#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 0.77 0.00 2.12 1.02 -1.26 -5.06 119.74 117.33 2k8d s LYS 5 Ca 0.00 0.46 0.00 0.00 0.02 0.00 0.00 55.97 56.45 2k8d s LYS 5 Cb 0.00 0.36 0.00 0.00 -0.52 0.00 0.00 37.83 37.67 2k8d s LYS 5 CO 0.00 -0.17 1.18 -0.25 -0.92 0.00 0.00 175.35 175.19 2k8d n ASP 6 N 1.99 3.38 -1.53 2.83 9.92 -1.26 -4.73 116.55 127.15 2k8d n ASP 6 Ca -0.17 -1.99 -0.04 0.00 -0.53 0.00 0.00 54.79 52.06 2k8d n ASP 6 Cb 0.56 -0.62 -0.01 0.00 -0.64 0.00 0.00 41.12 40.41 2k8d n ASP 6 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2k8d n ARG 7 N 0.79 0.13 -3.95 -1.24 1.74 -1.26 -3.64 116.66 109.23 2k8d n ARG 7 Ca 0.00 -0.78 -0.13 0.00 -0.77 0.00 0.00 57.85 56.17 2k8d n ARG 7 Cb 0.47 0.68 -0.14 0.00 -1.02 0.00 0.00 32.46 32.45 2k8d n ARG 7 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 2k8d s ILE 8 N -2.41 0.12 0.28 0.55 -4.36 0.19 -4.63 121.20 110.93 2k8d s ILE 8 Ca 0.09 -0.11 -0.26 0.00 -0.26 0.00 0.00 60.65 60.11 2k8d s ILE 8 Cb 0.00 -0.11 -0.09 0.00 1.25 0.00 0.00 42.46 43.50 2k8d s ILE 8 CO 0.06 0.00 0.91 -2.16 0.24 0.00 0.00 174.94 174.00 2k8d s PRO 9 N -0.11 4.62 -0.06 0.37 0.04 -1.26 -2.39 135.00 136.21 2k8d s PRO 9 Ca -0.00 1.32 -0.01 0.00 0.04 0.00 0.00 61.00 62.34 2k8d s PRO 9 Cb -0.01 -2.96 0.03 0.00 0.04 0.00 0.00 34.50 31.60 2k8d s PRO 9 CO -0.00 0.37 -0.00 0.42 0.04 0.00 0.00 177.00 177.83 2k8d s ILE 10 N -1.47 0.35 -0.32 0.56 -1.09 0.57 -3.85 121.20 115.95 2k8d s ILE 10 Ca 0.46 0.11 -0.01 0.00 -2.23 0.00 0.00 60.65 58.99 2k8d s ILE 10 Cb -0.21 -0.49 0.11 0.00 -1.58 0.00 0.00 42.46 40.29 2k8d s ILE 10 CO 0.26 0.24 0.12 -0.36 -1.23 0.00 0.00 174.94 173.97 2k8d s PHE 11 N 1.77 1.62 -0.94 3.97 0.40 -1.26 -0.31 117.98 123.23 2k8d s PHE 11 Ca 0.02 -1.76 -0.23 0.00 -0.60 0.00 0.00 56.93 54.36 2k8d s PHE 11 Cb -0.13 -1.66 -0.13 0.00 0.51 0.00 0.00 43.02 41.61 2k8d s PHE 11 CO -0.04 -0.86 1.92 0.43 0.70 0.00 0.00 175.22 177.36 2k8d n SER 12 N 4.70 2.73 -0.34 1.36 7.64 -0.97 -4.76 113.62 123.98 2k8d n SER 12 Ca -0.01 -2.68 0.06 0.00 1.01 0.00 0.00 58.87 57.25 2k8d n SER 12 Cb 0.41 -1.39 0.25 0.00 -1.01 0.00 0.00 64.21 62.46 2k8d n SER 12 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 2k8d h VAL 13 N 5.30 0.98 0.00 0.44 3.04 -1.85 0.61 116.25 124.78 2k8d h VAL 13 Ca 0.32 -0.34 0.00 0.00 -1.01 0.00 0.00 66.70 65.66 2k8d h VAL 13 Cb 0.80 -0.11 0.00 0.00 -2.01 0.00 0.00 31.29 29.97 2k8d h VAL 13 CO 1.61 0.18 0.09 0.00 -1.01 0.00 0.00 177.57 178.44 2k8d h ALA 14 N 1.52 1.07 0.00 3.17 0.00 -1.90 0.08 119.26 123.20 2k8d h ALA 14 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.36 2k8d h ALA 14 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2k8d h ALA 14 CO -0.21 -0.07 -0.18 1.17 0.00 0.00 0.00 179.25 179.97 2k8d n LYS 15 N -2.33 0.70 -2.58 0.00 4.81 0.01 -5.02 118.16 113.76 2k8d n LYS 15 Ca -0.01 -1.24 -0.08 0.00 -0.87 0.00 0.00 58.31 56.11 2k8d n LYS 15 Cb 0.13 -0.77 -0.02 0.00 0.02 0.00 0.00 35.03 34.39 2k8d n LYS 15 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2k8d n ASN 16 N -0.35 -0.06 -4.89 3.14 2.85 0.01 -4.95 115.26 111.01 2k8d n ASN 16 Ca 0.03 -0.28 -0.23 0.00 -0.11 0.00 0.00 54.58 54.00 2k8d n ASN 16 Cb 0.56 -0.35 0.06 0.00 1.24 0.00 0.00 39.78 41.29 2k8d n ASN 16 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 2k8d s ARG 17 N -3.26 2.26 0.03 1.20 0.52 -0.13 -4.92 118.95 114.65 2k8d s ARG 17 Ca 0.08 -0.72 -0.01 0.00 -0.52 0.00 0.00 55.73 54.56 2k8d s ARG 17 Cb -0.05 -2.37 -0.03 0.00 0.52 0.00 0.00 34.95 33.02 2k8d s ARG 17 CO 0.22 -1.01 -0.02 0.54 0.02 0.00 0.00 175.30 175.05 2k8d s VAL 18 N -2.97 0.16 0.23 3.52 0.11 -1.26 -2.29 120.40 117.90 2k8d s VAL 18 Ca 0.60 -1.28 -0.05 0.00 -2.93 0.00 0.00 61.98 58.32 2k8d s VAL 18 Cb -0.09 -0.82 -0.03 0.00 -1.53 0.00 0.00 36.38 33.91 2k8d s VAL 18 CO 0.41 -0.71 0.27 -1.83 -3.33 0.00 0.00 175.10 169.92 2k8d s GLU 19 N -2.54 1.39 -0.43 1.54 -1.05 0.57 -4.97 118.70 113.22 2k8d s GLU 19 Ca -0.06 -1.53 0.02 0.00 -0.15 0.00 0.00 54.97 53.25 2k8d s GLU 19 Cb -0.02 0.35 0.13 0.00 -0.44 0.00 0.00 34.13 34.14 2k8d s GLU 19 CO -0.05 -0.51 0.20 1.41 0.95 0.00 0.00 175.26 177.26 2k8d s MET 20 N -4.01 1.34 0.58 -4.83 1.75 -1.26 -0.31 119.30 112.56 2k8d s MET 20 Ca 0.33 -1.97 -0.15 0.00 -1.25 0.00 0.00 55.69 52.66 2k8d s MET 20 Cb 0.04 -2.54 -0.05 0.00 2.84 0.00 0.00 34.83 35.13 2k8d s MET 20 CO 0.12 -1.11 1.03 0.08 -0.65 0.00 0.00 175.02 174.49 2k8d s VAL 21 N 0.48 4.21 0.91 10.11 1.01 -1.01 -4.84 120.40 131.27 2k8d s VAL 21 Ca 0.16 0.97 -0.14 0.00 0.00 0.00 0.00 61.98 62.96 2k8d s VAL 21 Cb -0.23 -3.57 0.15 0.00 0.00 0.00 0.00 36.38 32.73 2k8d s VAL 21 CO -0.04 -0.70 1.24 -1.83 0.00 0.00 0.00 175.10 173.78 2k8d s GLU 22 N -4.33 1.11 0.72 2.72 1.03 -1.26 -0.64 118.70 118.04 2k8d s GLU 22 Ca 0.60 -0.14 -0.11 0.00 0.03 0.00 0.00 54.97 55.35 2k8d s GLU 22 Cb -0.13 -1.87 0.02 0.00 -0.80 0.00 0.00 34.13 31.35 2k8d s GLU 22 CO 0.39 -2.14 1.08 1.03 -1.33 0.00 0.00 175.26 174.29 2k8d s ARG 23 N -5.70 2.76 -1.29 -4.83 0.52 -1.24 -4.46 118.95 104.71 2k8d s ARG 23 Ca 0.68 0.63 -0.09 0.00 -0.52 0.00 0.00 55.73 56.43 2k8d s ARG 23 Cb -0.08 -2.00 0.16 0.00 0.52 0.00 0.00 34.95 33.55 2k8d s ARG 23 CO 0.52 -1.14 1.94 1.51 0.02 0.00 0.00 175.30 178.15 2k8d n ILE 24 N -3.11 4.40 -3.82 1.52 0.13 -1.26 -4.84 119.36 112.38 2k8d n ILE 24 Ca 0.07 -4.34 -0.33 0.00 -1.10 0.00 0.00 62.75 57.05 2k8d n ILE 24 Cb 0.56 -2.34 -0.12 0.00 -0.84 0.00 0.00 39.64 36.90 2k8d n ILE 24 CO 0.00 0.00 0.00 -1.61 2.80 0.00 0.00 176.55 177.74 2k8d s GLU 25 N 0.34 2.32 0.27 9.51 0.41 -1.26 -5.04 118.70 125.24 2k8d s GLU 25 Ca 0.41 -2.61 0.03 0.00 -0.41 0.00 0.00 54.97 52.39 2k8d s GLU 25 Cb 0.11 -3.55 -0.01 0.00 -1.78 0.00 0.00 34.13 28.90 2k8d s GLU 25 CO -0.01 -1.15 0.09 1.28 -0.49 0.00 0.00 175.26 174.99 2k8d n LEU 26 N 3.26 0.00 -4.68 1.80 4.77 -1.26 -5.18 117.00 115.71 2k8d n LEU 26 Ca 0.07 -2.04 -0.23 0.00 -0.03 0.00 0.00 56.01 53.78 2k8d n LEU 26 Cb 0.35 0.66 -0.07 0.00 -2.33 0.00 0.00 43.42 42.03 2k8d n LEU 26 CO 0.34 -0.31 -0.27 -0.55 -1.33 0.00 0.00 177.39 175.26 2k8d s SER 27 N -2.64 4.55 0.37 -1.43 0.15 -1.26 -5.04 113.70 108.40 2k8d s SER 27 Ca 0.13 -0.74 0.12 0.00 0.70 0.00 0.00 55.95 56.16 2k8d s SER 27 Cb 0.01 -0.76 0.92 0.00 -1.71 0.00 0.00 66.02 64.48 2k8d s SER 27 CO 0.09 -0.15 1.84 -0.78 1.20 0.00 0.00 173.24 175.44 2k8d h ASP 28 N 1.74 0.58 -1.17 5.45 1.82 -2.03 -0.51 116.42 122.31 2k8d h ASP 28 Ca -0.44 0.06 0.33 0.00 -0.39 0.00 0.00 57.03 56.59 2k8d h ASP 28 Cb 1.25 -0.05 -0.09 0.00 0.68 0.00 0.00 39.33 41.12 2k8d h ASP 28 CO 0.62 0.24 0.78 0.44 -1.61 0.00 0.00 179.24 179.71 2k8d h ASP 29 N 0.58 0.28 0.07 2.28 5.19 -2.03 -1.85 116.42 120.95 2k8d h ASP 29 Ca 0.50 0.07 -0.14 0.00 -0.62 0.00 0.00 57.03 56.84 2k8d h ASP 29 Cb 0.99 0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.54 2k8d h ASP 29 CO -0.24 -0.00 -0.66 -0.33 -3.12 0.00 0.00 179.24 174.89 2k8d h GLU 30 N 0.22 0.16 -2.04 3.56 4.39 -1.49 -3.39 114.58 115.98 2k8d h GLU 30 Ca 0.65 -0.27 -0.00 0.00 0.34 0.00 0.00 59.36 60.08 2k8d h GLU 30 Cb 2.00 0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 30.75 2k8d h GLU 30 CO -0.25 1.13 0.02 0.91 -1.16 0.00 0.00 179.01 179.65 2k8d n TRP 31 N -4.29 0.00 -0.07 4.33 7.02 -0.69 -1.17 117.44 122.56 2k8d n TRP 31 Ca -0.16 -0.21 0.00 0.00 -1.02 0.00 0.00 57.50 56.11 2k8d n TRP 31 Cb 0.70 -0.32 0.00 0.00 -2.42 0.00 0.00 31.31 29.27 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 1.95 0.00 0.00 -0.99 1.85 -1.26 -4.70 116.66 113.51 2k8d n ARG 32 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2k8d n ARG 32 Cb 0.10 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.51 2k8d n ARG 32 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 2k8d n GLU 33 N 0.00 3.62 -0.08 2.89 0.28 -0.32 -4.68 120.64 122.35 2k8d n GLU 33 Ca 0.00 0.00 0.06 0.00 -0.16 0.00 0.00 57.16 57.06 2k8d n GLU 33 Cb 0.00 -0.50 0.10 0.00 1.43 0.00 0.00 31.44 32.47 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 -0.76 0.39 -2.89 3.84 -5.35 -0.46 -5.02 119.36 109.12 2k8d n ILE 34 Ca 0.00 -0.70 -0.19 0.00 -0.27 0.00 0.00 62.75 61.60 2k8d n ILE 34 Cb 0.00 0.96 0.02 0.00 -1.74 0.00 0.00 39.64 38.89 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 -1.04 3.49 0.50 7.28 1.43 -1.26 -5.04 118.68 124.04 2k8d s LEU 35 Ca 0.20 -0.32 -0.23 0.00 -1.03 0.00 0.00 54.13 52.74 2k8d s LEU 35 Cb 0.12 -2.65 -0.06 0.00 0.03 0.00 0.00 46.19 43.63 2k8d s LEU 35 CO 0.17 -0.94 1.38 -1.81 0.23 0.00 0.00 176.35 175.38 2k8d s ASP 36 N -4.40 5.59 0.31 2.29 1.01 -1.26 -4.90 116.67 115.32 2k8d s ASP 36 Ca 0.56 2.81 0.23 0.00 0.71 0.00 0.00 52.55 56.87 2k8d s ASP 36 Cb -0.10 -2.64 1.15 0.00 1.01 0.00 0.00 42.92 42.34 2k8d s ASP 36 CO 0.35 -1.36 1.71 1.55 0.21 0.00 0.00 175.17 177.63 2k8d h PRO 37 N 1.89 0.00 -0.26 8.23 0.13 -1.99 -0.41 132.00 139.60 2k8d h PRO 37 Ca -0.51 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.48 2k8d h PRO 37 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 2k8d h PRO 37 CO 0.59 0.00 -0.41 1.49 -0.23 0.00 0.00 178.00 179.44 2k8d h GLU 38 N 0.00 0.73 -0.80 0.86 4.57 -2.00 -3.19 114.58 114.75 2k8d h GLU 38 Ca 0.00 -0.45 -0.03 0.00 -1.18 0.00 0.00 59.36 57.70 2k8d h GLU 38 Cb 0.14 0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 28.74 2k8d h GLU 38 CO 0.00 1.07 0.37 0.00 -1.18 0.00 0.00 179.01 179.27 2k8d h ALA 39 N 0.66 1.04 -0.15 2.92 0.00 -1.43 0.16 119.26 122.46 2k8d h ALA 39 Ca 0.02 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.81 2k8d h ALA 39 Cb 1.01 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 2k8d h ALA 39 CO 0.09 0.62 -0.20 0.35 0.00 0.00 0.00 179.25 180.11 2k8d h PHE 40 N 1.15 -0.51 0.02 0.00 3.57 -1.63 -1.70 116.94 117.82 2k8d h PHE 40 Ca 0.27 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.72 2k8d h PHE 40 Cb 0.14 0.25 0.01 0.00 2.79 0.00 0.00 35.95 39.14 2k8d h PHE 40 CO 0.01 -0.27 -0.34 0.07 -2.23 0.00 0.00 178.31 175.55 2k8d h ARG 41 N -0.24 0.20 0.00 1.11 0.11 -1.32 -3.24 114.38 111.00 2k8d h ARG 41 Ca 0.10 -0.24 -0.01 0.00 0.10 0.00 0.00 59.98 59.94 2k8d h ARG 41 Cb 0.40 0.07 -0.00 0.00 1.11 0.00 0.00 29.97 31.55 2k8d h ARG 41 CO -0.29 1.00 -0.06 -0.24 0.10 0.00 0.00 179.97 180.48 2k8d h VAL 42 N -0.50 0.48 0.00 0.08 3.04 -0.75 0.94 116.25 119.54 2k8d h VAL 42 Ca -0.05 -0.26 0.00 0.00 -1.01 0.00 0.00 66.70 65.38 2k8d h VAL 42 Cb 1.13 1.17 0.00 0.00 -2.01 0.00 0.00 31.29 31.58 2k8d h VAL 42 CO 0.07 0.05 0.00 0.00 -1.01 0.00 0.00 177.57 176.68 2k8d n ALA 43 N -2.27 1.44 0.00 3.17 0.00 -0.64 -0.98 120.51 121.22 2k8d n ALA 43 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2k8d n ALA 43 Cb 0.16 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.46 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 -1.48 0.00 -0.06 0.00 1.85 0.28 -4.71 116.66 112.55 2k8d n ARG 44 Ca 0.02 0.00 0.11 0.00 -1.00 0.00 0.00 57.85 56.99 2k8d n ARG 44 Cb 0.10 -0.89 0.42 0.00 -1.05 0.00 0.00 32.46 31.04 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 -2.48 1.67 -0.51 2.89 2.85 -0.92 -4.95 118.16 116.70 2k8d n LYS 45 Ca 0.00 -1.00 0.00 0.00 -1.05 0.00 0.00 58.31 56.26 2k8d n LYS 45 Cb 0.46 -1.41 0.00 0.00 -0.65 0.00 0.00 35.03 33.43 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 0.21 0.00 -0.14 0.58 0.00 -0.16 -4.36 120.51 116.65 2k8d n ALA 46 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2k8d n ALA 46 Cb 0.32 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.85 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 -0.90 -1.74 3.42 0.00 0.00 -1.24 -3.50 105.19 101.23 2k8d n GLY 47 Ca 0.00 0.44 -0.13 0.00 0.00 0.00 0.00 46.02 46.32 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 -0.86 0.02 0.77 2.61 -1.32 -1.26 -4.79 115.64 110.80 2k8d s THR 48 Ca 0.00 -0.14 -0.11 0.00 -1.21 0.00 0.00 61.69 60.23 2k8d s THR 48 Cb 0.00 -1.01 0.05 0.00 -1.51 0.00 0.00 72.50 70.04 2k8d s THR 48 CO 0.00 -0.08 1.08 -1.61 -2.21 0.00 0.00 174.62 171.81 2k8d s GLU 49 N -2.88 2.30 0.59 7.08 2.02 -1.26 -4.89 118.70 121.66 2k8d s GLU 49 Ca -0.03 0.83 -0.17 0.00 0.02 0.00 0.00 54.97 55.62 2k8d s GLU 49 Cb -0.00 -1.93 -0.03 0.00 0.10 0.00 0.00 34.13 32.27 2k8d s GLU 49 CO -0.05 -1.52 1.11 -1.25 0.02 0.00 0.00 175.26 173.57 2k8d s PRO 50 N -5.06 3.14 0.89 0.39 0.04 -1.26 -5.05 135.00 128.09 2k8d s PRO 50 Ca 0.60 1.46 -0.12 0.00 0.04 0.00 0.00 61.00 62.98 2k8d s PRO 50 Cb -0.15 -1.99 0.13 0.00 0.04 0.00 0.00 34.50 32.53 2k8d s PRO 50 CO 0.55 -0.99 1.12 -1.25 0.04 0.00 0.00 177.00 176.47 2k8d s PRO 51 N -3.71 1.30 0.23 0.56 0.04 -1.26 -5.11 135.00 127.05 2k8d s PRO 51 Ca 0.69 0.44 0.01 0.00 0.04 0.00 0.00 61.00 62.18 2k8d s PRO 51 Cb -0.21 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 2k8d s PRO 51 CO 0.34 -2.12 0.16 -0.06 0.04 0.00 0.00 177.00 175.36 2k8d s PHE 52 N -3.18 1.30 -0.33 0.56 0.40 -1.26 -5.10 117.98 110.36 2k8d s PHE 52 Ca 0.63 -1.45 -0.28 0.00 -0.60 0.00 0.00 56.93 55.24 2k8d s PHE 52 Cb -0.15 -0.60 -0.04 0.00 0.51 0.00 0.00 43.02 42.74 2k8d s PHE 52 CO 0.54 -0.69 2.08 0.95 0.70 0.00 0.00 175.22 178.80 2k8d s THR 53 N -3.99 3.19 0.00 0.64 -4.23 -1.26 -4.83 115.64 105.15 2k8d s THR 53 Ca 0.39 0.18 0.00 0.00 -1.18 0.00 0.00 61.69 61.08 2k8d s THR 53 Cb 0.06 -3.30 0.00 0.00 1.34 0.00 0.00 72.50 70.60 2k8d s THR 53 CO 0.16 -0.21 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 2k8d n GLY 54 N 5.69 1.37 3.13 3.99 0.00 -1.26 -5.19 105.19 112.92 2k8d n GLY 54 Ca 0.28 -0.80 -0.09 0.00 0.00 0.00 0.00 46.02 45.41 2k8d n GLY 54 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k8d s LYS 55 N -0.71 0.73 -0.04 1.61 -2.85 -1.26 -5.16 119.74 112.05 2k8d s LYS 55 Ca 0.00 -1.28 -0.22 0.00 -1.00 0.00 0.00 55.97 53.46 2k8d s LYS 55 Cb 0.00 0.02 0.05 0.00 -2.06 0.00 0.00 37.83 35.84 2k8d s LYS 55 CO 0.00 -0.08 0.49 -0.47 0.10 0.00 0.00 175.35 175.39 2k8d s TYR 56 N -3.79 -0.42 0.28 1.78 6.14 -1.26 -5.19 117.35 114.89 2k8d s TYR 56 Ca 0.10 0.72 -0.15 0.00 0.64 0.00 0.00 57.07 58.39 2k8d s TYR 56 Cb 0.07 0.24 0.01 0.00 0.42 0.00 0.00 41.96 42.70 2k8d s TYR 56 CO -0.07 -0.48 0.59 -3.38 0.64 0.00 0.00 175.55 172.84 2k8d s HIS 57 N -1.16 0.23 0.00 4.97 -3.43 -1.26 -5.19 115.29 109.45 2k8d s HIS 57 Ca -0.12 -0.65 0.00 0.00 -0.80 0.00 0.00 55.06 53.50 2k8d s HIS 57 Cb -0.03 0.39 0.00 0.00 -1.43 0.00 0.00 32.58 31.52 2k8d s HIS 57 CO 0.07 -1.14 0.00 -0.40 -2.00 0.00 0.00 174.74 171.26 2k8d n ASP 58 N -0.61 0.00 -2.61 7.38 5.68 -1.26 -5.10 116.55 120.04 2k8d n ASP 58 Ca -0.03 -0.01 -0.01 0.00 -0.50 0.00 0.00 54.79 54.24 2k8d n ASP 58 Cb 0.61 0.00 0.08 0.00 -1.14 0.00 0.00 41.12 40.67 2k8d n ASP 58 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2k8d n LEU 59 N 0.00 -0.14 -4.64 -2.12 -0.00 -1.26 -5.15 117.00 103.68 2k8d n LEU 59 Ca 0.00 -3.03 -0.24 0.00 -0.00 0.00 0.00 56.01 52.74 2k8d n LEU 59 Cb 0.00 0.24 -0.08 0.00 -0.00 0.00 0.00 43.42 43.58 2k8d n LEU 59 CO 0.00 1.39 -0.31 -1.38 -0.00 0.00 0.00 177.39 177.09 2k8d s HIS 60 N -1.44 2.62 -0.42 1.47 -3.43 -1.26 -5.06 115.29 107.77 2k8d s HIS 60 Ca 0.17 -0.32 0.09 0.00 -0.80 0.00 0.00 55.06 54.19 2k8d s HIS 60 Cb 0.37 -1.34 0.31 0.00 -1.43 0.00 0.00 32.58 30.50 2k8d s HIS 60 CO -0.09 0.54 0.86 -3.47 -2.00 0.00 0.00 174.74 170.57 2k8d n ASP 61 N -0.94 -0.81 -3.94 7.38 2.03 -1.26 -5.11 116.55 113.90 2k8d n ASP 61 Ca -0.05 -3.24 -0.09 0.00 0.52 0.00 0.00 54.79 51.93 2k8d n ASP 61 Cb 0.60 0.56 -0.05 0.00 -0.72 0.00 0.00 41.12 41.52 2k8d n ASP 61 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2k8d s ASP 62 N -1.77 -0.13 0.00 1.67 -1.08 -1.26 -5.18 116.67 108.92 2k8d s ASP 62 Ca 0.32 -0.82 0.00 0.00 -0.52 0.00 0.00 52.55 51.53 2k8d s ASP 62 Cb 0.29 0.60 0.00 0.00 -1.46 0.00 0.00 42.92 42.35 2k8d s ASP 62 CO -0.09 -1.14 0.00 0.61 0.52 0.00 0.00 175.17 175.06 2k8d n GLY 63 N -0.38 2.47 3.25 2.66 0.00 -1.26 -4.85 105.19 107.08 2k8d n GLY 63 Ca -0.03 -2.13 -0.15 0.00 0.00 0.00 0.00 46.02 43.71 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 -2.05 0.13 0.07 -0.61 -4.36 -0.27 -3.76 121.20 110.37 2k8d s ILE 64 Ca 0.00 -2.00 -0.23 0.00 -0.26 0.00 0.00 60.65 58.16 2k8d s ILE 64 Cb 0.00 -2.52 -0.06 0.00 1.25 0.00 0.00 42.46 41.13 2k8d s ILE 64 CO 0.00 0.00 0.68 -0.31 0.24 0.00 0.00 174.94 175.55 2k8d s TYR 65 N -3.88 3.79 -0.21 1.37 2.02 -0.01 -0.67 117.35 119.75 2k8d s TYR 65 Ca 0.39 1.41 -0.04 0.00 -0.37 0.00 0.00 57.07 58.45 2k8d s TYR 65 Cb 0.06 -2.68 -0.01 0.00 -0.40 0.00 0.00 41.96 38.93 2k8d s TYR 65 CO 0.16 0.44 -0.04 -0.98 -1.57 0.00 0.00 175.55 173.56 2k8d s ARG 66 N -0.65 3.41 -0.98 -0.62 1.04 0.76 -0.94 118.95 120.97 2k8d s ARG 66 Ca 0.34 -0.61 -0.24 0.00 -1.04 0.00 0.00 55.73 54.17 2k8d s ARG 66 Cb -0.20 -3.01 -0.05 0.00 -2.04 0.00 0.00 34.95 29.65 2k8d s ARG 66 CO 0.22 -0.15 1.93 0.00 -0.04 0.00 0.00 175.30 177.25 2k8d h ILE 68 N 6.98 0.40 0.00 0.00 2.10 -1.82 -0.33 117.51 124.84 2k8d h ILE 68 Ca 0.13 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.07 2k8d h ILE 68 Cb 0.99 0.64 0.00 0.00 -1.09 0.00 0.00 36.82 37.36 2k8d h ILE 68 CO 1.22 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 178.29 2k8d n GLY 71 N 0.01 0.21 3.77 0.00 0.00 -0.39 -4.94 105.19 103.85 2k8d n GLY 71 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.26 3.19 -0.01 2.61 2.01 -1.20 -4.73 115.64 116.26 2k8d s THR 72 Ca 0.00 1.06 -0.19 0.00 0.31 0.00 0.00 61.69 62.86 2k8d s THR 72 Cb 0.00 -3.62 -0.05 0.00 0.01 0.00 0.00 72.50 68.84 2k8d s THR 72 CO 0.00 0.14 0.55 1.51 -0.69 0.00 0.00 174.62 176.14 2k8d s ASP 73 N -1.03 6.92 0.00 3.53 -4.77 -1.26 0.22 116.67 120.28 2k8d s ASP 73 Ca 0.54 1.10 0.00 0.00 -3.30 0.00 0.00 52.55 50.88 2k8d s ASP 73 Cb -0.32 -2.34 0.00 0.00 -1.09 0.00 0.00 42.92 39.18 2k8d s ASP 73 CO 0.40 0.13 0.00 0.00 0.70 0.00 0.00 175.17 176.41 2k8d n LEU 74 N 2.64 0.00 -4.65 2.11 -0.00 -0.12 -4.20 117.00 112.79 2k8d n LEU 74 Ca -0.08 0.00 -0.42 0.00 -0.00 0.00 0.00 56.01 55.51 2k8d n LEU 74 Cb 0.51 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.90 2k8d n LEU 74 CO 0.42 0.00 1.60 -0.36 -0.00 0.00 0.00 177.39 179.06 2k8d s PHE 75 N 0.29 1.39 0.59 1.47 0.08 -1.25 -4.74 117.98 115.81 2k8d s PHE 75 Ca 0.00 -0.16 -0.17 0.00 0.12 0.00 0.00 56.93 56.72 2k8d s PHE 75 Cb 0.00 -4.14 -0.04 0.00 -0.57 0.00 0.00 43.02 38.28 2k8d s PHE 75 CO 0.00 -4.97 1.11 0.34 -0.10 0.00 0.00 175.22 171.60 2k8d s ASP 76 N 4.95 5.53 0.59 1.36 2.15 -1.26 -0.83 116.67 129.15 2k8d s ASP 76 Ca 0.88 2.06 0.28 0.00 0.43 0.00 0.00 52.55 56.20 2k8d s ASP 76 Cb -0.39 -2.56 1.61 0.00 -0.30 0.00 0.00 42.92 41.28 2k8d s ASP 76 CO 0.38 -1.35 2.06 0.28 -0.17 0.00 0.00 175.17 176.38 2k8d h SER 77 N 0.69 0.00 -0.02 -0.34 0.02 -1.94 0.30 113.55 112.26 2k8d h SER 77 Ca -0.48 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.47 2k8d h SER 77 Cb 1.25 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.79 2k8d h SER 77 CO 0.56 0.00 0.03 1.05 -1.14 0.00 0.00 176.83 177.32 2k8d h GLU 78 N 0.00 0.00 -0.66 3.45 4.11 -1.92 -0.89 114.58 118.67 2k8d h GLU 78 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.54 2k8d h GLU 78 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2k8d h GLU 78 CO -0.00 0.00 0.00 0.25 0.07 0.00 0.00 179.01 179.33 2k8d n THR 79 N -3.82 2.00 -2.51 -1.06 -2.24 0.09 -3.65 114.28 103.09 2k8d n THR 79 Ca -0.02 -1.07 -0.02 0.00 -2.27 0.00 0.00 64.05 60.67 2k8d n THR 79 Cb 0.11 -0.22 0.04 0.00 -2.10 0.00 0.00 70.33 68.16 2k8d n THR 79 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2k8d n LYS 80 N 0.61 0.85 -1.50 -0.78 2.85 -0.41 -4.22 118.16 115.56 2k8d n LYS 80 Ca 0.22 -1.87 -0.34 0.00 -1.05 0.00 0.00 58.31 55.27 2k8d n LYS 80 Cb 0.94 -0.13 -0.05 0.00 -0.65 0.00 0.00 35.03 35.14 2k8d n LYS 80 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2k8d n PHE 81 N -0.54 2.02 -3.41 5.58 7.35 -0.80 -4.63 117.46 123.03 2k8d n PHE 81 Ca -0.10 -2.65 -0.43 0.00 -0.76 0.00 0.00 57.45 53.52 2k8d n PHE 81 Cb 0.87 -2.04 -0.10 0.00 0.35 0.00 0.00 39.48 38.57 2k8d n PHE 81 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2k8d s ASP 82 N 1.39 6.14 -0.66 -2.13 -1.08 -1.26 -4.99 116.67 114.08 2k8d s ASP 82 Ca 0.63 -0.79 -0.30 0.00 -0.52 0.00 0.00 52.55 51.57 2k8d s ASP 82 Cb 0.22 -2.18 -0.14 0.00 -1.46 0.00 0.00 42.92 39.36 2k8d s ASP 82 CO -0.08 -0.49 2.48 -1.20 0.52 0.00 0.00 175.17 176.40 2k8d n SER 83 N 5.32 1.46 0.00 -0.34 7.64 -1.26 -0.10 113.62 126.34 2k8d n SER 83 Ca -0.10 -0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.74 2k8d n SER 83 Cb 0.47 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.42 2k8d n SER 83 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2k8d n GLY 84 N 6.34 1.54 0.18 0.23 0.00 -1.26 -4.63 105.19 107.59 2k8d n GLY 84 Ca 0.50 -0.03 -0.07 0.00 0.00 0.00 0.00 46.02 46.42 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 1.08 -3.14 2.61 2.02 -1.96 -3.46 112.91 110.05 2k8d h THR 85 Ca 0.00 -0.19 -0.20 0.00 0.77 0.00 0.00 66.41 66.79 2k8d h THR 85 Cb 0.00 0.48 -0.04 0.00 -1.74 0.00 0.00 68.15 66.86 2k8d h THR 85 CO 0.00 0.10 -0.23 0.61 0.37 0.00 0.00 175.52 176.37 2k8d n GLY 86 N -1.22 0.02 3.67 2.16 0.00 0.86 -4.93 105.19 105.76 2k8d n GLY 86 Ca 0.01 0.00 -0.39 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 -2.67 1.50 -1.17 1.61 4.27 -1.26 -4.85 117.44 114.87 2k8d n TRP 87 Ca -0.11 0.45 -0.31 0.00 -3.89 0.00 0.00 57.50 53.64 2k8d n TRP 87 Cb 0.50 -2.24 -0.06 0.00 -1.36 0.00 0.00 31.31 28.14 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 -0.90 3.13 -3.64 -2.67 -0.04 -1.26 -4.68 135.00 124.94 2k8d n PRO 88 Ca 0.12 -1.84 -0.02 0.00 -0.04 0.00 0.00 63.50 61.73 2k8d n PRO 88 Cb 0.45 -2.57 -0.04 0.00 -0.04 0.00 0.00 33.50 31.30 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 2.25 -1.09 0.00 3.54 1.04 -1.26 -1.79 113.70 116.39 2k8d s SER 89 Ca 0.66 1.52 0.00 0.00 0.48 0.00 0.00 55.95 58.61 2k8d s SER 89 Cb 0.20 2.16 0.00 0.00 0.10 0.00 0.00 66.02 68.48 2k8d s SER 89 CO -0.04 -0.22 0.00 0.33 0.98 0.00 0.00 173.24 174.29 2k8d n PHE 90 N 5.28 -0.06 0.07 5.02 7.35 -0.76 -4.86 117.46 129.50 2k8d n PHE 90 Ca -0.13 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 56.59 2k8d n PHE 90 Cb 0.50 0.00 0.04 0.00 0.35 0.00 0.00 39.48 40.38 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 0.10 -3.86 -5.13 0.18 -1.26 0.13 117.16 107.32 2k8d n TYR 91 Ca 0.00 -0.24 -0.11 0.00 1.88 0.00 0.00 57.90 59.43 2k8d n TYR 91 Cb 0.00 -0.02 0.00 0.00 -0.38 0.00 0.00 39.34 38.95 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 0.13 -1.80 -4.23 9.48 -0.08 -1.26 -4.65 116.55 114.15 2k8d n ASP 92 Ca 0.04 -2.61 -0.13 0.00 -1.51 0.00 0.00 54.79 50.58 2k8d n ASP 92 Cb 0.23 3.10 -0.10 0.00 2.34 0.00 0.00 41.12 46.69 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 -2.42 0.37 0.10 5.18 -7.23 -1.26 -4.82 120.40 110.32 2k8d s VAL 93 Ca 0.20 -1.97 -0.24 0.00 -1.81 0.00 0.00 61.98 58.16 2k8d s VAL 93 Cb -0.03 -2.31 -0.11 0.00 0.56 0.00 0.00 36.38 34.49 2k8d s VAL 93 CO 0.15 -0.26 1.71 1.62 -0.31 0.00 0.00 175.10 178.01 2k8d h VAL 94 N 2.64 0.82 0.00 1.32 3.04 -1.94 -3.49 116.25 118.65 2k8d h VAL 94 Ca -0.37 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.32 2k8d h VAL 94 Cb 1.22 0.82 0.00 0.00 -2.01 0.00 0.00 31.29 31.33 2k8d h VAL 94 CO 0.59 0.00 0.00 -1.20 -1.01 0.00 0.00 177.57 175.95 2k8d n SER 95 N -5.19 0.00 -4.55 3.17 7.64 -1.26 -4.99 113.62 108.44 2k8d n SER 95 Ca -0.06 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.47 2k8d n SER 95 Cb 0.12 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.28 2k8d n SER 95 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k8d n GLU 96 N -1.01 2.30 0.02 1.43 1.02 -1.26 -4.43 120.64 118.71 2k8d n GLU 96 Ca 0.00 -2.81 -0.01 0.00 -0.02 0.00 0.00 57.16 54.32 2k8d n GLU 96 Cb 0.00 -3.61 -0.00 0.00 -0.02 0.00 0.00 31.44 27.80 2k8d n GLU 96 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 2k8d n HIS 97 N 11.59 0.00 -2.09 -0.32 1.44 -1.26 -4.86 115.22 119.72 2k8d n HIS 97 Ca 0.47 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 56.17 2k8d n HIS 97 Cb 0.46 -0.04 0.10 0.00 0.12 0.00 0.00 29.99 30.63 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 -3.37 2.07 -4.38 4.39 5.15 -1.25 -4.35 115.26 113.52 2k8d n ASN 98 Ca -0.02 -3.09 -0.30 0.00 -0.60 0.00 0.00 54.58 50.57 2k8d n ASN 98 Cb 0.21 -0.42 -0.14 0.00 -0.53 0.00 0.00 39.78 38.90 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 -2.63 2.34 -0.00 -1.44 2.07 -1.26 -1.45 121.20 118.83 2k8d s ILE 99 Ca 0.38 -1.31 0.05 0.00 -1.41 0.00 0.00 60.65 58.36 2k8d s ILE 99 Cb 0.38 -1.93 -0.01 0.00 0.13 0.00 0.00 42.46 41.02 2k8d s ILE 99 CO -0.08 0.37 -0.16 -0.75 -1.91 0.00 0.00 174.94 172.42 2k8d s LYS 100 N -1.26 1.25 -0.00 3.50 2.47 0.72 -4.46 119.74 121.96 2k8d s LYS 100 Ca 0.12 -0.62 0.05 0.00 -1.56 0.00 0.00 55.97 53.96 2k8d s LYS 100 Cb -0.10 -1.23 -0.01 0.00 -1.46 0.00 0.00 37.83 35.03 2k8d s LYS 100 CO 0.03 0.33 -0.16 -0.51 0.16 0.00 0.00 175.35 175.20 2k8d s LEU 101 N -0.53 2.05 -0.13 5.43 1.02 -1.26 -1.19 118.68 124.08 2k8d s LEU 101 Ca 0.06 -0.31 0.03 0.00 0.02 0.00 0.00 54.13 53.92 2k8d s LEU 101 Cb -0.07 -0.80 0.01 0.00 0.02 0.00 0.00 46.19 45.35 2k8d s LEU 101 CO -0.00 0.18 -0.21 -0.13 0.02 0.00 0.00 176.35 176.20 2k8d s ARG 102 N -0.49 2.89 -0.19 1.70 3.00 -1.25 -4.92 118.95 119.69 2k8d s ARG 102 Ca 0.06 -0.81 -0.06 0.00 0.00 0.00 0.00 55.73 54.92 2k8d s ARG 102 Cb -0.06 -2.33 -0.03 0.00 0.00 0.00 0.00 34.95 32.53 2k8d s ARG 102 CO -0.00 0.00 0.02 -2.00 0.00 0.00 0.00 175.30 173.32 2k8d s GLU 103 N 0.79 3.74 0.39 3.54 2.12 -1.26 -0.55 118.70 127.47 2k8d s GLU 103 Ca -0.08 -0.46 0.05 0.00 0.36 0.00 0.00 54.97 54.83 2k8d s GLU 103 Cb -0.16 -3.11 -0.02 0.00 0.26 0.00 0.00 34.13 31.10 2k8d s GLU 103 CO -0.01 0.12 0.17 0.34 -0.54 0.00 0.00 175.26 175.34 2k8d s ASP 104 N 0.73 2.54 -0.03 -1.70 2.15 0.14 -4.98 116.67 115.53 2k8d s ASP 104 Ca 0.01 -1.71 0.15 0.00 0.43 0.00 0.00 52.55 51.44 2k8d s ASP 104 Cb -0.14 0.54 0.47 0.00 -0.30 0.00 0.00 42.92 43.49 2k8d s ASP 104 CO 0.02 -0.98 1.39 -2.11 -0.17 0.00 0.00 175.17 173.33 2k8d n ARG 105 N -0.85 2.94 -0.30 4.34 1.85 -1.26 -0.18 116.66 123.20 2k8d n ARG 105 Ca -0.03 -2.39 0.13 0.00 -1.00 0.00 0.00 57.85 54.57 2k8d n ARG 105 Cb 0.64 -1.47 0.30 0.00 -1.05 0.00 0.00 32.46 30.88 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 2.89 0.19 0.52 2.89 0.02 -1.85 0.24 113.55 118.44 2k8d h SER 106 Ca 0.00 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 2k8d h SER 106 Cb 0.95 0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.68 2k8d h SER 106 CO 0.05 -0.07 0.00 0.00 -1.14 0.00 0.00 176.83 175.66 2k8d n LEU 107 N -5.12 0.31 0.00 5.07 -0.00 -1.26 -4.82 117.00 111.18 2k8d n LEU 107 Ca 0.22 0.58 0.00 0.00 -0.00 0.00 0.00 56.01 56.81 2k8d n LEU 107 Cb 0.67 -0.55 0.00 0.00 -0.00 0.00 0.00 43.42 43.54 2k8d n LEU 107 CO 0.10 -0.44 0.00 0.61 -0.00 0.00 0.00 177.39 177.66 2k8d n GLY 108 N -0.21 0.98 0.00 1.47 0.00 0.79 -5.00 105.19 103.23 2k8d n GLY 108 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2k8d n GLY 108 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2k8d n MET 109 N -1.05 0.00 -3.52 1.61 0.00 -0.96 -5.09 117.12 108.11 2k8d n MET 109 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 57.70 57.57 2k8d n MET 109 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 33.22 33.11 2k8d n MET 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 2k8d s VAL 110 N 0.00 -0.49 -0.24 1.12 0.11 -1.26 -4.38 120.40 115.27 2k8d s VAL 110 Ca 0.00 0.05 0.02 0.00 -2.93 0.00 0.00 61.98 59.13 2k8d s VAL 110 Cb 0.00 -0.65 0.05 0.00 -1.53 0.00 0.00 36.38 34.25 2k8d s VAL 110 CO 0.00 -0.05 -0.12 -0.60 -3.33 0.00 0.00 175.10 171.00 2k8d s ARG 111 N 2.46 2.33 -0.09 1.54 3.52 0.75 -2.89 118.95 126.58 2k8d s ARG 111 Ca 0.06 -1.21 0.02 0.00 -0.13 0.00 0.00 55.73 54.48 2k8d s ARG 111 Cb -0.14 -2.79 -0.02 0.00 -1.56 0.00 0.00 34.95 30.44 2k8d s ARG 111 CO -0.12 -0.50 -0.15 0.00 -0.81 0.00 0.00 175.30 173.72 2k8d s GLU 113 N -0.16 1.39 -0.21 0.00 -1.05 0.29 0.10 118.70 119.06 2k8d s GLU 113 Ca -0.01 0.71 -0.03 0.00 -0.15 0.00 0.00 54.97 55.49 2k8d s GLU 113 Cb -0.13 -1.83 0.07 0.00 -0.44 0.00 0.00 34.13 31.79 2k8d s GLU 113 CO 0.03 -2.12 0.06 0.08 0.95 0.00 0.00 175.26 174.26 2k8d s VAL 114 N -3.01 0.41 0.26 1.83 1.01 0.30 -3.82 120.40 117.37 2k8d s VAL 114 Ca 0.63 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 62.06 2k8d s VAL 114 Cb -0.17 -1.01 -0.05 0.00 0.00 0.00 0.00 36.38 35.15 2k8d s VAL 114 CO 0.56 -0.30 0.03 -0.76 0.00 0.00 0.00 175.10 174.63 2k8d s LEU 115 N 1.90 2.07 0.56 3.92 1.02 -0.33 -1.12 118.68 126.70 2k8d s LEU 115 Ca 0.01 -1.29 -0.20 0.00 0.02 0.00 0.00 54.13 52.68 2k8d s LEU 115 Cb -0.17 -0.23 -0.05 0.00 0.02 0.00 0.00 46.19 45.76 2k8d s LEU 115 CO -0.12 -0.58 1.20 0.00 0.02 0.00 0.00 176.35 176.87 2k8d h ALA 117 N 1.17 1.00 0.00 0.00 0.00 -1.47 -3.28 119.26 116.69 2k8d h ALA 117 Ca -0.50 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 2k8d h ALA 117 Cb 1.28 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2k8d h ALA 117 CO 0.56 0.00 -0.60 -2.13 0.00 0.00 0.00 179.25 177.08 2k8d n ARG 118 N -2.68 0.22 -2.56 0.00 3.00 -1.26 -4.84 116.66 108.53 2k8d n ARG 118 Ca 0.04 0.09 -0.43 0.00 -0.00 0.00 0.00 57.85 57.54 2k8d n ARG 118 Cb 0.41 -0.89 0.00 0.00 0.00 0.00 0.00 32.46 31.98 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 6.38 1.57 0.00 0.00 9.92 -1.23 -3.84 116.55 129.35 2k8d n ASP 120 Ca 0.44 -2.54 0.00 0.00 -0.53 0.00 0.00 54.79 52.15 2k8d n ASP 120 Cb 0.42 -1.19 0.00 0.00 -0.64 0.00 0.00 41.12 39.71 2k8d n ASP 120 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k8d n ALA 121 N 13.63 0.00 -1.00 2.24 0.00 -1.26 -4.99 120.51 129.13 2k8d n ALA 121 Ca 0.45 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2k8d n ALA 121 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 2k8d n ALA 121 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2k8d n HIS 122 N -2.06 0.00 0.00 0.00 8.25 -1.26 -5.10 115.22 115.05 2k8d n HIS 122 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2k8d n HIS 122 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2k8d n HIS 122 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2k8d n LEU 123 N -0.91 0.00 0.00 2.41 4.77 -1.22 -4.75 117.00 117.30 2k8d n LEU 123 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2k8d n LEU 123 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2k8d n LEU 123 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 2k8d n GLY 124 N 0.00 -0.74 2.48 -0.72 0.00 -0.27 -0.36 105.19 105.59 2k8d n GLY 124 Ca 0.00 0.57 -0.04 0.00 0.00 0.00 0.00 46.02 46.55 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 -1.51 -4.12 1.61 1.44 0.15 -0.54 115.22 112.24 2k8d n HIS 125 Ca 0.00 -1.03 -0.15 0.00 -2.01 0.00 0.00 57.72 54.53 2k8d n HIS 125 Cb 0.00 0.51 -0.12 0.00 0.12 0.00 0.00 29.99 30.50 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 -2.33 0.63 0.01 0.61 0.11 0.11 0.05 120.40 119.60 2k8d s VAL 126 Ca 0.13 -0.92 0.01 0.00 -2.93 0.00 0.00 61.98 58.27 2k8d s VAL 126 Cb -0.03 -0.64 -0.01 0.00 -1.53 0.00 0.00 36.38 34.17 2k8d s VAL 126 CO 0.06 -0.23 -0.04 0.72 -3.33 0.00 0.00 175.10 172.29 2k8d s PHE 127 N -1.06 0.32 -0.36 1.54 -0.71 -0.10 -1.63 117.98 115.99 2k8d s PHE 127 Ca -0.06 -0.21 -0.29 0.00 -1.04 0.00 0.00 56.93 55.34 2k8d s PHE 127 Cb -0.08 -0.21 0.00 0.00 -1.21 0.00 0.00 43.02 41.52 2k8d s PHE 127 CO 0.01 -0.05 1.44 -0.51 -1.34 0.00 0.00 175.22 174.77 2k8d s ASP 128 N -0.56 6.38 0.00 1.98 1.11 -1.14 -0.08 116.67 124.36 2k8d s ASP 128 Ca -0.04 1.05 0.00 0.00 0.18 0.00 0.00 52.55 53.75 2k8d s ASP 128 Cb -0.04 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.41 2k8d s ASP 128 CO -0.00 -1.35 0.00 -0.67 1.18 0.00 0.00 175.17 174.33 2k8d n ASP 129 N 8.62 0.00 -3.84 0.27 -0.08 -0.38 -4.92 116.55 116.23 2k8d n ASP 129 Ca 0.17 0.00 -0.30 0.00 -1.51 0.00 0.00 54.79 53.15 2k8d n ASP 129 Cb 0.47 0.16 0.23 0.00 2.34 0.00 0.00 41.12 44.33 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 -1.53 1.64 0.77 0.27 0.00 -1.18 -4.82 107.32 102.46 2k8d s GLY 130 Ca 0.00 -1.05 -0.11 0.00 0.00 0.00 0.00 44.72 43.56 2k8d s GLY 130 CO 0.00 -0.17 1.08 2.56 0.00 0.00 0.00 173.10 176.57 2k8d s PRO 131 N -5.56 2.27 0.76 2.90 0.04 -1.26 -3.48 135.00 130.67 2k8d s PRO 131 Ca 0.72 0.91 -0.15 0.00 0.04 0.00 0.00 61.00 62.53 2k8d s PRO 131 Cb -0.08 -1.92 0.05 0.00 0.04 0.00 0.00 34.50 32.60 2k8d s PRO 131 CO 0.55 -1.56 1.23 -0.98 0.04 0.00 0.00 177.00 176.28 2k8d s ARG 132 N -5.02 1.92 0.08 4.56 1.04 -1.26 -0.58 118.95 119.70 2k8d s ARG 132 Ca 0.60 1.82 -0.16 0.00 -1.04 0.00 0.00 55.73 56.96 2k8d s ARG 132 Cb -0.16 -1.80 -0.11 0.00 -2.04 0.00 0.00 34.95 30.84 2k8d s ARG 132 CO 0.55 -2.02 1.37 -1.00 -0.04 0.00 0.00 175.30 174.17 2k8d h PRO 133 N -0.48 0.65 -0.02 3.89 0.13 -1.96 -3.44 132.00 130.77 2k8d h PRO 133 Ca -0.47 -0.38 -0.12 0.00 -0.87 0.00 0.00 66.00 64.15 2k8d h PRO 133 Cb 1.30 0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.45 2k8d h PRO 133 CO 0.48 1.00 -0.54 1.79 -0.23 0.00 0.00 178.00 180.50 2k8d h THR 134 N 0.36 1.38 -0.00 1.56 1.35 -1.84 -3.47 112.91 112.25 2k8d h THR 134 Ca 0.02 -1.85 -0.00 0.00 -0.55 0.00 0.00 66.41 64.03 2k8d h THR 134 Cb 0.93 1.98 -0.00 0.00 -1.73 0.00 0.00 68.15 69.33 2k8d h THR 134 CO 0.08 0.53 -0.00 0.61 -0.25 0.00 0.00 175.52 176.49 2k8d n GLY 135 N 0.05 0.39 3.26 5.82 0.00 0.26 -4.99 105.19 109.97 2k8d n GLY 135 Ca -0.02 -0.02 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.50 1.14 -0.23 1.61 -2.85 -1.23 -1.24 119.74 116.43 2k8d s LYS 136 Ca 0.00 -1.54 -0.02 0.00 -1.00 0.00 0.00 55.97 53.41 2k8d s LYS 136 Cb 0.00 -0.37 0.07 0.00 -2.06 0.00 0.00 37.83 35.48 2k8d s LYS 136 CO 0.00 -0.10 0.04 0.50 0.10 0.00 0.00 175.35 175.90 2k8d s ARG 137 N -3.89 0.78 0.47 1.78 3.52 0.89 -3.55 118.95 118.94 2k8d s ARG 137 Ca 0.24 -0.68 -0.22 0.00 -0.13 0.00 0.00 55.73 54.94 2k8d s ARG 137 Cb 0.06 -2.11 -0.08 0.00 -1.56 0.00 0.00 34.95 31.26 2k8d s ARG 137 CO 0.04 -0.75 1.08 0.71 -0.81 0.00 0.00 175.30 175.58 2k8d s TYR 138 N 1.74 2.99 -0.26 5.12 1.51 0.12 -0.92 117.35 127.65 2k8d s TYR 138 Ca 0.02 1.58 -0.06 0.00 -1.01 0.00 0.00 57.07 57.60 2k8d s TYR 138 Cb -0.17 -3.19 0.13 0.00 -0.11 0.00 0.00 41.96 38.62 2k8d s TYR 138 CO -0.13 -1.04 0.52 0.00 -1.11 0.00 0.00 175.55 173.79 2k8d s MET 140 N 2.74 0.03 -0.06 0.00 0.23 -0.74 -0.68 119.30 120.83 2k8d s MET 140 Ca 0.05 0.08 -0.02 0.00 -1.03 0.00 0.00 55.69 54.77 2k8d s MET 140 Cb -0.13 -0.02 0.04 0.00 -1.53 0.00 0.00 34.83 33.18 2k8d s MET 140 CO -0.17 -0.03 0.12 1.21 -2.03 0.00 0.00 175.02 174.12 2k8d s ASN 141 N 0.20 0.24 0.30 -1.18 2.47 0.52 -4.65 114.94 112.84 2k8d s ASN 141 Ca -0.02 0.24 -0.19 0.00 0.42 0.00 0.00 52.86 53.31 2k8d s ASN 141 Cb -0.02 0.13 0.06 0.00 -1.45 0.00 0.00 41.25 39.96 2k8d s ASN 141 CO -0.01 -0.18 0.86 -0.94 -3.72 0.00 0.00 177.10 173.11 2k8d s SER 142 N 1.52 -0.05 0.50 -4.21 1.04 -1.26 -3.41 113.70 107.82 2k8d s SER 142 Ca -0.05 -0.88 0.24 0.00 0.48 0.00 0.00 55.95 55.74 2k8d s SER 142 Cb -0.12 0.71 1.31 0.00 0.10 0.00 0.00 66.02 68.02 2k8d s SER 142 CO -0.05 -1.39 1.94 0.00 0.98 0.00 0.00 173.24 174.72 2k8d h ALA 143 N 2.00 2.46 -0.38 5.32 0.00 -1.88 -3.21 119.26 123.57 2k8d h ALA 143 Ca -0.28 -0.01 -0.38 0.00 0.00 0.00 0.00 54.91 54.24 2k8d h ALA 143 Cb 1.24 0.02 -0.14 0.00 0.00 0.00 0.00 17.79 18.91 2k8d h ALA 143 CO 0.35 -0.66 0.20 0.00 0.00 0.00 0.00 179.25 179.15 2k8d n ALA 144 N -2.62 6.10 -3.11 0.00 0.00 -1.26 -4.37 120.51 115.25 2k8d n ALA 144 Ca 0.14 -2.40 -0.22 0.00 0.00 0.00 0.00 53.44 50.95 2k8d n ALA 144 Cb 0.67 -2.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.08 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 1.17 2.34 -4.69 0.00 4.77 -1.22 -3.96 117.00 115.41 2k8d n LEU 145 Ca 0.42 -5.27 -0.40 0.00 -0.03 0.00 0.00 56.01 50.74 2k8d n LEU 145 Cb 0.64 0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.82 2k8d n LEU 145 CO 0.28 2.29 0.35 -0.75 -1.33 0.00 0.00 177.39 178.23 2k8d s LYS 146 N -2.74 4.32 0.43 3.23 2.20 -1.02 -4.93 119.74 121.24 2k8d s LYS 146 Ca 0.43 0.70 -0.24 0.00 -0.36 0.00 0.00 55.97 56.49 2k8d s LYS 146 Cb 0.30 -3.50 -0.08 0.00 -1.51 0.00 0.00 37.83 33.04 2k8d s LYS 146 CO -0.10 -0.06 1.21 -0.06 -0.36 0.00 0.00 175.35 175.98 2k8d s PHE 147 N 1.27 2.89 0.20 4.03 0.08 -1.26 -0.17 117.98 125.02 2k8d s PHE 147 Ca 0.32 1.51 0.00 0.00 0.12 0.00 0.00 56.93 58.88 2k8d s PHE 147 Cb -0.16 -3.47 -0.04 0.00 -0.57 0.00 0.00 43.02 38.77 2k8d s PHE 147 CO 0.13 -1.65 0.09 0.96 -0.10 0.00 0.00 175.22 174.65 2k8d s ILE 148 N -1.43 0.30 1.27 0.64 -4.36 0.16 -4.84 121.20 112.94 2k8d s ILE 148 Ca 0.61 -1.98 -0.18 0.00 -0.26 0.00 0.00 60.65 58.84 2k8d s ILE 148 Cb -0.32 -2.40 0.29 0.00 1.25 0.00 0.00 42.46 41.29 2k8d s ILE 148 CO 0.40 -0.16 0.76 -0.81 0.24 0.00 0.00 174.94 175.36 2k8d n PRO 149 N -0.29 -3.26 -0.37 0.37 -0.04 -1.26 -1.11 135.00 129.04 2k8d n PRO 149 Ca -0.01 -0.95 0.32 0.00 -0.04 0.00 0.00 63.50 62.82 2k8d n PRO 149 Cb 0.65 -1.95 0.64 0.00 -0.04 0.00 0.00 33.50 32.80 2k8d n PRO 149 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k8d h ARG 150 N -2.97 0.17 0.00 0.54 3.08 -1.88 -3.36 114.38 109.95 2k8d h ARG 150 Ca -0.51 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.53 2k8d h ARG 150 Cb 1.29 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2k8d h ARG 150 CO 0.37 0.11 0.00 -0.40 -1.07 0.00 0.00 179.97 178.98 2k8d n ASP 151 N -4.44 -1.34 0.00 7.04 5.75 -1.26 -4.78 116.55 117.52 2k8d n ASP 151 Ca 0.29 0.38 0.00 0.00 -0.01 0.00 0.00 54.79 55.45 2k8d n ASP 151 Cb 1.18 1.44 0.00 0.00 -1.03 0.00 0.00 41.12 42.71 2k8d n ASP 151 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k8d n GLN 152 N -2.99 0.00 0.02 0.11 1.13 -1.26 -4.96 117.38 109.44 2k8d n GLN 152 Ca 0.00 -0.04 0.19 0.00 -1.94 0.00 0.00 57.00 55.21 2k8d n GLN 152 Cb 0.00 -0.20 0.69 0.00 0.11 0.00 0.00 30.24 30.83 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 1.39 0.75 0.00 5.09 -0.00 -1.94 -3.50 117.51 119.31 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 0.60 0.76 0.00 0.00 -0.00 0.00 0.00 36.82 38.18 2k8d h ILE 153 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 178.15 178.76