#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 2.19 0.00 0.03 2.85 -1.26 -5.01 118.16 116.96 2k8d n LYS 5 Ca 0.00 -3.53 0.00 0.00 -1.05 0.00 0.00 58.31 53.73 2k8d n LYS 5 Cb 0.00 -1.74 0.00 0.00 -0.65 0.00 0.00 35.03 32.64 2k8d n LYS 5 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 2k8d n ASP 6 N -0.85 0.00 -4.03 -5.58 5.75 -1.26 -5.05 116.55 105.53 2k8d n ASP 6 Ca 0.26 0.00 -0.10 0.00 -0.01 0.00 0.00 54.79 54.95 2k8d n ASP 6 Cb 0.82 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.83 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 0.00 1.14 -0.06 0.11 0.52 -1.26 -4.21 118.95 115.19 2k8d s ARG 7 Ca 0.00 -1.28 0.01 0.00 -0.52 0.00 0.00 55.73 53.94 2k8d s ARG 7 Cb 0.00 0.34 0.02 0.00 0.52 0.00 0.00 34.95 35.83 2k8d s ARG 7 CO 0.00 -0.40 -0.07 0.96 0.02 0.00 0.00 175.30 175.81 2k8d s ILE 8 N -4.01 0.73 0.13 1.52 -4.36 0.94 -4.81 121.20 111.34 2k8d s ILE 8 Ca 0.21 -0.22 -0.30 0.00 -0.26 0.00 0.00 60.65 60.08 2k8d s ILE 8 Cb 0.04 -0.72 -0.07 0.00 1.25 0.00 0.00 42.46 42.96 2k8d s ILE 8 CO 0.02 0.27 1.17 -2.16 0.24 0.00 0.00 174.94 174.48 2k8d s PRO 9 N 0.93 4.49 0.04 0.37 0.04 -1.26 -0.80 135.00 138.82 2k8d s PRO 9 Ca -0.11 1.78 -0.00 0.00 0.04 0.00 0.00 61.00 62.71 2k8d s PRO 9 Cb -0.15 -3.30 -0.04 0.00 0.04 0.00 0.00 34.50 31.06 2k8d s PRO 9 CO 0.00 -0.12 0.18 0.42 0.04 0.00 0.00 177.00 177.52 2k8d s ILE 10 N 0.40 5.25 -0.37 0.56 -1.09 0.10 -3.90 121.20 122.15 2k8d s ILE 10 Ca 0.54 -0.39 0.04 0.00 -2.23 0.00 0.00 60.65 58.62 2k8d s ILE 10 Cb -0.30 -3.52 0.16 0.00 -1.58 0.00 0.00 42.46 37.22 2k8d s ILE 10 CO 0.33 0.20 0.41 0.12 -1.23 0.00 0.00 174.94 174.76 2k8d s PHE 11 N -1.43 -0.56 -1.20 3.97 2.19 -1.26 -0.48 117.98 119.21 2k8d s PHE 11 Ca 0.32 -0.56 -0.22 0.00 0.33 0.00 0.00 56.93 56.80 2k8d s PHE 11 Cb -0.13 -0.29 -0.06 0.00 -1.31 0.00 0.00 43.02 41.23 2k8d s PHE 11 CO 0.24 -1.00 1.90 -1.12 1.83 0.00 0.00 175.22 177.08 2k8d s SER 12 N 1.61 5.31 0.36 6.13 0.01 -0.91 -4.78 113.70 121.44 2k8d s SER 12 Ca 0.16 -1.79 0.06 0.00 1.31 0.00 0.00 55.95 55.69 2k8d s SER 12 Cb -0.13 -2.59 0.68 0.00 0.21 0.00 0.00 66.02 64.18 2k8d s SER 12 CO -0.07 -2.79 1.91 1.62 0.41 0.00 0.00 173.24 174.32 2k8d h VAL 13 N 6.08 1.18 0.00 3.43 3.04 -1.88 0.11 116.25 128.20 2k8d h VAL 13 Ca 0.25 -0.69 0.00 0.00 -1.01 0.00 0.00 66.70 65.26 2k8d h VAL 13 Cb 0.93 0.92 0.00 0.00 -2.01 0.00 0.00 31.29 31.13 2k8d h VAL 13 CO 1.26 0.24 0.00 0.00 -1.01 0.00 0.00 177.57 178.06 2k8d n ALA 14 N -2.48 1.36 -0.65 3.17 0.00 -1.26 -0.58 120.51 120.07 2k8d n ALA 14 Ca 0.01 -0.02 0.01 0.00 0.00 0.00 0.00 53.44 53.44 2k8d n ALA 14 Cb 0.22 -1.07 0.01 0.00 0.00 0.00 0.00 19.45 18.61 2k8d n ALA 14 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2k8d n LYS 15 N -1.34 1.37 -3.30 0.00 4.81 -0.41 -5.02 118.16 114.28 2k8d n LYS 15 Ca 0.02 -1.11 -0.13 0.00 -0.87 0.00 0.00 58.31 56.21 2k8d n LYS 15 Cb 0.04 -0.79 0.00 0.00 0.02 0.00 0.00 35.03 34.31 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 -0.32 -1.85 -4.62 3.14 5.15 0.26 -5.00 115.26 112.02 2k8d n ASN 16 Ca 0.01 -0.44 -0.23 0.00 -0.60 0.00 0.00 54.58 53.31 2k8d n ASN 16 Cb 0.42 -0.64 -0.08 0.00 -0.53 0.00 0.00 39.78 38.95 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 -4.11 2.15 -0.10 1.20 1.81 0.14 -4.96 118.95 115.09 2k8d s ARG 17 Ca 0.06 -1.56 -0.04 0.00 -1.72 0.00 0.00 55.73 52.48 2k8d s ARG 17 Cb -0.04 -2.05 0.05 0.00 -0.45 0.00 0.00 34.95 32.47 2k8d s ARG 17 CO 0.38 0.29 0.20 0.08 -0.68 0.00 0.00 175.30 175.56 2k8d s VAL 18 N -2.40 -0.25 -0.30 3.52 1.01 -1.26 -2.13 120.40 118.58 2k8d s VAL 18 Ca 0.32 0.29 -0.03 0.00 0.00 0.00 0.00 61.98 62.56 2k8d s VAL 18 Cb -0.05 -0.34 0.11 0.00 0.00 0.00 0.00 36.38 36.11 2k8d s VAL 18 CO 0.19 0.12 0.17 -1.83 0.00 0.00 0.00 175.10 173.75 2k8d s GLU 19 N 2.06 0.26 0.17 2.72 1.03 0.37 -4.98 118.70 120.32 2k8d s GLU 19 Ca -0.01 -0.54 -0.30 0.00 0.03 0.00 0.00 54.97 54.15 2k8d s GLU 19 Cb -0.12 -1.07 -0.08 0.00 -0.80 0.00 0.00 34.13 32.06 2k8d s GLU 19 CO -0.07 -1.04 1.29 1.41 -1.33 0.00 0.00 175.26 175.52 2k8d s MET 20 N 2.04 4.40 0.28 -4.83 1.75 -1.26 -0.72 119.30 120.96 2k8d s MET 20 Ca 0.10 2.00 0.11 0.00 -1.25 0.00 0.00 55.69 56.64 2k8d s MET 20 Cb -0.16 -3.22 -0.05 0.00 2.84 0.00 0.00 34.83 34.23 2k8d s MET 20 CO -0.32 -0.25 -0.16 0.08 -0.65 0.00 0.00 175.02 173.72 2k8d s VAL 21 N 0.30 2.28 0.78 10.11 1.01 0.02 -4.90 120.40 130.01 2k8d s VAL 21 Ca 0.57 -2.32 -0.12 0.00 0.00 0.00 0.00 61.98 60.11 2k8d s VAL 21 Cb -0.35 -2.35 0.06 0.00 0.00 0.00 0.00 36.38 33.74 2k8d s VAL 21 CO 0.36 -0.38 1.13 -1.61 0.00 0.00 0.00 175.10 174.60 2k8d s GLU 22 N -3.56 2.19 1.01 2.72 2.02 -1.26 -0.04 118.70 121.78 2k8d s GLU 22 Ca 0.29 0.35 -0.12 0.00 0.02 0.00 0.00 54.97 55.52 2k8d s GLU 22 Cb -0.02 -1.95 0.20 0.00 0.10 0.00 0.00 34.13 32.45 2k8d s GLU 22 CO 0.14 -1.48 1.08 1.03 0.02 0.00 0.00 175.26 176.05 2k8d s ARG 23 N -5.39 0.27 -0.09 1.61 0.52 -1.26 -4.49 118.95 110.13 2k8d s ARG 23 Ca 0.61 1.06 -0.30 0.00 -0.52 0.00 0.00 55.73 56.58 2k8d s ARG 23 Cb -0.12 -1.68 -0.04 0.00 0.52 0.00 0.00 34.95 33.63 2k8d s ARG 23 CO 0.51 -2.99 1.49 -1.50 0.02 0.00 0.00 175.30 172.83 2k8d s ILE 24 N -2.65 3.84 -0.21 1.52 1.10 -1.26 -4.96 121.20 118.58 2k8d s ILE 24 Ca 0.67 1.04 -0.06 0.00 -0.51 0.00 0.00 60.65 61.79 2k8d s ILE 24 Cb -0.22 -3.67 0.10 0.00 0.15 0.00 0.00 42.46 38.81 2k8d s ILE 24 CO 0.60 -0.08 0.42 -1.83 -2.11 0.00 0.00 174.94 171.95 2k8d s GLU 25 N 3.66 0.34 0.24 3.50 -1.05 -1.26 -5.10 118.70 119.03 2k8d s GLU 25 Ca 0.66 0.97 0.01 0.00 -0.15 0.00 0.00 54.97 56.46 2k8d s GLU 25 Cb -0.29 0.23 -0.04 0.00 -0.44 0.00 0.00 34.13 33.59 2k8d s GLU 25 CO 0.24 -0.32 0.19 -0.51 0.95 0.00 0.00 175.26 175.81 2k8d s LEU 26 N 2.62 1.31 0.50 1.83 1.43 -1.26 -5.18 118.68 119.93 2k8d s LEU 26 Ca 0.01 -1.49 0.02 0.00 -1.03 0.00 0.00 54.13 51.64 2k8d s LEU 26 Cb -0.13 0.48 0.02 0.00 0.03 0.00 0.00 46.19 46.60 2k8d s LEU 26 CO -0.14 -0.92 0.71 -0.94 0.23 0.00 0.00 176.35 175.30 2k8d s SER 27 N -3.22 5.47 -1.29 2.29 1.04 -1.26 -5.00 113.70 111.74 2k8d s SER 27 Ca 0.39 -0.02 -0.16 0.00 0.48 0.00 0.00 55.95 56.64 2k8d s SER 27 Cb 0.05 -0.99 -0.01 0.00 0.10 0.00 0.00 66.02 65.17 2k8d s SER 27 CO 0.17 -0.97 2.15 -0.67 0.98 0.00 0.00 173.24 174.90 2k8d n ASP 28 N -2.19 3.54 0.00 7.02 2.03 -1.26 -3.05 116.55 122.65 2k8d n ASP 28 Ca 0.06 -2.80 0.00 0.00 0.52 0.00 0.00 54.79 52.57 2k8d n ASP 28 Cb 0.59 -1.53 0.00 0.00 -0.72 0.00 0.00 41.12 39.47 2k8d n ASP 28 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2k8d n ASP 29 N 6.46 0.00 -0.20 1.67 8.00 -1.26 -4.98 116.55 126.23 2k8d n ASP 29 Ca 0.51 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 56.00 2k8d n ASP 29 Cb 0.39 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.58 2k8d n ASP 29 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2k8d h GLU 30 N 0.00 0.49 -1.89 -1.24 4.39 -1.94 -2.86 114.58 111.53 2k8d h GLU 30 Ca 0.00 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2k8d h GLU 30 Cb 0.00 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.54 2k8d h GLU 30 CO 0.00 0.33 0.00 0.91 -1.16 0.00 0.00 179.01 179.09 2k8d n TRP 31 N -4.91 0.00 0.00 4.33 7.02 -1.26 -0.92 117.44 121.71 2k8d n TRP 31 Ca 0.07 -0.35 0.00 0.00 -1.02 0.00 0.00 57.50 56.20 2k8d n TRP 31 Cb 0.21 -0.30 0.00 0.00 -2.42 0.00 0.00 31.31 28.80 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 1.53 0.00 0.00 -0.99 0.00 -1.08 -4.75 116.66 111.38 2k8d n ARG 32 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.85 57.84 2k8d n ARG 32 Cb 0.20 -0.26 -0.11 0.00 -0.00 0.00 0.00 32.46 32.30 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 -0.93 0.63 -0.99 2.89 0.28 -0.69 -3.94 120.64 117.90 2k8d n GLU 33 Ca 0.00 0.17 -0.03 0.00 -0.16 0.00 0.00 57.16 57.14 2k8d n GLU 33 Cb 0.00 -1.75 0.32 0.00 1.43 0.00 0.00 31.44 31.45 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 -2.84 2.90 -4.45 3.84 -5.35 -0.09 -4.98 119.36 108.39 2k8d n ILE 34 Ca -0.13 -1.63 -0.23 0.00 -0.27 0.00 0.00 62.75 60.49 2k8d n ILE 34 Cb 0.89 -0.34 -0.10 0.00 -1.74 0.00 0.00 39.64 38.34 2k8d n ILE 34 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2k8d s LEU 35 N -2.96 2.59 0.61 7.28 1.43 -1.25 -4.98 118.68 121.40 2k8d s LEU 35 Ca 0.55 -1.08 -0.19 0.00 -1.03 0.00 0.00 54.13 52.38 2k8d s LEU 35 Cb 0.44 -0.92 -0.03 0.00 0.03 0.00 0.00 46.19 45.70 2k8d s LEU 35 CO 0.14 -0.10 1.29 -1.81 0.23 0.00 0.00 176.35 176.10 2k8d s ASP 36 N -3.47 4.91 0.00 2.29 1.11 -1.26 -4.91 116.67 115.34 2k8d s ASP 36 Ca 0.29 2.61 0.07 0.00 0.18 0.00 0.00 52.55 55.69 2k8d s ASP 36 Cb -0.02 -2.62 0.41 0.00 1.07 0.00 0.00 42.92 41.77 2k8d s ASP 36 CO 0.13 -1.80 0.84 -0.81 1.18 0.00 0.00 175.17 174.72 2k8d n PRO 37 N -1.60 0.44 -0.11 8.23 -0.04 -1.26 -1.68 135.00 138.98 2k8d n PRO 37 Ca 0.14 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.45 2k8d n PRO 37 Cb 0.48 -1.25 -0.10 0.00 -0.04 0.00 0.00 33.50 32.59 2k8d n PRO 37 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2k8d n GLU 38 N -0.75 0.57 -0.21 0.54 2.13 -1.26 -4.58 120.64 117.08 2k8d n GLU 38 Ca 0.05 0.13 -0.06 0.00 0.66 0.00 0.00 57.16 57.94 2k8d n GLU 38 Cb 0.02 -1.45 0.04 0.00 0.27 0.00 0.00 31.44 30.32 2k8d n GLU 38 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2k8d h ALA 39 N 0.02 0.77 -0.50 4.31 0.00 -1.67 0.26 119.26 122.45 2k8d h ALA 39 Ca -0.50 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.38 2k8d h ALA 39 Cb 1.78 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 19.28 2k8d h ALA 39 CO -0.08 0.25 0.27 0.35 0.00 0.00 0.00 179.25 180.04 2k8d h PHE 40 N 0.82 0.49 0.02 0.00 3.57 -1.84 -0.49 116.94 119.52 2k8d h PHE 40 Ca 0.22 0.02 -0.24 0.00 3.53 0.00 0.00 57.97 61.50 2k8d h PHE 40 Cb -0.03 -0.15 0.01 0.00 2.79 0.00 0.00 35.95 38.57 2k8d h PHE 40 CO -0.02 0.25 -1.00 0.07 -2.23 0.00 0.00 178.31 175.37 2k8d h ARG 41 N 0.52 0.47 -0.40 1.11 0.11 -1.69 -3.14 114.38 111.36 2k8d h ARG 41 Ca 0.22 -0.53 0.12 0.00 0.10 0.00 0.00 59.98 59.88 2k8d h ARG 41 Cb 0.10 0.16 -0.02 0.00 1.11 0.00 0.00 29.97 31.32 2k8d h ARG 41 CO -0.14 1.18 0.34 0.28 0.10 0.00 0.00 179.97 181.73 2k8d h VAL 42 N 0.25 0.60 0.00 0.08 2.07 0.00 0.29 116.25 119.54 2k8d h VAL 42 Ca -0.10 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 2k8d h VAL 42 Cb 1.65 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 32.17 2k8d h VAL 42 CO 0.18 0.00 -0.05 0.00 0.02 0.00 0.00 177.57 177.72 2k8d h ALA 43 N 1.70 1.21 0.07 1.67 0.00 -1.04 -0.79 119.26 122.07 2k8d h ALA 43 Ca 0.19 -0.05 -0.37 0.00 0.00 0.00 0.00 54.91 54.69 2k8d h ALA 43 Cb 0.86 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 2k8d h ALA 43 CO -0.00 0.06 -2.10 2.89 0.00 0.00 0.00 179.25 180.10 2k8d n ARG 44 N -3.45 0.69 -0.15 0.00 1.85 0.97 -4.52 116.66 112.06 2k8d n ARG 44 Ca -0.02 0.26 0.11 0.00 -1.00 0.00 0.00 57.85 57.21 2k8d n ARG 44 Cb 0.17 -1.64 0.27 0.00 -1.05 0.00 0.00 32.46 30.21 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 -3.58 2.23 -1.19 2.89 2.85 -0.94 -4.95 118.16 115.48 2k8d n LYS 45 Ca -0.38 -1.85 -0.09 0.00 -1.05 0.00 0.00 58.31 54.94 2k8d n LYS 45 Cb 0.98 -1.47 -0.04 0.00 -0.65 0.00 0.00 35.03 33.85 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 1.07 -0.14 0.00 0.58 0.00 -0.31 -1.44 120.51 120.26 2k8d n ALA 46 Ca 0.18 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.77 2k8d n ALA 46 Cb 0.51 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.47 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 0.18 0.74 3.07 0.00 0.00 -1.15 -2.71 105.19 105.32 2k8d n GLY 47 Ca -0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 2k8d n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k8d s THR 48 N -2.00 -0.56 0.24 2.61 2.01 -0.52 -5.00 115.64 112.42 2k8d s THR 48 Ca 0.00 0.11 0.06 0.00 0.31 0.00 0.00 61.69 62.17 2k8d s THR 48 Cb 0.00 -0.66 -0.03 0.00 0.01 0.00 0.00 72.50 71.82 2k8d s THR 48 CO 0.00 0.01 0.24 -1.83 -0.69 0.00 0.00 174.62 172.35 2k8d s GLU 49 N 2.53 3.09 0.67 4.92 -1.05 -1.26 -4.83 118.70 122.77 2k8d s GLU 49 Ca 0.04 -0.94 -0.16 0.00 -0.15 0.00 0.00 54.97 53.76 2k8d s GLU 49 Cb -0.13 -2.68 0.01 0.00 -0.44 0.00 0.00 34.13 30.89 2k8d s GLU 49 CO -0.13 0.42 1.16 -1.25 0.95 0.00 0.00 175.26 176.41 2k8d s PRO 50 N -3.80 2.58 0.21 -4.83 0.04 -1.26 -4.95 135.00 123.00 2k8d s PRO 50 Ca 0.33 1.60 -0.30 0.00 0.04 0.00 0.00 61.00 62.66 2k8d s PRO 50 Cb -0.08 -1.90 -0.10 0.00 0.04 0.00 0.00 34.50 32.45 2k8d s PRO 50 CO 0.26 -1.46 1.44 -1.25 0.04 0.00 0.00 177.00 176.03 2k8d s PRO 51 N -3.89 4.28 0.01 0.56 0.04 -1.26 -4.77 135.00 129.97 2k8d s PRO 51 Ca 0.71 2.25 0.00 0.00 0.04 0.00 0.00 61.00 64.00 2k8d s PRO 51 Cb -0.25 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.14 2k8d s PRO 51 CO 0.41 -0.44 0.00 0.34 0.04 0.00 0.00 177.00 177.35 2k8d n PHE 52 N 2.91 -1.74 -1.15 0.56 7.35 -1.26 -5.07 117.46 119.06 2k8d n PHE 52 Ca 0.09 0.04 -0.30 0.00 -0.76 0.00 0.00 57.45 56.52 2k8d n PHE 52 Cb 0.40 0.58 0.14 0.00 0.35 0.00 0.00 39.48 40.95 2k8d n PHE 52 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 2k8d s THR 53 N -1.03 2.72 0.33 -2.13 2.01 -1.26 -5.10 115.64 111.18 2k8d s THR 53 Ca 0.00 0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.27 2k8d s THR 53 Cb 0.00 -2.67 -0.06 0.00 0.01 0.00 0.00 72.50 69.79 2k8d s THR 53 CO 0.00 -0.31 0.07 -0.83 -0.69 0.00 0.00 174.62 172.86 2k8d s GLY 54 N -3.32 2.12 0.35 4.40 0.00 -1.26 -5.13 107.32 104.49 2k8d s GLY 54 Ca 0.63 -1.92 -0.05 0.00 0.00 0.00 0.00 44.72 43.39 2k8d s GLY 54 CO 0.57 -1.80 0.54 1.25 0.00 0.00 0.00 173.10 173.66 2k8d s LYS 55 N -3.88 1.99 0.15 2.90 2.20 -1.26 -5.19 119.74 116.65 2k8d s LYS 55 Ca 0.35 -1.71 0.01 0.00 -0.36 0.00 0.00 55.97 54.25 2k8d s LYS 55 Cb 0.08 0.48 -0.04 0.00 -1.51 0.00 0.00 37.83 36.83 2k8d s LYS 55 CO 0.15 -0.85 0.02 1.52 -0.36 0.00 0.00 175.35 175.83 2k8d s TYR 56 N -2.88 1.07 0.00 4.03 -0.85 -1.26 -5.06 117.35 112.40 2k8d s TYR 56 Ca 0.28 -1.09 0.00 0.00 -0.52 0.00 0.00 57.07 55.73 2k8d s TYR 56 Cb -0.01 -0.61 0.00 0.00 0.38 0.00 0.00 41.96 41.71 2k8d s TYR 56 CO 0.19 -0.32 0.00 0.72 -1.52 0.00 0.00 175.55 174.62 2k8d n HIS 57 N -0.18 -0.01 -1.50 -3.49 8.25 -1.26 -5.04 115.22 111.99 2k8d n HIS 57 Ca -0.06 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.02 2k8d n HIS 57 Cb 0.63 0.01 -0.15 0.00 1.12 0.00 0.00 29.99 31.60 2k8d n HIS 57 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2k8d n ASP 58 N -1.52 0.16 0.00 0.41 5.75 -1.26 -4.59 116.55 115.49 2k8d n ASP 58 Ca 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 54.79 54.77 2k8d n ASP 58 Cb 0.00 -0.91 0.00 0.00 -1.03 0.00 0.00 41.12 39.18 2k8d n ASP 58 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2k8d n LEU 59 N 10.17 0.35 -4.02 -2.12 4.77 -1.26 -5.11 117.00 119.78 2k8d n LEU 59 Ca 0.64 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.53 2k8d n LEU 59 Cb 0.09 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.09 2k8d n LEU 59 CO 0.95 0.06 -0.17 -2.28 -1.33 0.00 0.00 177.39 174.61 2k8d s HIS 60 N -1.13 0.52 -0.99 -1.77 2.46 -1.26 -5.07 115.29 108.06 2k8d s HIS 60 Ca 0.00 -0.93 -0.23 0.00 0.47 0.00 0.00 55.06 54.37 2k8d s HIS 60 Cb 0.00 -0.24 0.00 0.00 -0.13 0.00 0.00 32.58 32.21 2k8d s HIS 60 CO 0.00 -0.57 1.70 -0.51 -2.47 0.00 0.00 174.74 172.89 2k8d s ASP 61 N -2.97 5.85 0.32 9.88 1.01 -1.26 -4.87 116.67 124.63 2k8d s ASP 61 Ca 0.16 -1.15 -0.10 0.00 0.71 0.00 0.00 52.55 52.16 2k8d s ASP 61 Cb 0.06 -2.57 0.04 0.00 1.01 0.00 0.00 42.92 41.46 2k8d s ASP 61 CO -0.03 -2.11 0.62 -0.67 0.21 0.00 0.00 175.17 173.18 2k8d n ASP 62 N 11.37 -1.79 0.00 0.27 -0.08 -1.26 -5.13 116.55 119.93 2k8d n ASP 62 Ca 0.37 -2.38 0.00 0.00 -1.51 0.00 0.00 54.79 51.28 2k8d n ASP 62 Cb 0.49 3.02 0.00 0.00 2.34 0.00 0.00 41.12 46.96 2k8d n ASP 62 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2k8d n GLY 63 N -0.45 1.92 3.29 0.27 0.00 -1.26 -4.90 105.19 104.05 2k8d n GLY 63 Ca -0.06 -2.14 -0.16 0.00 0.00 0.00 0.00 46.02 43.66 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 -1.79 0.37 -0.41 -0.61 -4.36 0.44 -1.13 121.20 113.72 2k8d s ILE 64 Ca 0.00 -2.00 -0.17 0.00 -0.26 0.00 0.00 60.65 58.22 2k8d s ILE 64 Cb 0.00 -2.58 0.02 0.00 1.25 0.00 0.00 42.46 41.14 2k8d s ILE 64 CO 0.00 0.00 0.42 -0.31 0.24 0.00 0.00 174.94 175.29 2k8d s TYR 65 N -3.84 3.18 -0.34 1.37 1.51 0.27 -0.69 117.35 118.81 2k8d s TYR 65 Ca 0.38 -0.32 -0.29 0.00 -1.01 0.00 0.00 57.07 55.83 2k8d s TYR 65 Cb 0.07 -2.84 0.01 0.00 -0.11 0.00 0.00 41.96 39.09 2k8d s TYR 65 CO 0.14 -0.64 1.28 0.50 -1.11 0.00 0.00 175.55 175.72 2k8d s ARG 66 N 2.09 3.85 -0.99 -0.62 3.00 0.18 -0.86 118.95 125.60 2k8d s ARG 66 Ca 0.12 1.10 -0.25 0.00 -1.00 0.00 0.00 55.73 55.70 2k8d s ARG 66 Cb -0.17 -3.90 -0.11 0.00 0.00 0.00 0.00 34.95 30.77 2k8d s ARG 66 CO 0.13 -1.21 2.08 0.00 0.00 0.00 0.00 175.30 176.30 2k8d n ILE 68 N 8.30 1.21 1.76 0.00 3.06 -1.25 -1.17 119.36 131.27 2k8d n ILE 68 Ca 0.43 0.37 0.15 0.00 -2.50 0.00 0.00 62.75 61.20 2k8d n ILE 68 Cb 0.46 -1.25 0.81 0.00 0.54 0.00 0.00 39.64 40.20 2k8d n ILE 68 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2k8d n GLY 71 N 0.00 0.29 3.25 0.00 0.00 -0.31 -4.97 105.19 103.45 2k8d n GLY 71 Ca 0.00 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.87 0.06 0.02 2.61 2.01 -0.98 -5.03 115.64 111.47 2k8d s THR 72 Ca 0.00 -1.73 0.02 0.00 0.31 0.00 0.00 61.69 60.29 2k8d s THR 72 Cb 0.00 -2.09 -0.02 0.00 0.01 0.00 0.00 72.50 70.41 2k8d s THR 72 CO 0.00 -0.28 -0.07 -1.81 -0.69 0.00 0.00 174.62 171.76 2k8d s ASP 73 N -3.04 0.83 0.00 3.53 1.11 -1.26 0.35 116.67 118.18 2k8d s ASP 73 Ca 0.25 -0.37 0.00 0.00 0.18 0.00 0.00 52.55 52.61 2k8d s ASP 73 Cb 0.05 -0.01 0.00 0.00 1.07 0.00 0.00 42.92 44.03 2k8d s ASP 73 CO 0.04 -0.08 0.00 0.00 1.18 0.00 0.00 175.17 176.30 2k8d n LEU 74 N 2.06 0.00 -4.51 1.23 -0.00 -0.04 -4.55 117.00 111.19 2k8d n LEU 74 Ca -0.19 0.00 -0.46 0.00 -0.00 0.00 0.00 56.01 55.37 2k8d n LEU 74 Cb 0.56 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.92 2k8d n LEU 74 CO 0.23 0.00 1.88 0.49 -0.00 0.00 0.00 177.39 179.98 2k8d n PHE 75 N 0.00 1.63 -2.16 1.47 3.72 -1.26 -4.38 117.46 116.48 2k8d n PHE 75 Ca 0.00 0.14 -0.41 0.00 -0.05 0.00 0.00 57.45 57.12 2k8d n PHE 75 Cb 0.00 -2.60 -0.03 0.00 -0.94 0.00 0.00 39.48 35.91 2k8d n PHE 75 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2k8d s ASP 76 N 8.45 6.84 0.01 4.37 1.11 -1.26 -0.57 116.67 135.61 2k8d s ASP 76 Ca 1.07 2.51 0.15 0.00 0.18 0.00 0.00 52.55 56.45 2k8d s ASP 76 Cb -0.62 -2.62 0.62 0.00 1.07 0.00 0.00 42.92 41.37 2k8d s ASP 76 CO 0.41 -0.55 1.47 -0.24 1.18 0.00 0.00 175.17 177.44 2k8d n SER 77 N 2.15 0.02 0.33 0.27 2.88 -0.28 -0.27 113.62 118.71 2k8d n SER 77 Ca 0.05 0.50 0.21 0.00 -1.33 0.00 0.00 58.87 58.30 2k8d n SER 77 Cb 0.42 -0.51 1.14 0.00 -0.75 0.00 0.00 64.21 64.51 2k8d n SER 77 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 2k8d h GLU 78 N 0.00 0.00 0.00 -1.46 4.11 -1.91 -0.09 114.58 115.23 2k8d h GLU 78 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 2k8d h GLU 78 Cb 0.25 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 2k8d h GLU 78 CO 0.00 0.00 -0.68 1.79 0.07 0.00 0.00 179.01 180.19 2k8d h THR 79 N 0.00 0.02 -2.61 -1.06 1.35 -0.97 -3.43 112.91 106.20 2k8d h THR 79 Ca -0.00 -1.03 -0.59 0.00 -0.55 0.00 0.00 66.41 64.24 2k8d h THR 79 Cb 0.05 1.68 -0.39 0.00 -1.73 0.00 0.00 68.15 67.76 2k8d h THR 79 CO 0.00 0.01 -0.86 -0.75 -0.25 0.00 0.00 175.52 173.67 2k8d s LYS 80 N -3.30 0.89 -0.04 4.72 2.36 -0.06 -3.01 119.74 121.31 2k8d s LYS 80 Ca 0.02 -1.80 -0.01 0.00 -2.55 0.00 0.00 55.97 51.63 2k8d s LYS 80 Cb 0.08 -1.63 0.03 0.00 -1.05 0.00 0.00 37.83 35.26 2k8d s LYS 80 CO 0.75 -1.26 0.03 0.12 1.55 0.00 0.00 175.35 176.54 2k8d s PHE 81 N 0.49 0.17 -0.34 4.03 5.36 -1.14 -4.60 117.98 121.96 2k8d s PHE 81 Ca 0.23 0.13 0.01 0.00 -0.96 0.00 0.00 56.93 56.34 2k8d s PHE 81 Cb -0.14 -0.45 0.14 0.00 -0.34 0.00 0.00 43.02 42.24 2k8d s PHE 81 CO -0.07 -0.17 0.29 0.34 -1.46 0.00 0.00 175.22 174.15 2k8d s ASP 82 N 1.67 2.02 0.10 6.13 2.15 -1.26 -5.05 116.67 122.43 2k8d s ASP 82 Ca -0.01 -1.51 -0.31 0.00 0.43 0.00 0.00 52.55 51.15 2k8d s ASP 82 Cb -0.13 0.20 -0.10 0.00 -0.30 0.00 0.00 42.92 42.60 2k8d s ASP 82 CO -0.03 -0.32 1.78 -0.44 -0.17 0.00 0.00 175.17 175.99 2k8d s SER 83 N 1.63 6.48 0.00 -0.34 0.01 -1.26 -0.25 113.70 119.98 2k8d s SER 83 Ca 0.15 2.67 0.00 0.00 1.31 0.00 0.00 55.95 60.08 2k8d s SER 83 Cb -0.17 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.50 2k8d s SER 83 CO -0.13 -0.97 0.00 0.61 0.41 0.00 0.00 173.24 173.16 2k8d n GLY 84 N 4.17 1.80 0.06 3.44 0.00 -1.26 -4.58 105.19 108.82 2k8d n GLY 84 Ca 0.17 -0.15 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 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 1.19 -7.02 2.61 2.02 -2.02 -3.47 112.91 106.22 2k8d h THR 85 Ca 0.00 -0.58 -0.60 0.00 0.77 0.00 0.00 66.41 66.00 2k8d h THR 85 Cb 0.00 1.53 -0.29 0.00 -1.74 0.00 0.00 68.15 67.65 2k8d h THR 85 CO 0.00 0.16 -0.90 0.61 0.37 0.00 0.00 175.52 175.76 2k8d n GLY 86 N -0.45 -0.36 3.76 2.16 0.00 0.66 -4.95 105.19 106.01 2k8d n GLY 86 Ca -0.07 0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 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 -3.47 2.46 -1.25 1.61 -0.00 -1.26 -4.84 118.94 112.18 2k8d s TRP 87 Ca 0.64 1.31 -0.17 0.00 -0.00 0.00 0.00 56.10 57.89 2k8d s TRP 87 Cb -0.37 -3.85 -0.02 0.00 -0.00 0.00 0.00 33.47 29.24 2k8d s TRP 87 CO 0.99 -2.80 2.12 -0.35 -0.00 0.00 0.00 176.95 176.91 2k8d n PRO 88 N -0.38 2.46 -4.06 5.86 -0.04 -1.26 -4.83 135.00 132.74 2k8d n PRO 88 Ca 0.06 -2.40 -0.12 0.00 -0.04 0.00 0.00 63.50 61.00 2k8d n PRO 88 Cb 0.43 -3.19 -0.11 0.00 -0.04 0.00 0.00 33.50 30.58 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 3.79 0.80 0.18 3.54 1.04 -1.26 -1.98 113.70 119.81 2k8d s SER 89 Ca 0.50 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 56.38 2k8d s SER 89 Cb 0.14 0.04 -0.04 0.00 0.10 0.00 0.00 66.02 66.26 2k8d s SER 89 CO -0.02 -0.22 0.06 0.72 0.98 0.00 0.00 173.24 174.76 2k8d s PHE 90 N -1.46 1.16 0.00 5.02 -0.71 -0.01 -4.63 117.98 117.36 2k8d s PHE 90 Ca -0.10 -1.18 0.00 0.00 -1.04 0.00 0.00 56.93 54.61 2k8d s PHE 90 Cb -0.10 -0.65 0.00 0.00 -1.21 0.00 0.00 43.02 41.07 2k8d s PHE 90 CO 0.00 -0.41 0.10 2.48 -1.34 0.00 0.00 175.22 176.05 2k8d n TYR 91 N -0.25 0.00 -3.88 3.49 0.18 -1.16 -0.16 117.16 115.38 2k8d n TYR 91 Ca -0.03 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.64 2k8d n TYR 91 Cb 0.64 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.59 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 -0.42 -1.35 -4.23 9.48 -0.08 -1.26 -4.61 116.55 114.07 2k8d n ASP 92 Ca 0.00 -2.50 -0.14 0.00 -1.51 0.00 0.00 54.79 50.64 2k8d n ASP 92 Cb 0.03 2.42 -0.10 0.00 2.34 0.00 0.00 41.12 45.80 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 -2.61 1.08 0.27 5.18 -7.23 -1.26 -4.85 120.40 110.98 2k8d s VAL 93 Ca 0.21 -1.94 0.00 0.00 -1.81 0.00 0.00 61.98 58.44 2k8d s VAL 93 Cb -0.02 -1.71 0.25 0.00 0.56 0.00 0.00 36.38 35.46 2k8d s VAL 93 CO 0.15 -0.71 1.75 1.62 -0.31 0.00 0.00 175.10 177.61 2k8d h VAL 94 N 3.00 0.68 0.00 1.32 3.04 -1.92 -3.47 116.25 118.90 2k8d h VAL 94 Ca -0.37 -0.20 0.00 0.00 -1.01 0.00 0.00 66.70 65.12 2k8d h VAL 94 Cb 1.19 0.04 0.00 0.00 -2.01 0.00 0.00 31.29 30.51 2k8d h VAL 94 CO 0.61 0.11 0.00 -1.20 -1.01 0.00 0.00 177.57 176.07 2k8d n SER 95 N -4.90 0.00 -4.17 3.17 7.64 -1.26 -4.83 113.62 109.27 2k8d n SER 95 Ca 0.18 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.68 2k8d n SER 95 Cb 0.48 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.65 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 -1.14 2.15 -0.02 1.43 1.02 -1.26 -4.32 120.64 118.50 2k8d n GLU 96 Ca 0.00 -2.50 -0.06 0.00 -0.02 0.00 0.00 57.16 54.58 2k8d n GLU 96 Cb 0.00 -3.38 -0.02 0.00 -0.02 0.00 0.00 31.44 28.02 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 9.68 0.00 -0.79 -0.32 1.44 -1.26 -4.86 115.22 119.10 2k8d n HIS 97 Ca 0.48 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 56.22 2k8d n HIS 97 Cb 0.43 -0.21 0.04 0.00 0.12 0.00 0.00 29.99 30.37 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 -3.47 1.42 -4.78 4.39 2.85 -1.25 -4.29 115.26 110.12 2k8d n ASN 98 Ca -0.11 -2.12 -0.27 0.00 -0.11 0.00 0.00 54.58 51.98 2k8d n ASN 98 Cb 0.44 -0.15 -0.06 0.00 1.24 0.00 0.00 39.78 41.25 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 -1.20 4.42 -0.06 -1.44 2.07 -1.26 -0.26 121.20 123.48 2k8d s ILE 99 Ca 0.09 -1.07 0.05 0.00 -1.41 0.00 0.00 60.65 58.31 2k8d s ILE 99 Cb 0.08 -3.24 -0.00 0.00 0.13 0.00 0.00 42.46 39.43 2k8d s ILE 99 CO 0.01 -0.08 -0.20 -0.75 -1.91 0.00 0.00 174.94 172.01 2k8d s LYS 100 N -2.99 2.20 0.11 3.50 2.36 0.49 -4.37 119.74 121.03 2k8d s LYS 100 Ca 0.30 -0.72 0.09 0.00 -2.55 0.00 0.00 55.97 53.09 2k8d s LYS 100 Cb -0.10 -1.84 -0.04 0.00 -1.05 0.00 0.00 37.83 34.80 2k8d s LYS 100 CO 0.23 0.26 -0.21 -0.51 1.55 0.00 0.00 175.35 176.67 2k8d s LEU 101 N 0.07 2.56 -0.14 5.43 1.43 -1.26 -1.98 118.68 124.79 2k8d s LEU 101 Ca -0.07 -0.59 -0.02 0.00 -1.03 0.00 0.00 54.13 52.43 2k8d s LEU 101 Cb -0.13 -1.44 0.04 0.00 0.03 0.00 0.00 46.19 44.68 2k8d s LEU 101 CO 0.04 0.19 -0.01 -0.13 0.23 0.00 0.00 176.35 176.67 2k8d s ARG 102 N -1.97 0.90 0.46 1.70 3.00 -1.26 -4.96 118.95 116.82 2k8d s ARG 102 Ca 0.16 -0.24 -0.25 0.00 0.00 0.00 0.00 55.73 55.40 2k8d s ARG 102 Cb -0.10 -1.64 -0.08 0.00 0.00 0.00 0.00 34.95 33.13 2k8d s ARG 102 CO 0.08 -0.44 1.38 -2.00 0.00 0.00 0.00 175.30 174.32 2k8d s GLU 103 N 1.83 3.66 0.33 3.54 -6.30 -1.26 -1.42 118.70 119.08 2k8d s GLU 103 Ca 0.02 2.32 -0.01 0.00 -2.50 0.00 0.00 54.97 54.80 2k8d s GLU 103 Cb -0.15 -2.61 0.00 0.00 0.00 0.00 0.00 34.13 31.38 2k8d s GLU 103 CO -0.07 -0.80 0.44 -3.47 0.02 0.00 0.00 175.26 171.38 2k8d n ASP 104 N -0.27 -1.21 -0.06 -1.70 2.03 -0.52 -4.90 116.55 109.92 2k8d n ASP 104 Ca 0.06 -2.79 0.04 0.00 0.52 0.00 0.00 54.79 52.61 2k8d n ASP 104 Cb 0.43 2.30 0.06 0.00 -0.72 0.00 0.00 41.12 43.18 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 -0.54 1.87 0.31 -0.67 0.00 -1.26 -0.06 116.66 116.31 2k8d n ARG 105 Ca 0.01 -1.82 0.19 0.00 -0.00 0.00 0.00 57.85 56.23 2k8d n ARG 105 Cb 0.55 -1.13 1.01 0.00 -0.00 0.00 0.00 32.46 32.89 2k8d n ARG 105 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 2k8d h SER 106 N 0.00 0.00 1.26 2.89 0.02 -1.85 0.22 113.55 116.09 2k8d h SER 106 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k8d h SER 106 Cb 0.80 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.34 2k8d h SER 106 CO 0.00 0.02 0.00 0.00 -1.14 0.00 0.00 176.83 175.71 2k8d n LEU 107 N -3.32 0.77 0.00 5.07 -0.00 -1.26 -4.89 117.00 113.37 2k8d n LEU 107 Ca -0.02 0.60 0.00 0.00 -0.00 0.00 0.00 56.01 56.59 2k8d n LEU 107 Cb 0.14 -0.39 0.00 0.00 -0.00 0.00 0.00 43.42 43.16 2k8d n LEU 107 CO 0.24 -0.29 0.00 0.61 -0.00 0.00 0.00 177.39 177.95 2k8d n GLY 108 N 0.93 0.85 0.00 1.47 0.00 0.73 -5.00 105.19 104.17 2k8d n GLY 108 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.71 0.00 -3.57 1.61 2.81 -1.01 -5.09 117.12 111.15 2k8d n MET 109 Ca 0.00 0.00 -0.17 0.00 -1.81 0.00 0.00 57.70 55.72 2k8d n MET 109 Cb 0.00 0.00 -0.14 0.00 -0.71 0.00 0.00 33.22 32.37 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 -0.33 -0.28 2.03 1.01 -1.26 -4.37 120.40 117.19 2k8d s VAL 110 Ca 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.07 2k8d s VAL 110 Cb 0.00 -0.54 0.09 0.00 0.00 0.00 0.00 36.38 35.93 2k8d s VAL 110 CO 0.00 -0.05 0.05 -0.60 0.00 0.00 0.00 175.10 174.50 2k8d s ARG 111 N 2.34 0.99 0.12 2.72 3.52 0.91 -1.27 118.95 128.29 2k8d s ARG 111 Ca 0.05 -1.08 0.04 0.00 -0.13 0.00 0.00 55.73 54.61 2k8d s ARG 111 Cb -0.14 -2.30 -0.04 0.00 -1.56 0.00 0.00 34.95 30.91 2k8d s ARG 111 CO -0.10 -0.85 0.07 0.00 -0.81 0.00 0.00 175.30 173.61 2k8d s GLU 113 N -2.63 1.62 -0.21 0.00 -1.05 -0.51 -0.44 118.70 115.49 2k8d s GLU 113 Ca 0.29 0.89 -0.04 0.00 -0.15 0.00 0.00 54.97 55.96 2k8d s GLU 113 Cb -0.11 -1.85 0.07 0.00 -0.44 0.00 0.00 34.13 31.80 2k8d s GLU 113 CO 0.21 -2.00 0.08 0.08 0.95 0.00 0.00 175.26 174.57 2k8d s VAL 114 N -2.95 0.25 0.30 1.83 1.01 -0.66 -4.08 120.40 116.09 2k8d s VAL 114 Ca 0.62 -0.53 0.08 0.00 0.00 0.00 0.00 61.98 62.15 2k8d s VAL 114 Cb -0.17 -0.92 -0.06 0.00 0.00 0.00 0.00 36.38 35.23 2k8d s VAL 114 CO 0.56 -0.36 -0.08 -0.76 0.00 0.00 0.00 175.10 174.46 2k8d s LEU 115 N 1.97 2.57 0.74 3.92 1.02 -0.84 -1.63 118.68 126.44 2k8d s LEU 115 Ca 0.03 -1.18 -0.14 0.00 0.02 0.00 0.00 54.13 52.86 2k8d s LEU 115 Cb -0.17 -0.78 0.05 0.00 0.02 0.00 0.00 46.19 45.31 2k8d s LEU 115 CO -0.14 -0.27 1.15 0.00 0.02 0.00 0.00 176.35 177.10 2k8d h ALA 117 N -0.57 1.18 0.00 0.00 0.00 -0.83 -3.38 119.26 115.65 2k8d h ALA 117 Ca -0.46 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 53.99 2k8d h ALA 117 Cb 1.27 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2k8d h ALA 117 CO 0.50 0.54 -1.03 -2.13 0.00 0.00 0.00 179.25 177.13 2k8d n ARG 118 N -3.87 0.11 -2.25 0.00 3.00 -1.26 -4.78 116.66 107.61 2k8d n ARG 118 Ca -0.01 0.05 -0.40 0.00 -0.00 0.00 0.00 57.85 57.48 2k8d n ARG 118 Cb 0.48 -0.69 -0.01 0.00 0.00 0.00 0.00 32.46 32.24 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 9.07 0.20 -4.02 0.00 8.00 -1.26 -3.76 116.55 124.78 2k8d n ASP 120 Ca 0.49 -1.69 -0.26 0.00 0.71 0.00 0.00 54.79 54.03 2k8d n ASP 120 Cb 0.45 -0.32 -0.07 0.00 -0.02 0.00 0.00 41.12 41.16 2k8d n ASP 120 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k8d n ALA 121 N 6.17 0.48 -0.25 2.24 0.00 -1.26 -5.05 120.51 122.84 2k8d n ALA 121 Ca 0.21 -2.01 -0.10 0.00 0.00 0.00 0.00 53.44 51.55 2k8d n ALA 121 Cb 0.25 1.25 -0.06 0.00 0.00 0.00 0.00 19.45 20.89 2k8d n ALA 121 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2k8d h HIS 122 N 1.48 -1.51 0.00 0.00 2.76 -1.87 -3.43 115.15 112.58 2k8d h HIS 122 Ca -0.33 0.09 0.00 0.00 -2.20 0.00 0.00 60.37 57.93 2k8d h HIS 122 Cb 1.15 0.75 0.00 0.00 1.55 0.00 0.00 27.41 30.86 2k8d h HIS 122 CO 0.00 -0.43 0.00 1.28 -1.30 0.00 0.00 177.93 177.48 2k8d n LEU 123 N -5.37 0.00 0.00 0.26 7.99 -1.24 -4.87 117.00 113.76 2k8d n LEU 123 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.01 2k8d n LEU 123 Cb 0.33 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.64 2k8d n LEU 123 CO -0.05 0.00 0.00 0.61 -1.51 0.00 0.00 177.39 176.44 2k8d n GLY 124 N 0.00 0.26 3.79 -0.72 0.00 -0.65 0.14 105.19 108.02 2k8d n GLY 124 Ca 0.00 0.43 -0.09 0.00 0.00 0.00 0.00 46.02 46.37 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 2.38 0.10 -0.03 1.61 -3.43 -0.74 -1.65 115.29 113.52 2k8d s HIS 125 Ca 0.00 -0.64 0.05 0.00 -0.80 0.00 0.00 55.06 53.68 2k8d s HIS 125 Cb 0.00 0.67 -0.01 0.00 -1.43 0.00 0.00 32.58 31.81 2k8d s HIS 125 CO 0.00 -1.37 -0.19 0.54 -2.00 0.00 0.00 174.74 171.72 2k8d s VAL 126 N -3.09 1.55 0.03 -5.38 0.11 0.41 -0.34 120.40 113.70 2k8d s VAL 126 Ca 0.15 -0.81 0.03 0.00 -2.93 0.00 0.00 61.98 58.42 2k8d s VAL 126 Cb -0.05 -1.31 -0.02 0.00 -1.53 0.00 0.00 36.38 33.47 2k8d s VAL 126 CO 0.10 0.44 -0.08 0.72 -3.33 0.00 0.00 175.10 172.95 2k8d s PHE 127 N -0.18 0.71 -0.21 1.54 -0.71 -0.26 -0.83 117.98 118.04 2k8d s PHE 127 Ca 0.01 -0.38 -0.29 0.00 -1.04 0.00 0.00 56.93 55.22 2k8d s PHE 127 Cb -0.10 -0.43 -0.06 0.00 -1.21 0.00 0.00 43.02 41.22 2k8d s PHE 127 CO 0.01 -0.05 2.19 -3.47 -1.34 0.00 0.00 175.22 172.57 2k8d n ASP 128 N 1.86 3.21 0.00 1.98 2.03 -0.39 0.04 116.55 125.27 2k8d n ASP 128 Ca -0.20 0.31 0.00 0.00 0.52 0.00 0.00 54.79 55.43 2k8d n ASP 128 Cb 0.55 -1.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.44 2k8d n ASP 128 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2k8d n ASP 129 N 10.94 0.00 -4.84 1.67 2.03 0.09 -4.90 116.55 121.54 2k8d n ASP 129 Ca 0.30 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 55.29 2k8d n ASP 129 Cb 0.41 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.80 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 -0.95 1.98 0.22 0.27 0.00 0.65 -4.98 107.32 104.51 2k8d s GLY 130 Ca 0.00 0.16 0.09 0.00 0.00 0.00 0.00 44.72 44.98 2k8d s GLY 130 CO 0.00 0.45 1.49 -0.56 0.00 0.00 0.00 173.10 174.48 2k8d h PRO 131 N 0.52 0.00 0.00 2.90 0.13 -1.97 -3.39 132.00 130.18 2k8d h PRO 131 Ca -0.46 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2k8d h PRO 131 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2k8d h PRO 131 CO 0.61 0.76 0.00 2.89 -0.23 0.00 0.00 178.00 182.03 2k8d n ARG 132 N -3.64 0.00 -0.01 0.86 1.85 -1.26 -4.79 116.66 109.67 2k8d n ARG 132 Ca -0.01 0.00 -0.13 0.00 -1.00 0.00 0.00 57.85 56.72 2k8d n ARG 132 Cb 0.74 0.00 -0.10 0.00 -1.05 0.00 0.00 32.46 32.04 2k8d n ARG 132 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 2k8d h PRO 133 N 0.00 -0.05 0.00 2.89 0.13 -1.95 -3.39 132.00 129.63 2k8d h PRO 133 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 2k8d h PRO 133 Cb 0.00 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.14 2k8d h PRO 133 CO 0.00 0.55 -0.19 1.79 -0.23 0.00 0.00 178.00 179.92 2k8d h THR 134 N -0.71 0.48 0.00 1.56 1.35 -1.94 -3.47 112.91 110.19 2k8d h THR 134 Ca -0.01 -1.02 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 2k8d h THR 134 Cb 0.62 1.72 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 2k8d h THR 134 CO 0.01 0.19 0.00 0.61 -0.25 0.00 0.00 175.52 176.08 2k8d n GLY 135 N 0.11 2.22 3.78 5.82 0.00 -1.26 -4.98 105.19 110.88 2k8d n GLY 135 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.02 2.88 -0.35 1.61 -2.85 -1.26 -0.25 119.74 119.49 2k8d s LYS 136 Ca 0.00 -0.80 0.02 0.00 -1.00 0.00 0.00 55.97 54.18 2k8d s LYS 136 Cb 0.00 -2.67 0.11 0.00 -2.06 0.00 0.00 37.83 33.21 2k8d s LYS 136 CO 0.00 0.52 0.12 0.50 0.10 0.00 0.00 175.35 176.58 2k8d s ARG 137 N -2.80 1.13 0.33 1.78 3.52 0.11 -4.39 118.95 118.64 2k8d s ARG 137 Ca 0.30 -1.58 -0.29 0.00 -0.13 0.00 0.00 55.73 54.03 2k8d s ARG 137 Cb -0.11 -2.52 -0.10 0.00 -1.56 0.00 0.00 34.95 30.66 2k8d s ARG 137 CO 0.23 -1.01 1.28 0.71 -0.81 0.00 0.00 175.30 175.70 2k8d s TYR 138 N 1.06 3.10 0.02 5.12 1.51 0.77 -1.11 117.35 127.82 2k8d s TYR 138 Ca 0.12 1.45 -0.01 0.00 -1.01 0.00 0.00 57.07 57.62 2k8d s TYR 138 Cb -0.20 -3.63 -0.02 0.00 -0.11 0.00 0.00 41.96 38.01 2k8d s TYR 138 CO -0.14 -1.71 -0.00 0.00 -1.11 0.00 0.00 175.55 172.58 2k8d s MET 140 N -1.34 0.31 -0.38 0.00 0.23 -0.84 -1.79 119.30 115.49 2k8d s MET 140 Ca -0.15 -0.51 0.03 0.00 -1.03 0.00 0.00 55.69 54.04 2k8d s MET 140 Cb -0.09 0.11 0.16 0.00 -1.53 0.00 0.00 34.83 33.48 2k8d s MET 140 CO -0.01 -0.06 0.39 1.21 -2.03 0.00 0.00 175.02 174.52 2k8d s ASN 141 N -1.29 1.12 0.25 -1.18 2.47 0.12 -4.72 114.94 111.71 2k8d s ASN 141 Ca -0.14 -1.76 -0.20 0.00 0.42 0.00 0.00 52.86 51.18 2k8d s ASN 141 Cb -0.09 0.51 0.07 0.00 -1.45 0.00 0.00 41.25 40.29 2k8d s ASN 141 CO -0.00 -0.24 0.95 -0.94 -3.72 0.00 0.00 177.10 173.14 2k8d s SER 142 N 1.25 -0.00 0.52 -4.21 1.04 -1.26 -3.71 113.70 107.32 2k8d s SER 142 Ca 0.19 -0.83 0.35 0.00 0.48 0.00 0.00 55.95 56.14 2k8d s SER 142 Cb -0.13 0.62 1.75 0.00 0.10 0.00 0.00 66.02 68.36 2k8d s SER 142 CO -0.04 -1.24 2.05 0.00 0.98 0.00 0.00 173.24 175.00 2k8d h ALA 143 N 2.00 1.00 0.00 5.32 0.00 -1.88 -3.40 119.26 122.30 2k8d h ALA 143 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2k8d h ALA 143 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2k8d h ALA 143 CO 0.37 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.62 2k8d n ALA 144 N -1.98 1.80 -2.11 0.00 0.00 -1.26 -4.38 120.51 112.58 2k8d n ALA 144 Ca -0.01 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.20 2k8d n ALA 144 Cb 0.14 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 18.61 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 0.39 4.70 -4.56 0.00 4.77 -1.26 -3.90 117.00 117.14 2k8d n LEU 145 Ca 0.00 -4.69 -0.40 0.00 -0.03 0.00 0.00 56.01 50.88 2k8d n LEU 145 Cb 0.16 -0.30 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 2k8d n LEU 145 CO 0.00 2.06 1.33 -0.75 -1.33 0.00 0.00 177.39 178.70 2k8d s LYS 146 N -3.60 3.06 0.28 3.23 2.20 -0.95 -4.93 119.74 119.03 2k8d s LYS 146 Ca 0.49 0.23 -0.30 0.00 -0.36 0.00 0.00 55.97 56.04 2k8d s LYS 146 Cb 0.40 -4.23 -0.13 0.00 -1.51 0.00 0.00 37.83 32.37 2k8d s LYS 146 CO 0.01 -2.26 1.29 1.19 -0.36 0.00 0.00 175.35 175.23 2k8d n PHE 147 N 10.45 2.01 -4.24 4.03 3.01 -1.26 -0.64 117.46 130.81 2k8d n PHE 147 Ca 0.11 0.53 -0.13 0.00 1.01 0.00 0.00 57.45 58.97 2k8d n PHE 147 Cb 0.50 -2.40 -0.10 0.00 -0.01 0.00 0.00 39.48 37.47 2k8d n PHE 147 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 2k8d s ILE 148 N -0.57 0.47 1.15 4.37 -4.36 0.14 -4.84 121.20 117.56 2k8d s ILE 148 Ca 0.63 -1.97 -0.13 0.00 -0.26 0.00 0.00 60.65 58.91 2k8d s ILE 148 Cb -0.64 -2.28 0.25 0.00 1.25 0.00 0.00 42.46 41.04 2k8d s ILE 148 CO 0.56 -0.30 0.90 -0.81 0.24 0.00 0.00 174.94 175.52 2k8d n PRO 149 N -0.28 -2.17 0.00 0.37 -0.04 -1.26 -0.42 135.00 131.20 2k8d n PRO 149 Ca -0.04 -0.60 0.00 0.00 -0.04 0.00 0.00 63.50 62.82 2k8d n PRO 149 Cb 0.64 -2.13 0.00 0.00 -0.04 0.00 0.00 33.50 31.98 2k8d n PRO 149 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k8d n ARG 150 N -4.52 0.00 0.00 0.54 5.12 -1.26 -4.05 116.66 112.49 2k8d n ARG 150 Ca 0.04 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.96 2k8d n ARG 150 Cb 0.55 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.85 2k8d n ARG 150 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2k8d n ASP 151 N -3.73 0.00 -0.33 0.55 2.03 -1.26 -4.63 116.55 109.18 2k8d n ASP 151 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2k8d n ASP 151 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2k8d n ASP 151 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k8d n GLN 152 N -0.78 0.00 0.00 -0.67 1.13 -1.26 -4.85 117.38 110.95 2k8d n GLN 152 Ca 0.00 -0.63 0.12 0.00 -1.94 0.00 0.00 57.00 54.55 2k8d n GLN 152 Cb 0.00 -0.38 0.65 0.00 0.11 0.00 0.00 30.24 30.62 2k8d n GLN 152 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 2k8d n ILE 153 N 0.00 0.17 -1.59 5.09 -6.64 -1.26 -5.15 119.36 109.98 2k8d n ILE 153 Ca 0.00 0.04 0.00 0.00 -1.77 0.00 0.00 62.75 61.02 2k8d n ILE 153 Cb 0.60 -0.65 0.00 0.00 -1.44 0.00 0.00 39.64 38.15 2k8d n ILE 153 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39