0.06 0.33 0.35 -0.94 -0.29 0.00 0.00 176.35 175.86 2yst s SER 74 N -0.57 -0.12 0.54 3.68 1.04 -0.74 -0.81 113.70 116.71 2yst s SER 74 Ca 0.11 -0.46 -0.20 0.00 0.48 0.00 0.00 55.95 55.88 2yst s SER 74 Cb -0.12 0.44 -0.06 0.00 0.10 0.00 0.00 66.02 66.39 2yst s SER 74 CO 0.02 -0.84 1.16 -0.69 0.98 0.00 0.00 173.24 173.87 2yst s VAL 75 N -3.84 2.99 -0.09 5.02 1.01 0.78 -0.59 120.40 125.69 2yst s VAL 75 Ca 0.05 0.65 0.00 0.00 0.00 0.00 0.00 61.98 62.68 2yst s VAL 75 Cb 0.03 -3.28 -0.06 0.00 0.00 0.00 0.00 36.38 33.07 2yst s VAL 75 CO -0.10 -0.10 -0.08 -0.11 0.00 0.00 0.00 175.10 174.70 2yst n LEU 76 N -1.18 2.85 -4.27 3.92 7.94 -0.98 -2.74 117.00 122.54 2yst n LEU 76 Ca 0.11 -0.04 -0.15 0.00 -1.11 0.00 0.00 56.01 54.82 2yst n LEU 76 Cb 0.50 -0.32 -0.10 0.00 0.53 0.00 0.00 43.42 44.03 2yst n LEU 76 CO 0.44 0.63 -0.42 -1.00 -1.11 0.00 0.00 177.39 175.93 2yst s HIS 77 N -2.18 1.37 0.63 1.96 3.76 -1.13 -4.41 115.29 115.30 2yst s HIS 77 Ca -0.12 -0.70 -0.17 0.00 -0.15 0.00 0.00 55.06 53.91 2yst s HIS 77 Cb 0.03 -0.68 -0.09 0.00 1.11 0.00 0.00 32.58 32.95 2yst s HIS 77 CO 0.21 0.15 0.26 0.54 -0.85 0.00 0.00 174.74 175.04 2yst n ARG 78 N -0.17 0.27 -5.07 1.40 3.00 -1.26 -4.51 116.66 110.32 2yst n ARG 78 Ca -0.10 0.11 -0.28 0.00 -0.01 0.00 0.00 57.85 57.57 2yst n ARG 78 Cb 0.60 -1.50 -0.16 0.00 0.00 0.00 0.00 32.46 31.40 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 -1.87 1.71 -0.05 0.55 1.01 -1.25 -5.02 121.20 116.28 2yst s ILE 79 Ca 0.63 -0.93 0.04 0.00 0.00 0.00 0.00 60.65 60.39 2yst s ILE 79 Cb -0.41 -1.42 -0.00 0.00 0.01 0.00 0.00 42.46 40.63 2yst s ILE 79 CO 0.61 0.48 -0.18 -0.62 0.00 0.00 0.00 174.94 175.23 2yst s ASP 80 N -0.50 2.33 0.12 3.58 2.15 -1.26 -4.47 116.67 118.62 2yst s ASP 80 Ca 0.08 -0.39 0.01 0.00 0.43 0.00 0.00 52.55 52.68 2yst s ASP 80 Cb -0.08 -0.73 -0.18 0.00 -0.30 0.00 0.00 42.92 41.63 2yst s ASP 80 CO -0.01 0.15 1.26 -0.09 -0.17 0.00 0.00 175.17 176.31 2yst h ARG 81 N 6.34 0.17 -0.02 4.34 1.12 -1.88 -3.00 114.38 121.45 2yst h ARG 81 Ca -0.31 -0.25 0.00 0.00 -1.11 0.00 0.00 59.98 58.31 2yst h ARG 81 Cb 1.18 0.09 -0.00 0.00 -0.01 0.00 0.00 29.97 31.23 2yst h ARG 81 CO 0.48 1.07 0.00 1.49 -3.11 0.00 0.00 179.97 179.90 2yst h GLU 82 N 0.06 0.01 -0.64 0.20 4.81 -1.99 -2.79 114.58 114.25 2yst h GLU 82 Ca -0.07 -0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.08 2yst h GLU 82 Cb 1.77 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 31.12 2yst h GLU 82 CO 0.16 0.01 0.08 1.05 -0.73 0.00 0.00 179.01 179.58 2yst h GLU 83 N 0.01 1.06 -3.43 1.92 4.11 -2.01 -3.43 114.58 112.81 2yst h GLU 83 Ca 0.01 -0.29 -0.23 0.00 0.07 0.00 0.00 59.36 58.92 2yst h GLU 83 Cb 0.01 -0.12 -0.29 0.00 0.50 0.00 0.00 28.75 28.84 2yst h GLU 83 CO -0.01 0.99 -0.62 0.14 0.07 0.00 0.00 179.01 179.57 2yst s VAL 84 N -5.15 -0.02 -0.14 -1.06 -7.23 -1.05 -5.04 120.40 100.70 2yst s VAL 84 Ca -0.11 0.08 0.10 0.00 -1.81 0.00 0.00 61.98 60.24 2yst s VAL 84 Cb 0.14 -0.16 -0.23 0.00 0.56 0.00 0.00 36.38 36.69 2yst s VAL 84 CO 0.85 0.03 0.29 -0.46 -0.31 0.00 0.00 175.10 175.50 2yst n ASN 85 N 3.55 0.94 -3.78 4.85 0.23 -1.21 -3.91 115.26 115.93 2yst n ASN 85 Ca -0.19 0.17 -0.13 0.00 -0.53 0.00 0.00 54.58 53.89 2yst n ASN 85 Cb 0.56 0.11 -0.14 0.00 -2.08 0.00 0.00 39.78 38.23 2yst n ASN 85 CO 0.00 0.00 0.00 -1.58 -0.93 0.00 0.00 177.26 174.75 2yst s GLN 86 N -2.54 0.08 -0.29 -3.83 0.74 -1.26 -2.80 119.66 109.76 2yst s GLN 86 Ca -0.14 0.28 -0.07 0.00 0.05 0.00 0.00 55.36 55.48 2yst s GLN 86 Cb 0.07 -0.11 0.00 0.00 1.10 0.00 0.00 33.01 34.07 2yst s GLN 86 CO 0.79 -0.12 0.07 -0.51 -0.55 0.00 0.00 175.29 174.97 2yst s LEU 87 N 0.81 3.75 -0.19 3.68 1.43 -1.13 -5.00 118.68 122.03 2yst s LEU 87 Ca -0.06 -0.63 -0.01 0.00 -1.03 0.00 0.00 54.13 52.40 2yst s LEU 87 Cb -0.08 -1.88 0.01 0.00 0.03 0.00 0.00 46.19 44.26 2yst s LEU 87 CO -0.04 -0.16 -0.13 -0.13 0.23 0.00 0.00 176.35 176.12 2yst s ARG 88 N 1.51 3.17 -0.07 1.70 0.52 -1.26 -1.80 118.95 122.73 2yst s ARG 88 Ca 0.03 -0.74 -0.06 0.00 -0.52 0.00 0.00 55.73 54.44 2yst s ARG 88 Cb -0.17 -2.75 0.02 0.00 0.52 0.00 0.00 34.95 32.58 2yst s ARG 88 CO 0.02 -0.17 0.18 -0.59 0.02 0.00 0.00 175.30 174.76 2yst s PHE 89 N 1.29 -0.20 0.13 -0.53 -0.12 -0.88 -4.81 117.98 112.87 2yst s PHE 89 Ca 0.04 0.49 -0.07 0.00 -0.05 0.00 0.00 56.93 57.34 2yst s PHE 89 Cb -0.14 0.06 -0.06 0.00 -0.63 0.00 0.00 43.02 42.25 2yst s PHE 89 CO -0.07 -0.10 0.40 0.99 -0.05 0.00 0.00 175.22 176.38 2yst s THR 90 N 0.21 5.12 -0.05 -4.49 2.01 -1.05 -0.41 115.64 116.98 2yst s THR 90 Ca -0.01 0.21 0.05 0.00 0.31 0.00 0.00 61.69 62.26 2yst s THR 90 Cb -0.02 -3.63 -0.01 0.00 0.01 0.00 0.00 72.50 68.85 2yst s THR 90 CO -0.01 0.11 -0.21 0.68 -0.69 0.00 0.00 174.62 174.50 2yst s VAL 91 N -1.59 1.75 0.31 3.82 -7.23 -0.35 -1.86 120.40 115.26 2yst s VAL 91 Ca 0.39 -0.90 0.03 0.00 -1.81 0.00 0.00 61.98 59.68 2yst s VAL 91 Cb -0.13 -1.49 -0.03 0.00 0.56 0.00 0.00 36.38 35.30 2yst s VAL 91 CO 0.22 0.49 0.48 -0.04 -0.31 0.00 0.00 175.10 175.94 2yst s MET 92 N -0.11 3.42 -0.14 4.82 -1.94 -0.83 -0.80 119.30 123.72 2yst s MET 92 Ca -0.03 -0.55 -0.03 0.00 -1.71 0.00 0.00 55.69 53.37 2yst s MET 92 Cb -0.12 -2.75 0.05 0.00 2.01 0.00 0.00 34.83 34.02 2yst s MET 92 CO 0.03 0.22 0.05 0.00 -0.01 0.00 0.00 175.02 175.30 2yst s ALA 93 N -2.20 0.67 -0.16 3.03 0.00 -0.69 -2.39 121.76 120.01 2yst s ALA 93 Ca 0.39 -0.35 -0.11 0.00 0.00 0.00 0.00 51.96 51.89 2yst s ALA 93 Cb -0.09 -0.97 -0.05 0.00 0.00 0.00 0.00 23.12 22.00 2yst s ALA 93 CO 0.33 -0.94 0.20 1.03 0.00 0.00 0.00 175.76 176.38 2yst s ARG 94 N 2.00 4.08 0.39 0.00 0.52 -1.05 -2.76 118.95 122.14 2yst s ARG 94 Ca 0.02 -0.07 0.08 0.00 -0.52 0.00 0.00 55.73 55.23 2yst s ARG 94 Cb -0.15 -3.38 -0.02 0.00 0.52 0.00 0.00 34.95 31.92 2yst s ARG 94 CO -0.07 0.37 0.36 0.34 0.02 0.00 0.00 175.30 176.32 2yst s ASP 95 N 0.11 5.17 -0.14 0.23 -1.08 -1.26 -2.52 116.67 117.17 2yst s ASP 95 Ca 0.13 -0.64 -0.06 0.00 -0.52 0.00 0.00 52.55 51.46 2yst s ASP 95 Cb -0.12 -0.71 -0.23 0.00 -1.46 0.00 0.00 42.92 40.40 2yst s ASP 95 CO 0.02 -0.56 3.26 0.54 0.52 0.00 0.00 175.17 178.95 2yst n ARG 96 N -1.51 1.95 -4.26 4.34 5.12 -1.26 -4.82 116.66 116.23 2yst n ARG 96 Ca 0.02 -1.01 -0.14 0.00 -1.93 0.00 0.00 57.85 54.79 2yst n ARG 96 Cb 0.61 -2.02 -0.10 0.00 -1.16 0.00 0.00 32.46 29.78 2yst n ARG 96 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2yst s GLY 97 N 2.13 1.53 -0.16 -0.13 0.00 -1.26 -5.10 107.32 104.34 2yst s GLY 97 Ca 0.61 -1.76 -0.06 0.00 0.00 0.00 0.00 44.72 43.51 2yst s GLY 97 CO -0.01 -1.50 0.34 -0.86 0.00 0.00 0.00 173.10 171.07 2yst s GLN 98 N -4.07 0.25 0.29 2.90 -2.07 -1.26 -2.33 119.66 113.38 2yst s GLN 98 Ca 0.36 0.85 -0.29 0.00 -1.82 0.00 0.00 55.36 54.45 2yst s GLN 98 Cb 0.07 0.10 -0.10 0.00 -1.09 0.00 0.00 33.01 32.00 2yst s GLN 98 CO 0.11 -0.24 1.24 -1.25 -1.32 0.00 0.00 175.29 173.83 2yst s PRO 99 N 2.25 4.45 0.13 9.60 0.04 -1.26 -5.11 135.00 145.10 2yst s PRO 99 Ca -0.02 2.06 -0.31 0.00 0.04 0.00 0.00 61.00 62.77 2yst s PRO 99 Cb -0.11 -3.13 -0.08 0.00 0.04 0.00 0.00 34.50 31.22 2yst s PRO 99 CO -0.11 -0.07 1.35 -1.25 0.04 0.00 0.00 177.00 176.97 2yst s PRO 100 N -1.43 4.35 -0.78 0.56 0.04 -0.99 -4.97 135.00 131.78 2yst s PRO 100 Ca 0.49 2.04 -0.22 0.00 0.04 0.00 0.00 61.00 63.34 2yst s PRO 100 Cb -0.37 -3.25 0.08 0.00 0.04 0.00 0.00 34.50 31.01 2yst s PRO 100 CO 0.47 -0.38 1.08 0.15 0.04 0.00 0.00 177.00 178.36 2yst s LYS 101 N 0.85 3.31 -0.54 4.56 3.01 -1.26 -4.94 119.74 124.73 2yst s LYS 101 Ca 0.62 -1.09 -0.28 0.00 -1.01 0.00 0.00 55.97 54.21 2yst s LYS 101 Cb -0.36 -4.54 0.02 0.00 -1.01 0.00 0.00 37.83 31.94 2yst s LYS 101 CO 0.32 -1.87 1.32 0.95 0.51 0.00 0.00 175.35 176.58 2yst s THR 102 N 3.88 3.91 -0.13 2.17 -4.23 -1.25 -4.47 115.64 115.52 2yst s THR 102 Ca 0.29 0.83 -0.20 0.00 -1.18 0.00 0.00 61.69 61.43 2yst s THR 102 Cb -0.11 -4.50 -0.04 0.00 1.34 0.00 0.00 72.50 69.19 2yst s THR 102 CO 0.03 -1.14 0.57 -1.81 -0.54 0.00 0.00 174.62 171.73 2yst s ASP 103 N 3.72 6.76 -0.08 3.99 1.11 -1.11 -4.75 116.67 126.31 2yst s ASP 103 Ca 0.51 0.91 -0.12 0.00 0.18 0.00 0.00 52.55 54.03 2yst s ASP 103 Cb -0.10 -2.33 -0.05 0.00 1.07 0.00 0.00 42.92 41.51 2yst s ASP 103 CO 0.27 -0.10 0.30 -0.54 1.18 0.00 0.00 175.17 176.28 2yst s LYS 104 N 1.01 3.86 -0.13 8.23 1.02 -1.26 -1.71 119.74 130.77 2yst s LYS 104 Ca 0.30 0.17 -0.02 0.00 0.02 0.00 0.00 55.97 56.43 2yst s LYS 104 Cb -0.16 -3.26 0.04 0.00 -0.52 0.00 0.00 37.83 33.93 2yst s LYS 104 CO 0.12 0.60 0.01 0.00 -0.92 0.00 0.00 175.35 175.17 2yst s ALA 105 N -0.67 0.89 0.19 5.17 0.00 0.02 -4.91 121.76 122.46 2yst s ALA 105 Ca 0.19 -0.43 -0.30 0.00 0.00 0.00 0.00 51.96 51.42 2yst s ALA 105 Cb -0.14 -0.96 -0.09 0.00 0.00 0.00 0.00 23.12 21.93 2yst s ALA 105 CO 0.08 -0.79 1.35 0.99 0.00 0.00 0.00 175.76 177.40 2yst s THR 106 N 1.90 3.13 -0.28 0.00 2.01 -1.16 -1.21 115.64 120.03 2yst s THR 106 Ca 0.02 0.90 0.02 0.00 0.31 0.00 0.00 61.69 62.94 2yst s THR 106 Cb -0.14 -3.58 0.06 0.00 0.01 0.00 0.00 72.50 68.85 2yst s THR 106 CO -0.07 0.12 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.23 2yst s VAL 107 N 0.30 2.42 -0.32 3.82 1.01 0.45 -0.71 120.40 127.37 2yst s VAL 107 Ca 0.59 -1.64 -0.10 0.00 0.00 0.00 0.00 61.98 60.83 2yst s VAL 107 Cb -0.38 -2.45 -0.01 0.00 0.00 0.00 0.00 36.38 33.55 2yst s VAL 107 CO 0.37 -0.11 0.17 -0.69 0.00 0.00 0.00 175.10 174.85 2yst s VAL 108 N 1.13 4.79 -0.42 2.92 1.01 -0.56 -2.06 120.40 127.21 2yst s VAL 108 Ca -0.06 -0.34 -0.04 0.00 0.00 0.00 0.00 61.98 61.54 2yst s VAL 108 Cb -0.20 -3.44 0.11 0.00 0.00 0.00 0.00 36.38 32.85 2yst s VAL 108 CO -0.04 0.06 0.22 -0.76 0.00 0.00 0.00 175.10 174.58 2yst s LEU 109 N 1.65 5.29 -0.48 3.92 1.43 -0.74 -2.14 118.68 127.60 2yst s LEU 109 Ca 0.05 -2.00 -0.28 0.00 -1.03 0.00 0.00 54.13 50.88 2yst s LEU 109 Cb -0.17 -1.85 0.00 0.00 0.03 0.00 0.00 46.19 44.20 2yst s LEU 109 CO 0.07 -0.56 1.56 0.20 0.23 0.00 0.00 176.35 177.86 2yst s ASN 110 N 1.93 6.01 -0.05 2.29 0.01 -1.16 -2.86 114.94 121.11 2yst s ASN 110 Ca 0.08 0.65 -0.30 0.00 -0.71 0.00 0.00 52.86 52.58 2yst s ASN 110 Cb -0.23 -2.54 -0.08 0.00 0.41 0.00 0.00 41.25 38.81 2yst s ASN 110 CO -0.04 -1.74 2.04 -0.38 -1.51 0.00 0.00 177.10 175.48 2yst n ILE 111 N 7.09 0.63 -3.24 0.60 2.08 -1.12 -3.19 119.36 122.22 2yst n ILE 111 Ca 0.17 -0.22 -0.24 0.00 0.56 0.00 0.00 62.75 63.02 2yst n ILE 111 Cb 0.49 -2.32 -0.01 0.00 -0.75 0.00 0.00 39.64 37.05 2yst n ILE 111 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 2yst s LYS 112 N 4.96 3.42 -0.42 0.38 -0.14 -0.80 -4.90 119.74 122.25 2yst s LYS 112 Ca 0.93 -0.31 -0.16 0.00 -1.36 0.00 0.00 55.97 55.07 2yst s LYS 112 Cb -0.45 -2.62 0.02 0.00 -1.68 0.00 0.00 37.83 33.11 2yst s LYS 112 CO 0.42 0.04 0.39 -0.51 -0.76 0.00 0.00 175.35 174.92 2yst s ASP 113 N -4.07 6.16 -0.23 2.83 1.01 -1.26 -2.81 116.67 118.29 2yst s ASP 113 Ca 0.42 -0.74 -0.07 0.00 0.71 0.00 0.00 52.55 52.86 2yst s ASP 113 Cb -0.10 -2.20 -0.12 0.00 1.01 0.00 0.00 42.92 41.52 2yst s ASP 113 CO 0.37 -0.53 -0.27 1.21 0.21 0.00 0.00 175.17 176.17 2yst n GLU 114 N 5.44 0.52 -0.10 8.23 4.07 -1.26 -4.79 120.64 132.75 2yst n GLU 114 Ca -0.09 0.19 -0.16 0.00 -0.06 0.00 0.00 57.16 57.04 2yst n GLU 114 Cb 0.47 -1.37 -0.08 0.00 -0.06 0.00 0.00 31.44 30.40 2yst n GLU 114 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 2yst n ASN 115 N -3.75 1.85 -4.76 4.31 5.15 -1.26 -4.93 115.26 111.87 2yst n ASN 115 Ca -0.44 0.48 -0.38 0.00 -0.60 0.00 0.00 54.58 53.64 2yst n ASN 115 Cb 0.86 -0.92 0.01 0.00 -0.53 0.00 0.00 39.78 39.20 2yst n ASN 115 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2yst s ASP 116 N -6.51 5.78 -0.04 1.20 2.15 -1.26 -5.04 116.67 112.96 2yst s ASP 116 Ca -0.25 2.58 0.02 0.00 0.43 0.00 0.00 52.55 55.34 2yst s ASP 116 Cb 0.05 -2.62 0.01 0.00 -0.30 0.00 0.00 42.92 40.05 2yst s ASP 116 CO 0.46 -1.21 -0.09 0.21 -0.17 0.00 0.00 175.17 174.37 2yst s ASN 117 N -1.06 1.32 0.00 -0.34 3.84 -1.26 -4.85 114.94 112.59 2yst s ASN 117 Ca 0.66 -0.21 -0.30 0.00 0.21 0.00 0.00 52.86 53.22 2yst s ASN 117 Cb -0.36 -0.44 -0.05 0.00 -0.55 0.00 0.00 41.25 39.85 2yst s ASN 117 CO 0.43 0.05 1.30 -0.69 -2.79 0.00 0.00 177.10 175.40 2yst s VAL 118 N 0.36 3.91 -2.00 -5.21 1.01 -1.26 -5.23 120.40 111.99 2yst s VAL 118 Ca -0.06 1.30 0.16 0.00 0.00 0.00 0.00 61.98 63.38 2yst s VAL 118 Cb -0.11 -3.84 0.44 0.00 0.00 0.00 0.00 36.38 32.88 2yst s VAL 118 CO 0.01 0.02 1.34 -0.81 0.00 0.00 0.00 175.10 175.66