#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8d n LYS 5 N 0.00 0.18 -2.31 0.03 -0.00 -1.26 -5.14 118.16 109.66 2k8d n LYS 5 Ca 0.00 -1.30 -0.04 0.00 -0.00 0.00 0.00 58.31 56.96 2k8d n LYS 5 Cb 0.00 0.33 0.01 0.00 -0.00 0.00 0.00 35.03 35.37 2k8d n LYS 5 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2k8d n ASP 6 N -0.06 -0.95 -4.98 -5.58 5.75 -1.26 -5.19 116.55 104.27 2k8d n ASP 6 Ca -0.19 -1.74 -0.22 0.00 -0.01 0.00 0.00 54.79 52.63 2k8d n ASP 6 Cb 0.81 1.61 0.03 0.00 -1.03 0.00 0.00 41.12 42.55 2k8d n ASP 6 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2k8d s ARG 7 N -2.10 2.31 -0.25 0.11 0.52 -1.26 -4.35 118.95 113.93 2k8d s ARG 7 Ca 0.08 -1.76 0.02 0.00 -0.52 0.00 0.00 55.73 53.55 2k8d s ARG 7 Cb -0.02 -2.45 0.06 0.00 0.52 0.00 0.00 34.95 33.06 2k8d s ARG 7 CO 0.06 -0.74 -0.09 0.96 0.02 0.00 0.00 175.30 175.51 2k8d s ILE 8 N -2.69 1.92 0.31 1.52 -4.36 0.70 -4.81 121.20 113.79 2k8d s ILE 8 Ca 0.51 -1.46 -0.29 0.00 -0.26 0.00 0.00 60.65 59.15 2k8d s ILE 8 Cb -0.04 -2.08 -0.10 0.00 1.25 0.00 0.00 42.46 41.49 2k8d s ILE 8 CO 0.32 -0.04 1.16 -2.16 0.24 0.00 0.00 174.94 174.46 2k8d s PRO 9 N 1.22 4.51 0.08 0.37 0.04 -1.26 -0.76 135.00 139.19 2k8d s PRO 9 Ca -0.07 1.91 0.06 0.00 0.04 0.00 0.00 61.00 62.94 2k8d s PRO 9 Cb -0.19 -3.11 -0.03 0.00 0.04 0.00 0.00 34.50 31.21 2k8d s PRO 9 CO -0.06 0.06 -0.17 0.42 0.04 0.00 0.00 177.00 177.29 2k8d s ILE 10 N -1.19 1.40 0.08 0.56 1.01 0.08 -4.34 121.20 118.80 2k8d s ILE 10 Ca 0.47 -1.36 0.04 0.00 0.00 0.00 0.00 60.65 59.80 2k8d s ILE 10 Cb -0.34 -1.29 -0.03 0.00 0.01 0.00 0.00 42.46 40.81 2k8d s ILE 10 CO 0.44 -0.10 -0.12 -0.36 0.00 0.00 0.00 174.94 174.80 2k8d s PHE 11 N -1.14 1.11 -0.61 3.97 0.40 -1.26 -0.37 117.98 120.08 2k8d s PHE 11 Ca 0.02 -0.54 0.05 0.00 -0.60 0.00 0.00 56.93 55.86 2k8d s PHE 11 Cb -0.10 -0.61 0.17 0.00 0.51 0.00 0.00 43.02 42.99 2k8d s PHE 11 CO 0.03 0.03 0.44 -1.12 0.70 0.00 0.00 175.22 175.30 2k8d s SER 12 N -2.04 3.69 0.29 1.36 0.01 -0.11 -4.79 113.70 112.11 2k8d s SER 12 Ca 0.01 -3.60 -0.00 0.00 1.31 0.00 0.00 55.95 53.67 2k8d s SER 12 Cb -0.07 -1.23 0.49 0.00 0.21 0.00 0.00 66.02 65.42 2k8d s SER 12 CO 0.01 -0.11 1.89 1.62 0.41 0.00 0.00 173.24 177.06 2k8d h VAL 13 N 4.47 1.06 0.00 3.43 3.04 -1.84 0.59 116.25 126.99 2k8d h VAL 13 Ca 0.19 -0.37 0.00 0.00 -1.01 0.00 0.00 66.70 65.51 2k8d h VAL 13 Cb 0.81 -0.11 0.00 0.00 -2.01 0.00 0.00 31.29 29.97 2k8d h VAL 13 CO 0.60 0.20 0.00 0.00 -1.01 0.00 0.00 177.57 177.36 2k8d n ALA 14 N -2.38 2.11 -0.77 3.17 0.00 -1.26 -1.05 120.51 120.33 2k8d n ALA 14 Ca 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2k8d n ALA 14 Cb 0.21 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.46 2k8d n ALA 14 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2k8d n LYS 15 N -0.86 0.30 -3.68 0.00 4.01 -0.13 -5.02 118.16 112.78 2k8d n LYS 15 Ca 0.09 -0.47 -0.28 0.00 -0.51 0.00 0.00 58.31 57.15 2k8d n LYS 15 Cb 0.04 -0.61 -0.06 0.00 -0.51 0.00 0.00 35.03 33.89 2k8d n LYS 15 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2k8d n ASN 16 N -0.07 -0.78 -4.91 4.39 5.15 0.01 -4.97 115.26 114.09 2k8d n ASN 16 Ca 0.00 -0.89 -0.27 0.00 -0.60 0.00 0.00 54.58 52.82 2k8d n ASN 16 Cb 0.34 -1.13 0.01 0.00 -0.53 0.00 0.00 39.78 38.47 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 -5.58 3.29 -0.03 1.20 0.52 -0.43 -4.91 118.95 113.01 2k8d s ARG 17 Ca 0.44 0.10 0.01 0.00 -0.52 0.00 0.00 55.73 55.76 2k8d s ARG 17 Cb -0.26 -2.34 0.02 0.00 0.52 0.00 0.00 34.95 32.89 2k8d s ARG 17 CO 0.72 -0.40 -0.03 0.08 0.02 0.00 0.00 175.30 175.69 2k8d s VAL 18 N -2.83 0.38 -0.23 3.52 1.01 -1.26 -0.93 120.40 120.05 2k8d s VAL 18 Ca 0.50 -0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.38 2k8d s VAL 18 Cb -0.10 -0.41 0.07 0.00 0.00 0.00 0.00 36.38 35.94 2k8d s VAL 18 CO 0.45 0.17 0.05 -1.83 0.00 0.00 0.00 175.10 173.94 2k8d s GLU 19 N 0.70 0.69 0.13 2.72 1.03 0.50 -4.98 118.70 119.50 2k8d s GLU 19 Ca -0.08 -0.61 -0.28 0.00 0.03 0.00 0.00 54.97 54.03 2k8d s GLU 19 Cb -0.11 -2.05 -0.07 0.00 -0.80 0.00 0.00 34.13 31.10 2k8d s GLU 19 CO -0.00 -0.74 0.88 1.41 -1.33 0.00 0.00 175.26 175.47 2k8d s MET 20 N 1.79 4.66 0.31 -4.83 1.75 -1.26 -0.74 119.30 120.98 2k8d s MET 20 Ca 0.02 1.32 0.03 0.00 -1.25 0.00 0.00 55.69 55.81 2k8d s MET 20 Cb -0.17 -3.34 -0.06 0.00 2.84 0.00 0.00 34.83 34.10 2k8d s MET 20 CO -0.14 0.34 0.06 0.08 -0.65 0.00 0.00 175.02 174.72 2k8d s VAL 21 N -0.41 1.08 0.11 10.11 1.01 0.06 -4.95 120.40 127.41 2k8d s VAL 21 Ca 0.42 -2.00 0.01 0.00 0.00 0.00 0.00 61.98 60.41 2k8d s VAL 21 Cb -0.23 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 2k8d s VAL 21 CO 0.28 -0.02 0.25 -1.61 0.00 0.00 0.00 175.10 174.01 2k8d s GLU 22 N -3.91 3.44 0.27 2.72 2.02 -1.26 -0.22 118.70 121.76 2k8d s GLU 22 Ca 0.36 -0.53 -0.29 0.00 0.02 0.00 0.00 54.97 54.53 2k8d s GLU 22 Cb 0.08 -3.00 -0.10 0.00 0.10 0.00 0.00 34.13 31.22 2k8d s GLU 22 CO 0.15 0.56 1.31 0.50 0.02 0.00 0.00 175.26 177.80 2k8d s ARG 23 N -2.93 4.38 -0.03 1.61 3.52 -1.26 -4.72 118.95 119.51 2k8d s ARG 23 Ca 0.35 2.14 -0.30 0.00 -0.13 0.00 0.00 55.73 57.79 2k8d s ARG 23 Cb -0.12 -3.13 -0.04 0.00 -1.56 0.00 0.00 34.95 30.10 2k8d s ARG 23 CO 0.28 -0.22 1.24 -1.50 -0.81 0.00 0.00 175.30 174.29 2k8d s ILE 24 N -0.51 4.13 -0.26 4.11 2.07 -1.26 -4.96 121.20 124.51 2k8d s ILE 24 Ca 0.53 1.47 -0.03 0.00 -1.41 0.00 0.00 60.65 61.22 2k8d s ILE 24 Cb -0.38 -3.95 0.15 0.00 0.13 0.00 0.00 42.46 38.41 2k8d s ILE 24 CO 0.45 0.01 0.46 -0.70 -1.91 0.00 0.00 174.94 173.25 2k8d s GLU 25 N 2.13 0.42 0.26 3.50 2.12 -1.26 -5.04 118.70 120.84 2k8d s GLU 25 Ca 0.58 0.73 0.02 0.00 0.36 0.00 0.00 54.97 56.66 2k8d s GLU 25 Cb -0.26 -0.07 -0.04 0.00 0.26 0.00 0.00 34.13 34.02 2k8d s GLU 25 CO 0.24 -0.61 0.18 -0.51 -0.54 0.00 0.00 175.26 174.02 2k8d s LEU 26 N 2.66 1.46 0.53 2.70 1.43 -1.26 -5.17 118.68 121.04 2k8d s LEU 26 Ca 0.14 -1.54 -0.09 0.00 -1.03 0.00 0.00 54.13 51.62 2k8d s LEU 26 Cb -0.15 0.38 -0.04 0.00 0.03 0.00 0.00 46.19 46.41 2k8d s LEU 26 CO -0.17 -0.91 0.90 -0.44 0.23 0.00 0.00 176.35 175.95 2k8d s SER 27 N -3.28 6.30 0.36 2.29 0.01 -1.26 -5.01 113.70 113.12 2k8d s SER 27 Ca 0.39 1.20 0.04 0.00 1.31 0.00 0.00 55.95 58.89 2k8d s SER 27 Cb 0.05 -2.37 0.68 0.00 0.21 0.00 0.00 66.02 64.59 2k8d s SER 27 CO 0.18 -0.68 1.97 0.44 0.41 0.00 0.00 173.24 175.56 2k8d h ASP 28 N 0.16 0.58 0.58 2.44 5.19 -2.03 -2.63 116.42 120.72 2k8d h ASP 28 Ca -0.46 -0.05 -0.09 0.00 -0.62 0.00 0.00 57.03 55.81 2k8d h ASP 28 Cb 1.20 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 40.54 2k8d h ASP 28 CO 0.62 0.50 -0.44 -0.78 -3.12 0.00 0.00 179.24 176.02 2k8d h ASP 29 N 0.65 0.00 -0.83 6.45 1.82 -2.04 -3.26 116.42 119.21 2k8d h ASP 29 Ca 0.16 0.00 0.01 0.00 -0.39 0.00 0.00 57.03 56.82 2k8d h ASP 29 Cb 0.08 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 40.04 2k8d h ASP 29 CO -0.02 0.44 0.55 -0.33 -1.61 0.00 0.00 179.24 178.27 2k8d h GLU 30 N 0.00 1.07 -0.01 0.28 5.08 -1.87 -2.55 114.58 116.58 2k8d h GLU 30 Ca -0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2k8d h GLU 30 Cb 0.85 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2k8d h GLU 30 CO 0.06 0.71 0.00 0.91 -1.00 0.00 0.00 179.01 179.68 2k8d n TRP 31 N -4.42 0.00 -0.64 4.33 7.02 -1.23 -0.89 117.44 121.60 2k8d n TRP 31 Ca 0.10 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.58 2k8d n TRP 31 Cb 0.04 -0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.93 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 -0.37 0.02 0.00 -0.99 0.00 -0.96 -4.54 116.66 109.82 2k8d n ARG 32 Ca 0.00 -0.11 0.00 0.00 -0.00 0.00 0.00 57.85 57.74 2k8d n ARG 32 Cb 0.00 -0.56 0.00 0.00 -0.00 0.00 0.00 32.46 31.90 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 -0.03 2.06 0.00 2.89 0.28 -0.12 -4.62 120.64 121.09 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 0.16 -0.83 0.03 0.00 1.43 0.00 0.00 31.44 32.23 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 -1.03 0.00 -3.69 3.84 -5.35 -0.07 -5.03 119.36 108.03 2k8d n ILE 34 Ca 0.00 -0.46 -0.20 0.00 -0.27 0.00 0.00 62.75 61.82 2k8d n ILE 34 Cb 0.02 1.23 -0.02 0.00 -1.74 0.00 0.00 39.64 39.13 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 -1.33 3.96 0.43 7.28 1.43 -1.25 -5.02 118.68 124.19 2k8d s LEU 35 Ca 0.13 -0.20 -0.25 0.00 -1.03 0.00 0.00 54.13 52.78 2k8d s LEU 35 Cb 0.11 -2.63 -0.09 0.00 0.03 0.00 0.00 46.19 43.60 2k8d s LEU 35 CO 0.21 -0.31 1.34 0.47 0.23 0.00 0.00 176.35 178.29 2k8d n ASP 36 N -1.50 2.86 0.20 2.29 9.92 -1.26 -4.83 116.55 124.22 2k8d n ASP 36 Ca -0.03 1.11 0.14 0.00 -0.53 0.00 0.00 54.79 55.49 2k8d n ASP 36 Cb 0.58 -1.54 0.66 0.00 -0.64 0.00 0.00 41.12 40.18 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 2.17 0.00 -0.20 -0.24 0.13 -1.97 -1.03 132.00 130.87 2k8d h PRO 37 Ca -0.49 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.50 2k8d h PRO 37 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2k8d h PRO 37 CO 0.60 0.00 -0.41 1.49 -0.23 0.00 0.00 178.00 179.45 2k8d h GLU 38 N 0.00 0.62 -0.50 0.86 4.81 -1.99 -2.48 114.58 115.90 2k8d h GLU 38 Ca 0.00 -0.41 -0.01 0.00 -0.13 0.00 0.00 59.36 58.81 2k8d h GLU 38 Cb 0.24 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 2k8d h GLU 38 CO 0.00 1.03 0.27 0.00 -0.73 0.00 0.00 179.01 179.58 2k8d h ALA 39 N 0.59 0.64 -0.56 2.92 0.00 -1.55 0.18 119.26 121.49 2k8d h ALA 39 Ca 0.00 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.88 2k8d h ALA 39 Cb 1.02 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 2k8d h ALA 39 CO 0.09 0.17 0.29 0.35 0.00 0.00 0.00 179.25 180.14 2k8d h PHE 40 N 0.67 0.53 0.00 0.00 3.57 -1.49 0.51 116.94 120.73 2k8d h PHE 40 Ca 0.18 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 2k8d h PHE 40 Cb 0.05 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 38.64 2k8d h PHE 40 CO -0.02 0.25 -0.08 0.07 -2.23 0.00 0.00 178.31 176.30 2k8d h ARG 41 N 0.55 0.05 -0.70 1.11 0.11 -1.02 -3.21 114.38 111.26 2k8d h ARG 41 Ca 0.25 -0.06 0.15 0.00 0.10 0.00 0.00 59.98 60.42 2k8d h ARG 41 Cb 0.17 0.02 -0.04 0.00 1.11 0.00 0.00 29.97 31.22 2k8d h ARG 41 CO -0.18 0.86 0.48 0.28 0.10 0.00 0.00 179.97 181.51 2k8d h VAL 42 N -0.73 0.79 0.00 0.08 2.07 -0.54 0.22 116.25 118.13 2k8d h VAL 42 Ca -0.01 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.39 2k8d h VAL 42 Cb 0.89 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2k8d h VAL 42 CO 0.02 0.06 0.00 0.00 0.02 0.00 0.00 177.57 177.67 2k8d h ALA 43 N 1.66 1.00 0.00 1.67 0.00 -0.89 0.23 119.26 122.93 2k8d h ALA 43 Ca 0.34 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 55.02 2k8d h ALA 43 Cb 0.86 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 2k8d h ALA 43 CO -0.09 0.00 -2.12 2.89 0.00 0.00 0.00 179.25 179.92 2k8d n ARG 44 N -2.92 0.67 0.00 0.00 -4.01 0.74 -4.54 116.66 106.61 2k8d n ARG 44 Ca -0.02 -0.03 0.07 0.00 -1.04 0.00 0.00 57.85 56.83 2k8d n ARG 44 Cb 0.13 -1.57 0.04 0.00 -3.04 0.00 0.00 32.46 28.02 2k8d n ARG 44 CO 0.00 0.00 0.00 0.36 -3.04 0.00 0.00 177.63 174.95 2k8d n LYS 45 N -2.63 1.16 -0.33 2.89 2.85 -1.01 -4.98 118.16 116.12 2k8d n LYS 45 Ca -0.21 -1.12 0.00 0.00 -1.05 0.00 0.00 58.31 55.93 2k8d n LYS 45 Cb 0.93 -1.23 0.00 0.00 -0.65 0.00 0.00 35.03 34.09 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 0.47 0.00 0.00 0.58 0.00 0.77 -3.82 120.51 118.52 2k8d n ALA 46 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2k8d n ALA 46 Cb 0.31 -0.76 0.00 0.00 0.00 0.00 0.00 19.45 19.01 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 -1.61 -0.89 3.04 0.00 0.00 -1.21 -2.99 105.19 101.53 2k8d n GLY 47 Ca 0.00 0.41 -0.12 0.00 0.00 0.00 0.00 46.02 46.31 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 0.00 0.02 0.13 2.61 -1.32 -1.25 -4.67 115.64 111.16 2k8d s THR 48 Ca 0.00 -0.14 -0.19 0.00 -1.21 0.00 0.00 61.69 60.16 2k8d s THR 48 Cb 0.00 -0.25 -0.03 0.00 -1.51 0.00 0.00 72.50 70.71 2k8d s THR 48 CO 0.00 -0.07 1.74 -0.33 -2.21 0.00 0.00 174.62 173.75 2k8d h GLU 49 N 5.62 0.16 -7.35 7.08 3.07 -1.99 -3.44 114.58 117.73 2k8d h GLU 49 Ca -0.26 -0.01 -0.48 0.00 -0.50 0.00 0.00 59.36 58.11 2k8d h GLU 49 Cb 1.20 -0.04 0.14 0.00 -0.84 0.00 0.00 28.75 29.22 2k8d h GLU 49 CO 0.41 0.10 0.25 -1.25 -1.40 0.00 0.00 179.01 177.13 2k8d s PRO 50 N -6.18 1.22 0.62 2.33 0.04 -1.26 -5.02 135.00 126.75 2k8d s PRO 50 Ca -0.13 0.75 -0.17 0.00 0.04 0.00 0.00 61.00 61.48 2k8d s PRO 50 Cb 0.10 -1.81 -0.02 0.00 0.04 0.00 0.00 34.50 32.81 2k8d s PRO 50 CO 0.69 -2.25 1.15 -1.25 0.04 0.00 0.00 177.00 175.39 2k8d s PRO 51 N -4.97 2.93 0.00 0.56 0.04 -1.26 -4.89 135.00 127.40 2k8d s PRO 51 Ca 0.63 1.59 -0.03 0.00 0.04 0.00 0.00 61.00 63.24 2k8d s PRO 51 Cb -0.18 -1.95 -0.14 0.00 0.04 0.00 0.00 34.50 32.27 2k8d s PRO 51 CO 0.57 -1.19 2.43 1.19 0.04 0.00 0.00 177.00 180.04 2k8d n PHE 52 N -1.93 0.00 -2.23 0.56 3.72 -1.26 -4.79 117.46 111.52 2k8d n PHE 52 Ca 0.12 -1.01 -0.37 0.00 -0.05 0.00 0.00 57.45 56.14 2k8d n PHE 52 Cb 0.51 -1.03 -0.03 0.00 -0.94 0.00 0.00 39.48 37.99 2k8d n PHE 52 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2k8d n THR 53 N 2.32 3.02 -3.64 4.37 -2.24 -1.26 -4.85 114.28 112.00 2k8d n THR 53 Ca 0.22 -3.07 -0.15 0.00 -2.27 0.00 0.00 64.05 58.78 2k8d n THR 53 Cb 0.59 -2.30 -0.08 0.00 -2.10 0.00 0.00 70.33 66.44 2k8d n THR 53 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2k8d s GLY 54 N 5.04 -0.44 -0.27 3.38 0.00 -1.26 -5.15 107.32 108.61 2k8d s GLY 54 Ca 0.59 1.39 -0.05 0.00 0.00 0.00 0.00 44.72 46.66 2k8d s GLY 54 CO 0.09 1.13 0.53 1.25 0.00 0.00 0.00 173.10 176.10 2k8d s LYS 55 N -0.34 0.48 -0.01 2.90 2.20 -1.26 -4.96 119.74 118.75 2k8d s LYS 55 Ca -0.05 1.01 -0.03 0.00 -0.36 0.00 0.00 55.97 56.54 2k8d s LYS 55 Cb -0.03 0.35 -0.00 0.00 -1.51 0.00 0.00 37.83 36.64 2k8d s LYS 55 CO 0.04 -0.46 0.07 -0.47 -0.36 0.00 0.00 175.35 174.16 2k8d s TYR 56 N 2.75 0.03 0.20 4.03 5.04 -1.26 -5.13 117.35 123.01 2k8d s TYR 56 Ca 0.09 -0.06 -0.21 0.00 -2.44 0.00 0.00 57.07 54.45 2k8d s TYR 56 Cb -0.14 -0.04 0.05 0.00 0.35 0.00 0.00 41.96 42.17 2k8d s TYR 56 CO -0.18 -0.14 0.60 -1.58 -1.34 0.00 0.00 175.55 172.91 2k8d s HIS 57 N -0.69 -0.33 0.00 4.97 2.46 -1.26 -4.94 115.29 115.50 2k8d s HIS 57 Ca -0.08 0.02 0.00 0.00 0.47 0.00 0.00 55.06 55.48 2k8d s HIS 57 Cb -0.05 0.54 0.00 0.00 -0.13 0.00 0.00 32.58 32.95 2k8d s HIS 57 CO 0.00 -0.96 0.00 -3.47 -2.47 0.00 0.00 174.74 167.85 2k8d n ASP 58 N -0.38 0.00 -3.25 9.88 2.03 -1.26 -5.11 116.55 118.46 2k8d n ASP 58 Ca -0.12 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 54.97 2k8d n ASP 58 Cb 0.63 0.00 0.21 0.00 -0.72 0.00 0.00 41.12 41.24 2k8d n ASP 58 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k8d n LEU 59 N 0.00 0.00 -4.30 -2.67 -0.00 -1.26 -4.94 117.00 103.83 2k8d n LEU 59 Ca 0.00 -0.63 -0.50 0.00 -0.00 0.00 0.00 56.01 54.88 2k8d n LEU 59 Cb 0.00 -0.78 -0.04 0.00 -0.00 0.00 0.00 43.42 42.60 2k8d n LEU 59 CO 0.00 -2.53 0.15 1.57 -0.00 0.00 0.00 177.39 176.58 2k8d n HIS 60 N -5.04 -0.16 -0.50 1.47 -0.00 -1.26 -4.97 115.22 104.77 2k8d n HIS 60 Ca 0.10 0.97 -0.29 0.00 -0.00 0.00 0.00 57.72 58.50 2k8d n HIS 60 Cb 0.43 -1.94 0.24 0.00 -0.00 0.00 0.00 29.99 28.73 2k8d n HIS 60 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 2k8d n ASP 61 N 1.80 -2.18 -4.34 0.26 5.75 -1.26 -5.11 116.55 111.48 2k8d n ASP 61 Ca 0.18 -0.24 -0.17 0.00 -0.01 0.00 0.00 54.79 54.55 2k8d n ASP 61 Cb 0.20 -1.15 -0.10 0.00 -1.03 0.00 0.00 41.12 39.03 2k8d n ASP 61 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2k8d s ASP 62 N -2.26 1.55 0.00 -1.12 2.15 -1.26 -5.02 116.67 110.71 2k8d s ASP 62 Ca 0.65 -1.33 0.00 0.00 0.43 0.00 0.00 52.55 52.30 2k8d s ASP 62 Cb -0.21 0.08 0.00 0.00 -0.30 0.00 0.00 42.92 42.49 2k8d s ASP 62 CO 0.65 -0.65 0.00 0.61 -0.17 0.00 0.00 175.17 175.62 2k8d n GLY 63 N -0.48 1.51 3.23 2.66 0.00 -1.26 -4.66 105.19 106.19 2k8d n GLY 63 Ca -0.02 -1.99 -0.13 0.00 0.00 0.00 0.00 46.02 43.88 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 -2.16 0.63 -0.15 -0.61 -4.36 -0.28 -2.83 121.20 111.44 2k8d s ILE 64 Ca 0.00 -1.97 -0.29 0.00 -0.26 0.00 0.00 60.65 58.13 2k8d s ILE 64 Cb 0.00 -2.09 -0.01 0.00 1.25 0.00 0.00 42.46 41.61 2k8d s ILE 64 CO 0.00 -0.50 1.10 -0.31 0.24 0.00 0.00 174.94 175.47 2k8d s TYR 65 N -3.69 3.27 -0.30 1.37 2.02 0.37 -1.41 117.35 118.98 2k8d s TYR 65 Ca 0.23 1.37 -0.26 0.00 -0.37 0.00 0.00 57.07 58.05 2k8d s TYR 65 Cb 0.06 -3.32 0.01 0.00 -0.40 0.00 0.00 41.96 38.31 2k8d s TYR 65 CO 0.03 -0.79 0.90 0.50 -1.57 0.00 0.00 175.55 174.63 2k8d s ARG 66 N 2.72 4.04 -0.83 -0.62 3.00 0.89 -0.77 118.95 127.38 2k8d s ARG 66 Ca 0.49 0.84 -0.21 0.00 -1.00 0.00 0.00 55.73 55.86 2k8d s ARG 66 Cb -0.19 -3.71 -0.14 0.00 0.00 0.00 0.00 34.95 30.91 2k8d s ARG 66 CO 0.14 -0.73 1.96 0.00 0.00 0.00 0.00 175.30 176.67 2k8d h ILE 68 N 4.40 0.00 0.00 0.00 2.10 -1.72 0.12 117.51 122.41 2k8d h ILE 68 Ca 0.44 -0.07 0.00 0.00 1.08 0.00 0.00 64.86 66.31 2k8d h ILE 68 Cb 0.65 1.01 0.00 0.00 -1.09 0.00 0.00 36.82 37.39 2k8d h ILE 68 CO 1.94 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 179.01 2k8d n GLY 71 N 0.00 0.10 3.52 0.00 0.00 0.26 -4.99 105.19 104.07 2k8d n GLY 71 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.01 1.86 0.08 2.61 2.01 -1.14 -4.79 115.64 114.27 2k8d s THR 72 Ca 0.00 0.00 0.04 0.00 0.31 0.00 0.00 61.69 62.04 2k8d s THR 72 Cb 0.00 -2.22 -0.03 0.00 0.01 0.00 0.00 72.50 70.26 2k8d s THR 72 CO 0.00 0.00 -0.12 -1.81 -0.69 0.00 0.00 174.62 172.00 2k8d s ASP 73 N -2.97 1.55 0.00 3.53 1.11 -1.26 0.36 116.67 118.98 2k8d s ASP 73 Ca 0.68 -0.70 0.00 0.00 0.18 0.00 0.00 52.55 52.71 2k8d s ASP 73 Cb -0.20 -0.02 0.00 0.00 1.07 0.00 0.00 42.92 43.76 2k8d s ASP 73 CO 0.61 -0.16 0.00 0.00 1.18 0.00 0.00 175.17 176.80 2k8d n LEU 74 N 0.95 0.00 -4.73 1.23 -0.00 0.05 -4.76 117.00 109.73 2k8d n LEU 74 Ca -0.19 0.00 -0.42 0.00 -0.00 0.00 0.00 56.01 55.40 2k8d n LEU 74 Cb 0.56 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.95 2k8d n LEU 74 CO 0.24 0.00 1.28 -0.36 -0.00 0.00 0.00 177.39 178.54 2k8d s PHE 75 N 0.88 2.88 0.16 1.47 0.08 -1.25 -4.61 117.98 117.60 2k8d s PHE 75 Ca 0.00 0.62 -0.30 0.00 0.12 0.00 0.00 56.93 57.37 2k8d s PHE 75 Cb 0.00 -4.05 -0.07 0.00 -0.57 0.00 0.00 43.02 38.33 2k8d s PHE 75 CO 0.00 -3.74 0.97 -0.51 -0.10 0.00 0.00 175.22 171.84 2k8d s ASP 76 N 0.84 7.52 0.45 1.36 1.01 -1.26 -0.48 116.67 126.10 2k8d s ASP 76 Ca 0.68 1.88 0.19 0.00 0.71 0.00 0.00 52.55 56.02 2k8d s ASP 76 Cb -0.47 -2.60 1.15 0.00 1.01 0.00 0.00 42.92 42.01 2k8d s ASP 76 CO 0.39 -0.01 1.90 0.28 0.21 0.00 0.00 175.17 177.94 2k8d h SER 77 N 5.03 0.31 0.32 0.27 0.02 -1.79 -0.37 113.55 117.34 2k8d h SER 77 Ca -0.44 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 2k8d h SER 77 Cb 1.21 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2k8d h SER 77 CO 0.70 0.14 0.00 1.05 -1.14 0.00 0.00 176.83 177.59 2k8d h GLU 78 N 0.32 0.00 0.00 3.45 4.11 -1.91 -0.02 114.58 120.53 2k8d h GLU 78 Ca 0.41 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.78 2k8d h GLU 78 Cb 1.10 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 2k8d h GLU 78 CO -0.12 0.00 -0.27 1.79 0.07 0.00 0.00 179.01 180.48 2k8d h THR 79 N 0.00 0.52 -2.68 -1.06 1.35 -1.37 -3.46 112.91 106.21 2k8d h THR 79 Ca 0.00 -1.46 0.00 0.00 -0.55 0.00 0.00 66.41 64.40 2k8d h THR 79 Cb 0.16 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 68.62 2k8d h THR 79 CO 0.00 0.26 0.00 0.29 -0.25 0.00 0.00 175.52 175.82 2k8d n LYS 80 N -3.25 0.37 -1.57 4.72 5.02 -0.02 -2.46 118.16 120.96 2k8d n LYS 80 Ca 0.02 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.32 2k8d n LYS 80 Cb 0.55 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.64 2k8d n LYS 80 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2k8d n PHE 81 N -1.62 0.49 0.27 2.13 7.35 -1.25 -4.78 117.46 120.05 2k8d n PHE 81 Ca 0.00 -1.21 0.18 0.00 -0.76 0.00 0.00 57.45 55.66 2k8d n PHE 81 Cb 0.00 -0.21 0.87 0.00 0.35 0.00 0.00 39.48 40.50 2k8d n PHE 81 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 2k8d h ASP 82 N 1.41 0.00 0.00 -2.13 3.32 -1.86 0.85 116.42 118.01 2k8d h ASP 82 Ca -0.10 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.75 2k8d h ASP 82 Cb 1.53 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.08 2k8d h ASP 82 CO 0.15 0.00 1.71 -1.54 -1.72 0.00 0.00 179.24 177.84 2k8d n SER 83 N -3.22 2.72 0.00 6.45 3.41 -1.26 -3.80 113.62 117.92 2k8d n SER 83 Ca -0.00 -2.14 0.00 0.00 -0.26 0.00 0.00 58.87 56.47 2k8d n SER 83 Cb 0.36 -0.80 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 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 3.73 1.95 1.59 5.00 0.00 -1.21 -4.97 105.19 111.27 2k8d n GLY 84 Ca 0.24 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 0.52 -0.85 2.61 -1.04 0.02 -5.07 114.28 110.48 2k8d n THR 85 Ca 0.00 0.17 0.00 0.00 -2.04 0.00 0.00 64.05 62.18 2k8d n THR 85 Cb 0.00 -0.95 0.00 0.00 -1.82 0.00 0.00 70.33 67.56 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 2.37 0.67 3.77 3.41 0.00 0.08 -4.82 105.19 110.66 2k8d n GLY 86 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2k8d n GLY 86 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2k8d s TRP 87 N -2.46 2.78 -1.20 1.61 -0.00 -1.26 -4.76 118.94 113.64 2k8d s TRP 87 Ca 0.00 1.47 -0.12 0.00 -0.00 0.00 0.00 56.10 57.45 2k8d s TRP 87 Cb 0.00 -3.54 -0.06 0.00 -0.00 0.00 0.00 33.47 29.86 2k8d s TRP 87 CO 0.00 -1.90 2.34 -0.35 -0.00 0.00 0.00 176.95 177.03 2k8d n PRO 88 N -0.31 2.58 -4.30 5.86 -0.04 -1.26 -4.52 135.00 133.01 2k8d n PRO 88 Ca 0.06 -2.00 -0.18 0.00 -0.04 0.00 0.00 63.50 61.35 2k8d n PRO 88 Cb 0.46 -2.83 -0.14 0.00 -0.04 0.00 0.00 33.50 30.95 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 3.35 1.03 0.24 3.54 1.04 -1.26 -1.65 113.70 119.99 2k8d s SER 89 Ca 0.53 -0.22 0.02 0.00 0.48 0.00 0.00 55.95 56.76 2k8d s SER 89 Cb 0.14 -0.09 -0.05 0.00 0.10 0.00 0.00 66.02 66.12 2k8d s SER 89 CO -0.02 0.06 0.06 0.72 0.98 0.00 0.00 173.24 175.04 2k8d s PHE 90 N -0.38 1.49 0.00 5.02 -0.71 0.12 -3.86 117.98 119.65 2k8d s PHE 90 Ca 0.02 -1.10 0.00 0.00 -1.04 0.00 0.00 56.93 54.80 2k8d s PHE 90 Cb -0.04 -0.87 0.00 0.00 -1.21 0.00 0.00 43.02 40.89 2k8d s PHE 90 CO -0.00 -0.26 0.02 2.48 -1.34 0.00 0.00 175.22 176.13 2k8d n TYR 91 N -0.42 0.00 -4.12 3.49 4.11 -1.03 -0.15 117.16 119.04 2k8d n TYR 91 Ca -0.02 0.00 -0.14 0.00 -0.00 0.00 0.00 57.90 57.74 2k8d n TYR 91 Cb 0.65 0.00 -0.06 0.00 -0.00 0.00 0.00 39.34 39.93 2k8d n TYR 91 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 2k8d s ASP 92 N -0.48 0.69 0.05 9.48 -1.08 -1.26 -4.58 116.67 119.48 2k8d s ASP 92 Ca 0.00 -1.40 0.00 0.00 -0.52 0.00 0.00 52.55 50.63 2k8d s ASP 92 Cb 0.00 0.58 -0.03 0.00 -1.46 0.00 0.00 42.92 42.01 2k8d s ASP 92 CO 0.00 -1.15 -0.04 0.54 0.52 0.00 0.00 175.17 175.03 2k8d s VAL 93 N -3.49 0.30 0.35 1.11 0.11 -1.26 -4.82 120.40 112.70 2k8d s VAL 93 Ca 0.32 -1.46 0.02 0.00 -2.93 0.00 0.00 61.98 57.93 2k8d s VAL 93 Cb 0.01 -1.05 0.27 0.00 -1.53 0.00 0.00 36.38 34.08 2k8d s VAL 93 CO 0.18 -0.75 2.00 1.62 -3.33 0.00 0.00 175.10 174.82 2k8d h VAL 94 N 3.75 1.15 0.00 2.04 3.04 -1.94 -3.48 116.25 120.81 2k8d h VAL 94 Ca -0.34 -0.30 0.00 0.00 -1.01 0.00 0.00 66.70 65.05 2k8d h VAL 94 Cb 1.17 0.20 0.00 0.00 -2.01 0.00 0.00 31.29 30.66 2k8d h VAL 94 CO 0.55 0.16 0.00 -1.20 -1.01 0.00 0.00 177.57 176.07 2k8d n SER 95 N -4.44 0.00 -3.55 3.17 7.64 -1.26 -4.70 113.62 110.48 2k8d n SER 95 Ca 0.07 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.56 2k8d n SER 95 Cb 0.06 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.24 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 -1.45 2.72 -0.06 1.43 1.02 -1.26 -4.46 120.64 118.58 2k8d n GLU 96 Ca 0.00 -2.24 -0.12 0.00 -0.02 0.00 0.00 57.16 54.79 2k8d n GLU 96 Cb 0.00 -3.01 -0.04 0.00 -0.02 0.00 0.00 31.44 28.37 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 5.55 0.00 -1.89 -0.32 1.44 -1.26 -4.83 115.22 113.92 2k8d n HIS 97 Ca 0.57 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 56.32 2k8d n HIS 97 Cb 0.33 -0.43 0.06 0.00 0.12 0.00 0.00 29.99 30.06 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 -3.82 0.90 -4.39 4.39 2.85 -1.26 -4.71 115.26 109.22 2k8d n ASN 98 Ca -0.21 -2.43 -0.32 0.00 -0.11 0.00 0.00 54.58 51.51 2k8d n ASN 98 Cb 0.54 -0.31 -0.14 0.00 1.24 0.00 0.00 39.78 41.11 2k8d n ASN 98 CO 0.00 0.00 0.00 -0.51 -2.11 0.00 0.00 177.26 174.64 2k8d s ILE 99 N -0.94 2.65 -0.12 -1.44 -1.16 -1.26 -0.54 121.20 118.39 2k8d s ILE 99 Ca 0.19 -0.87 -0.04 0.00 -0.51 0.00 0.00 60.65 59.42 2k8d s ILE 99 Cb 0.19 -2.01 -0.04 0.00 0.61 0.00 0.00 42.46 41.22 2k8d s ILE 99 CO -0.04 0.58 0.03 -0.75 -2.81 0.00 0.00 174.94 171.95 2k8d s LYS 100 N -0.51 3.31 0.06 3.50 2.47 0.96 -4.56 119.74 124.96 2k8d s LYS 100 Ca 0.07 -0.36 0.02 0.00 -1.56 0.00 0.00 55.97 54.13 2k8d s LYS 100 Cb -0.11 -2.95 -0.03 0.00 -1.46 0.00 0.00 37.83 33.28 2k8d s LYS 100 CO 0.01 0.60 -0.07 -0.51 0.16 0.00 0.00 175.35 175.54 2k8d s LEU 101 N -0.56 2.34 -0.07 5.43 1.02 -1.26 -1.55 118.68 124.02 2k8d s LEU 101 Ca 0.10 -0.70 -0.03 0.00 0.02 0.00 0.00 54.13 53.52 2k8d s LEU 101 Cb -0.12 -0.08 0.04 0.00 0.02 0.00 0.00 46.19 46.05 2k8d s LEU 101 CO 0.02 -0.31 0.16 -0.13 0.02 0.00 0.00 176.35 176.11 2k8d s ARG 102 N -2.34 0.10 0.51 1.70 3.00 -1.26 -4.96 118.95 115.70 2k8d s ARG 102 Ca -0.04 0.40 -0.23 0.00 0.00 0.00 0.00 55.73 55.87 2k8d s ARG 102 Cb -0.05 -0.18 -0.06 0.00 0.00 0.00 0.00 34.95 34.67 2k8d s ARG 102 CO -0.02 -0.17 1.34 -2.00 0.00 0.00 0.00 175.30 174.45 2k8d s GLU 103 N 1.24 3.38 0.32 3.54 -6.30 -1.26 -0.95 118.70 118.67 2k8d s GLU 103 Ca -0.09 2.21 -0.07 0.00 -2.50 0.00 0.00 54.97 54.52 2k8d s GLU 103 Cb -0.11 -2.39 0.01 0.00 0.00 0.00 0.00 34.13 31.63 2k8d s GLU 103 CO -0.06 -0.99 0.50 0.34 0.02 0.00 0.00 175.26 175.07 2k8d s ASP 104 N -0.91 0.48 -0.15 -1.70 2.15 -0.68 -4.89 116.67 110.98 2k8d s ASP 104 Ca 0.67 -1.28 0.18 0.00 0.43 0.00 0.00 52.55 52.56 2k8d s ASP 104 Cb -0.39 0.65 0.37 0.00 -0.30 0.00 0.00 42.92 43.25 2k8d s ASP 104 CO 0.48 -1.28 1.24 -2.11 -0.17 0.00 0.00 175.17 173.32 2k8d n ARG 105 N -0.50 1.81 0.00 4.34 0.00 -1.26 -0.07 116.66 120.99 2k8d n ARG 105 Ca -0.01 -2.68 0.00 0.00 -0.00 0.00 0.00 57.85 55.16 2k8d n ARG 105 Cb 0.62 -1.62 0.00 0.00 -0.00 0.00 0.00 32.46 31.46 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 -1.14 0.56 0.00 2.89 7.64 -1.26 -0.27 113.62 122.04 2k8d n SER 106 Ca 0.18 -0.47 0.00 0.00 1.01 0.00 0.00 58.87 59.59 2k8d n SER 106 Cb 0.73 -0.12 0.00 0.00 -1.01 0.00 0.00 64.21 63.81 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 0.73 0.12 0.00 -3.43 -0.00 -1.26 -4.94 117.00 108.22 2k8d n LEU 107 Ca 0.00 -0.29 0.00 0.00 -0.00 0.00 0.00 56.01 55.72 2k8d n LEU 107 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.52 2k8d n LEU 107 CO 0.00 0.03 0.00 0.61 -0.00 0.00 0.00 177.39 178.03 2k8d n GLY 108 N 0.33 0.70 0.00 1.47 0.00 0.63 -5.00 105.19 103.32 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 -1.16 0.00 -3.55 1.61 2.81 -1.15 -5.09 117.12 110.59 2k8d n MET 109 Ca 0.00 0.00 -0.16 0.00 -1.81 0.00 0.00 57.70 55.73 2k8d n MET 109 Cb 0.00 0.00 -0.13 0.00 -0.71 0.00 0.00 33.22 32.38 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 -0.36 -0.42 2.03 1.01 -1.26 -4.43 120.40 116.96 2k8d s VAL 110 Ca 0.00 0.04 0.03 0.00 0.00 0.00 0.00 61.98 62.05 2k8d s VAL 110 Cb 0.00 -0.59 0.12 0.00 0.00 0.00 0.00 36.38 35.91 2k8d s VAL 110 CO 0.00 -0.07 0.17 -0.60 0.00 0.00 0.00 175.10 174.59 2k8d s ARG 111 N 2.37 1.51 -0.18 2.72 3.52 0.90 -2.65 118.95 127.15 2k8d s ARG 111 Ca 0.05 -2.06 -0.06 0.00 -0.13 0.00 0.00 55.73 53.53 2k8d s ARG 111 Cb -0.14 -2.90 -0.03 0.00 -1.56 0.00 0.00 34.95 30.31 2k8d s ARG 111 CO -0.11 -1.05 0.02 0.00 -0.81 0.00 0.00 175.30 173.35 2k8d s GLU 113 N 0.45 1.53 -0.22 0.00 -1.05 -0.12 -0.02 118.70 119.26 2k8d s GLU 113 Ca 0.00 1.38 -0.04 0.00 -0.15 0.00 0.00 54.97 56.17 2k8d s GLU 113 Cb -0.13 -1.80 0.08 0.00 -0.44 0.00 0.00 34.13 31.84 2k8d s GLU 113 CO 0.01 -2.22 0.10 0.08 0.95 0.00 0.00 175.26 174.18 2k8d s VAL 114 N -2.76 0.06 0.39 1.83 1.01 -0.29 -4.12 120.40 116.52 2k8d s VAL 114 Ca 0.64 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 62.16 2k8d s VAL 114 Cb -0.20 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 2k8d s VAL 114 CO 0.57 -0.45 0.07 -0.76 0.00 0.00 0.00 175.10 174.53 2k8d s LEU 115 N 2.05 2.19 0.52 3.92 1.02 -0.60 -1.57 118.68 126.22 2k8d s LEU 115 Ca 0.04 -1.51 -0.20 0.00 0.02 0.00 0.00 54.13 52.48 2k8d s LEU 115 Cb -0.16 -0.38 -0.06 0.00 0.02 0.00 0.00 46.19 45.60 2k8d s LEU 115 CO -0.19 -0.74 1.13 0.00 0.02 0.00 0.00 176.35 176.57 2k8d h ALA 117 N 1.46 1.00 -0.02 0.00 0.00 -1.06 -3.39 119.26 117.25 2k8d h ALA 117 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2k8d h ALA 117 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2k8d h ALA 117 CO 0.58 0.00 0.00 -2.13 0.00 0.00 0.00 179.25 177.70 2k8d n ARG 118 N -2.53 0.00 0.00 0.00 3.00 -1.26 -4.94 116.66 110.93 2k8d n ARG 118 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.86 2k8d n ARG 118 Cb 0.23 -0.06 0.00 0.00 0.00 0.00 0.00 32.46 32.64 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 0.19 0.00 -4.74 0.00 8.00 -1.26 -4.91 116.55 113.83 2k8d n ASP 120 Ca 0.00 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.14 2k8d n ASP 120 Cb 0.09 -1.23 0.05 0.00 -0.02 0.00 0.00 41.12 40.01 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 -1.02 2.44 0.11 2.24 0.00 -1.26 -4.90 121.76 119.37 2k8d s ALA 121 Ca 0.00 1.12 -0.20 0.00 0.00 0.00 0.00 51.96 52.88 2k8d s ALA 121 Cb 0.00 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 2k8d s ALA 121 CO 0.00 -1.42 1.03 1.58 0.00 0.00 0.00 175.76 176.95 2k8d n HIS 122 N -1.79 -0.29 0.00 0.00 -0.00 -1.26 -4.37 115.22 107.51 2k8d n HIS 122 Ca 0.15 0.84 0.00 0.00 0.46 0.00 0.00 57.72 59.16 2k8d n HIS 122 Cb 0.49 -0.56 0.00 0.00 -0.12 0.00 0.00 29.99 29.80 2k8d n HIS 122 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2k8d n LEU 123 N -4.84 0.00 0.00 0.27 4.77 -1.18 -4.79 117.00 111.23 2k8d n LEU 123 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2k8d n LEU 123 Cb 0.18 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2k8d n LEU 123 CO -0.11 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.56 2k8d n GLY 124 N 0.00 -0.14 3.81 -0.72 0.00 -0.61 -0.33 105.19 107.20 2k8d n GLY 124 Ca 0.00 0.55 -0.05 0.00 0.00 0.00 0.00 46.02 46.51 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 -0.09 -0.05 1.61 -3.43 -0.54 -1.14 115.29 111.66 2k8d s HIS 125 Ca 0.00 -0.33 0.04 0.00 -0.80 0.00 0.00 55.06 53.98 2k8d s HIS 125 Cb 0.00 0.70 -0.02 0.00 -1.43 0.00 0.00 32.58 31.82 2k8d s HIS 125 CO 0.00 -1.07 -0.17 0.54 -2.00 0.00 0.00 174.74 172.04 2k8d s VAL 126 N -3.22 2.84 0.06 -5.38 0.11 0.97 -0.39 120.40 115.39 2k8d s VAL 126 Ca 0.13 -0.81 0.05 0.00 -2.93 0.00 0.00 61.98 58.42 2k8d s VAL 126 Cb -0.03 -2.09 -0.03 0.00 -1.53 0.00 0.00 36.38 32.70 2k8d s VAL 126 CO 0.05 0.59 -0.13 0.72 -3.33 0.00 0.00 175.10 173.00 2k8d s PHE 127 N -0.66 1.14 -1.16 1.54 -0.71 -0.12 -1.13 117.98 116.89 2k8d s PHE 127 Ca 0.10 -0.44 -0.22 0.00 -1.04 0.00 0.00 56.93 55.34 2k8d s PHE 127 Cb -0.11 -0.65 -0.02 0.00 -1.21 0.00 0.00 43.02 41.03 2k8d s PHE 127 CO 0.00 0.03 1.83 0.34 -1.34 0.00 0.00 175.22 176.09 2k8d s ASP 128 N -1.57 5.72 0.00 1.98 2.15 -1.08 -0.19 116.67 123.68 2k8d s ASP 128 Ca -0.02 -1.72 0.00 0.00 0.43 0.00 0.00 52.55 51.24 2k8d s ASP 128 Cb -0.09 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 2k8d s ASP 128 CO 0.02 -2.32 0.00 -0.67 -0.17 0.00 0.00 175.17 172.03 2k8d n ASP 129 N 12.03 0.00 -4.87 -0.34 2.03 -0.69 -4.95 116.55 119.75 2k8d n ASP 129 Ca 0.44 -0.91 -0.21 0.00 0.52 0.00 0.00 54.79 54.63 2k8d n ASP 129 Cb 0.47 0.00 0.09 0.00 -0.72 0.00 0.00 41.12 40.96 2k8d n ASP 129 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2k8d s GLY 130 N 0.00 1.73 0.72 0.27 0.00 0.29 -4.78 107.32 105.54 2k8d s GLY 130 Ca 0.00 -2.04 -0.12 0.00 0.00 0.00 0.00 44.72 42.57 2k8d s GLY 130 CO 0.00 -1.50 1.08 2.56 0.00 0.00 0.00 173.10 175.25 2k8d s PRO 131 N -4.90 2.59 0.72 2.90 0.04 -1.26 -4.09 135.00 131.00 2k8d s PRO 131 Ca 0.65 1.15 -0.15 0.00 0.04 0.00 0.00 61.00 62.69 2k8d s PRO 131 Cb -0.05 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.59 2k8d s PRO 131 CO 0.42 -1.38 1.17 1.03 0.04 0.00 0.00 177.00 178.28 2k8d s ARG 132 N -4.75 2.27 0.09 4.56 0.52 -1.26 -0.37 118.95 120.02 2k8d s ARG 132 Ca 0.61 1.63 -0.14 0.00 -0.52 0.00 0.00 55.73 57.32 2k8d s ARG 132 Cb -0.17 -1.86 -0.13 0.00 0.52 0.00 0.00 34.95 33.31 2k8d s ARG 132 CO 0.52 -1.70 1.34 -1.00 0.02 0.00 0.00 175.30 174.48 2k8d h PRO 133 N -0.29 0.73 -0.00 3.54 0.13 -1.96 -3.44 132.00 130.70 2k8d h PRO 133 Ca -0.47 -0.51 -0.10 0.00 -0.87 0.00 0.00 66.00 64.05 2k8d h PRO 133 Cb 1.28 0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.47 2k8d h PRO 133 CO 0.51 1.13 -0.47 1.79 -0.23 0.00 0.00 178.00 180.73 2k8d h THR 134 N 0.45 1.34 0.00 1.56 1.35 -1.83 -3.47 112.91 112.31 2k8d h THR 134 Ca -0.01 -1.60 0.00 0.00 -0.55 0.00 0.00 66.41 64.25 2k8d h THR 134 Cb 1.15 1.86 0.00 0.00 -1.73 0.00 0.00 68.15 69.43 2k8d h THR 134 CO 0.12 0.46 0.00 0.61 -0.25 0.00 0.00 175.52 176.45 2k8d n GLY 135 N -0.19 0.64 3.35 5.82 0.00 0.51 -4.99 105.19 110.32 2k8d n GLY 135 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.28 1.30 -0.34 1.61 -2.85 -1.26 -0.55 119.74 117.37 2k8d s LYS 136 Ca 0.00 -1.35 0.02 0.00 -1.00 0.00 0.00 55.97 53.64 2k8d s LYS 136 Cb 0.00 -1.54 0.10 0.00 -2.06 0.00 0.00 37.83 34.33 2k8d s LYS 136 CO 0.00 0.34 0.09 0.50 0.10 0.00 0.00 175.35 176.38 2k8d s ARG 137 N -2.39 1.16 0.29 1.78 3.52 0.73 -3.99 118.95 120.06 2k8d s ARG 137 Ca 0.14 -1.58 -0.29 0.00 -0.13 0.00 0.00 55.73 53.87 2k8d s ARG 137 Cb -0.08 -2.65 -0.10 0.00 -1.56 0.00 0.00 34.95 30.56 2k8d s ARG 137 CO 0.06 -0.98 1.23 0.71 -0.81 0.00 0.00 175.30 175.52 2k8d s TYR 138 N 1.13 3.27 -0.05 5.12 1.51 0.78 -0.94 117.35 128.18 2k8d s TYR 138 Ca 0.11 1.49 -0.05 0.00 -1.01 0.00 0.00 57.07 57.62 2k8d s TYR 138 Cb -0.19 -3.52 0.01 0.00 -0.11 0.00 0.00 41.96 38.15 2k8d s TYR 138 CO -0.15 -1.37 0.13 0.00 -1.11 0.00 0.00 175.55 173.05 2k8d s MET 140 N -0.00 0.83 -0.23 0.00 0.23 -0.66 -1.46 119.30 118.00 2k8d s MET 140 Ca -0.01 -0.76 -0.11 0.00 -1.03 0.00 0.00 55.69 53.78 2k8d s MET 140 Cb -0.01 0.35 0.08 0.00 -1.53 0.00 0.00 34.83 33.72 2k8d s MET 140 CO 0.00 -0.27 0.55 1.21 -2.03 0.00 0.00 175.02 174.48 2k8d s ASN 141 N -2.52 -0.72 0.12 -1.18 2.47 0.55 -4.69 114.94 108.96 2k8d s ASN 141 Ca 0.00 1.24 -0.24 0.00 0.42 0.00 0.00 52.86 54.29 2k8d s ASN 141 Cb 0.02 1.35 0.08 0.00 -1.45 0.00 0.00 41.25 41.25 2k8d s ASN 141 CO -0.08 -0.22 1.10 -1.54 -3.72 0.00 0.00 177.10 172.64 2k8d n SER 142 N 4.69 -1.55 0.24 -4.21 3.41 -1.26 -3.10 113.62 111.85 2k8d n SER 142 Ca -0.18 -1.69 0.16 0.00 -0.26 0.00 0.00 58.87 56.91 2k8d n SER 142 Cb 0.54 2.49 0.87 0.00 -0.26 0.00 0.00 64.21 67.85 2k8d n SER 142 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k8d h ALA 143 N 2.00 1.00 0.00 7.33 0.00 -1.83 -3.25 119.26 124.51 2k8d h ALA 143 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2k8d h ALA 143 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2k8d h ALA 143 CO 0.34 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.59 2k8d n ALA 144 N -1.92 2.05 -3.30 0.00 0.00 -1.26 -4.45 120.51 111.63 2k8d n ALA 144 Ca -0.02 -0.01 -0.30 0.00 0.00 0.00 0.00 53.44 53.10 2k8d n ALA 144 Cb 0.06 -1.03 -0.06 0.00 0.00 0.00 0.00 19.45 18.42 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 -0.55 4.41 -4.72 0.00 4.77 -1.23 -2.99 117.00 116.68 2k8d n LEU 145 Ca 0.01 -5.41 -0.36 0.00 -0.03 0.00 0.00 56.01 50.22 2k8d n LEU 145 Cb 0.01 -0.80 -0.07 0.00 -2.33 0.00 0.00 43.42 40.23 2k8d n LEU 145 CO 0.01 2.00 -0.07 -0.75 -1.33 0.00 0.00 177.39 177.25 2k8d s LYS 146 N -2.62 4.23 0.39 3.23 2.20 -1.03 -4.99 119.74 121.14 2k8d s LYS 146 Ca 0.38 -0.02 -0.24 0.00 -0.36 0.00 0.00 55.97 55.73 2k8d s LYS 146 Cb 0.14 -3.43 -0.09 0.00 -1.51 0.00 0.00 37.83 32.93 2k8d s LYS 146 CO 0.01 0.24 1.04 -0.06 -0.36 0.00 0.00 175.35 176.22 2k8d s PHE 147 N 0.49 3.31 0.19 4.03 0.08 -1.26 -0.08 117.98 124.74 2k8d s PHE 147 Ca 0.13 1.65 -0.00 0.00 0.12 0.00 0.00 56.93 58.84 2k8d s PHE 147 Cb -0.12 -3.12 -0.04 0.00 -0.57 0.00 0.00 43.02 39.16 2k8d s PHE 147 CO 0.02 -0.56 0.09 0.96 -0.10 0.00 0.00 175.22 175.62 2k8d s ILE 148 N -1.64 0.23 0.96 0.64 -4.36 -0.50 -4.82 121.20 111.71 2k8d s ILE 148 Ca 0.57 -1.97 -0.13 0.00 -0.26 0.00 0.00 60.65 58.86 2k8d s ILE 148 Cb -0.22 -2.36 0.07 0.00 1.25 0.00 0.00 42.46 41.20 2k8d s ILE 148 CO 0.28 -0.18 0.54 -0.81 0.24 0.00 0.00 174.94 175.01 2k8d n PRO 149 N -0.26 -0.46 -0.09 0.37 -0.04 -1.26 -1.13 135.00 132.13 2k8d n PRO 149 Ca -0.01 -0.09 0.26 0.00 -0.04 0.00 0.00 63.50 63.62 2k8d n PRO 149 Cb 0.65 -1.96 0.65 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 -1.69 0.00 0.00 0.54 2.47 -1.91 -3.33 114.38 110.46 2k8d h ARG 150 Ca -0.44 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.28 2k8d h ARG 150 Cb 1.29 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.61 2k8d h ARG 150 CO 0.36 0.00 0.00 -0.40 0.56 0.00 0.00 179.97 180.49 2k8d n ASP 151 N -3.63 0.00 0.00 7.04 5.75 -1.26 -4.51 116.55 119.94 2k8d n ASP 151 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.94 2k8d n ASP 151 Cb 1.05 0.45 0.00 0.00 -1.03 0.00 0.00 41.12 41.59 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 -2.38 0.00 0.23 0.11 6.02 -1.26 -4.93 117.38 115.17 2k8d n GLN 152 Ca 0.00 -0.21 0.18 0.00 -0.01 0.00 0.00 57.00 56.96 2k8d n GLN 152 Cb 0.00 -0.28 0.87 0.00 1.02 0.00 0.00 30.24 31.85 2k8d n GLN 152 CO 0.00 0.00 0.00 -0.84 -1.01 0.00 0.00 177.06 175.21 2k8d h ILE 153 N 2.52 0.37 0.00 5.09 -0.00 -1.93 -3.52 117.51 120.03 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 0.88 0.84 0.00 0.00 -0.00 0.00 0.00 36.82 38.54 2k8d h ILE 153 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 178.15 178.76