#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 0.50 0.00 0.03 1.02 -1.26 -5.04 119.74 114.99 2k8d s LYS 5 Ca 0.00 -0.72 0.00 0.00 0.02 0.00 0.00 55.97 55.27 2k8d s LYS 5 Cb 0.00 0.19 0.00 0.00 -0.52 0.00 0.00 37.83 37.50 2k8d s LYS 5 CO 0.00 -0.11 0.72 -0.25 -0.92 0.00 0.00 175.35 174.79 2k8d n ASP 6 N 1.01 1.98 -4.00 2.83 9.92 -1.26 -4.72 116.55 122.31 2k8d n ASP 6 Ca -0.20 -1.80 -0.08 0.00 -0.53 0.00 0.00 54.79 52.17 2k8d n ASP 6 Cb 0.57 -0.45 -0.09 0.00 -0.64 0.00 0.00 41.12 40.51 2k8d n ASP 6 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 2k8d s ARG 7 N -0.34 0.62 -0.26 -1.24 0.52 -1.26 -1.03 118.95 115.96 2k8d s ARG 7 Ca 0.00 -1.00 -0.01 0.00 -0.52 0.00 0.00 55.73 54.20 2k8d s ARG 7 Cb 0.00 0.23 0.04 0.00 0.52 0.00 0.00 34.95 35.74 2k8d s ARG 7 CO 0.00 -0.14 -0.06 0.96 0.02 0.00 0.00 175.30 176.07 2k8d s ILE 8 N -3.37 2.74 -0.61 1.52 -4.36 0.77 -4.81 121.20 113.08 2k8d s ILE 8 Ca 0.02 -1.20 -0.27 0.00 -0.26 0.00 0.00 60.65 58.94 2k8d s ILE 8 Cb 0.04 -2.46 -0.01 0.00 1.25 0.00 0.00 42.46 41.28 2k8d s ILE 8 CO -0.08 0.11 1.74 -2.16 0.24 0.00 0.00 174.94 174.79 2k8d s PRO 9 N 1.27 2.80 0.42 0.37 0.04 -1.26 -1.24 135.00 137.40 2k8d s PRO 9 Ca -0.02 0.52 -0.23 0.00 0.04 0.00 0.00 61.00 61.31 2k8d s PRO 9 Cb -0.18 -4.33 -0.09 0.00 0.04 0.00 0.00 34.50 29.95 2k8d s PRO 9 CO -0.04 -2.54 1.05 0.42 0.04 0.00 0.00 177.00 175.93 2k8d s ILE 10 N 8.24 3.74 0.07 0.56 1.09 -0.01 -4.48 121.20 130.41 2k8d s ILE 10 Ca 0.62 1.27 -0.03 0.00 -1.10 0.00 0.00 60.65 61.41 2k8d s ILE 10 Cb -0.12 -3.62 -0.03 0.00 -1.06 0.00 0.00 42.46 37.62 2k8d s ILE 10 CO 0.21 -0.06 0.04 -0.36 -0.10 0.00 0.00 174.94 174.67 2k8d s PHE 11 N -1.74 0.49 -0.14 3.97 0.40 -1.26 -0.98 117.98 118.72 2k8d s PHE 11 Ca 0.60 -0.98 -0.03 0.00 -0.60 0.00 0.00 56.93 55.92 2k8d s PHE 11 Cb -0.21 -0.32 0.05 0.00 0.51 0.00 0.00 43.02 43.05 2k8d s PHE 11 CO 0.26 -0.45 0.04 0.45 0.70 0.00 0.00 175.22 176.22 2k8d s SER 12 N -2.93 2.25 0.19 1.36 0.15 -0.20 -4.83 113.70 109.70 2k8d s SER 12 Ca 0.09 -0.49 -0.12 0.00 0.70 0.00 0.00 55.95 56.14 2k8d s SER 12 Cb 0.07 -0.43 0.17 0.00 -1.71 0.00 0.00 66.02 64.12 2k8d s SER 12 CO -0.08 -0.28 1.79 1.62 1.20 0.00 0.00 173.24 177.49 2k8d h VAL 13 N 6.43 0.95 -0.52 4.45 3.04 -1.79 0.59 116.25 129.40 2k8d h VAL 13 Ca -0.16 -0.19 0.13 0.00 -1.01 0.00 0.00 66.70 65.47 2k8d h VAL 13 Cb 1.13 0.36 -0.02 0.00 -2.01 0.00 0.00 31.29 30.74 2k8d h VAL 13 CO 0.29 0.10 0.36 0.00 -1.01 0.00 0.00 177.57 177.31 2k8d h ALA 14 N 1.30 2.34 -0.00 3.17 0.00 -1.96 -2.07 119.26 122.05 2k8d h ALA 14 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2k8d h ALA 14 Cb 0.16 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2k8d h ALA 14 CO -0.17 -0.48 0.00 1.63 0.00 0.00 0.00 179.25 180.22 2k8d n LYS 15 N -4.42 -0.64 -4.46 0.00 5.02 -1.15 -4.99 118.16 107.53 2k8d n LYS 15 Ca 0.09 -0.63 -0.40 0.00 -2.02 0.00 0.00 58.31 55.35 2k8d n LYS 15 Cb 0.52 -1.03 -0.07 0.00 -0.02 0.00 0.00 35.03 34.43 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 0.07 -1.83 -4.80 4.39 4.05 0.02 -4.96 115.26 112.19 2k8d n ASN 16 Ca 0.01 -1.20 -0.34 0.00 0.45 0.00 0.00 54.58 53.50 2k8d n ASN 16 Cb 0.05 -1.85 -0.02 0.00 1.23 0.00 0.00 39.78 39.19 2k8d n ASN 16 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2k8d s ARG 17 N -7.19 3.68 -0.04 1.20 1.81 -0.17 -4.85 118.95 113.39 2k8d s ARG 17 Ca 0.73 1.35 -0.03 0.00 -1.72 0.00 0.00 55.73 56.06 2k8d s ARG 17 Cb -0.42 -2.08 0.01 0.00 -0.45 0.00 0.00 34.95 32.02 2k8d s ARG 17 CO 1.01 -0.53 0.09 0.08 -0.68 0.00 0.00 175.30 175.26 2k8d s VAL 18 N -2.06 -0.01 -0.27 3.52 1.01 -1.26 -1.03 120.40 120.30 2k8d s VAL 18 Ca 0.67 0.04 -0.02 0.00 0.00 0.00 0.00 61.98 62.67 2k8d s VAL 18 Cb -0.17 -0.14 0.16 0.00 0.00 0.00 0.00 36.38 36.23 2k8d s VAL 18 CO 0.24 0.02 0.49 -1.83 0.00 0.00 0.00 175.10 174.01 2k8d s GLU 19 N 0.28 0.45 -0.01 2.72 1.03 -0.15 -4.97 118.70 118.05 2k8d s GLU 19 Ca -0.02 0.77 -0.30 0.00 0.03 0.00 0.00 54.97 55.45 2k8d s GLU 19 Cb -0.03 0.03 -0.03 0.00 -0.80 0.00 0.00 34.13 33.30 2k8d s GLU 19 CO -0.01 -0.63 0.99 1.41 -1.33 0.00 0.00 175.26 175.70 2k8d s MET 20 N 2.70 4.54 0.18 -4.83 1.75 -1.26 -0.83 119.30 121.55 2k8d s MET 20 Ca 0.16 1.43 0.10 0.00 -1.25 0.00 0.00 55.69 56.13 2k8d s MET 20 Cb -0.15 -3.47 -0.04 0.00 2.84 0.00 0.00 34.83 34.01 2k8d s MET 20 CO -0.18 -0.10 -0.20 0.08 -0.65 0.00 0.00 175.02 173.97 2k8d s VAL 21 N 1.16 2.07 0.68 10.11 1.01 -0.38 -4.94 120.40 130.10 2k8d s VAL 21 Ca 0.52 -2.00 -0.11 0.00 0.00 0.00 0.00 61.98 60.39 2k8d s VAL 21 Cb -0.21 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 2k8d s VAL 21 CO 0.27 -0.25 1.07 -1.61 0.00 0.00 0.00 175.10 174.58 2k8d s GLU 22 N -2.81 3.12 0.70 2.72 2.02 -1.26 -0.16 118.70 123.03 2k8d s GLU 22 Ca 0.19 0.60 -0.11 0.00 0.02 0.00 0.00 54.97 55.67 2k8d s GLU 22 Cb -0.06 -2.04 0.01 0.00 0.10 0.00 0.00 34.13 32.14 2k8d s GLU 22 CO 0.08 -0.88 1.06 1.03 0.02 0.00 0.00 175.26 176.58 2k8d s ARG 23 N -5.27 2.87 -1.26 1.61 0.52 -0.20 -4.60 118.95 112.62 2k8d s ARG 23 Ca 0.57 0.90 -0.08 0.00 -0.52 0.00 0.00 55.73 56.61 2k8d s ARG 23 Cb -0.11 -1.99 0.18 0.00 0.52 0.00 0.00 34.95 33.55 2k8d s ARG 23 CO 0.53 -1.13 1.93 1.51 0.02 0.00 0.00 175.30 178.16 2k8d n ILE 24 N -3.15 4.66 -1.80 1.52 3.06 -1.26 -4.78 119.36 117.61 2k8d n ILE 24 Ca 0.07 -4.58 -0.38 0.00 -2.50 0.00 0.00 62.75 55.37 2k8d n ILE 24 Cb 0.54 -2.26 0.05 0.00 0.54 0.00 0.00 39.64 38.51 2k8d n ILE 24 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 2k8d n GLU 25 N 3.10 2.79 -1.81 9.51 -0.58 -1.26 -4.98 120.64 127.40 2k8d n GLU 25 Ca 0.43 -3.52 -0.29 0.00 -0.42 0.00 0.00 57.16 53.35 2k8d n GLU 25 Cb 0.33 -2.27 0.13 0.00 -0.57 0.00 0.00 31.44 29.06 2k8d n GLU 25 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2k8d s LEU 26 N -3.98 2.39 0.49 -4.62 1.43 -1.26 -5.09 118.68 108.04 2k8d s LEU 26 Ca 0.55 0.66 -0.17 0.00 -1.03 0.00 0.00 54.13 54.13 2k8d s LEU 26 Cb 0.46 -2.95 -0.08 0.00 0.03 0.00 0.00 46.19 43.64 2k8d s LEU 26 CO -0.29 -2.37 0.97 -0.44 0.23 0.00 0.00 176.35 174.44 2k8d s SER 27 N -4.54 6.68 0.28 2.29 0.01 -1.26 -5.00 113.70 112.16 2k8d s SER 27 Ca 0.66 1.58 -0.03 0.00 1.31 0.00 0.00 55.95 59.47 2k8d s SER 27 Cb -0.10 -2.51 0.39 0.00 0.21 0.00 0.00 66.02 64.02 2k8d s SER 27 CO 0.51 -0.53 1.94 -0.78 0.41 0.00 0.00 173.24 174.79 2k8d h ASP 28 N 1.13 1.03 -0.01 2.44 1.82 -2.02 -2.52 116.42 118.28 2k8d h ASP 28 Ca -0.47 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.15 2k8d h ASP 28 Cb 1.18 -0.25 -0.00 0.00 0.68 0.00 0.00 39.33 40.95 2k8d h ASP 28 CO 0.61 0.72 0.02 0.44 -1.61 0.00 0.00 179.24 179.43 2k8d h ASP 29 N 1.20 0.00 -0.41 2.28 3.32 -2.03 -1.73 116.42 119.05 2k8d h ASP 29 Ca 0.35 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.28 2k8d h ASP 29 Cb -0.06 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2k8d h ASP 29 CO -0.09 0.00 -0.20 -0.33 -1.72 0.00 0.00 179.24 176.90 2k8d h GLU 30 N 0.00 0.91 0.00 3.56 5.08 -1.85 -3.21 114.58 119.07 2k8d h GLU 30 Ca 0.01 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 2k8d h GLU 30 Cb 0.05 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2k8d h GLU 30 CO -0.00 1.02 0.00 0.91 -1.00 0.00 0.00 179.01 179.94 2k8d n TRP 31 N -4.12 0.00 -0.45 4.33 7.02 -0.65 -0.91 117.44 122.66 2k8d n TRP 31 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2k8d n TRP 31 Cb 0.44 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.33 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 -0.59 0.28 0.00 -0.99 0.00 -1.21 -4.41 116.66 109.75 2k8d n ARG 32 Ca 0.01 -0.17 0.00 0.00 -0.00 0.00 0.00 57.85 57.68 2k8d n ARG 32 Cb 0.00 -0.62 0.00 0.00 -0.00 0.00 0.00 32.46 31.85 2k8d n ARG 32 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 2k8d n GLU 33 N -0.09 2.93 -0.04 2.89 0.28 -0.29 -4.68 120.64 121.64 2k8d n GLU 33 Ca 0.00 0.00 0.08 0.00 -0.16 0.00 0.00 57.16 57.08 2k8d n GLU 33 Cb 0.11 -0.74 0.09 0.00 1.43 0.00 0.00 31.44 32.33 2k8d n GLU 33 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 177.13 177.41 2k8d n ILE 34 N -0.77 0.18 -3.83 3.84 -5.35 -0.09 -5.03 119.36 108.31 2k8d n ILE 34 Ca 0.00 -0.59 -0.22 0.00 -0.27 0.00 0.00 62.75 61.67 2k8d n ILE 34 Cb 0.00 1.17 -0.04 0.00 -1.74 0.00 0.00 39.64 39.03 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 -1.22 3.40 0.36 7.28 1.43 -1.25 -5.02 118.68 123.66 2k8d s LEU 35 Ca 0.20 -0.71 -0.28 0.00 -1.03 0.00 0.00 54.13 52.32 2k8d s LEU 35 Cb 0.13 -1.96 -0.12 0.00 0.03 0.00 0.00 46.19 44.27 2k8d s LEU 35 CO 0.19 -0.46 1.37 0.47 0.23 0.00 0.00 176.35 178.16 2k8d n ASP 36 N -1.36 3.19 0.25 2.29 9.92 -1.26 -4.85 116.55 124.72 2k8d n ASP 36 Ca -0.00 1.22 0.17 0.00 -0.53 0.00 0.00 54.79 55.64 2k8d n ASP 36 Cb 0.61 -1.54 0.77 0.00 -0.64 0.00 0.00 41.12 40.32 2k8d n ASP 36 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 2k8d h PRO 37 N 2.70 0.00 -0.21 -0.24 0.13 -1.95 -1.25 132.00 131.19 2k8d h PRO 37 Ca -0.48 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.55 2k8d h PRO 37 Cb 1.27 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.39 2k8d h PRO 37 CO 0.63 0.00 -0.26 1.49 -0.23 0.00 0.00 178.00 179.63 2k8d h GLU 38 N 0.00 0.54 -0.63 0.86 4.81 -1.99 -2.54 114.58 115.62 2k8d h GLU 38 Ca 0.00 -0.31 0.01 0.00 -0.13 0.00 0.00 59.36 58.94 2k8d h GLU 38 Cb 0.28 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 2k8d h GLU 38 CO 0.00 0.90 0.41 0.00 -0.73 0.00 0.00 179.01 179.59 2k8d h ALA 39 N 0.63 0.81 -0.49 2.92 0.00 -1.60 0.21 119.26 121.74 2k8d h ALA 39 Ca 0.03 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2k8d h ALA 39 Cb 0.83 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.36 2k8d h ALA 39 CO 0.06 0.20 0.32 0.35 0.00 0.00 0.00 179.25 180.18 2k8d h PHE 40 N 0.82 0.60 -0.06 0.00 3.57 -1.47 0.12 116.94 120.53 2k8d h PHE 40 Ca 0.24 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.73 2k8d h PHE 40 Cb -0.05 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.48 2k8d h PHE 40 CO -0.04 0.37 -0.07 0.07 -2.23 0.00 0.00 178.31 176.42 2k8d h ARG 41 N 0.65 0.15 -0.71 1.11 0.11 -1.06 -3.16 114.38 111.47 2k8d h ARG 41 Ca 0.18 -0.08 0.17 0.00 0.10 0.00 0.00 59.98 60.34 2k8d h ARG 41 Cb -0.06 0.01 -0.04 0.00 1.11 0.00 0.00 29.97 30.98 2k8d h ARG 41 CO -0.05 0.62 0.49 0.28 0.10 0.00 0.00 179.97 181.41 2k8d h VAL 42 N -0.31 0.74 0.00 0.08 2.07 -0.31 0.21 116.25 118.74 2k8d h VAL 42 Ca 0.01 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 2k8d h VAL 42 Cb 0.59 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2k8d h VAL 42 CO 0.02 0.04 -0.05 0.00 0.02 0.00 0.00 177.57 177.60 2k8d h ALA 43 N 1.66 1.55 0.00 1.67 0.00 -0.73 0.14 119.26 123.55 2k8d h ALA 43 Ca 0.35 -0.05 -0.21 0.00 0.00 0.00 0.00 54.91 55.00 2k8d h ALA 43 Cb 1.01 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 2k8d h ALA 43 CO -0.08 0.07 -1.44 0.07 0.00 0.00 0.00 179.25 177.87 2k8d h ARG 44 N 0.00 0.00 -0.10 0.00 0.11 -0.68 -3.40 114.38 110.30 2k8d h ARG 44 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2k8d h ARG 44 Cb 0.12 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.20 2k8d h ARG 44 CO 0.01 0.43 0.00 0.36 0.10 0.00 0.00 179.97 180.86 2k8d n LYS 45 N -3.00 1.14 -3.63 0.08 2.85 -0.84 -4.98 118.16 109.78 2k8d n LYS 45 Ca -0.11 -1.38 -0.26 0.00 -1.05 0.00 0.00 58.31 55.51 2k8d n LYS 45 Cb 0.92 -1.22 -0.03 0.00 -0.65 0.00 0.00 35.03 34.05 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 0.58 -1.11 0.00 0.58 0.00 0.43 -1.63 120.51 119.35 2k8d n ALA 46 Ca 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2k8d n ALA 46 Cb 0.31 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.35 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 -1.05 2.57 3.27 0.00 0.00 -1.16 -4.50 105.19 104.31 2k8d n GLY 47 Ca 0.03 -0.18 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 2k8d n GLY 47 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2k8d s THR 48 N -2.24 -0.71 0.10 2.61 -1.32 -0.65 -4.93 115.64 108.50 2k8d s THR 48 Ca 0.00 0.11 -0.32 0.00 -1.21 0.00 0.00 61.69 60.27 2k8d s THR 48 Cb 0.00 -0.74 -0.14 0.00 -1.51 0.00 0.00 72.50 70.11 2k8d s THR 48 CO 0.00 0.03 1.60 -0.33 -2.21 0.00 0.00 174.62 173.71 2k8d h GLU 49 N 8.14 -0.76 -6.81 7.08 5.08 -1.95 -3.41 114.58 121.95 2k8d h GLU 49 Ca -0.17 0.05 -0.52 0.00 -1.00 0.00 0.00 59.36 57.73 2k8d h GLU 49 Cb 1.12 0.17 0.04 0.00 0.50 0.00 0.00 28.75 30.58 2k8d h GLU 49 CO 0.14 -0.51 0.58 -1.25 -1.00 0.00 0.00 179.01 176.97 2k8d s PRO 50 N -5.96 4.47 0.22 2.33 0.04 -1.26 -4.94 135.00 129.91 2k8d s PRO 50 Ca -0.17 2.02 0.24 0.00 0.04 0.00 0.00 61.00 63.14 2k8d s PRO 50 Cb 0.06 -3.14 0.91 0.00 0.04 0.00 0.00 34.50 32.37 2k8d s PRO 50 CO 0.63 -0.04 1.74 -0.35 0.04 0.00 0.00 177.00 179.01 2k8d n PRO 51 N 1.31 0.21 -1.96 0.56 -0.04 -1.26 -4.75 135.00 129.06 2k8d n PRO 51 Ca 0.01 0.32 -0.42 0.00 -0.04 0.00 0.00 63.50 63.36 2k8d n PRO 51 Cb 0.43 -1.82 -0.03 0.00 -0.04 0.00 0.00 33.50 32.04 2k8d n PRO 51 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2k8d s PHE 52 N -3.21 2.32 0.23 0.54 0.08 -1.26 -4.98 117.98 111.70 2k8d s PHE 52 Ca 0.07 0.31 0.01 0.00 0.12 0.00 0.00 56.93 57.44 2k8d s PHE 52 Cb 0.11 -3.94 -0.00 0.00 -0.57 0.00 0.00 43.02 38.62 2k8d s PHE 52 CO 0.47 -3.79 0.29 -2.37 -0.10 0.00 0.00 175.22 169.72 2k8d n THR 53 N 4.92 0.00 -0.46 0.64 5.66 -1.26 -5.05 114.28 118.73 2k8d n THR 53 Ca 0.16 -1.36 0.00 0.00 -3.05 0.00 0.00 64.05 59.80 2k8d n THR 53 Cb 0.41 0.77 0.00 0.00 -1.55 0.00 0.00 70.33 69.97 2k8d n THR 53 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2k8d n GLY 54 N -0.41 0.33 3.38 1.09 0.00 -1.26 -5.16 105.19 103.17 2k8d n GLY 54 Ca 0.02 -0.51 -0.12 0.00 0.00 0.00 0.00 46.02 45.41 2k8d n GLY 54 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k8d s LYS 55 N -1.34 1.46 0.18 1.61 2.47 -1.26 -5.19 119.74 117.67 2k8d s LYS 55 Ca 0.00 -1.55 0.00 0.00 -1.56 0.00 0.00 55.97 52.86 2k8d s LYS 55 Cb 0.00 0.37 -0.04 0.00 -1.46 0.00 0.00 37.83 36.69 2k8d s LYS 55 CO 0.00 -0.55 0.07 1.52 0.16 0.00 0.00 175.35 176.54 2k8d s TYR 56 N -3.90 1.14 -0.03 4.03 -0.85 -1.26 -4.95 117.35 111.54 2k8d s TYR 56 Ca 0.32 -1.20 0.04 0.00 -0.52 0.00 0.00 57.07 55.71 2k8d s TYR 56 Cb 0.03 -0.63 0.06 0.00 0.38 0.00 0.00 41.96 41.80 2k8d s TYR 56 CO 0.13 -0.43 0.93 -2.39 -1.52 0.00 0.00 175.55 172.27 2k8d n HIS 57 N -0.24 0.00 -3.86 -3.49 1.44 -1.26 -5.09 115.22 102.71 2k8d n HIS 57 Ca -0.03 -0.25 -0.11 0.00 -2.01 0.00 0.00 57.72 55.32 2k8d n HIS 57 Cb 0.65 -0.06 -0.09 0.00 0.12 0.00 0.00 29.99 30.60 2k8d n HIS 57 CO 0.00 0.00 0.00 0.16 -2.81 0.00 0.00 176.34 173.69 2k8d s ASP 58 N -1.19 0.03 0.00 4.39 -4.77 -1.26 -5.08 116.67 108.80 2k8d s ASP 58 Ca 0.07 -0.27 0.01 0.00 -3.30 0.00 0.00 52.55 49.05 2k8d s ASP 58 Cb 0.06 0.24 0.01 0.00 -1.09 0.00 0.00 42.92 42.14 2k8d s ASP 58 CO 0.01 -0.45 0.68 -0.11 0.70 0.00 0.00 175.17 176.00 2k8d n LEU 59 N 1.14 -0.04 -3.80 2.11 7.94 -1.26 -5.04 117.00 118.05 2k8d n LEU 59 Ca -0.21 -1.09 -0.12 0.00 -1.11 0.00 0.00 56.01 53.48 2k8d n LEU 59 Cb 0.57 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.41 2k8d n LEU 59 CO 0.22 0.82 -0.08 -2.28 -1.11 0.00 0.00 177.39 174.96 2k8d s HIS 60 N 0.00 -0.17 0.00 1.96 2.46 -1.26 -5.06 115.29 113.22 2k8d s HIS 60 Ca 0.01 0.37 0.00 0.00 0.47 0.00 0.00 55.06 55.91 2k8d s HIS 60 Cb 0.01 0.06 0.00 0.00 -0.13 0.00 0.00 32.58 32.52 2k8d s HIS 60 CO -0.00 -0.24 1.30 -0.25 -2.47 0.00 0.00 174.74 173.08 2k8d n ASP 61 N 2.13 3.60 -3.72 9.88 9.92 -1.26 -4.80 116.55 132.31 2k8d n ASP 61 Ca -0.18 -1.95 -0.19 0.00 -0.53 0.00 0.00 54.79 51.94 2k8d n ASP 61 Cb 0.57 -0.71 -0.09 0.00 -0.64 0.00 0.00 41.12 40.25 2k8d n ASP 61 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2k8d s ASP 62 N 1.57 1.52 0.11 -2.24 -1.08 -1.26 -4.79 116.67 110.50 2k8d s ASP 62 Ca 0.00 -1.65 0.00 0.00 -0.52 0.00 0.00 52.55 50.38 2k8d s ASP 62 Cb 0.00 0.49 0.00 0.00 -1.46 0.00 0.00 42.92 41.95 2k8d s ASP 62 CO 0.00 -0.97 0.00 0.61 0.52 0.00 0.00 175.17 175.33 2k8d n GLY 63 N -0.59 -1.57 3.16 2.66 0.00 -1.26 -4.93 105.19 102.65 2k8d n GLY 63 Ca 0.04 -1.42 -0.10 0.00 0.00 0.00 0.00 46.02 44.54 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 -1.53 0.56 0.61 -0.61 -4.36 -0.06 -3.66 121.20 112.14 2k8d s ILE 64 Ca 0.00 -1.91 -0.13 0.00 -0.26 0.00 0.00 60.65 58.35 2k8d s ILE 64 Cb 0.00 -1.70 -0.04 0.00 1.25 0.00 0.00 42.46 41.97 2k8d s ILE 64 CO 0.00 -0.85 1.03 -0.31 0.24 0.00 0.00 174.94 175.05 2k8d s TYR 65 N -3.71 3.45 -0.06 1.37 1.51 0.36 -1.19 117.35 119.09 2k8d s TYR 65 Ca 0.12 1.37 -0.03 0.00 -1.01 0.00 0.00 57.07 57.52 2k8d s TYR 65 Cb 0.06 -2.79 0.03 0.00 -0.11 0.00 0.00 41.96 39.15 2k8d s TYR 65 CO -0.05 -0.74 0.14 0.50 -1.11 0.00 0.00 175.55 174.29 2k8d s ARG 66 N -4.81 0.11 -0.88 -0.62 3.52 0.14 -0.44 118.95 115.98 2k8d s ARG 66 Ca 0.57 0.29 -0.21 0.00 -0.13 0.00 0.00 55.73 56.25 2k8d s ARG 66 Cb -0.12 -0.08 0.10 0.00 -1.56 0.00 0.00 34.95 33.30 2k8d s ARG 66 CO 0.47 -0.10 1.16 0.00 -0.81 0.00 0.00 175.30 176.02 2k8d h ILE 68 N 6.06 0.60 0.00 0.00 2.10 -1.81 -0.51 117.51 123.96 2k8d h ILE 68 Ca 0.04 -0.24 0.00 0.00 1.08 0.00 0.00 64.86 65.75 2k8d h ILE 68 Cb 1.03 1.15 0.00 0.00 -1.09 0.00 0.00 36.82 37.91 2k8d h ILE 68 CO 1.19 0.06 0.00 0.00 -1.08 0.00 0.00 178.15 178.32 2k8d n GLY 71 N -0.02 0.00 3.60 0.00 0.00 -0.25 -4.92 105.19 103.58 2k8d n GLY 71 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.91 3.74 0.93 2.61 2.01 -0.95 -4.89 115.64 118.19 2k8d s THR 72 Ca 0.00 -0.57 -0.11 0.00 0.31 0.00 0.00 61.69 61.32 2k8d s THR 72 Cb 0.00 -2.57 0.15 0.00 0.01 0.00 0.00 72.50 70.09 2k8d s THR 72 CO 0.00 0.52 1.09 1.51 -0.69 0.00 0.00 174.62 177.06 2k8d s ASP 73 N -1.04 3.01 0.00 3.53 -4.77 -1.26 -0.04 116.67 116.09 2k8d s ASP 73 Ca 0.14 1.72 0.00 0.00 -3.30 0.00 0.00 52.55 51.11 2k8d s ASP 73 Cb -0.11 -2.34 0.00 0.00 -1.09 0.00 0.00 42.92 39.38 2k8d s ASP 73 CO 0.04 -2.96 0.00 0.00 0.70 0.00 0.00 175.17 172.94 2k8d n LEU 74 N -4.11 0.00 -4.60 2.11 -0.00 0.42 -4.66 117.00 106.15 2k8d n LEU 74 Ca 0.08 0.00 -0.50 0.00 -0.00 0.00 0.00 56.01 55.58 2k8d n LEU 74 Cb 0.54 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.90 2k8d n LEU 74 CO 0.54 0.00 1.61 0.49 -0.00 0.00 0.00 177.39 180.03 2k8d n PHE 75 N 0.00 2.00 -1.94 1.47 3.72 -1.25 -4.54 117.46 116.92 2k8d n PHE 75 Ca 0.00 0.18 -0.35 0.00 -0.05 0.00 0.00 57.45 57.22 2k8d n PHE 75 Cb 0.00 -2.59 0.04 0.00 -0.94 0.00 0.00 39.48 35.99 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 5.51 5.11 0.40 4.37 -1.08 -1.26 -0.48 116.67 129.24 2k8d s ASP 76 Ca 1.00 2.31 0.28 0.00 -0.52 0.00 0.00 52.55 55.63 2k8d s ASP 76 Cb -0.79 -2.59 1.32 0.00 -1.46 0.00 0.00 42.92 39.40 2k8d s ASP 76 CO 0.52 -1.64 1.86 0.28 0.52 0.00 0.00 175.17 176.70 2k8d h SER 77 N 0.67 0.00 0.24 -0.34 0.02 -1.76 0.31 113.55 112.69 2k8d h SER 77 Ca -0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 2k8d h SER 77 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2k8d h SER 77 CO 0.54 0.00 0.00 -1.84 -1.14 0.00 0.00 176.83 174.39 2k8d n GLU 78 N -2.56 0.11 -0.03 3.45 0.28 -1.26 -1.21 120.64 119.43 2k8d n GLU 78 Ca 0.00 0.52 0.03 0.00 -0.16 0.00 0.00 57.16 57.55 2k8d n GLU 78 Cb 0.18 -1.81 0.04 0.00 1.43 0.00 0.00 31.44 31.28 2k8d n GLU 78 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 2k8d n THR 79 N -2.04 1.22 -3.25 3.84 -2.24 0.98 -4.91 114.28 107.88 2k8d n THR 79 Ca 0.00 -1.30 -0.04 0.00 -2.27 0.00 0.00 64.05 60.44 2k8d n THR 79 Cb 0.09 0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.61 2k8d n THR 79 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2k8d s LYS 80 N -1.45 0.71 0.01 -0.78 2.36 -0.35 -4.61 119.74 115.63 2k8d s LYS 80 Ca 0.09 -0.30 -0.02 0.00 -2.55 0.00 0.00 55.97 53.18 2k8d s LYS 80 Cb 0.07 -0.14 -0.01 0.00 -1.05 0.00 0.00 37.83 36.71 2k8d s LYS 80 CO 0.01 -1.16 0.04 0.12 1.55 0.00 0.00 175.35 175.91 2k8d s PHE 81 N 1.90 0.12 -0.14 4.03 2.19 -1.23 -4.36 117.98 120.50 2k8d s PHE 81 Ca 0.15 -0.26 -0.11 0.00 0.33 0.00 0.00 56.93 57.04 2k8d s PHE 81 Cb -0.08 -0.10 0.04 0.00 -1.31 0.00 0.00 43.02 41.57 2k8d s PHE 81 CO -0.10 -0.18 0.36 0.34 1.83 0.00 0.00 175.22 177.47 2k8d s ASP 82 N -1.10 -0.39 -0.64 6.13 2.15 -1.26 -4.87 116.67 116.69 2k8d s ASP 82 Ca -0.12 0.74 -0.26 0.00 0.43 0.00 0.00 52.55 53.34 2k8d s ASP 82 Cb -0.07 0.71 -0.12 0.00 -0.30 0.00 0.00 42.92 43.14 2k8d s ASP 82 CO -0.00 -0.14 2.46 -1.54 -0.17 0.00 0.00 175.17 175.78 2k8d n SER 83 N 3.31 1.73 -0.30 -0.34 3.41 -1.26 -0.95 113.62 119.22 2k8d n SER 83 Ca -0.16 -0.51 -0.04 0.00 -0.26 0.00 0.00 58.87 57.90 2k8d n SER 83 Cb 0.57 -1.43 -0.02 0.00 -0.26 0.00 0.00 64.21 63.07 2k8d n SER 83 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2k8d n GLY 84 N 6.19 0.39 0.00 5.00 0.00 -1.26 -4.65 105.19 110.86 2k8d n GLY 84 Ca 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.46 2k8d n GLY 84 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2k8d n THR 85 N -2.12 0.00 -2.06 2.61 -1.04 -0.56 -5.06 114.28 106.06 2k8d n THR 85 Ca -0.04 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.77 2k8d n THR 85 Cb 0.51 -0.15 -0.04 0.00 -1.82 0.00 0.00 70.33 68.83 2k8d n THR 85 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2k8d n GLY 86 N 1.40 0.49 3.77 3.41 0.00 -0.12 -4.75 105.19 109.38 2k8d n GLY 86 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2k8d n GLY 86 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2k8d n TRP 87 N -3.24 2.88 -1.56 1.61 -0.00 -1.26 -4.81 117.44 111.04 2k8d n TRP 87 Ca -0.22 0.45 -0.41 0.00 -0.00 0.00 0.00 57.50 57.32 2k8d n TRP 87 Cb 0.66 -2.51 -0.01 0.00 -0.00 0.00 0.00 31.31 29.45 2k8d n TRP 87 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2k8d n PRO 88 N 0.30 2.86 -3.83 5.87 -0.04 -1.26 -4.72 135.00 134.18 2k8d n PRO 88 Ca 0.02 -2.42 -0.12 0.00 -0.04 0.00 0.00 63.50 60.95 2k8d n PRO 88 Cb 0.39 -3.14 -0.11 0.00 -0.04 0.00 0.00 33.50 30.61 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 3.18 -0.10 0.00 3.54 1.04 -1.26 -1.43 113.70 118.67 2k8d s SER 89 Ca 0.52 0.10 0.00 0.00 0.48 0.00 0.00 55.95 57.05 2k8d s SER 89 Cb 0.15 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.58 2k8d s SER 89 CO -0.06 -0.24 0.00 0.33 0.98 0.00 0.00 173.24 174.24 2k8d n PHE 90 N 2.11 0.00 -0.66 5.02 7.35 0.65 -4.78 117.46 127.15 2k8d n PHE 90 Ca -0.18 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.51 2k8d n PHE 90 Cb 0.57 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.40 2k8d n PHE 90 CO 0.00 0.00 0.00 2.48 -0.76 0.00 0.00 176.76 178.48 2k8d n TYR 91 N 0.00 0.00 -3.83 -5.13 0.18 -1.26 -0.04 117.16 107.08 2k8d n TYR 91 Ca 0.00 -0.07 -0.10 0.00 1.88 0.00 0.00 57.90 59.61 2k8d n TYR 91 Cb 0.00 -0.01 -0.01 0.00 -0.38 0.00 0.00 39.34 38.94 2k8d n TYR 91 CO 0.00 0.00 0.00 -3.47 -2.08 0.00 0.00 176.86 171.31 2k8d n ASP 92 N -0.07 -1.14 -4.25 9.48 -0.08 -1.26 -4.72 116.55 114.50 2k8d n ASP 92 Ca 0.00 -2.31 -0.14 0.00 -1.51 0.00 0.00 54.79 50.83 2k8d n ASP 92 Cb 0.27 2.05 -0.10 0.00 2.34 0.00 0.00 41.12 45.68 2k8d n ASP 92 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 2k8d s VAL 93 N -2.63 0.75 -0.27 5.18 -7.23 -1.26 -4.80 120.40 110.14 2k8d s VAL 93 Ca 0.19 -1.99 0.28 0.00 -1.81 0.00 0.00 61.98 58.65 2k8d s VAL 93 Cb -0.01 -2.11 0.33 0.00 0.56 0.00 0.00 36.38 35.14 2k8d s VAL 93 CO 0.13 -0.49 1.81 1.62 -0.31 0.00 0.00 175.10 177.87 2k8d h VAL 94 N 2.68 0.00 0.00 1.32 3.04 -1.91 -3.47 116.25 117.91 2k8d h VAL 94 Ca -0.37 -0.51 0.00 0.00 -1.01 0.00 0.00 66.70 64.82 2k8d h VAL 94 Cb 1.20 1.43 0.00 0.00 -2.01 0.00 0.00 31.29 31.91 2k8d h VAL 94 CO 0.63 0.00 0.00 -1.20 -1.01 0.00 0.00 177.57 175.99 2k8d n SER 95 N -2.73 0.00 -4.42 3.17 7.64 -1.26 -2.70 113.62 113.32 2k8d n SER 95 Ca 0.02 0.00 -0.44 0.00 1.01 0.00 0.00 58.87 59.46 2k8d n SER 95 Cb 0.34 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.49 2k8d n SER 95 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2k8d s GLU 96 N -2.00 3.09 0.29 1.43 2.02 -1.26 -4.67 118.70 117.60 2k8d s GLU 96 Ca 0.00 -1.05 0.00 0.00 0.02 0.00 0.00 54.97 53.94 2k8d s GLU 96 Cb 0.00 -4.23 0.00 0.00 0.10 0.00 0.00 34.13 30.00 2k8d s GLU 96 CO 0.00 -1.63 0.00 -2.39 0.02 0.00 0.00 175.26 171.26 2k8d n HIS 97 N 6.93 -2.64 -0.17 1.61 1.44 -1.26 -4.88 115.22 116.24 2k8d n HIS 97 Ca -0.07 0.54 0.04 0.00 -2.01 0.00 0.00 57.72 56.22 2k8d n HIS 97 Cb 0.44 0.90 0.10 0.00 0.12 0.00 0.00 29.99 31.55 2k8d n HIS 97 CO 0.00 0.00 0.00 -1.71 -2.81 0.00 0.00 176.34 171.82 2k8d n ASN 98 N -3.42 2.62 -3.97 4.39 5.15 -1.26 -4.36 115.26 114.41 2k8d n ASN 98 Ca 0.00 -2.08 -0.09 0.00 -0.60 0.00 0.00 54.58 51.81 2k8d n ASN 98 Cb 0.00 -0.17 -0.11 0.00 -0.53 0.00 0.00 39.78 38.97 2k8d n ASN 98 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 2k8d s ILE 99 N -1.13 0.11 0.00 -1.44 -1.16 -1.26 -0.89 121.20 115.43 2k8d s ILE 99 Ca 0.16 -0.90 -0.03 0.00 -0.51 0.00 0.00 60.65 59.36 2k8d s ILE 99 Cb 0.09 -0.31 -0.01 0.00 0.61 0.00 0.00 42.46 42.85 2k8d s ILE 99 CO 0.09 -0.50 0.05 -0.75 -2.81 0.00 0.00 174.94 171.03 2k8d s LYS 100 N -1.51 0.32 0.10 3.50 2.47 0.62 -4.46 119.74 120.78 2k8d s LYS 100 Ca -0.15 -0.36 0.07 0.00 -1.56 0.00 0.00 55.97 53.96 2k8d s LYS 100 Cb -0.09 0.13 -0.03 0.00 -1.46 0.00 0.00 37.83 36.37 2k8d s LYS 100 CO -0.01 -0.06 -0.18 -0.51 0.16 0.00 0.00 175.35 174.75 2k8d s LEU 101 N -1.07 2.31 0.09 5.43 1.02 -1.26 -1.40 118.68 123.81 2k8d s LEU 101 Ca -0.12 -0.68 0.05 0.00 0.02 0.00 0.00 54.13 53.40 2k8d s LEU 101 Cb -0.07 -0.74 -0.03 0.00 0.02 0.00 0.00 46.19 45.37 2k8d s LEU 101 CO 0.00 -0.01 -0.12 -0.13 0.02 0.00 0.00 176.35 176.11 2k8d s ARG 102 N -1.97 0.86 -0.04 1.70 3.00 -1.25 -4.97 118.95 116.29 2k8d s ARG 102 Ca 0.04 -1.08 0.05 0.00 0.00 0.00 0.00 55.73 54.74 2k8d s ARG 102 Cb -0.09 -0.72 -0.01 0.00 0.00 0.00 0.00 34.95 34.13 2k8d s ARG 102 CO 0.04 0.14 -0.18 -2.00 0.00 0.00 0.00 175.30 173.30 2k8d s GLU 103 N -2.30 1.78 0.23 3.54 2.12 -1.26 -0.51 118.70 122.29 2k8d s GLU 103 Ca 0.03 -0.63 0.02 0.00 0.36 0.00 0.00 54.97 54.74 2k8d s GLU 103 Cb -0.06 -1.56 -0.01 0.00 0.26 0.00 0.00 34.13 32.76 2k8d s GLU 103 CO 0.02 0.27 0.27 -3.47 -0.54 0.00 0.00 175.26 171.80 2k8d n ASP 104 N 3.06 -0.72 -0.64 -1.70 2.03 0.25 -4.97 116.55 113.87 2k8d n ASP 104 Ca -0.18 -2.35 0.07 0.00 0.52 0.00 0.00 54.79 52.86 2k8d n ASP 104 Cb 0.53 1.44 0.19 0.00 -0.72 0.00 0.00 41.12 42.56 2k8d n ASP 104 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2k8d n ARG 105 N -0.40 2.73 -0.20 -0.67 1.85 -1.26 -0.49 116.66 118.23 2k8d n ARG 105 Ca 0.03 -2.44 0.21 0.00 -1.00 0.00 0.00 57.85 54.64 2k8d n ARG 105 Cb 0.40 -1.55 0.58 0.00 -1.05 0.00 0.00 32.46 30.83 2k8d n ARG 105 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 2k8d h SER 106 N 1.52 0.27 0.94 2.89 0.02 -1.83 0.22 113.55 117.59 2k8d h SER 106 Ca 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2k8d h SER 106 Cb 1.08 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.60 2k8d h SER 106 CO 0.11 0.11 0.00 0.00 -1.14 0.00 0.00 176.83 175.91 2k8d n LEU 107 N -4.44 0.06 0.00 5.07 -0.00 -1.26 -4.87 117.00 111.56 2k8d n LEU 107 Ca 0.18 0.51 0.00 0.00 -0.00 0.00 0.00 56.01 56.69 2k8d n LEU 107 Cb 0.73 -0.49 0.00 0.00 -0.00 0.00 0.00 43.42 43.66 2k8d n LEU 107 CO 0.33 -0.06 0.00 0.61 -0.00 0.00 0.00 177.39 178.27 2k8d n GLY 108 N 1.22 0.82 0.00 1.47 0.00 0.76 -5.00 105.19 104.47 2k8d n GLY 108 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.77 0.00 -3.66 1.61 2.81 -1.05 -5.08 117.12 110.98 2k8d n MET 109 Ca 0.00 0.00 -0.25 0.00 -1.81 0.00 0.00 57.70 55.64 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 0.08 1.51 0.00 0.00 175.97 177.56 2k8d s VAL 110 N 0.00 0.07 -0.19 2.03 1.01 -1.26 -4.28 120.40 117.78 2k8d s VAL 110 Ca 0.00 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 61.85 2k8d s VAL 110 Cb 0.00 -0.61 0.03 0.00 0.00 0.00 0.00 36.38 35.80 2k8d s VAL 110 CO 0.00 -0.16 -0.15 -0.60 0.00 0.00 0.00 175.10 174.18 2k8d s ARG 111 N 2.07 2.52 -0.00 2.72 3.52 0.36 -2.74 118.95 127.41 2k8d s ARG 111 Ca 0.02 -0.84 0.07 0.00 -0.13 0.00 0.00 55.73 54.85 2k8d s ARG 111 Cb -0.15 -2.48 -0.03 0.00 -1.56 0.00 0.00 34.95 30.73 2k8d s ARG 111 CO -0.08 -0.31 -0.22 0.00 -0.81 0.00 0.00 175.30 173.88 2k8d s GLU 113 N -0.93 2.63 -0.25 0.00 -1.05 0.33 0.20 118.70 119.62 2k8d s GLU 113 Ca 0.12 1.08 -0.04 0.00 -0.15 0.00 0.00 54.97 55.98 2k8d s GLU 113 Cb -0.10 -1.95 0.09 0.00 -0.44 0.00 0.00 34.13 31.73 2k8d s GLU 113 CO 0.01 -1.35 0.11 0.08 0.95 0.00 0.00 175.26 175.06 2k8d s VAL 114 N -2.93 0.09 0.43 1.83 1.01 0.08 -3.85 120.40 117.05 2k8d s VAL 114 Ca 0.60 -0.66 0.03 0.00 0.00 0.00 0.00 61.98 61.96 2k8d s VAL 114 Cb -0.16 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 2k8d s VAL 114 CO 0.54 -0.56 0.05 -0.76 0.00 0.00 0.00 175.10 174.38 2k8d s LEU 115 N 2.03 2.27 1.02 3.92 1.02 -0.49 -0.86 118.68 127.59 2k8d s LEU 115 Ca 0.06 -1.56 -0.12 0.00 0.02 0.00 0.00 54.13 52.53 2k8d s LEU 115 Cb -0.16 -0.49 0.20 0.00 0.02 0.00 0.00 46.19 45.76 2k8d s LEU 115 CO -0.26 -0.77 1.07 0.00 0.02 0.00 0.00 176.35 176.42 2k8d n ALA 117 N -4.40 3.58 -0.10 0.00 0.00 -0.07 -4.00 120.51 115.52 2k8d n ALA 117 Ca 0.06 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.86 2k8d n ALA 117 Cb 0.55 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 19.22 2k8d n ALA 117 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2k8d n ARG 118 N -0.08 0.00 -2.32 0.00 3.00 -1.26 -4.92 116.66 111.08 2k8d n ARG 118 Ca 0.09 0.00 -0.37 0.00 -0.00 0.00 0.00 57.85 57.57 2k8d n ARG 118 Cb 0.46 0.00 -0.04 0.00 0.00 0.00 0.00 32.46 32.88 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 11.13 0.00 -4.00 0.00 8.00 -1.26 -4.38 116.55 126.04 2k8d n ASP 120 Ca 0.25 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.45 2k8d n ASP 120 Cb 0.50 0.00 0.24 0.00 -0.02 0.00 0.00 41.12 41.84 2k8d n ASP 120 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k8d s ALA 121 N 0.00 0.25 -0.03 2.24 0.00 -1.26 -4.99 121.76 117.97 2k8d s ALA 121 Ca 0.00 -0.71 -0.19 0.00 0.00 0.00 0.00 51.96 51.06 2k8d s ALA 121 Cb 0.00 -2.98 -0.12 0.00 0.00 0.00 0.00 23.12 20.02 2k8d s ALA 121 CO 0.00 -3.69 0.80 1.25 0.00 0.00 0.00 175.76 174.12 2k8d h HIS 122 N -2.63 -0.44 0.00 0.00 2.76 -1.89 -3.41 115.15 109.54 2k8d h HIS 122 Ca -0.49 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 57.67 2k8d h HIS 122 Cb 1.32 0.15 0.00 0.00 1.55 0.00 0.00 27.41 30.42 2k8d h HIS 122 CO -1.57 -0.16 0.00 1.28 -1.30 0.00 0.00 177.93 176.18 2k8d n LEU 123 N -5.10 0.00 0.00 0.26 7.99 -1.19 -4.79 117.00 114.16 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 0.21 0.00 0.00 0.61 -1.51 0.00 0.00 177.39 176.70 2k8d n GLY 124 N 0.00 -1.23 2.77 -0.72 0.00 -0.04 0.24 105.19 106.21 2k8d n GLY 124 Ca 0.00 0.65 -0.06 0.00 0.00 0.00 0.00 46.02 46.61 2k8d n GLY 124 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2k8d n HIS 125 N 0.00 -1.82 -4.14 1.61 1.44 -0.12 -0.74 115.22 111.45 2k8d n HIS 125 Ca 0.00 -1.27 -0.15 0.00 -2.01 0.00 0.00 57.72 54.28 2k8d n HIS 125 Cb 0.00 0.63 -0.14 0.00 0.12 0.00 0.00 29.99 30.60 2k8d n HIS 125 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2k8d s VAL 126 N -2.31 0.40 0.04 0.61 0.11 0.13 -0.02 120.40 119.36 2k8d s VAL 126 Ca 0.13 -0.27 0.00 0.00 -2.93 0.00 0.00 61.98 58.90 2k8d s VAL 126 Cb -0.03 -0.35 -0.03 0.00 -1.53 0.00 0.00 36.38 34.44 2k8d s VAL 126 CO 0.08 0.08 -0.04 0.72 -3.33 0.00 0.00 175.10 172.61 2k8d s PHE 127 N -0.21 0.42 -0.02 1.54 -0.71 0.04 -1.06 117.98 117.98 2k8d s PHE 127 Ca 0.01 -0.71 -0.30 0.00 -1.04 0.00 0.00 56.93 54.89 2k8d s PHE 127 Cb -0.02 -0.29 -0.07 0.00 -1.21 0.00 0.00 43.02 41.42 2k8d s PHE 127 CO -0.00 -0.23 1.79 0.16 -1.34 0.00 0.00 175.22 175.60 2k8d s ASP 128 N -2.01 6.55 0.00 1.98 -4.77 -1.11 0.21 116.67 117.52 2k8d s ASP 128 Ca -0.07 2.40 0.00 0.00 -3.30 0.00 0.00 52.55 51.58 2k8d s ASP 128 Cb -0.04 -2.53 0.00 0.00 -1.09 0.00 0.00 42.92 39.26 2k8d s ASP 128 CO -0.04 -1.00 0.00 -0.67 0.70 0.00 0.00 175.17 174.16 2k8d n ASP 129 N 7.40 0.00 -4.76 2.11 2.03 -0.63 -4.90 116.55 117.81 2k8d n ASP 129 Ca 0.19 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.28 2k8d n ASP 129 Cb 0.42 0.00 0.10 0.00 -0.72 0.00 0.00 41.12 40.92 2k8d n ASP 129 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k8d n GLY 130 N -0.19 1.26 0.00 0.27 0.00 0.63 -5.02 105.19 102.14 2k8d n GLY 130 Ca 0.00 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.90 2k8d n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k8d n PRO 131 N -2.59 0.00 -3.61 1.61 -0.04 -1.26 -4.50 135.00 124.61 2k8d n PRO 131 Ca 0.17 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.61 2k8d n PRO 131 Cb 0.60 -0.29 -0.01 0.00 -0.04 0.00 0.00 33.50 33.76 2k8d n PRO 131 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2k8d s ARG 132 N -0.07 0.23 0.16 0.54 3.03 -1.26 -4.33 118.95 117.25 2k8d s ARG 132 Ca 0.00 -0.10 -0.10 0.00 2.03 0.00 0.00 55.73 57.56 2k8d s ARG 132 Cb 0.00 0.10 0.01 0.00 -1.03 0.00 0.00 34.95 34.03 2k8d s ARG 132 CO 0.00 -0.10 1.55 -1.00 -1.13 0.00 0.00 175.30 174.62 2k8d h PRO 133 N 2.00 1.01 -5.59 3.89 0.13 -2.02 -3.42 132.00 128.00 2k8d h PRO 133 Ca -0.14 -0.43 -0.47 0.00 -0.87 0.00 0.00 66.00 64.09 2k8d h PRO 133 Cb 1.17 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 2k8d h PRO 133 CO 0.24 1.11 1.53 0.25 -0.23 0.00 0.00 178.00 180.89 2k8d n THR 134 N -4.11 2.69 0.50 1.56 -2.24 -1.26 -4.43 114.28 106.99 2k8d n THR 134 Ca 0.00 -2.79 0.06 0.00 -2.27 0.00 0.00 64.05 59.04 2k8d n THR 134 Cb 0.46 -2.24 0.02 0.00 -2.10 0.00 0.00 70.33 66.46 2k8d n THR 134 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k8d n GLY 135 N 5.61 -0.17 3.75 3.38 0.00 -1.26 -4.44 105.19 112.06 2k8d n GLY 135 Ca 0.47 -0.33 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.31 4.74 -0.28 1.61 0.00 -1.26 -0.27 119.74 122.97 2k8d s LYS 136 Ca 0.11 1.61 0.01 0.00 0.00 0.00 0.00 55.97 57.69 2k8d s LYS 136 Cb 0.09 -3.26 0.06 0.00 0.00 0.00 0.00 37.83 34.72 2k8d s LYS 136 CO 0.24 0.34 -0.05 0.50 0.00 0.00 0.00 175.35 176.38 2k8d s ARG 137 N -1.03 2.32 0.01 1.78 3.52 0.13 -4.32 118.95 121.37 2k8d s ARG 137 Ca 0.44 -1.32 -0.30 0.00 -0.13 0.00 0.00 55.73 54.42 2k8d s ARG 137 Cb -0.28 -3.04 -0.04 0.00 -1.56 0.00 0.00 34.95 30.04 2k8d s ARG 137 CO 0.35 -0.60 1.05 0.71 -0.81 0.00 0.00 175.30 176.00 2k8d s TYR 138 N 1.17 3.58 -0.04 5.12 1.51 0.94 -0.78 117.35 128.85 2k8d s TYR 138 Ca -0.07 1.57 -0.02 0.00 -1.01 0.00 0.00 57.07 57.54 2k8d s TYR 138 Cb -0.20 -3.22 0.03 0.00 -0.11 0.00 0.00 41.96 38.46 2k8d s TYR 138 CO -0.03 -0.42 0.06 0.00 -1.11 0.00 0.00 175.55 174.05 2k8d s MET 140 N 2.13 0.80 -0.35 0.00 0.23 -0.52 -0.95 119.30 120.65 2k8d s MET 140 Ca 0.04 -1.13 0.04 0.00 -1.03 0.00 0.00 55.69 53.62 2k8d s MET 140 Cb -0.12 -0.46 0.16 0.00 -1.53 0.00 0.00 34.83 32.88 2k8d s MET 140 CO -0.03 0.07 0.44 1.21 -2.03 0.00 0.00 175.02 174.68 2k8d s ASN 141 N -2.40 0.29 0.03 -1.18 2.47 0.14 -4.65 114.94 109.64 2k8d s ASN 141 Ca 0.04 -0.99 -0.05 0.00 0.42 0.00 0.00 52.86 52.29 2k8d s ASN 141 Cb -0.03 1.06 -0.01 0.00 -1.45 0.00 0.00 41.25 40.83 2k8d s ASN 141 CO -0.01 -0.27 0.08 -0.94 -3.72 0.00 0.00 177.10 172.25 2k8d s SER 142 N 1.91 0.16 0.32 -4.21 1.04 -1.26 -3.18 113.70 108.47 2k8d s SER 142 Ca 0.14 -0.46 0.02 0.00 0.48 0.00 0.00 55.95 56.14 2k8d s SER 142 Cb -0.12 0.20 0.54 0.00 0.10 0.00 0.00 66.02 66.75 2k8d s SER 142 CO -0.14 -0.44 1.89 0.00 0.98 0.00 0.00 173.24 175.53 2k8d h ALA 143 N 3.96 1.36 -0.24 5.32 0.00 -1.99 -3.27 119.26 124.39 2k8d h ALA 143 Ca -0.32 -0.17 -0.43 0.00 0.00 0.00 0.00 54.91 53.99 2k8d h ALA 143 Cb 1.19 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.80 2k8d h ALA 143 CO 0.47 0.46 1.42 0.00 0.00 0.00 0.00 179.25 181.60 2k8d n ALA 144 N -2.47 2.10 -2.71 0.00 0.00 -1.26 -4.28 120.51 111.89 2k8d n ALA 144 Ca 0.03 -3.03 -0.06 0.00 0.00 0.00 0.00 53.44 50.38 2k8d n ALA 144 Cb 0.20 -3.54 0.06 0.00 0.00 0.00 0.00 19.45 16.16 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 12.14 0.69 -4.79 0.00 4.77 -1.22 -4.56 117.00 124.03 2k8d n LEU 145 Ca 0.46 -3.47 -0.32 0.00 -0.03 0.00 0.00 56.01 52.65 2k8d n LEU 145 Cb 0.44 0.35 0.05 0.00 -2.33 0.00 0.00 43.42 41.93 2k8d n LEU 145 CO 0.83 1.51 0.72 -0.75 -1.33 0.00 0.00 177.39 178.37 2k8d s LYS 146 N -2.48 2.86 0.04 3.23 2.20 -0.71 -4.77 119.74 120.10 2k8d s LYS 146 Ca 0.25 1.18 -0.06 0.00 -0.36 0.00 0.00 55.97 56.98 2k8d s LYS 146 Cb 0.42 -1.97 -0.05 0.00 -1.51 0.00 0.00 37.83 34.72 2k8d s LYS 146 CO -0.01 -1.18 0.29 -0.06 -0.36 0.00 0.00 175.35 174.03 2k8d s PHE 147 N -2.67 3.56 0.32 4.03 0.08 -1.26 0.26 117.98 122.30 2k8d s PHE 147 Ca 0.62 0.56 0.03 0.00 0.12 0.00 0.00 56.93 58.27 2k8d s PHE 147 Cb -0.17 -1.99 -0.04 0.00 -0.57 0.00 0.00 43.02 40.26 2k8d s PHE 147 CO 0.47 0.58 0.15 0.96 -0.10 0.00 0.00 175.22 177.28 2k8d s ILE 148 N -1.38 0.40 1.18 0.64 -0.00 -0.33 -4.91 121.20 116.80 2k8d s ILE 148 Ca 0.31 -2.00 -0.15 0.00 -0.00 0.00 0.00 60.65 58.80 2k8d s ILE 148 Cb -0.13 -2.50 0.28 0.00 -0.00 0.00 0.00 42.46 40.11 2k8d s ILE 148 CO 0.18 0.00 1.03 -2.16 -0.00 0.00 0.00 174.94 174.00 2k8d s PRO 149 N -3.79 -1.05 0.31 0.37 0.04 -1.26 -0.88 135.00 128.74 2k8d s PRO 149 Ca 0.34 0.50 0.08 0.00 0.04 0.00 0.00 61.00 61.96 2k8d s PRO 149 Cb 0.05 -1.57 0.91 0.00 0.04 0.00 0.00 34.50 33.94 2k8d s PRO 149 CO 0.17 -3.72 1.48 0.54 0.04 0.00 0.00 177.00 175.51 2k8d n ARG 150 N -4.87 -0.07 0.00 4.56 5.12 -1.26 -4.11 116.66 116.03 2k8d n ARG 150 Ca 0.06 1.37 0.00 0.00 -1.93 0.00 0.00 57.85 57.35 2k8d n ARG 150 Cb 0.57 -2.28 0.00 0.00 -1.16 0.00 0.00 32.46 29.59 2k8d n ARG 150 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 2k8d n ASP 151 N -5.30 0.00 0.00 0.55 5.68 -1.26 -4.84 116.55 111.38 2k8d n ASP 151 Ca 0.27 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.56 2k8d n ASP 151 Cb 0.90 0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.90 2k8d n ASP 151 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2k8d n GLN 152 N -1.25 0.00 0.20 0.11 1.13 -1.26 -4.96 117.38 111.34 2k8d n GLN 152 Ca 0.00 -0.10 0.18 0.00 -1.94 0.00 0.00 57.00 55.14 2k8d n GLN 152 Cb 0.00 -0.39 0.83 0.00 0.11 0.00 0.00 30.24 30.79 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 1.52 0.34 0.00 5.09 -0.00 -1.95 -3.49 117.51 119.03 2k8d h ILE 153 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.86 2k8d h ILE 153 Cb 0.63 0.76 0.00 0.00 -0.00 0.00 0.00 36.82 38.22 2k8d h ILE 153 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 178.15 178.76