#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yoc n SER 2 N 0.00 1.63 -0.05 6.12 2.88 -1.26 -4.75 113.62 118.19 1yoc n SER 2 Ca 0.00 0.82 -0.10 0.00 -1.33 0.00 0.00 58.87 58.26 1yoc n SER 2 Cb 0.00 -1.50 -0.03 0.00 -0.75 0.00 0.00 64.21 61.93 1yoc n SER 2 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1yoc h GLN 3 N 0.53 0.28 -0.64 -1.46 7.50 -1.93 0.44 115.11 119.84 1yoc h GLN 3 Ca -0.50 -0.02 -0.07 0.00 0.50 0.00 0.00 58.65 58.56 1yoc h GLN 3 Cb 1.35 -0.06 -0.03 0.00 0.05 0.00 0.00 27.48 28.79 1yoc h GLN 3 CO 0.52 0.20 0.13 1.98 -1.50 0.00 0.00 178.83 180.16 1yoc h MET 4 N 0.28 1.02 -0.77 1.46 4.05 -1.91 -1.19 114.93 117.87 1yoc h MET 4 Ca 0.08 -0.25 -0.04 0.00 -0.28 0.00 0.00 59.70 59.21 1yoc h MET 4 Cb -0.02 -0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 30.62 1yoc h MET 4 CO -0.02 0.92 0.33 0.52 0.23 0.00 0.00 176.91 178.90 1yoc h MET 5 N 0.97 1.13 -0.25 0.39 2.86 -1.72 0.14 114.93 118.45 1yoc h MET 5 Ca 0.20 -0.19 0.05 0.00 -2.06 0.00 0.00 59.70 57.70 1yoc h MET 5 Cb 0.38 -0.19 -0.04 0.00 0.06 0.00 0.00 31.60 31.80 1yoc h MET 5 CO 0.01 0.90 -0.02 1.96 1.06 0.00 0.00 176.91 180.81 1yoc h GLN 6 N 1.10 0.04 0.12 1.72 4.20 0.46 0.35 115.11 123.09 1yoc h GLN 6 Ca 0.26 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.96 1yoc h GLN 6 Cb 0.17 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1yoc h GLN 6 CO -0.03 0.03 -0.09 1.98 -0.67 0.00 0.00 178.83 180.06 1yoc h MET 7 N 0.05 -0.20 -0.54 1.46 4.05 -0.84 -1.01 114.93 117.89 1yoc h MET 7 Ca 0.12 0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.60 1yoc h MET 7 Cb 0.16 0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 30.97 1yoc h MET 7 CO -0.22 -0.14 0.29 -0.92 0.23 0.00 0.00 176.91 176.15 1yoc h TYR 8 N -0.21 0.53 -0.94 1.39 3.20 -0.25 -2.06 116.97 118.63 1yoc h TYR 8 Ca -0.01 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.90 1yoc h TYR 8 Cb 0.19 -0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.25 1yoc h TYR 8 CO -0.09 0.26 0.62 1.96 -1.64 0.00 0.00 178.16 179.27 1yoc h GLN 9 N 0.55 1.23 -0.07 1.82 1.08 -0.03 -1.26 115.11 118.43 1yoc h GLN 9 Ca 0.23 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.34 1yoc h GLN 9 Cb 0.12 -0.28 -0.00 0.00 -0.05 0.00 0.00 27.48 27.27 1yoc h GLN 9 CO -0.15 0.81 -0.02 0.37 -0.95 0.00 0.00 178.83 178.89 1yoc h GLN 10 N 1.26 0.14 0.00 1.46 4.15 -0.62 -3.35 115.11 118.14 1yoc h GLN 10 Ca 0.35 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.72 1yoc h GLN 10 Cb -0.12 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.57 1yoc h GLN 10 CO -0.09 0.48 -1.29 1.33 -1.93 0.00 0.00 178.83 177.33 1yoc n VAL 11 N -4.80 0.24 0.00 2.39 0.24 -0.83 -5.09 118.33 110.48 1yoc n VAL 11 Ca -0.07 -0.39 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 1yoc n VAL 11 Cb 0.23 0.02 0.00 0.00 -1.47 0.00 0.00 33.84 32.62 1yoc n VAL 11 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1yoc n GLY 12 N 1.29 -0.68 0.25 7.63 0.00 -0.48 -4.27 105.19 108.93 1yoc n GLY 12 Ca -0.00 -1.61 0.01 0.00 0.00 0.00 0.00 46.02 44.42 1yoc n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yoc h PRO 13 N 0.00 0.51 -0.46 1.61 0.13 -1.88 -1.85 132.00 130.05 1yoc h PRO 13 Ca 0.00 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 1yoc h PRO 13 Cb 0.00 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 30.99 1yoc h PRO 13 CO 0.00 0.33 0.26 0.00 -0.23 0.00 0.00 178.00 178.37 1yoc h ALA 14 N 1.43 0.59 -0.20 -0.56 0.00 -1.85 -0.82 119.26 117.85 1yoc h ALA 14 Ca 0.33 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.99 1yoc h ALA 14 Cb 0.38 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1yoc h ALA 14 CO -0.28 0.09 -0.59 0.37 0.00 0.00 0.00 179.25 178.83 1yoc h GLN 15 N 0.61 0.64 -0.71 0.00 5.75 -1.71 -2.72 115.11 116.97 1yoc h GLN 15 Ca 0.16 -0.43 -0.01 0.00 -0.15 0.00 0.00 58.65 58.22 1yoc h GLN 15 Cb 0.02 0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.60 1yoc h GLN 15 CO -0.03 1.05 0.40 0.35 -2.65 0.00 0.00 178.83 177.96 1yoc h PHE 16 N 0.48 0.95 -0.67 3.99 3.57 -1.20 -0.36 116.94 123.70 1yoc h PHE 16 Ca -0.00 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 1yoc h PHE 16 Cb 1.17 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 1yoc h PHE 16 CO 0.06 0.65 0.34 0.77 -2.23 0.00 0.00 178.31 177.89 1yoc h SER 17 N 0.98 0.86 -0.16 0.41 0.02 -0.90 0.16 113.55 114.92 1yoc h SER 17 Ca 0.25 -0.12 -0.11 0.00 -0.84 0.00 0.00 61.79 60.97 1yoc h SER 17 Cb -0.00 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 1yoc h SER 17 CO -0.04 0.74 -0.25 0.00 -1.14 0.00 0.00 176.83 176.13 1yoc h ALA 18 N 1.16 0.97 -0.20 3.77 0.00 -1.08 -2.83 119.26 121.04 1yoc h ALA 18 Ca 0.23 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1yoc h ALA 18 Cb 0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1yoc h ALA 18 CO -0.03 0.60 -0.04 0.52 0.00 0.00 0.00 179.25 180.30 1yoc h MET 19 N 0.55 0.39 -0.53 0.00 2.07 -0.45 -2.61 114.93 114.36 1yoc h MET 19 Ca 0.07 -0.15 -0.01 0.00 -2.07 0.00 0.00 59.70 57.55 1yoc h MET 19 Cb 0.72 -0.02 -0.03 0.00 -1.87 0.00 0.00 31.60 30.40 1yoc h MET 19 CO 0.06 0.63 0.27 0.82 1.07 0.00 0.00 176.91 179.75 1yoc h ILE 20 N 0.12 1.17 0.00 -1.22 1.08 -0.94 0.24 117.51 117.96 1yoc h ILE 20 Ca 0.05 -0.46 -0.01 0.00 -0.39 0.00 0.00 64.86 64.06 1yoc h ILE 20 Cb 0.48 0.48 -0.00 0.00 -3.07 0.00 0.00 36.82 34.71 1yoc h ILE 20 CO 0.02 0.19 -0.05 1.23 -0.69 0.00 0.00 178.15 178.86 1yoc h GLY 21 N 0.82 0.00 0.36 5.37 0.00 -1.38 -0.10 103.07 108.15 1yoc h GLY 21 Ca 0.19 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.35 1yoc h GLY 21 CO -0.03 0.00 -0.80 -1.61 0.00 0.00 0.00 176.54 174.10 1yoc h GLN 22 N 0.00 0.16 -0.80 4.80 4.15 -0.37 -3.18 115.11 119.88 1yoc h GLN 22 Ca -0.00 -0.27 -0.05 0.00 0.77 0.00 0.00 58.65 59.10 1yoc h GLN 22 Cb 0.37 0.10 -0.04 0.00 0.21 0.00 0.00 27.48 28.12 1yoc h GLN 22 CO 0.01 1.13 0.32 0.74 -1.93 0.00 0.00 178.83 179.10 1yoc h PHE 23 N -0.62 1.21 -2.74 3.99 0.04 -0.18 -3.35 116.94 115.30 1yoc h PHE 23 Ca -0.17 -0.09 -0.60 0.00 2.80 0.00 0.00 57.97 59.91 1yoc h PHE 23 Cb 1.45 -0.36 -0.40 0.00 2.20 0.00 0.00 35.95 38.84 1yoc h PHE 23 CO 0.19 0.91 -0.81 0.00 -0.60 0.00 0.00 178.31 178.01 1yoc s ALA 24 N -5.56 1.94 0.41 2.45 0.00 -0.09 -5.03 121.76 115.88 1yoc s ALA 24 Ca -0.12 -2.60 0.22 0.00 0.00 0.00 0.00 51.96 49.46 1yoc s ALA 24 Cb 0.16 -1.79 1.22 0.00 0.00 0.00 0.00 23.12 22.71 1yoc s ALA 24 CO 0.84 -2.05 1.70 -1.35 0.00 0.00 0.00 175.76 174.90 1yoc h PRO 25 N 6.26 0.26 0.00 0.00 0.11 -1.69 -1.39 132.00 135.55 1yoc h PRO 25 Ca 0.11 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.20 1yoc h PRO 25 Cb 0.90 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.95 1yoc h PRO 25 CO 0.44 0.17 -0.04 -0.92 -0.21 0.00 0.00 178.00 177.45 1yoc h TYR 26 N 0.27 0.00 0.00 0.65 3.20 -1.94 0.44 116.97 119.60 1yoc h TYR 26 Ca 0.69 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.50 1yoc h TYR 26 Cb 1.92 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 40.18 1yoc h TYR 26 CO -0.00 0.04 -0.29 0.74 -1.64 0.00 0.00 178.16 177.00 1yoc h PHE 27 N 0.00 0.00 0.00 -3.82 0.04 -1.55 -2.52 116.94 109.08 1yoc h PHE 27 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1yoc h PHE 27 Cb 0.11 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.26 1yoc h PHE 27 CO 0.00 0.29 0.00 0.00 -0.60 0.00 0.00 178.31 178.00 1yoc h ALA 28 N 1.71 1.00 0.00 2.45 0.00 -1.05 -2.44 119.26 120.92 1yoc h ALA 28 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yoc h ALA 28 Cb 0.61 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1yoc h ALA 28 CO 0.04 0.00 -0.01 0.66 0.00 0.00 0.00 179.25 179.94 1yoc h SER 29 N 0.00 0.00 -0.17 0.00 4.64 -1.55 -1.65 113.55 114.82 1yoc h SER 29 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yoc h SER 29 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1yoc h SER 29 CO 0.00 0.01 0.00 2.30 -0.87 0.00 0.00 176.83 178.27 1yoc n ILE 30 N -3.20 0.29 -3.75 0.95 -5.35 -0.92 -4.82 119.36 102.56 1yoc n ILE 30 Ca -0.03 -0.64 -0.27 0.00 -0.27 0.00 0.00 62.75 61.54 1yoc n ILE 30 Cb 0.10 1.11 0.02 0.00 -1.74 0.00 0.00 39.64 39.13 1yoc n ILE 30 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1yoc n ALA 31 N 0.98 -2.28 -1.67 -1.28 0.00 -0.62 -4.39 120.51 111.25 1yoc n ALA 31 Ca 0.12 -0.22 -0.34 0.00 0.00 0.00 0.00 53.44 53.00 1yoc n ALA 31 Cb 0.45 -2.95 0.02 0.00 0.00 0.00 0.00 19.45 16.96 1yoc n ALA 31 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1yoc s PRO 32 N -6.08 3.20 -0.15 0.00 0.04 -1.26 -4.42 135.00 126.33 1yoc s PRO 32 Ca 0.23 1.47 -0.01 0.00 0.04 0.00 0.00 61.00 62.73 1yoc s PRO 32 Cb -0.08 -2.00 0.04 0.00 0.04 0.00 0.00 34.50 32.51 1yoc s PRO 32 CO 0.85 -0.95 -0.02 -0.65 0.04 0.00 0.00 177.00 176.28 1yoc s GLN 33 N -3.65 1.02 0.37 4.56 -1.52 0.30 -4.81 119.66 115.94 1yoc s GLN 33 Ca 0.69 -0.33 -0.27 0.00 -1.95 0.00 0.00 55.36 53.50 1yoc s GLN 33 Cb -0.21 -1.78 -0.09 0.00 -0.22 0.00 0.00 33.01 30.71 1yoc s GLN 33 CO 0.32 -0.46 1.26 -0.06 -0.25 0.00 0.00 175.29 176.11 1yoc s PHE 34 N 1.78 3.00 -0.19 0.91 0.08 -1.26 -1.24 117.98 121.06 1yoc s PHE 34 Ca 0.01 1.47 -0.04 0.00 0.12 0.00 0.00 56.93 58.49 1yoc s PHE 34 Cb -0.15 -3.58 -0.10 0.00 -0.57 0.00 0.00 43.02 38.62 1yoc s PHE 34 CO -0.07 -1.73 -0.20 0.28 -0.10 0.00 0.00 175.22 173.40 1yoc n VAL 35 N 0.40 1.04 -3.67 -0.44 0.31 0.29 -4.65 118.33 111.62 1yoc n VAL 35 Ca 0.02 -0.33 -0.15 0.00 -0.01 0.00 0.00 64.34 63.88 1yoc n VAL 35 Cb 0.44 -1.43 -0.08 0.00 -0.91 0.00 0.00 33.84 31.86 1yoc n VAL 35 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1yoc s GLU 36 N -2.35 0.74 -0.11 5.55 2.12 -0.95 -4.98 118.70 118.71 1yoc s GLU 36 Ca -0.25 0.43 -0.05 0.00 0.36 0.00 0.00 54.97 55.46 1yoc s GLU 36 Cb 0.08 0.35 0.05 0.00 0.26 0.00 0.00 34.13 34.87 1yoc s GLU 36 CO 0.38 -0.16 0.24 -1.17 -0.54 0.00 0.00 175.26 174.01 1yoc s LEU 37 N -0.41 0.12 0.24 2.70 2.96 -1.26 -0.53 118.68 122.50 1yoc s LEU 37 Ca -0.06 0.53 -0.19 0.00 -0.22 0.00 0.00 54.13 54.19 1yoc s LEU 37 Cb -0.03 0.68 0.03 0.00 0.50 0.00 0.00 46.19 47.37 1yoc s LEU 37 CO 0.04 -0.20 0.63 0.00 -1.32 0.00 0.00 176.35 175.50 1yoc s ARG 38 N 1.76 1.60 0.10 1.98 1.70 -0.49 -5.03 118.95 120.58 1yoc s ARG 38 Ca -0.05 -0.93 -0.34 0.00 -0.47 0.00 0.00 55.73 53.95 1yoc s ARG 38 Cb -0.11 0.57 -0.14 0.00 -0.57 0.00 0.00 34.95 34.70 1yoc s ARG 38 CO -0.08 -0.71 1.63 -2.30 -1.08 0.00 0.00 175.30 172.76 1yoc n PRO 39 N -0.41 2.12 -0.94 3.89 -0.02 -1.26 -1.53 135.00 136.84 1yoc n PRO 39 Ca -0.07 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1yoc n PRO 39 Cb 0.61 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 1yoc n PRO 39 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yoc n GLY 40 N 3.60 0.63 3.64 -1.23 0.00 -1.26 -5.02 105.19 105.54 1yoc n GLY 40 Ca 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.13 1yoc n GLY 40 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1yoc s TYR 41 N -2.43 -0.89 -0.01 1.61 5.04 -0.58 -0.96 117.35 119.13 1yoc s TYR 41 Ca 0.00 1.83 0.01 0.00 -2.44 0.00 0.00 57.07 56.47 1yoc s TYR 41 Cb 0.00 0.51 0.00 0.00 0.35 0.00 0.00 41.96 42.82 1yoc s TYR 41 CO 0.00 -0.44 -0.04 0.00 -1.34 0.00 0.00 175.55 173.74 1yoc s ALA 42 N 1.33 0.39 -0.05 3.97 0.00 -0.95 -1.40 121.76 125.05 1yoc s ALA 42 Ca -0.08 -0.11 0.01 0.00 0.00 0.00 0.00 51.96 51.78 1yoc s ALA 42 Cb -0.05 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 22.93 1yoc s ALA 42 CO -0.15 0.05 -0.04 -2.00 0.00 0.00 0.00 175.76 173.62 1yoc s GLU 43 N 0.19 0.77 0.00 0.00 2.12 0.31 -0.84 118.70 121.25 1yoc s GLU 43 Ca -0.02 -0.07 0.00 0.00 0.36 0.00 0.00 54.97 55.24 1yoc s GLU 43 Cb -0.05 -0.83 -0.00 0.00 0.26 0.00 0.00 34.13 33.50 1yoc s GLU 43 CO -0.00 -0.11 -0.01 0.08 -0.54 0.00 0.00 175.26 174.68 1yoc s VAL 44 N 1.03 0.07 0.30 3.70 1.01 -0.44 -0.54 120.40 125.53 1yoc s VAL 44 Ca -0.09 -0.22 0.11 0.00 0.00 0.00 0.00 61.98 61.77 1yoc s VAL 44 Cb -0.14 -0.10 -0.05 0.00 0.00 0.00 0.00 36.38 36.09 1yoc s VAL 44 CO -0.01 -0.09 -0.10 0.42 0.00 0.00 0.00 175.10 175.32 1yoc s THR 45 N -0.32 2.73 -0.07 3.92 -4.23 -0.38 0.49 115.64 117.78 1yoc s THR 45 Ca -0.03 -2.17 -0.12 0.00 -1.18 0.00 0.00 61.69 58.18 1yoc s THR 45 Cb -0.02 -2.58 0.03 0.00 1.34 0.00 0.00 72.50 71.27 1yoc s THR 45 CO -0.00 -0.33 0.31 0.72 -0.54 0.00 0.00 174.62 174.77 1yoc s PHE 46 N -2.47 -0.26 0.35 3.99 -0.12 -0.62 -0.54 117.98 118.31 1yoc s PHE 46 Ca 0.32 0.56 -0.25 0.00 -0.05 0.00 0.00 56.93 57.50 1yoc s PHE 46 Cb -0.04 0.10 -0.10 0.00 -0.63 0.00 0.00 43.02 42.36 1yoc s PHE 46 CO 0.17 -0.27 0.99 -1.25 -0.05 0.00 0.00 175.22 174.82 1yoc s PRO 47 N -0.54 4.42 -0.07 1.99 0.04 -1.26 -1.31 135.00 138.27 1yoc s PRO 47 Ca -0.06 1.41 -0.30 0.00 0.04 0.00 0.00 61.00 62.09 1yoc s PRO 47 Cb -0.04 -2.69 -0.02 0.00 0.04 0.00 0.00 34.50 31.79 1yoc s PRO 47 CO 0.02 0.11 1.09 0.21 0.04 0.00 0.00 177.00 178.46 1yoc s LYS 48 N -2.24 4.41 0.24 4.56 2.20 -1.26 -4.89 119.74 122.76 1yoc s LYS 48 Ca 0.53 1.52 -0.20 0.00 -0.36 0.00 0.00 55.97 57.46 1yoc s LYS 48 Cb -0.20 -3.53 0.03 0.00 -1.51 0.00 0.00 37.83 32.62 1yoc s LYS 48 CO 0.26 -0.34 0.64 -0.98 -0.36 0.00 0.00 175.35 174.57 1yoc s ARG 49 N 1.94 1.61 0.22 4.03 1.70 -1.26 -4.90 118.95 122.29 1yoc s ARG 49 Ca 0.52 -0.90 -0.14 0.00 -0.47 0.00 0.00 55.73 54.74 1yoc s ARG 49 Cb -0.22 0.58 0.26 0.00 -0.57 0.00 0.00 34.95 35.00 1yoc s ARG 49 CO 0.21 -0.72 1.60 -0.09 -1.08 0.00 0.00 175.30 175.22 1yoc h ARG 50 N 2.06 -0.04 -0.42 3.89 2.43 -2.00 -2.18 114.38 118.12 1yoc h ARG 50 Ca -0.24 0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.06 1yoc h ARG 50 Cb 1.26 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.80 1yoc h ARG 50 CO 0.29 -0.03 0.42 0.93 -1.51 0.00 0.00 179.97 180.08 1yoc h GLU 51 N -0.04 0.00 -0.30 0.20 3.07 -1.97 -2.53 114.58 113.01 1yoc h GLU 51 Ca 0.33 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 1yoc h GLU 51 Cb 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 1yoc h GLU 51 CO -0.76 0.00 0.00 1.33 -1.40 0.00 0.00 179.01 178.18 1yoc n VAL 52 N -3.82 2.00 -2.38 3.13 0.24 -0.82 -5.02 118.33 111.65 1yoc n VAL 52 Ca 0.07 -1.64 -0.31 0.00 -2.04 0.00 0.00 64.34 60.43 1yoc n VAL 52 Cb 0.60 -0.07 -0.02 0.00 -1.47 0.00 0.00 33.84 32.89 1yoc n VAL 52 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1yoc s LEU 53 N -2.38 3.56 0.00 1.34 1.43 -0.96 -0.06 118.68 121.61 1yoc s LEU 53 Ca 0.39 1.34 0.01 0.00 -1.03 0.00 0.00 54.13 54.84 1yoc s LEU 53 Cb 0.29 -4.30 0.01 0.00 0.03 0.00 0.00 46.19 42.22 1yoc s LEU 53 CO 0.11 -0.62 0.07 -0.46 0.23 0.00 0.00 176.35 175.68 1yoc n ASN 54 N -1.93 0.55 0.00 2.29 0.23 -0.47 -4.57 115.26 111.36 1yoc n ASN 54 Ca 0.05 -1.17 0.10 0.00 -0.53 0.00 0.00 54.58 53.02 1yoc n ASN 54 Cb 0.54 -0.03 0.50 0.00 -2.08 0.00 0.00 39.78 38.72 1yoc n ASN 54 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1yoc n HIS 55 N -0.96 0.00 -0.46 -2.53 1.44 -1.26 -2.02 115.22 109.43 1yoc n HIS 55 Ca 0.01 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.79 1yoc n HIS 55 Cb 0.06 -0.32 0.21 0.00 0.12 0.00 0.00 29.99 30.07 1yoc n HIS 55 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 1yoc n ILE 56 N -1.32 1.45 -0.99 0.61 -5.35 -1.26 -4.99 119.36 107.52 1yoc n ILE 56 Ca 0.09 -1.26 0.00 0.00 -0.27 0.00 0.00 62.75 61.31 1yoc n ILE 56 Cb 0.17 0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.33 1yoc n ILE 56 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1yoc n GLY 57 N 0.35 0.52 3.98 3.28 0.00 -0.86 -5.04 105.19 107.43 1yoc n GLY 57 Ca 0.16 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.98 1yoc n GLY 57 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yoc s THR 58 N -2.21 2.34 0.01 2.61 -4.23 -1.26 -4.82 115.64 108.09 1yoc s THR 58 Ca 0.00 -1.13 -0.30 0.00 -1.18 0.00 0.00 61.69 59.07 1yoc s THR 58 Cb 0.00 -2.48 -0.06 0.00 1.34 0.00 0.00 72.50 71.30 1yoc s THR 58 CO 0.00 0.00 1.39 -0.69 -0.54 0.00 0.00 174.62 174.78 1yoc s VAL 59 N -2.58 3.68 0.19 2.29 1.01 0.50 -1.37 120.40 124.12 1yoc s VAL 59 Ca 0.53 1.09 -0.33 0.00 0.00 0.00 0.00 61.98 63.27 1yoc s VAL 59 Cb -0.06 -3.70 -0.14 0.00 0.00 0.00 0.00 36.38 32.49 1yoc s VAL 59 CO 0.33 0.01 1.54 1.57 0.00 0.00 0.00 175.10 178.55 1yoc n HIS 60 N 5.17 2.30 -0.32 5.22 -0.00 0.91 -4.58 115.22 123.92 1yoc n HIS 60 Ca 0.13 0.30 0.25 0.00 0.46 0.00 0.00 57.72 58.86 1yoc n HIS 60 Cb 0.44 -2.53 0.55 0.00 -0.12 0.00 0.00 29.99 28.33 1yoc n HIS 60 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1yoc h ALA 61 N 5.46 2.39 0.00 1.57 0.00 -1.91 0.07 119.26 126.84 1yoc h ALA 61 Ca -0.45 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 1yoc h ALA 61 Cb 1.26 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1yoc h ALA 61 CO 0.85 -0.79 -0.52 0.82 0.00 0.00 0.00 179.25 179.61 1yoc h ILE 62 N 0.32 0.38 -0.35 0.00 1.08 -1.96 -2.05 117.51 114.92 1yoc h ILE 62 Ca 0.59 -1.58 -0.10 0.00 -0.39 0.00 0.00 64.86 63.39 1yoc h ILE 62 Cb 1.65 2.09 -0.02 0.00 -3.07 0.00 0.00 36.82 37.47 1yoc h ILE 62 CO -0.25 0.22 -0.18 0.00 -0.69 0.00 0.00 178.15 177.25 1yoc h ALA 63 N 1.74 1.03 -0.55 1.87 0.00 -1.33 -0.62 119.26 121.40 1yoc h ALA 63 Ca -0.02 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 1yoc h ALA 63 Cb 1.22 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1yoc h ALA 63 CO 0.03 0.58 0.01 -0.07 0.00 0.00 0.00 179.25 179.80 1yoc h LEU 64 N 0.58 0.95 -1.10 0.00 3.38 -1.11 -1.95 115.31 116.06 1yoc h LEU 64 Ca 0.09 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 1yoc h LEU 64 Cb 0.63 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1yoc h LEU 64 CO 0.04 1.02 0.15 0.00 0.09 0.00 0.00 178.44 179.74 1yoc h ASN 66 N 0.77 0.79 -0.54 0.00 -0.00 -0.76 -0.33 115.58 115.51 1yoc h ASN 66 Ca 0.17 -0.17 -0.07 0.00 -0.00 0.00 0.00 56.30 56.23 1yoc h ASN 66 Cb 0.25 -0.21 -0.02 0.00 -0.00 0.00 0.00 38.32 38.34 1yoc h ASN 66 CO -0.01 0.75 0.08 0.00 -0.00 0.00 0.00 177.43 178.26 1yoc h ALA 67 N 1.08 1.05 -0.42 1.57 0.00 -0.92 -1.63 119.26 119.99 1yoc h ALA 67 Ca 0.19 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1yoc h ALA 67 Cb 0.20 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1yoc h ALA 67 CO -0.02 0.61 0.09 0.00 0.00 0.00 0.00 179.25 179.94 1yoc h ALA 68 N 1.20 0.56 -0.63 0.00 0.00 -0.72 -0.73 119.26 118.94 1yoc h ALA 68 Ca 0.18 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1yoc h ALA 68 Cb 0.41 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1yoc h ALA 68 CO 0.01 0.25 0.42 1.49 0.00 0.00 0.00 179.25 181.42 1yoc h GLU 69 N 0.55 0.83 -0.08 0.00 4.57 -0.82 0.10 114.58 119.72 1yoc h GLU 69 Ca 0.13 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.26 1yoc h GLU 69 Cb 0.33 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 28.73 1yoc h GLU 69 CO 0.00 0.55 0.04 1.25 -1.18 0.00 0.00 179.01 179.67 1yoc h LEU 70 N 0.85 0.10 -0.20 1.64 5.85 -1.08 0.16 115.31 122.63 1yoc h LEU 70 Ca 0.23 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 1yoc h LEU 70 Cb -0.10 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1yoc h LEU 70 CO -0.05 0.17 -0.08 0.00 -0.34 0.00 0.00 178.44 178.14 1yoc h ALA 71 N 0.94 0.28 -0.57 1.25 0.00 -0.95 -1.76 119.26 118.46 1yoc h ALA 71 Ca 0.03 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 1yoc h ALA 71 Cb 0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1yoc h ALA 71 CO -0.00 0.10 0.09 0.00 0.00 0.00 0.00 179.25 179.44 1yoc h ALA 72 N 0.71 0.75 -0.21 0.00 0.00 -0.94 -1.32 119.26 118.25 1yoc h ALA 72 Ca 0.05 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1yoc h ALA 72 Cb 0.56 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1yoc h ALA 72 CO 0.03 0.50 0.01 0.78 0.00 0.00 0.00 179.25 180.56 1yoc h GLY 73 N 0.83 0.39 1.28 0.00 0.00 -0.65 -1.36 103.07 103.56 1yoc h GLY 73 Ca 0.17 -0.28 -0.12 0.00 0.00 0.00 0.00 47.33 47.10 1yoc h GLY 73 CO 0.01 0.26 -0.20 -0.91 0.00 0.00 0.00 176.54 175.70 1yoc h THR 74 N 0.13 1.27 -0.58 4.70 1.35 -1.33 -0.14 112.91 118.30 1yoc h THR 74 Ca 0.06 -1.32 -0.03 0.00 -0.55 0.00 0.00 66.41 64.57 1yoc h THR 74 Cb 0.38 1.15 -0.03 0.00 -1.73 0.00 0.00 68.15 67.93 1yoc h THR 74 CO 0.01 0.45 0.26 -0.03 -0.25 0.00 0.00 175.52 175.96 1yoc h MET 75 N 0.73 0.85 -0.11 4.72 4.05 -1.19 -0.39 114.93 123.59 1yoc h MET 75 Ca 0.10 -0.14 -0.00 0.00 -0.28 0.00 0.00 59.70 59.38 1yoc h MET 75 Cb 0.72 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 31.37 1yoc h MET 75 CO 0.06 0.71 0.05 1.15 0.23 0.00 0.00 176.91 179.11 1yoc h THR 76 N 0.80 1.13 -0.56 -0.77 2.02 -0.96 -0.63 112.91 113.93 1yoc h THR 76 Ca 0.20 -0.37 -0.02 0.00 0.77 0.00 0.00 66.41 66.99 1yoc h THR 76 Cb 0.16 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.70 1yoc h THR 76 CO -0.02 0.11 0.27 -0.78 0.37 0.00 0.00 175.52 175.47 1yoc h ASP 77 N 0.05 0.70 1.55 4.18 3.58 -0.82 -2.07 116.42 123.59 1yoc h ASP 77 Ca 0.04 -0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.42 1yoc h ASP 77 Cb 0.13 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.00 1yoc h ASP 77 CO -0.00 0.60 0.00 0.00 -2.88 0.00 0.00 179.24 176.96 1yoc h ALA 78 N 1.51 1.00 0.00 -0.78 0.00 -0.75 -3.37 119.26 116.88 1yoc h ALA 78 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.89 1yoc h ALA 78 Cb 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1yoc h ALA 78 CO -0.03 0.00 -2.03 0.43 0.00 0.00 0.00 179.25 177.63 1yoc n SER 79 N -2.87 0.99 -4.85 0.00 7.64 -0.27 -4.58 113.62 109.68 1yoc n SER 79 Ca 0.03 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.59 1yoc n SER 79 Cb 0.43 1.15 -0.03 0.00 -1.01 0.00 0.00 64.21 64.75 1yoc n SER 79 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 1yoc s ILE 80 N -2.62 4.56 0.73 0.44 -4.36 -0.94 -4.80 121.20 114.21 1yoc s ILE 80 Ca -0.08 1.17 -0.16 0.00 -0.26 0.00 0.00 60.65 61.33 1yoc s ILE 80 Cb 0.07 -3.74 0.02 0.00 1.25 0.00 0.00 42.46 40.06 1yoc s ILE 80 CO 0.68 -0.74 1.07 -2.65 0.24 0.00 0.00 174.94 173.55 1yoc n PRO 81 N -1.70 0.53 -0.23 0.37 -0.02 -1.26 -4.91 135.00 127.79 1yoc n PRO 81 Ca 0.06 0.24 0.11 0.00 -2.02 0.00 0.00 63.50 61.90 1yoc n PRO 81 Cb 0.54 -2.32 0.40 0.00 -0.02 0.00 0.00 33.50 32.10 1yoc n PRO 81 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yoc h ALA 82 N -0.28 1.86 -0.06 3.55 0.00 -1.95 -1.61 119.26 120.77 1yoc h ALA 82 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1yoc h ALA 82 Cb 1.33 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1yoc h ALA 82 CO 0.48 -0.06 0.00 0.41 0.00 0.00 0.00 179.25 180.08 1yoc n GLY 83 N -1.46 -0.66 3.74 0.00 0.00 -1.26 -4.83 105.19 100.72 1yoc n GLY 83 Ca 0.15 -0.13 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1yoc n GLY 83 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yoc s HIS 84 N -1.92 2.95 0.26 1.61 4.02 -0.61 0.71 115.29 122.31 1yoc s HIS 84 Ca 0.16 -0.14 0.03 0.00 1.02 0.00 0.00 55.06 56.14 1yoc s HIS 84 Cb 0.08 -1.35 -0.05 0.00 -1.02 0.00 0.00 32.58 30.24 1yoc s HIS 84 CO 0.12 0.55 0.03 -0.98 1.02 0.00 0.00 174.74 175.49 1yoc s ARG 85 N -3.57 1.43 0.06 1.40 1.70 0.57 -4.75 118.95 115.80 1yoc s ARG 85 Ca 0.31 -1.75 -0.11 0.00 -0.47 0.00 0.00 55.73 53.71 1yoc s ARG 85 Cb -0.08 -0.60 0.01 0.00 -0.57 0.00 0.00 34.95 33.71 1yoc s ARG 85 CO 0.22 -0.16 0.24 1.67 -1.08 0.00 0.00 175.30 176.19 1yoc s TRP 86 N -3.47 0.02 -0.22 5.89 1.48 -1.26 -1.71 118.94 119.67 1yoc s TRP 86 Ca 0.33 -0.29 -0.16 0.00 -1.06 0.00 0.00 56.10 54.91 1yoc s TRP 86 Cb 0.07 0.02 0.06 0.00 -1.16 0.00 0.00 33.47 32.46 1yoc s TRP 86 CO 0.11 -0.51 0.56 -1.50 -4.06 0.00 0.00 176.95 171.55 1yoc s ILE 87 N -3.10 -0.01 0.31 0.66 2.07 -0.90 -4.98 121.20 115.25 1yoc s ILE 87 Ca -0.01 0.03 -0.29 0.00 -1.41 0.00 0.00 60.65 58.97 1yoc s ILE 87 Cb 0.01 -0.80 -0.10 0.00 0.13 0.00 0.00 42.46 41.71 1yoc s ILE 87 CO -0.07 0.01 1.16 -2.84 -1.91 0.00 0.00 174.94 171.29 1yoc s PRO 88 N 0.96 4.49 -0.19 3.50 0.02 -1.26 -0.93 135.00 141.59 1yoc s PRO 88 Ca -0.05 1.90 0.16 0.00 0.02 0.00 0.00 61.00 63.02 1yoc s PRO 88 Cb -0.05 -3.08 -0.23 0.00 0.02 0.00 0.00 34.50 31.16 1yoc s PRO 88 CO -0.08 0.04 0.04 0.54 -0.33 0.00 0.00 177.00 177.21 1yoc n ARG 89 N 0.92 0.89 -3.22 5.54 5.12 0.68 -4.90 116.66 121.69 1yoc n ARG 89 Ca -0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1yoc n ARG 89 Cb 0.44 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.26 1yoc n ARG 89 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1yoc n GLY 90 N 1.87 -1.40 3.49 -0.13 0.00 -1.22 -5.03 105.19 102.78 1yoc n GLY 90 Ca -0.32 -1.01 -0.16 0.00 0.00 0.00 0.00 46.02 44.54 1yoc n GLY 90 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1yoc s MET 91 N -1.38 0.90 -0.07 1.61 1.75 -1.26 -1.35 119.30 119.50 1yoc s MET 91 Ca 0.00 0.41 0.03 0.00 -1.25 0.00 0.00 55.69 54.88 1yoc s MET 91 Cb 0.00 0.43 0.01 0.00 2.84 0.00 0.00 34.83 38.11 1yoc s MET 91 CO 0.00 -0.23 -0.16 0.99 -0.65 0.00 0.00 175.02 174.97 1yoc s THR 92 N -0.70 1.40 0.16 10.11 2.01 -0.51 -5.00 115.64 123.11 1yoc s THR 92 Ca -0.08 -0.64 0.06 0.00 0.31 0.00 0.00 61.69 61.34 1yoc s THR 92 Cb -0.02 -1.24 -0.04 0.00 0.01 0.00 0.00 72.50 71.20 1yoc s THR 92 CO 0.06 0.41 -0.13 0.68 -0.69 0.00 0.00 174.62 174.95 1yoc s VAL 93 N 0.49 1.41 -0.03 3.82 -7.23 -1.26 -0.61 120.40 116.98 1yoc s VAL 93 Ca -0.14 -1.99 0.04 0.00 -1.81 0.00 0.00 61.98 58.08 1yoc s VAL 93 Cb -0.16 -1.80 -0.00 0.00 0.56 0.00 0.00 36.38 34.98 1yoc s VAL 93 CO 0.05 -0.58 -0.15 -1.61 -0.31 0.00 0.00 175.10 172.50 1yoc s GLU 94 N -3.34 1.48 -0.40 4.82 8.01 0.08 -4.99 118.70 124.35 1yoc s GLU 94 Ca 0.16 -0.51 -0.13 0.00 0.01 0.00 0.00 54.97 54.50 1yoc s GLU 94 Cb -0.01 -1.32 0.03 0.00 -4.31 0.00 0.00 34.13 28.52 1yoc s GLU 94 CO 0.03 0.22 0.26 0.71 0.01 0.00 0.00 175.26 176.49 1yoc s TYR 95 N 0.04 3.25 -0.09 1.61 2.02 -1.26 -2.22 117.35 120.69 1yoc s TYR 95 Ca -0.02 -0.85 0.06 0.00 -0.37 0.00 0.00 57.07 55.88 1yoc s TYR 95 Cb -0.10 -2.58 -0.24 0.00 -0.40 0.00 0.00 41.96 38.64 1yoc s TYR 95 CO 0.01 -0.65 0.48 1.28 -1.57 0.00 0.00 175.55 175.10 1yoc n LEU 96 N 5.07 1.51 -3.53 -1.29 4.77 0.03 -5.00 117.00 118.57 1yoc n LEU 96 Ca -0.11 0.29 -0.11 0.00 -0.03 0.00 0.00 56.01 56.05 1yoc n LEU 96 Cb 0.46 -0.30 -0.02 0.00 -2.33 0.00 0.00 43.42 41.23 1yoc n LEU 96 CO 0.39 0.58 0.40 0.00 -1.33 0.00 0.00 177.39 177.43 1yoc s ALA 97 N -2.57 -1.47 0.37 -1.18 0.00 -0.89 -4.99 121.76 111.03 1yoc s ALA 97 Ca -0.12 0.28 -0.27 0.00 0.00 0.00 0.00 51.96 51.85 1yoc s ALA 97 Cb 0.07 0.87 -0.09 0.00 0.00 0.00 0.00 23.12 23.98 1yoc s ALA 97 CO 0.80 -0.82 1.20 0.15 0.00 0.00 0.00 175.76 177.09 1yoc s LYS 98 N -3.79 4.19 -0.41 0.00 1.02 -1.26 -4.77 119.74 114.72 1yoc s LYS 98 Ca 0.03 1.94 -0.16 0.00 0.02 0.00 0.00 55.97 57.80 1yoc s LYS 98 Cb -0.02 -2.84 0.02 0.00 -0.52 0.00 0.00 37.83 34.47 1yoc s LYS 98 CO -0.09 -0.23 0.39 0.00 -0.92 0.00 0.00 175.35 174.50 1yoc s ALA 99 N -1.31 3.45 -0.20 5.17 0.00 -1.26 -4.94 121.76 122.67 1yoc s ALA 99 Ca 0.54 -1.56 0.15 0.00 0.00 0.00 0.00 51.96 51.09 1yoc s ALA 99 Cb -0.33 -2.99 0.44 0.00 0.00 0.00 0.00 23.12 20.23 1yoc s ALA 99 CO 0.43 -1.52 1.32 0.25 0.00 0.00 0.00 175.76 176.24 1yoc n THR 100 N 5.34 2.22 -3.40 0.00 -2.24 -1.26 -0.37 114.28 114.58 1yoc n THR 100 Ca -0.08 -2.40 -0.01 0.00 -2.27 0.00 0.00 64.05 59.29 1yoc n THR 100 Cb 0.47 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 1yoc n THR 100 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yoc n GLY 101 N -1.03 1.37 3.74 3.38 0.00 -1.26 -5.00 105.19 106.38 1yoc n GLY 101 Ca 0.22 -0.98 -0.40 0.00 0.00 0.00 0.00 46.02 44.87 1yoc n GLY 101 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yoc n ASP 102 N -0.79 2.88 -4.77 1.61 8.00 -1.26 -4.45 116.55 117.78 1yoc n ASP 102 Ca -0.01 1.08 -0.34 0.00 0.71 0.00 0.00 54.79 56.23 1yoc n ASP 102 Cb 0.09 -1.56 -0.07 0.00 -0.02 0.00 0.00 41.12 39.55 1yoc n ASP 102 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1yoc s VAL 103 N -1.22 4.72 -0.20 2.53 1.01 -0.43 -4.40 120.40 122.40 1yoc s VAL 103 Ca 0.64 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 62.34 1yoc s VAL 103 Cb -0.46 -3.10 0.04 0.00 0.00 0.00 0.00 36.38 32.86 1yoc s VAL 103 CO 0.55 0.45 -0.15 -0.60 0.00 0.00 0.00 175.10 175.35 1yoc s ARG 104 N -1.43 2.55 -0.19 2.72 3.52 -0.06 -1.60 118.95 124.47 1yoc s ARG 104 Ca 0.19 -0.96 -0.09 0.00 -0.13 0.00 0.00 55.73 54.75 1yoc s ARG 104 Cb -0.12 -2.60 -0.04 0.00 -1.56 0.00 0.00 34.95 30.63 1yoc s ARG 104 CO 0.10 -0.35 0.09 0.00 -0.81 0.00 0.00 175.30 174.32 1yoc s ALA 105 N 1.27 3.53 -0.18 6.12 0.00 0.18 -0.34 121.76 132.33 1yoc s ALA 105 Ca -0.00 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.25 1yoc s ALA 105 Cb -0.16 -2.03 0.03 0.00 0.00 0.00 0.00 23.12 20.97 1yoc s ALA 105 CO -0.10 0.17 -0.14 0.08 0.00 0.00 0.00 175.76 175.77 1yoc s VAL 106 N 0.36 1.77 -0.27 0.00 1.01 0.42 -1.33 120.40 122.36 1yoc s VAL 106 Ca 0.05 -0.92 -0.17 0.00 0.00 0.00 0.00 61.98 60.94 1yoc s VAL 106 Cb -0.12 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 1yoc s VAL 106 CO -0.01 0.34 0.48 0.00 0.00 0.00 0.00 175.10 175.91 1yoc s ALA 107 N 1.37 3.57 -0.48 5.51 0.00 -0.02 -1.34 121.76 130.37 1yoc s ALA 107 Ca 0.02 -0.72 -0.12 0.00 0.00 0.00 0.00 51.96 51.14 1yoc s ALA 107 Cb -0.15 -2.86 0.11 0.00 0.00 0.00 0.00 23.12 20.23 1yoc s ALA 107 CO -0.10 -0.78 0.38 0.34 0.00 0.00 0.00 175.76 175.60 1yoc s ASP 108 N 1.60 5.88 -0.18 0.00 -1.08 -0.48 -2.24 116.67 120.17 1yoc s ASP 108 Ca 0.19 -1.73 0.16 0.00 -0.52 0.00 0.00 52.55 50.65 1yoc s ASP 108 Cb -0.16 -2.08 0.76 0.00 -1.46 0.00 0.00 42.92 39.98 1yoc s ASP 108 CO 0.10 -0.71 1.67 0.61 0.52 0.00 0.00 175.17 177.37 1yoc n GLY 109 N 5.04 2.97 0.31 2.66 0.00 -0.13 -4.38 105.19 111.65 1yoc n GLY 109 Ca -0.11 -0.90 0.17 0.00 0.00 0.00 0.00 46.02 45.19 1yoc n GLY 109 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1yoc h SER 110 N 3.87 0.00 -0.09 1.61 4.64 -1.89 -2.89 113.55 118.80 1yoc h SER 110 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yoc h SER 110 Cb 1.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.80 1yoc h SER 110 CO 0.36 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 176.33 1yoc n GLN 111 N -3.59 2.25 -4.06 4.77 6.02 -1.26 -5.00 117.38 116.50 1yoc n GLN 111 Ca -0.03 -2.30 -0.35 0.00 -0.01 0.00 0.00 57.00 54.31 1yoc n GLN 111 Cb 0.10 -1.42 -0.08 0.00 1.02 0.00 0.00 30.24 29.86 1yoc n GLN 111 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1yoc s ILE 112 N -2.17 4.91 -0.65 5.09 1.01 -1.09 -5.05 121.20 123.25 1yoc s ILE 112 Ca 0.25 -0.01 -0.25 0.00 0.00 0.00 0.00 60.65 60.64 1yoc s ILE 112 Cb 0.20 -3.15 0.04 0.00 0.01 0.00 0.00 42.46 39.57 1yoc s ILE 112 CO 0.05 0.56 1.11 -0.62 0.00 0.00 0.00 174.94 176.04 1yoc s ASP 113 N -0.47 6.25 0.00 3.58 2.15 -1.26 -4.87 116.67 122.04 1yoc s ASP 113 Ca 0.10 -0.48 0.17 0.00 0.43 0.00 0.00 52.55 52.78 1yoc s ASP 113 Cb -0.12 -2.50 0.87 0.00 -0.30 0.00 0.00 42.92 40.88 1yoc s ASP 113 CO 0.02 -1.55 1.50 0.79 -0.17 0.00 0.00 175.17 175.76 1yoc n TRP 114 N 8.38 0.00 0.86 -5.34 7.02 -1.26 -1.83 117.44 125.27 1yoc n TRP 114 Ca 0.02 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.61 1yoc n TRP 114 Cb 0.48 -0.26 0.04 0.00 -2.42 0.00 0.00 31.31 29.14 1yoc n TRP 114 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 1yoc n GLN 115 N -1.26 0.09 -1.83 -0.99 6.02 -1.26 -4.20 117.38 113.94 1yoc n GLN 115 Ca 0.08 -0.01 -0.33 0.00 -0.01 0.00 0.00 57.00 56.74 1yoc n GLN 115 Cb 0.13 -1.52 0.03 0.00 1.02 0.00 0.00 30.24 29.90 1yoc n GLN 115 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1yoc s ALA 116 N -3.06 2.58 0.44 -1.58 0.00 -0.76 -4.98 121.76 114.41 1yoc s ALA 116 Ca 0.07 0.43 0.06 0.00 0.00 0.00 0.00 51.96 52.53 1yoc s ALA 116 Cb 0.16 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.97 1yoc s ALA 116 CO 0.80 -1.11 0.13 0.95 0.00 0.00 0.00 175.76 176.54 1yoc s THR 117 N -2.47 1.96 0.00 0.00 -4.23 -1.26 -4.93 115.64 104.71 1yoc s THR 117 Ca 0.65 -1.80 0.00 0.00 -1.18 0.00 0.00 61.69 59.36 1yoc s THR 117 Cb -0.18 -2.75 0.00 0.00 1.34 0.00 0.00 72.50 70.91 1yoc s THR 117 CO 0.41 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.10 1yoc n GLY 118 N -1.24 -0.92 3.72 3.99 0.00 0.62 -4.91 105.19 106.45 1yoc n GLY 118 Ca -0.05 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 43.81 1yoc n GLY 118 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1yoc s ASN 119 N -4.00 7.44 -0.05 1.61 -0.87 -1.26 -1.00 114.94 116.81 1yoc s ASN 119 Ca 0.00 1.73 0.04 0.00 -1.57 0.00 0.00 52.86 53.05 1yoc s ASN 119 Cb 0.00 -2.58 0.00 0.00 -0.02 0.00 0.00 41.25 38.65 1yoc s ASN 119 CO 0.00 -0.15 -0.15 -0.76 -2.57 0.00 0.00 177.10 173.47 1yoc s LEU 120 N 0.44 1.85 -0.30 0.60 1.43 0.57 -4.97 118.68 118.30 1yoc s LEU 120 Ca 0.49 -0.33 -0.07 0.00 -1.03 0.00 0.00 54.13 53.19 1yoc s LEU 120 Cb -0.22 -0.91 0.01 0.00 0.03 0.00 0.00 46.19 45.10 1yoc s LEU 120 CO 0.29 0.12 0.09 -0.69 0.23 0.00 0.00 176.35 176.38 1yoc s VAL 121 N 0.22 3.97 -0.26 -1.59 1.01 -1.26 -0.51 120.40 121.98 1yoc s VAL 121 Ca -0.07 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.03 1yoc s VAL 121 Cb -0.13 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 1yoc s VAL 121 CO 0.03 0.04 0.29 -0.69 0.00 0.00 0.00 175.10 174.76 1yoc s VAL 122 N 1.49 5.25 0.07 2.92 1.01 -0.02 -4.90 120.40 126.21 1yoc s VAL 122 Ca 0.02 0.40 -0.17 0.00 0.00 0.00 0.00 61.98 62.23 1yoc s VAL 122 Cb -0.18 -3.62 -0.06 0.00 0.00 0.00 0.00 36.38 32.52 1yoc s VAL 122 CO 0.03 0.23 0.52 -2.16 0.00 0.00 0.00 175.10 173.72 1yoc s PRO 123 N 1.71 4.09 -0.00 2.72 0.04 -1.26 -1.17 135.00 141.12 1yoc s PRO 123 Ca 0.12 0.61 0.03 0.00 0.04 0.00 0.00 61.00 61.80 1yoc s PRO 123 Cb -0.15 -3.18 -0.01 0.00 0.04 0.00 0.00 34.50 31.19 1yoc s PRO 123 CO 0.09 0.63 -0.10 0.08 0.04 0.00 0.00 177.00 177.74 1yoc s VAL 124 N -1.16 0.77 -0.02 -0.36 1.01 0.34 -1.38 120.40 119.60 1yoc s VAL 124 Ca 0.29 -0.46 0.04 0.00 0.00 0.00 0.00 61.98 61.85 1yoc s VAL 124 Cb -0.18 -0.66 -0.01 0.00 0.00 0.00 0.00 36.38 35.54 1yoc s VAL 124 CO 0.18 0.19 -0.15 -0.69 0.00 0.00 0.00 175.10 174.62 1yoc s VAL 125 N -0.29 1.23 -0.05 2.92 1.01 -0.45 -1.09 120.40 123.68 1yoc s VAL 125 Ca 0.03 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.41 1yoc s VAL 125 Cb -0.04 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.27 1yoc s VAL 125 CO -0.00 0.35 -0.16 0.00 0.00 0.00 0.00 175.10 175.29 1yoc s ALA 126 N -0.16 2.59 0.22 5.51 0.00 0.03 -0.44 121.76 129.50 1yoc s ALA 126 Ca 0.02 -1.00 0.11 0.00 0.00 0.00 0.00 51.96 51.09 1yoc s ALA 126 Cb -0.08 -0.91 -0.05 0.00 0.00 0.00 0.00 23.12 22.08 1yoc s ALA 126 CO 0.00 0.54 -0.21 0.71 0.00 0.00 0.00 175.76 176.81 1yoc s TYR 127 N -0.68 2.18 -0.04 0.00 2.02 0.53 -0.99 117.35 120.37 1yoc s TYR 127 Ca 0.11 -0.38 0.01 0.00 -0.37 0.00 0.00 57.07 56.43 1yoc s TYR 127 Cb -0.11 -1.03 0.02 0.00 -0.40 0.00 0.00 41.96 40.45 1yoc s TYR 127 CO 0.00 0.53 -0.03 0.08 -1.57 0.00 0.00 175.55 174.57 1yoc s VAL 128 N -2.09 0.42 -1.66 0.71 1.01 -0.58 -0.88 120.40 117.33 1yoc s VAL 128 Ca 0.23 -0.06 -0.18 0.00 0.00 0.00 0.00 61.98 61.98 1yoc s VAL 128 Cb -0.06 -0.47 0.14 0.00 0.00 0.00 0.00 36.38 35.99 1yoc s VAL 128 CO 0.11 0.20 0.84 -0.67 0.00 0.00 0.00 175.10 175.58 1yoc n ASP 129 N 4.07 -3.77 0.00 3.32 2.03 -1.26 -0.91 116.55 120.02 1yoc n ASP 129 Ca -0.26 -0.94 0.00 0.00 0.52 0.00 0.00 54.79 54.12 1yoc n ASP 129 Cb 0.51 -3.06 0.00 0.00 -0.72 0.00 0.00 41.12 37.85 1yoc n ASP 129 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1yoc n ASP 130 N -2.69 -2.63 -4.66 1.67 8.00 -1.26 -5.00 116.55 109.99 1yoc n ASP 130 Ca 0.07 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.22 1yoc n ASP 130 Cb 0.50 -1.79 -0.10 0.00 -0.02 0.00 0.00 41.12 39.71 1yoc n ASP 130 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1yoc s LYS 131 N -0.85 3.38 0.15 -1.24 1.02 -0.09 -5.00 119.74 117.10 1yoc s LYS 131 Ca 0.00 -0.39 -0.31 0.00 0.02 0.00 0.00 55.97 55.29 1yoc s LYS 131 Cb 0.00 -2.95 -0.10 0.00 -0.52 0.00 0.00 37.83 34.27 1yoc s LYS 131 CO 0.00 0.53 1.58 -1.25 -0.92 0.00 0.00 175.35 175.29 1yoc s PRO 132 N -0.39 4.22 0.00 -1.68 0.04 -1.26 -1.53 135.00 134.40 1yoc s PRO 132 Ca 0.08 2.35 0.00 0.00 0.04 0.00 0.00 61.00 63.47 1yoc s PRO 132 Cb -0.12 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.18 1yoc s PRO 132 CO 0.02 -0.62 0.13 1.33 0.04 0.00 0.00 177.00 177.90 1yoc n VAL 133 N 4.10 0.00 -3.60 -0.36 0.24 -0.16 -4.63 118.33 113.92 1yoc n VAL 133 Ca 0.14 -0.47 -0.12 0.00 -2.04 0.00 0.00 64.34 61.85 1yoc n VAL 133 Cb 0.39 1.02 -0.06 0.00 -1.47 0.00 0.00 33.84 33.71 1yoc n VAL 133 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1yoc s PHE 134 N -0.68 -0.55 0.03 6.34 5.36 -1.17 -0.79 117.98 126.52 1yoc s PHE 134 Ca 0.00 1.18 0.01 0.00 -0.96 0.00 0.00 56.93 57.16 1yoc s PHE 134 Cb 0.00 0.37 -0.02 0.00 -0.34 0.00 0.00 43.02 43.03 1yoc s PHE 134 CO 0.00 -0.35 -0.04 1.03 -1.46 0.00 0.00 175.22 174.39 1yoc s ARG 135 N -0.32 0.37 0.04 10.12 0.52 -0.94 -0.79 118.95 127.94 1yoc s ARG 135 Ca -0.01 -0.63 -0.06 0.00 -0.52 0.00 0.00 55.73 54.50 1yoc s ARG 135 Cb -0.03 -0.02 -0.01 0.00 0.52 0.00 0.00 34.95 35.42 1yoc s ARG 135 CO 0.00 -0.02 0.11 0.00 0.02 0.00 0.00 175.30 175.41 1yoc s ALA 136 N -1.38 -0.11 -0.12 2.13 0.00 -0.25 -0.74 121.76 121.29 1yoc s ALA 136 Ca -0.14 -0.52 -0.00 0.00 0.00 0.00 0.00 51.96 51.30 1yoc s ALA 136 Cb -0.10 0.26 0.03 0.00 0.00 0.00 0.00 23.12 23.31 1yoc s ALA 136 CO -0.01 -0.33 -0.07 -1.21 0.00 0.00 0.00 175.76 174.15 1yoc s GLU 137 N -2.62 1.49 -0.19 0.00 2.02 0.21 -0.50 118.70 119.12 1yoc s GLU 137 Ca -0.05 -0.27 -0.03 0.00 0.02 0.00 0.00 54.97 54.64 1yoc s GLU 137 Cb -0.01 -1.62 -0.01 0.00 0.10 0.00 0.00 34.13 32.58 1yoc s GLU 137 CO -0.05 -0.29 -0.06 0.42 0.02 0.00 0.00 175.26 175.31 1yoc s ILE 138 N 1.71 3.41 -0.25 -1.63 1.01 -0.32 -1.42 121.20 123.70 1yoc s ILE 138 Ca 0.05 -0.50 -0.17 0.00 0.00 0.00 0.00 60.65 60.02 1yoc s ILE 138 Cb -0.13 -2.52 -0.03 0.00 0.01 0.00 0.00 42.46 39.79 1yoc s ILE 138 CO -0.08 0.46 0.47 -0.89 0.00 0.00 0.00 174.94 174.89 1yoc s THR 139 N 1.06 5.11 -0.10 2.92 2.01 -0.45 -0.84 115.64 125.34 1yoc s THR 139 Ca 0.01 0.79 -0.01 0.00 0.31 0.00 0.00 61.69 62.79 1yoc s THR 139 Cb -0.15 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.55 1yoc s THR 139 CO -0.00 0.13 -0.05 -0.04 -0.69 0.00 0.00 174.62 173.96 1yoc s MET 140 N 2.09 3.11 -0.26 4.92 1.00 0.34 -0.23 119.30 130.27 1yoc s MET 140 Ca 0.20 -0.52 -0.09 0.00 0.00 0.00 0.00 55.69 55.27 1yoc s MET 140 Cb -0.16 -2.73 -0.04 0.00 0.00 0.00 0.00 34.83 31.90 1yoc s MET 140 CO 0.09 0.52 0.14 -0.47 0.00 0.00 0.00 175.02 175.30 1yoc s TYR 141 N -0.40 3.19 -0.14 -0.03 5.04 -0.10 -0.31 117.35 124.60 1yoc s TYR 141 Ca 0.06 -0.05 -0.02 0.00 -2.44 0.00 0.00 57.07 54.62 1yoc s TYR 141 Cb -0.12 -2.30 -0.02 0.00 0.35 0.00 0.00 41.96 39.86 1yoc s TYR 141 CO 0.02 -0.18 -0.07 0.08 -1.34 0.00 0.00 175.55 174.07 1yoc s VAL 142 N 1.53 3.64 0.17 3.14 1.01 -0.17 -2.12 120.40 127.60 1yoc s VAL 142 Ca 0.07 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.58 1yoc s VAL 142 Cb -0.15 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 1yoc s VAL 142 CO 0.07 0.52 0.09 -0.94 0.00 0.00 0.00 175.10 174.84 1yoc s SER 143 N 0.20 0.30 0.26 3.32 1.04 -0.70 -0.28 113.70 117.84 1yoc s SER 143 Ca -0.04 -1.30 -0.30 0.00 0.48 0.00 0.00 55.95 54.79 1yoc s SER 143 Cb -0.14 0.32 -0.09 0.00 0.10 0.00 0.00 66.02 66.21 1yoc s SER 143 CO 0.04 -0.78 1.06 -1.10 0.98 0.00 0.00 173.24 173.44 1yoc s GLN 144 N -4.10 4.69 0.00 4.02 -0.21 -1.26 -0.31 119.66 122.48 1yoc s GLN 144 Ca 0.32 1.73 0.17 0.00 0.02 0.00 0.00 55.36 57.59 1yoc s GLN 144 Cb 0.07 -3.22 1.01 0.00 1.00 0.00 0.00 33.01 31.88 1yoc s GLN 144 CO 0.07 0.27 1.42 0.00 -2.12 0.00 0.00 175.29 174.93