#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8d s LYS 5 N 0.00 0.75 0.26 2.12 -2.85 -1.26 -5.12 119.74 113.64 2k8d s LYS 5 Ca 0.00 -0.54 0.00 0.00 -1.00 0.00 0.00 55.97 54.44 2k8d s LYS 5 Cb 0.00 -2.14 -0.03 0.00 -2.06 0.00 0.00 37.83 33.60 2k8d s LYS 5 CO 0.00 -0.67 0.24 -0.51 0.10 0.00 0.00 175.35 174.51 2k8d s ASP 6 N 1.79 0.68 0.10 0.03 1.11 -1.26 -5.14 116.67 113.98 2k8d s ASP 6 Ca -0.00 -1.47 0.01 0.00 0.18 0.00 0.00 52.55 51.26 2k8d s ASP 6 Cb -0.17 0.48 -0.04 0.00 1.07 0.00 0.00 42.92 44.26 2k8d s ASP 6 CO -0.10 -0.98 -0.04 -0.13 1.18 0.00 0.00 175.17 175.10 2k8d s ARG 7 N -3.81 0.81 -0.01 8.23 1.81 -1.26 -3.41 118.95 121.30 2k8d s ARG 7 Ca 0.37 -1.33 0.01 0.00 -1.72 0.00 0.00 55.73 53.06 2k8d s ARG 7 Cb 0.04 -0.06 0.00 0.00 -0.45 0.00 0.00 34.95 34.49 2k8d s ARG 7 CO 0.17 -0.08 -0.04 0.96 -0.68 0.00 0.00 175.30 175.64 2k8d s ILE 8 N -3.75 0.37 -0.32 1.52 -4.36 0.95 -4.75 121.20 110.87 2k8d s ILE 8 Ca 0.13 -0.16 -0.29 0.00 -0.26 0.00 0.00 60.65 60.07 2k8d s ILE 8 Cb 0.06 -0.35 0.00 0.00 1.25 0.00 0.00 42.46 43.43 2k8d s ILE 8 CO -0.05 0.13 1.30 -2.16 0.24 0.00 0.00 174.94 174.40 2k8d s PRO 9 N 0.17 3.88 -0.04 0.37 0.04 -1.26 -1.03 135.00 137.13 2k8d s PRO 9 Ca -0.02 1.17 -0.22 0.00 0.04 0.00 0.00 61.00 61.98 2k8d s PRO 9 Cb -0.05 -3.89 -0.05 0.00 0.04 0.00 0.00 34.50 30.55 2k8d s PRO 9 CO -0.00 -1.17 0.65 0.42 0.04 0.00 0.00 177.00 176.94 2k8d s ILE 10 N 4.46 4.97 -0.35 0.56 -1.09 -1.04 -3.96 121.20 124.76 2k8d s ILE 10 Ca 0.56 1.35 0.00 0.00 -2.23 0.00 0.00 60.65 60.33 2k8d s ILE 10 Cb -0.16 -3.99 0.11 0.00 -1.58 0.00 0.00 42.46 36.85 2k8d s ILE 10 CO 0.24 0.33 0.15 -0.36 -1.23 0.00 0.00 174.94 174.07 2k8d s PHE 11 N 0.33 1.65 -0.69 3.97 0.40 -1.26 -0.32 117.98 122.06 2k8d s PHE 11 Ca 0.34 -1.90 -0.07 0.00 -0.60 0.00 0.00 56.93 54.70 2k8d s PHE 11 Cb -0.18 -1.67 -0.06 0.00 0.51 0.00 0.00 43.02 41.62 2k8d s PHE 11 CO 0.18 -0.84 1.85 0.43 0.70 0.00 0.00 175.22 177.53 2k8d n SER 12 N 4.40 3.57 -0.28 1.36 7.64 -0.52 -4.62 113.62 125.16 2k8d n SER 12 Ca 0.02 -2.29 0.16 0.00 1.01 0.00 0.00 58.87 57.77 2k8d n SER 12 Cb 0.39 -0.96 0.44 0.00 -1.01 0.00 0.00 64.21 63.07 2k8d n SER 12 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2k8d h VAL 13 N 3.70 0.72 0.00 0.44 2.07 -1.93 0.14 116.25 121.39 2k8d h VAL 13 Ca 0.38 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.71 2k8d h VAL 13 Cb 0.19 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.07 2k8d h VAL 13 CO 1.42 0.10 0.00 0.00 0.02 0.00 0.00 177.57 179.11 2k8d h ALA 14 N 1.61 1.00 -0.10 1.67 0.00 -1.84 0.18 119.26 121.79 2k8d h ALA 14 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.40 2k8d h ALA 14 Cb 1.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2k8d h ALA 14 CO -0.23 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.65 2k8d n LYS 15 N -2.85 1.29 -3.99 0.00 5.02 -0.14 -4.98 118.16 112.50 2k8d n LYS 15 Ca 0.00 -1.49 -0.39 0.00 -2.02 0.00 0.00 58.31 54.41 2k8d n LYS 15 Cb 0.23 -1.28 0.01 0.00 -0.02 0.00 0.00 35.03 33.97 2k8d n LYS 15 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2k8d n ASN 16 N 0.77 -3.71 -4.54 4.39 5.15 0.64 -5.04 115.26 112.91 2k8d n ASN 16 Ca 0.09 -1.12 -0.25 0.00 -0.60 0.00 0.00 54.58 52.70 2k8d n ASN 16 Cb 0.37 -1.40 -0.11 0.00 -0.53 0.00 0.00 39.78 38.11 2k8d n ASN 16 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2k8d s ARG 17 N -6.83 1.82 -0.14 1.20 1.81 0.29 -4.94 118.95 112.15 2k8d s ARG 17 Ca 0.37 -2.01 -0.06 0.00 -1.72 0.00 0.00 55.73 52.32 2k8d s ARG 17 Cb -0.21 -1.37 0.06 0.00 -0.45 0.00 0.00 34.95 32.99 2k8d s ARG 17 CO 0.86 -0.07 0.31 0.08 -0.68 0.00 0.00 175.30 175.79 2k8d s VAL 18 N -2.91 -0.29 -0.33 3.52 1.01 -1.26 -1.44 120.40 118.70 2k8d s VAL 18 Ca 0.35 0.20 -0.00 0.00 0.00 0.00 0.00 61.98 62.52 2k8d s VAL 18 Cb 0.08 -0.49 0.13 0.00 0.00 0.00 0.00 36.38 36.11 2k8d s VAL 18 CO 0.17 0.08 0.26 -1.83 0.00 0.00 0.00 175.10 173.78 2k8d s GLU 19 N 1.97 0.43 0.26 2.72 1.03 0.56 -4.97 118.70 120.70 2k8d s GLU 19 Ca -0.04 -0.69 -0.29 0.00 0.03 0.00 0.00 54.97 53.98 2k8d s GLU 19 Cb -0.11 -0.93 -0.09 0.00 -0.80 0.00 0.00 34.13 32.20 2k8d s GLU 19 CO -0.10 -1.11 1.26 1.41 -1.33 0.00 0.00 175.26 175.39 2k8d s MET 20 N 1.76 4.43 0.11 -4.83 1.75 -1.26 -2.48 119.30 118.78 2k8d s MET 20 Ca 0.13 2.06 0.02 0.00 -1.25 0.00 0.00 55.69 56.65 2k8d s MET 20 Cb -0.17 -3.15 -0.04 0.00 2.84 0.00 0.00 34.83 34.31 2k8d s MET 20 CO -0.18 -0.13 -0.07 0.08 -0.65 0.00 0.00 175.02 174.07 2k8d s VAL 21 N -0.61 0.78 0.70 10.11 1.01 -0.20 -4.89 120.40 127.28 2k8d s VAL 21 Ca 0.51 -1.96 -0.14 0.00 0.00 0.00 0.00 61.98 60.39 2k8d s VAL 21 Cb -0.37 -1.71 0.02 0.00 0.00 0.00 0.00 36.38 34.32 2k8d s VAL 21 CO 0.44 -0.85 1.12 -1.61 0.00 0.00 0.00 175.10 174.21 2k8d s GLU 22 N -3.82 2.55 0.57 2.72 2.02 -1.26 -0.04 118.70 121.44 2k8d s GLU 22 Ca 0.13 1.42 -0.16 0.00 0.02 0.00 0.00 54.97 56.38 2k8d s GLU 22 Cb 0.05 -1.92 -0.05 0.00 0.10 0.00 0.00 34.13 32.32 2k8d s GLU 22 CO -0.04 -1.45 1.05 -0.98 0.02 0.00 0.00 175.26 173.86 2k8d s ARG 23 N -4.20 3.44 0.28 1.61 1.70 -1.22 -4.60 118.95 115.96 2k8d s ARG 23 Ca 0.67 1.20 -0.30 0.00 -0.47 0.00 0.00 55.73 56.83 2k8d s ARG 23 Cb -0.21 -2.05 -0.11 0.00 -0.57 0.00 0.00 34.95 32.00 2k8d s ARG 23 CO 0.45 -0.71 1.61 -1.50 -1.08 0.00 0.00 175.30 174.06 2k8d s ILE 24 N -2.42 2.08 -0.29 4.99 2.07 -1.26 -4.98 121.20 121.39 2k8d s ILE 24 Ca 0.64 0.06 -0.13 0.00 -1.41 0.00 0.00 60.65 59.81 2k8d s ILE 24 Cb -0.15 -3.04 0.12 0.00 0.13 0.00 0.00 42.46 39.52 2k8d s ILE 24 CO 0.34 0.01 0.75 -0.70 -1.91 0.00 0.00 174.94 173.43 2k8d s GLU 25 N -0.30 0.55 0.31 3.50 2.56 -1.26 -5.03 118.70 119.02 2k8d s GLU 25 Ca 0.64 1.20 0.07 0.00 0.00 0.00 0.00 54.97 56.89 2k8d s GLU 25 Cb -0.48 0.54 -0.02 0.00 2.00 0.00 0.00 34.13 36.17 2k8d s GLU 25 CO 0.46 -0.16 0.27 1.28 -0.56 0.00 0.00 175.26 176.55 2k8d n LEU 26 N 4.91 0.00 0.00 2.70 4.77 -1.26 -5.11 117.00 123.01 2k8d n LEU 26 Ca -0.14 -2.90 0.00 0.00 -0.03 0.00 0.00 56.01 52.94 2k8d n LEU 26 Cb 0.53 1.59 0.00 0.00 -2.33 0.00 0.00 43.42 43.21 2k8d n LEU 26 CO -0.03 -0.49 0.00 -0.24 -1.33 0.00 0.00 177.39 175.30 2k8d n SER 27 N -1.78 0.00 0.00 -1.43 2.88 -1.26 -5.11 113.62 106.92 2k8d n SER 27 Ca 0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 2k8d n SER 27 Cb 0.56 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 2k8d n SER 27 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2k8d n ASP 28 N 0.00 0.00 0.00 -3.46 2.03 -1.26 -4.96 116.55 108.90 2k8d n ASP 28 Ca 0.00 0.00 0.03 0.00 0.52 0.00 0.00 54.79 55.34 2k8d n ASP 28 Cb 0.00 0.00 0.17 0.00 -0.72 0.00 0.00 41.12 40.57 2k8d n ASP 28 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2k8d n ASP 29 N 0.00 0.00 -0.11 1.67 2.03 -1.26 -4.22 116.55 114.66 2k8d n ASP 29 Ca 0.00 -0.34 -0.08 0.00 0.52 0.00 0.00 54.79 54.89 2k8d n ASP 29 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2k8d n ASP 29 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2k8d h GLU 30 N 0.00 0.45 -2.30 -0.67 5.08 -1.98 -2.55 114.58 112.61 2k8d h GLU 30 Ca 0.00 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 2k8d h GLU 30 Cb 0.00 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 2k8d h GLU 30 CO 0.00 0.30 0.05 0.91 -1.00 0.00 0.00 179.01 179.27 2k8d n TRP 31 N -4.86 0.00 0.00 4.33 7.02 -1.26 -0.87 117.44 121.80 2k8d n TRP 31 Ca 0.00 -0.60 0.00 0.00 -1.02 0.00 0.00 57.50 55.89 2k8d n TRP 31 Cb 0.04 -0.70 0.00 0.00 -2.42 0.00 0.00 31.31 28.23 2k8d n TRP 31 CO 0.00 0.00 0.00 2.89 -2.02 0.00 0.00 177.69 178.56 2k8d n ARG 32 N 2.33 0.00 0.08 -0.99 0.00 -0.97 -4.15 116.66 112.96 2k8d n ARG 32 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.97 2k8d n ARG 32 Cb 0.34 0.00 -0.04 0.00 -0.00 0.00 0.00 32.46 32.76 2k8d n ARG 32 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.63 178.68 2k8d h GLU 33 N 0.00 0.00 -0.31 2.89 4.11 -1.23 -3.32 114.58 116.72 2k8d h GLU 33 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2k8d h GLU 33 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2k8d h GLU 33 CO 0.00 0.45 0.00 0.44 0.07 0.00 0.00 179.01 179.97 2k8d n ILE 34 N -3.08 2.18 -4.13 -1.06 -5.35 -0.05 -5.03 119.36 102.83 2k8d n ILE 34 Ca -0.04 -1.72 -0.14 0.00 -0.27 0.00 0.00 62.75 60.59 2k8d n ILE 34 Cb 0.80 -0.16 -0.06 0.00 -1.74 0.00 0.00 39.64 38.48 2k8d n ILE 34 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2k8d s LEU 35 N -2.59 1.03 0.37 7.28 1.43 -1.25 -4.98 118.68 119.98 2k8d s LEU 35 Ca 0.42 -1.40 -0.27 0.00 -1.03 0.00 0.00 54.13 51.85 2k8d s LEU 35 Cb 0.32 1.11 -0.09 0.00 0.03 0.00 0.00 46.19 47.57 2k8d s LEU 35 CO 0.11 -1.12 1.28 -1.81 0.23 0.00 0.00 176.35 175.04 2k8d s ASP 36 N -3.20 6.53 0.26 2.29 1.01 -1.26 -4.74 116.67 117.56 2k8d s ASP 36 Ca 0.33 2.62 0.23 0.00 0.71 0.00 0.00 52.55 56.44 2k8d s ASP 36 Cb 0.02 -2.64 0.99 0.00 1.01 0.00 0.00 42.92 42.30 2k8d s ASP 36 CO 0.17 -0.70 1.69 -0.81 0.21 0.00 0.00 175.17 175.74 2k8d n PRO 37 N 0.39 0.18 0.05 8.23 -0.04 -1.26 -1.48 135.00 141.07 2k8d n PRO 37 Ca 0.02 0.45 -0.20 0.00 -0.04 0.00 0.00 63.50 63.73 2k8d n PRO 37 Cb 0.43 -1.87 -0.14 0.00 -0.04 0.00 0.00 33.50 31.88 2k8d n PRO 37 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2k8d h GLU 38 N 0.00 0.35 -0.92 0.54 4.57 -1.98 -3.22 114.58 113.92 2k8d h GLU 38 Ca 0.00 -0.54 -0.01 0.00 -1.18 0.00 0.00 59.36 57.63 2k8d h GLU 38 Cb 0.31 0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 29.05 2k8d h GLU 38 CO 0.00 1.24 0.55 0.00 -1.18 0.00 0.00 179.01 179.61 2k8d h ALA 39 N 0.14 1.23 -0.36 2.92 0.00 -1.59 0.15 119.26 121.74 2k8d h ALA 39 Ca -0.14 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.72 2k8d h ALA 39 Cb 1.63 -0.37 -0.08 0.00 0.00 0.00 0.00 17.79 18.96 2k8d h ALA 39 CO 0.16 0.65 -0.49 0.35 0.00 0.00 0.00 179.25 179.92 2k8d h PHE 40 N 1.27 -1.45 -0.16 0.00 3.57 -1.48 0.98 116.94 119.66 2k8d h PHE 40 Ca 0.33 0.07 -0.17 0.00 3.53 0.00 0.00 57.97 61.73 2k8d h PHE 40 Cb -0.04 0.69 0.01 0.00 2.79 0.00 0.00 35.95 39.39 2k8d h PHE 40 CO 0.01 -0.48 -0.56 0.07 -2.23 0.00 0.00 178.31 175.12 2k8d h ARG 41 N -0.39 0.66 -0.88 1.11 0.11 -1.38 -3.08 114.38 110.52 2k8d h ARG 41 Ca 0.10 -0.50 0.19 0.00 0.10 0.00 0.00 59.98 59.87 2k8d h ARG 41 Cb 0.60 0.09 -0.07 0.00 1.11 0.00 0.00 29.97 31.71 2k8d h ARG 41 CO -0.56 1.12 0.58 0.28 0.10 0.00 0.00 179.97 181.49 2k8d h VAL 42 N 0.34 0.72 0.00 0.08 2.07 -0.54 0.17 116.25 119.09 2k8d h VAL 42 Ca -0.02 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.34 2k8d h VAL 42 Cb 1.19 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2k8d h VAL 42 CO 0.12 0.08 0.00 0.00 0.02 0.00 0.00 177.57 177.79 2k8d n ALA 43 N -2.50 1.30 -0.02 1.67 0.00 0.32 -1.16 120.51 120.12 2k8d n ALA 43 Ca 0.19 -0.02 -0.03 0.00 0.00 0.00 0.00 53.44 53.57 2k8d n ALA 43 Cb 0.64 -1.09 -0.02 0.00 0.00 0.00 0.00 19.45 18.98 2k8d n ALA 43 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2k8d n ARG 44 N -1.44 0.55 -0.13 0.00 1.85 0.50 -4.71 116.66 113.28 2k8d n ARG 44 Ca 0.02 0.02 0.05 0.00 -1.00 0.00 0.00 57.85 56.94 2k8d n ARG 44 Cb 0.06 -1.10 0.15 0.00 -1.05 0.00 0.00 32.46 30.52 2k8d n ARG 44 CO 0.00 0.00 0.00 0.36 -0.01 0.00 0.00 177.63 177.98 2k8d n LYS 45 N -2.58 1.61 0.00 2.89 2.85 -0.58 -4.92 118.16 117.44 2k8d n LYS 45 Ca -0.08 -0.95 0.00 0.00 -1.05 0.00 0.00 58.31 56.23 2k8d n LYS 45 Cb 0.60 -1.22 0.00 0.00 -0.65 0.00 0.00 35.03 33.75 2k8d n LYS 45 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2k8d n ALA 46 N 0.26 0.00 0.00 0.58 0.00 -0.31 -3.29 120.51 117.75 2k8d n ALA 46 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2k8d n ALA 46 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.68 2k8d n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k8d n GLY 47 N 0.00 -2.20 2.91 0.00 0.00 -1.20 -4.60 105.19 100.10 2k8d n GLY 47 Ca 0.00 0.72 -0.22 0.00 0.00 0.00 0.00 46.02 46.52 2k8d n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2k8d s THR 48 N 0.00 0.69 0.15 2.61 -4.23 -1.21 -4.67 115.64 108.97 2k8d s THR 48 Ca 0.00 -0.19 -0.28 0.00 -1.18 0.00 0.00 61.69 60.04 2k8d s THR 48 Cb 0.00 -0.70 -0.03 0.00 1.34 0.00 0.00 72.50 73.11 2k8d s THR 48 CO 0.00 0.27 1.57 -0.33 -0.54 0.00 0.00 174.62 175.59 2k8d h GLU 49 N 7.34 -0.35 -7.50 3.99 5.08 -2.00 -3.41 114.58 117.73 2k8d h GLU 49 Ca -0.34 0.02 -0.48 0.00 -1.00 0.00 0.00 59.36 57.56 2k8d h GLU 49 Cb 1.16 0.08 0.08 0.00 0.50 0.00 0.00 28.75 30.57 2k8d h GLU 49 CO 0.44 -0.23 0.40 -1.25 -1.00 0.00 0.00 179.01 177.37 2k8d s PRO 50 N -5.81 2.57 -0.96 2.33 0.04 -1.26 -4.96 135.00 126.95 2k8d s PRO 50 Ca -0.15 0.32 -0.07 0.00 0.04 0.00 0.00 61.00 61.14 2k8d s PRO 50 Cb 0.11 -2.01 -0.09 0.00 0.04 0.00 0.00 34.50 32.54 2k8d s PRO 50 CO 0.64 -1.20 2.51 -0.35 0.04 0.00 0.00 177.00 178.65 2k8d n PRO 51 N -3.08 2.47 -2.33 0.56 -0.04 -1.26 -4.86 135.00 126.46 2k8d n PRO 51 Ca 0.07 -1.54 -0.35 0.00 -0.04 0.00 0.00 63.50 61.64 2k8d n PRO 51 Cb 0.58 -2.44 -0.04 0.00 -0.04 0.00 0.00 33.50 31.56 2k8d n PRO 51 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2k8d s PHE 52 N 2.65 2.22 -0.80 0.54 5.36 -1.26 -4.90 117.98 121.79 2k8d s PHE 52 Ca 0.51 -0.23 -0.24 0.00 -0.96 0.00 0.00 56.93 56.01 2k8d s PHE 52 Cb 0.15 -4.40 -0.17 0.00 -0.34 0.00 0.00 43.02 38.26 2k8d s PHE 52 CO -0.04 -1.80 1.89 2.41 -1.46 0.00 0.00 175.22 176.22 2k8d n THR 53 N 7.31 1.50 -1.39 0.12 -1.04 -1.26 -4.86 114.28 114.65 2k8d n THR 53 Ca 0.38 -1.40 -0.40 0.00 -2.04 0.00 0.00 64.05 60.58 2k8d n THR 53 Cb 0.49 -2.21 -0.05 0.00 -1.82 0.00 0.00 70.33 66.73 2k8d n THR 53 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2k8d n GLY 54 N 5.05 2.33 2.74 3.41 0.00 -1.26 -4.85 105.19 112.61 2k8d n GLY 54 Ca 0.47 -1.17 -0.35 0.00 0.00 0.00 0.00 46.02 44.97 2k8d n GLY 54 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2k8d n LYS 55 N 7.26 2.29 -1.91 1.61 4.81 -1.26 -4.85 118.16 126.10 2k8d n LYS 55 Ca 0.49 -1.91 -0.31 0.00 -0.87 0.00 0.00 58.31 55.71 2k8d n LYS 55 Cb 0.42 -2.81 -0.06 0.00 0.02 0.00 0.00 35.03 32.60 2k8d n LYS 55 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2k8d n TYR 56 N 5.52 2.62 1.38 5.64 4.01 -1.26 -4.77 117.16 130.30 2k8d n TYR 56 Ca 0.53 -1.56 0.12 0.00 -0.16 0.00 0.00 57.90 56.82 2k8d n TYR 56 Cb 0.28 -2.45 0.45 0.00 -0.31 0.00 0.00 39.34 37.31 2k8d n TYR 56 CO 0.00 0.00 0.00 -2.39 -0.46 0.00 0.00 176.86 174.01 2k8d n HIS 57 N 12.96 0.12 -2.46 -0.72 1.44 -1.26 -4.95 115.22 120.34 2k8d n HIS 57 Ca 0.46 -0.06 -0.35 0.00 -2.01 0.00 0.00 57.72 55.76 2k8d n HIS 57 Cb 0.45 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.54 2k8d n HIS 57 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 2k8d s ASP 58 N -1.74 6.31 -0.32 4.39 2.15 -1.26 -4.62 116.67 121.59 2k8d s ASP 58 Ca 0.35 2.04 0.02 0.00 0.43 0.00 0.00 52.55 55.38 2k8d s ASP 58 Cb 0.19 -2.57 0.15 0.00 -0.30 0.00 0.00 42.92 40.38 2k8d s ASP 58 CO 0.29 -0.80 0.37 -0.76 -0.17 0.00 0.00 175.17 174.10 2k8d s LEU 59 N -3.29 -0.42 0.00 -1.34 1.43 -1.26 -5.05 118.68 108.74 2k8d s LEU 59 Ca 0.66 -0.89 0.00 0.00 -1.03 0.00 0.00 54.13 52.86 2k8d s LEU 59 Cb -0.20 0.79 0.00 0.00 0.03 0.00 0.00 46.19 46.80 2k8d s LEU 59 CO 0.24 -0.33 0.00 1.57 0.23 0.00 0.00 176.35 178.07 2k8d n HIS 60 N 4.95 0.00 -1.62 0.29 -0.00 -1.26 -5.08 115.22 112.50 2k8d n HIS 60 Ca 0.03 0.00 -0.25 0.00 0.46 0.00 0.00 57.72 57.97 2k8d n HIS 60 Cb 0.47 0.09 0.18 0.00 -0.12 0.00 0.00 29.99 30.62 2k8d n HIS 60 CO 0.00 0.00 0.00 -0.40 0.46 0.00 0.00 176.34 176.40 2k8d n ASP 61 N -1.82 -0.31 -4.69 0.26 5.75 -1.26 -5.08 116.55 109.41 2k8d n ASP 61 Ca 0.00 -1.34 -0.29 0.00 -0.01 0.00 0.00 54.79 53.15 2k8d n ASP 61 Cb 0.00 -0.86 0.16 0.00 -1.03 0.00 0.00 41.12 39.40 2k8d n ASP 61 CO 0.00 0.00 0.00 1.51 -0.11 0.00 0.00 177.20 178.60 2k8d s ASP 62 N -4.90 2.89 0.00 -1.12 1.47 -1.26 -5.06 116.67 108.69 2k8d s ASP 62 Ca 0.63 1.29 0.00 0.00 1.18 0.00 0.00 52.55 55.65 2k8d s ASP 62 Cb -0.02 -1.96 0.00 0.00 -0.34 0.00 0.00 42.92 40.59 2k8d s ASP 62 CO 0.45 -2.98 0.00 0.61 0.68 0.00 0.00 175.17 173.93 2k8d n GLY 63 N -1.09 2.81 3.35 2.12 0.00 -1.26 -4.54 105.19 106.59 2k8d n GLY 63 Ca 0.06 -0.94 -0.15 0.00 0.00 0.00 0.00 46.02 44.99 2k8d n GLY 63 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2k8d s ILE 64 N -2.00 0.00 -0.23 -0.61 -4.36 -0.16 -2.93 121.20 110.92 2k8d s ILE 64 Ca 0.00 -1.82 -0.17 0.00 -0.26 0.00 0.00 60.65 58.40 2k8d s ILE 64 Cb 0.00 -2.50 -0.03 0.00 1.25 0.00 0.00 42.46 41.17 2k8d s ILE 64 CO 0.00 0.00 0.46 -0.31 0.24 0.00 0.00 174.94 175.33 2k8d s TYR 65 N -3.62 3.32 -0.35 1.37 2.02 -0.08 -1.25 117.35 118.76 2k8d s TYR 65 Ca 0.35 0.62 -0.27 0.00 -0.37 0.00 0.00 57.07 57.41 2k8d s TYR 65 Cb 0.03 -2.63 0.01 0.00 -0.40 0.00 0.00 41.96 38.97 2k8d s TYR 65 CO 0.19 -0.15 0.97 1.03 -1.57 0.00 0.00 175.55 176.01 2k8d s ARG 66 N 1.82 3.92 -0.78 -0.62 1.81 0.52 -0.95 118.95 124.67 2k8d s ARG 66 Ca 0.20 0.73 -0.25 0.00 -1.72 0.00 0.00 55.73 54.68 2k8d s ARG 66 Cb -0.15 -3.78 -0.03 0.00 -0.45 0.00 0.00 34.95 30.54 2k8d s ARG 66 CO 0.09 -0.93 1.87 0.00 -0.68 0.00 0.00 175.30 175.65 2k8d h ILE 68 N 7.04 1.02 -0.05 0.00 2.10 -1.05 -1.24 117.51 125.33 2k8d h ILE 68 Ca -0.06 -0.13 0.00 0.00 1.08 0.00 0.00 64.86 65.75 2k8d h ILE 68 Cb 1.07 0.59 0.00 0.00 -1.09 0.00 0.00 36.82 37.40 2k8d h ILE 68 CO 1.23 0.07 0.00 0.00 -1.08 0.00 0.00 178.15 178.37 2k8d n GLY 71 N 0.00 0.45 3.15 0.00 0.00 -0.52 -4.92 105.19 103.34 2k8d n GLY 71 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2k8d n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k8d s THR 72 N -2.78 2.00 0.48 2.61 2.01 -0.97 -4.94 115.64 114.06 2k8d s THR 72 Ca 0.00 -0.94 -0.23 0.00 0.31 0.00 0.00 61.69 60.83 2k8d s THR 72 Cb 0.00 -1.78 -0.07 0.00 0.01 0.00 0.00 72.50 70.67 2k8d s THR 72 CO 0.00 0.54 1.29 1.51 -0.69 0.00 0.00 174.62 177.27 2k8d s ASP 73 N 0.88 5.83 0.00 3.53 -4.77 -1.26 0.14 116.67 121.02 2k8d s ASP 73 Ca -0.06 2.61 0.00 0.00 -3.30 0.00 0.00 52.55 51.80 2k8d s ASP 73 Cb -0.15 -2.63 0.00 0.00 -1.09 0.00 0.00 42.92 39.05 2k8d s ASP 73 CO -0.03 -1.18 0.00 0.00 0.70 0.00 0.00 175.17 174.66 2k8d n LEU 74 N -0.54 0.00 -4.67 2.11 -0.00 -0.12 -4.81 117.00 108.98 2k8d n LEU 74 Ca 0.07 0.00 -0.47 0.00 -0.00 0.00 0.00 56.01 55.61 2k8d n LEU 74 Cb 0.45 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.83 2k8d n LEU 74 CO 0.52 0.00 1.25 0.49 -0.00 0.00 0.00 177.39 179.65 2k8d n PHE 75 N 0.00 2.21 -3.32 1.47 3.72 -1.26 -4.51 117.46 115.77 2k8d n PHE 75 Ca 0.00 0.24 -0.32 0.00 -0.05 0.00 0.00 57.45 57.32 2k8d n PHE 75 Cb 0.00 -2.55 -0.05 0.00 -0.94 0.00 0.00 39.48 35.93 2k8d n PHE 75 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2k8d s ASP 76 N 1.76 6.64 0.57 4.37 -1.08 -1.26 -0.90 116.67 126.78 2k8d s ASP 76 Ca 0.83 1.00 0.25 0.00 -0.52 0.00 0.00 52.55 54.12 2k8d s ASP 76 Cb -0.72 -2.26 1.63 0.00 -1.46 0.00 0.00 42.92 40.11 2k8d s ASP 76 CO 0.43 -0.13 2.20 0.28 0.52 0.00 0.00 175.17 178.47 2k8d h SER 77 N 2.35 0.00 0.90 -0.34 0.02 -1.76 0.12 113.55 114.84 2k8d h SER 77 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 2k8d h SER 77 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2k8d h SER 77 CO 0.68 0.00 0.00 1.05 -1.14 0.00 0.00 176.83 177.42 2k8d h GLU 78 N 0.00 0.00 0.00 3.45 4.11 -1.94 -2.48 114.58 117.72 2k8d h GLU 78 Ca 0.02 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.35 2k8d h GLU 78 Cb 0.09 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2k8d h GLU 78 CO -0.00 0.00 -1.79 0.25 0.07 0.00 0.00 179.01 177.54 2k8d n THR 79 N -2.74 0.58 -3.72 -1.06 -2.24 0.19 -4.76 114.28 100.53 2k8d n THR 79 Ca 0.01 -0.61 -0.28 0.00 -2.27 0.00 0.00 64.05 60.91 2k8d n THR 79 Cb 0.27 -0.28 -0.11 0.00 -2.10 0.00 0.00 70.33 68.11 2k8d n THR 79 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2k8d n LYS 80 N -2.54 1.44 -3.95 -0.78 0.00 0.11 -1.57 118.16 110.88 2k8d n LYS 80 Ca -0.10 -4.14 -0.28 0.00 0.00 0.00 0.00 58.31 53.79 2k8d n LYS 80 Cb 0.72 -2.10 -0.17 0.00 0.00 0.00 0.00 35.03 33.48 2k8d n LYS 80 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.40 177.52 2k8d s PHE 81 N -1.16 1.82 0.15 5.64 2.19 -1.19 -4.52 117.98 120.91 2k8d s PHE 81 Ca 0.28 -1.03 0.01 0.00 0.33 0.00 0.00 56.93 56.53 2k8d s PHE 81 Cb -0.00 -1.40 -0.04 0.00 -1.31 0.00 0.00 43.02 40.27 2k8d s PHE 81 CO -0.17 -0.60 -0.00 0.34 1.83 0.00 0.00 175.22 176.62 2k8d s ASP 82 N 1.60 1.09 -0.02 6.13 -1.08 -1.26 -4.97 116.67 118.15 2k8d s ASP 82 Ca 0.04 -1.14 0.01 0.00 -0.52 0.00 0.00 52.55 50.93 2k8d s ASP 82 Cb -0.13 0.14 0.01 0.00 -1.46 0.00 0.00 42.92 41.47 2k8d s ASP 82 CO -0.09 -0.57 -0.03 -0.55 0.52 0.00 0.00 175.17 174.45 2k8d s SER 83 N -3.13 0.56 0.00 -0.34 0.15 -1.26 -3.31 113.70 106.37 2k8d s SER 83 Ca 0.22 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.79 2k8d s SER 83 Cb 0.06 -0.16 0.00 0.00 -1.71 0.00 0.00 66.02 64.21 2k8d s SER 83 CO 0.02 0.00 0.00 0.61 1.20 0.00 0.00 173.24 175.07 2k8d n GLY 84 N 3.42 0.91 0.05 9.45 0.00 -1.26 -4.38 105.19 113.38 2k8d n GLY 84 Ca -0.18 -0.01 -0.02 0.00 0.00 0.00 0.00 46.02 45.81 2k8d n GLY 84 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2k8d h THR 85 N 0.00 0.00 -0.30 2.61 2.02 -1.94 -3.47 112.91 111.83 2k8d h THR 85 Ca 0.00 -0.01 -0.07 0.00 0.77 0.00 0.00 66.41 67.10 2k8d h THR 85 Cb 0.00 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.38 2k8d h THR 85 CO 0.00 0.00 -0.06 0.61 0.37 0.00 0.00 175.52 176.44 2k8d n GLY 86 N -0.78 0.32 3.45 2.16 0.00 -1.21 -4.80 105.19 104.33 2k8d n GLY 86 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2k8d n GLY 86 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2k8d n TRP 87 N -1.50 -1.01 -1.25 1.61 4.27 -1.26 -4.80 117.44 113.50 2k8d n TRP 87 Ca -0.03 0.32 -0.40 0.00 -3.89 0.00 0.00 57.50 53.50 2k8d n TRP 87 Cb 0.37 -1.88 -0.04 0.00 -1.36 0.00 0.00 31.31 28.41 2k8d n TRP 87 CO 0.00 0.00 0.00 -0.35 -2.29 0.00 0.00 177.69 175.05 2k8d n PRO 88 N -0.85 2.04 -4.38 -2.67 -0.04 -1.26 -4.79 135.00 123.05 2k8d n PRO 88 Ca 0.09 -2.00 -0.20 0.00 -0.04 0.00 0.00 63.50 61.35 2k8d n PRO 88 Cb 0.51 -2.94 -0.14 0.00 -0.04 0.00 0.00 33.50 30.89 2k8d n PRO 88 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2k8d s SER 89 N 4.17 1.46 0.11 3.54 1.04 -1.26 -1.38 113.70 121.39 2k8d s SER 89 Ca 0.53 -0.36 0.02 0.00 0.48 0.00 0.00 55.95 56.62 2k8d s SER 89 Cb 0.14 -0.11 -0.04 0.00 0.10 0.00 0.00 66.02 66.11 2k8d s SER 89 CO 0.03 0.06 -0.07 0.72 0.98 0.00 0.00 173.24 174.96 2k8d s PHE 90 N -0.65 0.98 0.00 5.02 -0.71 0.32 -4.47 117.98 118.47 2k8d s PHE 90 Ca 0.02 -0.89 0.00 0.00 -1.04 0.00 0.00 56.93 55.02 2k8d s PHE 90 Cb -0.07 -0.55 0.00 0.00 -1.21 0.00 0.00 43.02 41.20 2k8d s PHE 90 CO 0.01 -0.11 0.77 2.48 -1.34 0.00 0.00 175.22 177.03 2k8d n TYR 91 N -0.08 0.00 -3.83 3.49 0.18 -0.61 -0.17 117.16 116.14 2k8d n TYR 91 Ca -0.11 -0.29 -0.09 0.00 1.88 0.00 0.00 57.90 59.29 2k8d n TYR 91 Cb 0.61 -0.03 0.01 0.00 -0.38 0.00 0.00 39.34 39.55 2k8d n TYR 91 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2k8d s ASP 92 N -0.59 -0.04 0.20 9.48 -1.08 -1.26 -4.51 116.67 118.89 2k8d s ASP 92 Ca 0.00 -1.03 0.04 0.00 -0.52 0.00 0.00 52.55 51.04 2k8d s ASP 92 Cb 0.00 0.82 -0.03 0.00 -1.46 0.00 0.00 42.92 42.24 2k8d s ASP 92 CO 0.00 -1.60 0.31 0.68 0.52 0.00 0.00 175.17 175.08 2k8d s VAL 93 N -2.72 5.20 0.09 1.11 -7.23 -1.26 -4.84 120.40 110.75 2k8d s VAL 93 Ca 0.15 -0.91 -0.18 0.00 -1.81 0.00 0.00 61.98 59.23 2k8d s VAL 93 Cb -0.05 -3.76 -0.07 0.00 0.56 0.00 0.00 36.38 33.05 2k8d s VAL 93 CO 0.11 -0.23 1.53 1.62 -0.31 0.00 0.00 175.10 177.81 2k8d h VAL 94 N 1.40 1.26 -1.02 1.32 3.04 -1.95 -3.48 116.25 116.82 2k8d h VAL 94 Ca -0.50 -0.92 0.35 0.00 -1.01 0.00 0.00 66.70 64.61 2k8d h VAL 94 Cb 1.22 1.33 -0.20 0.00 -2.01 0.00 0.00 31.29 31.63 2k8d h VAL 94 CO 0.64 0.29 0.99 -0.44 -1.01 0.00 0.00 177.57 178.04 2k8d s SER 95 N -5.98 -0.01 -0.95 3.17 0.01 -1.26 -4.96 113.70 103.73 2k8d s SER 95 Ca -0.14 -0.00 -0.07 0.00 1.31 0.00 0.00 55.95 57.05 2k8d s SER 95 Cb 0.08 0.01 -0.12 0.00 0.21 0.00 0.00 66.02 66.19 2k8d s SER 95 CO 0.75 -0.01 2.79 -0.62 0.41 0.00 0.00 173.24 176.56 2k8d n GLU 96 N -0.08 2.68 -0.01 12.44 4.71 -1.26 -4.38 120.64 134.74 2k8d n GLU 96 Ca 0.03 -1.60 -0.03 0.00 -0.01 0.00 0.00 57.16 55.56 2k8d n GLU 96 Cb 0.57 -2.44 -0.01 0.00 -1.01 0.00 0.00 31.44 28.55 2k8d n GLU 96 CO 0.00 0.00 0.00 -2.39 0.09 0.00 0.00 177.13 174.83 2k8d n HIS 97 N 3.44 0.00 -1.07 -0.32 1.44 -1.26 -4.77 115.22 112.68 2k8d n HIS 97 Ca 0.57 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 56.35 2k8d n HIS 97 Cb 0.37 -0.18 0.23 0.00 0.12 0.00 0.00 29.99 30.53 2k8d n HIS 97 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 2k8d n ASN 98 N -3.69 3.40 -4.63 4.39 3.02 -1.25 -4.41 115.26 112.08 2k8d n ASN 98 Ca -0.05 -3.13 -0.28 0.00 -0.03 0.00 0.00 54.58 51.09 2k8d n ASN 98 Cb 0.19 -0.53 -0.08 0.00 -0.61 0.00 0.00 39.78 38.74 2k8d n ASN 98 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2k8d s ILE 99 N -2.90 3.58 0.05 2.41 2.07 -1.26 -0.48 121.20 124.68 2k8d s ILE 99 Ca 0.41 -1.40 0.09 0.00 -1.41 0.00 0.00 60.65 58.33 2k8d s ILE 99 Cb 0.34 -2.76 -0.03 0.00 0.13 0.00 0.00 42.46 40.14 2k8d s ILE 99 CO 0.06 -0.04 -0.24 -0.75 -1.91 0.00 0.00 174.94 172.06 2k8d s LYS 100 N -2.71 1.56 -0.14 3.50 2.36 0.83 -4.37 119.74 120.77 2k8d s LYS 100 Ca 0.26 -1.06 -0.09 0.00 -2.55 0.00 0.00 55.97 52.53 2k8d s LYS 100 Cb -0.10 -1.74 0.05 0.00 -1.05 0.00 0.00 37.83 34.99 2k8d s LYS 100 CO 0.17 0.44 0.34 -0.51 1.55 0.00 0.00 175.35 177.35 2k8d s LEU 101 N -1.31 0.30 -0.27 5.43 1.43 -1.26 -2.05 118.68 120.96 2k8d s LEU 101 Ca 0.10 0.73 -0.04 0.00 -1.03 0.00 0.00 54.13 53.89 2k8d s LEU 101 Cb -0.09 1.13 0.09 0.00 0.03 0.00 0.00 46.19 47.34 2k8d s LEU 101 CO 0.02 -0.16 0.11 -0.13 0.23 0.00 0.00 176.35 176.43 2k8d s ARG 102 N 0.96 0.27 0.37 1.70 3.00 -1.26 -4.99 118.95 119.00 2k8d s ARG 102 Ca -0.06 -0.54 -0.26 0.00 0.00 0.00 0.00 55.73 54.87 2k8d s ARG 102 Cb -0.07 -1.42 -0.09 0.00 0.00 0.00 0.00 34.95 33.37 2k8d s ARG 102 CO -0.07 -0.95 1.09 -1.21 0.00 0.00 0.00 175.30 174.16 2k8d s GLU 103 N 2.02 4.27 0.36 3.54 2.02 -1.26 -2.99 118.70 126.66 2k8d s GLU 103 Ca 0.08 1.68 -0.11 0.00 0.02 0.00 0.00 54.97 56.64 2k8d s GLU 103 Cb -0.16 -2.76 0.03 0.00 0.10 0.00 0.00 34.13 31.34 2k8d s GLU 103 CO -0.30 -0.08 0.65 0.34 0.02 0.00 0.00 175.26 175.89 2k8d s ASP 104 N -1.26 0.36 -0.32 -0.19 2.15 0.94 -4.97 116.67 113.37 2k8d s ASP 104 Ca 0.54 -1.25 0.10 0.00 0.43 0.00 0.00 52.55 52.36 2k8d s ASP 104 Cb -0.27 0.76 0.69 0.00 -0.30 0.00 0.00 42.92 43.80 2k8d s ASP 104 CO 0.34 -1.50 1.74 -2.11 -0.17 0.00 0.00 175.17 173.47 2k8d n ARG 105 N -0.54 3.23 0.00 4.34 0.00 -1.26 -0.47 116.66 121.97 2k8d n ARG 105 Ca -0.04 -3.07 0.00 0.00 -0.00 0.00 0.00 57.85 54.74 2k8d n ARG 105 Cb 0.61 -2.12 0.00 0.00 -0.00 0.00 0.00 32.46 30.94 2k8d n ARG 105 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2k8d n SER 106 N -0.44 0.31 0.00 2.89 7.64 -1.26 -0.31 113.62 122.45 2k8d n SER 106 Ca 0.40 -0.65 0.00 0.00 1.01 0.00 0.00 58.87 59.64 2k8d n SER 106 Cb 1.33 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 64.37 2k8d n SER 106 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k8d n LEU 107 N 0.30 0.23 0.00 -3.43 -0.00 -1.26 -4.90 117.00 107.94 2k8d n LEU 107 Ca 0.00 -0.23 0.00 0.00 -0.00 0.00 0.00 56.01 55.78 2k8d n LEU 107 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.50 2k8d n LEU 107 CO 0.00 0.06 0.00 0.61 -0.00 0.00 0.00 177.39 178.06 2k8d n GLY 108 N -0.02 0.41 0.00 1.47 0.00 0.58 -4.98 105.19 102.65 2k8d n GLY 108 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2k8d n GLY 108 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2k8d n MET 109 N -1.80 0.00 -3.72 1.61 2.81 -1.23 -5.06 117.12 109.73 2k8d n MET 109 Ca 0.00 0.00 -0.27 0.00 -1.81 0.00 0.00 57.70 55.62 2k8d n MET 109 Cb 0.00 0.00 -0.17 0.00 -0.71 0.00 0.00 33.22 32.34 2k8d n MET 109 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2k8d s VAL 110 N 0.83 0.46 -0.05 2.03 -7.23 -1.26 -4.29 120.40 110.89 2k8d s VAL 110 Ca 0.00 -0.50 -0.01 0.00 -1.81 0.00 0.00 61.98 59.66 2k8d s VAL 110 Cb 0.00 -0.98 -0.03 0.00 0.56 0.00 0.00 36.38 35.93 2k8d s VAL 110 CO 0.00 -0.21 0.02 -0.60 -0.31 0.00 0.00 175.10 174.01 2k8d s ARG 111 N 1.89 2.97 -0.01 4.82 3.52 0.38 -3.38 118.95 129.15 2k8d s ARG 111 Ca -0.01 -0.45 0.01 0.00 -0.13 0.00 0.00 55.73 55.15 2k8d s ARG 111 Cb -0.17 -2.80 0.00 0.00 -1.56 0.00 0.00 34.95 30.43 2k8d s ARG 111 CO -0.08 0.68 -0.03 0.00 -0.81 0.00 0.00 175.30 175.06 2k8d s GLU 113 N 0.03 2.12 -0.22 0.00 -1.05 -1.16 -0.25 118.70 118.17 2k8d s GLU 113 Ca 0.00 1.85 -0.02 0.00 -0.15 0.00 0.00 54.97 56.65 2k8d s GLU 113 Cb -0.03 -1.82 0.07 0.00 -0.44 0.00 0.00 34.13 31.91 2k8d s GLU 113 CO -0.00 -1.87 0.05 0.08 0.95 0.00 0.00 175.26 174.46 2k8d s VAL 114 N -1.86 0.59 0.29 1.83 1.01 -0.10 -4.04 120.40 118.12 2k8d s VAL 114 Ca 0.76 -0.72 0.07 0.00 0.00 0.00 0.00 61.98 62.08 2k8d s VAL 114 Cb -0.31 -1.16 -0.06 0.00 0.00 0.00 0.00 36.38 34.85 2k8d s VAL 114 CO 0.45 -0.30 -0.05 -0.76 0.00 0.00 0.00 175.10 174.44 2k8d s LEU 115 N 1.82 2.48 0.42 3.92 1.02 -0.87 -1.62 118.68 125.85 2k8d s LEU 115 Ca 0.01 -1.21 -0.23 0.00 0.02 0.00 0.00 54.13 52.72 2k8d s LEU 115 Cb -0.17 -0.64 -0.09 0.00 0.02 0.00 0.00 46.19 45.31 2k8d s LEU 115 CO -0.12 -0.36 1.07 0.00 0.02 0.00 0.00 176.35 176.96 2k8d h ALA 117 N 2.26 0.42 -2.29 0.00 0.00 -0.98 -3.33 119.26 115.35 2k8d h ALA 117 Ca -0.49 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2k8d h ALA 117 Cb 1.22 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2k8d h ALA 117 CO 0.61 0.10 0.00 -2.13 0.00 0.00 0.00 179.25 177.83 2k8d n ARG 118 N -4.63 0.00 -2.09 0.00 3.00 -1.26 -4.78 116.66 106.89 2k8d n ARG 118 Ca -0.02 0.09 -0.41 0.00 -0.00 0.00 0.00 57.85 57.51 2k8d n ARG 118 Cb 0.20 -0.51 -0.01 0.00 0.00 0.00 0.00 32.46 32.14 2k8d n ARG 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2k8d n ASP 120 N 7.95 1.20 -1.01 0.00 5.75 -1.25 -4.16 116.55 125.03 2k8d n ASP 120 Ca 0.50 -2.48 0.00 0.00 -0.01 0.00 0.00 54.79 52.80 2k8d n ASP 120 Cb 0.43 -1.38 0.00 0.00 -1.03 0.00 0.00 41.12 39.14 2k8d n ASP 120 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k8d n ALA 121 N 16.89 0.00 0.23 2.12 0.00 -1.26 -5.03 120.51 133.46 2k8d n ALA 121 Ca 0.42 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.76 2k8d n ALA 121 Cb 0.46 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.86 2k8d n ALA 121 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2k8d h HIS 122 N 0.00 -0.59 0.00 0.00 2.76 -1.88 -3.46 115.15 111.98 2k8d h HIS 122 Ca 0.00 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 2k8d h HIS 122 Cb 0.00 0.20 0.00 0.00 1.55 0.00 0.00 27.41 29.16 2k8d h HIS 122 CO 0.00 -0.37 0.00 1.28 -1.30 0.00 0.00 177.93 177.54 2k8d n LEU 123 N -5.03 0.00 0.00 0.26 7.99 -1.25 -4.89 117.00 114.08 2k8d n LEU 123 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.92 2k8d n LEU 123 Cb 0.25 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.56 2k8d n LEU 123 CO 0.19 0.00 0.00 0.61 -1.51 0.00 0.00 177.39 176.68 2k8d n GLY 124 N 0.00 -0.49 3.76 -0.72 0.00 -0.64 0.07 105.19 107.17 2k8d n GLY 124 Ca 0.00 0.24 -0.09 0.00 0.00 0.00 0.00 46.02 46.17 2k8d n GLY 124 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k8d s HIS 125 N 0.00 0.18 0.03 1.61 -3.43 -0.72 -0.93 115.29 112.03 2k8d s HIS 125 Ca 0.00 -0.71 0.08 0.00 -0.80 0.00 0.00 55.06 53.63 2k8d s HIS 125 Cb 0.00 0.63 -0.03 0.00 -1.43 0.00 0.00 32.58 31.76 2k8d s HIS 125 CO 0.00 -1.38 -0.24 0.54 -2.00 0.00 0.00 174.74 171.66 2k8d s VAL 126 N -2.98 1.92 0.13 -5.38 0.11 0.66 -0.45 120.40 114.41 2k8d s VAL 126 Ca 0.17 -1.26 -0.03 0.00 -2.93 0.00 0.00 61.98 57.93 2k8d s VAL 126 Cb -0.04 -1.64 -0.03 0.00 -1.53 0.00 0.00 36.38 33.14 2k8d s VAL 126 CO 0.11 0.33 0.11 0.72 -3.33 0.00 0.00 175.10 173.05 2k8d s PHE 127 N -0.76 0.71 -0.56 1.54 -0.71 -0.16 -1.63 117.98 116.41 2k8d s PHE 127 Ca 0.10 -1.09 -0.27 0.00 -1.04 0.00 0.00 56.93 54.62 2k8d s PHE 127 Cb -0.09 -0.36 -0.01 0.00 -1.21 0.00 0.00 43.02 41.35 2k8d s PHE 127 CO 0.01 -0.56 1.69 0.34 -1.34 0.00 0.00 175.22 175.36 2k8d s ASP 128 N -3.02 5.67 0.03 1.98 -1.08 -1.22 -0.08 116.67 118.96 2k8d s ASP 128 Ca 0.21 0.42 0.00 0.00 -0.52 0.00 0.00 52.55 52.66 2k8d s ASP 128 Cb 0.06 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.99 2k8d s ASP 128 CO 0.00 -2.05 0.00 -0.67 0.52 0.00 0.00 175.17 172.97 2k8d n ASP 129 N 11.25 -0.31 -4.72 -0.34 -0.08 -1.26 -4.91 116.55 116.19 2k8d n ASP 129 Ca 0.17 0.07 -0.32 0.00 -1.51 0.00 0.00 54.79 53.20 2k8d n ASP 129 Cb 0.50 0.69 0.12 0.00 2.34 0.00 0.00 41.12 44.77 2k8d n ASP 129 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 2k8d s GLY 130 N -2.00 1.93 1.05 0.27 0.00 -1.24 -4.82 107.32 102.50 2k8d s GLY 130 Ca 0.00 0.61 -0.17 0.00 0.00 0.00 0.00 44.72 45.16 2k8d s GLY 130 CO 0.00 1.00 1.24 2.56 0.00 0.00 0.00 173.10 177.90 2k8d s PRO 131 N -4.43 -0.02 0.45 2.90 0.04 -1.26 -2.59 135.00 130.09 2k8d s PRO 131 Ca 0.68 -0.26 -0.22 0.00 0.04 0.00 0.00 61.00 61.23 2k8d s PRO 131 Cb -0.23 -1.75 -0.11 0.00 0.04 0.00 0.00 34.50 32.45 2k8d s PRO 131 CO 0.52 -2.88 0.79 2.89 0.04 0.00 0.00 177.00 178.36 2k8d n ARG 132 N -4.13 0.93 0.09 4.56 1.85 -1.26 -0.68 116.66 118.01 2k8d n ARG 132 Ca 0.14 0.34 0.01 0.00 -1.00 0.00 0.00 57.85 57.34 2k8d n ARG 132 Cb 0.59 -1.82 -0.03 0.00 -1.05 0.00 0.00 32.46 30.16 2k8d n ARG 132 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 2k8d h PRO 133 N 1.03 0.00 0.00 2.89 0.13 -1.95 -3.44 132.00 130.66 2k8d h PRO 133 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2k8d h PRO 133 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2k8d h PRO 133 CO 0.53 0.41 -1.03 2.41 -0.23 0.00 0.00 178.00 180.10 2k8d n THR 134 N -3.07 0.00 -1.04 1.56 -1.04 -1.20 -5.01 114.28 104.48 2k8d n THR 134 Ca -0.03 -0.24 -0.01 0.00 -2.04 0.00 0.00 64.05 61.73 2k8d n THR 134 Cb 0.78 0.67 -0.01 0.00 -1.82 0.00 0.00 70.33 69.96 2k8d n THR 134 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2k8d n GLY 135 N 1.48 0.50 3.20 3.41 0.00 0.14 -5.00 105.19 108.92 2k8d n GLY 135 Ca 0.00 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.27 2k8d n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k8d s LYS 136 N -1.50 0.83 -0.27 1.61 -2.85 -1.07 -4.04 119.74 112.45 2k8d s LYS 136 Ca 0.00 -0.92 0.03 0.00 -1.00 0.00 0.00 55.97 54.08 2k8d s LYS 136 Cb 0.00 0.34 0.06 0.00 -2.06 0.00 0.00 37.83 36.17 2k8d s LYS 136 CO 0.00 -0.26 -0.08 0.50 0.10 0.00 0.00 175.35 175.61 2k8d s ARG 137 N -3.70 2.17 0.26 1.78 3.52 0.88 -3.74 118.95 120.12 2k8d s ARG 137 Ca 0.04 -1.40 -0.30 0.00 -0.13 0.00 0.00 55.73 53.94 2k8d s ARG 137 Cb 0.04 -2.95 -0.09 0.00 -1.56 0.00 0.00 34.95 30.39 2k8d s ARG 137 CO -0.10 -0.62 1.13 0.71 -0.81 0.00 0.00 175.30 175.61 2k8d s TYR 138 N 1.09 3.53 -0.03 5.12 1.51 0.76 -0.99 117.35 128.34 2k8d s TYR 138 Ca -0.07 1.63 -0.01 0.00 -1.01 0.00 0.00 57.07 57.61 2k8d s TYR 138 Cb -0.20 -3.33 0.02 0.00 -0.11 0.00 0.00 41.96 38.34 2k8d s TYR 138 CO -0.05 -0.74 0.06 0.00 -1.11 0.00 0.00 175.55 173.72 2k8d s MET 140 N 0.74 0.98 -1.41 0.00 0.23 -0.48 -1.76 119.30 117.60 2k8d s MET 140 Ca -0.06 -0.94 -0.11 0.00 -1.03 0.00 0.00 55.69 53.54 2k8d s MET 140 Cb -0.08 -2.26 0.07 0.00 -1.53 0.00 0.00 34.83 31.03 2k8d s MET 140 CO -0.03 -0.80 2.21 -1.71 -2.03 0.00 0.00 175.02 172.67 2k8d n ASN 141 N 4.81 5.12 -4.50 -1.18 5.15 0.11 -4.73 115.26 120.04 2k8d n ASN 141 Ca -0.06 -2.92 -0.32 0.00 -0.60 0.00 0.00 54.58 50.68 2k8d n ASN 141 Cb 0.44 -1.57 -0.12 0.00 -0.53 0.00 0.00 39.78 38.00 2k8d n ASN 141 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2k8d s SER 142 N 2.11 4.11 0.17 1.20 1.04 -1.26 -3.78 113.70 117.30 2k8d s SER 142 Ca 0.48 -0.25 -0.10 0.00 0.48 0.00 0.00 55.95 56.56 2k8d s SER 142 Cb 0.13 -0.84 0.06 0.00 0.10 0.00 0.00 66.02 65.48 2k8d s SER 142 CO -0.06 0.30 1.64 0.00 0.98 0.00 0.00 173.24 176.11 2k8d h ALA 143 N 4.89 0.80 0.00 5.32 0.00 -1.93 -3.38 119.26 124.96 2k8d h ALA 143 Ca -0.47 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.14 2k8d h ALA 143 Cb 1.16 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2k8d h ALA 143 CO 0.50 0.61 0.00 0.00 0.00 0.00 0.00 179.25 180.37 2k8d n ALA 144 N -2.47 1.61 -2.83 0.00 0.00 -1.26 -4.73 120.51 110.84 2k8d n ALA 144 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.03 2k8d n ALA 144 Cb 0.33 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.78 2k8d n ALA 144 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2k8d n LEU 145 N 0.06 5.87 -4.56 0.00 4.77 -1.26 -0.49 117.00 121.38 2k8d n LEU 145 Ca 0.00 -4.71 -0.43 0.00 -0.03 0.00 0.00 56.01 50.84 2k8d n LEU 145 Cb 0.06 -1.51 -0.04 0.00 -2.33 0.00 0.00 43.42 39.59 2k8d n LEU 145 CO 0.00 1.16 0.68 -0.75 -1.33 0.00 0.00 177.39 177.15 2k8d s LYS 146 N 0.17 3.55 0.47 3.23 2.20 -0.81 -4.97 119.74 123.58 2k8d s LYS 146 Ca 0.38 0.15 -0.24 0.00 -0.36 0.00 0.00 55.97 55.90 2k8d s LYS 146 Cb 0.01 -3.90 -0.07 0.00 -1.51 0.00 0.00 37.83 32.35 2k8d s LYS 146 CO 0.00 -1.13 1.35 -0.06 -0.36 0.00 0.00 175.35 175.15 2k8d s PHE 147 N 3.53 2.53 0.21 4.03 0.08 -1.26 -0.35 117.98 126.74 2k8d s PHE 147 Ca 0.35 1.36 -0.04 0.00 0.12 0.00 0.00 56.93 58.72 2k8d s PHE 147 Cb -0.11 -3.76 -0.03 0.00 -0.57 0.00 0.00 43.02 38.55 2k8d s PHE 147 CO 0.24 -2.57 0.21 0.96 -0.10 0.00 0.00 175.22 173.95 2k8d s ILE 148 N -1.29 0.01 1.30 0.64 -4.36 -0.38 -4.84 121.20 112.28 2k8d s ILE 148 Ca 0.64 -1.85 -0.20 0.00 -0.26 0.00 0.00 60.65 58.99 2k8d s ILE 148 Cb -0.40 -2.39 0.30 0.00 1.25 0.00 0.00 42.46 41.23 2k8d s ILE 148 CO 0.49 -0.03 0.71 -0.81 0.24 0.00 0.00 174.94 175.54 2k8d n PRO 149 N -0.28 -3.69 0.00 0.37 -0.04 -1.26 -0.98 135.00 129.11 2k8d n PRO 149 Ca 0.01 -1.09 0.00 0.00 -0.04 0.00 0.00 63.50 62.38 2k8d n PRO 149 Cb 0.65 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.27 2k8d n PRO 149 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k8d n ARG 150 N -4.48 0.00 0.00 0.54 5.12 -1.26 -3.81 116.66 112.76 2k8d n ARG 150 Ca 0.09 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.01 2k8d n ARG 150 Cb 0.53 -1.07 0.00 0.00 -1.16 0.00 0.00 32.46 30.76 2k8d n ARG 150 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2k8d n ASP 151 N -0.35 0.00 -2.71 0.55 2.03 -1.26 -4.31 116.55 110.50 2k8d n ASP 151 Ca 0.00 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.28 2k8d n ASP 151 Cb 0.00 0.00 0.10 0.00 -0.72 0.00 0.00 41.12 40.50 2k8d n ASP 151 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k8d n GLN 152 N 0.00 1.38 0.23 -0.67 1.13 -1.26 -4.83 117.38 113.36 2k8d n GLN 152 Ca 0.00 -1.93 0.14 0.00 -1.94 0.00 0.00 57.00 53.26 2k8d n GLN 152 Cb 0.00 -0.19 0.32 0.00 0.11 0.00 0.00 30.24 30.49 2k8d n GLN 152 CO 0.00 0.00 0.00 -0.84 -1.44 0.00 0.00 177.06 174.78 2k8d h ILE 153 N 3.77 0.00 0.00 5.09 3.07 -1.90 -3.54 117.51 124.00 2k8d h ILE 153 Ca -0.33 -0.84 0.00 0.00 1.55 0.00 0.00 64.86 65.25 2k8d h ILE 153 Cb 1.28 1.83 0.00 0.00 -0.27 0.00 0.00 36.82 39.67 2k8d h ILE 153 CO -0.04 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.67