#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 0.00 -3.02 0.03 4.81 -1.26 -5.16 118.16 113.57 2k8d n LYS 5 Ca 0.00 -0.18 -0.29 0.00 -0.87 0.00 0.00 58.31 56.97 2k8d n LYS 5 Cb 0.00 -0.17 -0.03 0.00 0.02 0.00 0.00 35.03 34.85 2k8d n LYS 5 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 2k8d s ASP 6 N -0.01 6.47 1.07 3.14 -4.77 -1.26 -4.87 116.67 116.43 2k8d s ASP 6 Ca 0.00 0.96 -0.12 0.00 -3.30 0.00 0.00 52.55 50.08 2k8d s ASP 6 Cb 0.00 -2.25 0.20 0.00 -1.09 0.00 0.00 42.92 39.79 2k8d s ASP 6 CO 0.00 -0.34 0.91 -2.11 0.70 0.00 0.00 175.17 174.33 2k8d n ARG 7 N -1.26 -1.53 -3.70 2.11 1.85 -1.26 -4.63 116.66 108.23 2k8d n ARG 7 Ca 0.01 -0.40 -0.37 0.00 -1.00 0.00 0.00 57.85 56.08 2k8d n ARG 7 Cb 0.54 -2.17 -0.09 0.00 -1.05 0.00 0.00 32.46 29.69 2k8d n ARG 7 CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 177.63 178.58 2k8d s ILE 8 N -2.47 3.75 0.31 8.89 -4.36 0.25 -4.88 121.20 122.69 2k8d s ILE 8 Ca 0.66 -2.80 -0.29 0.00 -0.26 0.00 0.00 60.65 57.96 2k8d s ILE 8 Cb -0.23 -3.46 -0.10 0.00 1.25 0.00 0.00 42.46 39.92 2k8d s ILE 8 CO 0.63 -0.86 1.40 -2.16 0.24 0.00 0.00 174.94 174.19 2k8d s PRO 9 N 0.13 4.27 0.15 0.37 0.04 -1.26 -2.47 135.00 136.23 2k8d s PRO 9 Ca 0.16 2.33 0.10 0.00 0.04 0.00 0.00 61.00 63.63 2k8d s PRO 9 Cb -0.20 -3.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.23 2k8d s PRO 9 CO -0.04 -0.35 -0.24 0.42 0.04 0.00 0.00 177.00 176.83 2k8d s ILE 10 N -0.69 2.17 -0.36 0.56 1.01 0.49 -4.20 121.20 120.18 2k8d s ILE 10 Ca 0.54 -1.85 0.02 0.00 0.00 0.00 0.00 60.65 59.36 2k8d s ILE 10 Cb -0.42 -1.97 0.15 0.00 0.01 0.00 0.00 42.46 40.23 2k8d s ILE 10 CO 0.51 -0.05 0.35 -0.36 0.00 0.00 0.00 174.94 175.39 2k8d s PHE 11 N -1.40 -0.20 -0.96 3.97 0.40 -1.26 -0.22 117.98 118.30 2k8d s PHE 11 Ca 0.16 -0.83 -0.25 0.00 -0.60 0.00 0.00 56.93 55.41 2k8d s PHE 11 Cb -0.09 -0.47 -0.17 0.00 0.51 0.00 0.00 43.02 42.80 2k8d s PHE 11 CO 0.07 -0.95 1.94 0.43 0.70 0.00 0.00 175.22 177.42 2k8d n SER 12 N 4.36 2.32 -0.15 1.36 7.64 -1.22 -4.78 113.62 123.15 2k8d n SER 12 Ca 0.09 -2.62 0.01 0.00 1.01 0.00 0.00 58.87 57.36 2k8d n SER 12 Cb 0.44 -1.50 0.28 0.00 -1.01 0.00 0.00 64.21 62.42 2k8d n SER 12 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2k8d h VAL 13 N 5.87 1.18 0.00 0.44 2.07 -1.92 0.68 116.25 124.57 2k8d h VAL 13 Ca 0.21 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.33 2k8d h VAL 13 Cb 0.88 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2k8d h VAL 13 CO 1.39 0.19 0.00 0.00 0.02 0.00 0.00 177.57 179.17 2k8d n ALA 14 N -2.44 1.44 -0.19 1.67 0.00 -1.26 -0.77 120.51 118.95 2k8d n ALA 14 Ca 0.06 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2k8d n ALA 14 Cb 0.07 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.30 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 -1.74 2.47 -3.33 0.00 4.81 -0.27 -5.02 118.16 115.08 2k8d n LYS 15 Ca 0.02 -1.36 -0.13 0.00 -0.87 0.00 0.00 58.31 55.97 2k8d n LYS 15 Cb 0.13 -0.93 -0.03 0.00 0.02 0.00 0.00 35.03 34.22 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 -0.43 -0.02 -4.90 3.14 5.15 0.05 -4.98 115.26 113.26 2k8d n ASN 16 Ca 0.00 -0.49 -0.29 0.00 -0.60 0.00 0.00 54.58 53.20 2k8d n ASN 16 Cb 0.30 -0.60 0.09 0.00 -0.53 0.00 0.00 39.78 39.04 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 -4.92 1.97 -0.01 1.20 0.52 0.04 -4.94 118.95 112.80 2k8d s ARG 17 Ca 0.04 0.12 0.00 0.00 -0.52 0.00 0.00 55.73 55.37 2k8d s ARG 17 Cb -0.02 -1.95 0.01 0.00 0.52 0.00 0.00 34.95 33.51 2k8d s ARG 17 CO 0.38 -1.59 -0.01 0.08 0.02 0.00 0.00 175.30 174.18 2k8d s VAL 18 N -3.57 0.13 -0.23 3.52 1.01 -1.26 -3.43 120.40 116.58 2k8d s VAL 18 Ca 0.62 -0.01 -0.03 0.00 0.00 0.00 0.00 61.98 62.55 2k8d s VAL 18 Cb -0.11 -0.16 0.10 0.00 0.00 0.00 0.00 36.38 36.21 2k8d s VAL 18 CO 0.49 0.07 0.22 -1.83 0.00 0.00 0.00 175.10 174.06 2k8d s GLU 19 N 0.31 0.21 -0.12 2.72 1.03 0.69 -4.96 118.70 118.58 2k8d s GLU 19 Ca -0.03 0.07 -0.28 0.00 0.03 0.00 0.00 54.97 54.77 2k8d s GLU 19 Cb -0.05 -1.12 -0.02 0.00 -0.80 0.00 0.00 34.13 32.15 2k8d s GLU 19 CO -0.01 -0.76 0.92 1.41 -1.33 0.00 0.00 175.26 175.50 2k8d s MET 20 N 2.31 4.39 -0.03 -4.83 1.75 -1.26 -0.38 119.30 121.24 2k8d s MET 20 Ca 0.07 1.22 0.03 0.00 -1.25 0.00 0.00 55.69 55.76 2k8d s MET 20 Cb -0.15 -3.54 0.00 0.00 2.84 0.00 0.00 34.83 33.98 2k8d s MET 20 CO -0.18 -0.27 -0.11 0.08 -0.65 0.00 0.00 175.02 173.89 2k8d s VAL 21 N 1.91 0.92 1.09 10.11 1.01 -1.03 -4.95 120.40 129.46 2k8d s VAL 21 Ca 0.44 -0.43 -0.15 0.00 0.00 0.00 0.00 61.98 61.85 2k8d s VAL 21 Cb -0.18 -0.82 0.17 0.00 0.00 0.00 0.00 36.38 35.55 2k8d s VAL 21 CO 0.16 0.28 0.56 -0.62 0.00 0.00 0.00 175.10 175.49 2k8d n GLU 22 N 3.33 -1.58 -0.99 2.72 -0.58 -1.26 -0.58 120.64 121.70 2k8d n GLU 22 Ca -0.19 -0.43 -0.30 0.00 -0.42 0.00 0.00 57.16 55.82 2k8d n GLU 22 Cb 0.54 -1.97 0.15 0.00 -0.57 0.00 0.00 31.44 29.59 2k8d n GLU 22 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2k8d s ARG 23 N -3.95 1.03 -0.21 3.49 0.52 -1.26 -4.47 118.95 114.09 2k8d s ARG 23 Ca 0.62 1.05 -0.20 0.00 -0.52 0.00 0.00 55.73 56.68 2k8d s ARG 23 Cb -0.19 -1.76 -0.03 0.00 0.52 0.00 0.00 34.95 33.49 2k8d s ARG 23 CO 0.65 -2.47 0.59 -1.50 0.02 0.00 0.00 175.30 172.59 2k8d s ILE 24 N -2.79 5.04 -0.21 1.52 2.07 -1.26 -5.01 121.20 120.55 2k8d s ILE 24 Ca 0.65 1.09 -0.04 0.00 -1.41 0.00 0.00 60.65 60.94 2k8d s ILE 24 Cb -0.20 -3.91 0.11 0.00 0.13 0.00 0.00 42.46 38.59 2k8d s ILE 24 CO 0.58 0.11 0.33 -1.83 -1.91 0.00 0.00 174.94 172.22 2k8d s GLU 25 N 1.99 0.28 0.35 3.50 -1.05 -1.26 -4.96 118.70 117.55 2k8d s GLU 25 Ca 0.26 0.55 0.06 0.00 -0.15 0.00 0.00 54.97 55.69 2k8d s GLU 25 Cb -0.16 -0.49 -0.03 0.00 -0.44 0.00 0.00 34.13 33.02 2k8d s GLU 25 CO 0.10 -0.55 0.22 -0.51 0.95 0.00 0.00 175.26 175.48 2k8d s LEU 26 N 2.49 1.79 0.00 1.83 1.43 -1.26 -5.17 118.68 119.78 2k8d s LEU 26 Ca 0.08 -1.72 -0.16 0.00 -1.03 0.00 0.00 54.13 51.31 2k8d s LEU 26 Cb -0.15 0.35 0.23 0.00 0.03 0.00 0.00 46.19 46.65 2k8d s LEU 26 CO -0.13 -1.01 0.93 -1.20 0.23 0.00 0.00 176.35 175.16 2k8d n SER 27 N -1.40 -1.40 -0.08 2.29 7.64 -1.26 -5.00 113.62 114.40 2k8d n SER 27 Ca 0.03 -1.12 -0.14 0.00 1.01 0.00 0.00 58.87 58.65 2k8d n SER 27 Cb 0.63 -0.81 -0.05 0.00 -1.01 0.00 0.00 64.21 62.97 2k8d n SER 27 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2k8d h ASP 28 N -2.15 0.72 0.00 6.43 1.82 -2.03 -3.38 116.42 117.83 2k8d h ASP 28 Ca -0.33 -0.50 0.00 0.00 -0.39 0.00 0.00 57.03 55.81 2k8d h ASP 28 Cb 1.00 -0.20 0.00 0.00 0.68 0.00 0.00 39.33 40.80 2k8d h ASP 28 CO 0.22 1.07 0.08 0.44 -1.61 0.00 0.00 179.24 179.44 2k8d h ASP 29 N 0.38 0.00 0.16 2.28 5.19 -2.04 -2.13 116.42 120.26 2k8d h ASP 29 Ca 0.03 0.00 -0.34 0.00 -0.62 0.00 0.00 57.03 56.10 2k8d h ASP 29 Cb 0.89 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.40 2k8d h ASP 29 CO 0.07 0.00 -1.76 -0.33 -3.12 0.00 0.00 179.24 174.10 2k8d h GLU 30 N 0.00 0.33 0.00 3.56 5.08 -1.98 -3.37 114.58 118.20 2k8d h GLU 30 Ca 0.00 -0.57 0.00 0.00 -1.00 0.00 0.00 59.36 57.79 2k8d h GLU 30 Cb 0.16 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2k8d h GLU 30 CO 0.00 1.27 0.00 0.91 -1.00 0.00 0.00 179.01 180.19 2k8d n TRP 31 N -3.63 0.00 -0.23 4.33 7.02 -0.80 -0.85 117.44 123.28 2k8d n TRP 31 Ca -0.27 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.21 2k8d n TRP 31 Cb 1.04 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.93 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 -0.63 1.57 0.00 -0.99 0.00 -1.26 -4.43 116.66 110.93 2k8d n ARG 32 Ca 0.01 -0.15 0.00 0.00 -0.00 0.00 0.00 57.85 57.71 2k8d n ARG 32 Cb 0.00 -0.54 0.00 0.00 -0.00 0.00 0.00 32.46 31.92 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 -0.27 3.51 -0.18 2.89 0.28 -0.20 -4.72 120.64 121.95 2k8d n GLU 33 Ca 0.00 0.00 0.07 0.00 -0.16 0.00 0.00 57.16 57.07 2k8d n GLU 33 Cb 0.06 -0.64 0.17 0.00 1.43 0.00 0.00 31.44 32.45 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 -0.58 0.90 -4.33 3.84 -5.35 -0.03 -5.02 119.36 108.79 2k8d n ILE 34 Ca 0.00 -0.95 -0.25 0.00 -0.27 0.00 0.00 62.75 61.29 2k8d n ILE 34 Cb 0.00 0.58 -0.08 0.00 -1.74 0.00 0.00 39.64 38.40 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 -1.01 3.00 0.61 7.28 1.43 -1.26 -5.00 118.68 123.73 2k8d s LEU 35 Ca 0.26 -0.98 -0.19 0.00 -1.03 0.00 0.00 54.13 52.18 2k8d s LEU 35 Cb 0.14 -1.37 -0.03 0.00 0.03 0.00 0.00 46.19 44.96 2k8d s LEU 35 CO 0.18 -0.25 1.20 0.47 0.23 0.00 0.00 176.35 178.18 2k8d n ASP 36 N -0.97 1.77 0.00 2.29 9.92 -1.26 -4.86 116.55 123.44 2k8d n ASP 36 Ca -0.04 0.85 0.04 0.00 -0.53 0.00 0.00 54.79 55.11 2k8d n ASP 36 Cb 0.62 -1.50 0.24 0.00 -0.64 0.00 0.00 41.12 39.84 2k8d n ASP 36 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2k8d n PRO 37 N -1.41 0.46 -0.11 -0.24 -0.04 -1.26 -1.66 135.00 130.75 2k8d n PRO 37 Ca 0.14 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.36 2k8d n PRO 37 Cb 0.47 -1.28 -0.11 0.00 -0.04 0.00 0.00 33.50 32.54 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 -0.78 0.59 -0.22 0.54 2.13 -1.26 -4.37 120.64 117.28 2k8d n GLU 38 Ca 0.06 0.45 -0.02 0.00 0.66 0.00 0.00 57.16 58.31 2k8d n GLU 38 Cb 0.03 -1.67 0.09 0.00 0.27 0.00 0.00 31.44 30.16 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 -0.57 0.84 -1.00 4.31 0.00 -1.67 0.35 119.26 121.53 2k8d h ALA 39 Ca -0.46 0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.52 2k8d h ALA 39 Cb 1.47 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 19.10 2k8d h ALA 39 CO -0.24 0.00 0.65 0.35 0.00 0.00 0.00 179.25 180.01 2k8d h PHE 40 N 0.63 1.22 0.10 0.00 3.57 -1.73 0.11 116.94 120.83 2k8d h PHE 40 Ca 0.29 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.67 2k8d h PHE 40 Cb 0.20 -0.40 0.01 0.00 2.79 0.00 0.00 35.95 38.54 2k8d h PHE 40 CO -0.09 0.67 -0.70 0.07 -2.23 0.00 0.00 178.31 176.04 2k8d h ARG 41 N 1.23 0.21 0.00 1.11 0.11 -1.45 -3.33 114.38 112.27 2k8d h ARG 41 Ca 0.41 -0.36 -0.00 0.00 0.10 0.00 0.00 59.98 60.13 2k8d h ARG 41 Cb 0.06 0.13 -0.00 0.00 1.11 0.00 0.00 29.97 31.28 2k8d h ARG 41 CO -0.14 1.17 -0.01 0.28 0.10 0.00 0.00 179.97 181.37 2k8d h VAL 42 N -0.54 0.45 0.00 0.08 2.07 -0.12 0.20 116.25 118.39 2k8d h VAL 42 Ca -0.13 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 2k8d h VAL 42 Cb 1.49 1.02 -0.00 0.00 -1.52 0.00 0.00 31.29 32.28 2k8d h VAL 42 CO 0.09 0.01 -0.03 0.00 0.02 0.00 0.00 177.57 177.66 2k8d h ALA 43 N 1.99 1.26 0.00 1.67 0.00 -0.89 -0.42 119.26 122.88 2k8d h ALA 43 Ca -0.00 -0.03 -0.40 0.00 0.00 0.00 0.00 54.91 54.48 2k8d h ALA 43 Cb 0.02 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.73 2k8d h ALA 43 CO 0.00 0.04 -2.48 2.89 0.00 0.00 0.00 179.25 179.70 2k8d n ARG 44 N -3.50 0.65 -0.04 0.00 1.85 0.67 -4.43 116.66 111.86 2k8d n ARG 44 Ca -0.02 0.16 0.08 0.00 -1.00 0.00 0.00 57.85 57.06 2k8d n ARG 44 Cb 0.14 -1.52 0.37 0.00 -1.05 0.00 0.00 32.46 30.40 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 -3.33 1.30 -3.92 2.89 2.85 -0.95 -4.91 118.16 112.10 2k8d n LYS 45 Ca -0.47 -0.46 -0.25 0.00 -1.05 0.00 0.00 58.31 56.08 2k8d n LYS 45 Cb 0.98 -1.27 -0.01 0.00 -0.65 0.00 0.00 35.03 34.08 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 -0.27 -1.94 -0.38 0.58 0.00 -0.35 -0.92 120.51 117.22 2k8d n ALA 46 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2k8d n ALA 46 Cb 0.16 -1.79 0.00 0.00 0.00 0.00 0.00 19.45 17.81 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 -1.86 1.10 3.07 0.00 0.00 -0.31 -4.36 105.19 102.82 2k8d n GLY 47 Ca -0.27 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.39 2k8d n GLY 47 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2k8d n THR 48 N -2.00 3.05 -2.60 2.61 -1.04 -0.09 -5.03 114.28 109.19 2k8d n THR 48 Ca 0.00 -5.15 -0.33 0.00 -2.04 0.00 0.00 64.05 56.53 2k8d n THR 48 Cb 0.00 -2.35 -0.05 0.00 -1.82 0.00 0.00 70.33 66.11 2k8d n THR 48 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2k8d s GLU 49 N -1.50 4.02 -0.15 -2.82 2.02 -1.26 -4.92 118.70 114.09 2k8d s GLU 49 Ca 0.28 1.11 -0.29 0.00 0.02 0.00 0.00 54.97 56.09 2k8d s GLU 49 Cb -0.05 -2.14 -0.03 0.00 0.10 0.00 0.00 34.13 32.00 2k8d s GLU 49 CO -0.12 -0.22 1.51 -1.25 0.02 0.00 0.00 175.26 175.20 2k8d s PRO 50 N -3.52 4.06 0.21 0.39 0.04 -1.26 -4.93 135.00 129.99 2k8d s PRO 50 Ca 0.62 1.81 0.04 0.00 0.04 0.00 0.00 61.00 63.51 2k8d s PRO 50 Cb -0.11 -3.93 0.16 0.00 0.04 0.00 0.00 34.50 30.66 2k8d s PRO 50 CO 0.21 -0.96 1.49 -1.00 0.04 0.00 0.00 177.00 176.79 2k8d h PRO 51 N 9.49 0.21 0.00 0.56 0.13 -1.95 -3.47 132.00 136.97 2k8d h PRO 51 Ca -0.33 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2k8d h PRO 51 Cb 1.14 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2k8d h PRO 51 CO 0.98 0.83 0.00 0.34 -0.23 0.00 0.00 178.00 179.92 2k8d n PHE 52 N -3.78 0.00 0.12 1.56 7.35 -1.26 -4.98 117.46 116.47 2k8d n PHE 52 Ca -0.03 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.66 2k8d n PHE 52 Cb 0.69 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.52 2k8d n PHE 52 CO 0.00 0.00 0.00 -2.37 -0.76 0.00 0.00 176.76 173.63 2k8d n THR 53 N 0.00 0.02 -3.64 -2.13 5.66 -1.26 -5.12 114.28 107.81 2k8d n THR 53 Ca 0.00 0.01 -0.14 0.00 -3.05 0.00 0.00 64.05 60.87 2k8d n THR 53 Cb 0.00 -0.52 -0.06 0.00 -1.55 0.00 0.00 70.33 68.20 2k8d n THR 53 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 2k8d s GLY 54 N -4.99 -0.33 0.07 1.09 0.00 -1.26 -5.09 107.32 96.81 2k8d s GLY 54 Ca 0.00 0.50 -0.26 0.00 0.00 0.00 0.00 44.72 44.96 2k8d s GLY 54 CO 0.00 0.23 0.78 1.25 0.00 0.00 0.00 173.10 175.36 2k8d s LYS 55 N -2.17 1.03 0.17 2.90 2.47 -1.26 -5.00 119.74 117.88 2k8d s LYS 55 Ca -0.07 -0.40 -0.04 0.00 -1.56 0.00 0.00 55.97 53.90 2k8d s LYS 55 Cb -0.01 0.46 -0.03 0.00 -1.46 0.00 0.00 37.83 36.79 2k8d s LYS 55 CO 0.00 -0.45 0.18 -0.47 0.16 0.00 0.00 175.35 174.77 2k8d s TYR 56 N -3.38 0.78 -0.32 4.03 5.04 -1.26 -5.03 117.35 117.21 2k8d s TYR 56 Ca 0.04 -1.10 0.04 0.00 -2.44 0.00 0.00 57.07 53.60 2k8d s TYR 56 Cb -0.01 -0.32 0.17 0.00 0.35 0.00 0.00 41.96 42.14 2k8d s TYR 56 CO -0.09 -0.66 0.45 -1.58 -1.34 0.00 0.00 175.55 172.33 2k8d s HIS 57 N -4.06 -1.07 0.63 4.97 5.65 -1.26 -5.13 115.29 115.02 2k8d s HIS 57 Ca 0.27 0.17 -0.04 0.00 0.25 0.00 0.00 55.06 55.71 2k8d s HIS 57 Cb 0.05 -0.09 0.04 0.00 -1.18 0.00 0.00 32.58 31.41 2k8d s HIS 57 CO 0.05 -1.02 0.91 0.16 -0.65 0.00 0.00 174.74 174.19 2k8d s ASP 58 N 2.26 5.16 0.00 9.88 -4.77 -1.26 -5.03 116.67 122.91 2k8d s ASP 58 Ca 0.12 0.38 0.00 0.00 -3.30 0.00 0.00 52.55 49.75 2k8d s ASP 58 Cb -0.11 -1.20 0.00 0.00 -1.09 0.00 0.00 42.92 40.51 2k8d s ASP 58 CO -0.21 -1.32 0.00 -0.11 0.70 0.00 0.00 175.17 174.23 2k8d n LEU 59 N -2.66 0.00 -3.85 2.11 -0.00 -1.26 -4.99 117.00 106.35 2k8d n LEU 59 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.08 2k8d n LEU 59 Cb 0.59 0.13 0.01 0.00 -0.00 0.00 0.00 43.42 44.16 2k8d n LEU 59 CO 0.50 -0.40 0.98 -2.28 -0.00 0.00 0.00 177.39 176.19 2k8d s HIS 60 N -0.80 0.01 -0.86 1.96 5.04 -1.26 -4.83 115.29 114.55 2k8d s HIS 60 Ca 0.00 -0.22 -0.04 0.00 -1.54 0.00 0.00 55.06 53.25 2k8d s HIS 60 Cb 0.00 0.60 0.12 0.00 0.04 0.00 0.00 32.58 33.35 2k8d s HIS 60 CO 0.00 -0.51 2.50 -0.25 -2.34 0.00 0.00 174.74 174.14 2k8d n ASP 61 N -0.93 7.23 -4.34 9.88 9.92 -1.26 -4.79 116.55 132.25 2k8d n ASP 61 Ca -0.02 -3.26 -0.18 0.00 -0.53 0.00 0.00 54.79 50.80 2k8d n ASP 61 Cb 0.60 -1.27 -0.10 0.00 -0.64 0.00 0.00 41.12 39.71 2k8d n ASP 61 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2k8d s ASP 62 N 0.13 2.25 0.00 -2.24 2.15 -1.26 -4.42 116.67 113.28 2k8d s ASP 62 Ca 0.55 -1.12 0.00 0.00 0.43 0.00 0.00 52.55 52.41 2k8d s ASP 62 Cb 0.30 -0.08 0.00 0.00 -0.30 0.00 0.00 42.92 42.84 2k8d s ASP 62 CO -0.18 -0.35 0.00 0.61 -0.17 0.00 0.00 175.17 175.08 2k8d n GLY 63 N -0.41 -0.91 2.90 2.66 0.00 -1.26 -4.95 105.19 103.23 2k8d n GLY 63 Ca -0.07 -1.67 -0.16 0.00 0.00 0.00 0.00 46.02 44.11 2k8d n GLY 63 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2k8d n ILE 64 N -0.95 0.00 -3.62 -0.61 -5.35 -0.19 -3.46 119.36 105.18 2k8d n ILE 64 Ca 0.00 -2.05 -0.21 0.00 -0.27 0.00 0.00 62.75 60.22 2k8d n ILE 64 Cb 0.00 1.07 -0.01 0.00 -1.74 0.00 0.00 39.64 38.95 2k8d n ILE 64 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2k8d s TYR 65 N -3.19 3.33 -0.22 4.28 1.51 -0.24 -0.86 117.35 121.96 2k8d s TYR 65 Ca 0.34 -0.00 -0.02 0.00 -1.01 0.00 0.00 57.07 56.38 2k8d s TYR 65 Cb 0.01 -1.83 0.07 0.00 -0.11 0.00 0.00 41.96 40.09 2k8d s TYR 65 CO 0.24 0.16 0.02 0.50 -1.11 0.00 0.00 175.55 175.36 2k8d s ARG 66 N -4.15 0.92 -1.04 -0.62 3.00 0.99 -1.18 118.95 116.86 2k8d s ARG 66 Ca 0.40 -0.67 -0.24 0.00 -1.00 0.00 0.00 55.73 54.22 2k8d s ARG 66 Cb -0.09 -2.23 -0.09 0.00 0.00 0.00 0.00 34.95 32.54 2k8d s ARG 66 CO 0.32 -0.68 1.99 0.00 0.00 0.00 0.00 175.30 176.92 2k8d h ILE 68 N 6.73 0.70 0.00 0.00 2.10 -1.33 -0.14 117.51 125.57 2k8d h ILE 68 Ca 0.14 -0.65 0.00 0.00 1.08 0.00 0.00 64.86 65.43 2k8d h ILE 68 Cb 0.97 1.40 0.00 0.00 -1.09 0.00 0.00 36.82 38.10 2k8d h ILE 68 CO 1.19 0.15 0.00 0.00 -1.08 0.00 0.00 178.15 178.41 2k8d n GLY 71 N 0.06 0.42 3.62 0.00 0.00 -0.18 -4.94 105.19 104.16 2k8d n GLY 71 Ca 0.00 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.51 3.59 0.38 2.61 2.01 -0.88 -4.92 115.64 116.92 2k8d s THR 72 Ca 0.00 -1.18 -0.06 0.00 0.31 0.00 0.00 61.69 60.76 2k8d s THR 72 Cb 0.00 -2.70 -0.05 0.00 0.01 0.00 0.00 72.50 69.77 2k8d s THR 72 CO 0.00 0.11 0.67 1.51 -0.69 0.00 0.00 174.62 176.22 2k8d s ASP 73 N -2.26 6.40 0.00 3.53 -4.77 -1.26 0.49 116.67 118.80 2k8d s ASP 73 Ca 0.23 0.85 0.00 0.00 -3.30 0.00 0.00 52.55 50.33 2k8d s ASP 73 Cb -0.11 -2.20 0.00 0.00 -1.09 0.00 0.00 42.92 39.51 2k8d s ASP 73 CO 0.15 -0.36 0.00 0.00 0.70 0.00 0.00 175.17 175.66 2k8d n LEU 74 N -1.48 0.00 -3.44 2.11 -0.00 -0.32 -4.68 117.00 109.19 2k8d n LEU 74 Ca -0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 56.01 55.62 2k8d n LEU 74 Cb 0.54 0.00 0.04 0.00 -0.00 0.00 0.00 43.42 44.00 2k8d n LEU 74 CO 0.49 0.00 -0.27 0.33 -0.00 0.00 0.00 177.39 177.94 2k8d n PHE 75 N 0.00 -2.57 -2.26 1.47 7.35 -1.26 -1.08 117.46 119.11 2k8d n PHE 75 Ca 0.00 1.08 -0.36 0.00 -0.76 0.00 0.00 57.45 57.41 2k8d n PHE 75 Cb 0.00 -1.71 -0.00 0.00 0.35 0.00 0.00 39.48 38.11 2k8d n PHE 75 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 2k8d s ASP 76 N -1.45 5.91 0.00 -2.13 1.11 -1.26 -2.63 116.67 116.22 2k8d s ASP 76 Ca 0.36 2.23 0.17 0.00 0.18 0.00 0.00 52.55 55.49 2k8d s ASP 76 Cb -0.04 -2.59 0.73 0.00 1.07 0.00 0.00 42.92 42.10 2k8d s ASP 76 CO 0.85 -1.09 1.52 -0.24 1.18 0.00 0.00 175.17 177.39 2k8d n SER 77 N -0.95 0.00 -0.27 0.27 2.88 -1.22 -2.77 113.62 111.56 2k8d n SER 77 Ca 0.10 0.41 -0.06 0.00 -1.33 0.00 0.00 58.87 57.99 2k8d n SER 77 Cb 0.50 -0.46 0.06 0.00 -0.75 0.00 0.00 64.21 63.56 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 1.16 0.00 -1.46 -0.00 -1.89 -2.75 114.58 109.63 2k8d h GLU 78 Ca 0.00 -0.24 0.00 0.00 -0.00 0.00 0.00 59.36 59.12 2k8d h GLU 78 Cb 0.26 -0.17 0.00 0.00 -0.00 0.00 0.00 28.75 28.84 2k8d h GLU 78 CO 0.00 0.98 -0.54 0.00 -0.00 0.00 0.00 179.01 179.45 2k8d h THR 79 N 1.12 0.00 -3.73 -1.06 1.03 -1.84 -3.46 112.91 104.96 2k8d h THR 79 Ca 0.24 -0.82 -0.43 0.00 -0.01 0.00 0.00 66.41 65.40 2k8d h THR 79 Cb 0.29 1.52 0.18 0.00 -1.07 0.00 0.00 68.15 69.07 2k8d h THR 79 CO -0.01 0.00 0.26 -0.75 -0.01 0.00 0.00 175.52 175.02 2k8d s LYS 80 N -3.25 -0.42 0.08 0.00 2.20 -1.04 -3.41 119.74 113.90 2k8d s LYS 80 Ca 0.04 -0.24 0.05 0.00 -0.36 0.00 0.00 55.97 55.46 2k8d s LYS 80 Cb 0.10 -1.71 -0.03 0.00 -1.51 0.00 0.00 37.83 34.68 2k8d s LYS 80 CO 0.72 -3.15 -0.13 -0.06 -0.36 0.00 0.00 175.35 172.37 2k8d s PHE 81 N -3.41 1.17 0.15 4.03 0.40 -1.26 -4.96 117.98 114.10 2k8d s PHE 81 Ca 0.72 -0.51 0.00 0.00 -0.60 0.00 0.00 56.93 56.54 2k8d s PHE 81 Cb -0.07 -0.65 0.00 0.00 0.51 0.00 0.00 43.02 42.81 2k8d s PHE 81 CO 0.55 0.05 0.00 -3.47 0.70 0.00 0.00 175.22 173.05 2k8d n ASP 82 N 1.04 0.24 -4.50 1.36 2.03 -1.26 -3.71 116.55 111.75 2k8d n ASP 82 Ca -0.19 0.25 -0.26 0.00 0.52 0.00 0.00 54.79 55.11 2k8d n ASP 82 Cb 0.55 0.08 0.13 0.00 -0.72 0.00 0.00 41.12 41.17 2k8d n ASP 82 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2k8d s SER 83 N -5.28 3.94 0.59 1.67 0.15 -1.26 -3.74 113.70 109.77 2k8d s SER 83 Ca 0.00 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.48 2k8d s SER 83 Cb 0.00 -0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.21 2k8d s SER 83 CO 0.00 -2.15 0.00 0.61 1.20 0.00 0.00 173.24 172.90 2k8d n GLY 84 N -3.14 0.33 0.31 9.45 0.00 -1.26 -2.27 105.19 108.62 2k8d n GLY 84 Ca 0.15 0.66 -0.17 0.00 0.00 0.00 0.00 46.02 46.66 2k8d n GLY 84 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2k8d h THR 85 N 0.00 0.45 -6.90 2.61 2.02 -1.93 -3.47 112.91 105.69 2k8d h THR 85 Ca 0.00 -0.02 -0.58 0.00 0.77 0.00 0.00 66.41 66.58 2k8d h THR 85 Cb 0.00 0.46 -0.23 0.00 -1.74 0.00 0.00 68.15 66.64 2k8d h THR 85 CO 0.00 0.00 -0.90 0.61 0.37 0.00 0.00 175.52 175.61 2k8d n GLY 86 N -1.38 -0.31 3.45 2.16 0.00 -0.96 -4.94 105.19 103.20 2k8d n GLY 86 Ca -0.12 0.13 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.67 2.39 0.00 1.61 -0.00 -1.24 -4.83 118.94 113.20 2k8d s TRP 87 Ca 0.45 -0.33 -0.03 0.00 -0.00 0.00 0.00 56.10 56.19 2k8d s TRP 87 Cb -0.26 -1.22 -0.15 0.00 -0.00 0.00 0.00 33.47 31.85 2k8d s TRP 87 CO 0.96 0.45 2.58 -0.35 -0.00 0.00 0.00 176.95 180.59 2k8d n PRO 88 N 0.47 1.36 -4.30 5.86 -0.04 -1.26 -4.51 135.00 132.58 2k8d n PRO 88 Ca -0.14 -0.55 -0.24 0.00 -0.04 0.00 0.00 63.50 62.52 2k8d n PRO 88 Cb 0.55 -1.65 -0.12 0.00 -0.04 0.00 0.00 33.50 32.23 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 2.14 2.62 0.32 3.54 1.04 -1.26 -2.92 113.70 119.18 2k8d s SER 89 Ca 0.37 -0.71 0.05 0.00 0.48 0.00 0.00 55.95 56.15 2k8d s SER 89 Cb 0.18 -0.15 -0.03 0.00 0.10 0.00 0.00 66.02 66.12 2k8d s SER 89 CO 0.00 0.06 0.30 0.72 0.98 0.00 0.00 173.24 175.31 2k8d s PHE 90 N -1.22 1.60 0.00 5.02 -0.71 0.13 -4.38 117.98 118.41 2k8d s PHE 90 Ca 0.08 -1.58 0.00 0.00 -1.04 0.00 0.00 56.93 54.38 2k8d s PHE 90 Cb -0.10 -0.59 0.00 0.00 -1.21 0.00 0.00 43.02 41.12 2k8d s PHE 90 CO 0.05 -0.90 0.12 2.48 -1.34 0.00 0.00 175.22 175.62 2k8d n TYR 91 N -0.59 0.00 -3.81 3.49 0.18 -1.22 -0.28 117.16 114.93 2k8d n TYR 91 Ca 0.06 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.75 2k8d n TYR 91 Cb 0.62 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 39.60 2k8d n TYR 91 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2k8d s ASP 92 N -0.02 -0.02 0.06 9.48 -1.08 -1.26 -4.66 116.67 119.17 2k8d s ASP 92 Ca 0.00 -1.09 0.02 0.00 -0.52 0.00 0.00 52.55 50.96 2k8d s ASP 92 Cb 0.00 0.84 -0.03 0.00 -1.46 0.00 0.00 42.92 42.27 2k8d s ASP 92 CO 0.00 -1.65 -0.07 -0.69 0.52 0.00 0.00 175.17 173.27 2k8d s VAL 93 N -2.49 0.57 0.04 1.11 1.01 -1.26 -4.85 120.40 114.53 2k8d s VAL 93 Ca 0.15 -1.36 -0.25 0.00 0.00 0.00 0.00 61.98 60.52 2k8d s VAL 93 Cb -0.05 -0.95 -0.14 0.00 0.00 0.00 0.00 36.38 35.24 2k8d s VAL 93 CO 0.11 -0.55 1.37 0.58 0.00 0.00 0.00 175.10 176.61 2k8d h VAL 94 N 4.00 0.00 -1.69 2.92 2.07 -1.99 -3.49 116.25 118.07 2k8d h VAL 94 Ca -0.35 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.38 2k8d h VAL 94 Cb 1.19 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 30.78 2k8d h VAL 94 CO 0.49 0.00 0.72 -0.55 0.02 0.00 0.00 177.57 178.25 2k8d s SER 95 N -3.32 -0.20 -0.75 0.57 0.15 -1.26 -5.04 113.70 103.85 2k8d s SER 95 Ca -0.13 0.01 -0.07 0.00 0.70 0.00 0.00 55.95 56.46 2k8d s SER 95 Cb 0.01 0.21 -0.12 0.00 -1.71 0.00 0.00 66.02 64.41 2k8d s SER 95 CO 0.39 -0.33 3.16 -0.62 1.20 0.00 0.00 173.24 177.04 2k8d n GLU 96 N -0.11 2.91 -0.04 5.44 -0.58 -1.26 -4.50 120.64 122.50 2k8d n GLU 96 Ca -0.02 -1.85 -0.04 0.00 -0.42 0.00 0.00 57.16 54.83 2k8d n GLU 96 Cb 0.59 -2.36 -0.01 0.00 -0.57 0.00 0.00 31.44 29.09 2k8d n GLU 96 CO 0.00 0.00 0.00 -2.39 -0.48 0.00 0.00 177.13 174.26 2k8d n HIS 97 N 2.57 0.00 0.10 -0.32 1.44 -1.26 -4.64 115.22 113.10 2k8d n HIS 97 Ca 0.58 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 56.35 2k8d n HIS 97 Cb 0.57 -0.24 0.12 0.00 0.12 0.00 0.00 29.99 30.56 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 -3.51 2.64 -4.31 4.39 4.05 -1.26 -4.51 115.26 112.76 2k8d n ASN 98 Ca -0.07 -1.81 -0.23 0.00 0.45 0.00 0.00 54.58 52.93 2k8d n ASN 98 Cb 0.25 -0.16 -0.12 0.00 1.23 0.00 0.00 39.78 40.98 2k8d n ASN 98 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 177.26 173.70 2k8d s ILE 99 N -1.02 1.76 -0.03 -1.44 2.07 -1.26 -0.42 121.20 120.86 2k8d s ILE 99 Ca 0.22 -1.74 0.02 0.00 -1.41 0.00 0.00 60.65 57.74 2k8d s ILE 99 Cb 0.12 -1.71 0.00 0.00 0.13 0.00 0.00 42.46 41.01 2k8d s ILE 99 CO 0.17 -0.20 -0.08 -0.75 -1.91 0.00 0.00 174.94 172.17 2k8d s LYS 100 N -2.39 0.93 0.06 3.50 2.36 0.59 -4.15 119.74 120.64 2k8d s LYS 100 Ca 0.11 -0.28 0.07 0.00 -2.55 0.00 0.00 55.97 53.33 2k8d s LYS 100 Cb -0.08 -0.87 -0.03 0.00 -1.05 0.00 0.00 37.83 35.81 2k8d s LYS 100 CO 0.05 0.09 -0.20 -0.51 1.55 0.00 0.00 175.35 176.34 2k8d s LEU 101 N 0.25 2.20 -0.16 5.43 1.02 -1.26 -1.63 118.68 124.54 2k8d s LEU 101 Ca -0.04 -0.56 -0.04 0.00 0.02 0.00 0.00 54.13 53.51 2k8d s LEU 101 Cb -0.09 -0.92 0.07 0.00 0.02 0.00 0.00 46.19 45.27 2k8d s LEU 101 CO 0.00 0.12 0.16 -0.13 0.02 0.00 0.00 176.35 176.53 2k8d s ARG 102 N -1.38 0.10 0.49 1.70 3.00 -1.21 -4.99 118.95 116.66 2k8d s ARG 102 Ca 0.07 0.22 -0.08 0.00 0.00 0.00 0.00 55.73 55.94 2k8d s ARG 102 Cb -0.09 -1.12 -0.04 0.00 0.00 0.00 0.00 34.95 33.70 2k8d s ARG 102 CO 0.02 -0.56 0.83 -1.21 0.00 0.00 0.00 175.30 174.39 2k8d s GLU 103 N 2.26 3.62 0.26 3.54 0.41 -1.26 -1.91 118.70 125.62 2k8d s GLU 103 Ca 0.04 0.38 -0.20 0.00 -0.41 0.00 0.00 54.97 54.79 2k8d s GLU 103 Cb -0.15 -2.32 0.06 0.00 -1.78 0.00 0.00 34.13 29.94 2k8d s GLU 103 CO -0.09 -0.23 0.91 0.34 -0.49 0.00 0.00 175.26 175.70 2k8d s ASP 104 N -3.85 -0.04 -0.48 -0.19 2.15 0.73 -4.95 116.67 110.04 2k8d s ASP 104 Ca 0.50 -0.81 0.03 0.00 0.43 0.00 0.00 52.55 52.70 2k8d s ASP 104 Cb -0.10 0.65 0.46 0.00 -0.30 0.00 0.00 42.92 43.63 2k8d s ASP 104 CO 0.43 -1.27 1.64 -2.11 -0.17 0.00 0.00 175.17 173.69 2k8d n ARG 105 N -0.59 3.00 0.00 4.34 -4.01 -1.26 -0.82 116.66 117.33 2k8d n ARG 105 Ca -0.05 -3.64 0.00 0.00 -1.04 0.00 0.00 57.85 53.11 2k8d n ARG 105 Cb 0.60 -2.25 0.00 0.00 -3.04 0.00 0.00 32.46 27.77 2k8d n ARG 105 CO 0.00 0.00 0.00 0.43 -3.04 0.00 0.00 177.63 175.02 2k8d n SER 106 N -0.85 0.56 0.00 2.89 7.64 -1.26 -0.51 113.62 122.09 2k8d n SER 106 Ca 0.53 -1.30 0.00 0.00 1.01 0.00 0.00 58.87 59.11 2k8d n SER 106 Cb 0.84 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 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 0.08 0.51 0.00 -3.43 -0.00 -1.26 -4.92 117.00 107.98 2k8d n LEU 107 Ca 0.00 -0.51 0.00 0.00 -0.00 0.00 0.00 56.01 55.50 2k8d n LEU 107 Cb 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.56 2k8d n LEU 107 CO 0.00 0.13 0.00 0.61 -0.00 0.00 0.00 177.39 178.13 2k8d n GLY 108 N -0.02 0.65 0.00 1.47 0.00 0.34 -4.97 105.19 102.65 2k8d n GLY 108 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2k8d n GLY 108 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2k8d n MET 109 N -2.03 0.00 -3.69 1.61 2.81 -1.26 -5.04 117.12 109.51 2k8d n MET 109 Ca 0.00 0.00 -0.25 0.00 -1.81 0.00 0.00 57.70 55.64 2k8d n MET 109 Cb 0.00 0.00 -0.17 0.00 -0.71 0.00 0.00 33.22 32.34 2k8d n MET 109 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2k8d s VAL 110 N 0.57 0.21 0.14 2.03 1.01 -1.26 -4.31 120.40 118.79 2k8d s VAL 110 Ca 0.00 -0.16 0.11 0.00 0.00 0.00 0.00 61.98 61.93 2k8d s VAL 110 Cb 0.00 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 2k8d s VAL 110 CO 0.00 -0.08 -0.25 -0.60 0.00 0.00 0.00 175.10 174.17 2k8d s ARG 111 N 2.01 1.39 -0.26 2.72 3.52 0.00 -2.15 118.95 126.20 2k8d s ARG 111 Ca 0.02 -1.37 -0.11 0.00 -0.13 0.00 0.00 55.73 54.14 2k8d s ARG 111 Cb -0.15 -1.81 0.10 0.00 -1.56 0.00 0.00 34.95 31.53 2k8d s ARG 111 CO -0.07 0.42 0.58 0.00 -0.81 0.00 0.00 175.30 175.42 2k8d s GLU 113 N 2.41 2.37 -0.22 0.00 -1.05 -0.80 -0.04 118.70 121.38 2k8d s GLU 113 Ca -0.06 1.65 -0.03 0.00 -0.15 0.00 0.00 54.97 56.38 2k8d s GLU 113 Cb -0.10 -1.87 0.07 0.00 -0.44 0.00 0.00 34.13 31.78 2k8d s GLU 113 CO -0.17 -1.63 0.05 0.08 0.95 0.00 0.00 175.26 174.53 2k8d s VAL 114 N -2.08 0.55 0.34 1.83 1.01 0.02 -3.31 120.40 118.77 2k8d s VAL 114 Ca 0.72 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 62.03 2k8d s VAL 114 Cb -0.26 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.93 2k8d s VAL 114 CO 0.43 -0.31 0.08 -0.76 0.00 0.00 0.00 175.10 174.55 2k8d s LEU 115 N 1.83 2.05 0.54 3.92 1.02 -0.64 -1.62 118.68 125.77 2k8d s LEU 115 Ca 0.01 -1.47 -0.21 0.00 0.02 0.00 0.00 54.13 52.49 2k8d s LEU 115 Cb -0.17 -0.25 -0.05 0.00 0.02 0.00 0.00 46.19 45.74 2k8d s LEU 115 CO -0.12 -0.72 1.21 0.00 0.02 0.00 0.00 176.35 176.73 2k8d h ALA 117 N 1.37 1.67 -3.00 0.00 0.00 -0.90 -3.38 119.26 115.03 2k8d h ALA 117 Ca -0.50 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2k8d h ALA 117 Cb 1.28 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2k8d h ALA 117 CO 0.57 0.27 0.00 -2.13 0.00 0.00 0.00 179.25 177.96 2k8d n ARG 118 N -4.43 0.00 0.00 0.00 3.00 -1.26 -4.91 116.66 109.06 2k8d n ARG 118 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.87 2k8d n ARG 118 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.57 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 0.78 0.00 -4.72 0.00 8.00 -1.26 -4.92 116.55 114.42 2k8d n ASP 120 Ca 0.00 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.20 2k8d n ASP 120 Cb 0.10 -0.43 0.13 0.00 -0.02 0.00 0.00 41.12 40.91 2k8d n ASP 120 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k8d s ALA 121 N -0.26 1.64 0.16 2.24 0.00 -1.26 -4.87 121.76 119.40 2k8d s ALA 121 Ca 0.00 -0.01 -0.25 0.00 0.00 0.00 0.00 51.96 51.70 2k8d s ALA 121 Cb 0.00 -3.20 0.01 0.00 0.00 0.00 0.00 23.12 19.92 2k8d s ALA 121 CO 0.00 -2.28 1.40 1.58 0.00 0.00 0.00 175.76 176.46 2k8d n HIS 122 N -3.84 -0.29 0.00 0.00 -0.00 -1.26 -4.46 115.22 105.37 2k8d n HIS 122 Ca 0.07 1.13 0.00 0.00 0.46 0.00 0.00 57.72 59.38 2k8d n HIS 122 Cb 0.55 -0.64 0.00 0.00 -0.12 0.00 0.00 29.99 29.78 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 -5.18 0.00 0.00 0.27 4.77 -1.16 -4.82 117.00 110.88 2k8d n LEU 123 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2k8d n LEU 123 Cb 0.27 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 2k8d n LEU 123 CO -0.14 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.53 2k8d n GLY 124 N 0.00 0.04 3.69 -0.72 0.00 -0.64 -0.39 105.19 107.17 2k8d n GLY 124 Ca 0.00 0.47 -0.09 0.00 0.00 0.00 0.00 46.02 46.41 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 2.52 -0.32 0.01 1.61 -3.43 -0.55 -0.80 115.29 114.33 2k8d s HIS 125 Ca 0.00 -0.04 0.06 0.00 -0.80 0.00 0.00 55.06 54.27 2k8d s HIS 125 Cb 0.00 0.65 -0.03 0.00 -1.43 0.00 0.00 32.58 31.77 2k8d s HIS 125 CO 0.00 -1.08 -0.16 0.54 -2.00 0.00 0.00 174.74 172.03 2k8d s VAL 126 N -3.84 2.89 0.07 -5.38 0.11 0.95 -1.09 120.40 114.12 2k8d s VAL 126 Ca 0.07 -1.01 -0.06 0.00 -2.93 0.00 0.00 61.98 58.05 2k8d s VAL 126 Cb -0.04 -2.19 -0.01 0.00 -1.53 0.00 0.00 36.38 32.61 2k8d s VAL 126 CO -0.01 0.43 0.12 0.72 -3.33 0.00 0.00 175.10 173.04 2k8d s PHE 127 N -0.86 0.25 -0.94 1.54 -0.71 0.13 -0.70 117.98 116.70 2k8d s PHE 127 Ca 0.14 -0.69 -0.24 0.00 -1.04 0.00 0.00 56.93 55.10 2k8d s PHE 127 Cb -0.11 -0.15 -0.16 0.00 -1.21 0.00 0.00 43.02 41.39 2k8d s PHE 127 CO 0.04 -0.48 1.92 -3.47 -1.34 0.00 0.00 175.22 171.89 2k8d n ASP 128 N 0.10 2.50 -0.54 1.98 2.03 -0.91 0.06 116.55 121.76 2k8d n ASP 128 Ca -0.15 -2.65 -0.00 0.00 0.52 0.00 0.00 54.79 52.50 2k8d n ASP 128 Cb 0.61 -1.43 -0.00 0.00 -0.72 0.00 0.00 41.12 39.58 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 12.51 -0.05 -4.89 1.67 2.03 -1.15 -4.96 116.55 121.72 2k8d n ASP 129 Ca 0.46 -1.20 -0.21 0.00 0.52 0.00 0.00 54.79 54.36 2k8d n ASP 129 Cb 0.44 -0.01 -0.02 0.00 -0.72 0.00 0.00 41.12 40.81 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 -0.21 2.14 0.60 0.27 0.00 -0.02 -4.58 107.32 105.53 2k8d s GLY 130 Ca 0.00 -1.83 -0.17 0.00 0.00 0.00 0.00 44.72 42.73 2k8d s GLY 130 CO -0.00 -1.72 1.11 2.56 0.00 0.00 0.00 173.10 175.05 2k8d s PRO 131 N -4.18 3.08 0.66 2.90 0.04 -1.26 -4.18 135.00 132.06 2k8d s PRO 131 Ca 0.47 1.48 -0.17 0.00 0.04 0.00 0.00 61.00 62.82 2k8d s PRO 131 Cb -0.03 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2k8d s PRO 131 CO 0.28 -1.04 1.22 -0.98 0.04 0.00 0.00 177.00 176.51 2k8d s ARG 132 N -3.73 2.54 0.09 4.56 1.70 -1.26 -0.35 118.95 122.49 2k8d s ARG 132 Ca 0.69 1.83 -0.14 0.00 -0.47 0.00 0.00 55.73 57.64 2k8d s ARG 132 Cb -0.22 -1.87 -0.15 0.00 -0.57 0.00 0.00 34.95 32.14 2k8d s ARG 132 CO 0.35 -1.55 1.31 -1.00 -1.08 0.00 0.00 175.30 173.33 2k8d h PRO 133 N 0.29 0.73 -0.01 3.89 0.13 -1.96 -3.44 132.00 131.63 2k8d h PRO 133 Ca -0.49 -0.55 -0.08 0.00 -0.87 0.00 0.00 66.00 64.00 2k8d h PRO 133 Cb 1.30 0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.52 2k8d h PRO 133 CO 0.52 1.17 -0.40 1.79 -0.23 0.00 0.00 178.00 180.86 2k8d h THR 134 N 0.43 1.29 0.00 1.56 1.35 -1.83 -3.46 112.91 112.25 2k8d h THR 134 Ca -0.03 -1.37 0.00 0.00 -0.55 0.00 0.00 66.41 64.46 2k8d h THR 134 Cb 1.25 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 69.40 2k8d h THR 134 CO 0.13 0.39 0.00 0.61 -0.25 0.00 0.00 175.52 176.40 2k8d n GLY 135 N -0.39 0.91 3.37 5.82 0.00 0.52 -4.97 105.19 110.45 2k8d n GLY 135 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 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 1.54 -0.24 1.61 -2.85 -1.26 -0.84 119.74 117.42 2k8d s LYS 136 Ca 0.00 -1.25 0.02 0.00 -1.00 0.00 0.00 55.97 53.74 2k8d s LYS 136 Cb 0.00 -1.90 0.06 0.00 -2.06 0.00 0.00 37.83 33.92 2k8d s LYS 136 CO 0.00 0.47 -0.08 0.50 0.10 0.00 0.00 175.35 176.34 2k8d s ARG 137 N -1.73 1.89 0.09 1.78 3.52 0.11 -4.12 118.95 120.49 2k8d s ARG 137 Ca 0.13 -1.11 -0.23 0.00 -0.13 0.00 0.00 55.73 54.38 2k8d s ARG 137 Cb -0.10 -2.69 -0.07 0.00 -1.56 0.00 0.00 34.95 30.53 2k8d s ARG 137 CO 0.04 -0.57 0.70 0.71 -0.81 0.00 0.00 175.30 175.38 2k8d s TYR 138 N 1.28 3.81 -0.00 5.12 1.51 0.62 -0.69 117.35 129.00 2k8d s TYR 138 Ca -0.07 1.46 -0.00 0.00 -1.01 0.00 0.00 57.07 57.45 2k8d s TYR 138 Cb -0.19 -2.70 0.00 0.00 -0.11 0.00 0.00 41.96 38.96 2k8d s TYR 138 CO -0.06 0.45 0.01 0.00 -1.11 0.00 0.00 175.55 174.84 2k8d s MET 140 N 0.15 0.61 -0.15 0.00 0.23 -1.15 -1.48 119.30 117.51 2k8d s MET 140 Ca -0.01 -0.56 -0.07 0.00 -1.03 0.00 0.00 55.69 54.02 2k8d s MET 140 Cb -0.02 0.25 0.06 0.00 -1.53 0.00 0.00 34.83 33.59 2k8d s MET 140 CO -0.00 -0.16 0.34 1.21 -2.03 0.00 0.00 175.02 174.38 2k8d s ASN 141 N -1.83 -0.29 0.19 -1.18 2.47 0.48 -4.86 114.94 109.91 2k8d s ASN 141 Ca -0.09 0.75 -0.23 0.00 0.42 0.00 0.00 52.86 53.72 2k8d s ASN 141 Cb -0.03 0.72 0.07 0.00 -1.45 0.00 0.00 41.25 40.56 2k8d s ASN 141 CO -0.02 -0.20 0.98 -0.94 -3.72 0.00 0.00 177.10 173.21 2k8d s SER 142 N 1.65 -0.07 0.26 -4.21 1.04 -1.26 -2.98 113.70 108.13 2k8d s SER 142 Ca -0.07 -0.61 0.17 0.00 0.48 0.00 0.00 55.95 55.91 2k8d s SER 142 Cb -0.10 0.53 0.91 0.00 0.10 0.00 0.00 66.02 67.46 2k8d s SER 142 CO -0.11 -1.03 1.50 0.00 0.98 0.00 0.00 173.24 174.58 2k8d n ALA 143 N -0.59 0.99 0.58 5.32 0.00 -1.26 -2.81 120.51 122.74 2k8d n ALA 143 Ca -0.05 0.16 0.11 0.00 0.00 0.00 0.00 53.44 53.65 2k8d n ALA 143 Cb 0.60 -1.20 0.43 0.00 0.00 0.00 0.00 19.45 19.29 2k8d n ALA 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k8d n ALA 144 N -1.70 1.88 -2.75 0.00 0.00 -1.26 -4.61 120.51 112.06 2k8d n ALA 144 Ca -0.01 -0.02 -0.43 0.00 0.00 0.00 0.00 53.44 52.98 2k8d n ALA 144 Cb 0.06 -1.36 -0.01 0.00 0.00 0.00 0.00 19.45 18.15 2k8d n ALA 144 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k8d s LEU 145 N -3.64 4.37 -0.17 0.00 1.43 -1.12 -1.08 118.68 118.47 2k8d s LEU 145 Ca 0.08 -2.53 -0.18 0.00 -1.03 0.00 0.00 54.13 50.48 2k8d s LEU 145 Cb 0.12 -2.49 -0.04 0.00 0.03 0.00 0.00 46.19 43.80 2k8d s LEU 145 CO 0.40 -1.03 0.47 -0.54 0.23 0.00 0.00 176.35 175.88 2k8d s LYS 146 N 3.15 4.24 0.41 1.70 1.02 -0.71 -5.00 119.74 124.56 2k8d s LYS 146 Ca 0.47 0.37 -0.23 0.00 0.02 0.00 0.00 55.97 56.60 2k8d s LYS 146 Cb 0.00 -3.51 -0.09 0.00 -0.52 0.00 0.00 37.83 33.72 2k8d s LYS 146 CO 0.02 -0.00 1.04 -0.06 -0.92 0.00 0.00 175.35 175.42 2k8d s PHE 147 N 1.16 3.25 0.15 3.18 0.08 -1.26 -0.01 117.98 124.54 2k8d s PHE 147 Ca 0.23 1.64 -0.06 0.00 0.12 0.00 0.00 56.93 58.86 2k8d s PHE 147 Cb -0.15 -3.09 -0.02 0.00 -0.57 0.00 0.00 43.02 39.19 2k8d s PHE 147 CO 0.09 -0.58 0.21 0.96 -0.10 0.00 0.00 175.22 175.79 2k8d s ILE 148 N -1.73 0.08 1.35 0.64 -4.36 -0.04 -4.82 121.20 112.31 2k8d s ILE 148 Ca 0.59 -1.58 -0.19 0.00 -0.26 0.00 0.00 60.65 59.22 2k8d s ILE 148 Cb -0.20 -1.92 0.35 0.00 1.25 0.00 0.00 42.46 41.93 2k8d s ILE 148 CO 0.25 -0.35 0.95 -2.16 0.24 0.00 0.00 174.94 173.87 2k8d s PRO 149 N -4.00 -2.35 0.59 0.37 0.04 -1.26 -1.03 135.00 127.36 2k8d s PRO 149 Ca 0.20 0.46 0.29 0.00 0.04 0.00 0.00 61.00 61.98 2k8d s PRO 149 Cb 0.05 -1.42 1.58 0.00 0.04 0.00 0.00 34.50 34.75 2k8d s PRO 149 CO 0.01 -4.57 2.02 0.00 0.04 0.00 0.00 177.00 174.50 2k8d h ARG 150 N -3.21 0.00 0.00 4.56 3.08 -1.90 -3.31 114.38 113.59 2k8d h ARG 150 Ca -0.52 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.53 2k8d h ARG 150 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.39 2k8d h ARG 150 CO 0.37 0.00 0.00 -0.40 -1.07 0.00 0.00 179.97 178.87 2k8d n ASP 151 N -3.77 -2.58 0.00 7.04 5.75 -1.26 -4.72 116.55 117.01 2k8d n ASP 151 Ca 0.04 0.68 0.00 0.00 -0.01 0.00 0.00 54.79 55.50 2k8d n ASP 151 Cb 0.46 2.57 0.00 0.00 -1.03 0.00 0.00 41.12 43.11 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 -3.15 0.00 0.28 0.11 1.13 -1.26 -4.83 117.38 109.66 2k8d n GLN 152 Ca 0.00 0.00 0.19 0.00 -1.94 0.00 0.00 57.00 55.25 2k8d n GLN 152 Cb 0.00 -0.16 0.96 0.00 0.11 0.00 0.00 30.24 31.15 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 0.96 0.00 0.00 5.09 -0.00 -1.93 -3.52 117.51 118.11 2k8d h ILE 153 Ca 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 64.86 64.77 2k8d h ILE 153 Cb 0.48 0.96 0.00 0.00 -0.00 0.00 0.00 36.82 38.26 2k8d h ILE 153 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 178.15 178.76