#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1blk s SER 2 N 0.00 -0.39 0.37 1.61 0.15 -1.26 -5.15 113.70 109.03 1blk s SER 2 Ca 0.00 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.39 1blk s SER 2 Cb 0.00 0.61 0.00 0.00 -1.71 0.00 0.00 66.02 64.92 1blk s SER 2 CO 0.00 -1.05 0.00 0.52 1.20 0.00 0.00 173.24 173.91 1blk n VAL 3 N -0.40 -2.68 -1.71 4.45 0.31 -1.26 -4.93 118.33 112.11 1blk n VAL 3 Ca -0.10 1.21 -0.32 0.00 -0.01 0.00 0.00 64.34 65.12 1blk n VAL 3 Cb 0.62 -1.83 0.04 0.00 -0.91 0.00 0.00 33.84 31.76 1blk n VAL 3 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1blk s ALA 4 N -4.16 2.58 1.19 3.52 0.00 -1.26 -5.04 121.76 118.58 1blk s ALA 4 Ca 0.00 0.31 -0.10 0.00 0.00 0.00 0.00 51.96 52.17 1blk s ALA 4 Cb 0.00 -3.24 0.15 0.00 0.00 0.00 0.00 23.12 20.03 1blk s ALA 4 CO 0.00 -1.20 0.38 -2.30 0.00 0.00 0.00 175.76 172.64 1blk n PRO 5 N -2.70 -2.97 0.00 0.00 -0.01 -1.26 -5.05 135.00 123.01 1blk n PRO 5 Ca 0.09 -0.63 0.00 0.00 -0.01 0.00 0.00 63.50 62.95 1blk n PRO 5 Cb 0.53 -0.77 0.00 0.00 -0.01 0.00 0.00 33.50 33.25 1blk n PRO 5 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 175.50 175.77 1blk n VAL 6 N -4.06 0.00 -2.47 -1.45 0.31 -1.26 -5.00 118.33 104.41 1blk n VAL 6 Ca 0.06 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 64.00 1blk n VAL 6 Cb 0.25 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.16 1blk n VAL 6 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1blk s GLU 7 N -0.90 3.54 0.34 5.55 0.41 -1.26 -4.96 118.70 121.43 1blk s GLU 7 Ca 0.00 -1.41 -0.28 0.00 -0.41 0.00 0.00 54.97 52.86 1blk s GLU 7 Cb 0.00 -5.39 -0.10 0.00 -1.78 0.00 0.00 34.13 26.85 1blk s GLU 7 CO 0.00 -2.53 1.32 0.95 -0.49 0.00 0.00 175.26 174.51 1blk s THR 8 N 5.80 2.66 -1.59 3.63 -4.23 -1.26 -3.46 115.64 117.18 1blk s THR 8 Ca 0.54 0.65 -0.03 0.00 -1.18 0.00 0.00 61.69 61.67 1blk s THR 8 Cb 0.01 -3.41 0.03 0.00 1.34 0.00 0.00 72.50 70.47 1blk s THR 8 CO 0.01 0.15 0.08 0.00 -0.54 0.00 0.00 174.62 174.31 1blk n LEU 9 N 0.68 -0.96 -3.56 4.79 -0.00 -1.26 -4.87 117.00 111.83 1blk n LEU 9 Ca 0.01 -1.27 -0.36 0.00 -0.00 0.00 0.00 56.01 54.38 1blk n LEU 9 Cb 0.42 -1.60 -0.01 0.00 -0.00 0.00 0.00 43.42 42.23 1blk n LEU 9 CO 0.59 0.43 0.87 1.21 -0.00 0.00 0.00 177.39 180.48 1blk n GLU 10 N -4.52 4.26 0.00 1.47 4.07 -1.22 -4.60 120.64 120.09 1blk n GLU 10 Ca -0.28 -4.68 0.00 0.00 -0.06 0.00 0.00 57.16 52.14 1blk n GLU 10 Cb 0.67 -2.40 0.00 0.00 -0.06 0.00 0.00 31.44 29.65 1blk n GLU 10 CO 0.00 0.00 0.00 1.33 -0.06 0.00 0.00 177.13 178.40 1blk n VAL 11 N 0.42 0.00 -2.79 6.31 0.24 -1.26 -5.12 118.33 116.13 1blk n VAL 11 Ca 0.35 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.64 1blk n VAL 11 Cb 0.33 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.70 1blk n VAL 11 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1blk n GLU 12 N -1.86 -3.06 -0.43 7.34 1.02 -1.26 -4.83 120.64 117.55 1blk n GLU 12 Ca 0.00 2.52 -0.02 0.00 -0.02 0.00 0.00 57.16 59.64 1blk n GLU 12 Cb 0.00 -4.96 -0.03 0.00 -0.02 0.00 0.00 31.44 26.44 1blk n GLU 12 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1blk n LYS 13 N 0.65 0.86 0.08 3.49 4.76 -1.26 -2.66 118.16 124.08 1blk n LYS 13 Ca 0.01 -0.16 0.00 0.00 -2.87 0.00 0.00 58.31 55.29 1blk n LYS 13 Cb 0.11 -1.31 0.00 0.00 -1.84 0.00 0.00 35.03 31.99 1blk n LYS 13 CO 0.00 0.00 0.00 -2.67 -1.37 0.00 0.00 177.40 173.36 1blk n TRP 14 N 1.87 -1.73 -2.85 2.13 -0.00 -1.26 -3.63 117.44 111.98 1blk n TRP 14 Ca 0.07 0.34 -0.43 0.00 -0.00 0.00 0.00 57.50 57.47 1blk n TRP 14 Cb 0.42 0.88 -0.01 0.00 -0.00 0.00 0.00 31.31 32.59 1blk n TRP 14 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 177.69 177.81 1blk s PHE 15 N -2.00 3.15 0.15 -2.67 5.36 -1.09 -0.18 117.98 120.71 1blk s PHE 15 Ca 0.00 -1.64 0.01 0.00 -0.96 0.00 0.00 56.93 54.34 1blk s PHE 15 Cb 0.00 -4.40 -0.04 0.00 -0.34 0.00 0.00 43.02 38.24 1blk s PHE 15 CO 0.00 -1.55 0.31 -0.06 -1.46 0.00 0.00 175.22 172.46 1blk s PHE 16 N 2.73 3.49 0.00 10.12 0.40 -1.21 -4.84 117.98 128.66 1blk s PHE 16 Ca 0.41 0.22 0.00 0.00 -0.60 0.00 0.00 56.93 56.96 1blk s PHE 16 Cb -0.02 -1.75 0.00 0.00 0.51 0.00 0.00 43.02 41.76 1blk s PHE 16 CO -0.04 0.49 0.00 0.54 0.70 0.00 0.00 175.22 176.91 1blk n ARG 17 N -0.42 3.57 -2.77 0.44 5.12 -1.26 -3.94 116.66 117.40 1blk n ARG 17 Ca -0.06 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.43 1blk n ARG 17 Cb 0.53 0.00 0.01 0.00 -1.16 0.00 0.00 32.46 31.84 1blk n ARG 17 CO 0.00 0.00 0.00 -2.37 -1.93 0.00 0.00 177.63 173.33 1blk n THR 18 N 0.00 4.74 -1.43 0.55 5.66 -1.26 -1.92 114.28 120.61 1blk n THR 18 Ca 0.00 -5.13 -0.31 0.00 -3.05 0.00 0.00 64.05 55.56 1blk n THR 18 Cb 0.00 -2.29 0.07 0.00 -1.55 0.00 0.00 70.33 66.56 1blk n THR 18 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 1blk s ILE 19 N -0.85 3.69 0.90 1.09 2.07 -1.26 -4.96 121.20 121.88 1blk s ILE 19 Ca 0.36 0.55 -0.10 0.00 -1.41 0.00 0.00 60.65 60.05 1blk s ILE 19 Cb 0.04 -3.17 0.14 0.00 0.13 0.00 0.00 42.46 39.60 1blk s ILE 19 CO 0.03 -0.71 1.12 -0.55 -1.91 0.00 0.00 174.94 172.92 1blk s SER 20 N -3.58 3.14 0.08 4.50 0.15 -1.26 -4.76 113.70 111.96 1blk s SER 20 Ca 0.60 2.01 -0.32 0.00 0.70 0.00 0.00 55.95 58.94 1blk s SER 20 Cb -0.16 -2.51 -0.17 0.00 -1.71 0.00 0.00 66.02 61.47 1blk s SER 20 CO 0.55 -2.94 1.63 -0.09 1.20 0.00 0.00 173.24 173.60 1blk h ARG 21 N -1.75 -0.76 0.00 5.44 2.43 -2.01 -0.66 114.38 117.07 1blk h ARG 21 Ca -0.45 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 1blk h ARG 21 Cb 1.27 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.99 1blk h ARG 21 CO 0.45 -0.51 0.00 1.57 -1.51 0.00 0.00 179.97 179.98 1blk h LYS 22 N -0.79 0.00 0.12 0.20 5.09 -1.99 -2.74 116.57 116.46 1blk h LYS 22 Ca -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 60.65 60.67 1blk h LYS 22 Cb 0.63 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.96 1blk h LYS 22 CO 0.09 0.00 -0.06 -0.44 -2.09 0.00 0.00 179.45 176.95 1blk h ASP 23 N 0.00 -0.14 -0.94 7.07 3.32 -1.51 -1.98 116.42 122.24 1blk h ASP 23 Ca 0.00 -0.23 0.17 0.00 0.02 0.00 0.00 57.03 56.99 1blk h ASP 23 Cb 0.10 0.04 -0.10 0.00 0.22 0.00 0.00 39.33 39.59 1blk h ASP 23 CO 0.00 0.44 0.53 0.00 -1.72 0.00 0.00 179.24 178.49 1blk h ALA 24 N -0.71 1.51 -0.37 3.45 0.00 -1.19 0.16 119.26 122.10 1blk h ALA 24 Ca -0.02 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1blk h ALA 24 Cb 0.36 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1blk h ALA 24 CO 0.03 -0.07 -0.06 0.93 0.00 0.00 0.00 179.25 180.07 1blk h GLU 25 N 0.70 0.61 -0.00 0.00 5.08 -1.57 -2.56 114.58 116.85 1blk h GLU 25 Ca 0.53 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.68 1blk h GLU 25 Cb 0.80 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 1blk h GLU 25 CO -0.38 0.68 -0.20 0.07 -1.00 0.00 0.00 179.01 178.18 1blk h ARG 26 N 0.57 0.00 0.06 2.33 0.11 0.12 -1.35 114.38 116.23 1blk h ARG 26 Ca 0.11 -0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.19 1blk h ARG 26 Cb 0.46 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.54 1blk h ARG 26 CO 0.02 0.20 -0.03 1.96 0.10 0.00 0.00 179.97 182.23 1blk h GLN 27 N 0.00 -0.07 -0.83 0.08 4.20 -1.09 -3.06 115.11 114.34 1blk h GLN 27 Ca -0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 1blk h GLN 27 Cb 0.35 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 1blk h GLN 27 CO 0.03 0.54 0.45 -0.07 -0.67 0.00 0.00 178.83 179.11 1blk h LEU 28 N -0.84 1.04 0.00 1.46 3.38 -1.39 -1.86 115.31 117.11 1blk h LEU 28 Ca -0.01 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1blk h LEU 28 Cb 0.65 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1blk h LEU 28 CO 0.01 0.84 0.00 0.18 0.09 0.00 0.00 178.44 179.57 1blk n LEU 29 N -4.39 0.00 -4.76 1.67 4.77 -0.52 -4.71 117.00 109.07 1blk n LEU 29 Ca 0.08 0.16 -0.37 0.00 -0.03 0.00 0.00 56.01 55.85 1blk n LEU 29 Cb 0.10 -0.16 0.02 0.00 -2.33 0.00 0.00 43.42 41.05 1blk n LEU 29 CO 0.38 -0.08 0.89 0.00 -1.33 0.00 0.00 177.39 177.26 1blk s ALA 30 N -2.32 2.76 -1.70 -1.18 0.00 -0.70 -4.89 121.76 113.74 1blk s ALA 30 Ca 0.19 1.11 0.17 0.00 0.00 0.00 0.00 51.96 53.43 1blk s ALA 30 Cb 0.11 -3.48 0.92 0.00 0.00 0.00 0.00 23.12 20.68 1blk s ALA 30 CO 0.22 -1.10 1.45 -0.35 0.00 0.00 0.00 175.76 175.99 1blk n PRO 31 N -1.07 0.38 0.20 0.00 -0.04 -1.26 -2.72 135.00 130.49 1blk n PRO 31 Ca 0.11 0.07 0.09 0.00 -0.04 0.00 0.00 63.50 63.72 1blk n PRO 31 Cb 0.47 -1.50 0.33 0.00 -0.04 0.00 0.00 33.50 32.77 1blk n PRO 31 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 1blk h MET 32 N 0.00 0.00 -4.09 0.54 2.86 -1.91 -3.46 114.93 108.87 1blk h MET 32 Ca 0.00 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.52 1blk h MET 32 Cb 0.08 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 31.60 1blk h MET 32 CO 0.00 0.26 -0.52 -0.80 1.06 0.00 0.00 176.91 176.91 1blk s ASN 33 N -6.24 0.27 -0.04 1.22 -0.87 -1.10 -4.86 114.94 103.32 1blk s ASN 33 Ca 0.02 -0.91 -0.10 0.00 -1.57 0.00 0.00 52.86 50.29 1blk s ASN 33 Cb 0.09 0.30 0.02 0.00 -0.02 0.00 0.00 41.25 41.64 1blk s ASN 33 CO 0.66 -0.71 0.24 -1.59 -2.57 0.00 0.00 177.10 173.14 1blk s LYS 34 N -3.93 0.47 0.00 -0.60 0.00 -1.26 -4.68 119.74 109.74 1blk s LYS 34 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 55.97 56.06 1blk s LYS 34 Cb 0.06 0.21 0.00 0.00 0.00 0.00 0.00 37.83 38.10 1blk s LYS 34 CO -0.06 -0.10 0.00 0.00 0.00 0.00 0.00 175.35 175.18 1blk n ALA 35 N 2.01 -0.75 0.00 0.59 0.00 -1.25 -4.17 120.51 116.94 1blk n ALA 35 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1blk n ALA 35 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1blk n ALA 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1blk n GLY 36 N 0.73 1.77 3.70 0.00 0.00 -1.25 -4.47 105.19 105.67 1blk n GLY 36 Ca 0.00 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 1blk n GLY 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1blk s SER 37 N -0.01 6.65 0.29 1.61 1.04 -1.20 -3.29 113.70 118.78 1blk s SER 37 Ca 0.00 2.48 0.02 0.00 0.48 0.00 0.00 55.95 58.93 1blk s SER 37 Cb 0.00 -2.58 -0.05 0.00 0.10 0.00 0.00 66.02 63.49 1blk s SER 37 CO 0.00 -0.82 0.10 -0.36 0.98 0.00 0.00 173.24 173.14 1blk s PHE 38 N 1.85 1.65 -0.21 5.02 0.40 -1.26 -2.92 117.98 122.51 1blk s PHE 38 Ca 0.70 -1.16 -0.14 0.00 -0.60 0.00 0.00 56.93 55.72 1blk s PHE 38 Cb -0.40 -0.99 0.06 0.00 0.51 0.00 0.00 43.02 42.20 1blk s PHE 38 CO 0.31 -0.28 0.53 -0.51 0.70 0.00 0.00 175.22 175.97 1blk s LEU 39 N -3.38 -0.31 -0.42 -0.37 1.43 -0.96 -4.22 118.68 110.46 1blk s LEU 39 Ca 0.36 1.13 -0.06 0.00 -1.03 0.00 0.00 54.13 54.54 1blk s LEU 39 Cb 0.07 1.80 0.10 0.00 0.03 0.00 0.00 46.19 48.20 1blk s LEU 39 CO 0.15 -0.20 0.24 -0.51 0.23 0.00 0.00 176.35 176.25 1blk s ILE 40 N 1.07 3.67 0.38 -0.59 2.07 0.75 -1.74 121.20 126.82 1blk s ILE 40 Ca -0.06 -1.84 -0.02 0.00 -1.41 0.00 0.00 60.65 57.32 1blk s ILE 40 Cb -0.06 -3.42 -0.04 0.00 0.13 0.00 0.00 42.46 39.07 1blk s ILE 40 CO -0.10 -0.65 0.62 0.00 -1.91 0.00 0.00 174.94 172.90 1blk s ARG 41 N 1.25 3.53 -0.02 3.50 1.04 -0.01 -3.30 118.95 124.95 1blk s ARG 41 Ca 0.06 -0.11 -0.14 0.00 -1.04 0.00 0.00 55.73 54.50 1blk s ARG 41 Cb -0.24 -2.57 -0.05 0.00 -2.04 0.00 0.00 34.95 30.05 1blk s ARG 41 CO -0.02 0.05 0.39 -1.83 -0.04 0.00 0.00 175.30 173.85 1blk s GLU 42 N -4.31 3.92 -0.38 3.89 -1.05 -0.81 -0.43 118.70 119.54 1blk s GLU 42 Ca 0.43 0.38 -0.29 0.00 -0.15 0.00 0.00 54.97 55.34 1blk s GLU 42 Cb -0.10 -3.23 0.01 0.00 -0.44 0.00 0.00 34.13 30.37 1blk s GLU 42 CO 0.38 0.66 1.26 0.45 0.95 0.00 0.00 175.26 178.95 1blk s SER 43 N -0.96 6.62 0.00 0.83 0.15 -0.87 -4.36 113.70 115.10 1blk s SER 43 Ca 0.23 0.90 -0.05 0.00 0.70 0.00 0.00 55.95 57.74 1blk s SER 43 Cb -0.16 -2.54 -0.20 0.00 -1.71 0.00 0.00 66.02 61.40 1blk s SER 43 CO 0.12 -1.18 2.93 -1.84 1.20 0.00 0.00 173.24 174.48 1blk n GLU 44 N 7.57 1.56 0.00 5.44 0.28 -1.26 -2.68 120.64 131.55 1blk n GLU 44 Ca 0.14 -0.76 0.00 0.00 -0.16 0.00 0.00 57.16 56.38 1blk n GLU 44 Cb 0.48 -1.86 0.00 0.00 1.43 0.00 0.00 31.44 31.49 1blk n GLU 44 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1blk n SER 45 N 2.54 0.00 -4.59 -1.84 3.41 -1.26 -5.08 113.62 106.80 1blk n SER 45 Ca 0.33 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.59 1blk n SER 45 Cb 0.72 0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 64.57 1blk n SER 45 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1blk s ASN 46 N -3.41 5.39 0.00 4.04 2.20 -1.09 -5.01 114.94 117.06 1blk s ASN 46 Ca 0.00 0.02 0.00 0.00 -0.94 0.00 0.00 52.86 51.94 1blk s ASN 46 Cb 0.00 -1.91 0.00 0.00 -2.00 0.00 0.00 41.25 37.34 1blk s ASN 46 CO 0.00 0.17 1.05 2.29 -2.94 0.00 0.00 177.10 177.66 1blk n LYS 47 N 3.58 0.57 0.00 3.55 -0.00 -1.26 -3.40 118.16 121.20 1blk n LYS 47 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.14 1blk n LYS 47 Cb 0.52 -1.21 0.00 0.00 -0.00 0.00 0.00 35.03 34.34 1blk n LYS 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1blk n GLY 48 N 1.55 0.00 3.96 2.58 0.00 -1.26 -5.16 105.19 106.85 1blk n GLY 48 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1blk n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1blk s ALA 49 N 0.00 3.89 0.30 4.61 0.00 -1.22 -4.33 121.76 125.01 1blk s ALA 49 Ca 0.00 -1.12 0.04 0.00 0.00 0.00 0.00 51.96 50.88 1blk s ALA 49 Cb 0.00 -1.82 -0.03 0.00 0.00 0.00 0.00 23.12 21.27 1blk s ALA 49 CO 0.00 0.26 0.20 -0.06 0.00 0.00 0.00 175.76 176.17 1blk s PHE 50 N -1.99 1.58 0.18 0.00 0.40 -0.35 -2.05 117.98 115.75 1blk s PHE 50 Ca 0.35 -1.50 -0.09 0.00 -0.60 0.00 0.00 56.93 55.10 1blk s PHE 50 Cb -0.10 -0.74 -0.01 0.00 0.51 0.00 0.00 43.02 42.68 1blk s PHE 50 CO 0.30 -0.69 0.30 -1.12 0.70 0.00 0.00 175.22 174.71 1blk s SER 51 N -3.34 0.03 -0.04 1.36 0.01 0.43 -1.96 113.70 110.20 1blk s SER 51 Ca 0.38 -0.94 -0.01 0.00 1.31 0.00 0.00 55.95 56.68 1blk s SER 51 Cb 0.04 0.46 0.03 0.00 0.21 0.00 0.00 66.02 66.76 1blk s SER 51 CO 0.21 -0.93 0.05 -0.22 0.41 0.00 0.00 173.24 172.75 1blk s LEU 52 N -3.00 0.38 -0.21 2.44 2.96 -1.23 -0.83 118.68 119.20 1blk s LEU 52 Ca 0.21 0.05 -0.10 0.00 -0.22 0.00 0.00 54.13 54.07 1blk s LEU 52 Cb 0.03 -0.17 -0.05 0.00 0.50 0.00 0.00 46.19 46.50 1blk s LEU 52 CO 0.03 -0.22 0.13 -0.44 -1.32 0.00 0.00 176.35 174.53 1blk s SER 53 N 1.92 6.06 0.01 3.68 0.01 -0.71 -1.41 113.70 123.27 1blk s SER 53 Ca 0.02 0.16 0.01 0.00 1.31 0.00 0.00 55.95 57.45 1blk s SER 53 Cb -0.12 -2.07 -0.01 0.00 0.21 0.00 0.00 66.02 64.03 1blk s SER 53 CO -0.03 0.14 -0.03 -0.69 0.41 0.00 0.00 173.24 173.04 1blk s VAL 54 N 0.57 0.20 -0.07 3.43 1.01 -1.22 -2.25 120.40 122.07 1blk s VAL 54 Ca 0.07 -0.50 -0.30 0.00 0.00 0.00 0.00 61.98 61.25 1blk s VAL 54 Cb -0.12 -0.25 -0.02 0.00 0.00 0.00 0.00 36.38 36.00 1blk s VAL 54 CO 0.00 -0.20 1.00 -0.75 0.00 0.00 0.00 175.10 175.16 1blk s LYS 55 N -0.73 4.47 -0.09 2.72 2.20 -1.15 0.74 119.74 127.90 1blk s LYS 55 Ca -0.06 1.41 -0.02 0.00 -0.36 0.00 0.00 55.97 56.94 1blk s LYS 55 Cb -0.05 -3.51 -0.03 0.00 -1.51 0.00 0.00 37.83 32.72 1blk s LYS 55 CO -0.00 -0.23 0.00 0.34 -0.36 0.00 0.00 175.35 175.10 1blk s ASP 56 N 1.08 5.24 -0.15 1.43 2.15 0.18 -3.89 116.67 122.71 1blk s ASP 56 Ca 0.50 0.14 -0.00 0.00 0.43 0.00 0.00 52.55 53.62 1blk s ASP 56 Cb -0.19 -1.50 0.03 0.00 -0.30 0.00 0.00 42.92 40.97 1blk s ASP 56 CO 0.21 0.37 -0.07 -0.63 -0.17 0.00 0.00 175.17 174.89 1blk s ILE 57 N -0.83 1.14 0.32 4.11 1.01 -1.26 -1.19 121.20 124.50 1blk s ILE 57 Ca 0.13 -0.54 0.04 0.00 0.00 0.00 0.00 60.65 60.27 1blk s ILE 57 Cb -0.11 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.08 1blk s ILE 57 CO 0.02 0.23 0.16 0.28 0.00 0.00 0.00 174.94 175.64 1blk s THR 58 N 1.63 0.37 -2.00 2.92 -1.32 -1.25 -5.03 115.64 110.97 1blk s THR 58 Ca 0.02 -2.00 0.07 0.00 -1.21 0.00 0.00 61.69 58.57 1blk s THR 58 Cb -0.14 -2.49 0.19 0.00 -1.51 0.00 0.00 72.50 68.54 1blk s THR 58 CO -0.08 0.00 0.82 1.07 -2.21 0.00 0.00 174.62 174.22 1blk n THR 59 N -0.64 0.00 -0.09 5.08 5.66 -1.26 -3.56 114.28 119.47 1blk n THR 59 Ca 0.00 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.85 1blk n THR 59 Cb 0.65 -0.80 -0.05 0.00 -1.55 0.00 0.00 70.33 68.57 1blk n THR 59 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1blk n GLN 60 N -0.92 0.47 -3.61 1.09 6.02 -1.26 -5.13 117.38 114.04 1blk n GLN 60 Ca 0.05 0.20 -0.01 0.00 -0.01 0.00 0.00 57.00 57.22 1blk n GLN 60 Cb 0.02 -1.31 -0.01 0.00 1.02 0.00 0.00 30.24 29.96 1blk n GLN 60 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1blk s GLY 61 N -5.06 -0.35 -0.27 1.08 0.00 -1.23 -5.13 107.32 96.35 1blk s GLY 61 Ca -0.28 1.10 -0.25 0.00 0.00 0.00 0.00 44.72 45.29 1blk s GLY 61 CO 0.39 0.31 0.85 1.85 0.00 0.00 0.00 173.10 176.50 1blk s GLU 62 N -2.45 4.10 0.14 2.90 2.12 -1.26 -3.81 118.70 120.43 1blk s GLU 62 Ca 0.12 0.86 0.02 0.00 0.36 0.00 0.00 54.97 56.33 1blk s GLU 62 Cb 0.02 -3.68 -0.01 0.00 0.26 0.00 0.00 34.13 30.72 1blk s GLU 62 CO -0.04 -0.62 0.08 1.33 -0.54 0.00 0.00 175.26 175.46 1blk n VAL 63 N 5.43 0.00 -3.37 3.70 0.24 -0.34 -5.02 118.33 118.97 1blk n VAL 63 Ca 0.06 -0.90 0.00 0.00 -2.04 0.00 0.00 64.34 61.46 1blk n VAL 63 Cb 0.48 0.38 0.00 0.00 -1.47 0.00 0.00 33.84 33.23 1blk n VAL 63 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1blk n VAL 64 N -0.29 0.00 -4.14 3.34 0.31 -1.26 0.50 118.33 116.79 1blk n VAL 64 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.24 1blk n VAL 64 Cb 0.23 -0.25 -0.10 0.00 -0.91 0.00 0.00 33.84 32.81 1blk n VAL 64 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1blk s LYS 65 N -0.67 0.78 -0.23 5.55 -0.14 0.23 -3.83 119.74 121.44 1blk s LYS 65 Ca 0.00 -1.32 -0.04 0.00 -1.36 0.00 0.00 55.97 53.25 1blk s LYS 65 Cb 0.00 0.05 0.09 0.00 -1.68 0.00 0.00 37.83 36.29 1blk s LYS 65 CO 0.00 -0.11 0.18 -1.01 -0.76 0.00 0.00 175.35 173.65 1blk s HIS 66 N -3.83 -0.07 0.00 3.18 3.76 -1.23 -3.39 115.29 113.71 1blk s HIS 66 Ca 0.13 -0.19 0.00 0.00 -0.15 0.00 0.00 55.06 54.85 1blk s HIS 66 Cb 0.07 -0.57 0.00 0.00 1.11 0.00 0.00 32.58 33.19 1blk s HIS 66 CO -0.05 -0.68 0.00 0.66 -0.85 0.00 0.00 174.74 173.82 1blk n TYR 67 N 5.29 -1.44 -3.15 1.40 4.01 -0.50 -4.93 117.16 117.85 1blk n TYR 67 Ca -0.05 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.73 1blk n TYR 67 Cb 0.47 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.49 1blk n TYR 67 CO 0.00 0.00 0.00 -1.59 -0.46 0.00 0.00 176.86 174.81 1blk s LYS 68 N -0.34 0.54 -0.22 -0.72 0.00 -1.26 -3.47 119.74 114.27 1blk s LYS 68 Ca 0.00 0.90 -0.20 0.00 0.00 0.00 0.00 55.97 56.66 1blk s LYS 68 Cb 0.00 0.49 -0.02 0.00 0.00 0.00 0.00 37.83 38.30 1blk s LYS 68 CO 0.00 -0.64 0.62 0.96 0.00 0.00 0.00 175.35 176.29 1blk s ILE 69 N 2.86 5.01 0.54 3.79 -0.00 -0.83 -4.42 121.20 128.16 1blk s ILE 69 Ca 0.18 1.14 0.05 0.00 -0.00 0.00 0.00 60.65 62.02 1blk s ILE 69 Cb -0.14 -3.93 0.05 0.00 -0.00 0.00 0.00 42.46 38.44 1blk s ILE 69 CO -0.21 0.08 0.74 -0.13 -0.00 0.00 0.00 174.94 175.42 1blk s ARG 70 N 2.12 2.47 -0.21 0.37 0.52 -0.92 -1.21 118.95 122.08 1blk s ARG 70 Ca 0.27 -1.16 -0.03 0.00 -0.52 0.00 0.00 55.73 54.30 1blk s ARG 70 Cb -0.16 -2.59 0.07 0.00 0.52 0.00 0.00 34.95 32.79 1blk s ARG 70 CO 0.09 -0.70 0.04 -1.54 0.02 0.00 0.00 175.30 173.22 1blk s SER 71 N -4.49 3.08 0.10 0.23 1.04 -1.26 -3.11 113.70 109.28 1blk s SER 71 Ca 0.59 -0.93 -0.08 0.00 0.48 0.00 0.00 55.95 56.01 1blk s SER 71 Cb -0.09 -0.64 -0.06 0.00 0.10 0.00 0.00 66.02 65.34 1blk s SER 71 CO 0.38 -0.32 0.38 -0.76 0.98 0.00 0.00 173.24 173.90 1blk s LEU 72 N 1.82 4.32 0.51 2.42 2.01 -0.73 -4.98 118.68 124.05 1blk s LEU 72 Ca 0.00 0.69 0.25 0.00 0.01 0.00 0.00 54.13 55.08 1blk s LEU 72 Cb -0.17 -3.09 1.39 0.00 0.01 0.00 0.00 46.19 44.33 1blk s LEU 72 CO -0.10 0.13 2.07 -2.24 1.01 0.00 0.00 176.35 177.22 1blk h ASP 73 N 3.39 0.00 -0.31 2.29 2.03 -2.00 -2.98 116.42 118.84 1blk h ASP 73 Ca -0.48 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 55.60 1blk h ASP 73 Cb 1.18 0.00 -0.32 0.00 -0.83 0.00 0.00 39.33 39.36 1blk h ASP 73 CO 0.69 0.12 -0.86 -0.46 -1.03 0.00 0.00 179.24 177.70 1blk n ASN 74 N -3.80 0.64 0.00 4.15 6.94 -1.26 -4.83 115.26 117.10 1blk n ASN 74 Ca -0.02 -2.10 0.00 0.00 -0.02 0.00 0.00 54.58 52.44 1blk n ASN 74 Cb 0.23 -0.12 0.00 0.00 -2.36 0.00 0.00 39.78 37.52 1blk n ASN 74 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1blk n GLY 75 N -0.87 0.17 5.08 4.83 0.00 -1.20 -5.10 105.19 108.11 1blk n GLY 75 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1blk n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1blk n GLY 76 N 0.00 0.19 3.02 -0.02 0.00 -1.13 -3.61 105.19 103.64 1blk n GLY 76 Ca 0.00 0.66 -0.10 0.00 0.00 0.00 0.00 46.02 46.58 1blk n GLY 76 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1blk s TYR 77 N 0.00 0.12 -0.16 1.61 1.51 0.05 -1.78 117.35 118.70 1blk s TYR 77 Ca 0.00 -0.26 -0.20 0.00 -1.01 0.00 0.00 57.07 55.60 1blk s TYR 77 Cb 0.00 -0.10 0.05 0.00 -0.11 0.00 0.00 41.96 41.80 1blk s TYR 77 CO 0.00 -0.20 0.53 1.52 -1.11 0.00 0.00 175.55 176.29 1blk s TYR 78 N -1.16 -0.55 0.00 2.71 -0.85 -1.18 -0.54 117.35 115.79 1blk s TYR 78 Ca -0.13 1.25 0.00 0.00 -0.52 0.00 0.00 57.07 57.68 1blk s TYR 78 Cb -0.07 0.21 0.00 0.00 0.38 0.00 0.00 41.96 42.48 1blk s TYR 78 CO 0.00 -0.34 0.00 0.44 -1.52 0.00 0.00 175.55 174.13 1blk n ILE 79 N 2.36 0.00 -4.06 -3.49 -5.35 -1.25 -2.17 119.36 105.40 1blk n ILE 79 Ca -0.15 0.00 -0.32 0.00 -0.27 0.00 0.00 62.75 62.01 1blk n ILE 79 Cb 0.56 -0.69 -0.15 0.00 -1.74 0.00 0.00 39.64 37.61 1blk n ILE 79 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 1blk s SER 80 N -3.48 3.94 0.00 7.28 0.01 -1.26 -4.91 113.70 115.29 1blk s SER 80 Ca 0.00 -1.13 0.01 0.00 1.31 0.00 0.00 55.95 56.14 1blk s SER 80 Cb 0.00 -1.46 0.06 0.00 0.21 0.00 0.00 66.02 64.83 1blk s SER 80 CO 0.00 -0.14 0.52 -2.65 0.41 0.00 0.00 173.24 171.38 1blk n PRO 81 N 4.53 0.03 -0.06 12.44 -0.02 -1.26 -0.73 135.00 149.93 1blk n PRO 81 Ca -0.16 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.27 1blk n PRO 81 Cb 0.45 -1.47 -0.05 0.00 -0.02 0.00 0.00 33.50 32.41 1blk n PRO 81 CO 0.00 0.00 0.00 0.07 1.98 0.00 0.00 175.50 177.55 1blk h ARG 82 N 0.00 0.00 -4.95 -0.52 -0.00 -2.02 -3.44 114.38 103.45 1blk h ARG 82 Ca 0.00 0.00 -0.65 0.00 -0.00 0.00 0.00 59.98 59.33 1blk h ARG 82 Cb 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 29.97 29.80 1blk h ARG 82 CO 0.00 0.35 -0.39 0.96 -0.00 0.00 0.00 179.97 180.89 1blk s ILE 83 N -1.80 5.24 0.19 0.08 -4.36 0.09 -5.08 121.20 115.56 1blk s ILE 83 Ca -0.07 0.20 0.11 0.00 -0.26 0.00 0.00 60.65 60.63 1blk s ILE 83 Cb -0.01 -3.66 -0.04 0.00 1.25 0.00 0.00 42.46 40.00 1blk s ILE 83 CO 0.25 0.12 -0.22 -0.89 0.24 0.00 0.00 174.94 174.44 1blk s THR 84 N 1.89 2.48 0.11 8.37 2.01 -1.26 -3.91 115.64 125.32 1blk s THR 84 Ca 0.10 -1.98 -0.01 0.00 0.31 0.00 0.00 61.69 60.12 1blk s THR 84 Cb -0.16 -2.19 -0.04 0.00 0.01 0.00 0.00 72.50 70.11 1blk s THR 84 CO 0.11 -0.11 0.02 -0.36 -0.69 0.00 0.00 174.62 173.58 1blk s PHE 85 N -1.67 0.79 0.03 4.92 0.08 0.30 -4.99 117.98 117.43 1blk s PHE 85 Ca 0.21 -1.15 0.10 0.00 0.12 0.00 0.00 56.93 56.21 1blk s PHE 85 Cb -0.08 -0.47 -0.19 0.00 -0.57 0.00 0.00 43.02 41.71 1blk s PHE 85 CO 0.11 -0.43 1.07 -1.00 -0.10 0.00 0.00 175.22 174.86 1blk h PRO 86 N 2.95 0.00 -4.50 0.24 0.13 -1.85 0.18 132.00 129.15 1blk h PRO 86 Ca -0.35 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.55 1blk h PRO 86 Cb 1.18 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.17 1blk h PRO 86 CO 0.62 0.75 -0.56 -0.08 -0.23 0.00 0.00 178.00 178.51 1blk s THR 87 N -2.71 0.00 -0.12 1.56 -1.32 -1.26 -4.27 115.64 107.52 1blk s THR 87 Ca -0.01 -1.93 0.27 0.00 -1.21 0.00 0.00 61.69 58.81 1blk s THR 87 Cb 0.09 -2.47 0.33 0.00 -1.51 0.00 0.00 72.50 68.94 1blk s THR 87 CO 0.81 0.00 1.78 -0.07 -2.21 0.00 0.00 174.62 174.94 1blk h LEU 88 N 2.56 0.00 -0.95 9.08 3.38 -1.95 -2.96 115.31 124.46 1blk h LEU 88 Ca -0.34 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.53 1blk h LEU 88 Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 1blk h LEU 88 CO 0.50 0.06 -0.28 0.06 0.09 0.00 0.00 178.44 178.87 1blk h GLN 89 N 0.00 0.42 0.00 1.13 3.07 -1.99 -0.41 115.11 117.34 1blk h GLN 89 Ca -0.00 -0.16 0.00 0.00 0.09 0.00 0.00 58.65 58.57 1blk h GLN 89 Cb 0.79 -0.02 0.00 0.00 0.08 0.00 0.00 27.48 28.33 1blk h GLN 89 CO 0.01 0.67 0.00 0.00 0.09 0.00 0.00 178.83 179.60 1blk h ALA 90 N 1.33 1.00 0.04 0.06 0.00 -1.95 -0.31 119.26 119.43 1blk h ALA 90 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.79 1blk h ALA 90 Cb 0.69 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.50 1blk h ALA 90 CO 0.05 0.00 -0.69 1.25 0.00 0.00 0.00 179.25 179.86 1blk h LEU 91 N 0.00 0.54 -0.54 0.00 6.46 -1.11 -3.17 115.31 117.49 1blk h LEU 91 Ca 0.00 -0.81 -0.16 0.00 -0.12 0.00 0.00 57.88 56.79 1blk h LEU 91 Cb 0.57 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.33 1blk h LEU 91 CO 0.00 1.29 -0.62 0.58 -0.62 0.00 0.00 178.44 179.07 1blk h VAL 92 N -0.15 1.36 -0.77 1.05 2.07 -0.75 -2.47 116.25 116.59 1blk h VAL 92 Ca -0.10 -1.96 -0.05 0.00 0.82 0.00 0.00 66.70 65.42 1blk h VAL 92 Cb 1.43 1.95 -0.03 0.00 -1.52 0.00 0.00 31.29 33.12 1blk h VAL 92 CO 0.13 0.59 0.30 0.06 0.02 0.00 0.00 177.57 178.68 1blk h GLN 93 N 0.29 1.16 -0.13 1.57 3.07 -1.18 0.51 115.11 120.40 1blk h GLN 93 Ca -0.01 -0.21 -0.09 0.00 0.09 0.00 0.00 58.65 58.43 1blk h GLN 93 Cb 1.15 -0.19 0.00 0.00 0.08 0.00 0.00 27.48 28.53 1blk h GLN 93 CO 0.11 0.94 -0.25 1.25 0.09 0.00 0.00 178.83 180.97 1blk h HIS 94 N 1.12 0.51 0.00 0.06 2.76 -1.49 -1.89 115.15 116.22 1blk h HIS 94 Ca 0.26 -0.18 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 1blk h HIS 94 Cb 0.22 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.09 1blk h HIS 94 CO 0.02 0.87 0.00 0.66 -1.30 0.00 0.00 177.93 178.18 1blk n TYR 95 N -4.45 0.18 1.21 5.26 4.01 -0.94 -1.92 117.16 120.50 1blk n TYR 95 Ca -0.07 0.06 0.14 0.00 -0.16 0.00 0.00 57.90 57.88 1blk n TYR 95 Cb 0.45 -0.60 0.64 0.00 -0.31 0.00 0.00 39.34 39.51 1blk n TYR 95 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1blk n SER 96 N -1.66 0.10 -0.03 7.72 7.64 0.18 -2.14 113.62 125.43 1blk n SER 96 Ca 0.04 0.07 0.04 0.00 1.01 0.00 0.00 58.87 60.03 1blk n SER 96 Cb 0.22 -0.31 -0.12 0.00 -1.01 0.00 0.00 64.21 62.99 1blk n SER 96 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1blk n LYS 97 N -1.35 0.78 -1.04 1.43 4.76 -0.81 -4.56 118.16 117.37 1blk n LYS 97 Ca 0.10 -0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1blk n LYS 97 Cb 0.30 -1.38 0.00 0.00 -1.84 0.00 0.00 35.03 32.10 1blk n LYS 97 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1blk n LYS 98 N -2.20 0.00 -3.51 1.97 0.00 -1.21 -5.06 118.16 108.15 1blk n LYS 98 Ca -0.09 0.00 -0.28 0.00 -0.00 0.00 0.00 58.31 57.94 1blk n LYS 98 Cb 0.58 0.00 -0.11 0.00 -0.00 0.00 0.00 35.03 35.50 1blk n LYS 98 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1blk s GLY 99 N -0.86 1.46 -0.05 2.58 0.00 -1.26 -4.20 107.32 105.00 1blk s GLY 99 Ca 0.00 -2.60 -0.24 0.00 0.00 0.00 0.00 44.72 41.89 1blk s GLY 99 CO 0.00 1.90 1.00 -1.80 0.00 0.00 0.00 173.10 174.20 1blk h ASP 100 N 5.91 -0.10 -0.25 1.64 1.82 -1.93 -3.43 116.42 120.08 1blk h ASP 100 Ca 0.19 -0.47 -0.27 0.00 -0.39 0.00 0.00 57.03 56.09 1blk h ASP 100 Cb 0.90 0.03 -0.18 0.00 0.68 0.00 0.00 39.33 40.76 1blk h ASP 100 CO 0.42 0.48 -0.55 0.61 -1.61 0.00 0.00 179.24 178.58 1blk n GLY 101 N 0.57 0.64 0.00 -0.78 0.00 -1.26 -5.04 105.19 99.31 1blk n GLY 101 Ca -0.08 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1blk n GLY 101 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1blk n LEU 102 N 1.06 0.00 0.02 0.99 4.77 -1.26 -4.98 117.00 117.60 1blk n LEU 102 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1blk n LEU 102 Cb 0.65 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1blk n LEU 102 CO 0.06 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.12 1blk s GLN 104 N -2.00 0.39 1.06 0.00 -1.52 -1.26 -5.01 119.66 111.32 1blk s GLN 104 Ca 0.00 0.69 -0.13 0.00 -1.95 0.00 0.00 55.36 53.97 1blk s GLN 104 Cb 0.00 0.04 0.23 0.00 -0.22 0.00 0.00 33.01 33.05 1blk s GLN 104 CO 0.00 -0.13 1.07 -1.59 -0.25 0.00 0.00 175.29 174.39 1blk s LYS 105 N 1.04 -0.10 -0.15 2.91 -2.85 -1.26 -4.56 119.74 114.77 1blk s LYS 105 Ca -0.07 0.55 -0.29 0.00 -1.00 0.00 0.00 55.97 55.15 1blk s LYS 105 Cb -0.07 -1.67 -0.01 0.00 -2.06 0.00 0.00 37.83 34.02 1blk s LYS 105 CO -0.09 -3.10 1.06 -0.51 0.10 0.00 0.00 175.35 172.82 1blk s LEU 106 N -6.71 4.20 -0.07 2.77 1.43 -0.91 -3.81 118.68 115.57 1blk s LEU 106 Ca 0.66 1.52 -0.09 0.00 -1.03 0.00 0.00 54.13 55.20 1blk s LEU 106 Cb -0.20 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.44 1blk s LEU 106 CO 0.60 -0.56 -0.17 0.35 0.23 0.00 0.00 176.35 176.79 1blk n THR 107 N 4.88 0.89 -3.55 5.49 -2.24 -1.21 -4.79 114.28 113.75 1blk n THR 107 Ca 0.10 0.27 -0.29 0.00 -2.27 0.00 0.00 64.05 61.87 1blk n THR 107 Cb 0.47 -1.88 -0.14 0.00 -2.10 0.00 0.00 70.33 66.68 1blk n THR 107 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1blk s LEU 108 N -6.67 0.88 -0.80 3.22 1.43 -1.26 -4.98 118.68 110.51 1blk s LEU 108 Ca -0.14 -1.55 -0.26 0.00 -1.03 0.00 0.00 54.13 51.15 1blk s LEU 108 Cb 0.02 -0.44 -0.10 0.00 0.03 0.00 0.00 46.19 45.70 1blk s LEU 108 CO 0.21 -0.41 2.26 -2.16 0.23 0.00 0.00 176.35 176.49 1blk s PRO 109 N 1.78 1.93 0.00 1.29 0.05 -1.26 -3.24 135.00 135.55 1blk s PRO 109 Ca 0.11 0.34 0.00 0.00 0.05 0.00 0.00 61.00 61.50 1blk s PRO 109 Cb -0.18 -4.84 0.00 0.00 0.05 0.00 0.00 34.50 29.53 1blk s PRO 109 CO -0.27 -4.03 0.00 0.00 0.05 0.00 0.00 177.00 172.76 1blk s VAL 111 N 0.00 3.54 0.95 0.00 0.11 -1.26 -4.71 120.40 119.03 1blk s VAL 111 Ca 0.00 1.46 -0.12 0.00 -2.93 0.00 0.00 61.98 60.39 1blk s VAL 111 Cb 0.00 -3.93 0.07 0.00 -1.53 0.00 0.00 36.38 30.99 1blk s VAL 111 CO 0.00 0.31 0.61 -3.20 -3.33 0.00 0.00 175.10 169.49 1blk n ASN 112 N 1.63 -1.42 -4.63 3.54 2.85 -1.26 -4.85 115.26 111.12 1blk n ASN 112 Ca 0.01 0.34 -0.43 0.00 -0.11 0.00 0.00 54.58 54.39 1blk n ASN 112 Cb 0.45 -1.28 -0.02 0.00 1.24 0.00 0.00 39.78 40.17 1blk n ASN 112 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 1blk s LEU 113 N -2.70 3.87 0.00 1.20 2.96 -1.26 -5.18 118.68 117.58 1blk s LEU 113 Ca 0.60 1.40 0.00 0.00 -0.22 0.00 0.00 54.13 55.90 1blk s LEU 113 Cb -0.21 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 42.94 1blk s LEU 113 CO 0.65 -1.18 0.00 0.00 -1.32 0.00 0.00 176.35 174.50