#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1blk n SER 2 N 0.00 3.00 -0.28 1.61 7.64 -1.26 -4.64 113.62 119.69 1blk n SER 2 Ca 0.00 -3.33 -0.00 0.00 1.01 0.00 0.00 58.87 56.55 1blk n SER 2 Cb 0.00 -0.63 -0.00 0.00 -1.01 0.00 0.00 64.21 62.57 1blk n SER 2 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1blk n VAL 3 N 0.61 0.00 -1.08 0.44 3.14 -1.26 -5.16 118.33 115.02 1blk n VAL 3 Ca 0.28 0.00 0.13 0.00 -2.96 0.00 0.00 64.34 61.79 1blk n VAL 3 Cb 0.45 0.01 -0.07 0.00 -1.06 0.00 0.00 33.84 33.17 1blk n VAL 3 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1blk n ALA 4 N 0.00 -2.83 -2.15 1.55 0.00 -1.26 -4.77 120.51 111.04 1blk n ALA 4 Ca -0.00 0.66 -0.42 0.00 0.00 0.00 0.00 53.44 53.68 1blk n ALA 4 Cb 0.27 -1.16 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 1blk n ALA 4 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1blk s PRO 5 N -3.69 4.36 0.00 0.00 0.04 -1.26 -4.78 135.00 129.67 1blk s PRO 5 Ca 0.00 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.06 1blk s PRO 5 Cb 0.00 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.30 1blk s PRO 5 CO 0.00 -0.35 0.04 0.28 0.04 0.00 0.00 177.00 177.01 1blk n VAL 6 N 3.51 0.00 -3.98 -0.36 0.31 -1.26 -4.89 118.33 111.66 1blk n VAL 6 Ca 0.09 0.34 -0.28 0.00 -0.01 0.00 0.00 64.34 64.48 1blk n VAL 6 Cb 0.43 -0.93 -0.01 0.00 -0.91 0.00 0.00 33.84 32.42 1blk n VAL 6 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1blk n GLU 7 N -0.07 -3.76 -3.21 5.55 2.13 -1.26 -4.95 120.64 115.07 1blk n GLU 7 Ca 0.00 0.45 0.00 0.00 0.66 0.00 0.00 57.16 58.27 1blk n GLU 7 Cb 0.00 -4.86 -0.03 0.00 0.27 0.00 0.00 31.44 26.82 1blk n GLU 7 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1blk s THR 8 N -3.68 -0.89 0.86 6.31 2.01 -1.26 -5.16 115.64 113.82 1blk s THR 8 Ca 0.26 -0.03 -0.13 0.00 0.31 0.00 0.00 61.69 62.10 1blk s THR 8 Cb -0.14 -0.96 0.12 0.00 0.01 0.00 0.00 72.50 71.53 1blk s THR 8 CO 0.88 -0.04 1.21 -0.76 -0.69 0.00 0.00 174.62 175.22 1blk s LEU 9 N 2.77 2.50 -0.40 4.42 1.43 -1.26 -5.06 118.68 123.07 1blk s LEU 9 Ca 0.17 0.67 0.02 0.00 -1.03 0.00 0.00 54.13 53.96 1blk s LEU 9 Cb -0.14 -3.02 0.15 0.00 0.03 0.00 0.00 46.19 43.20 1blk s LEU 9 CO -0.21 -2.18 0.27 -0.70 0.23 0.00 0.00 176.35 173.76 1blk s GLU 10 N -5.63 0.87 0.00 1.70 2.12 -1.26 -5.00 118.70 111.50 1blk s GLU 10 Ca 0.65 -1.79 0.00 0.00 0.36 0.00 0.00 54.97 54.19 1blk s GLU 10 Cb -0.09 -1.61 0.00 0.00 0.26 0.00 0.00 34.13 32.69 1blk s GLU 10 CO 0.50 -1.26 0.00 0.28 -0.54 0.00 0.00 175.26 174.24 1blk n VAL 11 N 3.47 0.00 -1.40 3.70 0.31 -1.26 -5.07 118.33 118.08 1blk n VAL 11 Ca 0.18 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.68 1blk n VAL 11 Cb 0.40 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.26 1blk n VAL 11 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1blk n GLU 12 N 0.00 -3.10 0.00 5.55 1.02 -1.26 -3.80 120.64 119.06 1blk n GLU 12 Ca 0.00 2.39 0.01 0.00 -0.02 0.00 0.00 57.16 59.53 1blk n GLU 12 Cb 0.00 -3.67 0.03 0.00 -0.02 0.00 0.00 31.44 27.78 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 -4.26 0.45 -0.09 3.49 4.76 -1.26 -3.19 118.16 118.06 1blk n LYS 13 Ca -0.06 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.21 1blk n LYS 13 Cb 0.66 -1.04 -0.12 0.00 -1.84 0.00 0.00 35.03 32.69 1blk n LYS 13 CO 0.00 0.00 0.00 0.11 -1.37 0.00 0.00 177.40 176.14 1blk h TRP 14 N 0.00 0.00 -2.15 2.13 5.08 -1.73 -3.37 115.95 115.91 1blk h TRP 14 Ca 0.00 0.00 -0.72 0.00 1.08 0.00 0.00 58.89 59.25 1blk h TRP 14 Cb 0.00 0.00 -0.17 0.00 -3.00 0.00 0.00 29.16 25.99 1blk h TRP 14 CO 0.00 1.21 1.28 0.12 -1.28 0.00 0.00 178.44 179.76 1blk s PHE 15 N -2.28 3.37 0.36 0.12 5.36 -1.19 -1.40 117.98 122.31 1blk s PHE 15 Ca -0.23 -1.92 0.05 0.00 -0.96 0.00 0.00 56.93 53.87 1blk s PHE 15 Cb 0.01 -4.33 -0.01 0.00 -0.34 0.00 0.00 43.02 38.35 1blk s PHE 15 CO 0.63 -1.44 0.51 0.12 -1.46 0.00 0.00 175.22 173.57 1blk s PHE 16 N 2.01 3.15 0.00 10.12 5.36 -1.24 -4.88 117.98 132.49 1blk s PHE 16 Ca 0.41 -0.12 0.00 0.00 -0.96 0.00 0.00 56.93 56.26 1blk s PHE 16 Cb -0.03 -2.05 0.00 0.00 -0.34 0.00 0.00 43.02 40.60 1blk s PHE 16 CO -0.02 -0.07 0.00 0.54 -1.46 0.00 0.00 175.22 174.21 1blk n ARG 17 N -1.72 2.91 -2.79 10.12 1.74 -1.26 -4.35 116.66 121.31 1blk n ARG 17 Ca -0.00 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 1blk n ARG 17 Cb 0.58 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 32.03 1blk n ARG 17 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1blk n THR 18 N 0.00 4.75 -1.40 0.55 5.66 -1.26 -2.19 114.28 120.40 1blk n THR 18 Ca 0.00 -5.15 -0.31 0.00 -3.05 0.00 0.00 64.05 55.54 1blk n THR 18 Cb 0.00 -2.29 0.08 0.00 -1.55 0.00 0.00 70.33 66.57 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 -0.90 3.43 0.71 1.09 2.07 -1.26 -4.92 121.20 121.42 1blk s ILE 19 Ca 0.36 0.46 -0.16 0.00 -1.41 0.00 0.00 60.65 59.90 1blk s ILE 19 Cb 0.04 -3.07 0.03 0.00 0.13 0.00 0.00 42.46 39.58 1blk s ILE 19 CO 0.03 -0.61 1.21 -0.55 -1.91 0.00 0.00 174.94 173.12 1blk s SER 20 N -3.60 4.38 0.08 4.50 0.15 -1.26 -4.84 113.70 113.11 1blk s SER 20 Ca 0.60 2.36 -0.27 0.00 0.70 0.00 0.00 55.95 59.34 1blk s SER 20 Cb -0.16 -2.59 -0.17 0.00 -1.71 0.00 0.00 66.02 61.39 1blk s SER 20 CO 0.56 -2.14 1.66 -0.09 1.20 0.00 0.00 173.24 174.43 1blk h ARG 21 N -0.09 -0.39 0.00 5.44 2.43 -2.01 -0.18 114.38 119.59 1blk h ARG 21 Ca -0.48 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 1blk h ARG 21 Cb 1.30 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.93 1blk h ARG 21 CO 0.51 -0.24 0.00 1.57 -1.51 0.00 0.00 179.97 180.30 1blk h LYS 22 N -0.42 0.00 0.13 0.20 5.09 -1.99 -2.75 116.57 116.83 1blk h LYS 22 Ca -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 60.65 60.69 1blk h LYS 22 Cb 0.32 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.65 1blk h LYS 22 CO 0.07 0.00 -0.06 -0.44 -2.09 0.00 0.00 179.45 176.92 1blk h ASP 23 N 0.00 -0.15 -1.01 7.07 3.32 -1.40 -0.96 116.42 123.29 1blk h ASP 23 Ca 0.00 0.01 0.22 0.00 0.02 0.00 0.00 57.03 57.28 1blk h ASP 23 Cb 0.03 0.04 -0.12 0.00 0.22 0.00 0.00 39.33 39.50 1blk h ASP 23 CO 0.00 0.27 0.61 0.00 -1.72 0.00 0.00 179.24 178.40 1blk h ALA 24 N -1.16 1.75 -0.49 3.45 0.00 -1.31 0.40 119.26 121.90 1blk h ALA 24 Ca -0.02 0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1blk h ALA 24 Cb 0.13 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1blk h ALA 24 CO 0.03 -0.18 -0.06 0.93 0.00 0.00 0.00 179.25 179.97 1blk h GLU 25 N 0.66 0.86 -0.33 0.00 5.08 -1.56 -1.16 114.58 118.13 1blk h GLU 25 Ca 0.61 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.67 1blk h GLU 25 Cb 1.09 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.24 1blk h GLU 25 CO -0.43 0.90 0.08 0.07 -1.00 0.00 0.00 179.01 178.64 1blk h ARG 26 N 0.79 0.48 0.06 2.33 0.11 0.12 0.23 114.38 118.49 1blk h ARG 26 Ca 0.14 -0.07 -0.00 0.00 0.10 0.00 0.00 59.98 60.14 1blk h ARG 26 Cb 0.56 -0.09 0.00 0.00 1.11 0.00 0.00 29.97 31.56 1blk h ARG 26 CO 0.03 0.44 -0.03 1.96 0.10 0.00 0.00 179.97 182.47 1blk h GLN 27 N 0.47 -0.07 -0.82 0.08 4.20 -1.12 -2.88 115.11 114.97 1blk h GLN 27 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1blk h GLN 27 Cb 0.18 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.93 1blk h GLN 27 CO -0.00 0.51 0.53 -0.07 -0.67 0.00 0.00 178.83 179.13 1blk h LEU 28 N -0.90 0.96 0.00 1.46 3.38 -1.09 -0.15 115.31 118.97 1blk h LEU 28 Ca -0.01 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1blk h LEU 28 Cb 0.62 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1blk h LEU 28 CO 0.01 0.71 0.00 0.18 0.09 0.00 0.00 178.44 179.43 1blk n LEU 29 N -4.40 0.00 -4.76 1.67 4.77 0.78 -4.47 117.00 110.60 1blk n LEU 29 Ca 0.09 0.26 -0.35 0.00 -0.03 0.00 0.00 56.01 55.98 1blk n LEU 29 Cb 0.04 -0.26 0.04 0.00 -2.33 0.00 0.00 43.42 40.91 1blk n LEU 29 CO 0.37 -0.12 0.80 0.00 -1.33 0.00 0.00 177.39 177.11 1blk s ALA 30 N -2.51 2.49 0.37 -1.18 0.00 -0.07 -4.93 121.76 115.93 1blk s ALA 30 Ca 0.16 0.86 0.27 0.00 0.00 0.00 0.00 51.96 53.26 1blk s ALA 30 Cb 0.11 -3.41 1.39 0.00 0.00 0.00 0.00 23.12 21.21 1blk s ALA 30 CO 0.24 -1.22 2.04 -1.00 0.00 0.00 0.00 175.76 175.83 1blk h PRO 31 N 0.59 0.00 -0.01 0.00 0.13 -1.86 -2.09 132.00 128.77 1blk h PRO 31 Ca -0.49 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.48 1blk h PRO 31 Cb 1.28 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 1blk h PRO 31 CO 0.54 0.13 -0.72 0.52 -0.23 0.00 0.00 178.00 178.24 1blk h MET 32 N 0.00 0.05 -3.89 0.86 2.86 -1.91 -3.39 114.93 109.50 1blk h MET 32 Ca -0.00 -0.04 -0.77 0.00 -2.06 0.00 0.00 59.70 56.83 1blk h MET 32 Cb 0.39 0.01 -0.27 0.00 0.06 0.00 0.00 31.60 31.79 1blk h MET 32 CO 0.02 0.75 -0.05 -0.80 1.06 0.00 0.00 176.91 177.88 1blk s ASN 33 N -6.84 6.41 0.56 1.22 0.02 -0.78 -4.97 114.94 110.56 1blk s ASN 33 Ca -0.01 -2.47 0.05 0.00 -1.02 0.00 0.00 52.86 49.41 1blk s ASN 33 Cb 0.12 -2.16 0.06 0.00 0.02 0.00 0.00 41.25 39.29 1blk s ASN 33 CO 0.79 -0.62 0.78 -1.59 0.02 0.00 0.00 177.10 176.47 1blk s LYS 34 N 0.51 2.35 -0.33 -0.60 0.00 -1.26 -4.38 119.74 116.04 1blk s LYS 34 Ca 0.14 -1.24 -0.29 0.00 0.00 0.00 0.00 55.97 54.58 1blk s LYS 34 Cb -0.16 -2.57 -0.13 0.00 0.00 0.00 0.00 37.83 34.97 1blk s LYS 34 CO -0.05 -0.81 1.33 0.00 0.00 0.00 0.00 175.35 175.82 1blk n ALA 35 N -2.30 -0.07 0.00 0.59 0.00 -1.26 -1.76 120.51 115.71 1blk n ALA 35 Ca 0.12 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1blk n ALA 35 Cb 0.60 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.71 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 4.45 1.07 3.72 0.00 0.00 -1.26 -4.44 105.19 108.74 1blk n GLY 36 Ca 0.33 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.81 6.70 0.20 1.61 1.04 -0.72 -3.31 113.70 118.40 1blk s SER 37 Ca 0.00 2.52 0.02 0.00 0.48 0.00 0.00 55.95 58.97 1blk s SER 37 Cb 0.00 -2.60 -0.05 0.00 0.10 0.00 0.00 66.02 63.47 1blk s SER 37 CO 0.00 -0.73 0.02 -0.36 0.98 0.00 0.00 173.24 173.16 1blk s PHE 38 N 0.83 1.30 -0.18 5.02 0.40 -1.26 -3.24 117.98 120.85 1blk s PHE 38 Ca 0.65 -1.05 -0.04 0.00 -0.60 0.00 0.00 56.93 55.89 1blk s PHE 38 Cb -0.41 -0.75 0.09 0.00 0.51 0.00 0.00 43.02 42.47 1blk s PHE 38 CO 0.34 -0.23 0.30 -0.51 0.70 0.00 0.00 175.22 175.81 1blk s LEU 39 N -3.21 -0.37 -0.71 -0.37 2.01 -0.91 -4.20 118.68 110.92 1blk s LEU 39 Ca 0.27 0.36 -0.07 0.00 0.01 0.00 0.00 54.13 54.70 1blk s LEU 39 Cb 0.06 0.79 0.19 0.00 0.01 0.00 0.00 46.19 47.24 1blk s LEU 39 CO 0.06 -0.27 0.58 -0.51 1.01 0.00 0.00 176.35 177.22 1blk s ILE 40 N 2.45 4.50 0.33 -0.59 2.07 -0.50 -0.83 121.20 128.63 1blk s ILE 40 Ca 0.05 -2.77 -0.06 0.00 -1.41 0.00 0.00 60.65 56.46 1blk s ILE 40 Cb -0.14 -3.86 -0.05 0.00 0.13 0.00 0.00 42.46 38.55 1blk s ILE 40 CO -0.11 -0.94 0.61 0.00 -1.91 0.00 0.00 174.94 172.58 1blk s ARG 41 N 0.02 3.65 0.01 3.50 1.04 0.78 -3.63 118.95 124.31 1blk s ARG 41 Ca 0.17 0.09 -0.11 0.00 -1.04 0.00 0.00 55.73 54.84 1blk s ARG 41 Cb -0.16 -2.58 -0.05 0.00 -2.04 0.00 0.00 34.95 30.11 1blk s ARG 41 CO -0.06 0.14 0.36 -1.83 -0.04 0.00 0.00 175.30 173.87 1blk s GLU 42 N -3.73 3.77 -0.17 3.89 -1.05 -0.93 0.29 118.70 120.77 1blk s GLU 42 Ca 0.45 0.21 -0.29 0.00 -0.15 0.00 0.00 54.97 55.19 1blk s GLU 42 Cb -0.11 -3.12 -0.01 0.00 -0.44 0.00 0.00 34.13 30.45 1blk s GLU 42 CO 0.31 0.65 1.15 0.45 0.95 0.00 0.00 175.26 178.78 1blk s SER 43 N -1.37 7.04 0.00 0.83 0.15 -1.19 -4.37 113.70 114.79 1blk s SER 43 Ca 0.26 1.58 0.00 0.00 0.70 0.00 0.00 55.95 58.49 1blk s SER 43 Cb -0.15 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 1blk s SER 43 CO 0.14 -0.68 0.37 -1.84 1.20 0.00 0.00 173.24 172.43 1blk n GLU 44 N 6.18 0.62 -0.35 5.44 0.28 -1.26 -2.36 120.64 129.18 1blk n GLU 44 Ca 0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.12 1blk n GLU 44 Cb 0.46 -1.25 0.00 0.00 1.43 0.00 0.00 31.44 32.07 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 0.06 0.00 -4.86 -1.84 3.41 -1.26 -5.12 113.62 104.01 1blk n SER 45 Ca 0.00 -1.60 -0.27 0.00 -0.26 0.00 0.00 58.87 56.74 1blk n SER 45 Cb 0.13 -0.12 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 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 -0.60 5.90 0.00 4.04 6.03 -0.99 -5.01 114.94 124.30 1blk s ASN 46 Ca 0.00 0.02 -0.03 0.00 -1.03 0.00 0.00 52.86 51.83 1blk s ASN 46 Cb 0.00 -1.66 -0.11 0.00 -3.03 0.00 0.00 41.25 36.44 1blk s ASN 46 CO 0.00 0.07 2.14 2.29 -2.03 0.00 0.00 177.10 179.57 1blk n LYS 47 N -0.34 1.09 -1.04 3.55 -0.00 -1.26 -4.40 118.16 115.76 1blk n LYS 47 Ca -0.08 -0.43 0.00 0.00 -0.00 0.00 0.00 58.31 57.81 1blk n LYS 47 Cb 0.54 -1.59 0.00 0.00 -0.00 0.00 0.00 35.03 33.98 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 2.30 1.15 3.98 2.58 0.00 -1.26 -4.90 105.19 109.05 1blk n GLY 48 Ca 0.18 -0.43 -0.20 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.07 4.14 0.33 4.61 0.00 -1.26 -4.32 121.76 123.19 1blk s ALA 49 Ca 0.00 -1.40 0.02 0.00 0.00 0.00 0.00 51.96 50.59 1blk s ALA 49 Cb 0.00 -1.83 -0.02 0.00 0.00 0.00 0.00 23.12 21.27 1blk s ALA 49 CO 0.00 -0.27 0.36 -0.06 0.00 0.00 0.00 175.76 175.79 1blk s PHE 50 N -2.39 1.39 0.06 0.00 0.40 -0.25 -3.17 117.98 114.03 1blk s PHE 50 Ca 0.50 -1.47 -0.10 0.00 -0.60 0.00 0.00 56.93 55.26 1blk s PHE 50 Cb -0.10 -0.41 0.01 0.00 0.51 0.00 0.00 43.02 43.03 1blk s PHE 50 CO 0.34 -0.98 0.22 -1.12 0.70 0.00 0.00 175.22 174.37 1blk s SER 51 N -3.30 0.03 -0.03 1.36 0.01 0.14 -2.75 113.70 109.16 1blk s SER 51 Ca 0.36 -0.43 -0.01 0.00 1.31 0.00 0.00 55.95 57.18 1blk s SER 51 Cb 0.01 0.32 0.03 0.00 0.21 0.00 0.00 66.02 66.60 1blk s SER 51 CO 0.23 -0.63 0.06 -0.22 0.41 0.00 0.00 173.24 173.09 1blk s LEU 52 N -2.34 0.65 -0.15 2.44 2.96 -1.24 -0.16 118.68 120.83 1blk s LEU 52 Ca -0.02 0.09 -0.06 0.00 -0.22 0.00 0.00 54.13 53.92 1blk s LEU 52 Cb 0.01 -0.04 -0.04 0.00 0.50 0.00 0.00 46.19 46.62 1blk s LEU 52 CO -0.06 -0.18 0.07 -0.44 -1.32 0.00 0.00 176.35 174.42 1blk s SER 53 N 1.54 5.75 0.02 3.68 0.01 -0.01 -1.62 113.70 123.06 1blk s SER 53 Ca -0.03 0.19 -0.02 0.00 1.31 0.00 0.00 55.95 57.39 1blk s SER 53 Cb -0.12 -1.90 -0.02 0.00 0.21 0.00 0.00 66.02 64.19 1blk s SER 53 CO -0.03 0.27 0.01 -0.69 0.41 0.00 0.00 173.24 173.21 1blk s VAL 54 N -0.18 0.11 -0.17 3.43 1.01 -1.22 -2.14 120.40 121.24 1blk s VAL 54 Ca 0.08 -0.92 -0.29 0.00 0.00 0.00 0.00 61.98 60.85 1blk s VAL 54 Cb -0.12 -0.40 -0.00 0.00 0.00 0.00 0.00 36.38 35.86 1blk s VAL 54 CO 0.01 -0.51 1.03 -0.75 0.00 0.00 0.00 175.10 174.89 1blk s LYS 55 N -1.64 4.33 -0.13 2.72 2.47 -1.20 0.02 119.74 126.31 1blk s LYS 55 Ca -0.14 1.38 -0.03 0.00 -1.56 0.00 0.00 55.97 55.63 1blk s LYS 55 Cb -0.08 -3.60 -0.03 0.00 -1.46 0.00 0.00 37.83 32.66 1blk s LYS 55 CO -0.01 -0.50 -0.03 0.34 0.16 0.00 0.00 175.35 175.32 1blk s ASP 56 N 1.18 4.94 -0.36 1.43 -1.08 0.12 -4.18 116.67 118.73 1blk s ASP 56 Ca 0.46 -0.04 -0.09 0.00 -0.52 0.00 0.00 52.55 52.37 1blk s ASP 56 Cb -0.17 -1.64 0.03 0.00 -1.46 0.00 0.00 42.92 39.68 1blk s ASP 56 CO 0.11 0.24 0.16 -0.63 0.52 0.00 0.00 175.17 175.57 1blk s ILE 57 N -0.08 4.20 0.21 4.11 -1.09 -1.26 -1.51 121.20 125.77 1blk s ILE 57 Ca 0.03 -0.98 0.07 0.00 -2.23 0.00 0.00 60.65 57.53 1blk s ILE 57 Cb -0.13 -3.35 -0.05 0.00 -1.58 0.00 0.00 42.46 37.35 1blk s ILE 57 CO 0.02 -0.20 -0.11 0.28 -1.23 0.00 0.00 174.94 173.70 1blk s THR 58 N 1.48 1.58 0.23 2.92 -1.32 -1.24 -5.04 115.64 114.26 1blk s THR 58 Ca 0.00 -2.16 0.36 0.00 -1.21 0.00 0.00 61.69 58.68 1blk s THR 58 Cb -0.19 -2.11 0.39 0.00 -1.51 0.00 0.00 72.50 69.08 1blk s THR 58 CO 0.05 -0.55 2.08 0.00 -2.21 0.00 0.00 174.62 173.99 1blk h THR 59 N 2.54 0.00 -1.95 5.08 1.03 -2.04 -3.10 112.91 114.47 1blk h THR 59 Ca -0.38 -0.26 -0.75 0.00 -0.01 0.00 0.00 66.41 65.00 1blk h THR 59 Cb 1.22 1.20 -0.26 0.00 -1.07 0.00 0.00 68.15 69.23 1blk h THR 59 CO 0.63 0.00 1.03 0.00 -0.01 0.00 0.00 175.52 177.17 1blk n GLN 60 N -2.95 2.81 0.00 0.00 6.02 -1.26 -4.98 117.38 117.02 1blk n GLN 60 Ca -0.01 -3.48 0.00 0.00 -0.01 0.00 0.00 57.00 53.50 1blk n GLN 60 Cb 0.19 -2.27 0.00 0.00 1.02 0.00 0.00 30.24 29.18 1blk n GLN 60 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1blk n GLY 61 N -0.44 -1.28 3.73 1.08 0.00 -1.17 -4.91 105.19 102.20 1blk n GLY 61 Ca 0.54 -1.59 -0.40 0.00 0.00 0.00 0.00 46.02 44.57 1blk n GLY 61 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1blk s GLU 62 N -2.63 4.48 0.30 1.61 2.12 -1.26 -3.68 118.70 119.63 1blk s GLU 62 Ca 0.00 1.03 0.05 0.00 0.36 0.00 0.00 54.97 56.42 1blk s GLU 62 Cb 0.00 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 30.98 1blk s GLU 62 CO 0.00 0.20 0.19 1.33 -0.54 0.00 0.00 175.26 176.44 1blk n VAL 63 N 3.17 0.00 -2.42 3.70 0.24 -0.57 -5.03 118.33 117.42 1blk n VAL 63 Ca -0.02 -2.00 0.00 0.00 -2.04 0.00 0.00 64.34 60.28 1blk n VAL 63 Cb 0.51 0.90 0.00 0.00 -1.47 0.00 0.00 33.84 33.78 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 -0.61 0.00 -4.07 3.34 0.31 -1.26 0.14 118.33 116.19 1blk n VAL 64 Ca 0.02 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.27 1blk n VAL 64 Cb 0.50 -0.70 -0.09 0.00 -0.91 0.00 0.00 33.84 32.64 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 1.87 0.76 -0.27 5.55 -0.14 0.10 -3.83 119.74 123.78 1blk s LYS 65 Ca 0.00 -1.24 -0.03 0.00 -1.36 0.00 0.00 55.97 53.34 1blk s LYS 65 Cb 0.00 0.25 0.10 0.00 -1.68 0.00 0.00 37.83 36.50 1blk s LYS 65 CO 0.00 -0.19 0.17 -1.01 -0.76 0.00 0.00 175.35 173.56 1blk s HIS 66 N -3.95 0.07 0.00 3.18 3.76 -1.25 -3.38 115.29 113.72 1blk s HIS 66 Ca 0.12 -0.57 0.00 0.00 -0.15 0.00 0.00 55.06 54.46 1blk s HIS 66 Cb 0.07 -0.73 0.00 0.00 1.11 0.00 0.00 32.58 33.03 1blk s HIS 66 CO -0.06 -0.81 0.00 0.66 -0.85 0.00 0.00 174.74 173.68 1blk n TYR 67 N 5.27 -1.61 -3.15 1.40 4.01 -0.64 -4.97 117.16 117.47 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 0.44 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.46 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 -0.37 0.56 -0.23 -0.72 0.00 -1.26 -3.70 119.74 114.02 1blk s LYS 68 Ca 0.00 0.93 -0.19 0.00 0.00 0.00 0.00 55.97 56.70 1blk s LYS 68 Cb 0.00 0.51 -0.03 0.00 0.00 0.00 0.00 37.83 38.31 1blk s LYS 68 CO 0.00 -0.67 0.58 0.96 0.00 0.00 0.00 175.35 176.22 1blk s ILE 69 N 2.86 5.04 0.59 3.79 -0.00 -1.11 -4.32 121.20 128.05 1blk s ILE 69 Ca 0.19 1.05 0.05 0.00 -0.00 0.00 0.00 60.65 61.94 1blk s ILE 69 Cb -0.14 -3.89 0.08 0.00 -0.00 0.00 0.00 42.46 38.51 1blk s ILE 69 CO -0.21 0.10 0.82 -0.13 -0.00 0.00 0.00 174.94 175.51 1blk s ARG 70 N 2.08 2.23 -0.11 0.37 0.52 -0.80 -1.09 118.95 122.14 1blk s ARG 70 Ca 0.25 -1.31 -0.03 0.00 -0.52 0.00 0.00 55.73 54.13 1blk s ARG 70 Cb -0.16 -2.55 0.04 0.00 0.52 0.00 0.00 34.95 32.81 1blk s ARG 70 CO 0.09 -0.93 0.05 -1.54 0.02 0.00 0.00 175.30 173.00 1blk s SER 71 N -4.61 1.84 0.26 0.23 1.04 -1.26 -3.13 113.70 108.08 1blk s SER 71 Ca 0.62 -0.29 -0.08 0.00 0.48 0.00 0.00 55.95 56.68 1blk s SER 71 Cb -0.07 -0.30 -0.06 0.00 0.10 0.00 0.00 66.02 65.69 1blk s SER 71 CO 0.40 -0.28 0.55 -0.76 0.98 0.00 0.00 173.24 174.13 1blk s LEU 72 N 2.07 4.11 0.25 2.42 2.01 -0.93 -4.97 118.68 123.64 1blk s LEU 72 Ca 0.03 0.84 0.18 0.00 0.01 0.00 0.00 54.13 55.19 1blk s LEU 72 Cb -0.14 -3.63 0.93 0.00 0.01 0.00 0.00 46.19 43.36 1blk s LEU 72 CO -0.06 -0.13 1.56 -0.90 1.01 0.00 0.00 176.35 177.82 1blk n ASP 73 N -0.50 0.47 -0.29 2.29 5.68 -1.26 -1.26 116.55 121.68 1blk n ASP 73 Ca -0.00 0.69 0.13 0.00 -0.50 0.00 0.00 54.79 55.11 1blk n ASP 73 Cb 0.53 -0.76 0.44 0.00 -1.14 0.00 0.00 41.12 40.19 1blk n ASP 73 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1blk n ASN 74 N -2.10 1.07 -0.96 -1.12 6.94 -1.26 -4.96 115.26 112.87 1blk n ASN 74 Ca -0.00 -1.01 0.00 0.00 -0.02 0.00 0.00 54.58 53.55 1blk n ASN 74 Cb 0.07 0.08 0.00 0.00 -2.36 0.00 0.00 39.78 37.57 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 1.29 0.07 3.84 4.83 0.00 -0.39 -5.11 105.19 109.72 1blk n GLY 75 Ca 0.14 -0.39 -0.06 0.00 0.00 0.00 0.00 46.02 45.71 1blk n GLY 75 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1blk s GLY 76 N -1.85 0.25 0.02 -0.02 0.00 -1.24 -4.38 107.32 100.11 1blk s GLY 76 Ca 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 44.72 44.16 1blk s GLY 76 CO 0.00 0.81 -0.05 -0.19 0.00 0.00 0.00 173.10 173.68 1blk s TYR 77 N -2.28 0.40 -0.10 1.90 1.51 0.20 -2.19 117.35 116.79 1blk s TYR 77 Ca 0.18 -0.28 -0.16 0.00 -1.01 0.00 0.00 57.07 55.79 1blk s TYR 77 Cb -0.04 -0.25 0.04 0.00 -0.11 0.00 0.00 41.96 41.59 1blk s TYR 77 CO 0.09 -0.07 0.40 1.52 -1.11 0.00 0.00 175.55 176.39 1blk s TYR 78 N -0.75 -0.38 -0.05 2.71 -0.85 -1.18 -0.57 117.35 116.27 1blk s TYR 78 Ca -0.06 0.82 -0.02 0.00 -0.52 0.00 0.00 57.07 57.29 1blk s TYR 78 Cb -0.06 0.16 -0.02 0.00 0.38 0.00 0.00 41.96 42.42 1blk s TYR 78 CO -0.00 -0.32 -0.07 0.44 -1.52 0.00 0.00 175.55 174.08 1blk n ILE 79 N 2.12 0.30 -4.47 -3.49 -5.35 -1.25 -1.91 119.36 105.30 1blk n ILE 79 Ca -0.17 -0.08 -0.33 0.00 -0.27 0.00 0.00 62.75 61.90 1blk n ILE 79 Cb 0.57 -1.50 -0.14 0.00 -1.74 0.00 0.00 39.64 36.82 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 -5.41 3.98 0.00 7.28 0.01 -1.26 -4.87 113.70 113.44 1blk s SER 80 Ca -0.08 -0.38 0.07 0.00 1.31 0.00 0.00 55.95 56.87 1blk s SER 80 Cb 0.03 -1.63 0.34 0.00 0.21 0.00 0.00 66.02 64.97 1blk s SER 80 CO 0.10 0.10 1.08 -2.65 0.41 0.00 0.00 173.24 172.27 1blk n PRO 81 N 3.99 0.09 0.00 12.44 -0.02 -1.26 -0.71 135.00 149.52 1blk n PRO 81 Ca -0.18 0.23 0.15 0.00 -2.02 0.00 0.00 63.50 61.68 1blk n PRO 81 Cb 0.52 -1.50 0.84 0.00 -0.02 0.00 0.00 33.50 33.34 1blk n PRO 81 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1blk n ARG 82 N -1.30 0.71 -3.65 -0.52 -4.01 -1.26 -4.68 116.66 101.95 1blk n ARG 82 Ca 0.03 -0.02 -0.05 0.00 -1.04 0.00 0.00 57.85 56.77 1blk n ARG 82 Cb 0.06 -1.50 -0.07 0.00 -3.04 0.00 0.00 32.46 27.91 1blk n ARG 82 CO 0.00 0.00 0.00 0.96 -3.04 0.00 0.00 177.63 175.55 1blk s ILE 83 N -2.30 -0.78 0.25 8.89 -4.36 0.11 -5.17 121.20 117.83 1blk s ILE 83 Ca 0.37 0.08 0.11 0.00 -0.26 0.00 0.00 60.65 60.96 1blk s ILE 83 Cb 0.21 -0.83 -0.05 0.00 1.25 0.00 0.00 42.46 43.04 1blk s ILE 83 CO 0.42 0.03 -0.17 -0.89 0.24 0.00 0.00 174.94 174.57 1blk s THR 84 N 2.69 2.66 0.26 8.37 2.01 -1.26 -3.85 115.64 126.52 1blk s THR 84 Ca -0.04 -2.18 0.02 0.00 0.31 0.00 0.00 61.69 59.80 1blk s THR 84 Cb -0.12 -2.37 -0.04 0.00 0.01 0.00 0.00 72.50 69.99 1blk s THR 84 CO -0.16 -0.31 0.20 -0.36 -0.69 0.00 0.00 174.62 173.30 1blk s PHE 85 N -2.22 1.41 -0.13 4.92 0.08 0.27 -4.98 117.98 117.32 1blk s PHE 85 Ca 0.28 -1.49 0.18 0.00 0.12 0.00 0.00 56.93 56.01 1blk s PHE 85 Cb -0.06 -0.61 -0.23 0.00 -0.57 0.00 0.00 43.02 41.54 1blk s PHE 85 CO 0.15 -0.75 0.41 -0.35 -0.10 0.00 0.00 175.22 174.58 1blk n PRO 86 N -0.42 0.66 -4.07 0.24 -0.04 -1.26 -0.63 135.00 129.48 1blk n PRO 86 Ca 0.04 0.05 -0.10 0.00 -0.04 0.00 0.00 63.50 63.46 1blk n PRO 86 Cb 0.64 -1.63 -0.08 0.00 -0.04 0.00 0.00 33.50 32.40 1blk n PRO 86 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1blk s THR 87 N -2.79 0.04 -0.87 0.52 -1.32 -1.26 -3.58 115.64 106.37 1blk s THR 87 Ca -0.07 -1.66 0.22 0.00 -1.21 0.00 0.00 61.69 58.97 1blk s THR 87 Cb 0.08 -2.15 0.20 0.00 -1.51 0.00 0.00 72.50 69.13 1blk s THR 87 CO 0.84 -0.17 1.69 0.18 -2.21 0.00 0.00 174.62 174.95 1blk n LEU 88 N -0.25 0.23 -0.18 9.08 4.77 -1.26 -2.24 117.00 127.16 1blk n LEU 88 Ca -0.03 0.54 -0.08 0.00 -0.03 0.00 0.00 56.01 56.41 1blk n LEU 88 Cb 0.64 -0.49 0.07 0.00 -2.33 0.00 0.00 43.42 41.30 1blk n LEU 88 CO 0.27 -0.22 0.82 0.06 -1.33 0.00 0.00 177.39 176.99 1blk h GLN 89 N 0.00 0.98 0.00 3.23 -0.00 -1.98 0.75 115.11 118.09 1blk h GLN 89 Ca 0.00 -0.31 -0.07 0.00 -0.00 0.00 0.00 58.65 58.27 1blk h GLN 89 Cb 0.41 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.48 27.79 1blk h GLN 89 CO 0.00 0.98 -0.33 0.00 -0.00 0.00 0.00 178.83 179.48 1blk h ALA 90 N 1.07 0.79 -0.05 0.06 0.00 -1.87 -0.00 119.26 119.26 1blk h ALA 90 Ca 0.16 -0.30 -0.19 0.00 0.00 0.00 0.00 54.91 54.58 1blk h ALA 90 Cb 0.56 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.31 1blk h ALA 90 CO 0.03 0.41 -0.70 1.25 0.00 0.00 0.00 179.25 180.25 1blk h LEU 91 N 0.00 0.70 -0.15 0.00 6.46 -1.33 -2.68 115.31 118.31 1blk h LEU 91 Ca -0.00 -0.70 -0.21 0.00 -0.12 0.00 0.00 57.88 56.84 1blk h LEU 91 Cb 1.25 -0.21 0.01 0.00 -0.73 0.00 0.00 40.66 40.98 1blk h LEU 91 CO 0.04 1.30 -0.73 0.58 -0.62 0.00 0.00 178.44 179.01 1blk h VAL 92 N 0.15 1.29 -0.42 1.05 2.07 -0.83 -2.73 116.25 116.83 1blk h VAL 92 Ca -0.07 -1.94 0.00 0.00 0.82 0.00 0.00 66.70 65.51 1blk h VAL 92 Cb 1.36 2.01 -0.02 0.00 -1.52 0.00 0.00 31.29 33.12 1blk h VAL 92 CO 0.14 0.61 0.27 0.06 0.02 0.00 0.00 177.57 178.67 1blk h GLN 93 N 0.48 0.56 -0.19 1.57 -0.00 -1.07 0.50 115.11 116.95 1blk h GLN 93 Ca -0.05 -0.04 -0.07 0.00 -0.00 0.00 0.00 58.65 58.49 1blk h GLN 93 Cb 1.36 -0.12 -0.00 0.00 -0.00 0.00 0.00 27.48 28.72 1blk h GLN 93 CO 0.15 0.38 -0.16 1.25 -0.00 0.00 0.00 178.83 180.45 1blk h HIS 94 N 0.57 0.53 0.00 0.06 2.76 -1.32 -0.41 115.15 117.34 1blk h HIS 94 Ca 0.15 -0.15 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1blk h HIS 94 Cb -0.05 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 28.80 1blk h HIS 94 CO 0.00 0.79 0.00 0.66 -1.30 0.00 0.00 177.93 178.08 1blk n TYR 95 N -4.50 0.03 1.28 5.26 4.01 -0.69 -2.04 117.16 120.50 1blk n TYR 95 Ca -0.05 0.01 0.14 0.00 -0.16 0.00 0.00 57.90 57.83 1blk n TYR 95 Cb 0.38 -0.51 0.69 0.00 -0.31 0.00 0.00 39.34 39.58 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 -1.52 0.00 -0.09 7.72 7.64 0.17 -1.47 113.62 126.06 1blk n SER 96 Ca 0.04 -0.05 -0.15 0.00 1.01 0.00 0.00 58.87 59.73 1blk n SER 96 Cb 0.22 -0.31 -0.08 0.00 -1.01 0.00 0.00 64.21 63.03 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 -1.31 0.45 -3.64 1.43 4.01 -0.87 -4.57 118.16 113.66 1blk n LYS 97 Ca 0.12 0.12 -0.15 0.00 -0.51 0.00 0.00 58.31 57.90 1blk n LYS 97 Cb 0.23 -1.32 -0.08 0.00 -0.51 0.00 0.00 35.03 33.35 1blk n LYS 97 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 1blk s LYS 98 N -2.36 0.80 -1.57 1.97 2.36 -1.21 -4.99 119.74 114.73 1blk s LYS 98 Ca -0.25 0.51 -0.10 0.00 -2.55 0.00 0.00 55.97 53.58 1blk s LYS 98 Cb 0.07 0.38 -0.05 0.00 -1.05 0.00 0.00 37.83 37.18 1blk s LYS 98 CO 0.40 -0.17 2.84 0.41 1.55 0.00 0.00 175.35 180.38 1blk n GLY 99 N 2.00 4.41 0.53 5.54 0.00 -1.26 -4.35 105.19 112.05 1blk n GLY 99 Ca -0.16 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.26 1blk n GLY 99 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1blk n ASP 100 N 3.43 0.73 0.00 1.61 -0.08 -1.26 -3.95 116.55 117.04 1blk n ASP 100 Ca 0.75 -1.30 0.00 0.00 -1.51 0.00 0.00 54.79 52.73 1blk n ASP 100 Cb 0.24 -0.33 0.00 0.00 2.34 0.00 0.00 41.12 43.38 1blk n ASP 100 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1blk n GLY 101 N 0.21 0.00 0.00 0.27 0.00 -1.26 -5.09 105.19 99.32 1blk n GLY 101 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.06 0.00 0.00 0.99 4.77 -1.25 -5.06 117.00 116.39 1blk n LEU 102 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1blk n LEU 102 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1blk n LEU 102 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.06 1blk s GLN 104 N -0.83 0.22 1.09 0.00 1.11 -1.26 -4.90 119.66 115.10 1blk s GLN 104 Ca 0.00 0.64 -0.14 0.00 0.01 0.00 0.00 55.36 55.87 1blk s GLN 104 Cb 0.00 -0.07 0.24 0.00 -1.01 0.00 0.00 33.01 32.16 1blk s GLN 104 CO 0.00 -0.19 1.07 -1.59 0.01 0.00 0.00 175.29 174.59 1blk s LYS 105 N 1.60 -0.33 -0.20 2.91 -2.85 -1.26 -4.68 119.74 114.94 1blk s LYS 105 Ca -0.07 0.45 -0.29 0.00 -1.00 0.00 0.00 55.97 55.06 1blk s LYS 105 Cb -0.11 -1.65 0.00 0.00 -2.06 0.00 0.00 37.83 34.01 1blk s LYS 105 CO -0.09 -3.23 1.06 -0.51 0.10 0.00 0.00 175.35 172.68 1blk s LEU 106 N -6.77 4.14 -0.07 2.77 1.43 -0.54 -4.08 118.68 115.56 1blk s LEU 106 Ca 0.67 1.45 -0.08 0.00 -1.03 0.00 0.00 54.13 55.14 1blk s LEU 106 Cb -0.18 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.47 1blk s LEU 106 CO 0.59 -0.64 -0.16 0.35 0.23 0.00 0.00 176.35 176.73 1blk n THR 107 N 5.17 0.77 -3.61 5.49 -2.24 -1.21 -4.77 114.28 113.87 1blk n THR 107 Ca 0.12 0.30 -0.28 0.00 -2.27 0.00 0.00 64.05 61.91 1blk n THR 107 Cb 0.46 -1.85 -0.16 0.00 -2.10 0.00 0.00 70.33 66.69 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 -6.45 0.86 -0.73 3.22 1.43 -1.26 -4.98 118.68 110.77 1blk s LEU 108 Ca -0.13 -1.12 -0.26 0.00 -1.03 0.00 0.00 54.13 51.59 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 0.19 -0.40 2.30 -2.84 0.23 0.00 0.00 176.35 175.83 1blk s PRO 109 N 2.00 1.93 0.00 1.29 0.02 -1.26 -2.67 135.00 136.30 1blk s PRO 109 Ca 0.06 0.58 0.00 0.00 0.02 0.00 0.00 61.00 61.66 1blk s PRO 109 Cb -0.16 -4.76 0.00 0.00 0.02 0.00 0.00 34.50 29.60 1blk s PRO 109 CO -0.25 -3.91 0.00 0.00 -0.33 0.00 0.00 177.00 172.52 1blk n VAL 111 N 0.00 0.00 -0.06 0.00 0.24 -1.26 -4.94 118.33 112.31 1blk n VAL 111 Ca 0.00 -0.13 -0.07 0.00 -2.04 0.00 0.00 64.34 62.10 1blk n VAL 111 Cb 0.00 0.14 -0.02 0.00 -1.47 0.00 0.00 33.84 32.48 1blk n VAL 111 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1blk n ASN 112 N -1.03 1.62 -4.55 -1.34 5.15 -1.26 -4.86 115.26 108.99 1blk n ASN 112 Ca -0.01 0.27 -0.40 0.00 -0.60 0.00 0.00 54.58 53.84 1blk n ASN 112 Cb 0.08 -0.65 -0.03 0.00 -0.53 0.00 0.00 39.78 38.65 1blk n ASN 112 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1blk s LEU 113 N -7.47 3.27 0.00 1.20 0.20 -1.26 -5.23 118.68 109.38 1blk s LEU 113 Ca -0.22 0.08 0.17 0.00 0.69 0.00 0.00 54.13 54.85 1blk s LEU 113 Cb 0.03 -2.64 1.01 0.00 -0.43 0.00 0.00 46.19 44.16 1blk s LEU 113 CO 0.32 -2.08 1.42 0.00 -0.29 0.00 0.00 176.35 175.72