#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 1.77 0.00 2.12 4.76 -1.26 -4.86 118.16 120.70 2k8d n LYS 5 Ca 0.00 -1.42 0.00 0.00 -2.87 0.00 0.00 58.31 54.02 2k8d n LYS 5 Cb 0.00 -2.48 0.00 0.00 -1.84 0.00 0.00 35.03 30.71 2k8d n LYS 5 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2k8d n ASP 6 N 4.83 -0.04 -4.78 4.39 8.00 -1.26 -4.53 116.55 123.16 2k8d n ASP 6 Ca 0.41 -0.20 -0.22 0.00 0.71 0.00 0.00 54.79 55.49 2k8d n ASP 6 Cb 0.16 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.21 2k8d n ASP 6 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2k8d s ARG 7 N -0.65 2.76 -0.24 -1.24 1.81 -1.26 -0.75 118.95 119.37 2k8d s ARG 7 Ca 0.00 -1.16 0.00 0.00 -1.72 0.00 0.00 55.73 52.86 2k8d s ARG 7 Cb 0.00 -2.46 0.06 0.00 -0.45 0.00 0.00 34.95 32.11 2k8d s ARG 7 CO 0.00 0.38 -0.04 0.96 -0.68 0.00 0.00 175.30 175.93 2k8d s ILE 8 N -2.19 1.44 -0.62 1.52 -4.36 0.83 -4.80 121.20 113.02 2k8d s ILE 8 Ca 0.33 -1.21 -0.27 0.00 -0.26 0.00 0.00 60.65 59.24 2k8d s ILE 8 Cb -0.07 -1.76 -0.00 0.00 1.25 0.00 0.00 42.46 41.88 2k8d s ILE 8 CO 0.24 -0.15 1.63 -2.16 0.24 0.00 0.00 174.94 174.73 2k8d s PRO 9 N 1.43 2.93 0.50 0.37 0.04 -1.26 -1.20 135.00 137.80 2k8d s PRO 9 Ca -0.04 0.40 -0.19 0.00 0.04 0.00 0.00 61.00 61.21 2k8d s PRO 9 Cb -0.19 -4.28 -0.08 0.00 0.04 0.00 0.00 34.50 30.00 2k8d s PRO 9 CO -0.07 -2.40 1.01 0.42 0.04 0.00 0.00 177.00 176.01 2k8d s ILE 10 N 7.56 4.05 -0.28 0.56 1.01 -0.07 -4.45 121.20 129.58 2k8d s ILE 10 Ca 0.57 1.16 -0.03 0.00 0.00 0.00 0.00 60.65 62.35 2k8d s ILE 10 Cb -0.12 -3.51 0.09 0.00 0.01 0.00 0.00 42.46 38.93 2k8d s ILE 10 CO 0.21 -0.39 0.11 -0.36 0.00 0.00 0.00 174.94 174.51 2k8d s PHE 11 N -2.23 0.65 -0.82 3.97 0.40 -1.26 -0.49 117.98 118.20 2k8d s PHE 11 Ca 0.64 -1.00 -0.24 0.00 -0.60 0.00 0.00 56.93 55.73 2k8d s PHE 11 Cb -0.14 -1.06 -0.17 0.00 0.51 0.00 0.00 43.02 42.17 2k8d s PHE 11 CO 0.24 -0.79 1.90 0.43 0.70 0.00 0.00 175.22 177.69 2k8d n SER 12 N 5.15 2.44 0.18 1.36 7.64 -1.16 -4.72 113.62 124.51 2k8d n SER 12 Ca -0.05 -2.65 0.09 0.00 1.01 0.00 0.00 58.87 57.26 2k8d n SER 12 Cb 0.43 -1.27 0.60 0.00 -1.01 0.00 0.00 64.21 62.97 2k8d n SER 12 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 2k8d h VAL 13 N 5.20 0.99 -0.99 0.44 3.04 -1.88 -0.06 116.25 122.98 2k8d h VAL 13 Ca 0.31 -0.04 0.29 0.00 -1.01 0.00 0.00 66.70 66.26 2k8d h VAL 13 Cb 0.78 0.87 -0.04 0.00 -2.01 0.00 0.00 31.29 30.89 2k8d h VAL 13 CO 1.69 0.02 0.85 0.00 -1.01 0.00 0.00 177.57 179.12 2k8d h ALA 14 N 1.92 2.86 0.00 3.17 0.00 -1.87 0.32 119.26 125.66 2k8d h ALA 14 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2k8d h ALA 14 Cb 0.11 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2k8d h ALA 14 CO -0.01 -1.36 -0.15 1.63 0.00 0.00 0.00 179.25 179.36 2k8d n LYS 15 N -3.85 0.94 -3.72 0.00 5.02 -0.27 -5.02 118.16 111.26 2k8d n LYS 15 Ca 0.21 -1.40 -0.22 0.00 -2.02 0.00 0.00 58.31 54.89 2k8d n LYS 15 Cb 1.18 -0.86 -0.05 0.00 -0.02 0.00 0.00 35.03 35.28 2k8d n LYS 15 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2k8d n ASN 16 N -0.48 -0.11 -4.93 4.39 5.15 0.10 -5.00 115.26 114.39 2k8d n ASN 16 Ca 0.04 -0.81 -0.26 0.00 -0.60 0.00 0.00 54.58 52.95 2k8d n ASN 16 Cb 0.55 -1.00 0.05 0.00 -0.53 0.00 0.00 39.78 38.84 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 -5.95 2.59 -0.06 1.20 0.52 -0.20 -4.94 118.95 112.11 2k8d s ARG 17 Ca 0.07 -0.20 -0.03 0.00 -0.52 0.00 0.00 55.73 55.05 2k8d s ARG 17 Cb -0.04 -2.26 0.03 0.00 0.52 0.00 0.00 34.95 33.20 2k8d s ARG 17 CO 0.63 -0.91 0.13 0.08 0.02 0.00 0.00 175.30 175.25 2k8d s VAL 18 N -3.06 -0.04 -0.27 3.52 1.01 -1.26 -3.01 120.40 117.29 2k8d s VAL 18 Ca 0.57 0.13 -0.02 0.00 0.00 0.00 0.00 61.98 62.66 2k8d s VAL 18 Cb -0.11 -0.21 0.12 0.00 0.00 0.00 0.00 36.38 36.18 2k8d s VAL 18 CO 0.44 0.05 0.25 -1.83 0.00 0.00 0.00 175.10 174.02 2k8d s GLU 19 N 0.86 0.27 -0.26 2.72 1.03 0.35 -4.98 118.70 118.70 2k8d s GLU 19 Ca -0.07 -0.13 -0.26 0.00 0.03 0.00 0.00 54.97 54.54 2k8d s GLU 19 Cb -0.09 -0.85 0.00 0.00 -0.80 0.00 0.00 34.13 32.40 2k8d s GLU 19 CO -0.04 -0.95 0.93 1.41 -1.33 0.00 0.00 175.26 175.28 2k8d s MET 20 N 2.31 4.16 0.43 -4.83 1.75 -1.26 -0.89 119.30 120.97 2k8d s MET 20 Ca 0.09 1.04 0.02 0.00 -1.25 0.00 0.00 55.69 55.59 2k8d s MET 20 Cb -0.15 -3.67 0.02 0.00 2.84 0.00 0.00 34.83 33.88 2k8d s MET 20 CO -0.29 -0.64 0.20 0.28 -0.65 0.00 0.00 175.02 173.92 2k8d n VAL 21 N 5.42 0.00 -4.27 10.11 0.31 -0.34 -4.94 118.33 124.61 2k8d n VAL 21 Ca 0.08 -1.82 -0.23 0.00 -0.01 0.00 0.00 64.34 62.36 2k8d n VAL 21 Cb 0.47 0.08 -0.07 0.00 -0.91 0.00 0.00 33.84 33.41 2k8d n VAL 21 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2k8d s GLU 22 N -3.68 2.30 0.78 5.55 1.03 -1.26 -0.12 118.70 123.29 2k8d s GLU 22 Ca 0.15 -1.45 -0.15 0.00 0.03 0.00 0.00 54.97 53.56 2k8d s GLU 22 Cb -0.01 -2.15 0.03 0.00 -0.80 0.00 0.00 34.13 31.20 2k8d s GLU 22 CO 0.10 0.32 0.95 0.54 -1.33 0.00 0.00 175.26 175.84 2k8d n ARG 23 N -0.93 0.29 -2.33 -4.83 5.12 0.07 -4.74 116.66 109.31 2k8d n ARG 23 Ca -0.06 0.16 -0.42 0.00 -1.93 0.00 0.00 57.85 55.60 2k8d n ARG 23 Cb 0.59 -2.22 -0.03 0.00 -1.16 0.00 0.00 32.46 29.64 2k8d n ARG 23 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 2k8d s ILE 24 N -1.99 3.99 -0.18 0.55 -1.16 -1.26 -4.97 121.20 116.18 2k8d s ILE 24 Ca 0.71 1.32 -0.04 0.00 -0.51 0.00 0.00 60.65 62.12 2k8d s ILE 24 Cb -0.31 -3.85 0.09 0.00 0.61 0.00 0.00 42.46 39.00 2k8d s ILE 24 CO 0.53 -0.03 0.30 -0.70 -2.81 0.00 0.00 174.94 172.23 2k8d s GLU 25 N 2.59 0.22 0.28 3.50 2.12 -1.26 -5.07 118.70 121.08 2k8d s GLU 25 Ca 0.60 0.62 0.06 0.00 0.36 0.00 0.00 54.97 56.61 2k8d s GLU 25 Cb -0.28 -0.34 -0.02 0.00 0.26 0.00 0.00 34.13 33.75 2k8d s GLU 25 CO 0.23 -0.44 0.21 1.28 -0.54 0.00 0.00 175.26 176.00 2k8d n LEU 26 N 5.35 0.00 0.00 2.70 4.77 -1.26 -5.11 117.00 123.45 2k8d n LEU 26 Ca -0.06 -2.54 0.00 0.00 -0.03 0.00 0.00 56.01 53.38 2k8d n LEU 26 Cb 0.50 1.26 0.00 0.00 -2.33 0.00 0.00 43.42 42.84 2k8d n LEU 26 CO 0.04 -0.42 0.00 -1.20 -1.33 0.00 0.00 177.39 174.48 2k8d n SER 27 N -1.89 0.00 -1.24 -1.43 7.64 -1.26 -5.12 113.62 110.32 2k8d n SER 27 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.92 2k8d n SER 27 Cb 0.49 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 2k8d n SER 27 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2k8d n ASP 28 N -0.14 0.00 0.00 6.43 -0.08 -1.26 -4.88 116.55 116.62 2k8d n ASP 28 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2k8d n ASP 28 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2k8d n ASP 28 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 2k8d n ASP 29 N 0.00 0.00 -0.16 1.67 2.03 -1.26 -4.18 116.55 114.65 2k8d n ASP 29 Ca 0.00 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.24 2k8d n ASP 29 Cb 0.00 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.41 2k8d n ASP 29 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2k8d h GLU 30 N 0.00 0.64 -2.14 -0.67 5.08 -1.99 -2.70 114.58 112.81 2k8d h GLU 30 Ca 0.00 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2k8d h GLU 30 Cb 0.00 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2k8d h GLU 30 CO 0.00 0.45 0.03 0.91 -1.00 0.00 0.00 179.01 179.40 2k8d n TRP 31 N -4.73 0.00 0.00 4.33 7.02 -1.26 -1.12 117.44 121.68 2k8d n TRP 31 Ca 0.02 -0.48 0.00 0.00 -1.02 0.00 0.00 57.50 56.02 2k8d n TRP 31 Cb 0.04 -0.49 0.00 0.00 -2.42 0.00 0.00 31.31 28.43 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 2.02 0.00 0.04 -0.99 0.00 -1.02 -4.27 116.66 112.44 2k8d n ARG 32 Ca 0.04 0.00 0.02 0.00 -0.00 0.00 0.00 57.85 57.92 2k8d n ARG 32 Cb 0.26 -0.10 -0.08 0.00 -0.00 0.00 0.00 32.46 32.54 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 -0.90 0.62 -0.41 2.89 0.28 -0.80 -4.15 120.64 118.17 2k8d n GLU 33 Ca 0.00 0.17 0.08 0.00 -0.16 0.00 0.00 57.16 57.25 2k8d n GLU 33 Cb 0.00 -1.78 0.25 0.00 1.43 0.00 0.00 31.44 31.33 2k8d n GLU 33 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 177.13 177.41 2k8d n ILE 34 N -2.81 1.78 -4.26 3.84 -5.35 -0.27 -5.02 119.36 107.26 2k8d n ILE 34 Ca -0.09 -1.43 -0.17 0.00 -0.27 0.00 0.00 62.75 60.80 2k8d n ILE 34 Cb 0.79 0.08 -0.09 0.00 -1.74 0.00 0.00 39.64 38.68 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 -2.01 1.55 0.28 7.28 1.43 -1.26 -5.00 118.68 120.95 2k8d s LEU 35 Ca 0.38 -1.63 -0.30 0.00 -1.03 0.00 0.00 54.13 51.55 2k8d s LEU 35 Cb 0.27 0.48 -0.11 0.00 0.03 0.00 0.00 46.19 46.86 2k8d s LEU 35 CO 0.15 -0.98 1.55 -1.81 0.23 0.00 0.00 176.35 175.48 2k8d s ASP 36 N -3.30 6.45 0.14 2.29 1.11 -1.26 -4.83 116.67 117.27 2k8d s ASP 36 Ca 0.40 2.87 0.16 0.00 0.18 0.00 0.00 52.55 56.16 2k8d s ASP 36 Cb 0.04 -2.63 0.73 0.00 1.07 0.00 0.00 42.92 42.12 2k8d s ASP 36 CO 0.22 -0.85 1.50 -0.81 1.18 0.00 0.00 175.17 176.40 2k8d n PRO 37 N 2.21 0.09 0.02 8.23 -0.04 -1.26 -1.31 135.00 142.95 2k8d n PRO 37 Ca 0.08 0.42 -0.19 0.00 -0.04 0.00 0.00 63.50 63.77 2k8d n PRO 37 Cb 0.38 -1.71 -0.11 0.00 -0.04 0.00 0.00 33.50 32.02 2k8d n PRO 37 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2k8d h GLU 38 N 0.00 0.48 -0.34 0.54 4.81 -1.96 -3.19 114.58 114.91 2k8d h GLU 38 Ca 0.00 -0.55 0.04 0.00 -0.13 0.00 0.00 59.36 58.72 2k8d h GLU 38 Cb 0.20 0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.70 2k8d h GLU 38 CO 0.00 1.19 0.13 0.00 -0.73 0.00 0.00 179.01 179.60 2k8d h ALA 39 N 0.31 0.40 -0.50 2.92 0.00 -1.47 0.29 119.26 121.22 2k8d h ALA 39 Ca -0.10 0.03 0.10 0.00 0.00 0.00 0.00 54.91 54.94 2k8d h ALA 39 Cb 1.48 -0.00 -0.10 0.00 0.00 0.00 0.00 17.79 19.17 2k8d h ALA 39 CO 0.15 -0.26 -0.25 0.35 0.00 0.00 0.00 179.25 179.25 2k8d h PHE 40 N 0.29 -0.64 0.00 0.00 3.57 -1.60 0.16 116.94 118.72 2k8d h PHE 40 Ca 0.15 0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.65 2k8d h PHE 40 Cb 0.11 0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.21 2k8d h PHE 40 CO -0.13 -0.32 -0.22 0.07 -2.23 0.00 0.00 178.31 175.48 2k8d h ARG 41 N -0.13 0.14 -0.13 1.11 0.11 -1.39 -3.27 114.38 110.82 2k8d h ARG 41 Ca 0.23 -0.16 0.04 0.00 0.10 0.00 0.00 59.98 60.19 2k8d h ARG 41 Cb 0.49 0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.61 2k8d h ARG 41 CO -0.58 0.91 0.12 0.28 0.10 0.00 0.00 179.97 180.80 2k8d h VAL 42 N -0.56 0.65 0.00 0.08 2.07 -0.17 0.23 116.25 118.54 2k8d h VAL 42 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2k8d h VAL 42 Cb 0.99 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 2k8d h VAL 42 CO 0.04 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.63 2k8d n ALA 43 N -2.42 1.25 -0.02 1.67 0.00 0.54 -0.88 120.51 120.65 2k8d n ALA 43 Ca 0.00 0.10 -0.01 0.00 0.00 0.00 0.00 53.44 53.53 2k8d n ALA 43 Cb 0.23 -1.25 -0.06 0.00 0.00 0.00 0.00 19.45 18.37 2k8d n ALA 43 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2k8d n ARG 44 N -1.98 1.76 -0.25 0.00 1.85 0.77 -4.69 116.66 114.12 2k8d n ARG 44 Ca 0.00 -0.03 0.06 0.00 -1.00 0.00 0.00 57.85 56.89 2k8d n ARG 44 Cb 0.09 -1.20 0.18 0.00 -1.05 0.00 0.00 32.46 30.48 2k8d n ARG 44 CO 0.00 0.00 0.00 0.36 -0.01 0.00 0.00 177.63 177.98 2k8d n LYS 45 N -2.09 2.79 0.00 2.89 2.85 -1.06 -4.99 118.16 118.55 2k8d n LYS 45 Ca -0.08 -2.33 0.00 0.00 -1.05 0.00 0.00 58.31 54.85 2k8d n LYS 45 Cb 0.54 -1.48 0.00 0.00 -0.65 0.00 0.00 35.03 33.44 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 -0.12 0.00 0.00 0.58 0.00 -0.06 -2.30 120.51 118.61 2k8d n ALA 46 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2k8d n ALA 46 Cb 0.60 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 19.72 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 -1.59 1.07 3.17 0.00 0.00 -1.22 -2.62 105.19 104.00 2k8d n GLY 47 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.37 -0.03 -0.06 2.61 2.01 -0.97 -4.96 115.64 112.87 2k8d s THR 48 Ca 0.00 0.11 -0.19 0.00 0.31 0.00 0.00 61.69 61.91 2k8d s THR 48 Cb 0.00 -0.50 -0.14 0.00 0.01 0.00 0.00 72.50 71.87 2k8d s THR 48 CO 0.00 0.04 0.78 -0.33 -0.69 0.00 0.00 174.62 174.43 2k8d h GLU 49 N 7.03 -0.22 -7.36 4.92 3.07 -1.95 -3.45 114.58 116.62 2k8d h GLU 49 Ca -0.38 0.01 -0.48 0.00 -0.50 0.00 0.00 59.36 58.02 2k8d h GLU 49 Cb 1.17 0.05 0.14 0.00 -0.84 0.00 0.00 28.75 29.27 2k8d h GLU 49 CO 0.33 0.18 0.27 -1.25 -1.40 0.00 0.00 179.01 177.14 2k8d s PRO 50 N -3.23 1.42 0.18 2.33 0.04 -1.26 -4.95 135.00 129.54 2k8d s PRO 50 Ca -0.12 0.73 0.20 0.00 0.04 0.00 0.00 61.00 61.86 2k8d s PRO 50 Cb 0.00 -1.83 0.87 0.00 0.04 0.00 0.00 34.50 33.57 2k8d s PRO 50 CO 0.43 -2.10 1.62 -0.35 0.04 0.00 0.00 177.00 176.64 2k8d n PRO 51 N -3.78 0.13 -1.49 0.56 -0.04 -1.26 -4.23 135.00 124.90 2k8d n PRO 51 Ca 0.07 0.39 -0.41 0.00 -0.04 0.00 0.00 63.50 63.51 2k8d n PRO 51 Cb 0.56 -1.76 -0.02 0.00 -0.04 0.00 0.00 33.50 32.24 2k8d n PRO 51 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2k8d n PHE 52 N -2.01 2.89 -1.55 0.54 3.72 -1.26 -4.93 117.46 114.86 2k8d n PHE 52 Ca 0.02 -2.68 -0.41 0.00 -0.05 0.00 0.00 57.45 54.34 2k8d n PHE 52 Cb 0.20 -2.31 -0.04 0.00 -0.94 0.00 0.00 39.48 36.38 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 5.05 0.10 -2.15 4.37 -2.24 -1.26 -4.80 114.28 113.35 2k8d n THR 53 Ca 0.55 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2k8d n THR 53 Cb 0.36 -2.41 0.00 0.00 -2.10 0.00 0.00 70.33 66.17 2k8d n THR 53 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k8d n GLY 54 N 6.04 -1.20 2.97 3.38 0.00 -1.26 -5.15 105.19 109.97 2k8d n GLY 54 Ca 0.37 -0.86 -0.11 0.00 0.00 0.00 0.00 46.02 45.41 2k8d n GLY 54 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k8d s LYS 55 N -0.58 0.30 0.03 1.61 2.20 -1.26 -5.07 119.74 116.96 2k8d s LYS 55 Ca 0.00 -0.44 -0.26 0.00 -0.36 0.00 0.00 55.97 54.91 2k8d s LYS 55 Cb 0.00 -0.07 -0.17 0.00 -1.51 0.00 0.00 37.83 36.08 2k8d s LYS 55 CO 0.00 0.00 1.40 1.88 -0.36 0.00 0.00 175.35 178.27 2k8d h TYR 56 N 5.15 -0.38 -2.78 4.03 0.05 -2.02 -3.48 116.97 117.54 2k8d h TYR 56 Ca -0.30 -0.01 0.07 0.00 0.05 0.00 0.00 58.73 58.54 2k8d h TYR 56 Cb 1.21 0.13 -0.02 0.00 1.01 0.00 0.00 36.73 39.05 2k8d h TYR 56 CO 0.57 -0.10 0.41 -1.58 -1.05 0.00 0.00 178.16 176.40 2k8d s HIS 57 N -5.16 0.07 0.34 4.88 2.46 -1.26 -5.19 115.29 111.43 2k8d s HIS 57 Ca -0.15 -0.61 0.04 0.00 0.47 0.00 0.00 55.06 54.81 2k8d s HIS 57 Cb 0.03 0.77 -0.06 0.00 -0.13 0.00 0.00 32.58 33.19 2k8d s HIS 57 CO 0.59 -1.26 0.06 -0.51 -2.47 0.00 0.00 174.74 171.15 2k8d s ASP 58 N -3.19 2.49 0.11 9.88 1.11 -1.26 -5.05 116.67 120.76 2k8d s ASP 58 Ca 0.18 -1.42 0.00 0.00 0.18 0.00 0.00 52.55 51.48 2k8d s ASP 58 Cb -0.04 -0.00 0.00 0.00 1.07 0.00 0.00 42.92 43.95 2k8d s ASP 58 CO 0.08 -0.65 0.00 -0.11 1.18 0.00 0.00 175.17 175.67 2k8d n LEU 59 N -0.73 -0.62 0.00 1.23 -0.00 -1.24 -4.91 117.00 110.73 2k8d n LEU 59 Ca -0.03 0.20 0.00 0.00 -0.00 0.00 0.00 56.01 56.18 2k8d n LEU 59 Cb 0.66 0.77 0.00 0.00 -0.00 0.00 0.00 43.42 44.86 2k8d n LEU 59 CO 0.42 -0.43 0.00 1.57 -0.00 0.00 0.00 177.39 178.94 2k8d n HIS 60 N -2.78 0.00 -4.38 1.96 -0.00 -1.26 -4.53 115.22 104.24 2k8d n HIS 60 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.72 57.51 2k8d n HIS 60 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 29.99 29.86 2k8d n HIS 60 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.34 176.50 2k8d s ASP 61 N 0.00 1.88 0.08 0.26 -4.77 -1.26 -5.09 116.67 107.78 2k8d s ASP 61 Ca 0.00 -0.51 -0.23 0.00 -3.30 0.00 0.00 52.55 48.51 2k8d s ASP 61 Cb 0.00 -0.12 -0.07 0.00 -1.09 0.00 0.00 42.92 41.65 2k8d s ASP 61 CO 0.00 0.04 0.70 1.51 0.70 0.00 0.00 175.17 178.12 2k8d s ASP 62 N -1.29 7.20 0.03 2.11 -4.77 -1.26 -4.99 116.67 113.70 2k8d s ASP 62 Ca 0.03 1.42 -0.27 0.00 -3.30 0.00 0.00 52.55 50.42 2k8d s ASP 62 Cb -0.08 -2.44 0.10 0.00 -1.09 0.00 0.00 42.92 39.40 2k8d s ASP 62 CO 0.02 0.15 1.23 -0.83 0.70 0.00 0.00 175.17 176.44 2k8d s GLY 63 N -0.67 -0.13 0.25 2.12 0.00 -1.26 -3.55 107.32 104.08 2k8d s GLY 63 Ca 0.34 0.08 0.01 0.00 0.00 0.00 0.00 44.72 45.16 2k8d s GLY 63 CO 0.22 3.89 0.13 -0.26 0.00 0.00 0.00 173.10 177.08 2k8d s ILE 64 N -2.15 0.28 -0.10 0.90 -4.36 -0.01 -1.55 121.20 114.22 2k8d s ILE 64 Ca 0.25 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.52 2k8d s ILE 64 Cb 0.00 -2.55 -0.05 0.00 1.25 0.00 0.00 42.46 41.11 2k8d s ILE 64 CO -0.00 0.00 0.28 -0.31 0.24 0.00 0.00 174.94 175.15 2k8d s TYR 65 N -3.84 3.58 -0.27 1.37 1.51 0.71 -0.22 117.35 120.20 2k8d s TYR 65 Ca 0.38 0.69 -0.10 0.00 -1.01 0.00 0.00 57.07 57.03 2k8d s TYR 65 Cb 0.06 -2.20 -0.04 0.00 -0.11 0.00 0.00 41.96 39.67 2k8d s TYR 65 CO 0.15 0.51 0.14 0.50 -1.11 0.00 0.00 175.55 175.75 2k8d s ARG 66 N -0.45 3.84 -0.84 -0.62 3.00 0.72 -0.48 118.95 124.13 2k8d s ARG 66 Ca 0.18 -0.38 -0.25 0.00 -1.00 0.00 0.00 55.73 54.28 2k8d s ARG 66 Cb -0.14 -3.53 -0.08 0.00 0.00 0.00 0.00 34.95 31.20 2k8d s ARG 66 CO 0.07 -0.18 2.14 0.00 0.00 0.00 0.00 175.30 177.32 2k8d n ILE 68 N 8.21 1.34 1.52 0.00 3.06 -0.82 -0.52 119.36 132.15 2k8d n ILE 68 Ca 0.42 0.34 0.14 0.00 -2.50 0.00 0.00 62.75 61.14 2k8d n ILE 68 Cb 0.46 -1.17 0.76 0.00 0.54 0.00 0.00 39.64 40.23 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 -0.42 3.42 0.00 0.00 0.33 -4.99 105.19 103.52 2k8d n GLY 71 Ca 0.00 0.23 -0.13 0.00 0.00 0.00 0.00 46.02 46.12 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 -3.18 -0.00 0.19 2.61 2.01 -1.13 -5.00 115.64 111.14 2k8d s THR 72 Ca 0.22 0.01 0.04 0.00 0.31 0.00 0.00 61.69 62.27 2k8d s THR 72 Cb -0.03 -0.73 -0.03 0.00 0.01 0.00 0.00 72.50 71.72 2k8d s THR 72 CO 0.44 0.00 0.29 -1.81 -0.69 0.00 0.00 174.62 172.85 2k8d s ASP 73 N 0.52 6.16 0.00 3.53 1.01 -1.26 0.29 116.67 126.92 2k8d s ASP 73 Ca -0.02 0.06 0.00 0.00 0.71 0.00 0.00 52.55 53.30 2k8d s ASP 73 Cb -0.04 -1.79 0.00 0.00 1.01 0.00 0.00 42.92 42.09 2k8d s ASP 73 CO -0.03 0.00 0.00 0.00 0.21 0.00 0.00 175.17 175.36 2k8d n LEU 74 N -0.89 0.00 -4.69 1.23 -0.00 0.37 -4.77 117.00 108.25 2k8d n LEU 74 Ca -0.08 0.00 -0.51 0.00 -0.00 0.00 0.00 56.01 55.42 2k8d n LEU 74 Cb 0.55 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.92 2k8d n LEU 74 CO 0.46 0.00 1.40 0.49 -0.00 0.00 0.00 177.39 179.74 2k8d n PHE 75 N 0.00 2.21 -1.78 1.47 3.72 -1.26 -4.37 117.46 117.46 2k8d n PHE 75 Ca 0.00 0.20 -0.42 0.00 -0.05 0.00 0.00 57.45 57.18 2k8d n PHE 75 Cb 0.00 -2.58 -0.03 0.00 -0.94 0.00 0.00 39.48 35.93 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 3.55 6.50 0.35 4.37 1.11 -1.26 -0.21 116.67 131.09 2k8d s ASP 76 Ca 0.93 2.60 0.26 0.00 0.18 0.00 0.00 52.55 56.53 2k8d s ASP 76 Cb -0.82 -2.55 1.21 0.00 1.07 0.00 0.00 42.92 41.83 2k8d s ASP 76 CO 0.55 -0.99 1.79 -1.28 1.18 0.00 0.00 175.17 176.42 2k8d h SER 77 N 9.47 0.00 0.87 0.27 0.87 -1.60 -0.32 113.55 123.12 2k8d h SER 77 Ca -0.46 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.10 2k8d h SER 77 Cb 1.22 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 2k8d h SER 77 CO 0.94 0.00 0.00 1.05 -0.53 0.00 0.00 176.83 178.29 2k8d h GLU 78 N 0.00 0.00 0.00 2.24 4.11 -1.90 -1.05 114.58 117.98 2k8d h GLU 78 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 2k8d h GLU 78 Cb 0.26 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 2k8d h GLU 78 CO 0.00 0.00 -0.15 1.79 0.07 0.00 0.00 179.01 180.72 2k8d h THR 79 N 0.00 0.37 -4.54 -1.06 1.35 -1.37 -3.47 112.91 104.20 2k8d h THR 79 Ca 0.00 -0.92 -0.13 0.00 -0.55 0.00 0.00 66.41 64.81 2k8d h THR 79 Cb 0.44 1.69 0.01 0.00 -1.73 0.00 0.00 68.15 68.55 2k8d h THR 79 CO 0.00 0.15 -0.01 1.17 -0.25 0.00 0.00 175.52 176.58 2k8d n LYS 80 N -3.30 0.81 -0.08 4.72 4.81 -0.40 -3.04 118.16 121.69 2k8d n LYS 80 Ca 0.00 -0.81 0.03 0.00 -0.87 0.00 0.00 58.31 56.67 2k8d n LYS 80 Cb 0.39 -0.08 0.08 0.00 0.02 0.00 0.00 35.03 35.43 2k8d n LYS 80 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2k8d n PHE 81 N -1.41 0.21 -1.65 5.64 3.72 -1.24 -4.97 117.46 117.76 2k8d n PHE 81 Ca 0.04 -0.41 -0.46 0.00 -0.05 0.00 0.00 57.45 56.58 2k8d n PHE 81 Cb 0.16 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 38.64 2k8d n PHE 81 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2k8d n ASP 82 N 0.13 2.38 0.00 4.37 8.00 -1.26 -0.76 116.55 129.40 2k8d n ASP 82 Ca 0.06 1.14 0.00 0.00 0.71 0.00 0.00 54.79 56.70 2k8d n ASP 82 Cb 0.31 -1.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.04 2k8d n ASP 82 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2k8d n SER 83 N 2.08 0.00 0.00 -2.24 3.41 -1.26 -4.84 113.62 110.77 2k8d n SER 83 Ca 0.12 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.73 2k8d n SER 83 Cb 0.30 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.25 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 0.00 0.02 0.00 5.00 0.00 -0.86 -3.66 105.19 105.70 2k8d n GLY 84 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2k8d n GLY 84 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2k8d n THR 85 N -2.58 0.01 -1.07 2.61 5.66 -0.89 -4.77 114.28 113.25 2k8d n THR 85 Ca -0.00 -0.03 -0.04 0.00 -3.05 0.00 0.00 64.05 60.93 2k8d n THR 85 Cb 0.01 0.30 -0.02 0.00 -1.55 0.00 0.00 70.33 69.07 2k8d n THR 85 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2k8d n GLY 86 N 2.50 0.34 3.72 1.09 0.00 0.06 -4.90 105.19 108.00 2k8d n GLY 86 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.27 2.99 -1.14 1.61 -0.00 -1.26 -4.63 118.94 115.23 2k8d s TRP 87 Ca 0.00 0.59 -0.18 0.00 -0.00 0.00 0.00 56.10 56.51 2k8d s TRP 87 Cb 0.00 -4.00 -0.05 0.00 -0.00 0.00 0.00 33.47 29.42 2k8d s TRP 87 CO 0.00 -3.65 2.09 -0.35 -0.00 0.00 0.00 176.95 175.04 2k8d n PRO 88 N 3.69 2.23 -4.07 5.86 -0.04 -1.26 -4.36 135.00 137.05 2k8d n PRO 88 Ca 0.13 -2.25 -0.10 0.00 -0.04 0.00 0.00 63.50 61.24 2k8d n PRO 88 Cb 0.37 -3.12 -0.11 0.00 -0.04 0.00 0.00 33.50 30.61 2k8d n PRO 88 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2k8d s SER 89 N 4.03 0.65 0.22 3.54 1.04 -1.26 -1.15 113.70 120.78 2k8d s SER 89 Ca 0.52 -0.72 -0.06 0.00 0.48 0.00 0.00 55.95 56.16 2k8d s SER 89 Cb 0.14 0.10 -0.02 0.00 0.10 0.00 0.00 66.02 66.34 2k8d s SER 89 CO 0.01 -0.37 0.29 0.72 0.98 0.00 0.00 173.24 174.86 2k8d s PHE 90 N -2.41 0.82 0.00 5.02 -0.71 -0.45 -3.68 117.98 116.57 2k8d s PHE 90 Ca -0.04 -1.10 0.00 0.00 -1.04 0.00 0.00 56.93 54.75 2k8d s PHE 90 Cb -0.03 -0.23 0.00 0.00 -1.21 0.00 0.00 43.02 41.55 2k8d s PHE 90 CO -0.03 -0.80 0.00 2.48 -1.34 0.00 0.00 175.22 175.53 2k8d n TYR 91 N -0.33 0.00 -4.24 3.49 0.18 -1.17 -0.30 117.16 114.80 2k8d n TYR 91 Ca 0.01 0.00 -0.18 0.00 1.88 0.00 0.00 57.90 59.61 2k8d n TYR 91 Cb 0.64 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 39.53 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 -0.81 1.39 0.07 9.48 -1.08 -1.26 -4.54 116.67 119.92 2k8d s ASP 92 Ca 0.00 -1.67 -0.02 0.00 -0.52 0.00 0.00 52.55 50.33 2k8d s ASP 92 Cb 0.00 0.56 -0.03 0.00 -1.46 0.00 0.00 42.92 41.98 2k8d s ASP 92 CO 0.00 -1.08 0.02 0.54 0.52 0.00 0.00 175.17 175.17 2k8d s VAL 93 N -3.45 0.19 0.25 1.11 0.11 -1.26 -4.83 120.40 112.51 2k8d s VAL 93 Ca 0.39 -1.71 -0.06 0.00 -2.93 0.00 0.00 61.98 57.66 2k8d s VAL 93 Cb 0.02 -1.57 0.25 0.00 -1.53 0.00 0.00 36.38 33.55 2k8d s VAL 93 CO 0.25 -0.85 1.92 1.62 -3.33 0.00 0.00 175.10 174.71 2k8d h VAL 94 N 3.03 1.24 0.00 2.04 3.04 -1.92 -3.48 116.25 120.20 2k8d h VAL 94 Ca -0.34 -0.46 0.00 0.00 -1.01 0.00 0.00 66.70 64.89 2k8d h VAL 94 Cb 1.16 -0.21 0.00 0.00 -2.01 0.00 0.00 31.29 30.23 2k8d h VAL 94 CO 0.63 0.24 0.00 -1.20 -1.01 0.00 0.00 177.57 176.23 2k8d n SER 95 N -4.40 0.00 -2.05 3.17 7.64 -1.26 -4.83 113.62 111.89 2k8d n SER 95 Ca 0.12 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.92 2k8d n SER 95 Cb 0.03 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.11 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 -1.16 1.47 -0.07 1.43 4.71 -1.26 -4.32 120.64 121.43 2k8d n GLU 96 Ca 0.00 -0.69 -0.13 0.00 -0.01 0.00 0.00 57.16 56.34 2k8d n GLU 96 Cb 0.00 -1.80 -0.05 0.00 -1.01 0.00 0.00 31.44 28.58 2k8d n GLU 96 CO 0.00 0.00 0.00 -2.39 0.09 0.00 0.00 177.13 174.83 2k8d n HIS 97 N 2.49 0.00 -1.04 -0.32 1.44 -1.26 -4.66 115.22 111.87 2k8d n HIS 97 Ca 0.29 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 56.06 2k8d n HIS 97 Cb 0.68 -0.48 0.08 0.00 0.12 0.00 0.00 29.99 30.39 2k8d n HIS 97 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 2k8d n ASN 98 N -3.37 1.75 -4.15 4.39 5.03 -1.26 -4.55 115.26 113.10 2k8d n ASN 98 Ca -0.25 -2.59 -0.27 0.00 0.87 0.00 0.00 54.58 52.34 2k8d n ASN 98 Cb 0.70 -0.29 -0.16 0.00 -1.02 0.00 0.00 39.78 39.01 2k8d n ASN 98 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 2k8d s ILE 99 N -1.89 1.49 -0.01 2.41 -1.16 -1.26 -0.18 121.20 120.61 2k8d s ILE 99 Ca 0.19 -0.76 0.02 0.00 -0.51 0.00 0.00 60.65 59.59 2k8d s ILE 99 Cb 0.17 -1.28 -0.04 0.00 0.61 0.00 0.00 42.46 41.92 2k8d s ILE 99 CO 0.02 0.43 -0.02 -0.75 -2.81 0.00 0.00 174.94 171.81 2k8d s LYS 100 N -0.02 2.74 -0.03 3.50 2.47 0.96 -4.65 119.74 124.72 2k8d s LYS 100 Ca -0.03 -0.62 0.00 0.00 -1.56 0.00 0.00 55.97 53.76 2k8d s LYS 100 Cb -0.11 -2.64 0.03 0.00 -1.46 0.00 0.00 37.83 33.65 2k8d s LYS 100 CO 0.02 0.62 0.01 -0.51 0.16 0.00 0.00 175.35 175.66 2k8d s LEU 101 N -1.47 1.05 -0.15 5.43 1.43 -1.26 -2.32 118.68 121.39 2k8d s LEU 101 Ca 0.18 -0.00 -0.02 0.00 -1.03 0.00 0.00 54.13 53.26 2k8d s LEU 101 Cb -0.11 -0.19 0.04 0.00 0.03 0.00 0.00 46.19 45.96 2k8d s LEU 101 CO 0.09 -0.12 0.00 -0.13 0.23 0.00 0.00 176.35 176.42 2k8d s ARG 102 N 1.15 0.85 -0.07 1.70 3.00 -1.26 -4.96 118.95 119.37 2k8d s ARG 102 Ca -0.08 -0.27 -0.04 0.00 0.00 0.00 0.00 55.73 55.33 2k8d s ARG 102 Cb -0.13 -1.72 -0.04 0.00 0.00 0.00 0.00 34.95 33.06 2k8d s ARG 102 CO -0.02 -0.47 0.12 -2.00 0.00 0.00 0.00 175.30 172.92 2k8d s GLU 103 N 1.84 3.31 0.32 3.54 2.12 -1.26 -1.40 118.70 127.16 2k8d s GLU 103 Ca 0.01 -0.28 -0.04 0.00 0.36 0.00 0.00 54.97 55.03 2k8d s GLU 103 Cb -0.15 -3.05 0.00 0.00 0.26 0.00 0.00 34.13 31.19 2k8d s GLU 103 CO -0.07 0.72 0.46 0.34 -0.54 0.00 0.00 175.26 176.17 2k8d s ASP 104 N -1.35 0.71 -0.00 -1.70 -1.08 0.76 -4.97 116.67 109.03 2k8d s ASP 104 Ca 0.19 -1.39 0.17 0.00 -0.52 0.00 0.00 52.55 51.00 2k8d s ASP 104 Cb -0.12 0.64 0.49 0.00 -1.46 0.00 0.00 42.92 42.47 2k8d s ASP 104 CO 0.09 -1.25 1.41 -2.11 0.52 0.00 0.00 175.17 173.82 2k8d n ARG 105 N -0.52 2.32 0.00 4.34 0.00 -1.26 -0.60 116.66 120.94 2k8d n ARG 105 Ca 0.00 -2.00 0.00 0.00 -0.00 0.00 0.00 57.85 55.85 2k8d n ARG 105 Cb 0.62 -1.45 0.00 0.00 -0.00 0.00 0.00 32.46 31.63 2k8d n ARG 105 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2k8d n SER 106 N 1.11 0.00 0.00 2.89 2.88 -1.26 -0.24 113.62 119.00 2k8d n SER 106 Ca 0.19 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 2k8d n SER 106 Cb 0.48 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 2k8d n SER 106 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k8d n LEU 107 N 0.15 0.21 0.00 2.46 -0.00 -1.26 -4.94 117.00 113.62 2k8d n LEU 107 Ca 0.00 -0.38 0.00 0.00 -0.00 0.00 0.00 56.01 55.63 2k8d n LEU 107 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2k8d n LEU 107 CO 0.00 0.05 0.00 0.61 -0.00 0.00 0.00 177.39 178.05 2k8d n GLY 108 N 0.35 0.71 0.00 1.47 0.00 0.67 -5.00 105.19 103.38 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 -1.13 0.00 -3.62 1.61 2.81 -1.10 -5.09 117.12 110.60 2k8d n MET 109 Ca 0.00 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.68 2k8d n MET 109 Cb 0.00 0.00 -0.16 0.00 -0.71 0.00 0.00 33.22 32.35 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 0.12 -0.18 -0.12 2.03 1.01 -1.26 -4.34 120.40 117.66 2k8d s VAL 110 Ca 0.00 0.10 0.03 0.00 0.00 0.00 0.00 61.98 62.11 2k8d s VAL 110 Cb 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 36.38 35.95 2k8d s VAL 110 CO 0.00 -0.06 -0.21 -0.60 0.00 0.00 0.00 175.10 174.23 2k8d s ARG 111 N 2.22 3.10 0.05 2.72 3.52 0.23 -2.09 118.95 128.70 2k8d s ARG 111 Ca 0.04 -0.83 0.06 0.00 -0.13 0.00 0.00 55.73 54.87 2k8d s ARG 111 Cb -0.14 -2.42 -0.03 0.00 -1.56 0.00 0.00 34.95 30.80 2k8d s ARG 111 CO -0.07 0.10 -0.18 0.00 -0.81 0.00 0.00 175.30 174.34 2k8d s GLU 113 N -1.30 1.64 -0.28 0.00 -1.05 -0.50 0.03 118.70 117.25 2k8d s GLU 113 Ca 0.04 1.06 -0.03 0.00 -0.15 0.00 0.00 54.97 55.89 2k8d s GLU 113 Cb -0.09 -1.84 0.11 0.00 -0.44 0.00 0.00 34.13 31.88 2k8d s GLU 113 CO 0.02 -2.04 0.18 0.08 0.95 0.00 0.00 175.26 174.45 2k8d s VAL 114 N -2.88 -0.18 0.19 1.83 1.01 -0.23 -4.19 120.40 115.94 2k8d s VAL 114 Ca 0.63 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 62.01 2k8d s VAL 114 Cb -0.18 -0.96 -0.05 0.00 0.00 0.00 0.00 36.38 35.19 2k8d s VAL 114 CO 0.57 -0.62 -0.07 -0.76 0.00 0.00 0.00 175.10 174.22 2k8d s LEU 115 N 2.19 2.40 -0.03 3.92 1.02 -0.98 -1.06 118.68 126.15 2k8d s LEU 115 Ca 0.09 -1.10 -0.30 0.00 0.02 0.00 0.00 54.13 52.84 2k8d s LEU 115 Cb -0.15 -0.35 -0.05 0.00 0.02 0.00 0.00 46.19 45.66 2k8d s LEU 115 CO -0.34 -0.39 1.36 0.00 0.02 0.00 0.00 176.35 177.00 2k8d n ALA 117 N 5.52 1.39 -0.03 0.00 0.00 0.75 -1.08 120.51 127.07 2k8d n ALA 117 Ca 0.13 -0.03 -0.00 0.00 0.00 0.00 0.00 53.44 53.54 2k8d n ALA 117 Cb 0.44 -1.12 -0.14 0.00 0.00 0.00 0.00 19.45 18.63 2k8d n ALA 117 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2k8d n ARG 118 N -1.45 0.66 -3.18 0.00 3.00 -1.25 -4.89 116.66 109.54 2k8d n ARG 118 Ca 0.02 0.00 0.02 0.00 -0.00 0.00 0.00 57.85 57.89 2k8d n ARG 118 Cb 0.08 -1.61 -0.01 0.00 0.00 0.00 0.00 32.46 30.93 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 4.95 0.16 0.31 0.00 9.92 -0.87 -3.11 116.55 127.92 2k8d n ASP 120 Ca 0.08 -0.33 -0.13 0.00 -0.53 0.00 0.00 54.79 53.87 2k8d n ASP 120 Cb 0.55 -0.03 -0.06 0.00 -0.64 0.00 0.00 41.12 40.94 2k8d n ASP 120 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k8d h ALA 121 N 2.47 -1.19 0.00 2.24 0.00 -1.96 -3.47 119.26 117.35 2k8d h ALA 121 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2k8d h ALA 121 Cb 0.04 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2k8d h ALA 121 CO 0.00 -1.14 0.00 1.58 0.00 0.00 0.00 179.25 179.69 2k8d n HIS 122 N -4.37 -3.58 0.00 0.00 -0.00 -1.26 -5.11 115.22 100.90 2k8d n HIS 122 Ca -0.10 0.88 0.00 0.00 0.46 0.00 0.00 57.72 58.96 2k8d n HIS 122 Cb 0.34 2.37 0.00 0.00 -0.12 0.00 0.00 29.99 32.58 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 -3.05 0.00 0.00 0.27 7.99 -1.14 -4.80 117.00 116.27 2k8d n LEU 123 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.00 2k8d n LEU 123 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 2k8d n LEU 123 CO 0.00 0.00 0.00 0.61 -1.51 0.00 0.00 177.39 176.49 2k8d n GLY 124 N 0.00 -0.14 3.83 -0.72 0.00 -0.22 -0.04 105.19 107.90 2k8d n GLY 124 Ca 0.00 0.52 -0.08 0.00 0.00 0.00 0.00 46.02 46.46 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 -0.04 0.03 1.61 -3.43 -0.44 -1.07 115.29 111.94 2k8d s HIS 125 Ca 0.00 -0.51 0.07 0.00 -0.80 0.00 0.00 55.06 53.83 2k8d s HIS 125 Cb 0.00 0.74 -0.02 0.00 -1.43 0.00 0.00 32.58 31.87 2k8d s HIS 125 CO 0.00 -1.37 -0.22 0.54 -2.00 0.00 0.00 174.74 171.69 2k8d s VAL 126 N -3.26 1.74 0.03 -5.38 0.11 0.10 -0.05 120.40 113.70 2k8d s VAL 126 Ca 0.13 -1.14 0.01 0.00 -2.93 0.00 0.00 61.98 58.04 2k8d s VAL 126 Cb -0.05 -1.49 -0.02 0.00 -1.53 0.00 0.00 36.38 33.28 2k8d s VAL 126 CO 0.09 0.31 -0.04 0.72 -3.33 0.00 0.00 175.10 172.85 2k8d s PHE 127 N -0.71 0.43 -0.08 1.54 -0.71 -0.49 -0.99 117.98 116.96 2k8d s PHE 127 Ca 0.08 -0.61 -0.29 0.00 -1.04 0.00 0.00 56.93 55.07 2k8d s PHE 127 Cb -0.09 -0.28 -0.06 0.00 -1.21 0.00 0.00 43.02 41.38 2k8d s PHE 127 CO 0.01 -0.19 1.74 0.34 -1.34 0.00 0.00 175.22 175.78 2k8d s ASP 128 N -1.75 6.50 0.00 1.98 2.15 -0.89 -0.02 116.67 124.65 2k8d s ASP 128 Ca -0.10 2.18 0.00 0.00 0.43 0.00 0.00 52.55 55.06 2k8d s ASP 128 Cb -0.07 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 2k8d s ASP 128 CO -0.02 -1.07 0.00 -0.67 -0.17 0.00 0.00 175.17 173.24 2k8d n ASP 129 N 7.71 0.00 -4.92 -0.34 2.03 0.09 -4.89 116.55 116.23 2k8d n ASP 129 Ca 0.19 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 55.27 2k8d n ASP 129 Cb 0.43 0.05 0.04 0.00 -0.72 0.00 0.00 41.12 40.91 2k8d n ASP 129 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k8d n GLY 130 N 1.11 2.31 3.76 0.27 0.00 0.15 -5.02 105.19 107.78 2k8d n GLY 130 Ca 0.00 -2.26 -0.37 0.00 0.00 0.00 0.00 46.02 43.39 2k8d n GLY 130 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k8d s PRO 131 N -4.48 3.42 0.65 1.61 0.04 -1.26 -4.35 135.00 130.62 2k8d s PRO 131 Ca 0.48 1.92 -0.12 0.00 0.04 0.00 0.00 61.00 63.32 2k8d s PRO 131 Cb -0.04 -2.26 -0.02 0.00 0.04 0.00 0.00 34.50 32.22 2k8d s PRO 131 CO 0.30 -0.87 1.04 1.03 0.04 0.00 0.00 177.00 178.55 2k8d s ARG 132 N -2.89 3.31 -0.07 4.56 3.00 -1.26 -2.05 118.95 123.54 2k8d s ARG 132 Ca 0.69 0.88 -0.26 0.00 0.00 0.00 0.00 55.73 57.03 2k8d s ARG 132 Cb -0.32 -2.04 -0.23 0.00 0.00 0.00 0.00 34.95 32.35 2k8d s ARG 132 CO 0.38 -0.80 1.01 -1.00 0.00 0.00 0.00 175.30 174.89 2k8d h PRO 133 N -0.38 0.06 -5.15 3.54 0.13 -2.01 -3.45 132.00 124.74 2k8d h PRO 133 Ca -0.44 -0.06 -0.64 0.00 -0.87 0.00 0.00 66.00 63.99 2k8d h PRO 133 Cb 1.20 0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.30 2k8d h PRO 133 CO 0.59 0.81 2.33 0.25 -0.23 0.00 0.00 178.00 181.75 2k8d n THR 134 N -4.65 3.34 -0.02 1.56 -2.24 -1.26 -4.44 114.28 106.57 2k8d n THR 134 Ca -0.09 -3.28 0.06 0.00 -2.27 0.00 0.00 64.05 58.47 2k8d n THR 134 Cb 0.41 -2.40 0.14 0.00 -2.10 0.00 0.00 70.33 66.38 2k8d n THR 134 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k8d n GLY 135 N 5.00 2.01 3.75 3.38 0.00 -0.87 -4.64 105.19 113.82 2k8d n GLY 135 Ca 0.49 -0.39 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2k8d n GLY 135 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k8d s LYS 136 N -1.00 4.75 -0.47 1.61 -2.85 -1.26 0.30 119.74 120.82 2k8d s LYS 136 Ca 0.22 1.58 -0.10 0.00 -1.00 0.00 0.00 55.97 56.68 2k8d s LYS 136 Cb 0.12 -3.27 0.11 0.00 -2.06 0.00 0.00 37.83 32.73 2k8d s LYS 136 CO 0.17 0.35 0.34 0.50 0.10 0.00 0.00 175.35 176.81 2k8d s ARG 137 N -0.96 2.54 0.41 1.78 3.52 0.98 -4.19 118.95 123.03 2k8d s ARG 137 Ca 0.44 -1.70 -0.26 0.00 -0.13 0.00 0.00 55.73 54.09 2k8d s ARG 137 Cb -0.27 -3.93 -0.08 0.00 -1.56 0.00 0.00 34.95 29.11 2k8d s ARG 137 CO 0.34 -1.15 1.24 0.71 -0.81 0.00 0.00 175.30 175.63 2k8d s TYR 138 N 1.39 2.92 -0.09 5.12 1.51 0.59 -1.40 117.35 127.39 2k8d s TYR 138 Ca 0.05 1.48 -0.07 0.00 -1.01 0.00 0.00 57.07 57.51 2k8d s TYR 138 Cb -0.26 -3.55 0.03 0.00 -0.11 0.00 0.00 41.96 38.07 2k8d s TYR 138 CO 0.00 -1.76 0.24 0.00 -1.11 0.00 0.00 175.55 172.92 2k8d s MET 140 N 0.42 0.51 -0.26 0.00 0.23 -0.30 -1.33 119.30 118.57 2k8d s MET 140 Ca -0.02 -0.91 -0.05 0.00 -1.03 0.00 0.00 55.69 53.68 2k8d s MET 140 Cb -0.04 -0.01 0.14 0.00 -1.53 0.00 0.00 34.83 33.39 2k8d s MET 140 CO -0.02 -0.04 0.52 -0.80 -2.03 0.00 0.00 175.02 172.66 2k8d s ASN 141 N -2.09 -0.72 0.09 -1.18 0.02 0.94 -4.68 114.94 107.33 2k8d s ASN 141 Ca -0.05 0.94 -0.25 0.00 -1.02 0.00 0.00 52.86 52.48 2k8d s ASN 141 Cb -0.03 1.79 0.09 0.00 0.02 0.00 0.00 41.25 43.11 2k8d s ASN 141 CO -0.03 -0.25 1.15 -0.94 0.02 0.00 0.00 177.10 177.04 2k8d s SER 142 N 2.75 -0.01 0.00 -1.22 1.04 -1.26 -2.90 113.70 112.09 2k8d s SER 142 Ca 0.07 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.06 2k8d s SER 142 Cb -0.14 0.34 0.00 0.00 0.10 0.00 0.00 66.02 66.32 2k8d s SER 142 CO -0.17 -0.67 0.18 0.00 0.98 0.00 0.00 173.24 173.55 2k8d n ALA 143 N -0.74 1.52 0.47 5.32 0.00 -1.08 -3.58 120.51 122.42 2k8d n ALA 143 Ca -0.01 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.54 2k8d n ALA 143 Cb 0.60 -1.00 0.08 0.00 0.00 0.00 0.00 19.45 19.13 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 0.41 3.01 -2.70 0.00 0.00 -1.26 -2.18 120.51 117.80 2k8d n ALA 144 Ca 0.00 -0.30 -0.42 0.00 0.00 0.00 0.00 53.44 52.71 2k8d n ALA 144 Cb 0.09 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 18.43 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 -4.34 4.10 -0.18 0.00 1.43 -1.24 -1.95 118.68 116.50 2k8d s LEU 145 Ca 0.04 -1.82 -0.00 0.00 -1.03 0.00 0.00 54.13 51.32 2k8d s LEU 145 Cb 0.13 -2.51 0.04 0.00 0.03 0.00 0.00 46.19 43.89 2k8d s LEU 145 CO 0.77 -1.30 -0.06 -0.75 0.23 0.00 0.00 176.35 175.24 2k8d s LYS 146 N 4.01 1.55 0.45 1.70 2.20 -1.17 -4.95 119.74 123.54 2k8d s LYS 146 Ca 0.42 -0.64 -0.24 0.00 -0.36 0.00 0.00 55.97 55.16 2k8d s LYS 146 Cb -0.01 -2.16 -0.08 0.00 -1.51 0.00 0.00 37.83 34.07 2k8d s LYS 146 CO -0.08 -0.46 1.19 0.12 -0.36 0.00 0.00 175.35 175.77 2k8d s PHE 147 N 1.56 2.87 0.13 4.03 2.19 -1.26 -0.20 117.98 127.30 2k8d s PHE 147 Ca -0.00 1.52 0.00 0.00 0.33 0.00 0.00 56.93 58.77 2k8d s PHE 147 Cb -0.16 -3.44 -0.04 0.00 -1.31 0.00 0.00 43.02 38.07 2k8d s PHE 147 CO -0.08 -1.62 0.01 0.96 1.83 0.00 0.00 175.22 176.32 2k8d s ILE 148 N -1.47 0.38 0.96 3.12 -4.36 0.70 -4.80 121.20 115.73 2k8d s ILE 148 Ca 0.62 -1.92 -0.11 0.00 -0.26 0.00 0.00 60.65 58.98 2k8d s ILE 148 Cb -0.31 -1.93 0.12 0.00 1.25 0.00 0.00 42.46 41.60 2k8d s ILE 148 CO 0.38 -0.62 0.85 -0.81 0.24 0.00 0.00 174.94 174.98 2k8d n PRO 149 N -0.10 -0.62 -0.10 0.37 -0.04 -1.26 -0.83 135.00 132.43 2k8d n PRO 149 Ca -0.08 -0.13 0.17 0.00 -0.04 0.00 0.00 63.50 63.42 2k8d n PRO 149 Cb 0.63 -2.16 0.26 0.00 -0.04 0.00 0.00 33.50 32.18 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 -3.39 0.01 0.00 0.54 5.12 -1.23 -4.22 116.66 113.49 2k8d n ARG 150 Ca 0.09 0.72 0.00 0.00 -1.93 0.00 0.00 57.85 56.73 2k8d n ARG 150 Cb 0.53 -1.80 0.00 0.00 -1.16 0.00 0.00 32.46 30.03 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 -2.56 0.00 0.00 0.55 2.03 -1.26 -4.68 116.55 110.63 2k8d n ASP 151 Ca 0.14 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.45 2k8d n ASP 151 Cb 1.03 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.43 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 -0.62 0.00 0.18 -0.67 1.13 -1.26 -4.95 117.38 111.18 2k8d n GLN 152 Ca 0.00 -0.44 0.14 0.00 -1.94 0.00 0.00 57.00 54.76 2k8d n GLN 152 Cb 0.00 -0.46 0.56 0.00 0.11 0.00 0.00 30.24 30.45 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 2.93 0.00 0.00 5.09 -0.00 -1.94 -3.51 117.51 120.08 2k8d h ILE 153 Ca 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 64.86 64.55 2k8d h ILE 153 Cb 0.98 1.12 0.00 0.00 -0.00 0.00 0.00 36.82 38.92 2k8d h ILE 153 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 178.15 178.76